A0A077ZD65_TRITR Loading...

PHTB1 C domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZD65, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 229 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
1M65.9Low76.5Confident194 Ų19499.5 Ų99.596%0.95647%0.465SS*.  0-26.20-82.6-164.7-86.100114.9L3 P4 F5M1-L3 PolarHBondContact O-N 3.4Å; M1-P4 WeakPolarHBondContact O-CD 3.49Å; M1-F5 PolarHBondContact O-N 3.44Å
2W75Confident76.1Confident79 Ų7996.9 Ų96.930%0.29946%0.456SS..Hα-helixtrans-59.6-40.5-177.586.4-88.4000114.4F5 K6 A118 L122W2-F5 PolarHBondContact O-N 2.95Å; W2-K6 HydrophobicContact CE3-CB 4.34Å; W2-K6 HydrophobicContact CE3-CD 4.11Å; W2-K6 HydrophobicContact CH2-CD 4.44Å; W2-K6 HydrophobicContact CZ3-CB 4.46Å; W2-K6 HydrophobicContact CZ3-CD 3.48Å; W2-K6 VanDerWaalsContact CZ3-CD 3.48Å; W2-K6 WeakPolarHBondContact O-CB 3.43Å; W2-K6 PolarHBondContact O-N 3.46Å; W2-A118 HydrophobicContact CB-CB 4.39Å; W2-A118 VanDerWaalsContact CD1-CB 3.42Å; W2-A118 HydrophobicContact CG-CB 4.1Å; W2-L122 HydrophobicContact CB-CB 4.18Å
3L76.1Confident75.9Confident107 Ų10799.2 Ų99.256%0.5647%0.466SS*.Hα-helixtrans-60.2-54.6-179.9-81.5169.4000112.6M1 F5 K6 E7M1-L3 PolarHBondContact O-N 3.4Å; L3-F5 VanDerWaalsContact C-N 3.29Å; L3-F5 PolarHBondContact O-N 3.5Å; L3-K6 PolarHBondContact O-N 3.36Å; L3-E7 WeakPolarHBondContact O-CB 3.49Å; L3-E7 PolarHBondContact O-N 3.21Å
4P78.5Confident75.7Confident74 Ų74100.3 Ų100.348%0.48148%0.477SS..Hα-helixtrans-54.7-43.5173.6-27.430.9000113.3M1 E7 I8M1-P4 WeakPolarHBondContact O-CD 3.49Å; P4-E7 PolarHBondContact O-N 3.47Å; P4-I8 WeakPolarHBondContact O-CB 3.34Å; P4-I8 WeakPolarHBondContact O-CD1 3.37Å; P4-I8 VanDerWaalsContact O-CG1 3.22Å; P4-I8 WeakPolarHBondContact O-CG1 3.41Å; P4-I8 PolarHBondContact O-N 2.87Å
5F76Confident75.3Confident56 Ų5698.7 Ų98.725%0.24648%0.476CS..Hα-helixtrans-61.2-49.2-179.8179.5-98.5000111.7M1 W2 L3 E7 I8 L9 L122 D125 L126 L129M1-F5 PolarHBondContact O-N 3.44Å; W2-F5 PolarHBondContact O-N 2.95Å; L3-F5 VanDerWaalsContact C-N 3.29Å; L3-F5 PolarHBondContact O-N 3.5Å; F5-E7 VanDerWaalsContact C-N 3.31Å; F5-E7 PolarHBondContact O-N 2.91Å; F5-I8 PolarHBondContact O-N 3.03Å; F5-L9 HydrophobicContact CE1-CD1 3.92Å; F5-L9 HydrophobicContact CZ-CD1 4.03Å; F5-L9 VanDerWaalsContact O-CB 3.3Å; F5-L9 WeakPolarHBondContact O-CB 3.41Å; F5-L9 PolarHBondContact O-N 3.42Å; F5-L122 HydrophobicContact CB-CD1 3.9Å; F5-L122 HydrophobicContact CD1-CD1 3.45Å; F5-L122 VanDerWaalsContact CD1-CD1 3.45Å; F5-L122 HydrophobicContact CD2-CD1 4.23Å; F5-L122 HydrophobicContact CE1-CD1 3.99Å; F5-L122 HydrophobicContact CG-CD1 3.58Å; F5-D125 HydrophobicContact CD1-CB 4.48Å; F5-D125 HydrophobicContact CE1-CB 3.88Å; F5-L126 HydrophobicContact CE1-CD2 4.37Å; F5-L126 HydrophobicContact CE2-CD2 3.96Å; F5-L126 HydrophobicContact CZ-CD2 3.63Å; F5-L126 HydrophobicContact CZ-CG 4.27Å; F5-L129 HydrophobicContact CE1-CD1 3.95Å; F5-L129 HydrophobicContact CZ-CD1 3.52Å
6K75.8Confident74.1Confident113 Ų113107.6 Ų107.649%0.49150%0.503SS..Hα-helixtrans-61.2-40.7177.5-178174.6178179.60112.1W2 L3 L9 K10W2-K6 HydrophobicContact CE3-CB 4.34Å; W2-K6 HydrophobicContact CE3-CD 4.11Å; W2-K6 HydrophobicContact CH2-CD 4.44Å; W2-K6 HydrophobicContact CZ3-CB 4.46Å; W2-K6 HydrophobicContact CZ3-CD 3.48Å; W2-K6 VanDerWaalsContact CZ3-CD 3.48Å; W2-K6 WeakPolarHBondContact O-CB 3.43Å; W2-K6 PolarHBondContact O-N 3.46Å; L3-K6 PolarHBondContact O-N 3.36Å; K6-L9 PolarHBondContact O-N 3.3Å; K6-K10 VanDerWaalsContact O-CB 3.29Å; K6-K10 WeakPolarHBondContact O-CB 3.44Å; K6-K10 PolarHBondContact O-N 3.49Å
7E79.9Confident72.9Confident75 Ų75110.1 Ų110.135%0.3551%0.508SS..Hα-helixtrans-67.2-42.5178.3-178.661.3-167.300111.8L3 P4 F5 L9 K10 R11L3-E7 WeakPolarHBondContact O-CB 3.49Å; L3-E7 PolarHBondContact O-N 3.21Å; P4-E7 PolarHBondContact O-N 3.47Å; F5-E7 VanDerWaalsContact C-N 3.31Å; F5-E7 PolarHBondContact O-N 2.91Å; E7-L9 VanDerWaalsContact C-N 3.33Å; E7-K10 PolarHBondContact O-N 3.24Å; E7-R11 WeakPolarHBondContact O-CB 3.38Å; E7-R11 VanDerWaalsContact O-CG 3.28Å; E7-R11 WeakPolarHBondContact O-CG 2.92Å; E7-R11 PolarHBondContact O-N 3.07Å; E7-R11 IonicContact OE1-CZ 3.33Å; E7-R11 IonicContact OE1-NE 2.77Å; E7-R11 PolarHBondContact OE1-NE 3.35Å; E7-R11 IonicContact OE1-NH2 3Å; E7-R11 PolarHBondContact OE1-NH2 3.14Å
8I79.8Confident72.2Confident98 Ų98112.7 Ų112.750%0.50352%0.521SS..Hα-helixtrans-61.4-46.2174.5-70.2164000110P4 F5 K10 R11 L12P4-I8 WeakPolarHBondContact O-CB 3.34Å; P4-I8 WeakPolarHBondContact O-CD1 3.37Å; P4-I8 VanDerWaalsContact O-CG1 3.22Å; P4-I8 WeakPolarHBondContact O-CG1 3.41Å; P4-I8 PolarHBondContact O-N 2.87Å; F5-I8 PolarHBondContact O-N 3.03Å; I8-K10 VanDerWaalsContact C-N 3.34Å; I8-K10 PolarHBondContact O-N 2.82Å; I8-R11 PolarHBondContact O-N 3.2Å; I8-L12 HydrophobicContact CG2-CD1 3.8Å; I8-L12 HydrophobicContact CG2-CG 4.23Å; I8-L12 WeakPolarHBondContact O-CB 3.5Å; I8-L12 VanDerWaalsContact O-CG 3.29Å; I8-L12 WeakPolarHBondContact O-CG 3.45Å; I8-L12 PolarHBondContact O-N 2.98Å
9L75.5Confident71.4Confident27 Ų27118.3 Ų118.314%0.14154%0.544CS..Hα-helixtrans-62.1-43.8-179.9-169.6139.4000111.9F5 K6 E7 L12 Q13 L129F5-L9 HydrophobicContact CE1-CD1 3.92Å; F5-L9 HydrophobicContact CZ-CD1 4.03Å; F5-L9 VanDerWaalsContact O-CB 3.3Å; F5-L9 WeakPolarHBondContact O-CB 3.41Å; F5-L9 PolarHBondContact O-N 3.42Å; K6-L9 PolarHBondContact O-N 3.3Å; E7-L9 VanDerWaalsContact C-N 3.33Å; L9-L12 PolarHBondContact O-N 2.89Å; L9-Q13 VanDerWaalsContact O-CG 3.31Å; L9-Q13 WeakPolarHBondContact O-CG 3.5Å; L9-Q13 PolarHBondContact O-N 3.26Å; L9-L129 HydrophobicContact CD1-CD1 3.19Å; L9-L129 HydrophobicContact CD1-CD2 3.73Å; L9-L129 HydrophobicContact CD1-CG 3.95Å
10K78.9Confident70.7Confident113 Ų113115.7 Ų115.749%0.49155%0.55SS..Hα-helixtrans-59.8-48.8173.1-176.8-176.1174-170.50111.2K6 E7 I8 L12 Q13 D14K6-K10 VanDerWaalsContact O-CB 3.29Å; K6-K10 WeakPolarHBondContact O-CB 3.44Å; K6-K10 PolarHBondContact O-N 3.49Å; E7-K10 PolarHBondContact O-N 3.24Å; I8-K10 VanDerWaalsContact C-N 3.34Å; I8-K10 PolarHBondContact O-N 2.82Å; K10-L12 VanDerWaalsContact C-N 3.35Å; K10-L12 PolarHBondContact O-N 3.38Å; K10-Q13 PolarHBondContact O-N 3.46Å; K10-D14 WeakPolarHBondContact O-CB 3.45Å; K10-D14 PolarHBondContact O-N 3.02Å
11R79.9Confident70.1Confident159 Ų159115 Ų11560%0.655%0.548SS*.Hα-helixtrans-61.8-40.4178.7-74.2178.9-172.1-160.72.4112.6E7 I8 Q13 D14 V15E7-R11 WeakPolarHBondContact O-CB 3.38Å; E7-R11 VanDerWaalsContact O-CG 3.28Å; E7-R11 WeakPolarHBondContact O-CG 2.92Å; E7-R11 PolarHBondContact O-N 3.07Å; E7-R11 IonicContact OE1-CZ 3.33Å; E7-R11 IonicContact OE1-NE 2.77Å; E7-R11 PolarHBondContact OE1-NE 3.35Å; E7-R11 IonicContact OE1-NH2 3Å; E7-R11 PolarHBondContact OE1-NH2 3.14Å; I8-R11 PolarHBondContact O-N 3.2Å; R11-Q13 VanDerWaalsContact C-N 3.31Å; R11-Q13 PolarHBondContact O-N 3.08Å; R11-D14 CarbonylContact O-C 3.57Å; R11-D14 PolarHBondContact O-N 3.39Å; R11-V15 WeakPolarHBondContact O-CG2 3.32Å; R11-V15 PolarHBondContact O-N 2.84Å
12L72.5Confident69.7Low68 Ų68109.6 Ų109.636%0.35652%0.523SS..Hα-helixtrans-64.8-35.8176.4-73.4173000112.1I8 L9 K10 V24I8-L12 HydrophobicContact CG2-CD1 3.8Å; I8-L12 HydrophobicContact CG2-CG 4.23Å; I8-L12 WeakPolarHBondContact O-CB 3.5Å; I8-L12 VanDerWaalsContact O-CG 3.29Å; I8-L12 WeakPolarHBondContact O-CG 3.45Å; I8-L12 PolarHBondContact O-N 2.98Å; L9-L12 PolarHBondContact O-N 2.89Å; K10-L12 VanDerWaalsContact C-N 3.35Å; K10-L12 PolarHBondContact O-N 3.38Å; L12-V24 HydrophobicContact CB-CG2 4.1Å; L12-V24 HydrophobicContact CD1-CG1 4.48Å; L12-V24 HydrophobicContact CD1-CG2 4.3Å
13Q73Confident69.1Low126 Ų126113.9 Ų113.959%0.58954%0.539SS*.Hα-helixtrans-73.3-32.1173.5-71.3175.5-1100112.7L9 K10 R11L9-Q13 VanDerWaalsContact O-CG 3.31Å; L9-Q13 WeakPolarHBondContact O-CG 3.5Å; L9-Q13 PolarHBondContact O-N 3.26Å; K10-Q13 PolarHBondContact O-N 3.46Å; R11-Q13 VanDerWaalsContact C-N 3.31Å; R11-Q13 PolarHBondContact O-N 3.08Å
14D73.5Confident68.6Low115 Ų115110.8 Ų110.862%0.61552%0.524SS*.Hα-helixtrans-79.8-20.8176.8-74.3-18.3000112.7K10 R11 R16K10-D14 WeakPolarHBondContact O-CB 3.45Å; K10-D14 PolarHBondContact O-N 3.02Å; R11-D14 CarbonylContact O-C 3.57Å; R11-D14 PolarHBondContact O-N 3.39Å; D14-R16 PolarHBondContact O-N 3.21Å; D14-R16 VanDerWaalsContact O-N 3.14Å
15V69.7Low68.1Low76 Ų76112.6 Ų112.646%0.46153%0.53SS..SBendtrans-59.5122.1175.11750000108.4R11 Y17R11-V15 WeakPolarHBondContact O-CG2 3.32Å; R11-V15 PolarHBondContact O-N 2.84Å; V15-Y17 HydrophobicContact CG1-CD2 4.45Å; V15-Y17 PolarHBondContact O-N 3.37Å
16R55.1Low67.7Low242 Ų242111.3 Ų111.391%0.91353%0.53SS*.SBendtrans-64.454.3-168-161.6-168.5-67.2-163.5-2.1114.4D14D14-R16 PolarHBondContact O-N 3.21Å; D14-R16 VanDerWaalsContact O-N 3.14Å
17Y54.6Low67.2Low149 Ų149113 Ų11358%0.58455%0.549SS*.SBendtrans-86.3150.9150-82.2-88.9000108.1V15 K19 I21 L22V15-Y17 HydrophobicContact CG1-CD2 4.45Å; V15-Y17 PolarHBondContact O-N 3.37Å; Y17-K19 PolarHBondContact O-N 2.92Å; Y17-I21 HydrophobicContact CD1-CG2 4.44Å; Y17-L22 HydrophobicContact CD2-CD1 3.57Å; Y17-L22 HydrophobicContact CE2-CD1 4.32Å; Y17-L22 HydrophobicContact CG-CD1 4.12Å
18E59.4Low66.5Low158 Ų158111.6 Ų111.674%0.73856%0.555SS**  trans-47.9129.9173.8-75.1178.214800109.3G20 I21E18-G20 PolarHBondContact O-N 3.36Å; E18-I21 HydrophobicContact CB-CD1 3.76Å; E18-I21 HydrophobicContact CB-CG1 4.16Å; E18-I21 HydrophobicContact CG-CD1 4.49Å; E18-I21 PolarHBondContact O-N 2.79Å
19K57.5Low65.9Low219 Ų219111.8 Ų111.895%0.95256%0.563SS**THydrogen-bonded Turntrans-47.2109.4-177.4-74-179176179.50109.2Y17Y17-K19 PolarHBondContact O-N 2.92Å
20G57.3Low65.6Low65 Ų65111.5 Ų111.567%0.6756%0.561SS**THydrogen-bonded Turntrans116.4-9.6177.600000116.5E18E18-G20 PolarHBondContact O-N 3.36Å
21I58.2Low65.3Low101 Ų101110.1 Ų110.152%0.51856%0.562SS.*SBendtrans-76.4-44.4176-58.7178.1000111.1Y17 E18 R23Y17-I21 HydrophobicContact CD1-CG2 4.44Å; E18-I21 HydrophobicContact CB-CD1 3.76Å; E18-I21 HydrophobicContact CB-CG1 4.16Å; E18-I21 HydrophobicContact CG-CD1 4.49Å; E18-I21 PolarHBondContact O-N 2.79Å; I21-R23 PolarHBondContact O-N 3.11Å
22L57.8Low65.1Low81 Ų81103.6 Ų103.642%0.42454%0.54SS..  trans-81.4101.5-176.1-115.9156.9000110.7Y17Y17-L22 HydrophobicContact CD2-CD1 3.57Å; Y17-L22 HydrophobicContact CE2-CD1 4.32Å; Y17-L22 HydrophobicContact CG-CD1 4.12Å
23R63.2Low65.6Low170 Ų170105.4 Ų105.464%0.64255%0.547SS*.  trans-92.3108.7170.9-67.5-173.1-179.7-173.94.8109.4I21 R132I21-R23 PolarHBondContact O-N 3.11Å; R23-R132 VanDerWaalsContact CZ-NH2 3.28Å; R23-R132 VanDerWaalsContact NH1-NH2 3.16Å
24V64.3Low66Low41 Ų41104.7 Ų104.725%0.24855%0.547CS..  trans-88109.2172.1-177.10000107.6L12 L129L12-V24 HydrophobicContact CB-CG2 4.1Å; L12-V24 HydrophobicContact CD1-CG1 4.48Å; L12-V24 HydrophobicContact CD1-CG2 4.3Å; V24-L129 HydrophobicContact CB-CD2 4.5Å; V24-L129 HydrophobicContact CG1-CD2 4.45Å; V24-L129 WeakPolarHBondContact O-CD2 3.45Å
25N68.5Low66.6Low112 Ų11299.6 Ų99.660%0.59952%0.52SS*.  trans-110139.8172.5-63.4-20.4000108.4
26A66.8Low67.5Low30 Ų3097.3 Ų97.325%0.24850%0.503CS..  trans-77.9123.3168.300000108.5L126 L129 S130A26-L126 HydrophobicContact CB-CD2 4.18Å; A26-L129 HydrophobicContact CB-CB 4.13Å; A26-S130 WeakPolarHBondContact CB-OG 3.49Å
27V66Low69.1Low147 Ų14790.7 Ų90.789%0.89148%0.481SS*.  trans-100.2116.4177.7-177.90000108.1
28G65Low70.7Confident46 Ų4686.3 Ų86.347%0.47447%0.466SS..SBendtrans138.3152.8177.200000112.2I30G28-I30 PolarHBondContact O-N 2.95Å
29P66.5Low72.2Confident103 Ų10378.8 Ų78.867%0.66943%0.431SS*.  trans-65125.4174.527.5-32.1000109.2V31P29-V31 HydrophobicContact CB-CG2 4.47Å; P29-V31 HydrophobicContact CG-CG2 4.39Å; P29-V31 PolarHBondContact O-N 3.41Å
30I69.1Low73.7Confident20 Ų2070.4 Ų70.410%0.10340%0.397CS..  trans-66.5105.6163.1-59.8173.3000106G28 P32 L123 L126 L127 I201G28-I30 PolarHBondContact O-N 2.95Å; I30-P32 VanDerWaalsContact O-CD 3.22Å; I30-P32 WeakPolarHBondContact O-CD 3.31Å; I30-L123 HydrophobicContact CG2-CD1 3.67Å; I30-L126 HydrophobicContact CD1-CB 4.37Å; I30-L127 HydrophobicContact CD1-CB 4.45Å; I30-L127 HydrophobicContact CD1-CD1 4.11Å; I30-I201 HydrophobicContact CG2-CD1 4.24Å
31V72.5Confident75.3Confident84 Ų8470.6 Ų70.651%0.50939%0.385SS..  trans-88105.9175.2-176.40000107.5P29 E33P29-V31 HydrophobicContact CB-CG2 4.47Å; P29-V31 HydrophobicContact CG-CG2 4.39Å; P29-V31 PolarHBondContact O-N 3.41Å; V31-E33 HydrophobicContact CG1-CB 3.83Å; V31-E33 PolarHBondContact O-N 3.31Å
32P76.3Confident76.8Confident22 Ų2265.8 Ų65.814%0.14336%0.36CS..THydrogen-bonded Turntrans-75.4-2.4-176.633-36.7000112.8I30 D34 Y35 F36 F197 I201I30-P32 VanDerWaalsContact O-CD 3.22Å; I30-P32 WeakPolarHBondContact O-CD 3.31Å; P32-D34 PolarHBondContact O-N 2.63Å; P32-Y35 WeakPolarHBondContact O-CB 3.48Å; P32-Y35 PolarHBondContact O-N 3.48Å; P32-F36 HydrophobicContact CB-CD2 4.25Å; P32-F36 HydrophobicContact CB-CE1 4.09Å; P32-F36 HydrophobicContact CB-CE2 3.76Å; P32-F36 HydrophobicContact CB-CZ 3.69Å; P32-F36 HydrophobicContact CG-CD2 4.49Å; P32-F36 HydrophobicContact CG-CE2 3.84Å; P32-F36 HydrophobicContact CG-CZ 4.12Å; P32-F36 WeakPolarHBondContact O-CB 3.48Å; P32-F36 WeakPolarHBondContact O-CD1 3.15Å; P32-F36 WeakPolarHBondContact O-CD2 3.49Å; P32-F36 WeakPolarHBondContact O-CG 3.42Å; P32-F36 PolarHBondContact O-N 3.43Å; P32-F197 HydrophobicContact CB-CD1 4.21Å; P32-F197 HydrophobicContact CB-CE1 4.09Å; P32-I201 HydrophobicContact CB-CD1 3.95Å; P32-I201 HydrophobicContact CG-CD1 4.27Å
33E82.3Confident78.4Confident107 Ų10762.5 Ų62.550%0.534%0.342SS..Hα-helixtrans-62.4-45.3-173.5-163.6-171.6144.900112.7V31 Y35 F36 K37V31-E33 HydrophobicContact CG1-CB 3.83Å; V31-E33 PolarHBondContact O-N 3.31Å; E33-Y35 VanDerWaalsContact C-N 3.29Å; E33-Y35 PolarHBondContact O-N 2.92Å; E33-F36 PolarHBondContact O-N 3.3Å; E33-K37 WeakPolarHBondContact O-CG 3.38Å; E33-K37 PolarHBondContact O-N 2.89Å; E33-K37 VanDerWaalsContact OE1-CE 3.24Å; E33-K37 WeakPolarHBondContact OE1-CE 3.34Å; E33-K37 IonicContact OE1-NZ 3.95Å; E33-K37 PolarHBondContact OE1-NZ 2.86Å
34D83Confident79.7Confident111 Ų11159.8 Ų59.859%0.59434%0.337SS*.Hα-helixtrans-66.3-36.8179-66.7-26.7000111.6P32 K37 Q38P32-D34 PolarHBondContact O-N 2.63Å; D34-K37 PolarHBondContact O-N 3.36Å; D34-K37 IonicContact OD1-NZ 3.68Å; D34-Q38 PolarHBondContact O-N 3.27Å
35Y85.7Confident81Confident8 Ų859.1 Ų59.13%0.03133%0.332CS..Hα-helixtrans-63.2-43.1172.7174-113.3000111.8P32 E33 Q38 L39 L116 N120 L123 F193 F197P32-Y35 WeakPolarHBondContact O-CB 3.48Å; P32-Y35 PolarHBondContact O-N 3.48Å; E33-Y35 VanDerWaalsContact C-N 3.29Å; E33-Y35 PolarHBondContact O-N 2.92Å; Y35-Q38 WeakPolarHBondContact O-CB 3.2Å; Y35-Q38 PolarHBondContact O-N 3.17Å; Y35-L39 HydrophobicContact CD1-CD1 3.88Å; Y35-L39 HydrophobicContact CE1-CD1 3.29Å; Y35-L39 HydrophobicContact CE1-CG 4.13Å; Y35-L39 HydrophobicContact CE2-CD1 4.2Å; Y35-L39 HydrophobicContact CE2-CG 4.14Å; Y35-L39 VanDerWaalsContact CZ-CD1 3.48Å; Y35-L39 PolarHBondContact O-N 2.93Å; Y35-L116 HydrophobicContact CE2-CD1 3.75Å; Y35-N120 WeakPolarHBondContact CE2-OD1 3.36Å; Y35-N120 PolarHBondContact OH-OD1 3.2Å; Y35-L123 HydrophobicContact CD1-CD2 3.55Å; Y35-L123 HydrophobicContact CD2-CD2 3.88Å; Y35-L123 HydrophobicContact CE1-CD2 3.71Å; Y35-L123 HydrophobicContact CE2-CD2 4.06Å; Y35-L123 HydrophobicContact CG-CD2 3.62Å; Y35-F193 HydrophobicContact CE1-CE1 4.18Å; Y35-F197 HydrophobicContact CD1-CE1 4.19Å; Y35-F197 HydrophobicContact CE1-CE1 4.39Å
