A0A060X4Q3_ONCMY Loading...

Homeobox protein Hox-D4

Sequence-specific transcription factor which is part of a developmental regulatory system that provides cells with specific positional identities on the anterior-posterior axis.

AlphaFold DB , UniProt , Accession A0A060X4Q3, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 256 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M40.5Very low50.6Low250 Ų250134.3 Ų134.3100%1.23270%0.703SS**  078.10-71.6173166.400109.1
2E44.4Very low51.5Low187 Ų187130.8 Ų130.887%0.87468%0.684SS**  trans-136.698.6-178.9-111.4-73.6150.500106.8
3G47.3Very low52.6Low78 Ų78126.1 Ų126.180%0.80467%0.668SS**  trans173.674.2-174.300000112.6
4G50.7Low53.4Low55 Ų55124.4 Ų124.457%0.56766%0.658SS**  trans-163.1-3.1174.800000117
5K54.1Low54.3Low184 Ų184126.4 Ų126.480%0.866%0.659SS**SBendtrans-93.9-18.5-177.2-83.8170-178.21500114.7
6K49.5Very low55.1Low161 Ų161128.5 Ų128.570%0.766%0.657SS**Hα-helixtrans-79.1-24.6-176-64.4-178.8-177.7175.70112.6R10K6-R10 WeakPolarHBondContact O-CG 3.46Å
7D55.9Low55.7Low79 Ų79126.2 Ų126.242%0.42265%0.646SS.*Hα-helixtrans-81-32-172.7-52.9-41.7000113R10 K11D7-R10 PolarHBondContact O-N 3.48Å; D7-K11 VanDerWaalsContact O-CB 3.32Å; D7-K11 WeakPolarHBondContact O-CB 3.34Å; D7-K11 WeakPolarHBondContact O-CG 3.3Å; D7-K11 PolarHBondContact O-N 3.34Å
8N52.1Low55.9Low103 Ų103125.7 Ų125.755%0.55164%0.64SS**Hα-helixtrans-74.4-33.2-175.9-148.22.9000112.3K11 I12N8-K11 PolarHBondContact O-N 3.23Å; N8-I12 WeakPolarHBondContact O-CB 3.35Å; N8-I12 WeakPolarHBondContact O-CD1 3.15Å; N8-I12 VanDerWaalsContact O-CG1 3.28Å; N8-I12 WeakPolarHBondContact O-CG1 3.4Å; N8-I12 PolarHBondContact O-N 3.37Å
9S49.2Very low56.2Low88 Ų88126.4 Ų126.462%0.61564%0.639SS**Hα-helixtrans-72.1-36.4175.3-1530000111.8C13S9-C13 WeakPolarHBondContact O-CB 3.36Å; S9-C13 PolarHBondContact O-N 3.23Å
10R56.9Low56.8Low168 Ų168126.3 Ų126.363%0.63464%0.639SS**Hα-helixtrans-65.7-45.4171.1-71.1176177.2169.6-4.6110.7K6 D7 I12 C13 I14K6-R10 WeakPolarHBondContact O-CG 3.46Å; D7-R10 PolarHBondContact O-N 3.48Å; R10-I12 PolarHBondContact O-N 3.26Å; R10-C13 PolarHBondContact O-N 3.31Å; R10-I14 WeakPolarHBondContact O-CB 3.39Å; R10-I14 WeakPolarHBondContact O-CG1 3.5Å; R10-I14 PolarHBondContact O-N 3.39Å
11K55.9Low57.3Low124 Ų124126.7 Ų126.754%0.53964%0.64SS.*Hα-helixtrans-57.8-48.8175.4-74.1169.6-175.3-175.60111.9D7 N8 C13 I14 F15D7-K11 VanDerWaalsContact O-CB 3.32Å; D7-K11 WeakPolarHBondContact O-CB 3.34Å; D7-K11 WeakPolarHBondContact O-CG 3.3Å; D7-K11 PolarHBondContact O-N 3.34Å; N8-K11 PolarHBondContact O-N 3.23Å; K11-C13 PolarHBondContact O-N 3.18Å; K11-I14 PolarHBondContact O-N 3.49Å; K11-F15 HydrophobicContact CB-CD2 4.46Å; K11-F15 HydrophobicContact CB-CE2 4.5Å; K11-F15 WeakPolarHBondContact O-CB 3.44Å; K11-F15 WeakPolarHBondContact O-CD2 3.17Å; K11-F15 PolarHBondContact O-N 3.01Å
12I62Low58.2Low92 Ų92118 Ų11847%0.47260%0.601SS.*Hα-helixtrans-62.9-40.5178.1-69.8159.2000111.7N8 R10 F15 Y16N8-I12 WeakPolarHBondContact O-CB 3.35Å; N8-I12 WeakPolarHBondContact O-CD1 3.15Å; N8-I12 VanDerWaalsContact O-CG1 3.28Å; N8-I12 WeakPolarHBondContact O-CG1 3.4Å; N8-I12 PolarHBondContact O-N 3.37Å; R10-I12 PolarHBondContact O-N 3.26Å; I12-F15 PolarHBondContact O-N 3.12Å; I12-Y16 HydrophobicContact CG2-CD2 4.2Å; I12-Y16 HydrophobicContact CG2-CE2 4.47Å; I12-Y16 WeakPolarHBondContact O-CD2 3.32Å; I12-Y16 PolarHBondContact O-N 3.12Å
13C65.1Low58.8Low70 Ų70114.3 Ų114.347%0.47359%0.586SS.*Hα-helixtrans-65.7-43.5176.7-156.70000111.6S9 R10 K11 Y16 L17S9-C13 WeakPolarHBondContact O-CB 3.36Å; S9-C13 PolarHBondContact O-N 3.23Å; R10-C13 PolarHBondContact O-N 3.31Å; K11-C13 PolarHBondContact O-N 3.18Å; C13-Y16 PolarHBondContact O-N 3.2Å; C13-L17 WeakPolarHBondContact O-CB 3.44Å; C13-L17 VanDerWaalsContact O-CG 3.31Å; C13-L17 WeakPolarHBondContact O-CG 3.49Å; C13-L17 PolarHBondContact O-N 3.16Å
14I64.8Low59.1Low103 Ų103114 Ų11453%0.52857%0.571SS.*Hα-helixtrans-64.5-42.6175.9-66.7-69.1000111R10 K11 Y16 L17 Q18R10-I14 WeakPolarHBondContact O-CB 3.39Å; R10-I14 WeakPolarHBondContact O-CG1 3.5Å; R10-I14 PolarHBondContact O-N 3.39Å; K11-I14 PolarHBondContact O-N 3.49Å; I14-Y16 VanDerWaalsContact C-N 3.32Å; I14-Y16 PolarHBondContact O-N 3.09Å; I14-L17 PolarHBondContact O-N 3.35Å; I14-Q18 WeakPolarHBondContact O-CB 3.46Å; I14-Q18 PolarHBondContact O-N 3.21Å
15F66.2Low59Low154 Ų154114.8 Ų114.868%0.67557%0.568SS**Hα-helixtrans-60.6-40.4174.7-86.9-67.7000112.4K11 I12 K19K11-F15 HydrophobicContact CB-CD2 4.46Å; K11-F15 HydrophobicContact CB-CE2 4.5Å; K11-F15 WeakPolarHBondContact O-CB 3.44Å; K11-F15 WeakPolarHBondContact O-CD2 3.17Å; K11-F15 PolarHBondContact O-N 3.01Å; I12-F15 PolarHBondContact O-N 3.12Å; F15-K19 VanDerWaalsContact O-CB 3.24Å; F15-K19 WeakPolarHBondContact O-CB 3.44Å; F15-K19 PolarHBondContact O-N 3.21Å; F15-K19 VanDerWaalsContact O-N 3.09Å
16Y67.6Low59.1Low160 Ų160113 Ų11363%0.62756%0.56SS**Hα-helixtrans-70.6-43176.9-97.2-92.3000112.4I12 C13 I14 K19 L20I12-Y16 HydrophobicContact CG2-CD2 4.2Å; I12-Y16 HydrophobicContact CG2-CE2 4.47Å; I12-Y16 WeakPolarHBondContact O-CD2 3.32Å; I12-Y16 PolarHBondContact O-N 3.12Å; C13-Y16 PolarHBondContact O-N 3.2Å; I14-Y16 VanDerWaalsContact C-N 3.32Å; I14-Y16 PolarHBondContact O-N 3.09Å; Y16-K19 PolarHBondContact O-N 3.09Å; Y16-L20 WeakPolarHBondContact O-CB 3.34Å; Y16-L20 PolarHBondContact O-N 3Å
17L64.1Low59.6Low89 Ų89113.2 Ų113.247%0.46657%0.566SS.*Hα-helixtrans-69.2-41.3179-72.1169.4000112.1C13 I14 K19 L20 M21C13-L17 WeakPolarHBondContact O-CB 3.44Å; C13-L17 VanDerWaalsContact O-CG 3.31Å; C13-L17 WeakPolarHBondContact O-CG 3.49Å; C13-L17 PolarHBondContact O-N 3.16Å; I14-L17 PolarHBondContact O-N 3.35Å; L17-K19 VanDerWaalsContact C-N 3.35Å; L17-K19 PolarHBondContact O-N 2.99Å; L17-L20 PolarHBondContact O-N 2.79Å; L17-M21 WeakPolarHBondContact O-CB 3.5Å; L17-M21 WeakPolarHBondContact O-CG 3.45Å; L17-M21 PolarHBondContact O-N 2.74Å
18Q59.6Low59.9Low117 Ų117115 Ų11555%0.54758%0.579SS.*Hα-helixtrans-59.9-46.1173.2-171.387.770.600110.5I14 L20 M21 T22I14-Q18 WeakPolarHBondContact O-CB 3.46Å; I14-Q18 PolarHBondContact O-N 3.21Å; Q18-L20 VanDerWaalsContact C-N 3.32Å; Q18-L20 PolarHBondContact O-N 3.26Å; Q18-M21 PolarHBondContact O-N 3.21Å; Q18-T22 WeakPolarHBondContact O-CG2 3.37Å; Q18-T22 PolarHBondContact O-N 3.37Å; Q18-T22 PolarHBondContact O-OG1 3.32Å
19K62.6Low59.9Low140 Ų140117.2 Ų117.261%0.60959%0.591SS**Hα-helixtrans-65.6-34.7177.1-165.9178.7-178.4-178.10112F15 Y16 L17 T22 M23F15-K19 VanDerWaalsContact O-CB 3.24Å; F15-K19 WeakPolarHBondContact O-CB 3.44Å; F15-K19 PolarHBondContact O-N 3.21Å; F15-K19 VanDerWaalsContact O-N 3.09Å; Y16-K19 PolarHBondContact O-N 3.09Å; L17-K19 VanDerWaalsContact C-N 3.35Å; L17-K19 PolarHBondContact O-N 2.99Å; K19-T22 WeakPolarHBondContact CA-OG1 3.34Å; K19-T22 PolarHBondContact O-OG1 3.26Å; K19-M23 HydrophobicContact CG-CG 4.35Å; K19-M23 VanDerWaalsContact O-CB 3.29Å; K19-M23 WeakPolarHBondContact O-CB 3.3Å; K19-M23 WeakPolarHBondContact O-CG 3.4Å; K19-M23 PolarHBondContact O-N 3.16Å
20L67.1Low60.2Low123 Ų123115.5 Ų115.564%0.64458%0.579SS**Hα-helixtrans-69.4-43176.3-146.1105.6000111.3Y16 L17 Q18 M23 S24Y16-L20 WeakPolarHBondContact O-CB 3.34Å; Y16-L20 PolarHBondContact O-N 3Å; L17-L20 PolarHBondContact O-N 2.79Å; Q18-L20 VanDerWaalsContact C-N 3.32Å; Q18-L20 PolarHBondContact O-N 3.26Å; L20-M23 PolarHBondContact O-N 3Å; L20-S24 WeakPolarHBondContact O-CB 3.49Å; L20-S24 PolarHBondContact O-N 3.25Å
21M66.9Low60.3Low135 Ų135117.2 Ų117.267%0.66559%0.591SS**Hα-helixtrans-66.2-41.9177.3-76.1177.7170.200112.2L17 Q18 M23 S24 S25L17-M21 WeakPolarHBondContact O-CB 3.5Å; L17-M21 WeakPolarHBondContact O-CG 3.45Å; L17-M21 PolarHBondContact O-N 2.74Å; Q18-M21 PolarHBondContact O-N 3.21Å; M21-M23 VanDerWaalsContact C-N 3.35Å; M21-S24 PolarHBondContact O-N 3.08Å; M21-S25 PolarHBondContact O-N 3.42Å