36F89Confident82.1Confident28 Ų2854.7 Ų54.712%0.12331%0.309CS..Hα-helixtrans-66.5-36.6178-65.9-19.8000113.2P32 E33 Q38 L39 D40 K194 F197 S198P32-F36 HydrophobicContact CB-CD2 4.25Å; P32-F36 HydrophobicContact CB-CE1 4.09Å; P32-F36 HydrophobicContact CB-CE2 3.76Å; P32-F36 HydrophobicContact CB-CZ 3.69Å; P32-F36 HydrophobicContact CG-CD2 4.49Å; P32-F36 HydrophobicContact CG-CE2 3.84Å; P32-F36 HydrophobicContact CG-CZ 4.12Å; P32-F36 WeakPolarHBondContact O-CB 3.48Å; P32-F36 WeakPolarHBondContact O-CD1 3.15Å; P32-F36 WeakPolarHBondContact O-CD2 3.49Å; P32-F36 WeakPolarHBondContact O-CG 3.42Å; P32-F36 PolarHBondContact O-N 3.43Å; E33-F36 PolarHBondContact O-N 3.3Å; F36-Q38 VanDerWaalsContact C-N 3.33Å; F36-L39 HydrophobicContact CD1-CD1 4.18Å; F36-L39 WeakPolarHBondContact O-CB 3Å; F36-L39 PolarHBondContact O-N 2.92Å; F36-D40 VanDerWaalsContact O-CG 3.32Å; F36-D40 PolarHBondContact O-N 3.02Å; F36-D40 VanDerWaalsContact O-OD2 3.05Å; F36-K194 HydrophobicContact CB-CD 4.34Å; F36-K194 HydrophobicContact CD1-CB 4.43Å; F36-K194 HydrophobicContact CD1-CD 4.23Å; F36-K194 HydrophobicContact CD1-CG 3.75Å; F36-K194 HydrophobicContact CE1-CB 4.07Å; F36-K194 HydrophobicContact CE1-CG 3.8Å; F36-K194 HydrophobicContact CE2-CB 4.35Å; F36-K194 HydrophobicContact CG-CD 4.15Å; F36-K194 HydrophobicContact CG-CG 4.12Å; F36-K194 HydrophobicContact CZ-CB 4.01Å; F36-K194 HydrophobicContact CZ-CG 4.22Å; F36-K194 PolarHBondContact O-NZ 3.17Å; F36-F197 HydrophobicContact CE1-CB 4.44Å; F36-F197 AromaticContact CE1-CD1 3.67Å; F36-F197 HydrophobicContact CE1-CD1 3.67Å; F36-F197 HydrophobicContact CE1-CE1 4.47Å; F36-F197 HydrophobicContact CE1-CG 4.46Å; F36-F197 HydrophobicContact CZ-CB 4.42Å; F36-F197 AromaticContact CZ-CD1 3.84Å; F36-F197 HydrophobicContact CZ-CD1 3.84Å; F36-S198 VanDerWaalsContact CE2-OG 3.27Å; F36-S198 WeakPolarHBondContact CE2-OG 3.48Å; F36-S198 WeakPolarHBondContact CZ-OG 3.29Å
37K89Confident83.2Confident102 Ų10257.9 Ų57.944%0.44332%0.319SS..Hα-helixtrans-60.9-45.2171.6-73170.6-174.7157.70110.7E33 D34 L39 D40 T41E33-K37 WeakPolarHBondContact O-CG 3.38Å; E33-K37 PolarHBondContact O-N 2.89Å; E33-K37 VanDerWaalsContact OE1-CE 3.24Å; E33-K37 WeakPolarHBondContact OE1-CE 3.34Å; E33-K37 IonicContact OE1-NZ 3.95Å; E33-K37 PolarHBondContact OE1-NZ 2.86Å; D34-K37 PolarHBondContact O-N 3.36Å; D34-K37 IonicContact OD1-NZ 3.68Å; K37-L39 VanDerWaalsContact C-N 3.33Å; K37-L39 PolarHBondContact O-N 3.02Å; K37-D40 PolarHBondContact O-N 3.11Å; K37-T41 PolarHBondContact O-N 3.28Å; K37-T41 PolarHBondContact O-OG1 3.48Å
38Q88.1Confident84.4Confident58 Ų5855.8 Ų55.827%0.27130%0.3SS..Hα-helixtrans-63.6-39.2178.4-169.71750.800112.5D34 Y35 F36 F42 G115 L116 S119D34-Q38 PolarHBondContact O-N 3.27Å; Y35-Q38 WeakPolarHBondContact O-CB 3.2Å; Y35-Q38 PolarHBondContact O-N 3.17Å; F36-Q38 VanDerWaalsContact C-N 3.33Å; Q38-F42 PolarHBondContact O-N 2.94Å; Q38-F42 VanDerWaalsContact O-N 3.12Å; Q38-G115 PolarHBondContact NE2-O 3.34Å; Q38-L116 VanDerWaalsContact NE2-N 3.13Å; Q38-S119 PolarHBondContact OE1-OG 2.76Å
39L89.4Confident85.7Confident0 Ų053.9 Ų53.90%028%0.279CS..Hα-helixtrans-61.4-47.8171.5-80.9170.8000112Y35 F36 K37 T41 F42 F43 L116 W157 L190 F193Y35-L39 HydrophobicContact CD1-CD1 3.88Å; Y35-L39 HydrophobicContact CE1-CD1 3.29Å; Y35-L39 HydrophobicContact CE1-CG 4.13Å; Y35-L39 HydrophobicContact CE2-CD1 4.2Å; Y35-L39 HydrophobicContact CE2-CG 4.14Å; Y35-L39 VanDerWaalsContact CZ-CD1 3.48Å; Y35-L39 PolarHBondContact O-N 2.93Å; F36-L39 HydrophobicContact CD1-CD1 4.18Å; F36-L39 WeakPolarHBondContact O-CB 3Å; F36-L39 PolarHBondContact O-N 2.92Å; K37-L39 VanDerWaalsContact C-N 3.33Å; K37-L39 PolarHBondContact O-N 3.02Å; L39-T41 VanDerWaalsContact C-N 3.33Å; L39-T41 PolarHBondContact O-N 3.44Å; L39-F42 PolarHBondContact O-N 3.31Å; L39-F43 HydrophobicContact CD2-CE2 4.22Å; L39-F43 VanDerWaalsContact O-CD2 3.27Å; L39-F43 WeakPolarHBondContact O-CD2 3.38Å; L39-F43 PolarHBondContact O-N 3.39Å; L39-L116 HydrophobicContact CD2-CD1 3.49Å; L39-L116 VanDerWaalsContact CD2-CD1 3.49Å; L39-L116 HydrophobicContact CD2-CD2 3.83Å; L39-L116 HydrophobicContact CD2-CG 4.29Å; L39-L116 HydrophobicContact CG-CD1 3.9Å; L39-W157 HydrophobicContact CD2-CH2 3.63Å; L39-W157 HydrophobicContact CD2-CZ3 3.81Å; L39-L190 HydrophobicContact CB-CD1 4.24Å; L39-L190 HydrophobicContact CD1-CD1 4.26Å; L39-F193 HydrophobicContact CD1-CD1 4.43Å; L39-F193 HydrophobicContact CD1-CE1 4.04Å
40D90.3Very high86.9Confident43 Ų4351.6 Ų51.623%0.2327%0.268CS..Hα-helixtrans-58.8-46.4179.1-72.7-37.7000111.2F36 K37 F42 F43 Q44 K194F36-D40 VanDerWaalsContact O-CG 3.32Å; F36-D40 PolarHBondContact O-N 3.02Å; F36-D40 VanDerWaalsContact O-OD2 3.05Å; K37-D40 PolarHBondContact O-N 3.11Å; D40-F42 VanDerWaalsContact C-N 3.3Å; D40-F42 PolarHBondContact O-N 3.15Å; D40-F43 PolarHBondContact O-N 3.32Å; D40-Q44 WeakPolarHBondContact O-CB 3.44Å; D40-Q44 WeakPolarHBondContact O-CG 3.41Å; D40-Q44 PolarHBondContact O-N 2.88Å; D40-K194 IonicContact OD1-NZ 2.7Å; D40-K194 PolarHBondContact OD1-NZ 3.3Å; D40-K194 IonicContact OD2-NZ 3.87Å; D40-K194 PolarHBondContact OD2-NZ 3.05Å
41T90.4Very high88Confident68 Ų6857.7 Ų57.742%0.41729%0.29SS..Hα-helixtrans-57.9-43.1177.2-56.90000111.7K37 L39 Q44 L45K37-T41 PolarHBondContact O-N 3.28Å; K37-T41 PolarHBondContact O-OG1 3.48Å; L39-T41 VanDerWaalsContact C-N 3.33Å; L39-T41 PolarHBondContact O-N 3.44Å; T41-Q44 PolarHBondContact O-N 2.87Å; T41-L45 HydrophobicContact CG2-CD1 4.06Å; T41-L45 HydrophobicContact CG2-CG 4.49Å; T41-L45 WeakPolarHBondContact O-CB 3.36Å; T41-L45 VanDerWaalsContact O-CG 3.3Å; T41-L45 WeakPolarHBondContact O-CG 3.31Å; T41-L45 PolarHBondContact O-N 3.4Å
42F90.2Very high88.9Confident1 Ų154.6 Ų54.60%0.00427%0.272CS..Hα-helixtrans-62.1-47.5177.7172.7-96.5000112.1Q38 L39 D40 L45 S46 L109 A112 A113 L116 F147Q38-F42 PolarHBondContact O-N 2.94Å; Q38-F42 VanDerWaalsContact O-N 3.12Å; L39-F42 PolarHBondContact O-N 3.31Å; D40-F42 VanDerWaalsContact C-N 3.3Å; D40-F42 PolarHBondContact O-N 3.15Å; F42-L45 PolarHBondContact O-N 3.47Å; F42-S46 WeakPolarHBondContact O-CB 3.47Å; F42-S46 PolarHBondContact O-N 3.44Å; F42-L109 HydrophobicContact CD2-CD1 3.7Å; F42-L109 HydrophobicContact CE2-CD1 3.5Å; F42-L109 HydrophobicContact CE2-CG 4.26Å; F42-L109 HydrophobicContact CZ-CD1 4.26Å; F42-A112 HydrophobicContact CB-CB 4.48Å; F42-A112 HydrophobicContact CD2-CB 4.18Å; F42-A113 HydrophobicContact CD2-CB 4.24Å; F42-A113 HydrophobicContact CE2-CB 3.76Å; F42-L116 HydrophobicContact CB-CD2 4.43Å; F42-L116 HydrophobicContact CD1-CD2 4.08Å; F42-L116 HydrophobicContact CG-CD2 4.09Å; F42-F147 AromaticContact CE1-CE2 3.96Å; F42-F147 HydrophobicContact CE1-CE2 3.96Å; F42-F147 HydrophobicContact CE1-CZ 4.28Å; F42-F147 HydrophobicContact CE2-CZ 4.21Å; F42-F147 AromaticContact CZ-CE2 3.78Å; F42-F147 HydrophobicContact CZ-CE2 3.78Å; F42-F147 AromaticContact CZ-CZ 3.62Å; F42-F147 HydrophobicContact CZ-CZ 3.62Å
43F90.5Very high89.7Confident12 Ų1257.7 Ų57.75%0.05328%0.284CS..Hα-helixtrans-69.7-34.1179.6-78.3-73.2000112.9L39 D40 S46 E47 W157 I158 L190L39-F43 HydrophobicContact CD2-CE2 4.22Å; L39-F43 VanDerWaalsContact O-CD2 3.27Å; L39-F43 WeakPolarHBondContact O-CD2 3.38Å; L39-F43 PolarHBondContact O-N 3.39Å; D40-F43 PolarHBondContact O-N 3.32Å; F43-S46 PolarHBondContact O-N 3.38Å; F43-E47 WeakPolarHBondContact O-CB 3.32Å; F43-E47 PolarHBondContact O-N 3.31Å; F43-W157 HydrophobicContact CE2-CZ3 4.08Å; F43-W157 HydrophobicContact CZ-CE3 4.18Å; F43-W157 HydrophobicContact CZ-CZ3 4.03Å; F43-I158 HydrophobicContact CE1-CB 4.44Å; F43-I158 HydrophobicContact CE1-CG2 4.33Å; F43-I158 HydrophobicContact CZ-CB 3.86Å; F43-I158 HydrophobicContact CZ-CD1 4.46Å; F43-I158 HydrophobicContact CZ-CG1 4.2Å; F43-I158 HydrophobicContact CZ-CG2 4.24Å; F43-L190 HydrophobicContact CB-CD2 4.29Å; F43-L190 HydrophobicContact CD2-CD1 3.92Å; F43-L190 HydrophobicContact CD2-CD2 3.55Å; F43-L190 HydrophobicContact CD2-CG 4.25Å; F43-L190 HydrophobicContact CE2-CD1 3.74Å; F43-L190 HydrophobicContact CE2-CD2 4.21Å; F43-L190 HydrophobicContact CE2-CG 4.43Å; F43-L190 HydrophobicContact CG-CD2 4.07Å
44Q91.5Very high90.2Very high113 Ų11355.2 Ų55.253%0.52828%0.282SS..Hα-helixtrans-63.3-47.5172.8-74.5172.85.100111.5D40 T41 S46 E47 E48D40-Q44 WeakPolarHBondContact O-CB 3.44Å; D40-Q44 WeakPolarHBondContact O-CG 3.41Å; D40-Q44 PolarHBondContact O-N 2.88Å; T41-Q44 PolarHBondContact O-N 2.87Å; Q44-S46 VanDerWaalsContact C-N 3.31Å; Q44-S46 PolarHBondContact O-N 2.9Å; Q44-E47 PolarHBondContact O-N 2.89Å; Q44-E48 WeakPolarHBondContact O-CB 3.49Å; Q44-E48 PolarHBondContact O-N 3.4Å
45L91.6Very high90.7Very high27 Ų2754.3 Ų54.314%0.14128%0.277CS..Hα-helixtrans-61.8-39.5176.7-75.1170.9000112.1T41 F42 E48 L49 L109 A112T41-L45 HydrophobicContact CG2-CD1 4.06Å; T41-L45 HydrophobicContact CG2-CG 4.49Å; T41-L45 WeakPolarHBondContact O-CB 3.36Å; T41-L45 VanDerWaalsContact O-CG 3.3Å; T41-L45 WeakPolarHBondContact O-CG 3.31Å; T41-L45 PolarHBondContact O-N 3.4Å; F42-L45 PolarHBondContact O-N 3.47Å; L45-E48 PolarHBondContact O-N 3.11Å; L45-L49 VanDerWaalsContact O-CB 3.3Å; L45-L49 WeakPolarHBondContact O-CB 3.46Å; L45-L49 PolarHBondContact O-N 3.28Å; L45-L109 HydrophobicContact CB-CD1 3.95Å; L45-A112 HydrophobicContact CD1-CB 3.76Å
46S90.6Very high91Very high18 Ų1855.8 Ų55.813%0.12629%0.285CS..Hα-helixtrans-61.4-46.4175.5173.10000111.7F42 F43 Q44 L49 A50 G153F42-S46 WeakPolarHBondContact O-CB 3.47Å; F42-S46 PolarHBondContact O-N 3.44Å; F43-S46 PolarHBondContact O-N 3.38Å; Q44-S46 VanDerWaalsContact C-N 3.31Å; Q44-S46 PolarHBondContact O-N 2.9Å; S46-L49 PolarHBondContact O-N 3.46Å; S46-A50 PolarHBondContact O-N 3.23Å; S46-G153 WeakPolarHBondContact OG-CA 3.39Å; S46-G153 PolarHBondContact OG-O 2.95Å
47E90.8Very high91.2Very high97 Ų9759.5 Ų59.545%0.45331%0.306SS..Hα-helixtrans-65.4-43.1177.3-173.3179.2-175.700111.9F43 Q44 A50 R51F43-E47 WeakPolarHBondContact O-CB 3.32Å; F43-E47 PolarHBondContact O-N 3.31Å; Q44-E47 PolarHBondContact O-N 2.89Å; E47-A50 PolarHBondContact O-N 3.3Å; E47-R51 VanDerWaalsContact CD-NH2 3.35Å; E47-R51 WeakPolarHBondContact O-CG 3.41Å; E47-R51 PolarHBondContact O-N 2.94Å; E47-R51 VanDerWaalsContact O-N 3.07Å; E47-R51 IonicContact OE1-CZ 2.63Å; E47-R51 IonicContact OE1-NE 3.53Å; E47-R51 IonicContact OE1-NH2 3.78Å; E47-R51 PolarHBondContact OE1-NH2 3.05Å; E47-R51 IonicContact OE2-NH2 2.93Å
48E91.4Very high91.4Very high103 Ų10357.7 Ų57.748%0.48131%0.306SS..Hα-helixtrans-63-43.5178.1-154.8-169.1156.600110.9Q44 L45 A50 R51 V52 M105Q44-E48 WeakPolarHBondContact O-CB 3.49Å; Q44-E48 PolarHBondContact O-N 3.4Å; L45-E48 PolarHBondContact O-N 3.11Å; E48-A50 VanDerWaalsContact C-N 3.32Å; E48-A50 PolarHBondContact O-N 2.85Å; E48-R51 WeakPolarHBondContact O-CB 3.12Å; E48-R51 PolarHBondContact O-N 3.47Å; E48-R51 VanDerWaalsContact O-N 3.15Å; E48-V52 PolarHBondContact O-N 3.01Å; E48-M105 HydrophobicContact CB-CE 3.44Å; E48-M105 VanDerWaalsContact CB-CE 3.44Å; E48-M105 VanDerWaalsContact CD-CE 3.49Å; E48-M105 HydrophobicContact CG-CE 3.35Å; E48-M105 WeakPolarHBondContact O-CE 3.31Å
49L92.3Very high91.5Very high6 Ų659.6 Ų59.63%0.03131%0.311CS..Hα-helixtrans-61-43.3177.3177.762.2000110.9L45 S46 R51 V52 Q53 M105 L109L45-L49 VanDerWaalsContact O-CB 3.3Å; L45-L49 WeakPolarHBondContact O-CB 3.46Å; L45-L49 PolarHBondContact O-N 3.28Å; S46-L49 PolarHBondContact O-N 3.46Å; L49-R51 VanDerWaalsContact C-N 3.29Å; L49-R51 PolarHBondContact O-N 3.2Å; L49-V52 PolarHBondContact O-N 3.48Å; L49-Q53 HydrophobicContact CD1-CG 4.14Å; L49-Q53 HydrophobicContact CG-CG 4.41Å; L49-Q53 WeakPolarHBondContact O-CB 3.49Å; L49-Q53 VanDerWaalsContact O-CG 3.27Å; L49-Q53 WeakPolarHBondContact O-CG 3.4Å; L49-Q53 PolarHBondContact O-N 2.94Å; L49-M105 HydrophobicContact CB-CE 4.31Å; L49-M105 HydrophobicContact CD1-CB 3.85Å; L49-M105 VanDerWaalsContact N-CE 3.29Å; L49-L109 HydrophobicContact CD2-CD2 3.53Å
50A91.7Very high91.6Very high55 Ų5560.5 Ų60.546%0.45532%0.319SS..Hα-helixtrans-60.1-39.5176.500000112S46 E47 E48 A54S46-A50 PolarHBondContact O-N 3.23Å; E47-A50 PolarHBondContact O-N 3.3Å; E48-A50 VanDerWaalsContact C-N 3.32Å; E48-A50 PolarHBondContact O-N 2.85Å; A50-A54 WeakPolarHBondContact O-CB 3.32Å; A50-A54 PolarHBondContact O-N 3.1Å
51R92.2Very high91.8Very high149 Ų14962.1 Ų62.156%0.56233%0.33SS*.Hα-helixtrans-65.3-48.2175.6-68.5175.1-171.7-177.63.2111.8E47 E48 L49 Q53 A54 D55E47-R51 VanDerWaalsContact CD-NH2 3.35Å; E47-R51 WeakPolarHBondContact O-CG 3.41Å; E47-R51 PolarHBondContact O-N 2.94Å; E47-R51 VanDerWaalsContact O-N 3.07Å; E47-R51 IonicContact OE1-CZ 2.63Å; E47-R51 IonicContact OE1-NE 3.53Å; E47-R51 IonicContact OE1-NH2 3.78Å; E47-R51 PolarHBondContact OE1-NH2 3.05Å; E47-R51 IonicContact OE2-NH2 2.93Å; E48-R51 WeakPolarHBondContact O-CB 3.12Å; E48-R51 PolarHBondContact O-N 3.47Å; E48-R51 VanDerWaalsContact O-N 3.15Å; L49-R51 VanDerWaalsContact C-N 3.29Å; L49-R51 PolarHBondContact O-N 3.2Å; R51-Q53 VanDerWaalsContact C-N 3.3Å; R51-Q53 PolarHBondContact O-N 3.38Å; R51-A54 WeakPolarHBondContact O-CB 3.34Å; R51-A54 PolarHBondContact O-N 2.89Å; R51-A54 VanDerWaalsContact O-N 3.13Å; R51-D55 PolarHBondContact O-N 2.88Å
52V91.5Very high91.8Very high19 Ų1962.2 Ų62.212%0.11533%0.325CS..Hα-helixtrans-64.1-36.5179.7173.50000111.7E48 L49 D55 L56 A102 M105E48-V52 PolarHBondContact O-N 3.01Å; L49-V52 PolarHBondContact O-N 3.48Å; V52-D55 PolarHBondContact O-N 3.28Å; V52-L56 VanDerWaalsContact O-CB 3.32Å; V52-L56 WeakPolarHBondContact O-CB 3.47Å; V52-L56 PolarHBondContact O-N 2.68Å; V52-A102 HydrophobicContact CG1-CB 3.98Å; V52-M105 HydrophobicContact CB-CE 4.47Å; V52-M105 HydrophobicContact CB-SD 3.9Å; V52-M105 HydrophobicContact CG1-SD 4.14Å; V52-M105 HydrophobicContact CG2-CE 3.95Å; V52-M105 HydrophobicContact CG2-SD 3.53Å; V52-M105 VanDerWaalsContact CG2-SD 3.53Å
53Q92.9Very high91.8Very high87 Ų8763.4 Ų63.441%0.40733%0.331SS..Hα-helixtrans-66.1-39.3173.2-73.6176.4-9.700112.5L49 R51 L56 N57L49-Q53 HydrophobicContact CD1-CG 4.14Å; L49-Q53 HydrophobicContact CG-CG 4.41Å; L49-Q53 WeakPolarHBondContact O-CB 3.49Å; L49-Q53 VanDerWaalsContact O-CG 3.27Å; L49-Q53 WeakPolarHBondContact O-CG 3.4Å; L49-Q53 PolarHBondContact O-N 2.94Å; R51-Q53 VanDerWaalsContact C-N 3.3Å; R51-Q53 PolarHBondContact O-N 3.38Å; Q53-L56 PolarHBondContact O-N 3.07Å; Q53-N57 WeakPolarHBondContact O-CB 3.41Å; Q53-N57 VanDerWaalsContact O-CG 3.27Å; Q53-N57 PolarHBondContact O-N 3.29Å; Q53-N57 PolarHBondContact O-ND2 2.93Å
54A93.3Very high91.9Very high54 Ų5470 Ų7045%0.44636%0.355SS..Hα-helixtrans-63.4-43.7174.700000111.6A50 R51 N57 S58A50-A54 WeakPolarHBondContact O-CB 3.32Å; A50-A54 PolarHBondContact O-N 3.1Å; R51-A54 WeakPolarHBondContact O-CB 3.34Å; R51-A54 PolarHBondContact O-N 2.89Å; R51-A54 VanDerWaalsContact O-N 3.13Å; A54-N57 PolarHBondContact O-N 2.96Å; A54-S58 PolarHBondContact O-N 3.31Å
55D92Very high91.9Very high93 Ų9368.7 Ų68.750%0.49735%0.351SS..Hα-helixtrans-63.4-43.2175.7-76.4-13.6000111.7R51 V52 N57 S58 R59R51-D55 PolarHBondContact O-N 2.88Å; V52-D55 PolarHBondContact O-N 3.28Å; D55-N57 VanDerWaalsContact C-N 3.33Å; D55-N57 PolarHBondContact O-N 3.42Å; D55-S58 PolarHBondContact O-N 3.44Å; D55-R59 WeakPolarHBondContact O-CB 3.45Å; D55-R59 VanDerWaalsContact O-CG 3.31Å; D55-R59 WeakPolarHBondContact O-CG 3.13Å; D55-R59 PolarHBondContact O-N 3.13Å
56L92.6Very high91.7Very high38 Ų3868.9 Ų68.920%0.19935%0.352CS..Hα-helixtrans-58.7-45.2175.2-17868.9000111.3V52 Q53 R59 A60 L95 L98 A99V52-L56 VanDerWaalsContact O-CB 3.32Å; V52-L56 WeakPolarHBondContact O-CB 3.47Å; V52-L56 PolarHBondContact O-N 2.68Å; Q53-L56 PolarHBondContact O-N 3.07Å; L56-R59 PolarHBondContact O-N 3.02Å; L56-A60 WeakPolarHBondContact O-CB 3.4Å; L56-A60 PolarHBondContact O-N 3.38Å; L56-L95 HydrophobicContact CD1-CD1 3.67Å; L56-L95 HydrophobicContact CD1-CG 4.27Å; L56-L98 HydrophobicContact CD1-CB 3.74Å; L56-A99 HydrophobicContact CD1-CB 4.16Å
57N93Very high91.5Very high106 Ų10671.3 Ų71.357%0.56736%0.361SS*.Hα-helixtrans-63.1-45.5177.6-75.7-30.3000111.9Q53 A54 D55 R59 A60 V61Q53-N57 WeakPolarHBondContact O-CB 3.41Å; Q53-N57 VanDerWaalsContact O-CG 3.27Å; Q53-N57 PolarHBondContact O-N 3.29Å; Q53-N57 PolarHBondContact O-ND2 2.93Å; A54-N57 PolarHBondContact O-N 2.96Å; D55-N57 VanDerWaalsContact C-N 3.33Å; D55-N57 PolarHBondContact O-N 3.42Å; N57-R59 VanDerWaalsContact C-N 3.35Å; N57-R59 PolarHBondContact O-N 3.21Å; N57-A60 PolarHBondContact O-N 2.9Å; N57-V61 WeakPolarHBondContact O-CG2 3.44Å; N57-V61 PolarHBondContact O-N 3.39Å
58S92.6Very high91.4Very high64 Ų6475.4 Ų75.445%0.44837%0.373SS..Hα-helixtrans-59-46.7176.7-173.90000111.3A54 D55 A60 V61 E62A54-S58 PolarHBondContact O-N 3.31Å; D55-S58 PolarHBondContact O-N 3.44Å; S58-A60 PolarHBondContact O-N 3.33Å; S58-V61 WeakPolarHBondContact O-CB 3.47Å; S58-V61 PolarHBondContact O-N 2.95Å; S58-E62 PolarHBondContact O-N 2.98Å
59R90.5Very high91.2Very high99 Ų9974 Ų7437%0.37437%0.366SS..Hα-helixtrans-67.5-34.5177.3-66.6-58.5176.7-167.7-12.6113.3D55 L56 N57 V61 E62 F63 L95 L98D55-R59 WeakPolarHBondContact O-CB 3.45Å; D55-R59 VanDerWaalsContact O-CG 3.31Å; D55-R59 WeakPolarHBondContact O-CG 3.13Å; D55-R59 PolarHBondContact O-N 3.13Å; L56-R59 PolarHBondContact O-N 3.02Å; N57-R59 VanDerWaalsContact C-N 3.35Å; N57-R59 PolarHBondContact O-N 3.21Å; R59-V61 VanDerWaalsContact C-N 3.29Å; R59-V61 PolarHBondContact O-N 2.95Å; R59-E62 WeakPolarHBondContact CD-OE2 3.49Å; R59-E62 IonicContact CZ-OE1 3.63Å; R59-E62 IonicContact CZ-OE2 3.54Å; R59-E62 IonicContact NE-OE2 3.49Å; R59-E62 IonicContact NH1-OE1 2.66Å; R59-E62 PolarHBondContact NH1-OE1 2.9Å; R59-E62 IonicContact NH1-OE2 3.43Å; R59-E62 PolarHBondContact NH1-OE2 2.94Å; R59-E62 PolarHBondContact O-N 3.35Å; R59-F63 WeakPolarHBondContact O-CB 3.49Å; R59-F63 PolarHBondContact O-N 3.34Å; R59-L95 HydrophobicContact CB-CD1 3.95Å; R59-L98 HydrophobicContact CB-CD1 4.18Å; R59-L98 HydrophobicContact CG-CD1 3.71Å
60A92.1Very high90.8Very high19 Ų1975.6 Ų75.616%0.15737%0.373CS..Hα-helixtrans-63.9-37.1173.800000111.5L56 N57 S58 R64 L95L56-A60 WeakPolarHBondContact O-CB 3.4Å; L56-A60 PolarHBondContact O-N 3.38Å; N57-A60 PolarHBondContact O-N 2.9Å; S58-A60 PolarHBondContact O-N 3.33Å; A60-R64 WeakPolarHBondContact O-CG 3.22Å; A60-R64 PolarHBondContact O-N 3.25Å; A60-R64 VanDerWaalsContact O-N 3.11Å; A60-L95 HydrophobicContact CB-CD1 4.04Å
61V93.3Very high90.3Very high76 Ų7679.5 Ų79.546%0.46138%0.38SS..Hα-helixtrans-66.2-47.4174172.90000111N57 S58 R59 F63 R64 I65N57-V61 WeakPolarHBondContact O-CG2 3.44Å; N57-V61 PolarHBondContact O-N 3.39Å; S58-V61 WeakPolarHBondContact O-CB 3.47Å; S58-V61 PolarHBondContact O-N 2.95Å; R59-V61 VanDerWaalsContact C-N 3.29Å; R59-V61 PolarHBondContact O-N 2.95Å; V61-F63 VanDerWaalsContact C-N 3.31Å; V61-F63 PolarHBondContact O-N 3.17Å; V61-R64 PolarHBondContact O-N 3.43Å; V61-I65 HydrophobicContact CG1-CD1 3.95Å; V61-I65 WeakPolarHBondContact O-CG1 3.46Å; V61-I65 PolarHBondContact O-N 2.89Å
62E90.7Very high89.9Confident70 Ų7078.1 Ų78.133%0.32738%0.382SS..Hα-helixtrans-57.2-44.7175.4-70.8179.5-179.700112.1S58 R59 R64 I65 L66S58-E62 PolarHBondContact O-N 2.98Å; R59-E62 WeakPolarHBondContact CD-OE2 3.49Å; R59-E62 IonicContact CZ-OE1 3.63Å; R59-E62 IonicContact CZ-OE2 3.54Å; R59-E62 IonicContact NE-OE2 3.49Å; R59-E62 IonicContact NH1-OE1 2.66Å; R59-E62 PolarHBondContact NH1-OE1 2.9Å; R59-E62 IonicContact NH1-OE2 3.43Å; R59-E62 PolarHBondContact NH1-OE2 2.94Å; R59-E62 PolarHBondContact O-N 3.35Å; E62-R64 VanDerWaalsContact C-N 3.35Å; E62-R64 PolarHBondContact O-N 3.31Å; E62-I65 PolarHBondContact O-N 3.04Å; E62-L66 WeakPolarHBondContact O-CG 3.34Å; E62-L66 PolarHBondContact O-N 2.85Å
63F90.4Very high89.3Confident26 Ų2682.7 Ų82.711%0.11440%0.398CS..Hα-helixtrans-57.9-46.7177.3-178-101.1000111.5R59 V61 I65 L66 E67 L88 T91 N92R59-F63 WeakPolarHBondContact O-CB 3.49Å; R59-F63 PolarHBondContact O-N 3.34Å; V61-F63 VanDerWaalsContact C-N 3.31Å; V61-F63 PolarHBondContact O-N 3.17Å; F63-I65 VanDerWaalsContact C-N 3.32Å; F63-I65 PolarHBondContact O-N 3.47Å; F63-L66 WeakPolarHBondContact O-CB 3.21Å; F63-L66 PolarHBondContact O-N 2.98Å; F63-E67 HydrophobicContact CD1-CG 4.21Å; F63-E67 HydrophobicContact CE1-CG 3.79Å; F63-E67 WeakPolarHBondContact CE1-OE1 3.49Å; F63-E67 WeakPolarHBondContact CE1-OE2 3.49Å; F63-E67 HydrophobicContact CE2-CG 4.48Å; F63-E67 HydrophobicContact CZ-CG 3.93Å; F63-E67 WeakPolarHBondContact CZ-OE1 3.4Å; F63-E67 WeakPolarHBondContact O-CG 3.42Å; F63-E67 PolarHBondContact O-N 3.44Å; F63-L88 HydrophobicContact CD2-CD1 3.77Å; F63-L88 HydrophobicContact CE2-CD1 3.37Å; F63-L88 HydrophobicContact CE2-CG 3.84Å; F63-L88 HydrophobicContact CZ-CD1 4Å; F63-L88 HydrophobicContact CZ-CG 4.43Å; F63-T91 HydrophobicContact CB-CG2 4.08Å; F63-T91 HydrophobicContact CD2-CG2 4.06Å; F63-N92 HydrophobicContact CD2-CB 4.4Å; F63-N92 HydrophobicContact CE2-CB 3.75Å; F63-N92 HydrophobicContact CZ-CB 4.4Å
64R92.3Very high88.3Confident151 Ų15183.2 Ų83.257%0.5740%0.402SS*.Hα-helixtrans-62.1-37.4176.5-71.5170.6-177.21582.3112.9A60 V61 E62 R68A60-R64 WeakPolarHBondContact O-CG 3.22Å; A60-R64 PolarHBondContact O-N 3.25Å; A60-R64 VanDerWaalsContact O-N 3.11Å; V61-R64 PolarHBondContact O-N 3.43Å; E62-R64 VanDerWaalsContact C-N 3.35Å; E62-R64 PolarHBondContact O-N 3.31Å; R64-R68 WeakPolarHBondContact O-CG 3.49Å; R64-R68 PolarHBondContact O-N 3.15Å; R64-R68 VanDerWaalsContact O-N 3.11Å
65I91.2Very high87.2Confident85 Ų8589.5 Ų89.544%0.43642%0.42SS..Hα-helixtrans-65.2-44.2176.1-68.1166.1000109.8V61 E62 F63 R68 Q69V61-I65 HydrophobicContact CG1-CD1 3.95Å; V61-I65 WeakPolarHBondContact O-CG1 3.46Å; V61-I65 PolarHBondContact O-N 2.89Å; E62-I65 PolarHBondContact O-N 3.04Å; F63-I65 VanDerWaalsContact C-N 3.32Å; F63-I65 PolarHBondContact O-N 3.47Å; I65-R68 PolarHBondContact O-N 3.27Å; I65-Q69 WeakPolarHBondContact O-CG 3.3Å; I65-Q69 PolarHBondContact O-N 3.46Å
66L87.9Confident86.1Confident32 Ų3290.7 Ų90.717%0.16843%0.426CS..Hα-helixtrans-62.5-46.4176.5-70.7171.8000111.2E62 F63 R68 Q69 F70 F84 I87 L88 T91E62-L66 WeakPolarHBondContact O-CG 3.34Å; E62-L66 PolarHBondContact O-N 2.85Å; F63-L66 WeakPolarHBondContact O-CB 3.21Å; F63-L66 PolarHBondContact O-N 2.98Å; L66-R68 VanDerWaalsContact C-N 3.28Å; L66-R68 PolarHBondContact O-N 3.42Å; L66-Q69 PolarHBondContact O-N 2.9Å; L66-Q69 VanDerWaalsContact O-N 3.08Å; L66-F70 PolarHBondContact O-N 3.45Å; L66-F84 HydrophobicContact CB-CE1 4.21Å; L66-F84 HydrophobicContact CB-CZ 3.87Å; L66-F84 HydrophobicContact CD2-CE2 4.14Å; L66-F84 HydrophobicContact CD2-CZ 3.75Å; L66-F84 HydrophobicContact CG-CZ 4.44Å; L66-F84 WeakPolarHBondContact O-CE1 3.33Å; L66-F84 WeakPolarHBondContact O-CZ 3.49Å; L66-I87 HydrophobicContact CD1-CG2 3.98Å; L66-I87 HydrophobicContact CD2-CG2 4.27Å; L66-L88 HydrophobicContact CB-CD1 3.92Å; L66-T91 HydrophobicContact CD1-CG2 4.16Å; L66-T91 WeakPolarHBondContact CD1-OG1 3.34Å
67E87.5Confident84.8Confident69 Ų6991.3 Ų91.332%0.32243%0.434SS..Hα-helixtrans-55.2-43.8175.7-73.6-173.2133.600112.1F63 Q69 F70 F71 L88F63-E67 HydrophobicContact CD1-CG 4.21Å; F63-E67 HydrophobicContact CE1-CG 3.79Å; F63-E67 WeakPolarHBondContact CE1-OE1 3.49Å; F63-E67 WeakPolarHBondContact CE1-OE2 3.49Å; F63-E67 HydrophobicContact CE2-CG 4.48Å; F63-E67 HydrophobicContact CZ-CG 3.93Å; F63-E67 WeakPolarHBondContact CZ-OE1 3.4Å; F63-E67 WeakPolarHBondContact O-CG 3.42Å; F63-E67 PolarHBondContact O-N 3.44Å; E67-Q69 PolarHBondContact O-N 3.03Å; E67-F70 VanDerWaalsContact O-CB 3.31Å; E67-F70 WeakPolarHBondContact O-CB 3.27Å; E67-F70 PolarHBondContact O-N 3.24Å; E67-F71 HydrophobicContact CB-CE2 4.46Å; E67-F71 WeakPolarHBondContact O-CD2 3.38Å; E67-F71 PolarHBondContact O-N 3.26Å; E67-F71 VanDerWaalsContact O-N 3.15Å; E67-L88 HydrophobicContact CG-CD1 3.75Å; E67-L88 HydrophobicContact CG-CD2 4.46Å
68R88.9Confident83.7Confident183 Ų18393.1 Ų93.169%0.69144%0.443SS*.Hα-helixtrans-62-43.5176.3-70.4175.2-175.5-161.71.1112.2R64 I65 L66 F70 F71 I72R64-R68 WeakPolarHBondContact O-CG 3.49Å; R64-R68 PolarHBondContact O-N 3.15Å; R64-R68 VanDerWaalsContact O-N 3.11Å; I65-R68 PolarHBondContact O-N 3.27Å; L66-R68 VanDerWaalsContact C-N 3.28Å; L66-R68 PolarHBondContact O-N 3.42Å; R68-F70 VanDerWaalsContact C-N 3.32Å; R68-F70 PolarHBondContact O-N 3.04Å; R68-F71 PolarHBondContact O-N 3.32Å; R68-I72 WeakPolarHBondContact O-CG1 3.31Å; R68-I72 PolarHBondContact O-N 3.07Å
69Q85.7Confident82.5Confident73 Ų7394.3 Ų94.334%0.34145%0.452SS..Hα-helixtrans-65.6-35.2177.2-71.1-176.913.300112.4I65 L66 E67 I72 R73 F84I65-Q69 WeakPolarHBondContact O-CG 3.3Å; I65-Q69 PolarHBondContact O-N 3.46Å; L66-Q69 PolarHBondContact O-N 2.9Å; L66-Q69 VanDerWaalsContact O-N 3.08Å; E67-Q69 PolarHBondContact O-N 3.03Å; Q69-I72 PolarHBondContact O-N 3.35Å; Q69-R73 WeakPolarHBondContact O-CB 3.22Å; Q69-R73 WeakPolarHBondContact O-CG 3.49Å; Q69-R73 PolarHBondContact O-N 3.22Å; Q69-F84 HydrophobicContact CB-CE2 3.79Å; Q69-F84 HydrophobicContact CB-CZ 3.78Å
70F83.6Confident81.6Confident39 Ų3994 Ų9417%0.17146%0.457CS..Hα-helixtrans-57.4-52.6173.7-178.1-111.7000111.1L66 E67 R68 I72 R73 L74 L81 F84L66-F70 PolarHBondContact O-N 3.45Å; E67-F70 VanDerWaalsContact O-CB 3.31Å; E67-F70 WeakPolarHBondContact O-CB 3.27Å; E67-F70 PolarHBondContact O-N 3.24Å; R68-F70 VanDerWaalsContact C-N 3.32Å; R68-F70 PolarHBondContact O-N 3.04Å; F70-I72 VanDerWaalsContact C-N 3.26Å; F70-I72 PolarHBondContact O-N 3.33Å; F70-R73 PolarHBondContact O-N 2.88Å; F70-L74 HydrophobicContact CZ-CD1 4.47Å; F70-L74 WeakPolarHBondContact O-CB 3.4Å; F70-L74 PolarHBondContact O-N 3.24Å; F70-L81 HydrophobicContact CD2-CD1 3.87Å; F70-L81 HydrophobicContact CE2-CD1 3.29Å; F70-L81 HydrophobicContact CE2-CG 3.98Å; F70-L81 HydrophobicContact CZ-CD1 3.89Å; F70-F84 HydrophobicContact CB-CD1 3.63Å; F70-F84 HydrophobicContact CB-CE1 3.38Å; F70-F84 HydrophobicContact CB-CZ 4.16Å; F70-F84 HydrophobicContact CD2-CB 4.43Å; F70-F84 AromaticContact CD2-CD1 3.4Å; F70-F84 HydrophobicContact CD2-CD1 3.4Å; F70-F84 HydrophobicContact CD2-CE1 4.08Å; F70-F84 HydrophobicContact CD2-CG 4.14Å; F70-F84 HydrophobicContact CE2-CD1 4.45Å; F70-F84 AromaticContact CG-CD1 3.94Å; F70-F84 HydrophobicContact CG-CD1 3.94Å; F70-F84 HydrophobicContact CG-CE1 4.16Å
71F82.6Confident80.9Confident138 Ų13894.7 Ų94.761%0.60546%0.458SS*.Hα-helixtrans-62.1-34-178.5-70.8-61.2000112.7E67 R68E67-F71 HydrophobicContact CB-CE2 4.46Å; E67-F71 WeakPolarHBondContact O-CD2 3.38Å; E67-F71 PolarHBondContact O-N 3.26Å; E67-F71 VanDerWaalsContact O-N 3.15Å; R68-F71 PolarHBondContact O-N 3.32Å
72I82.6Confident80.3Confident120 Ų12097 Ų9762%0.61546%0.464SS*.Hα-helixtrans-69.4-47.3175.7-66.1162.6000110.7R68 Q69 F70R68-I72 WeakPolarHBondContact O-CG1 3.31Å; R68-I72 PolarHBondContact O-N 3.07Å; Q69-I72 PolarHBondContact O-N 3.35Å; F70-I72 VanDerWaalsContact C-N 3.26Å; F70-I72 PolarHBondContact O-N 3.33Å
73R78.5Confident79.9Confident115 Ų11597.7 Ų97.743%0.43447%0.473SS..Hα-helixtrans-78.6-15.7-175.7-68.5-169.6-161.4177.58.1114.7Q69 F70 K75 D76Q69-R73 WeakPolarHBondContact O-CB 3.22Å; Q69-R73 WeakPolarHBondContact O-CG 3.49Å; Q69-R73 PolarHBondContact O-N 3.22Å; F70-R73 PolarHBondContact O-N 2.88Å; R73-K75 PolarHBondContact O-N 3.5Å; R73-D76 PolarHBondContact O-N 2.7Å
74L73.4Confident79.6Confident97 Ų9796.9 Ų96.951%0.50847%0.469SS..THydrogen-bonded Turntrans-52.7-21.7174.4-174.167000112.2F70 L81F70-L74 HydrophobicContact CZ-CD1 4.47Å; F70-L74 WeakPolarHBondContact O-CB 3.4Å; F70-L74 PolarHBondContact O-N 3.24Å; L74-L81 HydrophobicContact CB-CD1 4.35Å; L74-L81 HydrophobicContact CD1-CD1 3.52Å; L74-L81 HydrophobicContact CD1-CD2 3.66Å; L74-L81 HydrophobicContact CD1-CG 4.24Å
75K70Confident79.3Confident186 Ų18693.5 Ų93.581%0.80946%0.46SS*.THydrogen-bonded Turntrans-79.2-20.3175.8-163.4174176.5-176.50115.1R73R73-K75 PolarHBondContact O-N 3.5Å
76D68.3Low79.1Confident119 Ų11991.9 Ų91.964%0.63645%0.454SS*.THydrogen-bonded Turntrans-113.8-2.8-156.2-75.6-15.8000117.5R73R73-D76 PolarHBondContact O-N 2.7Å
77S65.7Low79.2Confident51 Ų5194 Ų9436%0.35747%0.465SS..  trans157.3145.4161.643.80000112.7S79 N80 L81S77-S79 PolarHBondContact O-N 3.18Å; S77-N80 PolarHBondContact OG-ND2 3.22Å; S77-L81 PolarHBondContact O-N 3.01Å
78D70Confident79.2Confident144 Ų14492.1 Ų92.177%0.7746%0.457SS*.Hα-helixtrans-64.9-33.2-176.7-65.8-30.1000114.6L81D78-L81 WeakPolarHBondContact O-CB 3.47Å; D78-L81 PolarHBondContact O-N 2.85Å
79S66.8Low79.3Confident89 Ų8988 Ų8862%0.62245%0.445SS*.Hα-helixtrans-71.8-39.4-176.258.90000113.2S77 L81S77-S79 PolarHBondContact O-N 3.18Å; S79-L81 PolarHBondContact O-N 2.85Å
80N72.3Confident79.6Confident91 Ų9188 Ų8849%0.48745%0.448SS..Hα-helixtrans-68.5-28.2175.1-77-36.7000111.9S77 F84S77-N80 PolarHBondContact OG-ND2 3.22Å; N80-F84 WeakPolarHBondContact O-CB 3.3Å; N80-F84 PolarHBondContact O-N 3.25Å; N80-F84 VanDerWaalsContact O-N 3.07Å
81L76.5Confident79.9Confident35 Ų3586.9 Ų86.918%0.18344%0.444CS..Hα-helixtrans-65.2-43.9-179.6-166.470.8000112.4F70 L74 S77 D78 S79 T83 F84 Q85F70-L81 HydrophobicContact CD2-CD1 3.87Å; F70-L81 HydrophobicContact CE2-CD1 3.29Å; F70-L81 HydrophobicContact CE2-CG 3.98Å; F70-L81 HydrophobicContact CZ-CD1 3.89Å; L74-L81 HydrophobicContact CB-CD1 4.35Å; L74-L81 HydrophobicContact CD1-CD1 3.52Å; L74-L81 HydrophobicContact CD1-CD2 3.66Å; L74-L81 HydrophobicContact CD1-CG 4.24Å; S77-L81 PolarHBondContact O-N 3.01Å; D78-L81 WeakPolarHBondContact O-CB 3.47Å; D78-L81 PolarHBondContact O-N 2.85Å; S79-L81 PolarHBondContact O-N 2.85Å; L81-T83 PolarHBondContact O-N 3.06Å; L81-F84 WeakPolarHBondContact O-CB 3.42Å; L81-F84 PolarHBondContact O-N 3.05Å; L81-Q85 WeakPolarHBondContact O-CB 3.35Å; L81-Q85 PolarHBondContact O-N 2.87Å
82H81.6Confident80.3Confident125 Ų12583.2 Ų83.258%0.57943%0.431SS*.Hα-helixtrans-65.2-42.1-178.8-173.360.7000112.4F84 Q85 T86H82-F84 VanDerWaalsContact C-N 3.31Å; H82-F84 PolarHBondContact O-N 2.93Å; H82-Q85 PolarHBondContact O-N 2.82Å; H82-T86 PolarHBondContact O-N 2.97Å; H82-T86 PolarHBondContact O-OG1 3.47Å
83T82.6Confident80.8Confident84 Ų8484.2 Ų84.252%0.51543%0.431SS..Hα-helixtrans-61.1-44.5174.9-55.90000110.3L81 T86 I87L81-T83 PolarHBondContact O-N 3.06Å; T83-T86 WeakPolarHBondContact O-CB 3.39Å; T83-T86 PolarHBondContact O-N 3.41Å; T83-I87 HydrophobicContact CG2-CD1 4.32Å; T83-I87 WeakPolarHBondContact O-CG1 3.17Å; T83-I87 PolarHBondContact O-N 2.81Å; T83-I87 VanDerWaalsContact O-N 3.14Å
84F83.5Confident81.4Confident9 Ų986.5 Ų86.54%0.03944%0.44CS..Hα-helixtrans-63.1-48178.4-162.3-75.7000112.4L66 Q69 F70 N80 L81 H82 T86 I87 L88L66-F84 HydrophobicContact CB-CE1 4.21Å; L66-F84 HydrophobicContact CB-CZ 3.87Å; L66-F84 HydrophobicContact CD2-CE2 4.14Å; L66-F84 HydrophobicContact CD2-CZ 3.75Å; L66-F84 HydrophobicContact CG-CZ 4.44Å; L66-F84 WeakPolarHBondContact O-CE1 3.33Å; L66-F84 WeakPolarHBondContact O-CZ 3.49Å; Q69-F84 HydrophobicContact CB-CE2 3.79Å; Q69-F84 HydrophobicContact CB-CZ 3.78Å; F70-F84 HydrophobicContact CB-CD1 3.63Å; F70-F84 HydrophobicContact CB-CE1 3.38Å; F70-F84 HydrophobicContact CB-CZ 4.16Å; F70-F84 HydrophobicContact CD2-CB 4.43Å; F70-F84 AromaticContact CD2-CD1 3.4Å; F70-F84 HydrophobicContact CD2-CD1 3.4Å; F70-F84 HydrophobicContact CD2-CE1 4.08Å; F70-F84 HydrophobicContact CD2-CG 4.14Å; F70-F84 HydrophobicContact CE2-CD1 4.45Å; F70-F84 AromaticContact CG-CD1 3.94Å; F70-F84 HydrophobicContact CG-CD1 3.94Å; F70-F84 HydrophobicContact CG-CE1 4.16Å; N80-F84 WeakPolarHBondContact O-CB 3.3Å; N80-F84 PolarHBondContact O-N 3.25Å; N80-F84 VanDerWaalsContact O-N 3.07Å; L81-F84 WeakPolarHBondContact O-CB 3.42Å; L81-F84 PolarHBondContact O-N 3.05Å; H82-F84 VanDerWaalsContact C-N 3.31Å; H82-F84 PolarHBondContact O-N 2.93Å; F84-T86 PolarHBondContact O-N 2.93Å; F84-I87 PolarHBondContact O-N 2.66Å; F84-I87 VanDerWaalsContact O-N 3.11Å; F84-L88 HydrophobicContact CE1-CB 4.43Å; F84-L88 PolarHBondContact O-N 3.43Å
85Q85.1Confident82.3Confident79 Ų7983.3 Ų83.337%0.36942%0.423SS..Hα-helixtrans-56.6-41.3177.8-178.2178.8-25.400111.1L81 H82 L88 Q89L81-Q85 WeakPolarHBondContact O-CB 3.35Å; L81-Q85 PolarHBondContact O-N 2.87Å; H82-Q85 PolarHBondContact O-N 2.82Å; Q85-L88 PolarHBondContact O-N 2.95Å; Q85-Q89 HydrophobicContact CG-CG 4.5Å; Q85-Q89 WeakPolarHBondContact O-CB 3.49Å; Q85-Q89 VanDerWaalsContact O-CG 3.32Å; Q85-Q89 WeakPolarHBondContact O-CG 3.27Å; Q85-Q89 PolarHBondContact O-N 3.21Å
86T88.4Confident83.5Confident51 Ų5179.7 Ų79.731%0.31341%0.41SS..Hα-helixtrans-61.5-45.3176.4-580000111.8H82 T83 F84 L88 Q89 N90H82-T86 PolarHBondContact O-N 2.97Å; H82-T86 PolarHBondContact O-OG1 3.47Å; T83-T86 WeakPolarHBondContact O-CB 3.39Å; T83-T86 PolarHBondContact O-N 3.41Å; F84-T86 PolarHBondContact O-N 2.93Å; T86-L88 VanDerWaalsContact C-N 3.34Å; T86-L88 PolarHBondContact O-N 3.34Å; T86-Q89 PolarHBondContact O-N 3.32Å; T86-N90 WeakPolarHBondContact O-CB 3.42Å; T86-N90 VanDerWaalsContact O-CG 3.3Å; T86-N90 PolarHBondContact O-N 3.04Å; T86-N90 PolarHBondContact O-ND2 3.19Å