22T60.1Low60.4Low67 Ų67119.7 Ų119.741%0.41160%0.598SS.*Hα-helixtrans-71.2-28.2176.553.60000113.3Q18 K19 S25 F26Q18-T22 WeakPolarHBondContact O-CG2 3.37Å; Q18-T22 PolarHBondContact O-N 3.37Å; Q18-T22 PolarHBondContact O-OG1 3.32Å; K19-T22 WeakPolarHBondContact CA-OG1 3.34Å; K19-T22 PolarHBondContact O-OG1 3.26Å; T22-S25 PolarHBondContact O-OG 3.49Å; T22-F26 PolarHBondContact O-N 3.03Å
23M57.7Low60.5Low111 Ų111121.3 Ų121.355%0.54761%0.612SS.*Hα-helixtrans-78-28172.1-63.9-81.280.400112.3K19 L20 M21K19-M23 HydrophobicContact CG-CG 4.35Å; K19-M23 VanDerWaalsContact O-CB 3.29Å; K19-M23 WeakPolarHBondContact O-CB 3.3Å; K19-M23 WeakPolarHBondContact O-CG 3.4Å; K19-M23 PolarHBondContact O-N 3.16Å; L20-M23 PolarHBondContact O-N 3Å; M21-M23 VanDerWaalsContact C-N 3.35Å
24S52.3Low60.5Low72 Ų72123.4 Ų123.450%0.50362%0.619SS.*Hα-helixtrans-75.3-37.2175.4-167.20000112.4L20 M21 M27 V28L20-S24 WeakPolarHBondContact O-CB 3.49Å; L20-S24 PolarHBondContact O-N 3.25Å; M21-S24 PolarHBondContact O-N 3.08Å; S24-M27 PolarHBondContact O-N 3.31Å; S24-V28 WeakPolarHBondContact O-CG2 3.39Å
25S49.6Very low60.4Low70 Ų70121.5 Ų121.549%0.4961%0.613SS.*Hα-helixtrans-70.2-32177.865.80000112.6M21 T22 M27 V28 D29M21-S25 PolarHBondContact O-N 3.42Å; T22-S25 PolarHBondContact O-OG 3.49Å; S25-M27 PolarHBondContact O-N 3.06Å; S25-V28 PolarHBondContact O-N 3.46Å; S25-D29 PolarHBondContact O-N 2.84Å
26F56Low60.8Low147 Ų147123.2 Ų123.265%0.64562%0.62SS**Hα-helixtrans-64.7-24.8177.8-162.5-96.7000113.3T22 S30T22-F26 PolarHBondContact O-N 3.03Å; F26-S30 WeakPolarHBondContact O-CB 3.19Å; F26-S30 PolarHBondContact O-OG 2.79Å
27M60.3Low60.3Low165 Ų165123.5 Ų123.581%0.81363%0.625SS**Hα-helixtrans-88.7-18.7177.7-70.6-173.161.100114S24 S25S24-M27 PolarHBondContact O-N 3.31Å; S25-M27 PolarHBondContact O-N 3.06Å
28V62.1Low60.5Low117 Ų117123.3 Ų123.371%0.70963%0.629SS**Hα-helixtrans-101-27.6-172.3178.40000112.4S24 S25S24-V28 WeakPolarHBondContact O-CG2 3.39Å; S25-V28 PolarHBondContact O-N 3.46Å
29D52.7Low60.6Low150 Ų150122.3 Ų122.380%0.80263%0.633SS**SBendtrans-113.54.8-177.5-115.7-14.1000114.5S25 K31S25-D29 PolarHBondContact O-N 2.84Å; D29-K31 PolarHBondContact O-N 2.86Å
30S54.2Low60.2Low51 Ų51121.2 Ų121.236%0.35764%0.641SS.*  trans-73.6116.3171.1-73.60000108.9F26 Y32F26-S30 WeakPolarHBondContact O-CB 3.19Å; F26-S30 PolarHBondContact O-OG 2.79Å; S30-Y32 PolarHBondContact O-N 3.43Å
31K60.5Low59.7Low205 Ų205122.9 Ų122.989%0.89165%0.646SS**  trans-64.776.4157.410.9-167.6171.8-156.70106.9D29 V33D29-K31 PolarHBondContact O-N 2.86Å; K31-V33 VanDerWaalsContact C-N 3.28Å; K31-V33 PolarHBondContact O-N 3.18Å
32Y56.9Low59.1Low175 Ų175123 Ų12369%0.68664%0.644SS**  trans-6991.3-178.8-168.8-94.4000106.6S30 D34S30-Y32 PolarHBondContact O-N 3.43Å; Y32-D34 VanDerWaalsContact C-N 3.31Å; Y32-D34 HydrophobicContact CD1-CB 4.5Å; Y32-D34 HydrophobicContact CE1-CB 4.4Å; Y32-D34 PolarHBondContact O-N 3.01Å
33V65.1Low58.8Low127 Ų127129.6 Ų129.677%0.7766%0.663SS**  trans-65.5104.9159.5179.20000104.2K31 P35K31-V33 VanDerWaalsContact C-N 3.28Å; K31-V33 PolarHBondContact O-N 3.18Å; V33-P35 WeakPolarHBondContact O-CD 3.42Å
34D65.3Low58.7Low114 Ų114129.2 Ų129.261%0.6167%0.672SS**  trans-48.7117.1170.2-174.535000106.9Y32 K36Y32-D34 VanDerWaalsContact C-N 3.31Å; Y32-D34 HydrophobicContact CD1-CB 4.5Å; Y32-D34 HydrophobicContact CE1-CB 4.4Å; Y32-D34 PolarHBondContact O-N 3.01Å; D34-K36 PolarHBondContact O-N 3.38Å
35P62.4Low58.7Low62 Ų62133 Ų13340%0.40368%0.681SS.*  trans-59.4106-178.121-29.7000107.3V33 F37V33-P35 WeakPolarHBondContact O-CD 3.42Å; P35-F37 HydrophobicContact CG-CE2 4.11Å; P35-F37 HydrophobicContact CG-CZ 4.48Å; P35-F37 WeakPolarHBondContact O-CD2 3.28Å; P35-F37 PolarHBondContact O-N 2.65Å
36K73.3Confident58.7Low191 Ų191135.7 Ų135.783%0.8369%0.691SS**  trans-65.292.5173.1-174.677178.4178.90105.9D34 P38D34-K36 PolarHBondContact O-N 3.38Å; K36-P38 WeakPolarHBondContact O-CD 3.49Å
37F57.8Low58.4Low166 Ų166134.5 Ų134.573%0.72870%0.7SS**PPolyproline II helixtrans-54.3125.4173-74.5-85.5000107.4P35P35-F37 HydrophobicContact CG-CE2 4.11Å; P35-F37 HydrophobicContact CG-CZ 4.48Å; P35-F37 WeakPolarHBondContact O-CD2 3.28Å; P35-F37 PolarHBondContact O-N 2.65Å
38P69.1Low58.1Low85 Ų85136.7 Ų136.755%0.55270%0.701SS**PPolyproline II helixtrans-52.1135.2173.8-2331.4000108.6K36 C40K36-P38 WeakPolarHBondContact O-CD 3.49Å; P38-C40 PolarHBondContact O-N 3.29Å
39P60.4Low57.7Low96 Ų96137.9 Ų137.962%0.62370%0.702SS**PPolyproline II helixtrans-50.5131.3171.6-2130.7000108.9E41 E42P39-E41 PolarHBondContact O-N 3.24Å; P39-E42 PolarHBondContact O-N 3.5Å
40C54.6Low57.4Low116 Ų116135.2 Ų135.278%0.78469%0.693SS**G310 helixtrans-55.8-16-175.8-84.40000114.4P38 E42 Y43P38-C40 PolarHBondContact O-N 3.29Å; C40-E42 VanDerWaalsContact C-N 3.28Å; C40-E42 PolarHBondContact O-N 2.88Å; C40-Y43 PolarHBondContact O-N 3.31Å
41E57.2Low57.2Low158 Ų158140 Ų14074%0.73871%0.714SS**G310 helixtrans-65.2-27.3-176.6-67-160.5151.400113.9P39 Y43 S44P39-E41 PolarHBondContact O-N 3.24Å; E41-Y43 VanDerWaalsContact C-N 3.26Å; E41-Y43 PolarHBondContact O-N 3.06Å; E41-S44 PolarHBondContact O-OG 3.29Å
42E53.2Low56.7Low137 Ų137138.2 Ų138.264%0.6471%0.709SS**G310 helixtrans-77.3-14.6-178.8-141.6175.6-167.300112.6P39 C40P39-E42 PolarHBondContact O-N 3.5Å; C40-E42 VanDerWaalsContact C-N 3.28Å; C40-E42 PolarHBondContact O-N 2.88Å
43Y54.3Low56.2Low206 Ų206131.8 Ų131.881%0.80870%0.696SS**G310 helixtrans-77.6-20.6178.8-109.6-89.5000113.7C40 E41C40-Y43 PolarHBondContact O-N 3.31Å; E41-Y43 VanDerWaalsContact C-N 3.26Å; E41-Y43 PolarHBondContact O-N 3.06Å
44S54.9Low55.5Low104 Ų104132.2 Ų132.273%0.72770%0.699SS**G310 helixtrans-88.1-9.9176.443.70000114E41E41-S44 PolarHBondContact O-OG 3.29Å
45Q53.2Low54.8Low151 Ų151133.9 Ų133.971%0.70671%0.708SS**THydrogen-bonded Turntrans-95.4-21.4-165.7-132.5161.43.100114.1
46N48.9Very low54.2Low127 Ų127140.2 Ų140.268%0.67973%0.725SS**SBendtrans-102.7118170.9-74.525.9000108.2Y48N46-Y48 PolarHBondContact O-N 3.05Å
47S49.9Very low53Low122 Ų122141.5 Ų141.585%0.85373%0.726SS**  trans-59.349176.3-45.30000114I49S47-I49 VanDerWaalsContact C-N 3.3Å
48Y53.6Low52.3Low211 Ų211135.9 Ų135.983%0.82772%0.715SS**  trans-80.6-17.4179.2-169.5-100.5000111.7N46N46-Y48 PolarHBondContact O-N 3.05Å
49I54.1Low51.2Low142 Ų142137.6 Ų137.673%0.72873%0.727SS**SBendtrans-98.9112165.1-54.6-174.9000105.7S47 D51S47-I49 VanDerWaalsContact C-N 3.3Å; I49-D51 PolarHBondContact O-N 3.41Å
50P47Very low50.3Low93 Ų93137.7 Ų137.760%0.60474%0.735SS**  trans-54.8126.2167.4-18.129.7000107.4Q52P50-Q52 PolarHBondContact O-N 2.79Å
51D49.8Very low50.2Low152 Ų152141.2 Ų141.281%0.81374%0.74SS**  trans-61.985.1170.8-170.335.7000108I49 G53I49-D51 PolarHBondContact O-N 3.41Å; D51-G53 PolarHBondContact O-N 3.28Å
52Q49.7Very low49.5Very low168 Ų168139.8 Ų139.879%0.78574%0.738SS**  trans-74.9104.6163.1-68.4-74.2-14.800103.9P50P50-Q52 PolarHBondContact O-N 2.79Å
53G46Very low49.5Very low39 Ų39139.3 Ų139.340%0.40275%0.746SS.*  trans-41.2146.5-17400000113.4D51 D55D51-G53 PolarHBondContact O-N 3.28Å; G53-D55 PolarHBondContact O-N 3.33Å
54T50.6Low49.1Very low137 Ų137132 Ų13284%0.8473%0.734SS**THydrogen-bonded Turntrans-63.611.3-171.6-4.90000114.8
55D50.5Low48.5Very low148 Ų148136.2 Ų136.279%0.79174%0.74SS**THydrogen-bonded Turntrans-94.9-6-173.8-59.8-43.5000114.1G53G53-D55 PolarHBondContact O-N 3.33Å
56Y51.3Low48.4Very low196 Ų196138.2 Ų138.277%0.76975%0.749SS**THydrogen-bonded Turntrans-78.5-20.4-174.1-164-97.2000114.8