87I88.9Confident84.6Confident77 Ų7777.8 Ų77.840%0.39541%0.406SS..Hα-helixtrans-62-43.5176.7-65.6166.5000110.6L66 T83 F84 N90 T91L66-I87 HydrophobicContact CD1-CG2 3.98Å; L66-I87 HydrophobicContact CD2-CG2 4.27Å; T83-I87 HydrophobicContact CG2-CD1 4.32Å; T83-I87 WeakPolarHBondContact O-CG1 3.17Å; T83-I87 PolarHBondContact O-N 2.81Å; T83-I87 VanDerWaalsContact O-N 3.14Å; F84-I87 PolarHBondContact O-N 2.66Å; F84-I87 VanDerWaalsContact O-N 3.11Å; I87-N90 PolarHBondContact O-N 2.6Å; I87-T91 WeakPolarHBondContact O-CB 3.49Å; I87-T91 PolarHBondContact O-N 2.84Å; I87-T91 PolarHBondContact O-OG1 3.47Å
88L89.1Confident85.9Confident29 Ų2977.3 Ų77.315%0.15240%0.399CS..Hα-helixtrans-62.8-46.2178.7-171.869.7000111.5F63 L66 E67 F84 Q85 T86 N90 T91 N92F63-L88 HydrophobicContact CD2-CD1 3.77Å; F63-L88 HydrophobicContact CE2-CD1 3.37Å; F63-L88 HydrophobicContact CE2-CG 3.84Å; F63-L88 HydrophobicContact CZ-CD1 4Å; F63-L88 HydrophobicContact CZ-CG 4.43Å; L66-L88 HydrophobicContact CB-CD1 3.92Å; E67-L88 HydrophobicContact CG-CD1 3.75Å; E67-L88 HydrophobicContact CG-CD2 4.46Å; F84-L88 HydrophobicContact CE1-CB 4.43Å; F84-L88 PolarHBondContact O-N 3.43Å; Q85-L88 PolarHBondContact O-N 2.95Å; T86-L88 VanDerWaalsContact C-N 3.34Å; T86-L88 PolarHBondContact O-N 3.34Å; L88-N90 PolarHBondContact O-N 3.22Å; L88-T91 PolarHBondContact O-N 3.04Å; L88-N92 WeakPolarHBondContact O-CB 3.35Å; L88-N92 PolarHBondContact O-N 3.41Å
89Q90.9Very high87Confident96 Ų9672.2 Ų72.245%0.44938%0.377SS..Hα-helixtrans-61-43.1176-75178.7-8.600112.1Q85 T86 T91 N92 K93Q85-Q89 HydrophobicContact CG-CG 4.5Å; Q85-Q89 WeakPolarHBondContact O-CB 3.49Å; Q85-Q89 VanDerWaalsContact O-CG 3.32Å; Q85-Q89 WeakPolarHBondContact O-CG 3.27Å; Q85-Q89 PolarHBondContact O-N 3.21Å; T86-Q89 PolarHBondContact O-N 3.32Å; Q89-T91 VanDerWaalsContact C-N 3.35Å; Q89-N92 PolarHBondContact O-N 3.36Å; Q89-K93 WeakPolarHBondContact O-CG 3.33Å; Q89-K93 PolarHBondContact O-N 3.26Å
90N91.2Very high88.4Confident74 Ų7472.5 Ų72.540%0.39637%0.372SS..Hα-helixtrans-64.2-40.6176.8-74.8-22.5000111.9T86 I87 L88 K93 R94T86-N90 WeakPolarHBondContact O-CB 3.42Å; T86-N90 VanDerWaalsContact O-CG 3.3Å; T86-N90 PolarHBondContact O-N 3.04Å; T86-N90 PolarHBondContact O-ND2 3.19Å; I87-N90 PolarHBondContact O-N 2.6Å; L88-N90 PolarHBondContact O-N 3.22Å; N90-K93 PolarHBondContact O-N 2.92Å; N90-R94 WeakPolarHBondContact O-CG 3.42Å; N90-R94 PolarHBondContact O-N 3.21Å
91T90.2Very high89.3Confident16 Ų1670.6 Ų70.610%0.09837%0.365CS..Hα-helixtrans-66-42.1177-52.70000110.8F63 L66 I87 L88 Q89 R94 L95F63-T91 HydrophobicContact CB-CG2 4.08Å; F63-T91 HydrophobicContact CD2-CG2 4.06Å; L66-T91 HydrophobicContact CD1-CG2 4.16Å; L66-T91 WeakPolarHBondContact CD1-OG1 3.34Å; I87-T91 WeakPolarHBondContact O-CB 3.49Å; I87-T91 PolarHBondContact O-N 2.84Å; I87-T91 PolarHBondContact O-OG1 3.47Å; L88-T91 PolarHBondContact O-N 3.04Å; Q89-T91 VanDerWaalsContact C-N 3.35Å; T91-R94 PolarHBondContact O-N 2.91Å; T91-L95 WeakPolarHBondContact O-CB 3.34Å; T91-L95 PolarHBondContact O-N 2.98Å
92N90.8Very high90.1Very high60 Ų6069.4 Ų69.432%0.32136%0.36SS..Hα-helixtrans-60.9-47.4174.8-168.3-4.4000111.7F63 L88 Q89 R94 L95 M96F63-N92 HydrophobicContact CD2-CB 4.4Å; F63-N92 HydrophobicContact CE2-CB 3.75Å; F63-N92 HydrophobicContact CZ-CB 4.4Å; L88-N92 WeakPolarHBondContact O-CB 3.35Å; L88-N92 PolarHBondContact O-N 3.41Å; Q89-N92 PolarHBondContact O-N 3.36Å; N92-R94 VanDerWaalsContact C-N 3.3Å; N92-R94 PolarHBondContact O-N 3.29Å; N92-L95 WeakPolarHBondContact O-CB 3.24Å; N92-L95 PolarHBondContact O-N 3.01Å; N92-L95 VanDerWaalsContact O-N 3.1Å; N92-M96 WeakPolarHBondContact O-CG 3.29Å; N92-M96 PolarHBondContact O-N 3.01Å
93K93Very high90.6Very high142 Ų14269.8 Ų69.862%0.61736%0.36SS*.Hα-helixtrans-56.8-43.2176-74.8176.7-179.9177.90112.3Q89 N90 M96 S97Q89-K93 WeakPolarHBondContact O-CG 3.33Å; Q89-K93 PolarHBondContact O-N 3.26Å; N90-K93 PolarHBondContact O-N 2.92Å; K93-M96 PolarHBondContact O-N 2.97Å; K93-S97 PolarHBondContact O-N 3.35Å
94R91.6Very high91.1Very high163 Ų16374.3 Ų74.362%0.61537%0.368SS*.Hα-helixtrans-65.1-41.7175.9-71.6174.5-178.5-176.60.1111.9N90 T91 N92 S97 L98N90-R94 WeakPolarHBondContact O-CG 3.42Å; N90-R94 PolarHBondContact O-N 3.21Å; T91-R94 PolarHBondContact O-N 2.91Å; N92-R94 VanDerWaalsContact C-N 3.3Å; N92-R94 PolarHBondContact O-N 3.29Å; R94-S97 PolarHBondContact O-N 3.41Å; R94-L98 WeakPolarHBondContact O-CG 3.43Å; R94-L98 PolarHBondContact O-N 2.95Å
95L92.7Very high91.5Very high29 Ų2974.7 Ų74.715%0.15237%0.37CS..Hα-helixtrans-60.5-45.6177-17172.7000111.3L56 R59 A60 T91 N92 L98 A99L56-L95 HydrophobicContact CD1-CD1 3.67Å; L56-L95 HydrophobicContact CD1-CG 4.27Å; R59-L95 HydrophobicContact CB-CD1 3.95Å; A60-L95 HydrophobicContact CB-CD1 4.04Å; T91-L95 WeakPolarHBondContact O-CB 3.34Å; T91-L95 PolarHBondContact O-N 2.98Å; N92-L95 WeakPolarHBondContact O-CB 3.24Å; N92-L95 PolarHBondContact O-N 3.01Å; N92-L95 VanDerWaalsContact O-N 3.1Å; L95-L98 PolarHBondContact O-N 3.5Å; L95-A99 WeakPolarHBondContact O-CB 3.48Å; L95-A99 PolarHBondContact O-N 3.31Å
96M93.6Very high91.8Very high111 Ų11173.1 Ų73.155%0.54737%0.366SS..Hα-helixtrans-62.1-44175.6-67.5-63-18000111.7N92 K93 L98 A99 D100N92-M96 WeakPolarHBondContact O-CG 3.29Å; N92-M96 PolarHBondContact O-N 3.01Å; K93-M96 PolarHBondContact O-N 2.97Å; M96-L98 VanDerWaalsContact C-N 3.31Å; M96-L98 PolarHBondContact O-N 3.41Å; M96-A99 PolarHBondContact O-N 2.88Å; M96-D100 PolarHBondContact O-N 2.9Å
97S93.1Very high92Very high79 Ų7975 Ų7555%0.55237%0.371SS*.Hα-helixtrans-60.8-38.8175.9-176.70000112.9K93 R94 S101K93-S97 PolarHBondContact O-N 3.35Å; R94-S97 PolarHBondContact O-N 3.41Å; S97-S101 WeakPolarHBondContact O-CB 3.4Å; S97-S101 PolarHBondContact O-N 3.24Å
98L92.5Very high92.1Very high40 Ų4073.8 Ų73.821%0.20937%0.37CS..Hα-helixtrans-68.8-39175.5-75.8170.6000111.5L56 R59 R94 L95 M96 S101 A102L56-L98 HydrophobicContact CD1-CB 3.74Å; R59-L98 HydrophobicContact CB-CD1 4.18Å; R59-L98 HydrophobicContact CG-CD1 3.71Å; R94-L98 WeakPolarHBondContact O-CG 3.43Å; R94-L98 PolarHBondContact O-N 2.95Å; L95-L98 PolarHBondContact O-N 3.5Å; M96-L98 VanDerWaalsContact C-N 3.31Å; M96-L98 PolarHBondContact O-N 3.41Å; L98-S101 WeakPolarHBondContact O-CB 3.49Å; L98-S101 PolarHBondContact O-N 2.96Å; L98-A102 WeakPolarHBondContact O-CB 3.24Å; L98-A102 PolarHBondContact O-N 3.28Å
99A93.5Very high92.2Very high37 Ų3772.7 Ų72.731%0.30636%0.364SS..Hα-helixtrans-64.1-42.5176.500000111.6L56 L95 M96 S101 A102 K103L56-A99 HydrophobicContact CD1-CB 4.16Å; L95-A99 WeakPolarHBondContact O-CB 3.48Å; L95-A99 PolarHBondContact O-N 3.31Å; M96-A99 PolarHBondContact O-N 2.88Å; A99-S101 VanDerWaalsContact C-N 3.34Å; A99-A102 PolarHBondContact O-N 3.42Å; A99-K103 WeakPolarHBondContact O-CB 3.45Å; A99-K103 PolarHBondContact O-N 3.43Å
100D94.5Very high92.1Very high96 Ų9673.5 Ų73.551%0.51337%0.368SS..Hα-helixtrans-63-41.3174.4-75.2-23.4000111.6M96 K103 R104M96-D100 PolarHBondContact O-N 2.9Å; D100-K103 PolarHBondContact O-N 2.77Å; D100-R104 WeakPolarHBondContact O-CG 3.36Å; D100-R104 PolarHBondContact O-N 2.63Å
101S92Very high92.1Very high50 Ų5075.3 Ų75.335%0.3538%0.378SS..Hα-helixtrans-61.6-48.7174.6-166.30000111.3S97 L98 A99 K103 R104 M105S97-S101 WeakPolarHBondContact O-CB 3.4Å; S97-S101 PolarHBondContact O-N 3.24Å; L98-S101 WeakPolarHBondContact O-CB 3.49Å; L98-S101 PolarHBondContact O-N 2.96Å; A99-S101 VanDerWaalsContact C-N 3.34Å; S101-K103 VanDerWaalsContact C-N 3.29Å; S101-K103 PolarHBondContact O-N 3.34Å; S101-R104 PolarHBondContact O-N 2.9Å; S101-M105 VanDerWaalsContact O-CG 3.22Å; S101-M105 WeakPolarHBondContact O-CG 3.47Å; S101-M105 PolarHBondContact O-N 3.37Å
102A92.6Very high92.1Very high10 Ų1075.5 Ų75.58%0.08338%0.38CS..Hα-helixtrans-58.2-42.3177.900000111.5V52 L98 A99 M105 T106V52-A102 HydrophobicContact CG1-CB 3.98Å; L98-A102 WeakPolarHBondContact O-CB 3.24Å; L98-A102 PolarHBondContact O-N 3.28Å; A99-A102 PolarHBondContact O-N 3.42Å; A102-M105 PolarHBondContact O-N 3.46Å; A102-T106 PolarHBondContact O-N 3.04Å; A102-T106 PolarHBondContact O-OG1 3.17Å; A102-T106 VanDerWaalsContact O-OG1 3.05Å
103K93.3Very high92Very high133 Ų13373.1 Ų73.158%0.57837%0.369SS*.Hα-helixtrans-61.1-49.3176.9-176.2-178.8175.2-175.40112.1A99 D100 S101 M105 T106 E107A99-K103 WeakPolarHBondContact O-CB 3.45Å; A99-K103 PolarHBondContact O-N 3.43Å; D100-K103 PolarHBondContact O-N 2.77Å; S101-K103 VanDerWaalsContact C-N 3.29Å; S101-K103 PolarHBondContact O-N 3.34Å; K103-M105 PolarHBondContact O-N 3.27Å; K103-T106 WeakPolarHBondContact O-CB 3.49Å; K103-T106 PolarHBondContact O-N 3.23Å; K103-E107 VanDerWaalsContact CE-OE1 3.29Å; K103-E107 WeakPolarHBondContact CE-OE1 3.29Å; K103-E107 WeakPolarHBondContact O-CG 3.48Å; K103-E107 PolarHBondContact O-N 3.47Å
104R93.3Very high91.8Very high179 Ų17970.5 Ų70.568%0.67536%0.362SS*.Hα-helixtrans-60.1-37.1178-70.3173.3-173.6-81.70.2111.9D100 S101 E107 S108D100-R104 WeakPolarHBondContact O-CG 3.36Å; D100-R104 PolarHBondContact O-N 2.63Å; S101-R104 PolarHBondContact O-N 2.9Å; R104-E107 PolarHBondContact O-N 3.49Å; R104-S108 WeakPolarHBondContact O-CB 3.35Å; R104-S108 PolarHBondContact O-N 2.66Å
105M90.9Very high91.6Very high18 Ų1864 Ų649%0.08935%0.345CS..Hα-helixtrans-70.2-39.6177.6-69.117378.300112.2E48 L49 V52 S101 A102 K103 S108 L109E48-M105 HydrophobicContact CB-CE 3.44Å; E48-M105 VanDerWaalsContact CB-CE 3.44Å; E48-M105 VanDerWaalsContact CD-CE 3.49Å; E48-M105 HydrophobicContact CG-CE 3.35Å; E48-M105 WeakPolarHBondContact O-CE 3.31Å; L49-M105 HydrophobicContact CB-CE 4.31Å; L49-M105 HydrophobicContact CD1-CB 3.85Å; L49-M105 VanDerWaalsContact N-CE 3.29Å; V52-M105 HydrophobicContact CB-CE 4.47Å; V52-M105 HydrophobicContact CB-SD 3.9Å; V52-M105 HydrophobicContact CG1-SD 4.14Å; V52-M105 HydrophobicContact CG2-CE 3.95Å; V52-M105 HydrophobicContact CG2-SD 3.53Å; V52-M105 VanDerWaalsContact CG2-SD 3.53Å; S101-M105 VanDerWaalsContact O-CG 3.22Å; S101-M105 WeakPolarHBondContact O-CG 3.47Å; S101-M105 PolarHBondContact O-N 3.37Å; A102-M105 PolarHBondContact O-N 3.46Å; K103-M105 PolarHBondContact O-N 3.27Å; M105-S108 PolarHBondContact O-N 2.86Å; M105-L109 WeakPolarHBondContact O-CB 3.27Å; M105-L109 PolarHBondContact O-N 2.77Å
106T91.5Very high91.4Very high46 Ų4662.6 Ų62.628%0.28234%0.338SS..Hα-helixtrans-58.8-47.1171.9-58.40000111A102 K103 S108 L109 E110A102-T106 PolarHBondContact O-N 3.04Å; A102-T106 PolarHBondContact O-OG1 3.17Å; A102-T106 VanDerWaalsContact O-OG1 3.05Å; K103-T106 WeakPolarHBondContact O-CB 3.49Å; K103-T106 PolarHBondContact O-N 3.23Å; T106-S108 VanDerWaalsContact C-N 3.32Å; T106-S108 PolarHBondContact O-N 3.05Å; T106-L109 PolarHBondContact O-N 2.89Å; T106-E110 WeakPolarHBondContact O-CG 3.43Å; T106-E110 PolarHBondContact O-N 2.92Å
107E92.3Very high91.1Very high90 Ų9059.4 Ų59.442%0.42132%0.321SS..Hα-helixtrans-60-41.8176.2-68.7170.3-172.800111.7K103 R104 N111K103-E107 VanDerWaalsContact CE-OE1 3.29Å; K103-E107 WeakPolarHBondContact CE-OE1 3.29Å; K103-E107 WeakPolarHBondContact O-CG 3.48Å; K103-E107 PolarHBondContact O-N 3.47Å; R104-E107 PolarHBondContact O-N 3.49Å; E107-N111 PolarHBondContact O-N 3.4Å; E107-N111 VanDerWaalsContact O-N 3.09Å; E107-N111 PolarHBondContact O-ND2 3.39Å
108S91.5Very high90.8Very high51 Ų5156.8 Ų56.836%0.35730%0.304SS..Hα-helixtrans-64.7-40.4175.6-171.20000112.3R104 M105 T106 N111 A112R104-S108 WeakPolarHBondContact O-CB 3.35Å; R104-S108 PolarHBondContact O-N 2.66Å; M105-S108 PolarHBondContact O-N 2.86Å; T106-S108 VanDerWaalsContact C-N 3.32Å; T106-S108 PolarHBondContact O-N 3.05Å; S108-N111 PolarHBondContact O-N 3.09Å; S108-A112 WeakPolarHBondContact O-CB 3.31Å; S108-A112 PolarHBondContact O-N 3.25Å
109L90.9Very high90.6Very high7 Ų756 Ų564%0.03730%0.302CS..Hα-helixtrans-67.2-42.5178.7-177.463.3000111.4F42 L45 L49 M105 T106 N111 A112 A113 I152F42-L109 HydrophobicContact CD2-CD1 3.7Å; F42-L109 HydrophobicContact CE2-CD1 3.5Å; F42-L109 HydrophobicContact CE2-CG 4.26Å; F42-L109 HydrophobicContact CZ-CD1 4.26Å; L45-L109 HydrophobicContact CB-CD1 3.95Å; L49-L109 HydrophobicContact CD2-CD2 3.53Å; M105-L109 WeakPolarHBondContact O-CB 3.27Å; M105-L109 PolarHBondContact O-N 2.77Å; T106-L109 PolarHBondContact O-N 2.89Å; L109-N111 VanDerWaalsContact C-N 3.32Å; L109-N111 PolarHBondContact O-N 3.43Å; L109-A112 PolarHBondContact O-N 3.07Å; L109-A113 WeakPolarHBondContact O-CB 3.45Å; L109-A113 PolarHBondContact O-N 3.44Å; L109-I152 HydrophobicContact CD2-CG2 3.95Å
110E90.2Very high90.3Very high113 Ų11354.3 Ų54.353%0.52829%0.288SS..Hα-helixtrans-60.1-43174.3-74.2176.4-178.200111.5T106 A113 N114T106-E110 WeakPolarHBondContact O-CG 3.43Å; T106-E110 PolarHBondContact O-N 2.92Å; E110-A113 PolarHBondContact O-N 3.43Å; E110-N114 WeakPolarHBondContact O-CB 3.4Å; E110-N114 VanDerWaalsContact O-CG 3.23Å; E110-N114 PolarHBondContact O-N 3.37Å; E110-N114 PolarHBondContact O-ND2 2.94Å
111N90.7Very high89.9Confident112 Ų11252.5 Ų52.560%0.59928%0.276SS*.Hα-helixtrans-63.1-43.5174.8-74.8-37.2000112E107 S108 L109 N114 G115E107-N111 PolarHBondContact O-N 3.4Å; E107-N111 VanDerWaalsContact O-N 3.09Å; E107-N111 PolarHBondContact O-ND2 3.39Å; S108-N111 PolarHBondContact O-N 3.09Å; L109-N111 VanDerWaalsContact C-N 3.32Å; L109-N111 PolarHBondContact O-N 3.43Å; N111-N114 PolarHBondContact O-N 2.93Å; N111-G115 PolarHBondContact O-N 3.17Å
112A89Confident89.6Confident19 Ų1952 Ų5216%0.15727%0.27CS..Hα-helixtrans-63.3-41.9175.600000111.8F42 L45 S108 L109 G115 L116F42-A112 HydrophobicContact CB-CB 4.48Å; F42-A112 HydrophobicContact CD2-CB 4.18Å; L45-A112 HydrophobicContact CD1-CB 3.76Å; S108-A112 WeakPolarHBondContact O-CB 3.31Å; S108-A112 PolarHBondContact O-N 3.25Å; L109-A112 PolarHBondContact O-N 3.07Å; A112-G115 PolarHBondContact O-N 3.12Å; A112-L116 WeakPolarHBondContact O-CB 3.38Å; A112-L116 PolarHBondContact O-N 3.42Å
113A89.1Confident89.2Confident11 Ų1152.2 Ų52.29%0.09127%0.269CS..Hα-helixtrans-62.8-45.6176.600000111.7F42 L109 E110 G115 L116 K117 F147F42-A113 HydrophobicContact CD2-CB 4.24Å; F42-A113 HydrophobicContact CE2-CB 3.76Å; L109-A113 WeakPolarHBondContact O-CB 3.45Å; L109-A113 PolarHBondContact O-N 3.44Å; E110-A113 PolarHBondContact O-N 3.43Å; A113-G115 VanDerWaalsContact C-N 3.35Å; A113-L116 WeakPolarHBondContact O-CB 3.43Å; A113-L116 PolarHBondContact O-N 3.46Å; A113-L116 VanDerWaalsContact O-N 3.12Å; A113-K117 WeakPolarHBondContact O-CG 3.13Å; A113-K117 PolarHBondContact O-N 3.22Å; A113-F147 HydrophobicContact CB-CE1 4.3Å
114N88.6Confident88.8Confident87 Ų8745.9 Ų45.947%0.46524%0.242SC..Hα-helixtrans-64.4-41.6176.9-72.8-27.1000111.7E110 N111 L116 K117 A118E110-N114 WeakPolarHBondContact O-CB 3.4Å; E110-N114 VanDerWaalsContact O-CG 3.23Å; E110-N114 PolarHBondContact O-N 3.37Å; E110-N114 PolarHBondContact O-ND2 2.94Å; N111-N114 PolarHBondContact O-N 2.93Å; N114-L116 VanDerWaalsContact C-N 3.3Å; N114-L116 PolarHBondContact O-N 3.47Å; N114-K117 PolarHBondContact O-N 2.87Å; N114-A118 PolarHBondContact O-N 3.37Å; N114-A118 VanDerWaalsContact O-N 3.09Å
115G87.8Confident88.3Confident25 Ų2538.5 Ų38.526%0.25822%0.216SC..Hα-helixtrans-57.1-4617000000111.3Q38 N111 A112 A113 A118 S119Q38-G115 PolarHBondContact NE2-O 3.34Å; N111-G115 PolarHBondContact O-N 3.17Å; A112-G115 PolarHBondContact O-N 3.12Å; A113-G115 VanDerWaalsContact C-N 3.35Å; G115-A118 PolarHBondContact O-N 2.79Å; G115-S119 WeakPolarHBondContact O-CB 3.33Å; G115-S119 PolarHBondContact O-N 3.18Å