57Y46.9Very low48Very low217 Ų217140.6 Ų140.685%0.85176%0.756SS**THydrogen-bonded Turntrans-121.724.4178.3-75-79.3000113.3
58G43.5Very low47.7Very low48 Ų48140.3 Ų140.350%0.49575%0.751SS.*SBendtrans-87.2131167.200000110.4A60G58-A60 PolarHBondContact O-N 2.99Å; G58-A60 VanDerWaalsContact O-N 3.09Å
59P45.1Very low47.1Very low122 Ų122134 Ų13479%0.79275%0.751SS**  trans-67.2112.8170.528.3-29000107.7Q61P59-Q61 PolarHBondContact O-N 3.08Å
60A43Very low46.8Very low98 Ų98134.3 Ų134.381%0.8175%0.752SS**  trans-60.9108.4171.500000108.8G58 D62G58-A60 PolarHBondContact O-N 2.99Å; G58-A60 VanDerWaalsContact O-N 3.09Å; A60-D62 PolarHBondContact O-N 3.37Å
61Q52.5Low46.5Very low189 Ų189139.6 Ų139.688%0.88376%0.762SS**  trans-79.696.5161.7-72.4-168.311.600107.2P59P59-Q61 PolarHBondContact O-N 3.08Å
62D41Very low46.3Very low128 Ų128138.4 Ų138.468%0.68476%0.762SS**  trans-109117.5168-161.3-6.8000108.4A60 G64A60-D62 PolarHBondContact O-N 3.37Å; D62-G64 PolarHBondContact O-N 3.13Å
63P53Low45.6Very low127 Ų127141.8 Ų141.883%0.82577%0.768SS**SBendtrans-87.188.5176.834.1-28.2000108.9
64G47.3Very low45.3Very low54 Ų54145 Ų14556%0.55778%0.784SS**  trans142.966.9159.200000116.6D62D62-G64 PolarHBondContact O-N 3.13Å
65F41.6Very low44.8Very low191 Ų191146.2 Ų146.284%0.83879%0.785SS**  trans-143.7112.7151.6-98.1-83000110.2H67F65-H67 PolarHBondContact O-N 3.31Å
66Q50.7Low44.2Very low193 Ų193149.4 Ų149.490%0.90279%0.788SS**PPolyproline II helixtrans-67.1118.7171.4-76.9171.713.100109.4
67H40.8Very low43.7Very low177 Ų177146 Ų14682%0.81979%0.788SS**PPolyproline II helixtrans-76.4125.4165.3-80.3-82.5000109.7F65 G69F65-H67 PolarHBondContact O-N 3.31Å; H67-G69 PolarHBondContact O-N 3.44Å
68P43.5Very low43.2Very low116 Ų116144.3 Ų144.375%0.75379%0.788SS**PPolyproline II helixtrans-69.5131.2165.528.5-29.8000109
69G41.1Very low43Very low80 Ų80148.3 Ų148.383%0.82579%0.793SS**PPolyproline II helixtrans-57.6138.8-175.500000114.1H67H67-G69 PolarHBondContact O-N 3.44Å
70I47.4Very low42.5Very low147 Ų147147.5 Ų147.575%0.75479%0.788SS**  trans-78.3116173.9-72175.4000108.6
71Y41.5Very low42Very low205 Ų205152.3 Ų152.380%0.80479%0.791SS**  trans56133.3164-50.2-64.4000120.6R73Y71-R73 PolarHBondContact O-N 3.08Å
72P44.5Very low41Very low127 Ų127148.1 Ų148.183%0.82578%0.782SS**  trans-69.3113.6163.2-7.923.8000109.9S74P72-S74 PolarHBondContact O-N 3.01Å
73R36Very low40.5Very low239 Ų239148.2 Ų148.290%0.90279%0.792SS**  trans-72.3113.1167.4-171.5178.4-177.1176.4-1.4107.9Y71Y71-R73 PolarHBondContact O-N 3.08Å
74S39Very low39.5Very low107 Ų107148.1 Ų148.175%0.74879%0.789SS**  trans-51.6137.7173.8-57.20000111.7P72 Y76P72-S74 PolarHBondContact O-N 3.01Å; S74-Y76 PolarHBondContact O-N 3.38Å; S74-Y76 VanDerWaalsContact O-N 3.12Å
75N41.3Very low38.9Very low162 Ų162152.1 Ų152.187%0.86680%0.803SS**  trans-44109.9177.9-65.8-50.2000112.4
76Y36.9Very low38.7Very low214 Ų214149.2 Ų149.284%0.83980%0.801SS**  trans-114.5113.4157.6-122.4-93.5000106.8S74 E78S74-Y76 PolarHBondContact O-N 3.38Å; S74-Y76 VanDerWaalsContact O-N 3.12Å; Y76-E78 PolarHBondContact O-N 3.07Å; Y76-E78 VanDerWaalsContact O-N 3.12Å
77T42.2Very low37.8Very low125 Ų125149.1 Ų149.177%0.76780%0.8SS**  trans-70.698.9171.4-43.20000107.7Q79T77-Q79 PolarHBondContact O-N 3.28Å
78E34.4Very low37.3Very low182 Ų182144.1 Ų144.185%0.8580%0.797SS**  trans-72.3107.7164.4-83.7-145.5115.500108.7Y76Y76-E78 PolarHBondContact O-N 3.07Å; Y76-E78 VanDerWaalsContact O-N 3.12Å
79Q39.4Very low36.7Very low132 Ų132144.4 Ų144.462%0.61780%0.801SS**  trans-78.2126.4161.5-85.5-76.718.100108.5T77 F81T77-Q79 PolarHBondContact O-N 3.28Å; Q79-F81 HydrophobicContact CB-CZ 4.38Å; Q79-F81 PolarHBondContact O-N 3.36Å
80P36.5Very low36.2Very low105 Ų105146 Ų14668%0.68280%0.795SS**  trans-73.5108175.528.1-31.4000110S82P80-S82 PolarHBondContact O-N 3.34Å
81F31Very low35.6Very low198 Ų198144.8 Ų144.887%0.86879%0.794SS**  trans-8095.9166.4-56.2-77.3000109Q79Q79-F81 HydrophobicContact CB-CZ 4.38Å; Q79-F81 PolarHBondContact O-N 3.36Å
82S31.7Very low35.5Very low101 Ų101143.6 Ų143.671%0.70680%0.796SS**  trans-69.8125165.6-53.90000109.5P80 T84P80-S82 PolarHBondContact O-N 3.34Å; S82-T84 PolarHBondContact O-N 3.37Å
83C30.8Very low35.8Very low131 Ų131142.5 Ų142.589%0.88579%0.789SS**  trans-77.3109.6169.557.70000109.4
84T32.1Very low35.5Very low125 Ų125143 Ų14377%0.76779%0.79SS**  trans-120.2111.7166.342.50000109.9S82S82-T84 PolarHBondContact O-N 3.37Å
85T34.9Very low34.9Very low138 Ų138141.3 Ų141.385%0.84779%0.79SS**  trans-54.2124.2159.9-61.80000110.5
86V36.2Very low34.7Very low130 Ų130142.2 Ų142.279%0.78879%0.789SS**  trans-164.1130140.3-96.50000112.7
87Q33.2Very low34.6Very low191 Ų191137.7 Ų137.789%0.89378%0.783SS**  trans-8.1135.7153.9-58.6171.2-1.300120.6
88G29.3Very low34.3Very low72 Ų72139.9 Ų139.974%0.74279%0.785SS**  101.6119.4121.500000120
89S30.7Very low34Very low122 Ų122138.4 Ų138.485%0.85378%0.778SS**  trans69144.1141.1-103.30000117.7
90T31.4Very low33.7Very low112 Ų112142.4 Ų142.469%0.68779%0.787SS**  cis-170.6141.716.3-60.60000107.7
91V33.8Very low33.5Very low122 Ų122141.3 Ų141.374%0.73979%0.787SS**  trans67.1109.3141.6174.40000123
92Q39.8Very low33.6Very low181 Ų181136.3 Ų136.385%0.84678%0.777SS**  69158.8122-69.7-122.94000124.1
93P50.7Low34.3Very low103 Ų103140.1 Ų140.167%0.66978%0.783SS**  trans-114.8-178.1-147.343.8-34.5000114.8
94R29.8Very low35.2Very low249 Ų249139 Ų13994%0.9477%0.774SS**  trans134.1137.3133.7-168.8174.7-176.1141.3-0.5116
95G27Very low35.2Very low72 Ų72138.6 Ų138.674%0.74278%0.776SS**  trans101.6139.5162.300000112.8
96H37.1Very low35.8Very low181 Ų181137 Ų13784%0.83877%0.768SS**  cis-160.9157.935.2-159.3-67.8000112.2
97V33.9Very low35.6Very low119 Ų119140.7 Ų140.772%0.72177%0.774SS**  trans-90.8148.1-179.8173.40000112.7
98H36.3Very low35.5Very low172 Ų172137.4 Ų137.480%0.79677%0.767SS**  trans-168.3111.8148.5-109.175.1000107.5
99E28.3Very low35.6Very low151 Ų151138.1 Ų138.171%0.70677%0.766SS**  42.7133.783.7-104.5-155.9119.600114.5
100R33.6Very low35.5Very low215 Ų215140.6 Ų140.681%0.81176%0.764SS**  cis-171.1164.313.8-157.3-169.2-175.3-162.5-2.4109.2
101A32.3Very low35.5Very low82 Ų82140.9 Ų140.968%0.67877%0.766SS**  trans72.9145.1148.300000119
102S32.6Very low35.4Very low94 Ų94143.4 Ų143.466%0.65777%0.77SS**  cis-177131.20.4-86.70000110.3
103H46.5Very low35.4Very low180 Ų180139.8 Ų139.883%0.83376%0.762SS**  trans59.2175141.8-52.4-63.9000121.3
104P50.4Low34.3Very low108 Ų108140.7 Ų140.770%0.70177%0.769SS**  -138.7170.3-99.236.3-12.9000117.6
105S31.6Very low35Very low116 Ų116134.1 Ų134.181%0.81176%0.759SS**  trans61.3174.8150.8-70.30000119.9
106P47.8Very low35.8Very low105 Ų105136.5 Ų136.568%0.68276%0.761SS**  cis-127.8174.1-30.229.5-9.9000112
107F31Very low35.8Very low207 Ų207134.4 Ų134.491%0.90876%0.761SS**  -172.3149.7129.2-120.6-93.7000112.7
108T32.4Very low35.9Very low122 Ų122137.4 Ų137.475%0.74877%0.767SS**  trans-116.4171.5-167.3-38.40000109.6
109A30.6Very low36.1Very low88 Ų88135.5 Ų135.573%0.72777%0.767SS**  trans96.8113.6164.100000115.3
110Q29.1Very low36.4Very low173 Ų173134.6 Ų134.681%0.80877%0.772SS**  92128.957-77.5-152.840.400114.2
111T30.7Very low36.7Very low119 Ų119127.1 Ų127.173%0.7376%0.763SS**  trans73.9107.7148.833.20000122.6
112E32.6Very low37.1Very low175 Ų175129.3 Ų129.382%0.81877%0.77SS**  24.1163.8121.2-65.3-76.5118.300121.2
113P39.8Very low37.4Very low104 Ų104136.6 Ų136.668%0.67578%0.783SS**  cis-140.8-169-29.236.2-15.2000114.8
114C26.2Very low37.1Very low122 Ų122134.6 Ų134.682%0.82478%0.783SS**  trans99.5153.4165.6-810000118.9
115P45.4Very low36.2Very low111 Ų111134.8 Ų134.872%0.72179%0.786SS**  cis-129.1177-18.333.2-12.8000113.6
116P43.1Very low36.6Very low122 Ų122132.8 Ų132.879%0.79278%0.784SS**  trans-86.3132.8-173.833-32.3000113.6
117V38.3Very low36.1Very low138 Ų138134.3 Ų134.384%0.83678%0.782SS**  trans-86.5118.6171.9-179.70000109.5V119V117-V119 PolarHBondContact O-N 2.9Å
118Q35.5Very low36.7Very low182 Ų182133.6 Ų133.685%0.8578%0.781SS**  trans-76.9114.9174.5-62.8177.9-3.100109.5
119V39.7Very low37.1Very low131 Ų131134.1 Ų134.179%0.79478%0.775SS**  trans-104.1110.6166.1-1800000107.9V117 G121V117-V119 PolarHBondContact O-N 2.9Å; V119-G121 PolarHBondContact O-N 3.01Å; V119-G121 VanDerWaalsContact O-N 3.16Å
120T36.1Very low37.7Very low132 Ų132136.7 Ų136.781%0.8178%0.777SS**  trans-62.9103170.644.20000110.1
121G39.9Very low38.3Very low59 Ų59134 Ų13461%0.60877%0.772SS**PPolyproline II helixtrans-76.7144.5163.500000110.7V119 R123V119-G121 PolarHBondContact O-N 3.01Å; V119-G121 VanDerWaalsContact O-N 3.16Å; G121-R123 PolarHBondContact O-N 3Å
122P40.8Very low38.9Very low127 Ų127137.3 Ų137.383%0.82578%0.777SS**PPolyproline II helixtrans-65.8131.7179.624.8-30000110.5T124P122-T124 PolarHBondContact O-N 2.88Å
123R38.9Very low38.9Very low248 Ų248136.8 Ų136.894%0.93678%0.779SS**PPolyproline II helixtrans-56.4117.1179.4-49.2-174-151.7-152.46.2109.2G121 C125G121-R123 PolarHBondContact O-N 3Å; R123-C125 PolarHBondContact O-N 2.71Å
124T38.2Very low39.2Very low137 Ų137140 Ų14084%0.8479%0.785SS**  trans-70.4114.1164.953.80000107.8P122 G126P122-T124 PolarHBondContact O-N 2.88Å; T124-G126 PolarHBondContact O-N 2.85Å
125C32.7Very low39.7Very low112 Ų112142.8 Ų142.876%0.75779%0.786SS**  trans-54.1102.3172.8-176.90000110R123 Q127R123-C125 PolarHBondContact O-N 2.71Å; C125-Q127 PolarHBondContact O-N 3.4Å; C125-Q127 VanDerWaalsContact O-N 3.09Å
126G40.5Very low39.3Very low74 Ų74141.2 Ų141.276%0.76379%0.79SS**  trans-76.681.2162.800000108.3T124 Q128T124-G126 PolarHBondContact O-N 2.85Å; G126-Q128 PolarHBondContact O-N 3.01Å
127Q37.5Very low39.6Very low137 Ų137143.3 Ų143.364%0.6479%0.793SS**  trans-7098.6172.4-161.5173.414.500108.3C125 Q129C125-Q127 PolarHBondContact O-N 3.4Å; C125-Q127 VanDerWaalsContact O-N 3.09Å; Q127-Q129 VanDerWaalsContact C-N 3.31Å; Q127-Q129 HydrophobicContact CB-CG 4.42Å; Q127-Q129 HydrophobicContact CG-CG 3.78Å; Q127-Q129 PolarHBondContact O-N 3.43Å
128Q43.5Very low40Very low192 Ų192145.2 Ų145.290%0.89779%0.793SS**  trans-62.597.7157.3-77.7178.9500107.3G126 N130G126-Q128 PolarHBondContact O-N 3.01Å; Q128-N130 PolarHBondContact O-N 2.93Å
129Q40.8Very low40.8Very low133 Ų133140.9 Ų140.962%0.62179%0.788SS**  trans-83.793.8167.4-65.7-173.44.300108Q127 T131Q127-Q129 VanDerWaalsContact C-N 3.31Å; Q127-Q129 HydrophobicContact CB-CG 4.42Å; Q127-Q129 HydrophobicContact CG-CG 3.78Å; Q127-Q129 PolarHBondContact O-N 3.43Å; Q129-T131 HydrophobicContact CB-CG2 4.48Å; Q129-T131 PolarHBondContact O-N 3.13Å
130N43Very low41.8Very low142 Ų142144.1 Ų144.176%0.75979%0.791SS**  trans-73.8101.8156.7-177.87.4000107.4Q128Q128-N130 PolarHBondContact O-N 2.93Å
131T40.5Very low42.5Very low118 Ų118145.7 Ų145.772%0.72479%0.789SS**  trans-115.594.1169.156.40000109.2Q129 N133Q129-T131 HydrophobicContact CB-CG2 4.48Å; Q129-T131 PolarHBondContact O-N 3.13Å; T131-N133 PolarHBondContact O-N 3.07Å
132K43.2Very low43.6Very low188 Ų188148 Ų14882%0.81779%0.793SS**  trans-73.3111.3150.8-76.9179.9177.4177.60107.2
133N33Very low45.1Very low163 Ų163147.9 Ų147.987%0.87279%0.791SS**  trans-159.2123.5145.5-113.9-11.2000111.1T131T131-N133 PolarHBondContact O-N 3.07Å
134Q46.5Very low47.1Very low171 Ų171140.6 Ų140.680%0.79977%0.773SS**  trans-87.9128.4170.8-66.9-178.72400109.2
135H37.2Very low49.4Very low182 Ų182137.8 Ų137.884%0.84376%0.756SS**  trans156.3131.3130.2-92.564.3000110
136G35.6Very low52Low78 Ų78138.5 Ų138.580%0.80474%0.743SS**  trans130.295.6166.500000114.2Q138G136-Q138 PolarHBondContact O-N 3.4Å
137I50.8Low54.2Low165 Ų165139.3 Ų139.385%0.84674%0.736SS**  trans-59.6123174.7-64.1-171.7000110.2
138Q46.5Very low56.6Low179 Ų179142.3 Ų142.384%0.83674%0.741SS**  trans-146.1105.2134.7-78.5-131.536.900107.4G136 K140G136-Q138 PolarHBondContact O-N 3.4Å; Q138-K140 VanDerWaalsContact C-N 3.33Å; Q138-K140 PolarHBondContact O-N 3.48Å
139A53.1Low58.6Low91 Ų91137.4 Ų137.475%0.75272%0.719SS**  trans-60.497.9170.100000107.9Q141A139-Q141 PolarHBondContact O-N 2.96Å
140K59.6Low60.5Low198 Ų198137 Ų13786%0.86172%0.715SS**  trans-58.3112169.1-68.3-173.4178.9-174.60106.2Q138Q138-K140 VanDerWaalsContact C-N 3.33Å; Q138-K140 PolarHBondContact O-N 3.48Å
141Q51.5Low62.2Low166 Ų166138.1 Ų138.178%0.77671%0.713SS**  trans-42.1128.2175.4-72.1-74.412.800108.9A139 T143A139-Q141 PolarHBondContact O-N 2.96Å; Q141-T143 PolarHBondContact O-N 2.84Å
142P61.7Low63.5Low106 Ų106138.5 Ų138.569%0.68871%0.707SS**  trans-60.1116.9178.124.9-32000107.4V144P142-V144 PolarHBondContact O-N 3.36Å
143T72.3Confident64.5Low126 Ų126136.2 Ų136.277%0.77370%0.699SS**  trans-50.9116.8179.7-46.80000109Q141 V145Q141-T143 PolarHBondContact O-N 2.84Å; T143-V145 PolarHBondContact O-N 3.31Å
144V82.4Confident65.5Low94 Ų94131.4 Ų131.457%0.5768%0.675SS**  trans-69.697.4-177.8-179.60000108.4P142 Y146P142-V144 PolarHBondContact O-N 3.36Å; V144-Y146 HydrophobicContact CG1-CD1 4.27Å; V144-Y146 HydrophobicContact CG1-CE1 3.85Å; V144-Y146 HydrophobicContact CG1-CE2 4.16Å; V144-Y146 PolarHBondContact O-N 3.24Å
145V85.2Confident65.9Low78 Ų78128.3 Ų128.347%0.47367%0.668SS.*  trans-84.3101.2175.3-177.40000109T143 M149 K150T143-V145 PolarHBondContact O-N 3.31Å; V145-M149 HydrophobicContact CG1-CB 3.99Å; V145-K150 HydrophobicContact CG1-CG 3.95Å
146Y88Confident66.7Low127 Ų127125.7 Ų125.750%0.49867%0.665SS.*  trans-64.8150.7177.3-62.8-79.4000111.8V144 W148 M149V144-Y146 HydrophobicContact CG1-CD1 4.27Å; V144-Y146 HydrophobicContact CG1-CE1 3.85Å; V144-Y146 HydrophobicContact CG1-CE2 4.16Å; V144-Y146 PolarHBondContact O-N 3.24Å; Y146-W148 VanDerWaalsContact CB-CD1 3.49Å; Y146-W148 VanDerWaalsContact CB-NE1 3.27Å; Y146-W148 AromaticContact CG-NE1 3.81Å; Y146-W148 PolarHBondContact O-N 3.14Å; Y146-W148 VanDerWaalsContact O-N 3.09Å; Y146-M149 HydrophobicContact CD2-SD 3.71Å; Y146-M149 HydrophobicContact CG-SD 4.41Å; Y146-M149 WeakPolarHBondContact O-CB 3.25Å; Y146-M149 PolarHBondContact O-N 3.07Å
147P86.4Confident67.6Low92 Ų92126.3 Ų126.360%0.59765%0.653SS**G310 helixtrans-52.9-35.7-177.7-29.636000114.8M149 K150 H152P147-M149 VanDerWaalsContact C-N 3.29Å; P147-M149 PolarHBondContact O-N 3.12Å; P147-K150 WeakPolarHBondContact O-CB 3.42Å; P147-K150 PolarHBondContact O-N 2.67Å; P147-H152 PolarHBondContact O-NE2 3.37Å
148W87.3Confident67.5Low200 Ų200123.4 Ų123.476%0.75864%0.639SS**G310 helixtrans-70.3-22.7178.266-95000113.8Y146 K150Y146-W148 VanDerWaalsContact CB-CD1 3.49Å; Y146-W148 VanDerWaalsContact CB-NE1 3.27Å; Y146-W148 AromaticContact CG-NE1 3.81Å; Y146-W148 PolarHBondContact O-N 3.14Å; Y146-W148 VanDerWaalsContact O-N 3.09Å; W148-K150 VanDerWaalsContact C-N 3.26Å
149M85.8Confident68.1Low88 Ų88120.4 Ų120.443%0.43364%0.635SS.*G310 helixtrans-78.1-15.4175.7-59.6174.572.900111.6V145 Y146 P147V145-M149 HydrophobicContact CG1-CB 3.99Å; Y146-M149 HydrophobicContact CD2-SD 3.71Å; Y146-M149 HydrophobicContact CG-SD 4.41Å; Y146-M149 WeakPolarHBondContact O-CB 3.25Å; Y146-M149 PolarHBondContact O-N 3.07Å; P147-M149 VanDerWaalsContact C-N 3.29Å; P147-M149 PolarHBondContact O-N 3.12Å
150K81.9Confident68.3Low125 Ų125122.8 Ų122.854%0.54364%0.635SS.*SBendtrans-77129.3177.5-60.7-174.1177.2-178.10109.8V145 P147 W148 H152V145-K150 HydrophobicContact CG1-CG 3.95Å; P147-K150 WeakPolarHBondContact O-CB 3.42Å; P147-K150 PolarHBondContact O-N 2.67Å; W148-K150 VanDerWaalsContact C-N 3.26Å; K150-H152 PolarHBondContact O-CD2 3.09Å; K150-H152 PolarHBondContact O-N 2.82Å