116L88.1Confident87.8Confident0 Ų039.9 Ų39.90%022%0.223CC..Hα-helixtrans-65.6-43.1-177-179.562.5000111.1Y35 Q38 L39 F42 A112 A113 N114 A118 S119 N120 F147 W157Y35-L116 HydrophobicContact CE2-CD1 3.75Å; Q38-L116 VanDerWaalsContact NE2-N 3.13Å; L39-L116 HydrophobicContact CD2-CD1 3.49Å; L39-L116 VanDerWaalsContact CD2-CD1 3.49Å; L39-L116 HydrophobicContact CD2-CD2 3.83Å; L39-L116 HydrophobicContact CD2-CG 4.29Å; L39-L116 HydrophobicContact CG-CD1 3.9Å; F42-L116 HydrophobicContact CB-CD2 4.43Å; F42-L116 HydrophobicContact CD1-CD2 4.08Å; F42-L116 HydrophobicContact CG-CD2 4.09Å; A112-L116 WeakPolarHBondContact O-CB 3.38Å; A112-L116 PolarHBondContact O-N 3.42Å; A113-L116 WeakPolarHBondContact O-CB 3.43Å; A113-L116 PolarHBondContact O-N 3.46Å; A113-L116 VanDerWaalsContact O-N 3.12Å; N114-L116 VanDerWaalsContact C-N 3.3Å; N114-L116 PolarHBondContact O-N 3.47Å; L116-A118 VanDerWaalsContact C-N 3.33Å; L116-A118 PolarHBondContact O-N 2.87Å; L116-S119 WeakPolarHBondContact O-CB 3.16Å; L116-S119 PolarHBondContact O-N 3.36Å; L116-N120 WeakPolarHBondContact O-CB 3.28Å; L116-N120 PolarHBondContact O-N 3.37Å; L116-N120 PolarHBondContact O-OD1 2.83Å; L116-F147 HydrophobicContact CD2-CD2 4.18Å; L116-F147 HydrophobicContact CD2-CE2 4.44Å; L116-W157 HydrophobicContact CD2-CH2 4.23Å; L116-W157 HydrophobicContact CD2-CZ3 4.1Å
117K87.9Confident87.2Confident44 Ų4437.7 Ų37.719%0.19121%0.21CC..Hα-helixtrans-55.3-48.7172.9-71.6171.3-172.4171.60111.5A113 N114 S119 N120 Q121 F147 E149A113-K117 WeakPolarHBondContact O-CG 3.13Å; A113-K117 PolarHBondContact O-N 3.22Å; N114-K117 PolarHBondContact O-N 2.87Å; K117-S119 VanDerWaalsContact C-N 3.32Å; K117-S119 PolarHBondContact O-N 2.85Å; K117-N120 PolarHBondContact O-N 3.35Å; K117-Q121 WeakPolarHBondContact O-CG 3.4Å; K117-Q121 PolarHBondContact O-N 3.36Å; K117-F147 HydrophobicContact CD-CD1 4.45Å; K117-F147 HydrophobicContact CG-CB 4.07Å; K117-F147 HydrophobicContact CG-CD1 4.03Å; K117-F147 HydrophobicContact CG-CG 4.39Å; K117-E149 VanDerWaalsContact NZ-CD 3.33Å; K117-E149 VanDerWaalsContact NZ-CG 3.34Å; K117-E149 IonicContact NZ-OE1 2.7Å; K117-E149 PolarHBondContact NZ-OE1 2.9Å
118A87.4Confident86.7Confident24 Ų2435 Ų3520%0.19820%0.197CC..Hα-helixtrans-61.6-42.3178.200000111.9W2 N114 G115 L116 L122W2-A118 HydrophobicContact CB-CB 4.39Å; W2-A118 VanDerWaalsContact CD1-CB 3.42Å; W2-A118 HydrophobicContact CG-CB 4.1Å; N114-A118 PolarHBondContact O-N 3.37Å; N114-A118 VanDerWaalsContact O-N 3.09Å; G115-A118 PolarHBondContact O-N 2.79Å; L116-A118 VanDerWaalsContact C-N 3.33Å; L116-A118 PolarHBondContact O-N 2.87Å; A118-L122 WeakPolarHBondContact O-CB 3.34Å; A118-L122 PolarHBondContact O-N 3.42Å
119S86.7Confident86Confident25 Ų2533.8 Ų33.818%0.17519%0.187CC..Hα-helixtrans-65.5-45.7178-158.30000111.4Q38 G115 L116 K117 Q121 L122 L123Q38-S119 PolarHBondContact OE1-OG 2.76Å; G115-S119 WeakPolarHBondContact O-CB 3.33Å; G115-S119 PolarHBondContact O-N 3.18Å; L116-S119 WeakPolarHBondContact O-CB 3.16Å; L116-S119 PolarHBondContact O-N 3.36Å; K117-S119 VanDerWaalsContact C-N 3.32Å; K117-S119 PolarHBondContact O-N 2.85Å; S119-Q121 PolarHBondContact O-N 3.44Å; S119-L122 PolarHBondContact O-N 3.28Å; S119-L123 WeakPolarHBondContact O-CB 3.38Å; S119-L123 PolarHBondContact O-N 2.87Å
120N88.8Confident85.2Confident1 Ų134.1 Ų34.11%0.00519%0.189CC..Hα-helixtrans-57.5-46.4176.2-76.7-3.9000112.3Y35 L116 K117 L123 A124 L145Y35-N120 WeakPolarHBondContact CE2-OD1 3.36Å; Y35-N120 PolarHBondContact OH-OD1 3.2Å; L116-N120 WeakPolarHBondContact O-CB 3.28Å; L116-N120 PolarHBondContact O-N 3.37Å; L116-N120 PolarHBondContact O-OD1 2.83Å; K117-N120 PolarHBondContact O-N 3.35Å; N120-L123 PolarHBondContact O-N 2.72Å; N120-A124 WeakPolarHBondContact O-CB 3.43Å; N120-A124 PolarHBondContact O-N 3.2Å; N120-L145 HydrophobicContact CB-CB 4.15Å; N120-L145 WeakPolarHBondContact CB-O 3.31Å; N120-L145 VanDerWaalsContact CG-O 3.25Å; N120-L145 PolarHBondContact ND2-O 2.91Å
121Q86.3Confident84.4Confident57 Ų5729.4 Ų29.427%0.26617%0.168SC..Hα-helixtrans-66.1-45.7178.5-69.1-65-24.900111.4K117 S119 L123 A124 D125K117-Q121 WeakPolarHBondContact O-CG 3.4Å; K117-Q121 PolarHBondContact O-N 3.36Å; S119-Q121 PolarHBondContact O-N 3.44Å; Q121-L123 VanDerWaalsContact C-N 3.31Å; Q121-L123 PolarHBondContact O-N 2.9Å; Q121-A124 PolarHBondContact O-N 2.98Å; Q121-D125 VanDerWaalsContact O-CG 3.27Å; Q121-D125 PolarHBondContact O-N 3.46Å
122L84.1Confident83.5Confident40 Ų4033.9 Ų33.921%0.20918%0.176CC..Hα-helixtrans-60.3-43.7177178.861.8000111.3W2 F5 A118 S119 D125 L126W2-L122 HydrophobicContact CB-CB 4.18Å; F5-L122 HydrophobicContact CB-CD1 3.9Å; F5-L122 HydrophobicContact CD1-CD1 3.45Å; F5-L122 VanDerWaalsContact CD1-CD1 3.45Å; F5-L122 HydrophobicContact CD2-CD1 4.23Å; F5-L122 HydrophobicContact CE1-CD1 3.99Å; F5-L122 HydrophobicContact CG-CD1 3.58Å; A118-L122 WeakPolarHBondContact O-CB 3.34Å; A118-L122 PolarHBondContact O-N 3.42Å; S119-L122 PolarHBondContact O-N 3.28Å; L122-D125 PolarHBondContact O-N 2.91Å; L122-L126 HydrophobicContact CD1-CD1 4.16Å; L122-L126 HydrophobicContact CD1-CG 4.21Å; L122-L126 HydrophobicContact CG-CD1 3.92Å; L122-L126 HydrophobicContact CG-CG 4.39Å; L122-L126 WeakPolarHBondContact O-CB 3.25Å; L122-L126 VanDerWaalsContact O-CG 3.27Å; L122-L126 WeakPolarHBondContact O-CG 3.45Å; L122-L126 PolarHBondContact O-N 2.86Å
123L83.9Confident82.7Confident14 Ų1433.3 Ų33.37%0.07317%0.171CC..Hα-helixtrans-66.6-40-179.9-170.665.4000111.8I30 Y35 S119 N120 Q121 L126 L127 F197I30-L123 HydrophobicContact CG2-CD1 3.67Å; Y35-L123 HydrophobicContact CD1-CD2 3.55Å; Y35-L123 HydrophobicContact CD2-CD2 3.88Å; Y35-L123 HydrophobicContact CE1-CD2 3.71Å; Y35-L123 HydrophobicContact CE2-CD2 4.06Å; Y35-L123 HydrophobicContact CG-CD2 3.62Å; S119-L123 WeakPolarHBondContact O-CB 3.38Å; S119-L123 PolarHBondContact O-N 2.87Å; N120-L123 PolarHBondContact O-N 2.72Å; Q121-L123 VanDerWaalsContact C-N 3.31Å; Q121-L123 PolarHBondContact O-N 2.9Å; L123-L126 PolarHBondContact O-N 3.25Å; L123-L127 VanDerWaalsContact O-CB 3.25Å; L123-L127 WeakPolarHBondContact O-CB 3.37Å; L123-L127 PolarHBondContact O-N 3.07Å; L123-F197 HydrophobicContact CD1-CE1 4.49Å; L123-F197 HydrophobicContact CD1-CZ 4.24Å; L123-F197 HydrophobicContact CD2-CE1 3.6Å; L123-F197 HydrophobicContact CD2-CE2 4.34Å; L123-F197 HydrophobicContact CD2-CZ 3.32Å; L123-F197 HydrophobicContact CG-CE1 4.32Å; L123-F197 HydrophobicContact CG-CZ 3.76Å
124A85.1Confident82.2Confident1 Ų136.1 Ų36.11%0.00819%0.188CC..Hα-helixtrans-60.1-48.7172.700000110.9N120 Q121 L127 F128 L145N120-A124 WeakPolarHBondContact O-CB 3.43Å; N120-A124 PolarHBondContact O-N 3.2Å; Q121-A124 PolarHBondContact O-N 2.98Å; A124-L127 PolarHBondContact O-N 3.01Å; A124-F128 HydrophobicContact CB-CE2 3.97Å; A124-F128 HydrophobicContact CB-CZ 4.25Å; A124-F128 WeakPolarHBondContact O-CD2 3.4Å; A124-F128 WeakPolarHBondContact O-CE2 3.13Å; A124-F128 WeakPolarHBondContact O-CG 3.43Å; A124-F128 PolarHBondContact O-N 3.01Å; A124-L145 HydrophobicContact CB-CD1 3.87Å
125D82.9Confident81.8Confident24 Ų2437.6 Ų37.613%0.12820%0.196CC..Hα-helixtrans-62.6-45.5179.2-64.8-18.3000111.2F5 Q121 L122 L127 F128 L129 R142F5-D125 HydrophobicContact CD1-CB 4.48Å; F5-D125 HydrophobicContact CE1-CB 3.88Å; Q121-D125 VanDerWaalsContact O-CG 3.27Å; Q121-D125 PolarHBondContact O-N 3.46Å; L122-D125 PolarHBondContact O-N 2.91Å; D125-L127 VanDerWaalsContact C-N 3.35Å; D125-L127 PolarHBondContact O-N 3.43Å; D125-F128 PolarHBondContact O-N 2.91Å; D125-L129 VanDerWaalsContact O-CD1 3.3Å; D125-L129 WeakPolarHBondContact O-CD1 3.41Å; D125-L129 WeakPolarHBondContact O-CG 3.49Å; D125-L129 PolarHBondContact O-N 2.93Å; D125-R142 IonicContact OD1-CZ 2.66Å; D125-R142 IonicContact OD1-NH1 2.63Å; D125-R142 PolarHBondContact OD1-NH1 2.65Å; D125-R142 IonicContact OD1-NH2 2.6Å; D125-R142 PolarHBondContact OD1-NH2 2.77Å
126L80.6Confident81.5Confident46 Ų4641 Ų4124%0.24121%0.208CC..Hα-helixtrans-61.8-40.4176.6-74.1172.8000112.5F5 A26 I30 L122 L123 F128 L129 S130F5-L126 HydrophobicContact CE1-CD2 4.37Å; F5-L126 HydrophobicContact CE2-CD2 3.96Å; F5-L126 HydrophobicContact CZ-CD2 3.63Å; F5-L126 HydrophobicContact CZ-CG 4.27Å; A26-L126 HydrophobicContact CB-CD2 4.18Å; I30-L126 HydrophobicContact CD1-CB 4.37Å; L122-L126 HydrophobicContact CD1-CD1 4.16Å; L122-L126 HydrophobicContact CD1-CG 4.21Å; L122-L126 HydrophobicContact CG-CD1 3.92Å; L122-L126 HydrophobicContact CG-CG 4.39Å; L122-L126 WeakPolarHBondContact O-CB 3.25Å; L122-L126 VanDerWaalsContact O-CG 3.27Å; L122-L126 WeakPolarHBondContact O-CG 3.45Å; L122-L126 PolarHBondContact O-N 2.86Å; L123-L126 PolarHBondContact O-N 3.25Å; L126-F128 VanDerWaalsContact C-N 3.35Å; L126-L129 PolarHBondContact O-N 3.27Å; L126-S130 WeakPolarHBondContact O-CB 3.39Å; L126-S130 PolarHBondContact O-N 3.43Å; L126-S130 PolarHBondContact O-OG 3.46Å
127L80.2Confident81.2Confident1 Ų141 Ų411%0.00521%0.208CC..Hα-helixtrans-62.6-43.6177.4-167.980.5000110.9I30 L123 A124 D125 L129 S130 I131 L133 V141 I201I30-L127 HydrophobicContact CD1-CB 4.45Å; I30-L127 HydrophobicContact CD1-CD1 4.11Å; L123-L127 VanDerWaalsContact O-CB 3.25Å; L123-L127 WeakPolarHBondContact O-CB 3.37Å; L123-L127 PolarHBondContact O-N 3.07Å; A124-L127 PolarHBondContact O-N 3.01Å; D125-L127 VanDerWaalsContact C-N 3.35Å; D125-L127 PolarHBondContact O-N 3.43Å; L127-L129 VanDerWaalsContact C-N 3.29Å; L127-L129 PolarHBondContact O-N 3.4Å; L127-S130 PolarHBondContact O-N 3.44Å; L127-I131 HydrophobicContact CD1-CD1 3.4Å; L127-I131 VanDerWaalsContact CD1-CD1 3.4Å; L127-I131 HydrophobicContact CG-CD1 4.05Å; L127-I131 PolarHBondContact O-N 3.49Å; L127-L133 HydrophobicContact CD2-CD1 3.75Å; L127-L133 HydrophobicContact CG-CD1 3.88Å; L127-V141 HydrophobicContact CD2-CG1 3.69Å; L127-I201 HydrophobicContact CD1-CG1 4.02Å
128F81.4Confident80.9Confident33 Ų3341.4 Ų41.415%0.14521%0.21CC..Hα-helixtrans-71.6-23.7-179.7-55.4-28000113.4A124 D125 L126 L133 Q138 V141 R142A124-F128 HydrophobicContact CB-CE2 3.97Å; A124-F128 HydrophobicContact CB-CZ 4.25Å; A124-F128 WeakPolarHBondContact O-CD2 3.4Å; A124-F128 WeakPolarHBondContact O-CE2 3.13Å; A124-F128 WeakPolarHBondContact O-CG 3.43Å; A124-F128 PolarHBondContact O-N 3.01Å; D125-F128 PolarHBondContact O-N 2.91Å; L126-F128 VanDerWaalsContact C-N 3.35Å; F128-L133 HydrophobicContact CD1-CD1 4.07Å; F128-L133 HydrophobicContact CE1-CD1 4.3Å; F128-Q138 HydrophobicContact CD1-CB 4.01Å; F128-Q138 HydrophobicContact CD1-CG 3.64Å; F128-Q138 HydrophobicContact CE1-CB 3.73Å; F128-Q138 HydrophobicContact CE1-CG 3.83Å; F128-Q138 HydrophobicContact CE2-CB 4.43Å; F128-Q138 HydrophobicContact CG-CB 4.5Å; F128-Q138 HydrophobicContact CG-CG 4.18Å; F128-Q138 HydrophobicContact CZ-CB 3.96Å; F128-Q138 HydrophobicContact CZ-CG 4.5Å; F128-Q138 WeakPolarHBondContact CZ-O 2.98Å; F128-V141 HydrophobicContact CE1-CB 4.27Å; F128-V141 HydrophobicContact CE1-CG1 4.33Å; F128-V141 HydrophobicContact CZ-CB 4.38Å; F128-V141 HydrophobicContact CZ-CG1 4.42Å; F128-R142 HydrophobicContact CE2-CB 4.15Å; F128-R142 HydrophobicContact CZ-CB 4.04Å
129L76.5Confident80.8Confident26 Ų2647.5 Ų47.514%0.13623%0.232CC..Hα-helixtrans-84.5-31.7173.7-65159.7000113.1F5 L9 V24 A26 D125 L126 L127F5-L129 HydrophobicContact CE1-CD1 3.95Å; F5-L129 HydrophobicContact CZ-CD1 3.52Å; L9-L129 HydrophobicContact CD1-CD1 3.19Å; L9-L129 HydrophobicContact CD1-CD2 3.73Å; L9-L129 HydrophobicContact CD1-CG 3.95Å; V24-L129 HydrophobicContact CB-CD2 4.5Å; V24-L129 HydrophobicContact CG1-CD2 4.45Å; V24-L129 WeakPolarHBondContact O-CD2 3.45Å; A26-L129 HydrophobicContact CB-CB 4.13Å; D125-L129 VanDerWaalsContact O-CD1 3.3Å; D125-L129 WeakPolarHBondContact O-CD1 3.41Å; D125-L129 WeakPolarHBondContact O-CG 3.49Å; D125-L129 PolarHBondContact O-N 2.93Å; L126-L129 PolarHBondContact O-N 3.27Å; L127-L129 VanDerWaalsContact C-N 3.29Å; L127-L129 PolarHBondContact O-N 3.4Å
130S73.9Confident80.7Confident14 Ų1448.6 Ų48.610%0.09824%0.236CC..Hα-helixtrans-82.3-34.4-178.4-53.90000111.6A26 L126 L127 N208A26-S130 WeakPolarHBondContact CB-OG 3.49Å; L126-S130 WeakPolarHBondContact O-CB 3.39Å; L126-S130 PolarHBondContact O-N 3.43Å; L126-S130 PolarHBondContact O-OG 3.46Å; L127-S130 PolarHBondContact O-N 3.44Å; S130-N208 PolarHBondContact O-ND2 3.18Å
131I72.7Confident80.5Confident14 Ų1448.6 Ų48.67%0.07224%0.236CC..SBendtrans-129.5124.6-169.1-57.2144.8000108.8L127 L133 A204L127-I131 HydrophobicContact CD1-CD1 3.4Å; L127-I131 VanDerWaalsContact CD1-CD1 3.4Å; L127-I131 HydrophobicContact CG-CD1 4.05Å; L127-I131 PolarHBondContact O-N 3.49Å; I131-L133 VanDerWaalsContact C-N 3.29Å; I131-L133 HydrophobicContact CB-CD1 4.36Å; I131-L133 HydrophobicContact CB-CG 4.34Å; I131-L133 HydrophobicContact CG2-CD1 4.27Å; I131-L133 HydrophobicContact CG2-CD2 4.21Å; I131-L133 HydrophobicContact CG2-CG 3.78Å; I131-L133 PolarHBondContact O-N 3.2Å; I131-A204 HydrophobicContact CB-CB 4.19Å; I131-A204 HydrophobicContact CD1-CB 3.25Å; I131-A204 HydrophobicContact CG1-CB 3.56Å; I131-A204 HydrophobicContact CG2-CB 3.62Å
132R72Confident80.6Confident205 Ų20549.8 Ų49.877%0.77424%0.238SC*.  trans-70.885.9168.8-85.5-175.1170.5-164.9-7.5110.5R23R23-R132 VanDerWaalsContact CZ-NH2 3.28Å; R23-R132 VanDerWaalsContact NH1-NH2 3.16Å
133L73.2Confident80.7Confident8 Ų851 Ų514%0.04225%0.25CS..  trans-87.4142.7169-67.1151.3000108.9L127 F128 I131 L137 Q138 F172L127-L133 HydrophobicContact CD2-CD1 3.75Å; L127-L133 HydrophobicContact CG-CD1 3.88Å; F128-L133 HydrophobicContact CD1-CD1 4.07Å; F128-L133 HydrophobicContact CE1-CD1 4.3Å; I131-L133 VanDerWaalsContact C-N 3.29Å; I131-L133 HydrophobicContact CB-CD1 4.36Å; I131-L133 HydrophobicContact CB-CG 4.34Å; I131-L133 HydrophobicContact CG2-CD1 4.27Å; I131-L133 HydrophobicContact CG2-CD2 4.21Å; I131-L133 HydrophobicContact CG2-CG 3.78Å; I131-L133 PolarHBondContact O-N 3.2Å; L133-L137 HydrophobicContact CD2-CD2 3.34Å; L133-L137 HydrophobicContact CD2-CG 3.89Å; L133-Q138 HydrophobicContact CB-CG 3.81Å; L133-Q138 PolarHBondContact O-NE2 3.46Å; L133-F172 HydrophobicContact CD2-CD2 4.22Å; L133-F172 HydrophobicContact CD2-CE2 4.15Å
134P77.9Confident80.8Confident70 Ų7050.4 Ų50.446%0.45525%0.247SC..  trans-64150.5172.328.8-35000110.9N136 L137 Q138P134-N136 VanDerWaalsContact CB-OD1 3.23Å; P134-N136 WeakPolarHBondContact CB-OD1 3.48Å; P134-N136 VanDerWaalsContact CG-OD1 3.3Å; P134-N136 WeakPolarHBondContact CG-OD1 3.35Å; P134-N136 PolarHBondContact O-N 3.3Å; P134-N136 VanDerWaalsContact O-N 3.12Å; P134-L137 HydrophobicContact CG-CB 3.87Å; P134-L137 HydrophobicContact CG-CD2 4.46Å; P134-L137 WeakPolarHBondContact O-CA 3.38Å; P134-L137 WeakPolarHBondContact O-CB 3.22Å; P134-L137 PolarHBondContact O-N 2.96Å; P134-Q138 PolarHBondContact O-N 2.9Å
135D80.7Confident80.8Confident118 Ų11850.4 Ų50.463%0.63125%0.247SC*.Hα-helixtrans-57-32.8-170.9-68.9-12.9000113.8K139D135-K139 WeakPolarHBondContact O-CG 3.36Å; D135-K139 PolarHBondContact O-N 3.36Å
136N82.1Confident81Confident95 Ų9552.5 Ų52.551%0.50826%0.261SS..Hα-helixtrans-63-43.8174.863.3-29.1000111.6P134 K139 L140P134-N136 VanDerWaalsContact CB-OD1 3.23Å; P134-N136 WeakPolarHBondContact CB-OD1 3.48Å; P134-N136 VanDerWaalsContact CG-OD1 3.3Å; P134-N136 WeakPolarHBondContact CG-OD1 3.35Å; P134-N136 PolarHBondContact O-N 3.3Å; P134-N136 VanDerWaalsContact O-N 3.12Å; N136-K139 PolarHBondContact O-N 2.91Å; N136-L140 WeakPolarHBondContact O-CG 3.33Å; N136-L140 PolarHBondContact O-N 3.31Å
137L80.1Confident81.1Confident1 Ų151.2 Ų51.21%0.00525%0.253CS..Hα-helixtrans-72-36.4180-172.553.8000111.3L133 P134 K139 L140 V141 A168 F172L133-L137 HydrophobicContact CD2-CD2 3.34Å; L133-L137 HydrophobicContact CD2-CG 3.89Å; P134-L137 HydrophobicContact CG-CB 3.87Å; P134-L137 HydrophobicContact CG-CD2 4.46Å; P134-L137 WeakPolarHBondContact O-CA 3.38Å; P134-L137 WeakPolarHBondContact O-CB 3.22Å; P134-L137 PolarHBondContact O-N 2.96Å; L137-K139 VanDerWaalsContact C-N 3.32Å; L137-K139 PolarHBondContact O-N 3.12Å; L137-L140 PolarHBondContact O-N 2.81Å; L137-V141 HydrophobicContact CD1-CG2 4.29Å; L137-V141 WeakPolarHBondContact O-CG2 3.47Å; L137-V141 PolarHBondContact O-N 2.89Å; L137-A168 HydrophobicContact CD1-CB 3.31Å; L137-A168 WeakPolarHBondContact CD1-O 3.44Å; L137-F172 HydrophobicContact CD2-CB 3.92Å; L137-F172 HydrophobicContact CD2-CD2 3.59Å; L137-F172 HydrophobicContact CD2-CG 4.15Å