151K77.9Confident67.9Low165 Ų165121.6 Ų121.672%0.71763%0.627SS**  trans-75.184.2-179.4-62.5-178.2-177173.60110.8H153 V154K151-H153 PolarHBondContact O-N 2.91Å; K151-V154 HydrophobicContact CB-CG2 3.98Å; K151-V154 PolarHBondContact O-N 3.04Å
152H68.4Low68.1Low126 Ų126120.9 Ų120.958%0.58363%0.634SS**THydrogen-bonded Turntrans-56.2-25.1-177.3-73.2-69.7000115.7P147 K150 V154P147-H152 PolarHBondContact O-NE2 3.37Å; K150-H152 PolarHBondContact O-CD2 3.09Å; K150-H152 PolarHBondContact O-N 2.82Å; H152-V154 PolarHBondContact O-N 3.46Å
153H63.7Low67.9Low141 Ų141117.4 Ų117.465%0.65362%0.617SS**THydrogen-bonded Turntrans-75.1-10.2-176.4-50.2110.2000114.4K151 R168K151-H153 PolarHBondContact O-N 2.91Å; H153-R168 PolarHBondContact O-NH2 3.21Å; H153-R168 VanDerWaalsContact O-NH2 3.14Å
154V54.6Low67.4Low62 Ų62118.3 Ų118.338%0.37663%0.625SS.*THydrogen-bonded Turntrans-102-36.4-168-176.70000111.7K151 H152 T156K151-V154 HydrophobicContact CB-CG2 3.98Å; K151-V154 PolarHBondContact O-N 3.04Å; H152-V154 PolarHBondContact O-N 3.46Å; V154-T156 PolarHBondContact O-N 3.36Å
155T53Low66.3Low105 Ų105118.7 Ų118.764%0.64462%0.621SS**THydrogen-bonded Turntrans-74-22.9-170.1-390000114.6V157T155-V157 PolarHBondContact O-N 3.38Å
156T55.3Low65Low128 Ų128119.6 Ų119.679%0.78563%0.628SS**THydrogen-bonded Turntrans-81.5-11.3-172.4-37.90000114.1V154V154-T156 PolarHBondContact O-N 3.36Å
157V53.7Low64.3Low90 Ų90123 Ų12355%0.54565%0.646SS.*THydrogen-bonded Turntrans-109.1-17.2-173.7-88.90000115.5T155T155-V157 PolarHBondContact O-N 3.38Å
158N48.3Very low63.6Low104 Ų104127.3 Ų127.356%0.55665%0.65SS**  trans-165.3115.4168.5-85.8-50.4000110D160N158-D160 PolarHBondContact O-N 2.85Å
159P60Low63.4Low116 Ų116123.1 Ų123.175%0.75365%0.651SS**THydrogen-bonded Turntrans-65-24.5174.6-20.532.5000113.9
160D57.9Low63.5Low142 Ų142130.3 Ų130.376%0.75967%0.674SS**THydrogen-bonded Turntrans-102.92.5-166.4-56.9-34.5000114.5N158 T162N158-D160 PolarHBondContact O-N 2.85Å; D160-T162 PolarHBondContact O-N 3.36Å
161Y50Low64Low172 Ų172130.1 Ų130.168%0.67568%0.683SS**  trans-92.987.3-178.3-125.7-95.6000111.7G163 E165Y161-G163 PolarHBondContact O-N 3.06Å; Y161-E165 HydrophobicContact CD1-CG 4.44Å
162T55.5Low64.8Low151 Ų151126.3 Ų126.393%0.92668%0.683SS**  trans-84.942.4173.6-10.60000112D160D160-T162 PolarHBondContact O-N 3.36Å
163G59.1Low66.2Low33 Ų33123.7 Ų123.734%0.3467%0.668SS.*SBendtrans-99.7158.8177.900000113Y161 E165Y161-G163 PolarHBondContact O-N 3.06Å; G163-E165 PolarHBondContact O-N 3.44Å
164P61.2Low67.9Low145 Ų145120.6 Ų120.694%0.94266%0.659SS**  trans-65.283.5164.7-4.519.5000108.9
165E58.5Low69.9Low103 Ų103127.1 Ų127.148%0.48168%0.677SS.*PPolyproline II helixtrans-84.1145.8-161.8-139.9-101.1154.900112.7Y161 G163 K167Y161-E165 HydrophobicContact CD1-CG 4.44Å; G163-E165 PolarHBondContact O-N 3.44Å; E165-K167 PolarHBondContact O-N 3.33Å
166P59.4Low72Confident97 Ų97128.7 Ų128.763%0.6368%0.677SS**PPolyproline II helixtrans-66.5128.7-166.7-19.733.5000113R168P166-R168 PolarHBondContact O-N 3.18Å
167K71.9Confident74.1Confident199 Ų199124 Ų12487%0.86565%0.646SS**PPolyproline II helixtrans-54.5117.1165.5-66.8148.1-176.8171.70107.4E165 S169E165-K167 PolarHBondContact O-N 3.33Å; K167-S169 PolarHBondContact O-N 3.04Å
168R73.3Confident76.2Confident182 Ų182121.9 Ų121.969%0.68763%0.633SS**  trans-47.8108.4175.4-76.6-174.8-175.9146.67.6109H153 P166 R170H153-R168 PolarHBondContact O-NH2 3.21Å; H153-R168 VanDerWaalsContact O-NH2 3.14Å; P166-R168 PolarHBondContact O-N 3.18Å; R168-R170 PolarHBondContact O-N 3.12Å
169S82.1Confident78.5Confident112 Ų112120.7 Ų120.778%0.78363%0.627SS**PPolyproline II helixtrans-66133.3-178.8-176.20000109.2K167K167-S169 PolarHBondContact O-N 3.04Å
170R88.3Confident80.3Confident238 Ų238118.2 Ų118.290%0.89861%0.605SS**PPolyproline II helixtrans-84.7118.7174.3-81.6-176.8174.6-91.82108.8R168R168-R170 PolarHBondContact O-N 3.12Å
171T92.7Very high82.3Confident121 Ų121111.4 Ų111.474%0.74257%0.569SS**PPolyproline II helixtrans-76.5128167.3-41.70000109.7
172A94.9Very high84.6Confident86 Ų86106.7 Ų106.771%0.71155%0.553SS**PPolyproline II helixtrans-83.8146.9171.800000110.5
173Y97.4Very high86.6Confident70 Ų70105.4 Ų105.428%0.27553%0.534SS..PPolyproline II helixtrans-80.5145.6170.8-60.1-48.9000110.2L205 W213Y173-L205 HydrophobicContact CD1-CD1 4.12Å; Y173-L205 HydrophobicContact CD1-CD2 3.88Å; Y173-L205 HydrophobicContact CE1-CD1 4.04Å; Y173-L205 HydrophobicContact CE1-CD2 3.69Å; Y173-W213 AromaticContact CD2-CD1 3.86Å; Y173-W213 AromaticContact CE2-CD1 3.63Å
174T98.2Very high88.4Confident77 Ų77104.5 Ų104.547%0.47252%0.521SS..PPolyproline II helixtrans-68.4159.217574.30000110.5Q176 Q177 V178T174-Q176 VanDerWaalsContact C-N 3.27Å; T174-Q176 PolarHBondContact O-N 3.44Å; T174-Q177 PolarHBondContact O-N 3.31Å; T174-Q177 VanDerWaalsContact O-N 3.16Å; T174-Q177 VanDerWaalsContact OG1-CG 3.3Å; T174-Q177 WeakPolarHBondContact OG1-CG 3.38Å; T174-Q177 PolarHBondContact OG1-N 3Å; T174-V178 WeakPolarHBondContact O-CG2 3.48Å; T174-V178 PolarHBondContact O-N 3.07Å
175R97.6Very high90.2Very high198 Ų19897.8 Ų97.875%0.74748%0.477SS*.Hα-helixtrans-56.3-43.1177.7-174.1173.8-178.1-87.6-0.6111.9V178 L179R175-V178 PolarHBondContact O-N 3.26Å; R175-L179 HydrophobicContact CG-CD1 4.21Å; R175-L179 WeakPolarHBondContact O-CG 3.4Å; R175-L179 PolarHBondContact O-N 3.01Å
176Q97.8Very high92Very high139 Ų13998.6 Ų98.665%0.6548%0.481SS*.Hα-helixtrans-61.1-45.1177.3-178.6-177.5-18.300112T174 V178 L179 E180T174-Q176 VanDerWaalsContact C-N 3.27Å; T174-Q176 PolarHBondContact O-N 3.44Å; Q176-V178 VanDerWaalsContact C-N 3.32Å; Q176-V178 PolarHBondContact O-N 3.3Å; Q176-L179 PolarHBondContact O-N 3.38Å; Q176-E180 PolarHBondContact O-N 2.89Å; Q176-E180 VanDerWaalsContact O-N 3.08Å
177Q97.8Very high93.8Very high29 Ų29101.7 Ų101.714%0.13649%0.485CS..Hα-helixtrans-59.7-43.9177.3-73171.8-2600111.5T174 L181 L203T174-Q177 PolarHBondContact O-N 3.31Å; T174-Q177 VanDerWaalsContact O-N 3.16Å; T174-Q177 VanDerWaalsContact OG1-CG 3.3Å; T174-Q177 WeakPolarHBondContact OG1-CG 3.38Å; T174-Q177 PolarHBondContact OG1-N 3Å; Q177-L181 WeakPolarHBondContact O-CB 3.35Å; Q177-L181 WeakPolarHBondContact O-CD1 3.35Å; Q177-L181 WeakPolarHBondContact O-CG 3.33Å; Q177-L181 PolarHBondContact O-N 2.9Å; Q177-L203 HydrophobicContact CG-CB 4.34Å; Q177-L203 PolarHBondContact NE2-O 2.85Å
178V98.2Very high95Very high45 Ų4595.6 Ų95.627%0.27346%0.462SS..Hα-helixtrans-62.9-44.8178.4177.10000111.2T174 R175 Q176 L181 E182T174-V178 WeakPolarHBondContact O-CG2 3.48Å; T174-V178 PolarHBondContact O-N 3.07Å; R175-V178 PolarHBondContact O-N 3.26Å; Q176-V178 VanDerWaalsContact C-N 3.32Å; Q176-V178 PolarHBondContact O-N 3.3Å; V178-L181 PolarHBondContact O-N 3.44Å; V178-E182 HydrophobicContact CG1-CG 4.36Å; V178-E182 WeakPolarHBondContact O-CB 3.37Å; V178-E182 WeakPolarHBondContact O-CG 3.37Å; V178-E182 PolarHBondContact O-N 3.3Å
179L97.9Very high96.1Very high79 Ų7991.8 Ų91.841%0.41445%0.447SS..Hα-helixtrans-62.2-45.7-179.4-71.3172.5000112.4R175 Q176 L181 E182 K183R175-L179 HydrophobicContact CG-CD1 4.21Å; R175-L179 WeakPolarHBondContact O-CG 3.4Å; R175-L179 PolarHBondContact O-N 3.01Å; Q176-L179 PolarHBondContact O-N 3.38Å; L179-L181 PolarHBondContact O-N 3.4Å; L179-E182 PolarHBondContact O-N 2.95Å; L179-K183 WeakPolarHBondContact O-CB 3.33Å; L179-K183 PolarHBondContact O-N 3.06Å
180E97.8Very high96.8Very high64 Ų6493.2 Ų93.230%0.29944%0.436SS..Hα-helixtrans-65.7-38.6177.2-72.9-62.9145.700111.8Q176 E182 K183 E184 L203Q176-E180 PolarHBondContact O-N 2.89Å; Q176-E180 VanDerWaalsContact O-N 3.08Å; E180-E182 VanDerWaalsContact C-N 3.34Å; E180-E182 PolarHBondContact O-N 2.91Å; E180-K183 PolarHBondContact O-N 3.48Å; E180-K183 IonicContact OE1-NZ 3.65Å; E180-K183 IonicContact OE2-NZ 3.24Å; E180-K183 PolarHBondContact OE2-NZ 3.48Å; E180-E184 WeakPolarHBondContact O-CB 3.5Å; E180-E184 WeakPolarHBondContact O-CG 3.46Å; E180-E184 PolarHBondContact O-N 3.47Å; E180-L203 HydrophobicContact CB-CD1 4.08Å; E180-L203 HydrophobicContact CB-CD2 3.63Å; E180-L203 HydrophobicContact CB-CG 4.43Å; E180-L203 HydrophobicContact CG-CD2 3.91Å
181L98.4Very high97.3Very high0 Ų083.1 Ų83.10%040%0.4CS..Hα-helixtrans-63.5-40174.2-71.5167.1000112.2Q177 V178 L179 F185 I199 L203 L205 I210 W213 F214Q177-L181 WeakPolarHBondContact O-CB 3.35Å; Q177-L181 WeakPolarHBondContact O-CD1 3.35Å; Q177-L181 WeakPolarHBondContact O-CG 3.33Å; Q177-L181 PolarHBondContact O-N 2.9Å; V178-L181 PolarHBondContact O-N 3.44Å; L179-L181 PolarHBondContact O-N 3.4Å; L181-F185 WeakPolarHBondContact O-CB 3.28Å; L181-F185 PolarHBondContact O-N 3.09Å; L181-I199 HydrophobicContact CD2-CG2 4.21Å; L181-L203 HydrophobicContact CD1-CD1 4.4Å; L181-L203 HydrophobicContact CD2-CD1 3.84Å; L181-L203 HydrophobicContact CG-CD1 3.67Å; L181-L205 HydrophobicContact CD1-CD1 4.28Å; L181-I210 HydrophobicContact CD2-CD1 3.75Å; L181-W213 HydrophobicContact CB-CD2 3.93Å; L181-W213 HydrophobicContact CB-CE3 3.92Å; L181-W213 HydrophobicContact CB-CH2 3.62Å; L181-W213 HydrophobicContact CB-CZ2 3.61Å; L181-W213 HydrophobicContact CB-CZ3 3.77Å; L181-W213 HydrophobicContact CD1-CD2 3.87Å; L181-W213 HydrophobicContact CD1-CG 3.84Å; L181-W213 HydrophobicContact CD1-CZ2 4.5Å; L181-W213 HydrophobicContact CD2-CD2 4.37Å; L181-W213 HydrophobicContact CD2-CE3 4.28Å; L181-W213 HydrophobicContact CG-CD2 4.28Å; L181-W213 HydrophobicContact CG-CE3 4.48Å; L181-W213 WeakPolarHBondContact O-CH2 3.33Å; L181-W213 WeakPolarHBondContact O-CZ3 3.49Å; L181-F214 HydrophobicContact CD2-CE2 4.06Å
182E98.3Very high97.6Very high72 Ų7281.4 Ų81.434%0.33639%0.39SS..Hα-helixtrans-67-45.4175.4-75.2-171.417200111.6V178 L179 E180 E184 F185 H186 W213V178-E182 HydrophobicContact CG1-CG 4.36Å; V178-E182 WeakPolarHBondContact O-CB 3.37Å; V178-E182 WeakPolarHBondContact O-CG 3.37Å; V178-E182 PolarHBondContact O-N 3.3Å; L179-E182 PolarHBondContact O-N 2.95Å; E180-E182 VanDerWaalsContact C-N 3.34Å; E180-E182 PolarHBondContact O-N 2.91Å; E182-E184 VanDerWaalsContact C-N 3.34Å; E182-E184 PolarHBondContact O-N 3.49Å; E182-F185 WeakPolarHBondContact O-CB 3.45Å; E182-F185 PolarHBondContact O-N 3.27Å; E182-F185 VanDerWaalsContact O-N 3.13Å; E182-H186 PolarHBondContact O-N 3.31Å; E182-H186 PolarHBondContact O-ND1 3.09Å; E182-W213 HydrophobicContact CG-CH2 3.91Å; E182-W213 HydrophobicContact CG-CZ2 3.99Å
183K97.7Very high97.7Very high124 Ų12484 Ų8454%0.53938%0.381SS..Hα-helixtrans-54.6-49.9174.5175.2-176.2164.4-162.20111.2L179 E180 F185 H186 F187L179-K183 WeakPolarHBondContact O-CB 3.33Å; L179-K183 PolarHBondContact O-N 3.06Å; E180-K183 PolarHBondContact O-N 3.48Å; E180-K183 IonicContact OE1-NZ 3.65Å; E180-K183 IonicContact OE2-NZ 3.24Å; E180-K183 PolarHBondContact OE2-NZ 3.48Å; K183-F185 VanDerWaalsContact C-N 3.31Å; K183-F185 PolarHBondContact O-N 3.4Å; K183-H186 PolarHBondContact O-N 3.2Å; K183-F187 PolarHBondContact O-N 2.8Å
184E98Very high97.8Very high15 Ų1589.5 Ų89.57%0.0740%0.401CS..Hα-helixtrans-63-36.6176.9-73.1-63.9132.100112.7E180 E182 H186 F187 N188 R195 I199 F214E180-E184 WeakPolarHBondContact O-CB 3.5Å; E180-E184 WeakPolarHBondContact O-CG 3.46Å; E180-E184 PolarHBondContact O-N 3.47Å; E182-E184 VanDerWaalsContact C-N 3.34Å; E182-E184 PolarHBondContact O-N 3.49Å; E184-H186 VanDerWaalsContact C-N 3.35Å; E184-H186 PolarHBondContact O-N 2.9Å; E184-F187 PolarHBondContact O-N 3.44Å; E184-N188 PolarHBondContact O-N 3.45Å; E184-R195 IonicContact OE1-CZ 3.67Å; E184-R195 IonicContact OE1-NE 3.99Å; E184-R195 IonicContact OE1-NH2 2.67Å; E184-R195 PolarHBondContact OE1-NH2 3.23Å; E184-R195 IonicContact OE2-CZ 3.38Å; E184-R195 IonicContact OE2-NE 2.85Å; E184-R195 PolarHBondContact OE2-NE 3.34Å; E184-R195 IonicContact OE2-NH2 3.12Å; E184-R195 PolarHBondContact OE2-NH2 3.04Å; E184-R195 VanDerWaalsContact OE2-NH2 3.12Å; E184-I199 HydrophobicContact CB-CD1 4.03Å; E184-I199 HydrophobicContact CG-CD1 3.66Å; E184-I199 HydrophobicContact CG-CG1 4.06Å; E184-F214 HydrophobicContact CB-CZ 4.03Å
185F98.1Very high97.8Very high3 Ų390 Ų901%0.01339%0.394CS..Hα-helixtrans-65.5-37.3177.5-177.8-98.2000113L181 E182 K183 N188 R189 W213 F214 R217 R218 W221L181-F185 WeakPolarHBondContact O-CB 3.28Å; L181-F185 PolarHBondContact O-N 3.09Å; E182-F185 WeakPolarHBondContact O-CB 3.45Å; E182-F185 PolarHBondContact O-N 3.27Å; E182-F185 VanDerWaalsContact O-N 3.13Å; K183-F185 VanDerWaalsContact C-N 3.31Å; K183-F185 PolarHBondContact O-N 3.4Å; F185-N188 CarbonylContact O-C 3.27Å; F185-N188 VanDerWaalsContact O-C 3.27Å; F185-R189 HydrophobicContact CE1-CG 4.24Å; F185-R189 HydrophobicContact CE2-CB 4.09Å; F185-R189 HydrophobicContact CE2-CG 4.17Å; F185-R189 HydrophobicContact CZ-CB 4.29Å; F185-R189 HydrophobicContact CZ-CG 3.92Å; F185-R189 PolarHBondContact O-N 3.18Å; F185-W213 HydrophobicContact CB-CH2 4.39Å; F185-W213 HydrophobicContact CB-CZ3 4.09Å; F185-F214 HydrophobicContact CB-CE1 4.18Å; F185-F214 HydrophobicContact CB-CZ 4.29Å; F185-F214 AromaticContact CD2-CD1 3.97Å; F185-F214 HydrophobicContact CD2-CD1 3.97Å; F185-F214 AromaticContact CD2-CE1 3.91Å; F185-F214 HydrophobicContact CD2-CE1 3.91Å; F185-R217 HydrophobicContact CB-CG 4.42Å; F185-R217 HydrophobicContact CD1-CG 3.74Å; F185-R217 HydrophobicContact CD2-CB 4.16Å; F185-R217 HydrophobicContact CD2-CG 3.56Å; F185-R217 HydrophobicContact CE1-CG 3.8Å; F185-R217 HydrophobicContact CE2-CB 4.14Å; F185-R217 HydrophobicContact CE2-CG 3.63Å; F185-R217 HydrophobicContact CG-CG 3.61Å; F185-R217 HydrophobicContact CZ-CG 3.75Å; F185-R218 HydrophobicContact CE2-CG 3.73Å; F185-R218 HydrophobicContact CZ-CG 4.27Å; F185-W221 HydrophobicContact CE1-CB 4.32Å; F185-W221 HydrophobicContact CE1-CG 4.23Å; F185-W221 HydrophobicContact CZ-CB 4.02Å; F185-W221 HydrophobicContact CZ-CG 4.14Å
186H96.8Very high97.8Very high120 Ų12083 Ų8356%0.55637%0.368SS*.Hα-helixtrans-69.3-39.2174.7-69.290.6000111.2E182 K183 E184E182-H186 PolarHBondContact O-N 3.31Å; E182-H186 PolarHBondContact O-ND1 3.09Å; K183-H186 PolarHBondContact O-N 3.2Å; E184-H186 VanDerWaalsContact C-N 3.35Å; E184-H186 PolarHBondContact O-N 2.9Å
187F97.5Very high97.9Very high163 Ų16379.1 Ų79.172%0.71535%0.351SS*.Hα-helixtrans-61.8-50.3174.1179.5-104.1000111.7K183 E184K183-F187 PolarHBondContact O-N 2.8Å; E184-F187 PolarHBondContact O-N 3.44Å
188N95.8Very high97.9Very high71 Ų7180.8 Ų80.838%0.3836%0.359SS..  trans-147.8120.3174.3-169.1-12.3000111.5E184 F185 Y190E184-N188 PolarHBondContact O-N 3.45Å; F185-N188 CarbonylContact O-C 3.27Å; F185-N188 VanDerWaalsContact O-C 3.27Å; N188-Y190 PolarHBondContact ND2-O 3.2Å; N188-Y190 PolarHBondContact O-N 2.92Å; N188-Y190 PolarHBondContact OD1-N 2.84Å; N188-Y190 PolarHBondContact OD1-O 3.31Å
189R96.8Very high97.9Very high101 Ų10179 Ų7938%0.38135%0.348SS..SBendtrans-64-15.7179.4-68.2170.1170.573.3-2.1113.1F185 R218F185-R189 HydrophobicContact CE1-CG 4.24Å; F185-R189 HydrophobicContact CE2-CB 4.09Å; F185-R189 HydrophobicContact CE2-CG 4.17Å; F185-R189 HydrophobicContact CZ-CB 4.29Å; F185-R189 HydrophobicContact CZ-CG 3.92Å; F185-R189 PolarHBondContact O-N 3.18Å; R189-R218 WeakPolarHBondContact O-CD 3.39Å
190Y97.9Very high97.9Very high142 Ų14275.6 Ų75.656%0.55733%0.331SS*.SBendtrans-133126.9-178.9-65-99.3000111.1N188N188-Y190 PolarHBondContact ND2-O 3.2Å; N188-Y190 PolarHBondContact O-N 2.92Å; N188-Y190 PolarHBondContact OD1-N 2.84Å; N188-Y190 PolarHBondContact OD1-O 3.31Å