138Q82.4Confident81.1Confident52 Ų5255.2 Ų55.224%0.24328%0.275CS..Hα-helixtrans-59.5-44.4171.8-64.3-174.729.700111.6F128 L133 P134 V141 R142F128-Q138 HydrophobicContact CD1-CB 4.01Å; F128-Q138 HydrophobicContact CD1-CG 3.64Å; F128-Q138 HydrophobicContact CE1-CB 3.73Å; F128-Q138 HydrophobicContact CE1-CG 3.83Å; F128-Q138 HydrophobicContact CE2-CB 4.43Å; F128-Q138 HydrophobicContact CG-CB 4.5Å; F128-Q138 HydrophobicContact CG-CG 4.18Å; F128-Q138 HydrophobicContact CZ-CB 3.96Å; F128-Q138 HydrophobicContact CZ-CG 4.5Å; F128-Q138 WeakPolarHBondContact CZ-O 2.98Å; L133-Q138 HydrophobicContact CB-CG 3.81Å; L133-Q138 PolarHBondContact O-NE2 3.46Å; P134-Q138 PolarHBondContact O-N 2.9Å; Q138-V141 PolarHBondContact O-N 2.87Å; Q138-R142 VanDerWaalsContact O-CB 3.31Å; Q138-R142 WeakPolarHBondContact O-CB 3.49Å; Q138-R142 PolarHBondContact O-N 3.21Å
139K85.7Confident80.7Confident152 Ų15260.3 Ų60.366%0.66130%0.299SS*.Hα-helixtrans-61.6-45.3175.3-72.6173.5-176.3179.10111.6D135 N136 L137 R142 S143D135-K139 WeakPolarHBondContact O-CG 3.36Å; D135-K139 PolarHBondContact O-N 3.36Å; N136-K139 PolarHBondContact O-N 2.91Å; L137-K139 VanDerWaalsContact C-N 3.32Å; L137-K139 PolarHBondContact O-N 3.12Å; K139-R142 PolarHBondContact O-N 3.41Å; K139-S143 WeakPolarHBondContact O-CB 3.39Å; K139-S143 PolarHBondContact O-N 2.77Å; K139-S143 PolarHBondContact O-OG 2.96Å
140L84.6Confident80.7Confident49 Ų4965.7 Ų65.726%0.25733%0.328SS..Hα-helixtrans-61.3-47.4178.2-73.6172.7000112.3N136 L137 S143 A144 L164 A168N136-L140 WeakPolarHBondContact O-CG 3.33Å; N136-L140 PolarHBondContact O-N 3.31Å; L137-L140 PolarHBondContact O-N 2.81Å; L140-S143 PolarHBondContact O-N 2.7Å; L140-A144 WeakPolarHBondContact O-CB 3.2Å; L140-A144 PolarHBondContact O-N 3.04Å; L140-L164 HydrophobicContact CD2-CD2 4.15Å; L140-A168 HydrophobicContact CB-CB 4.34Å
141V84.6Confident81.1Confident0 Ų065.9 Ų65.90%033%0.328CS..Hα-helixtrans-66.5-41.8179.6173.40000111.2L127 F128 L137 Q138 S143 A144 L145 M165 A168 L200L127-V141 HydrophobicContact CD2-CG1 3.69Å; F128-V141 HydrophobicContact CE1-CB 4.27Å; F128-V141 HydrophobicContact CE1-CG1 4.33Å; F128-V141 HydrophobicContact CZ-CB 4.38Å; F128-V141 HydrophobicContact CZ-CG1 4.42Å; L137-V141 HydrophobicContact CD1-CG2 4.29Å; L137-V141 WeakPolarHBondContact O-CG2 3.47Å; L137-V141 PolarHBondContact O-N 2.89Å; Q138-V141 PolarHBondContact O-N 2.87Å; V141-S143 VanDerWaalsContact C-N 3.33Å; V141-S143 PolarHBondContact O-N 3.5Å; V141-A144 WeakPolarHBondContact O-CB 3.43Å; V141-A144 PolarHBondContact O-N 2.81Å; V141-L145 HydrophobicContact CG1-CD1 3.88Å; V141-L145 HydrophobicContact CG1-CG 4.42Å; V141-L145 WeakPolarHBondContact O-CG 3.47Å; V141-L145 PolarHBondContact O-N 3.5Å; V141-M165 HydrophobicContact CG1-CE 3.95Å; V141-M165 HydrophobicContact CG2-SD 4.36Å; V141-A168 HydrophobicContact CG2-CB 4.11Å; V141-L200 HydrophobicContact CG2-CD2 4.01Å
142R87Confident81.2Confident82 Ų8271.1 Ų71.131%0.30935%0.354SS..Hα-helixtrans-62.5-42.5175.8-171.8173.5-70.8-91.22.1110.9D125 F128 Q138 K139 A144 L145 T146D125-R142 IonicContact OD1-CZ 2.66Å; D125-R142 IonicContact OD1-NH1 2.63Å; D125-R142 PolarHBondContact OD1-NH1 2.65Å; D125-R142 IonicContact OD1-NH2 2.6Å; D125-R142 PolarHBondContact OD1-NH2 2.77Å; F128-R142 HydrophobicContact CE2-CB 4.15Å; F128-R142 HydrophobicContact CZ-CB 4.04Å; Q138-R142 VanDerWaalsContact O-CB 3.31Å; Q138-R142 WeakPolarHBondContact O-CB 3.49Å; Q138-R142 PolarHBondContact O-N 3.21Å; K139-R142 PolarHBondContact O-N 3.41Å; R142-A144 VanDerWaalsContact C-N 3.33Å; R142-A144 PolarHBondContact O-N 3.48Å; R142-L145 PolarHBondContact O-N 2.95Å; R142-T146 PolarHBondContact O-N 3.26Å; R142-T146 PolarHBondContact O-OG1 3.33Å
143S86.3Confident81.7Confident66 Ų6662 Ų6246%0.46233%0.325SS..Hα-helixtrans-63.5-38.7174.8-65.20000112K139 L140 V141 L145 T146K139-S143 WeakPolarHBondContact O-CB 3.39Å; K139-S143 PolarHBondContact O-N 2.77Å; K139-S143 PolarHBondContact O-OG 2.96Å; L140-S143 PolarHBondContact O-N 2.7Å; V141-S143 VanDerWaalsContact C-N 3.33Å; V141-S143 PolarHBondContact O-N 3.5Å; S143-L145 VanDerWaalsContact C-N 3.34Å; S143-L145 PolarHBondContact O-N 3.26Å; S143-T146 PolarHBondContact O-N 3.18Å
144A86.3Confident82.2Confident1 Ų161.7 Ų61.71%0.00832%0.323CS..Hα-helixtrans-63.9-39.2176.700000112.4L140 V141 R142 T146 W157 A161 L164 M165L140-A144 WeakPolarHBondContact O-CB 3.2Å; L140-A144 PolarHBondContact O-N 3.04Å; V141-A144 WeakPolarHBondContact O-CB 3.43Å; V141-A144 PolarHBondContact O-N 2.81Å; R142-A144 VanDerWaalsContact C-N 3.33Å; R142-A144 PolarHBondContact O-N 3.48Å; A144-T146 VanDerWaalsContact C-N 3.32Å; A144-W157 PolarHBondContact O-NE1 3.48Å; A144-A161 WeakPolarHBondContact O-CB 3.47Å; A144-L164 HydrophobicContact CB-CB 3.63Å; A144-L164 HydrophobicContact CB-CD1 4.24Å; A144-M165 HydrophobicContact CB-CE 4.16Å; A144-M165 HydrophobicContact CB-CG 3.98Å; A144-M165 HydrophobicContact CB-SD 4.38Å
145L85.9Confident82.5Confident2 Ų263.7 Ų63.71%0.0133%0.326CS..Hα-helixtrans-82.1-9.5178.9-65.5173.3000112.9N120 A124 V141 R142 S143 F147 M165 F193N120-L145 HydrophobicContact CB-CB 4.15Å; N120-L145 WeakPolarHBondContact CB-O 3.31Å; N120-L145 VanDerWaalsContact CG-O 3.25Å; N120-L145 PolarHBondContact ND2-O 2.91Å; A124-L145 HydrophobicContact CB-CD1 3.87Å; V141-L145 HydrophobicContact CG1-CD1 3.88Å; V141-L145 HydrophobicContact CG1-CG 4.42Å; V141-L145 WeakPolarHBondContact O-CG 3.47Å; V141-L145 PolarHBondContact O-N 3.5Å; R142-L145 PolarHBondContact O-N 2.95Å; S143-L145 VanDerWaalsContact C-N 3.34Å; S143-L145 PolarHBondContact O-N 3.26Å; L145-F147 PolarHBondContact O-N 3Å; L145-M165 HydrophobicContact CD2-CE 4.15Å; L145-M165 HydrophobicContact CG-CE 4.17Å; L145-F193 HydrophobicContact CD2-CZ 4.04Å
146T85.9Confident82.7Confident68 Ų6865.7 Ų65.742%0.41733%0.329SS..  trans-76.1111178.7-600000109.5R142 S143 A144 W157R142-T146 PolarHBondContact O-N 3.26Å; R142-T146 PolarHBondContact O-OG1 3.33Å; S143-T146 PolarHBondContact O-N 3.18Å; A144-T146 VanDerWaalsContact C-N 3.32Å; T146-W157 PolarHBondContact O-NE1 3.46Å; T146-W157 VanDerWaalsContact O-NE1 3.15Å
147F83.2Confident83Confident19 Ų1961.7 Ų61.78%0.08331%0.307CS..  trans-83.7128.6178.5-177.5-89.6000110.6F42 A113 L116 K117 L145 D151 W157F42-F147 AromaticContact CE1-CE2 3.96Å; F42-F147 HydrophobicContact CE1-CE2 3.96Å; F42-F147 HydrophobicContact CE1-CZ 4.28Å; F42-F147 HydrophobicContact CE2-CZ 4.21Å; F42-F147 AromaticContact CZ-CE2 3.78Å; F42-F147 HydrophobicContact CZ-CE2 3.78Å; F42-F147 AromaticContact CZ-CZ 3.62Å; F42-F147 HydrophobicContact CZ-CZ 3.62Å; A113-F147 HydrophobicContact CB-CE1 4.3Å; L116-F147 HydrophobicContact CD2-CD2 4.18Å; L116-F147 HydrophobicContact CD2-CE2 4.44Å; K117-F147 HydrophobicContact CD-CD1 4.45Å; K117-F147 HydrophobicContact CG-CB 4.07Å; K117-F147 HydrophobicContact CG-CD1 4.03Å; K117-F147 HydrophobicContact CG-CG 4.39Å; L145-F147 PolarHBondContact O-N 3Å; F147-D151 WeakPolarHBondContact CZ-O 3.45Å; F147-W157 HydrophobicContact CD2-CB 4.27Å; F147-W157 AromaticContact CD2-CD2 3.52Å; F147-W157 HydrophobicContact CD2-CD2 3.52Å; F147-W157 AromaticContact CD2-CE3 3.68Å; F147-W157 HydrophobicContact CD2-CE3 3.68Å; F147-W157 AromaticContact CD2-CG 3.76Å; F147-W157 HydrophobicContact CD2-CG 3.76Å; F147-W157 HydrophobicContact CD2-CZ3 4.31Å; F147-W157 HydrophobicContact CE2-CB 4.41Å; F147-W157 HydrophobicContact CE2-CD2 4.16Å; F147-W157 AromaticContact CE2-CE3 3.98Å; F147-W157 HydrophobicContact CE2-CE3 3.98Å; F147-W157 HydrophobicContact CE2-CG 4.33Å; F147-W157 HydrophobicContact CG-CD2 4.5Å
148D80.1Confident83.4Confident84 Ų8461.7 Ų61.745%0.44931%0.307SS..  trans-82.8128.7176.7-176.42.2000110.6N150 D151D148-N150 PolarHBondContact O-N 2.97Å; D148-N150 PolarHBondContact OD1-N 3.47Å; D148-N150 PolarHBondContact OD1-ND2 3.2Å; D148-D151 PolarHBondContact O-N 2.96Å
149E72.7Confident83.5Confident141 Ų14162.3 Ų62.366%0.65931%0.31SS*.THydrogen-bonded Turntrans-67.3-23.1-179-46.5-158.8133.100113K117 D151K117-E149 VanDerWaalsContact NZ-CD 3.33Å; K117-E149 VanDerWaalsContact NZ-CG 3.34Å; K117-E149 IonicContact NZ-OE1 2.7Å; K117-E149 PolarHBondContact NZ-OE1 2.9Å; E149-D151 VanDerWaalsContact C-N 3.28Å; E149-D151 PolarHBondContact O-N 3.15Å
150N77.8Confident83.6Confident139 Ų13959.7 Ų59.774%0.74330%0.3SS*.THydrogen-bonded Turntrans-80.2-11.1-177.8-58.1-65.4000113.1D148 I152D148-N150 PolarHBondContact O-N 2.97Å; D148-N150 PolarHBondContact OD1-N 3.47Å; D148-N150 PolarHBondContact OD1-ND2 3.2Å; N150-I152 PolarHBondContact O-N 3.06Å
151D82Confident83.7Confident17 Ų1757.4 Ų57.49%0.09129%0.288CS..  trans-98.677.1180-172.216.3000110.9F147 D148 E149 G153 G154 Q155 K156 W157F147-D151 WeakPolarHBondContact CZ-O 3.45Å; D148-D151 PolarHBondContact O-N 2.96Å; E149-D151 VanDerWaalsContact C-N 3.28Å; E149-D151 PolarHBondContact O-N 3.15Å; D151-G153 PolarHBondContact O-N 3.3Å; D151-G154 VanDerWaalsContact CG-CA 3.49Å; D151-G154 PolarHBondContact O-N 3.2Å; D151-G154 PolarHBondContact OD1-N 2.87Å; D151-G154 WeakPolarHBondContact OD2-CA 3.48Å; D151-Q155 PolarHBondContact OD1-N 3.23Å; D151-Q155 PolarHBondContact OD2-N 2.98Å; D151-K156 WeakPolarHBondContact OD2-CA 3.45Å; D151-K156 WeakPolarHBondContact OD2-CB 3.46Å; D151-K156 PolarHBondContact OD2-N 3.01Å; D151-W157 PolarHBondContact OD2-N 3.3Å
152I75.2Confident83.7Confident124 Ų12457.6 Ų57.664%0.63629%0.289SS*.THydrogen-bonded Turntrans-49.5-35.2-176.3-57.5172.5000111.8L109 N150L109-I152 HydrophobicContact CD2-CG2 3.95Å; N150-I152 PolarHBondContact O-N 3.06Å
153G81.6Confident83.6Confident15 Ų1557.4 Ų57.416%0.15529%0.29CS..THydrogen-bonded Turntrans-98.3-3.5-179.100000115.8S46 D151 Q155S46-G153 WeakPolarHBondContact OG-CA 3.39Å; S46-G153 PolarHBondContact OG-O 2.95Å; D151-G153 PolarHBondContact O-N 3.3Å; G153-Q155 PolarHBondContact O-N 3.49Å
154G83.6Confident83.5Confident0 Ų055 Ų550%027%0.273CS..SBendtrans63.415-176.900000115.4D151 I158D151-G154 VanDerWaalsContact CG-CA 3.49Å; D151-G154 PolarHBondContact O-N 3.2Å; D151-G154 PolarHBondContact OD1-N 2.87Å; D151-G154 WeakPolarHBondContact OD2-CA 3.48Å; G154-I158 WeakPolarHBondContact O-CB 3.36Å; G154-I158 WeakPolarHBondContact O-CG2 3.38Å; G154-I158 PolarHBondContact O-N 2.75Å
155Q84.8Confident83.4Confident113 Ų11355.1 Ų55.153%0.52827%0.273SS..Hα-helixtrans-70.9-45.6-176.2-63.9-170.3-6.800112.3D151 G153 W157 I158 E159 P186D151-Q155 PolarHBondContact OD1-N 3.23Å; D151-Q155 PolarHBondContact OD2-N 2.98Å; G153-Q155 PolarHBondContact O-N 3.49Å; Q155-W157 VanDerWaalsContact C-N 3.35Å; Q155-I158 WeakPolarHBondContact O-CG2 3.42Å; Q155-E159 PolarHBondContact O-N 3.18Å; Q155-P186 HydrophobicContact CB-CG 4.42Å; Q155-P186 HydrophobicContact CG-CB 4.23Å; Q155-P186 HydrophobicContact CG-CG 3.7Å
156K85.6Confident83.2Confident159 Ų15955.9 Ų55.969%0.69128%0.276SS*.Hα-helixtrans-69.9-39.4177-60.7179.4-178.8174.40110.1D151 E159 Q160D151-K156 WeakPolarHBondContact OD2-CA 3.45Å; D151-K156 WeakPolarHBondContact OD2-CB 3.46Å; D151-K156 PolarHBondContact OD2-N 3.01Å; K156-E159 PolarHBondContact O-N 3.49Å; K156-Q160 WeakPolarHBondContact O-CB 3.26Å; K156-Q160 PolarHBondContact O-N 3.33Å
157W88.6Confident83Confident12 Ų1257.1 Ų57.15%0.04528%0.278CS..Hα-helixtrans-61.2-49.6176.6171.667000111.2L39 F43 L116 A144 T146 F147 D151 Q155 E159 Q160 A161L39-W157 HydrophobicContact CD2-CH2 3.63Å; L39-W157 HydrophobicContact CD2-CZ3 3.81Å; F43-W157 HydrophobicContact CE2-CZ3 4.08Å; F43-W157 HydrophobicContact CZ-CE3 4.18Å; F43-W157 HydrophobicContact CZ-CZ3 4.03Å; L116-W157 HydrophobicContact CD2-CH2 4.23Å; L116-W157 HydrophobicContact CD2-CZ3 4.1Å; A144-W157 PolarHBondContact O-NE1 3.48Å; T146-W157 PolarHBondContact O-NE1 3.46Å; T146-W157 VanDerWaalsContact O-NE1 3.15Å; F147-W157 HydrophobicContact CD2-CB 4.27Å; F147-W157 AromaticContact CD2-CD2 3.52Å; F147-W157 HydrophobicContact CD2-CD2 3.52Å; F147-W157 AromaticContact CD2-CE3 3.68Å; F147-W157 HydrophobicContact CD2-CE3 3.68Å; F147-W157 AromaticContact CD2-CG 3.76Å; F147-W157 HydrophobicContact CD2-CG 3.76Å; F147-W157 HydrophobicContact CD2-CZ3 4.31Å; F147-W157 HydrophobicContact CE2-CB 4.41Å; F147-W157 HydrophobicContact CE2-CD2 4.16Å; F147-W157 AromaticContact CE2-CE3 3.98Å; F147-W157 HydrophobicContact CE2-CE3 3.98Å; F147-W157 HydrophobicContact CE2-CG 4.33Å; F147-W157 HydrophobicContact CG-CD2 4.5Å; D151-W157 PolarHBondContact OD2-N 3.3Å; Q155-W157 VanDerWaalsContact C-N 3.35Å; W157-E159 VanDerWaalsContact C-N 3.3Å; W157-E159 PolarHBondContact O-N 2.84Å; W157-Q160 PolarHBondContact O-N 3.44Å; W157-A161 HydrophobicContact CZ2-CB 4.31Å; W157-A161 WeakPolarHBondContact O-CB 3.42Å; W157-A161 PolarHBondContact O-N 2.86Å
158I86.9Confident82.9Confident0 Ų056.2 Ų56.20%027%0.274CS..Hα-helixtrans-66.2-34.3-178.3-164.359.3000112.4F43 G154 Q155 R162 N189 L190 F193F43-I158 HydrophobicContact CE1-CB 4.44Å; F43-I158 HydrophobicContact CE1-CG2 4.33Å; F43-I158 HydrophobicContact CZ-CB 3.86Å; F43-I158 HydrophobicContact CZ-CD1 4.46Å; F43-I158 HydrophobicContact CZ-CG1 4.2Å; F43-I158 HydrophobicContact CZ-CG2 4.24Å; G154-I158 WeakPolarHBondContact O-CB 3.36Å; G154-I158 WeakPolarHBondContact O-CG2 3.38Å; G154-I158 PolarHBondContact O-N 2.75Å; Q155-I158 WeakPolarHBondContact O-CG2 3.42Å; I158-R162 VanDerWaalsContact O-CB 3.24Å; I158-R162 WeakPolarHBondContact O-CB 3.17Å; I158-R162 PolarHBondContact O-N 3.03Å; I158-N189 HydrophobicContact CG1-CB 4.2Å; I158-N189 HydrophobicContact CG2-CB 4.11Å; I158-L190 HydrophobicContact CD1-CD1 4.01Å; I158-L190 HydrophobicContact CG1-CB 4.32Å; I158-F193 HydrophobicContact CD1-CB 3.78Å; I158-F193 HydrophobicContact CD1-CD1 4.03Å; I158-F193 HydrophobicContact CD1-CD2 4.37Å; I158-F193 HydrophobicContact CD1-CG 3.81Å
159E85.9Confident82.8Confident66 Ų6653.2 Ų53.231%0.30826%0.257SS..Hα-helixtrans-62.1-49173-177.5-176.616700111Q155 K156 W157 R162 K163 V182Q155-E159 PolarHBondContact O-N 3.18Å; K156-E159 PolarHBondContact O-N 3.49Å; W157-E159 VanDerWaalsContact C-N 3.3Å; W157-E159 PolarHBondContact O-N 2.84Å; E159-R162 PolarHBondContact O-N 3.19Å; E159-K163 HydrophobicContact CG-CD 4.43Å; E159-K163 WeakPolarHBondContact O-CG 3.44Å; E159-K163 PolarHBondContact O-N 2.77Å; E159-K163 WeakPolarHBondContact OE1-CE 3.37Å; E159-K163 IonicContact OE1-NZ 2.68Å; E159-K163 PolarHBondContact OE1-NZ 3.29Å; E159-V182 HydrophobicContact CG-CG1 3.71Å; E159-V182 HydrophobicContact CG-CG2 4.5Å
160Q86.9Confident83.1Confident96 Ų9650.2 Ų50.245%0.44924%0.24SC..Hα-helixtrans-66.8-43179.1-176.760.416.200111.8K156 W157 R162 K163 L164K156-Q160 WeakPolarHBondContact O-CB 3.26Å; K156-Q160 PolarHBondContact O-N 3.33Å; W157-Q160 PolarHBondContact O-N 3.44Å; Q160-R162 VanDerWaalsContact C-N 3.31Å; Q160-R162 PolarHBondContact O-N 3.46Å; Q160-K163 PolarHBondContact O-N 2.94Å; Q160-L164 HydrophobicContact CG-CD1 3.95Å; Q160-L164 HydrophobicContact CG-CG 4.38Å; Q160-L164 WeakPolarHBondContact O-CB 3.46Å; Q160-L164 VanDerWaalsContact O-CG 3.31Å; Q160-L164 WeakPolarHBondContact O-CG 3.35Å; Q160-L164 PolarHBondContact O-N 3.4Å
161A87.3Confident83.1Confident1 Ų146.1 Ų46.11%0.00822%0.222CC..Hα-helixtrans-61-41.7178.100000110.9A144 W157 M165 F193A144-A161 WeakPolarHBondContact O-CB 3.47Å; W157-A161 HydrophobicContact CZ2-CB 4.31Å; W157-A161 WeakPolarHBondContact O-CB 3.42Å; W157-A161 PolarHBondContact O-N 2.86Å; A161-M165 VanDerWaalsContact O-CB 3.28Å; A161-M165 WeakPolarHBondContact O-CB 3.4Å; A161-M165 WeakPolarHBondContact O-CG 3.25Å; A161-M165 PolarHBondContact O-N 2.89Å; A161-F193 HydrophobicContact CB-CD2 4.03Å; A161-F193 HydrophobicContact CB-CE2 3.86Å
162R84.1Confident82.5Confident5 Ų548.9 Ų48.92%0.01923%0.233CC..Hα-helixtrans-60.5-53.1172.9179.3-172.3164.4-168.5-9.3111.1I158 E159 Q160 L164 M165 E166 E180 P181 N189 L196I158-R162 VanDerWaalsContact O-CB 3.24Å; I158-R162 WeakPolarHBondContact O-CB 3.17Å; I158-R162 PolarHBondContact O-N 3.03Å; E159-R162 PolarHBondContact O-N 3.19Å; Q160-R162 VanDerWaalsContact C-N 3.31Å; Q160-R162 PolarHBondContact O-N 3.46Å; R162-L164 VanDerWaalsContact C-N 3.31Å; R162-L164 PolarHBondContact O-N 3.04Å; R162-M165 PolarHBondContact O-N 3.09Å; R162-E166 WeakPolarHBondContact O-CB 3.37Å; R162-E166 PolarHBondContact O-N 3.42Å; R162-E180 PolarHBondContact NH2-O 3.36Å; R162-P181 PolarHBondContact NH1-O 3.47Å; R162-P181 PolarHBondContact NH2-O 3.36Å; R162-N189 PolarHBondContact NH1-OD1 3.47Å; R162-L196 HydrophobicContact CG-CD1 4.33Å