191L97.9Very high97.9Very high27 Ų2779.4 Ų79.414%0.14135%0.348CS..  trans-90.3137.4178.7-61.3179.7000112.7R195 R196 I199 I210 F214L191-R195 HydrophobicContact CD2-CG 3.91Å; L191-R196 HydrophobicContact CB-CB 4.5Å; L191-R196 HydrophobicContact CD1-CB 4.47Å; L191-R196 PolarHBondContact O-NH2 3.07Å; L191-I199 HydrophobicContact CD1-CD1 3.79Å; L191-I199 HydrophobicContact CD2-CD1 3.77Å; L191-I199 HydrophobicContact CG-CD1 4.44Å; L191-I210 HydrophobicContact CD1-CG2 3.5Å; L191-F214 HydrophobicContact CD1-CD1 4.17Å; L191-F214 HydrophobicContact CD1-CD2 3.65Å; L191-F214 HydrophobicContact CD1-CE1 3.96Å; L191-F214 HydrophobicContact CD1-CE2 3.44Å; L191-F214 VanDerWaalsContact CD1-CE2 3.44Å; L191-F214 HydrophobicContact CD1-CG 4.02Å; L191-F214 HydrophobicContact CD1-CZ 3.61Å; L191-F214 HydrophobicContact CD2-CE1 3.75Å; L191-F214 HydrophobicContact CD2-CE2 4.4Å; L191-F214 HydrophobicContact CD2-CZ 3.7Å; L191-F214 HydrophobicContact CG-CD1 3.82Å; L191-F214 HydrophobicContact CG-CD2 4.22Å; L191-F214 HydrophobicContact CG-CE1 3.53Å; L191-F214 HydrophobicContact CG-CE2 3.99Å; L191-F214 HydrophobicContact CG-CG 4.16Å; L191-F214 HydrophobicContact CG-CZ 3.64Å
192T98.4Very high97.9Very high85 Ų8584.5 Ų84.552%0.52138%0.38SS..  trans-69.1169.9163.5660000111R195 R196T192-R195 WeakPolarHBondContact OG1-CB 3.43Å; T192-R195 PolarHBondContact OG1-N 2.99Å; T192-R196 WeakPolarHBondContact O-CB 3.33Å; T192-R196 PolarHBondContact O-N 2.9Å
193R98.1Very high97.9Very high140 Ų14081.5 Ų81.553%0.52837%0.366SS..Hα-helixtrans-62-48.7176.4179.566.4177.191.2-9.2111.2R196 I197 E207R193-R196 WeakPolarHBondContact O-CB 3.46Å; R193-R196 PolarHBondContact O-N 3.22Å; R193-I197 WeakPolarHBondContact O-CG1 3.34Å; R193-I197 PolarHBondContact O-N 2.91Å; R193-E207 IonicContact CZ-OE1 3.21Å; R193-E207 IonicContact CZ-OE2 3.02Å; R193-E207 IonicContact NE-OE2 3.76Å; R193-E207 IonicContact NH1-OE1 2.84Å; R193-E207 PolarHBondContact NH1-OE1 3.01Å; R193-E207 IonicContact NH1-OE2 2.7Å; R193-E207 PolarHBondContact NH1-OE2 3.34Å; R193-E207 IonicContact NH2-OE1 2.8Å; R193-E207 PolarHBondContact NH2-OE1 3.45Å; R193-E207 IonicContact NH2-OE2 3.26Å; R193-E207 PolarHBondContact NH2-OE2 3.06Å
194R98.1Very high97.9Very high186 Ų18681.7 Ų81.770%0.70238%0.377SS*.Hα-helixtrans-60.6-51.1-179.5178.2177.5170.2165.22.5111.5R196 I197 E198R194-R196 PolarHBondContact O-N 3.31Å; R194-I197 WeakPolarHBondContact O-CB 3.25Å; R194-I197 PolarHBondContact O-N 3.45Å; R194-E198 WeakPolarHBondContact CG-OE1 3.41Å; R194-E198 IonicContact CZ-OE1 3.97Å; R194-E198 IonicContact NE-OE1 3.04Å; R194-E198 PolarHBondContact NE-OE1 3.26Å; R194-E198 PolarHBondContact O-N 3.42Å
195R98.4Very high97.9Very high86 Ų8681.9 Ų81.933%0.32538%0.379SS..Hα-helixtrans-60.7-35.3-178.5-172.455.8175.3178.8-1.3112.9E184 L191 T192 I197 E198 I199E184-R195 IonicContact OE1-CZ 3.67Å; E184-R195 IonicContact OE1-NE 3.99Å; E184-R195 IonicContact OE1-NH2 2.67Å; E184-R195 PolarHBondContact OE1-NH2 3.23Å; E184-R195 IonicContact OE2-CZ 3.38Å; E184-R195 IonicContact OE2-NE 2.85Å; E184-R195 PolarHBondContact OE2-NE 3.34Å; E184-R195 IonicContact OE2-NH2 3.12Å; E184-R195 PolarHBondContact OE2-NH2 3.04Å; E184-R195 VanDerWaalsContact OE2-NH2 3.12Å; L191-R195 HydrophobicContact CD2-CG 3.91Å; T192-R195 WeakPolarHBondContact OG1-CB 3.43Å; T192-R195 PolarHBondContact OG1-N 2.99Å; R195-I197 VanDerWaalsContact C-N 3.32Å; R195-I197 PolarHBondContact O-N 2.99Å; R195-E198 VanDerWaalsContact CD-OE2 3.25Å; R195-E198 WeakPolarHBondContact CD-OE2 3.37Å; R195-E198 IonicContact CZ-OE2 3.82Å; R195-E198 IonicContact NE-OE2 3.89Å; R195-E198 IonicContact NH1-OE2 2.82Å; R195-E198 PolarHBondContact NH1-OE2 3.46Å; R195-E198 PolarHBondContact O-N 3.24Å; R195-I199 HydrophobicContact CG-CD1 3.88Å; R195-I199 HydrophobicContact CG-CG1 4.45Å; R195-I199 WeakPolarHBondContact O-CG1 3.16Å; R195-I199 PolarHBondContact O-N 2.7Å
196R98.4Very high97.9Very high53 Ų5384.4 Ų84.420%0.240%0.397CS..Hα-helixtrans-62.4-37.2175-171.9-166.3-39.8-123.5-8.2113L191 T192 R193 R194 A200 E207 I210L191-R196 HydrophobicContact CB-CB 4.5Å; L191-R196 HydrophobicContact CD1-CB 4.47Å; L191-R196 PolarHBondContact O-NH2 3.07Å; T192-R196 WeakPolarHBondContact O-CB 3.33Å; T192-R196 PolarHBondContact O-N 2.9Å; R193-R196 WeakPolarHBondContact O-CB 3.46Å; R193-R196 PolarHBondContact O-N 3.22Å; R194-R196 PolarHBondContact O-N 3.31Å; R196-A200 WeakPolarHBondContact O-CB 3.34Å; R196-A200 PolarHBondContact O-N 2.84Å; R196-A200 VanDerWaalsContact O-N 3.07Å; R196-E207 HydrophobicContact CG-CB 4.34Å; R196-I210 HydrophobicContact CG-CB 4.18Å; R196-I210 HydrophobicContact CG-CG2 3.96Å
197I98.6Very high98Very high56 Ų5681.7 Ų81.729%0.28738%0.384SS..Hα-helixtrans-63.8-51.5175.4-60.3169000108.9R193 R194 R195 I199 A200 H201R193-I197 WeakPolarHBondContact O-CG1 3.34Å; R193-I197 PolarHBondContact O-N 2.91Å; R194-I197 WeakPolarHBondContact O-CB 3.25Å; R194-I197 PolarHBondContact O-N 3.45Å; R195-I197 VanDerWaalsContact C-N 3.32Å; R195-I197 PolarHBondContact O-N 2.99Å; I197-I199 PolarHBondContact O-N 3.04Å; I197-A200 WeakPolarHBondContact O-CB 3.45Å; I197-A200 PolarHBondContact O-N 3.36Å; I197-A200 VanDerWaalsContact O-N 3.12Å; I197-H201 VanDerWaalsContact CG2-CD2 3.42Å; I197-H201 WeakPolarHBondContact CG2-CD2 3.38Å; I197-H201 VanDerWaalsContact CG2-NE2 3.28Å; I197-H201 WeakPolarHBondContact CG2-NE2 3.46Å; I197-H201 PolarHBondContact O-CD2 3.22Å; I197-H201 PolarHBondContact O-N 2.78Å; I197-H201 VanDerWaalsContact O-N 3.07Å
198E98.4Very high98Very high65 Ų6582 Ų8230%0.30438%0.381SS..Hα-helixtrans-55-50.6-178-65.1168.7-174.400111.2R194 R195 A200 H201 T202R194-E198 WeakPolarHBondContact CG-OE1 3.41Å; R194-E198 IonicContact CZ-OE1 3.97Å; R194-E198 IonicContact NE-OE1 3.04Å; R194-E198 PolarHBondContact NE-OE1 3.26Å; R194-E198 PolarHBondContact O-N 3.42Å; R195-E198 VanDerWaalsContact CD-OE2 3.25Å; R195-E198 WeakPolarHBondContact CD-OE2 3.37Å; R195-E198 IonicContact CZ-OE2 3.82Å; R195-E198 IonicContact NE-OE2 3.89Å; R195-E198 IonicContact NH1-OE2 2.82Å; R195-E198 PolarHBondContact NH1-OE2 3.46Å; R195-E198 PolarHBondContact O-N 3.24Å; E198-A200 PolarHBondContact O-N 3.27Å; E198-H201 PolarHBondContact O-N 2.79Å; E198-T202 PolarHBondContact O-N 3.24Å; E198-T202 VanDerWaalsContact O-N 3.13Å; E198-T202 PolarHBondContact O-OG1 3.32Å; E198-T202 VanDerWaalsContact O-OG1 3.08Å
199I98.3Very high98.1Very high8 Ų881.6 Ų81.64%0.04138%0.376CS..Hα-helixtrans-65.1-39.1179.3-61.6164.2000111.7L181 E184 L191 R195 I197 H201 T202 L203 I210L181-I199 HydrophobicContact CD2-CG2 4.21Å; E184-I199 HydrophobicContact CB-CD1 4.03Å; E184-I199 HydrophobicContact CG-CD1 3.66Å; E184-I199 HydrophobicContact CG-CG1 4.06Å; L191-I199 HydrophobicContact CD1-CD1 3.79Å; L191-I199 HydrophobicContact CD2-CD1 3.77Å; L191-I199 HydrophobicContact CG-CD1 4.44Å; R195-I199 HydrophobicContact CG-CD1 3.88Å; R195-I199 HydrophobicContact CG-CG1 4.45Å; R195-I199 WeakPolarHBondContact O-CG1 3.16Å; R195-I199 PolarHBondContact O-N 2.7Å; I197-I199 PolarHBondContact O-N 3.04Å; I199-H201 VanDerWaalsContact C-N 3.33Å; I199-H201 PolarHBondContact O-N 2.8Å; I199-T202 PolarHBondContact O-N 2.91Å; I199-L203 HydrophobicContact CG2-CD1 3.63Å; I199-L203 HydrophobicContact CG2-CG 4.09Å; I199-L203 WeakPolarHBondContact O-CB 3.22Å; I199-L203 WeakPolarHBondContact O-CG 3.36Å; I199-L203 PolarHBondContact O-N 2.92Å; I199-I210 HydrophobicContact CG2-CD1 3.88Å