163K84.9Confident82.3Confident77 Ų7744.5 Ų44.534%0.33521%0.213SC..Hα-helixtrans-56-45.9179.9-74.1169.9174.8169.20111.7E159 Q160 E166 M167 V182E159-K163 HydrophobicContact CG-CD 4.43Å; E159-K163 WeakPolarHBondContact O-CG 3.44Å; E159-K163 PolarHBondContact O-N 2.77Å; E159-K163 WeakPolarHBondContact OE1-CE 3.37Å; E159-K163 IonicContact OE1-NZ 2.68Å; E159-K163 PolarHBondContact OE1-NZ 3.29Å; Q160-K163 PolarHBondContact O-N 2.94Å; K163-E166 PolarHBondContact O-N 3.34Å; K163-M167 WeakPolarHBondContact O-CG 3.2Å; K163-M167 PolarHBondContact O-N 2.8Å; K163-V182 VanDerWaalsContact CE-CG2 3.42Å
164L85.1Confident81.6Confident17 Ų1750.9 Ų50.99%0.08924%0.243CC..Hα-helixtrans-66.8-41.3178.4-69.4173.9000112.1L140 A144 Q160 R162 E166 M167 A168L140-L164 HydrophobicContact CD2-CD2 4.15Å; A144-L164 HydrophobicContact CB-CB 3.63Å; A144-L164 HydrophobicContact CB-CD1 4.24Å; Q160-L164 HydrophobicContact CG-CD1 3.95Å; Q160-L164 HydrophobicContact CG-CG 4.38Å; Q160-L164 WeakPolarHBondContact O-CB 3.46Å; Q160-L164 VanDerWaalsContact O-CG 3.31Å; Q160-L164 WeakPolarHBondContact O-CG 3.35Å; Q160-L164 PolarHBondContact O-N 3.4Å; R162-L164 VanDerWaalsContact C-N 3.31Å; R162-L164 PolarHBondContact O-N 3.04Å; L164-E166 VanDerWaalsContact C-N 3.32Å; L164-M167 HydrophobicContact CD2-CE 3.58Å; L164-M167 HydrophobicContact CG-CE 4.41Å; L164-M167 PolarHBondContact O-N 3.42Å; L164-A168 VanDerWaalsContact O-CB 3.26Å; L164-A168 WeakPolarHBondContact O-CB 3.31Å; L164-A168 PolarHBondContact O-N 3.29Å
165M83.2Confident80.4Confident2 Ų252.7 Ų52.71%0.0126%0.258CS..Hα-helixtrans-66.1-35175.2-82.4-61.6-173.300112.7V141 A144 L145 A161 R162 A168 Y169 F193 L196 F197 L200V141-M165 HydrophobicContact CG1-CE 3.95Å; V141-M165 HydrophobicContact CG2-SD 4.36Å; A144-M165 HydrophobicContact CB-CE 4.16Å; A144-M165 HydrophobicContact CB-CG 3.98Å; A144-M165 HydrophobicContact CB-SD 4.38Å; L145-M165 HydrophobicContact CD2-CE 4.15Å; L145-M165 HydrophobicContact CG-CE 4.17Å; A161-M165 VanDerWaalsContact O-CB 3.28Å; A161-M165 WeakPolarHBondContact O-CB 3.4Å; A161-M165 WeakPolarHBondContact O-CG 3.25Å; A161-M165 PolarHBondContact O-N 2.89Å; R162-M165 PolarHBondContact O-N 3.09Å; M165-A168 WeakPolarHBondContact O-CB 3.44Å; M165-A168 PolarHBondContact O-N 3.32Å; M165-Y169 WeakPolarHBondContact O-CB 3.5Å; M165-Y169 PolarHBondContact O-N 2.85Å; M165-F193 HydrophobicContact CB-CD2 4.34Å; M165-F193 HydrophobicContact CB-CE2 4.45Å; M165-F193 HydrophobicContact CE-CE2 3.99Å; M165-F193 HydrophobicContact CE-CZ 4.2Å; M165-F193 HydrophobicContact CG-CD2 3.8Å; M165-F193 HydrophobicContact CG-CE2 3.45Å; M165-F193 VanDerWaalsContact CG-CE2 3.45Å; M165-F193 HydrophobicContact CG-CZ 4.47Å; M165-L196 HydrophobicContact CB-CB 4.43Å; M165-L196 HydrophobicContact CB-CD1 4.49Å; M165-F197 HydrophobicContact CE-CD2 3.33Å; M165-F197 HydrophobicContact CE-CE2 3.67Å; M165-F197 HydrophobicContact CE-CG 4.48Å; M165-F197 HydrophobicContact SD-CD2 4.23Å; M165-L200 HydrophobicContact SD-CD2 4.24Å
166E82.5Confident79.1Confident19 Ų1955.6 Ų55.69%0.08927%0.272CS..Hα-helixtrans-67.3-46.3176-164.5-177.6137.800110.6R162 K163 L164 A168 Y169 R170 L196R162-E166 WeakPolarHBondContact O-CB 3.37Å; R162-E166 PolarHBondContact O-N 3.42Å; K163-E166 PolarHBondContact O-N 3.34Å; L164-E166 VanDerWaalsContact C-N 3.32Å; E166-A168 VanDerWaalsContact C-N 3.31Å; E166-A168 PolarHBondContact O-N 2.93Å; E166-Y169 PolarHBondContact O-N 3.49Å; E166-R170 WeakPolarHBondContact O-CB 3.13Å; E166-R170 VanDerWaalsContact O-CG 3.25Å; E166-R170 WeakPolarHBondContact O-CG 3.34Å; E166-R170 PolarHBondContact O-N 2.88Å; E166-R170 IonicContact OE1-CZ 2.67Å; E166-R170 IonicContact OE1-NE 3.23Å; E166-R170 PolarHBondContact OE1-NE 3.43Å; E166-R170 IonicContact OE1-NH2 3.42Å; E166-R170 PolarHBondContact OE1-NH2 3.48Å; E166-L196 HydrophobicContact CB-CD1 4.12Å
167M81.7Confident77.5Confident93 Ų9355.6 Ų55.646%0.45828%0.279SS..Hα-helixtrans-60.3-41.1172.1-71.8-171.2-66.500112.2K163 L164 R170 S171K163-M167 WeakPolarHBondContact O-CG 3.2Å; K163-M167 PolarHBondContact O-N 2.8Å; L164-M167 HydrophobicContact CD2-CE 3.58Å; L164-M167 HydrophobicContact CG-CE 4.41Å; L164-M167 PolarHBondContact O-N 3.42Å; M167-R170 PolarHBondContact O-N 3.26Å; M167-S171 WeakPolarHBondContact O-CB 3.37Å; M167-S171 PolarHBondContact O-N 3.03Å; M167-S171 PolarHBondContact O-OG 3.41Å
168A80.4Confident76Confident0 Ų057 Ų570%029%0.287CS..Hα-helixtrans-58.9-50.1174.800000111.1L137 L140 V141 L164 M165 E166 S171 F172L137-A168 HydrophobicContact CD1-CB 3.31Å; L137-A168 WeakPolarHBondContact CD1-O 3.44Å; L140-A168 HydrophobicContact CB-CB 4.34Å; V141-A168 HydrophobicContact CG2-CB 4.11Å; L164-A168 VanDerWaalsContact O-CB 3.26Å; L164-A168 WeakPolarHBondContact O-CB 3.31Å; L164-A168 PolarHBondContact O-N 3.29Å; M165-A168 WeakPolarHBondContact O-CB 3.44Å; M165-A168 PolarHBondContact O-N 3.32Å; E166-A168 VanDerWaalsContact C-N 3.31Å; E166-A168 PolarHBondContact O-N 2.93Å; A168-S171 PolarHBondContact O-N 3.29Å; A168-S171 PolarHBondContact O-OG 3.21Å; A168-F172 WeakPolarHBondContact O-CB 3.33Å; A168-F172 PolarHBondContact O-N 2.68Å
169Y77.4Confident74.5Confident21 Ų2161.3 Ų61.38%0.08232%0.317CS..Hα-helixtrans-64.5-42.3179.1-176.1-89.4000112.6M165 E166 S171 F172 T173 I178 L196 M199 K203M165-Y169 WeakPolarHBondContact O-CB 3.5Å; M165-Y169 PolarHBondContact O-N 2.85Å; E166-Y169 PolarHBondContact O-N 3.49Å; Y169-S171 PolarHBondContact O-N 3.13Å; Y169-F172 PolarHBondContact O-N 2.93Å; Y169-T173 HydrophobicContact CD1-CG2 4.25Å; Y169-T173 HydrophobicContact CD2-CG2 4.24Å; Y169-T173 HydrophobicContact CE1-CG2 3.81Å; Y169-T173 WeakPolarHBondContact CE1-OG1 3.42Å; Y169-T173 HydrophobicContact CE2-CG2 3.82Å; Y169-T173 HydrophobicContact CG-CG2 4.46Å; Y169-T173 WeakPolarHBondContact O-CB 3.27Å; Y169-T173 WeakPolarHBondContact O-CG2 3.38Å; Y169-T173 PolarHBondContact O-N 3.48Å; Y169-T173 PolarHBondContact O-OG1 3.27Å; Y169-I178 HydrophobicContact CD1-CD1 3.52Å; Y169-I178 HydrophobicContact CD1-CG1 4.49Å; Y169-I178 HydrophobicContact CE1-CD1 3.2Å; Y169-I178 HydrophobicContact CE1-CG1 4.3Å; Y169-L196 HydrophobicContact CG-CD2 4.4Å; Y169-M199 HydrophobicContact CD2-CB 4.41Å; Y169-M199 HydrophobicContact CE2-CB 3.85Å; Y169-K203 HydrophobicContact CE2-CD 4.13Å; Y169-K203 WeakPolarHBondContact OH-CE 3.32Å; Y169-K203 PolarHBondContact OH-NZ 3.29Å
170R79.7Confident73.3Confident78 Ų7862.9 Ų62.929%0.29433%0.325SS..Hα-helixtrans-58.4-47.5174.4-72.3176.8-172.5-154.46.3111.1E166 M167 F172 T173 N174 S179E166-R170 WeakPolarHBondContact O-CB 3.13Å; E166-R170 VanDerWaalsContact O-CG 3.25Å; E166-R170 WeakPolarHBondContact O-CG 3.34Å; E166-R170 PolarHBondContact O-N 2.88Å; E166-R170 IonicContact OE1-CZ 2.67Å; E166-R170 IonicContact OE1-NE 3.23Å; E166-R170 PolarHBondContact OE1-NE 3.43Å; E166-R170 IonicContact OE1-NH2 3.42Å; E166-R170 PolarHBondContact OE1-NH2 3.48Å; M167-R170 PolarHBondContact O-N 3.26Å; R170-F172 PolarHBondContact O-N 2.9Å; R170-T173 PolarHBondContact O-N 3.46Å; R170-N174 WeakPolarHBondContact O-CA 3.42Å; R170-N174 PolarHBondContact O-N 3.01Å; R170-S179 PolarHBondContact NH2-OG 3.45Å
171S77.3Confident72.2Confident54 Ų5463.4 Ų63.438%0.37834%0.336SS..Hα-helixtrans-64.3-28.817877.30000113.3M167 A168 Y169M167-S171 WeakPolarHBondContact O-CB 3.37Å; M167-S171 PolarHBondContact O-N 3.03Å; M167-S171 PolarHBondContact O-OG 3.41Å; A168-S171 PolarHBondContact O-N 3.29Å; A168-S171 PolarHBondContact O-OG 3.21Å; Y169-S171 PolarHBondContact O-N 3.13Å
172F70.8Confident71Confident75 Ų7566.3 Ų66.333%0.32935%0.354SS..Hα-helixtrans-81.3-25.6178.5-169.5-102.7000113L133 L137 A168 Y169 R170 L200 K203L133-F172 HydrophobicContact CD2-CD2 4.22Å; L133-F172 HydrophobicContact CD2-CE2 4.15Å; L137-F172 HydrophobicContact CD2-CB 3.92Å; L137-F172 HydrophobicContact CD2-CD2 3.59Å; L137-F172 HydrophobicContact CD2-CG 4.15Å; A168-F172 WeakPolarHBondContact O-CB 3.33Å; A168-F172 PolarHBondContact O-N 2.68Å; Y169-F172 PolarHBondContact O-N 2.93Å; R170-F172 PolarHBondContact O-N 2.9Å; F172-L200 HydrophobicContact CB-CD1 4.42Å; F172-L200 HydrophobicContact CD1-CD1 4.41Å; F172-L200 HydrophobicContact CG-CD1 4.34Å; F172-K203 HydrophobicContact CE1-CB 3.92Å
173T71.1Confident69.9Low32 Ų3266.6 Ų66.620%0.19636%0.358CS..Hα-helixtrans-116.2-7.4-170.359.60000114.8Y169 R170 A175 K203Y169-T173 HydrophobicContact CD1-CG2 4.25Å; Y169-T173 HydrophobicContact CD2-CG2 4.24Å; Y169-T173 HydrophobicContact CE1-CG2 3.81Å; Y169-T173 WeakPolarHBondContact CE1-OG1 3.42Å; Y169-T173 HydrophobicContact CE2-CG2 3.82Å; Y169-T173 HydrophobicContact CG-CG2 4.46Å; Y169-T173 WeakPolarHBondContact O-CB 3.27Å; Y169-T173 WeakPolarHBondContact O-CG2 3.38Å; Y169-T173 PolarHBondContact O-N 3.48Å; Y169-T173 PolarHBondContact O-OG1 3.27Å; R170-T173 PolarHBondContact O-N 3.46Å; T173-A175 PolarHBondContact O-N 3.46Å; T173-K203 HydrophobicContact CG2-CD 3.79Å
174N66.5Low68.9Low148 Ų14868 Ų6879%0.79138%0.384SS*.  trans52.315.8-170.6-61-30.7000113.9R170R170-N174 WeakPolarHBondContact O-CA 3.42Å; R170-N174 PolarHBondContact O-N 3.01Å
175A58.2Low68.3Low39 Ų3972.8 Ų72.832%0.32241%0.405SS..  trans-91.6124.1-178.300000110.1T173 D177T173-A175 PolarHBondContact O-N 3.46Å; A175-D177 PolarHBondContact O-N 3.34Å
176E56.5Low67.8Low173 Ų17374.6 Ų74.681%0.80842%0.417SS*.  trans-74.1-14175.9-70.4-174.1151.700113.1I178E176-I178 PolarHBondContact O-N 2.9Å
177D51.9Low67.7Low159 Ų15977.4 Ų77.485%0.8543%0.43SS*.THydrogen-bonded Turntrans-88.311-153.1-105.7-14.1000118A175A175-D177 PolarHBondContact O-N 3.34Å
178I57.8Low67.6Low43 Ų4377.4 Ų77.422%0.22143%0.429CS..THydrogen-bonded Turntrans-109.126.7179.6-36.8-171.2000112.7Y169 E176 E180 L196 M199Y169-I178 HydrophobicContact CD1-CD1 3.52Å; Y169-I178 HydrophobicContact CD1-CG1 4.49Å; Y169-I178 HydrophobicContact CE1-CD1 3.2Å; Y169-I178 HydrophobicContact CE1-CG1 4.3Å; E176-I178 PolarHBondContact O-N 2.9Å; I178-E180 PolarHBondContact O-N 2.88Å; I178-L196 HydrophobicContact CD1-CD2 4.42Å; I178-L196 HydrophobicContact CG2-CD2 4.29Å; I178-M199 HydrophobicContact CD1-CE 4.49Å
179S56.2Low67.6Low90 Ų9077.8 Ų77.863%0.62943%0.431SS*.  trans-75.973.1175.6-147.90000111.6R170R170-S179 PolarHBondContact NH2-OG 3.45Å
180E60.2Low68Low98 Ų9876.8 Ų76.846%0.45843%0.427SS..PPolyproline II helixtrans-87.9140.5169.6-73.7-174.6-169.900110.5R162 I178 K192R162-E180 PolarHBondContact NH2-O 3.36Å; I178-E180 PolarHBondContact O-N 2.88Å; E180-K192 VanDerWaalsContact OE2-CE 3.22Å; E180-K192 WeakPolarHBondContact OE2-CE 3.04Å; E180-K192 IonicContact OE2-NZ 2.77Å; E180-K192 PolarHBondContact OE2-NZ 3.03Å
181P64.3Low68.3Low107 Ų10776.9 Ų76.970%0.69543%0.431SS*.PPolyproline II helixtrans-57.4148.4176.822.7-31.6000111.7R162 A183R162-P181 PolarHBondContact NH1-O 3.47Å; R162-P181 PolarHBondContact NH2-O 3.36Å; P181-A183 PolarHBondContact O-N 3.28Å
182V60.8Low68.5Low63 Ų6376.2 Ų76.238%0.38242%0.421SS..PPolyproline II helixtrans-57122.9170.1176.70000107.3E159 K163E159-V182 HydrophobicContact CG-CG1 3.71Å; E159-V182 HydrophobicContact CG-CG2 4.5Å; K163-V182 VanDerWaalsContact CE-CG2 3.42Å
183A61.4Low69.2Low11 Ų1172.6 Ų72.69%0.09141%0.406CS..PPolyproline II helixtrans-75.2142.4178.800000109P181 Q185 E188 N189P181-A183 PolarHBondContact O-N 3.28Å; A183-Q185 PolarHBondContact O-N 2.74Å; A183-E188 HydrophobicContact CB-CB 3.52Å; A183-E188 HydrophobicContact CB-CG 4.41Å; A183-E188 WeakPolarHBondContact CB-OE2 3.19Å; A183-N189 WeakPolarHBondContact CB-OD1 3.23Å; A183-N189 PolarHBondContact N-OD1 3.38Å; A183-N189 PolarHBondContact O-ND2 2.95Å
184A63.4Low69.9Low107 Ų10771.9 Ų71.988%0.88440%0.4SS*.SBendtrans-66-25.9177.100000112.1
185Q72.8Confident70.8Confident117 Ų11772.6 Ų72.655%0.54739%0.391SS..SBendtrans-94.9130.9-177-62.9-167.2-0.400111.8A183 Q187 E188 N189A183-Q185 PolarHBondContact O-N 2.74Å; Q185-Q187 PolarHBondContact O-N 2.85Å; Q185-E188 HydrophobicContact CB-CB 4.47Å; Q185-E188 HydrophobicContact CB-CG 4.18Å; Q185-E188 PolarHBondContact O-N 3.23Å; Q185-N189 PolarHBondContact O-N 3.08Å; Q185-N189 PolarHBondContact O-ND2 3.35Å
186P74Confident71.9Confident39 Ų3971.1 Ų71.125%0.25338%0.378SS..Hα-helixtrans-55.8-36.6176.5-25.633.5000113.1Q155 N189 L190Q155-P186 HydrophobicContact CB-CG 4.42Å; Q155-P186 HydrophobicContact CG-CB 4.23Å; Q155-P186 HydrophobicContact CG-CG 3.7Å; P186-N189 PolarHBondContact O-N 3.39Å; P186-L190 PolarHBondContact O-N 2.91Å
187Q78.6Confident73.2Confident79 Ų7962.9 Ų62.937%0.36934%0.339SS..Hα-helixtrans-67.8-38.4-177.4-163.371.5-34.600112.5Q185 L190 Q191Q185-Q187 PolarHBondContact O-N 2.85Å; Q187-L190 WeakPolarHBondContact O-CB 3.32Å; Q187-L190 PolarHBondContact O-N 3.32Å; Q187-Q191 WeakPolarHBondContact O-CG 3.32Å; Q187-Q191 PolarHBondContact O-N 2.98Å
188E80.7Confident74.7Confident93 Ų9357.5 Ų57.544%0.43531%0.314SS..Hα-helixtrans-65.5-41.4173.7-68.9-177.6-164.200111A183 Q185 L190 Q191 K192A183-E188 HydrophobicContact CB-CB 3.52Å; A183-E188 HydrophobicContact CB-CG 4.41Å; A183-E188 WeakPolarHBondContact CB-OE2 3.19Å; Q185-E188 HydrophobicContact CB-CB 4.47Å; Q185-E188 HydrophobicContact CB-CG 4.18Å; Q185-E188 PolarHBondContact O-N 3.23Å; E188-L190 VanDerWaalsContact C-N 3.31Å; E188-L190 PolarHBondContact O-N 3.36Å; E188-Q191 PolarHBondContact O-N 3.49Å; E188-K192 VanDerWaalsContact O-CG 3.31Å; E188-K192 WeakPolarHBondContact O-CG 3.12Å; E188-K192 PolarHBondContact O-N 3.48Å
189N80.8Confident75.8Confident7 Ų759 Ų594%0.03732%0.322CS..Hα-helixtrans-62.9-38.6175.3-71-37.4000111.7I158 R162 A183 Q185 P186 K192 F193I158-N189 HydrophobicContact CG1-CB 4.2Å; I158-N189 HydrophobicContact CG2-CB 4.11Å; R162-N189 PolarHBondContact NH1-OD1 3.47Å; A183-N189 WeakPolarHBondContact CB-OD1 3.23Å; A183-N189 PolarHBondContact N-OD1 3.38Å; A183-N189 PolarHBondContact O-ND2 2.95Å; Q185-N189 PolarHBondContact O-N 3.08Å; Q185-N189 PolarHBondContact O-ND2 3.35Å; P186-N189 PolarHBondContact O-N 3.39Å; N189-K192 PolarHBondContact O-N 3.43Å; N189-F193 WeakPolarHBondContact O-CB 3.3Å; N189-F193 PolarHBondContact O-N 2.67Å
190L84.6Confident76.9Confident0 Ų054.9 Ų54.90%029%0.292CS..Hα-helixtrans-61.4-48.3174.8179.461.8000111.9L39 F43 I158 P186 Q187 E188 K192 F193 K194L39-L190 HydrophobicContact CB-CD1 4.24Å; L39-L190 HydrophobicContact CD1-CD1 4.26Å; F43-L190 HydrophobicContact CB-CD2 4.29Å; F43-L190 HydrophobicContact CD2-CD1 3.92Å; F43-L190 HydrophobicContact CD2-CD2 3.55Å; F43-L190 HydrophobicContact CD2-CG 4.25Å; F43-L190 HydrophobicContact CE2-CD1 3.74Å; F43-L190 HydrophobicContact CE2-CD2 4.21Å; F43-L190 HydrophobicContact CE2-CG 4.43Å; F43-L190 HydrophobicContact CG-CD2 4.07Å; I158-L190 HydrophobicContact CD1-CD1 4.01Å; I158-L190 HydrophobicContact CG1-CB 4.32Å; P186-L190 PolarHBondContact O-N 2.91Å; Q187-L190 WeakPolarHBondContact O-CB 3.32Å; Q187-L190 PolarHBondContact O-N 3.32Å; E188-L190 VanDerWaalsContact C-N 3.31Å; E188-L190 PolarHBondContact O-N 3.36Å; L190-K192 VanDerWaalsContact C-N 3.32Å; L190-K192 PolarHBondContact O-N 3.44Å; L190-F193 PolarHBondContact O-N 3.23Å; L190-K194 HydrophobicContact CD1-CD 4.47Å; L190-K194 HydrophobicContact CD1-CG 4.38Å; L190-K194 HydrophobicContact CG-CD 4.31Å; L190-K194 VanDerWaalsContact O-CG 3.31Å; L190-K194 WeakPolarHBondContact O-CG 3.22Å; L190-K194 PolarHBondContact O-N 3.28Å
191Q85.7Confident77.8Confident80 Ų8050.5 Ų50.537%0.37427%0.272SS..Hα-helixtrans-62.6-40.7179.3-66.8-59.9-23.900111.9Q187 E188 K194 R195Q187-Q191 WeakPolarHBondContact O-CG 3.32Å; Q187-Q191 PolarHBondContact O-N 2.98Å; E188-Q191 PolarHBondContact O-N 3.49Å; Q191-K194 PolarHBondContact O-N 3.06Å; Q191-R195 WeakPolarHBondContact O-CG 3.44Å; Q191-R195 PolarHBondContact O-N 2.88Å
192K82.5Confident78.4Confident40 Ų4047.4 Ų47.417%0.17426%0.259CS..Hα-helixtrans-65.8-43176.1-68.9178.9-171.4-154.50111.9E180 E188 N189 L190 K194 R195 L196E180-K192 VanDerWaalsContact OE2-CE 3.22Å; E180-K192 WeakPolarHBondContact OE2-CE 3.04Å; E180-K192 IonicContact OE2-NZ 2.77Å; E180-K192 PolarHBondContact OE2-NZ 3.03Å; E188-K192 VanDerWaalsContact O-CG 3.31Å; E188-K192 WeakPolarHBondContact O-CG 3.12Å; E188-K192 PolarHBondContact O-N 3.48Å; N189-K192 PolarHBondContact O-N 3.43Å; L190-K192 VanDerWaalsContact C-N 3.32Å; L190-K192 PolarHBondContact O-N 3.44Å; K192-K194 PolarHBondContact O-N 3.32Å; K192-R195 PolarHBondContact O-N 3Å; K192-L196 WeakPolarHBondContact O-CG 3.3Å; K192-L196 PolarHBondContact O-N 3.06Å
193F85Confident79.1Confident0 Ų048.7 Ų48.70%026%0.259CS..Hα-helixtrans-58.2-47.8173.7172.3-95.3000111.5Y35 L39 L145 I158 A161 M165 N189 L190 R195 L196 F197Y35-F193 HydrophobicContact CE1-CE1 4.18Å; L39-F193 HydrophobicContact CD1-CD1 4.43Å; L39-F193 HydrophobicContact CD1-CE1 4.04Å; L145-F193 HydrophobicContact CD2-CZ 4.04Å; I158-F193 HydrophobicContact CD1-CB 3.78Å; I158-F193 HydrophobicContact CD1-CD1 4.03Å; I158-F193 HydrophobicContact CD1-CD2 4.37Å; I158-F193 HydrophobicContact CD1-CG 3.81Å; A161-F193 HydrophobicContact CB-CD2 4.03Å; A161-F193 HydrophobicContact CB-CE2 3.86Å; M165-F193 HydrophobicContact CB-CD2 4.34Å; M165-F193 HydrophobicContact CB-CE2 4.45Å; M165-F193 HydrophobicContact CE-CE2 3.99Å; M165-F193 HydrophobicContact CE-CZ 4.2Å; M165-F193 HydrophobicContact CG-CD2 3.8Å; M165-F193 HydrophobicContact CG-CE2 3.45Å; M165-F193 VanDerWaalsContact CG-CE2 3.45Å; M165-F193 HydrophobicContact CG-CZ 4.47Å; N189-F193 WeakPolarHBondContact O-CB 3.3Å; N189-F193 PolarHBondContact O-N 2.67Å; L190-F193 PolarHBondContact O-N 3.23Å; F193-R195 VanDerWaalsContact C-N 3.34Å; F193-R195 PolarHBondContact O-N 2.92Å; F193-L196 PolarHBondContact O-N 3.12Å; F193-F197 VanDerWaalsContact O-CB 3.29Å; F193-F197 WeakPolarHBondContact O-CB 3.2Å; F193-F197 PolarHBondContact O-N 2.89Å
194K86.1Confident79.5Confident16 Ų1648.4 Ų48.47%0.0726%0.257CS..Hα-helixtrans-57.7-45.4176.9-72.3178.3169.7-169.40112.1F36 D40 L190 Q191 K192 F197 S198F36-K194 HydrophobicContact CB-CD 4.34Å; F36-K194 HydrophobicContact CD1-CB 4.43Å; F36-K194 HydrophobicContact CD1-CD 4.23Å; F36-K194 HydrophobicContact CD1-CG 3.75Å; F36-K194 HydrophobicContact CE1-CB 4.07Å; F36-K194 HydrophobicContact CE1-CG 3.8Å; F36-K194 HydrophobicContact CE2-CB 4.35Å; F36-K194 HydrophobicContact CG-CD 4.15Å; F36-K194 HydrophobicContact CG-CG 4.12Å; F36-K194 HydrophobicContact CZ-CB 4.01Å; F36-K194 HydrophobicContact CZ-CG 4.22Å; F36-K194 PolarHBondContact O-NZ 3.17Å; D40-K194 IonicContact OD1-NZ 2.7Å; D40-K194 PolarHBondContact OD1-NZ 3.3Å; D40-K194 IonicContact OD2-NZ 3.87Å; D40-K194 PolarHBondContact OD2-NZ 3.05Å; L190-K194 HydrophobicContact CD1-CD 4.47Å; L190-K194 HydrophobicContact CD1-CG 4.38Å; L190-K194 HydrophobicContact CG-CD 4.31Å; L190-K194 VanDerWaalsContact O-CG 3.31Å; L190-K194 WeakPolarHBondContact O-CG 3.22Å; L190-K194 PolarHBondContact O-N 3.28Å; Q191-K194 PolarHBondContact O-N 3.06Å; K192-K194 PolarHBondContact O-N 3.32Å; K194-F197 PolarHBondContact O-N 3.31Å; K194-S198 WeakPolarHBondContact O-CB 3.12Å; K194-S198 PolarHBondContact O-N 2.91Å; K194-S198 PolarHBondContact O-OG 3.3Å
195R84.7Confident79.8Confident163 Ų16345.6 Ų45.662%0.61523%0.227SC*.Hα-helixtrans-60.4-50176.3-72.1175-173.8178.52.1111.8Q191 K192 F193 F197 S198 M199Q191-R195 WeakPolarHBondContact O-CG 3.44Å; Q191-R195 PolarHBondContact O-N 2.88Å; K192-R195 PolarHBondContact O-N 3Å; F193-R195 VanDerWaalsContact C-N 3.34Å; F193-R195 PolarHBondContact O-N 2.92Å; R195-F197 VanDerWaalsContact C-N 3.3Å; R195-F197 PolarHBondContact O-N 3.41Å; R195-S198 PolarHBondContact O-N 3.35Å; R195-M199 WeakPolarHBondContact O-CB 3.46Å; R195-M199 VanDerWaalsContact O-CG 3.31Å; R195-M199 WeakPolarHBondContact O-CG 3.42Å; R195-M199 PolarHBondContact O-N 2.88Å
196L82.1Confident79.6Confident8 Ų842.7 Ų42.74%0.04222%0.223CC..Hα-helixtrans-59.2-43177.9-73.9167.7000111.4R162 M165 E166 Y169 I178 K192 F193 M199 L200R162-L196 HydrophobicContact CG-CD1 4.33Å; M165-L196 HydrophobicContact CB-CB 4.43Å; M165-L196 HydrophobicContact CB-CD1 4.49Å; E166-L196 HydrophobicContact CB-CD1 4.12Å; Y169-L196 HydrophobicContact CG-CD2 4.4Å; I178-L196 HydrophobicContact CD1-CD2 4.42Å; I178-L196 HydrophobicContact CG2-CD2 4.29Å; K192-L196 WeakPolarHBondContact O-CG 3.3Å; K192-L196 PolarHBondContact O-N 3.06Å; F193-L196 PolarHBondContact O-N 3.12Å; L196-M199 HydrophobicContact CD2-CE 3.94Å; L196-M199 HydrophobicContact CG-CE 4.46Å; L196-M199 PolarHBondContact O-N 3.33Å; L196-L200 WeakPolarHBondContact O-CB 3.3Å; L196-L200 PolarHBondContact O-N 3.06Å
197F82.7Confident79Confident0 Ų042.8 Ų42.80%023%0.232CC..Hα-helixtrans-65.5-45.8179-168.3-111.1000112.4P32 Y35 F36 L123 M165 F193 K194 R195 M199 L200 I201P32-F197 HydrophobicContact CB-CD1 4.21Å; P32-F197 HydrophobicContact CB-CE1 4.09Å; Y35-F197 HydrophobicContact CD1-CE1 4.19Å; Y35-F197 HydrophobicContact CE1-CE1 4.39Å; F36-F197 HydrophobicContact CE1-CB 4.44Å; F36-F197 AromaticContact CE1-CD1 3.67Å; F36-F197 HydrophobicContact CE1-CD1 3.67Å; F36-F197 HydrophobicContact CE1-CE1 4.47Å; F36-F197 HydrophobicContact CE1-CG 4.46Å; F36-F197 HydrophobicContact CZ-CB 4.42Å; F36-F197 AromaticContact CZ-CD1 3.84Å; F36-F197 HydrophobicContact CZ-CD1 3.84Å; L123-F197 HydrophobicContact CD1-CE1 4.49Å; L123-F197 HydrophobicContact CD1-CZ 4.24Å; L123-F197 HydrophobicContact CD2-CE1 3.6Å; L123-F197 HydrophobicContact CD2-CE2 4.34Å; L123-F197 HydrophobicContact CD2-CZ 3.32Å; L123-F197 HydrophobicContact CG-CE1 4.32Å; L123-F197 HydrophobicContact CG-CZ 3.76Å; M165-F197 HydrophobicContact CE-CD2 3.33Å; M165-F197 HydrophobicContact CE-CE2 3.67Å; M165-F197 HydrophobicContact CE-CG 4.48Å; M165-F197 HydrophobicContact SD-CD2 4.23Å; F193-F197 VanDerWaalsContact O-CB 3.29Å; F193-F197 WeakPolarHBondContact O-CB 3.2Å; F193-F197 PolarHBondContact O-N 2.89Å; K194-F197 PolarHBondContact O-N 3.31Å; R195-F197 VanDerWaalsContact C-N 3.3Å; R195-F197 PolarHBondContact O-N 3.41Å; F197-M199 VanDerWaalsContact C-N 3.34Å; F197-M199 PolarHBondContact O-N 2.96Å; F197-L200 PolarHBondContact O-N 3.33Å; F197-I201 HydrophobicContact CD1-CD1 3.61Å; F197-I201 HydrophobicContact CE1-CD1 3.15Å; F197-I201 HydrophobicContact CE1-CG1 4.24Å; F197-I201 HydrophobicContact CE2-CD1 4.31Å; F197-I201 HydrophobicContact CG-CD1 4.36Å; F197-I201 HydrophobicContact CZ-CD1 3.55Å; F197-I201 HydrophobicContact CZ-CG1 4.27Å; F197-I201 WeakPolarHBondContact O-CG1 3.43Å; F197-I201 PolarHBondContact O-N 3.22Å
198S84.6Confident77.8Confident47 Ų4743.2 Ų43.233%0.32924%0.236SC..Hα-helixtrans-61.7-40.3174-69.40000112.4F36 K194 R195 I201 G202F36-S198 VanDerWaalsContact CE2-OG 3.27Å; F36-S198 WeakPolarHBondContact CE2-OG 3.48Å; F36-S198 WeakPolarHBondContact CZ-OG 3.29Å; K194-S198 WeakPolarHBondContact O-CB 3.12Å; K194-S198 PolarHBondContact O-N 2.91Å; K194-S198 PolarHBondContact O-OG 3.3Å; R195-S198 PolarHBondContact O-N 3.35Å; S198-I201 PolarHBondContact O-N 2.81Å; S198-G202 PolarHBondContact O-N 2.82Å
199M81.5Confident76.5Confident75 Ų7546.7 Ų46.737%0.36925%0.25SS..Hα-helixtrans-65.3-39.5176-74.2-171.1-68.200111.8Y169 I178 R195 L196 F197 G202 K203Y169-M199 HydrophobicContact CD2-CB 4.41Å; Y169-M199 HydrophobicContact CE2-CB 3.85Å; I178-M199 HydrophobicContact CD1-CE 4.49Å; R195-M199 WeakPolarHBondContact O-CB 3.46Å; R195-M199 VanDerWaalsContact O-CG 3.31Å; R195-M199 WeakPolarHBondContact O-CG 3.42Å; R195-M199 PolarHBondContact O-N 2.88Å; L196-M199 HydrophobicContact CD2-CE 3.94Å; L196-M199 HydrophobicContact CG-CE 4.46Å; L196-M199 PolarHBondContact O-N 3.33Å; F197-M199 VanDerWaalsContact C-N 3.34Å; F197-M199 PolarHBondContact O-N 2.96Å; M199-G202 PolarHBondContact O-N 3.22Å; M199-K203 WeakPolarHBondContact O-CB 3.42Å; M199-K203 PolarHBondContact O-N 3.42Å
200L78.8Confident74.9Confident3 Ų355.1 Ų55.12%0.01629%0.287CS..Hα-helixtrans-62.8-50.6175.7-172.571.2000110.9V141 M165 F172 L196 F197 G202 K203 A204V141-L200 HydrophobicContact CG2-CD2 4.01Å; M165-L200 HydrophobicContact SD-CD2 4.24Å; F172-L200 HydrophobicContact CB-CD1 4.42Å; F172-L200 HydrophobicContact CD1-CD1 4.41Å; F172-L200 HydrophobicContact CG-CD1 4.34Å; L196-L200 WeakPolarHBondContact O-CB 3.3Å; L196-L200 PolarHBondContact O-N 3.06Å; F197-L200 PolarHBondContact O-N 3.33Å; L200-G202 PolarHBondContact O-N 3.46Å; L200-K203 PolarHBondContact O-N 3Å; L200-A204 WeakPolarHBondContact O-CB 3.31Å; L200-A204 PolarHBondContact O-N 3.36Å
201I78.8Confident73.2Confident6 Ų660.6 Ų60.63%0.03132%0.32CS..Hα-helixtrans-62-43.7176.9-68168.5000111I30 P32 L127 F197 S198 A204 N205I30-I201 HydrophobicContact CG2-CD1 4.24Å; P32-I201 HydrophobicContact CB-CD1 3.95Å; P32-I201 HydrophobicContact CG-CD1 4.27Å; L127-I201 HydrophobicContact CD1-CG1 4.02Å; F197-I201 HydrophobicContact CD1-CD1 3.61Å; F197-I201 HydrophobicContact CE1-CD1 3.15Å; F197-I201 HydrophobicContact CE1-CG1 4.24Å; F197-I201 HydrophobicContact CE2-CD1 4.31Å; F197-I201 HydrophobicContact CG-CD1 4.36Å; F197-I201 HydrophobicContact CZ-CD1 3.55Å; F197-I201 HydrophobicContact CZ-CG1 4.27Å; F197-I201 WeakPolarHBondContact O-CG1 3.43Å; F197-I201 PolarHBondContact O-N 3.22Å; S198-I201 PolarHBondContact O-N 2.81Å; I201-A204 PolarHBondContact O-N 3.44Å; I201-N205 WeakPolarHBondContact CG2-ND2 3.43Å; I201-N205 WeakPolarHBondContact O-CB 3.29Å; I201-N205 VanDerWaalsContact O-CG 3.3Å; I201-N205 PolarHBondContact O-N 3.41Å; I201-N205 PolarHBondContact O-ND2 2.89Å
202G77.3Confident71.2Confident41 Ų4163.6 Ų63.642%0.42334%0.338SS..Hα-helixtrans-60.8-47.6-179.500000112.5S198 M199 L200 A204 A206S198-G202 PolarHBondContact O-N 2.82Å; M199-G202 PolarHBondContact O-N 3.22Å; L200-G202 PolarHBondContact O-N 3.46Å; G202-A204 VanDerWaalsContact C-N 3.34Å; G202-A206 WeakPolarHBondContact O-CB 3.28Å; G202-A206 PolarHBondContact O-N 2.87Å
203K74Confident68.8Low90 Ų9068.4 Ų68.439%0.39137%0.366SS..Hα-helixtrans-65.7-38.5175.4-76.2-169.3168.8-179.40112.1Y169 F172 T173 M199 L200 A206 G207Y169-K203 HydrophobicContact CE2-CD 4.13Å; Y169-K203 WeakPolarHBondContact OH-CE 3.32Å; Y169-K203 PolarHBondContact OH-NZ 3.29Å; F172-K203 HydrophobicContact CE1-CB 3.92Å; T173-K203 HydrophobicContact CG2-CD 3.79Å; M199-K203 WeakPolarHBondContact O-CB 3.42Å; M199-K203 PolarHBondContact O-N 3.42Å; L200-K203 PolarHBondContact O-N 3Å; K203-A206 PolarHBondContact O-N 3.25Å; K203-G207 PolarHBondContact O-N 2.85Å
204A69.8Low66.6Low5 Ų573.5 Ų73.54%0.04140%0.399CS..Hα-helixtrans-66.9-40.8179.800000112.7I131 L200 I201 G202 G207 N208I131-A204 HydrophobicContact CB-CB 4.19Å; I131-A204 HydrophobicContact CD1-CB 3.25Å; I131-A204 HydrophobicContact CG1-CB 3.56Å; I131-A204 HydrophobicContact CG2-CB 3.62Å; L200-A204 WeakPolarHBondContact O-CB 3.31Å; L200-A204 PolarHBondContact O-N 3.36Å; I201-A204 PolarHBondContact O-N 3.44Å; G202-A204 VanDerWaalsContact C-N 3.34Å; A204-G207 PolarHBondContact O-N 2.77Å; A204-N208 PolarHBondContact O-N 3.03Å; A204-N208 VanDerWaalsContact O-N 3.13Å
205N70.3Confident64.3Low48 Ų4876.1 Ų76.126%0.25743%0.43SS..Hα-helixtrans-66-37.2172.7-72.7-19000112.1I201 G207 N208 K209I201-N205 WeakPolarHBondContact CG2-ND2 3.43Å; I201-N205 WeakPolarHBondContact O-CB 3.29Å; I201-N205 VanDerWaalsContact O-CG 3.3Å; I201-N205 PolarHBondContact O-N 3.41Å; I201-N205 PolarHBondContact O-ND2 2.89Å; N205-G207 VanDerWaalsContact C-N 3.33Å; N205-N208 PolarHBondContact O-N 2.88Å; N205-K209 PolarHBondContact O-N 3.06Å
206A69.1Low61.8Low56 Ų5675.6 Ų75.646%0.46344%0.44SS..Hα-helixtrans-66.1-35.5174.400000112.3G202 K203 N208G202-A206 WeakPolarHBondContact O-CB 3.28Å; G202-A206 PolarHBondContact O-N 2.87Å; K203-A206 PolarHBondContact O-N 3.25Å; A206-N208 VanDerWaalsContact C-N 3.34Å
207G60.4Low59.9Low42 Ų4281 Ų8143%0.43348%0.475SS..Hα-helixtrans-62.7-39.3172.300000112.6K203 A204 N205 K210K203-G207 PolarHBondContact O-N 2.85Å; A204-G207 PolarHBondContact O-N 2.77Å; N205-G207 VanDerWaalsContact C-N 3.33Å; G207-K210 PolarHBondContact O-N 3.19Å
208N55.1Low57.9Low87 Ų8785.4 Ų85.447%0.46551%0.512SS..Hα-helixtrans-68.2-39179.8-14214.5000112.3S130 A204 N205 A206 K210 V211S130-N208 PolarHBondContact O-ND2 3.18Å; A204-N208 PolarHBondContact O-N 3.03Å; A204-N208 VanDerWaalsContact O-N 3.13Å; N205-N208 PolarHBondContact O-N 2.88Å; A206-N208 VanDerWaalsContact C-N 3.34Å; N208-K210 PolarHBondContact O-N 3.21Å; N208-V211 PolarHBondContact O-N 3.49Å; N208-V211 VanDerWaalsContact O-N 3.08Å
209K53.3Low55.6Low167 Ų16791.7 Ų91.773%0.72654%0.536SS*.Hα-helixtrans-61.8-26.6176.1-74.8-171.6178.4-174.90114.2N205 V211 D212N205-K209 PolarHBondContact O-N 3.06Å; K209-V211 VanDerWaalsContact C-N 3.27Å; K209-V211 PolarHBondContact O-N 3.42Å; K209-D212 PolarHBondContact O-N 2.85Å
210K46.9Very low53.4Low184 Ų18497.1 Ų97.180%0.856%0.56SS**THydrogen-bonded Turntrans-72.3-21.3176.6-74.6-170.1-178.6-173.70113.1G207 N208G207-K210 PolarHBondContact O-N 3.19Å; N208-K210 PolarHBondContact O-N 3.21Å
211V48.1Very low51.3Low115 Ų115101.5 Ų101.570%0.69759%0.591SS**THydrogen-bonded Turntrans-83.2-28.2177.4-1780000111.1N208 K209 N213N208-V211 PolarHBondContact O-N 3.49Å; N208-V211 VanDerWaalsContact O-N 3.08Å; K209-V211 VanDerWaalsContact C-N 3.27Å; K209-V211 PolarHBondContact O-N 3.42Å; V211-N213 VanDerWaalsContact C-N 3.29Å; V211-N213 PolarHBondContact O-N 2.87Å
212D43.2Very low49.6Very low143 Ų143107.3 Ų107.377%0.76563%0.629SS**SBendtrans-85.48.6-175.6-117.65.3000114.8K209 P214K209-D212 PolarHBondContact O-N 2.85Å; D212-P214 WeakPolarHBondContact O-CD 3.04Å
213N33.5Very low47.8Very low141 Ų141108.7 Ų108.775%0.75464%0.643SS**  trans-110.869.1170.3-145.836.6000109.7V211 G215V211-N213 VanDerWaalsContact C-N 3.29Å; V211-N213 PolarHBondContact O-N 2.87Å; N213-G215 PolarHBondContact O-N 2.72Å
214P38.9Very low46.3Very low106 Ų106113.6 Ų113.669%0.68867%0.668SS**  trans-65.2120169.628.3-29.8000107.4D212D212-P214 WeakPolarHBondContact O-CD 3.04Å
215G36.4Very low44.9Very low71 Ų71124.9 Ų124.973%0.73271%0.709SS**  trans-50145.4-175.700000113.3N213N213-G215 PolarHBondContact O-N 2.72Å
216D33.8Very low43.6Very low153 Ų153127.2 Ų127.282%0.81873%0.729SS**  trans-33.8138173.3-78.9-57.8000113.5A218D216-A218 PolarHBondContact O-N 3.02Å
217P42.1Very low42Very low120 Ų120131 Ų13178%0.77975%0.751SS**  trans-63.3105.2176.427.5-31.4000108.5H219P217-H219 PolarHBondContact O-N 3.14Å
218A40.5Very low41.1Very low93 Ų93134.5 Ų134.577%0.76977%0.768SS**  trans-55.2115.8169.500000108.2D216 E220D216-A218 PolarHBondContact O-N 3.02Å; A218-E220 PolarHBondContact O-N 2.89Å
219H35.9Very low41Very low179 Ų179140 Ų14083%0.82981%0.814SS**  trans-45.593.8165.8-91.7-98.1000111.2P217 S221P217-H219 PolarHBondContact O-N 3.14Å; H219-S221 VanDerWaalsContact C-N 3.32Å; H219-S221 PolarHBondContact O-N 3.19Å
220E35.3Very low40.4Very low190 Ų190138.7 Ų138.789%0.88882%0.818SS**  trans-82.387.7155.6-87.6-170.8149.200107.9A218A218-E220 PolarHBondContact O-N 2.89Å
221S35.1Very low40.1Very low94 Ų94136.3 Ų136.366%0.65782%0.819SS**  trans-63.8125.4164.8-68.70000108.7H219 G223H219-S221 VanDerWaalsContact C-N 3.32Å; H219-S221 PolarHBondContact O-N 3.19Å; S221-G223 PolarHBondContact O-N 3.32Å
222P42.2Very low39.6Very low128 Ų128137.4 Ų137.483%0.83183%0.826SS**  trans-69.2103.1174.112.4-6.8000109Q224P222-Q224 PolarHBondContact O-N 2.97Å
223G40.1Very low39.4Very low70 Ų70137.1 Ų137.172%0.72283%0.829SS**  trans-59.7122.1173.800000111.1S221 R225S221-G223 PolarHBondContact O-N 3.32Å; G223-R225 PolarHBondContact O-N 3.24Å
224Q41.4Very low39.8Very low194 Ų194136.9 Ų136.991%0.90783%0.834SS**  trans-47.7117.4167.2-65.8171.7-51.600110.7P222P222-Q224 PolarHBondContact O-N 2.97Å
225R40.7Very low39.8Very low242 Ų242138.9 Ų138.991%0.91384%0.844SS**  trans-102.687.2157.7-79.8-171.1-176.9-171.52.6108.7G223G223-R225 PolarHBondContact O-N 3.24Å
226S43.2Very low40.1Very low97 Ų97143.8 Ų143.868%0.67885%0.852SS**  trans8.8118.1142.747.90000117.8
227C35.1Very low40.6Very low136 Ų136143.1 Ų143.192%0.91985%0.854SS**  trans-50.8129.1154.3-57.70000110.9
228S43.1Very low40.4Very low114 Ų114145 Ų14580%0.79786%0.861SS**  trans-119132.6159.7-65.30000107.4
229S52.7Low40.4Very low203 Ų203149.7 Ų149.7100%1.4287%0.869SS**  trans-44.40-171.4-60.10000117.5

Retrieved 229 of 229 residues in 134.1 ms (Link to these results)

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