200A98.4Very high98.2Very high7 Ų776.8 Ų76.86%0.05836%0.358CS..Hα-helixtrans-58.7-44.817900000111.7R196 I197 E198 V204 L205 E207 I210R196-A200 WeakPolarHBondContact O-CB 3.34Å; R196-A200 PolarHBondContact O-N 2.84Å; R196-A200 VanDerWaalsContact O-N 3.07Å; I197-A200 WeakPolarHBondContact O-CB 3.45Å; I197-A200 PolarHBondContact O-N 3.36Å; I197-A200 VanDerWaalsContact O-N 3.12Å; E198-A200 PolarHBondContact O-N 3.27Å; A200-V204 WeakPolarHBondContact O-CA 3.43Å; A200-V204 PolarHBondContact O-N 3.48Å; A200-V204 VanDerWaalsContact O-N 3.08Å; A200-L205 CarbonylContact C-O 3.48Å; A200-L205 WeakPolarHBondContact CA-O 3.4Å; A200-L205 WeakPolarHBondContact CB-O 3.42Å; A200-L205 PolarHBondContact O-N 2.98Å; A200-L205 VanDerWaalsContact O-O 3.1Å; A200-E207 HydrophobicContact CB-CG 4.25Å; A200-I210 HydrophobicContact CB-CG1 4.1Å
201H98.4Very high98.2Very high143 Ų14375.5 Ų75.566%0.66236%0.356SS*.Hα-helixtrans-66.5-47.3176.7-68.1-66.9000112.1I197 E198 I199 L203 V204I197-H201 VanDerWaalsContact CG2-CD2 3.42Å; I197-H201 WeakPolarHBondContact CG2-CD2 3.38Å; I197-H201 VanDerWaalsContact CG2-NE2 3.28Å; I197-H201 WeakPolarHBondContact CG2-NE2 3.46Å; I197-H201 PolarHBondContact O-CD2 3.22Å; I197-H201 PolarHBondContact O-N 2.78Å; I197-H201 VanDerWaalsContact O-N 3.07Å; E198-H201 PolarHBondContact O-N 2.79Å; I199-H201 VanDerWaalsContact C-N 3.33Å; I199-H201 PolarHBondContact O-N 2.8Å; H201-L203 VanDerWaalsContact C-N 3.3Å; H201-L203 PolarHBondContact O-N 3.13Å; H201-V204 PolarHBondContact O-N 3.03Å
202T97.9Very high98.2Very high108 Ų10877 Ų7766%0.66336%0.363SS*.Hα-helixtrans-61.8-37.1-178.4-55.20000112.7E198 I199E198-T202 PolarHBondContact O-N 3.24Å; E198-T202 VanDerWaalsContact O-N 3.13Å; E198-T202 PolarHBondContact O-OG1 3.32Å; E198-T202 VanDerWaalsContact O-OG1 3.08Å; I199-T202 PolarHBondContact O-N 2.91Å
203L97.9Very high98.2Very high9 Ų974.4 Ų74.45%0.04734%0.344CS..Hα-helixtrans-95.4-1.9-176.5-58.8-173.1000113.9Q177 E180 L181 I199 H201 L205Q177-L203 HydrophobicContact CG-CB 4.34Å; Q177-L203 PolarHBondContact NE2-O 2.85Å; E180-L203 HydrophobicContact CB-CD1 4.08Å; E180-L203 HydrophobicContact CB-CD2 3.63Å; E180-L203 HydrophobicContact CB-CG 4.43Å; E180-L203 HydrophobicContact CG-CD2 3.91Å; L181-L203 HydrophobicContact CD1-CD1 4.4Å; L181-L203 HydrophobicContact CD2-CD1 3.84Å; L181-L203 HydrophobicContact CG-CD1 3.67Å; I199-L203 HydrophobicContact CG2-CD1 3.63Å; I199-L203 HydrophobicContact CG2-CG 4.09Å; I199-L203 WeakPolarHBondContact O-CB 3.22Å; I199-L203 WeakPolarHBondContact O-CG 3.36Å; I199-L203 PolarHBondContact O-N 2.92Å; H201-L203 VanDerWaalsContact C-N 3.3Å; H201-L203 PolarHBondContact O-N 3.13Å; L203-L205 VanDerWaalsContact C-N 3.27Å; L203-L205 HydrophobicContact CB-CD1 4.15Å; L203-L205 HydrophobicContact CB-CG 4.16Å; L203-L205 PolarHBondContact O-N 2.91Å
204V98.3Very high98.2Very high128 Ų12868.1 Ų68.178%0.77632%0.32SS*.THydrogen-bonded Turntrans53.447.9-174.7-162.70000110.8A200 H201A200-V204 WeakPolarHBondContact O-CA 3.43Å; A200-V204 PolarHBondContact O-N 3.48Å; A200-V204 VanDerWaalsContact O-N 3.08Å; H201-V204 PolarHBondContact O-N 3.03Å
205L97.6Very high98.2Very high18 Ų1863.2 Ų63.29%0.09431%0.305CS..  trans-124148.4177.3-67178.8000109.5Y173 L181 A200 L203 Q209 I210Y173-L205 HydrophobicContact CD1-CD1 4.12Å; Y173-L205 HydrophobicContact CD1-CD2 3.88Å; Y173-L205 HydrophobicContact CE1-CD1 4.04Å; Y173-L205 HydrophobicContact CE1-CD2 3.69Å; L181-L205 HydrophobicContact CD1-CD1 4.28Å; A200-L205 CarbonylContact C-O 3.48Å; A200-L205 WeakPolarHBondContact CA-O 3.4Å; A200-L205 WeakPolarHBondContact CB-O 3.42Å; A200-L205 PolarHBondContact O-N 2.98Å; A200-L205 VanDerWaalsContact O-O 3.1Å; L203-L205 VanDerWaalsContact C-N 3.27Å; L203-L205 HydrophobicContact CB-CD1 4.15Å; L203-L205 HydrophobicContact CB-CG 4.16Å; L203-L205 PolarHBondContact O-N 2.91Å; L205-Q209 HydrophobicContact CB-CB 4.37Å; L205-I210 HydrophobicContact CB-CD1 3.89Å; L205-I210 HydrophobicContact CB-CG1 4.41Å; L205-I210 HydrophobicContact CD1-CD1 3.91Å
206S98.4Very high98.2Very high56 Ų5663.8 Ų63.839%0.39232%0.315SS..  trans-67.1149.2172.565.40000111.5R208 Q209 I210S206-R208 PolarHBondContact O-N 3.02Å; S206-Q209 WeakPolarHBondContact O-CA 3.38Å; S206-Q209 WeakPolarHBondContact O-CB 2.96Å; S206-Q209 PolarHBondContact O-N 2.95Å; S206-Q209 VanDerWaalsContact OG-CG 3.3Å; S206-Q209 WeakPolarHBondContact OG-CG 3.24Å; S206-Q209 PolarHBondContact OG-N 2.94Å; S206-Q209 PolarHBondContact OG-OE1 2.89Å; S206-I210 PolarHBondContact O-N 3.43Å; S206-I210 VanDerWaalsContact O-N 3.09Å
207E98.4Very high98.2Very high64 Ų6463.2 Ų63.230%0.29931%0.313SS..Hα-helixtrans-53-31.8173-66.6-167.5-142.600113.3R193 R196 A200 K211R193-E207 IonicContact CZ-OE1 3.21Å; R193-E207 IonicContact CZ-OE2 3.02Å; R193-E207 IonicContact NE-OE2 3.76Å; R193-E207 IonicContact NH1-OE1 2.84Å; R193-E207 PolarHBondContact NH1-OE1 3.01Å; R193-E207 IonicContact NH1-OE2 2.7Å; R193-E207 PolarHBondContact NH1-OE2 3.34Å; R193-E207 IonicContact NH2-OE1 2.8Å; R193-E207 PolarHBondContact NH2-OE1 3.45Å; R193-E207 IonicContact NH2-OE2 3.26Å; R193-E207 PolarHBondContact NH2-OE2 3.06Å; R196-E207 HydrophobicContact CG-CB 4.34Å; A200-E207 HydrophobicContact CB-CG 4.25Å; E207-K211 WeakPolarHBondContact O-CB 3.44Å; E207-K211 PolarHBondContact O-N 2.71Å
208R97.7Very high98.1Very high170 Ų17063.5 Ų63.564%0.64231%0.31SS*.Hα-helixtrans-65.6-44.1176-176.2178.8-176-87.40.7111.1S206 K211 I212S206-R208 PolarHBondContact O-N 3.02Å; R208-K211 WeakPolarHBondContact O-CB 3.38Å; R208-K211 PolarHBondContact O-N 2.91Å; R208-I212 HydrophobicContact CG-CD1 3.88Å; R208-I212 WeakPolarHBondContact O-CB 3.28Å; R208-I212 VanDerWaalsContact O-CG1 3.28Å; R208-I212 WeakPolarHBondContact O-CG1 3.49Å; R208-I212 PolarHBondContact O-N 3.42Å
209Q98Very high98Very high61 Ų6164.6 Ų64.629%0.28532%0.316SS..Hα-helixtrans-62.3-46.4175.8-76.1162.7-54.900110.7L205 S206 K211 I212 W213L205-Q209 HydrophobicContact CB-CB 4.37Å; S206-Q209 WeakPolarHBondContact O-CA 3.38Å; S206-Q209 WeakPolarHBondContact O-CB 2.96Å; S206-Q209 PolarHBondContact O-N 2.95Å; S206-Q209 VanDerWaalsContact OG-CG 3.3Å; S206-Q209 WeakPolarHBondContact OG-CG 3.24Å; S206-Q209 PolarHBondContact OG-N 2.94Å; S206-Q209 PolarHBondContact OG-OE1 2.89Å; Q209-K211 VanDerWaalsContact C-N 3.31Å; Q209-K211 PolarHBondContact O-N 2.73Å; Q209-I212 PolarHBondContact O-N 3.28Å; Q209-W213 WeakPolarHBondContact O-CB 3.38Å; Q209-W213 PolarHBondContact O-N 3.06Å
210I98.4Very high97.8Very high0 Ų070.1 Ų70.10%034%0.34CS..Hα-helixtrans-56.7-46.5174.6-55.2-58.4000110.7L181 L191 R196 I199 A200 L205 S206 I212 W213 F214L181-I210 HydrophobicContact CD2-CD1 3.75Å; L191-I210 HydrophobicContact CD1-CG2 3.5Å; R196-I210 HydrophobicContact CG-CB 4.18Å; R196-I210 HydrophobicContact CG-CG2 3.96Å; I199-I210 HydrophobicContact CG2-CD1 3.88Å; A200-I210 HydrophobicContact CB-CG1 4.1Å; L205-I210 HydrophobicContact CB-CD1 3.89Å; L205-I210 HydrophobicContact CB-CG1 4.41Å; L205-I210 HydrophobicContact CD1-CD1 3.91Å; S206-I210 PolarHBondContact O-N 3.43Å; S206-I210 VanDerWaalsContact O-N 3.09Å; I210-I212 PolarHBondContact O-N 3.26Å; I210-W213 PolarHBondContact O-N 3.26Å; I210-F214 HydrophobicContact CG2-CD2 4.09Å; I210-F214 HydrophobicContact CG2-CE2 4.3Å; I210-F214 WeakPolarHBondContact O-CD2 3.44Å; I210-F214 PolarHBondContact O-N 3.37Å
211K97.9Very high97.6Very high116 Ų11673.7 Ų73.750%0.50435%0.352SS..Hα-helixtrans-58.9-47.8177.6-174.6177.372.5178.20112.3E207 R208 Q209 Q215E207-K211 WeakPolarHBondContact O-CB 3.44Å; E207-K211 PolarHBondContact O-N 2.71Å; R208-K211 WeakPolarHBondContact O-CB 3.38Å; R208-K211 PolarHBondContact O-N 2.91Å; Q209-K211 VanDerWaalsContact C-N 3.31Å; Q209-K211 PolarHBondContact O-N 2.73Å; K211-Q215 WeakPolarHBondContact O-CB 3.46Å; K211-Q215 PolarHBondContact O-N 2.91Å
212I98.1Very high97.3Very high57 Ų5772.9 Ų72.929%0.29235%0.347SS..Hα-helixtrans-65.8-43-179.2-70.7168.7000110.1R208 Q209 I210 Q215 N216R208-I212 HydrophobicContact CG-CD1 3.88Å; R208-I212 WeakPolarHBondContact O-CB 3.28Å; R208-I212 VanDerWaalsContact O-CG1 3.28Å; R208-I212 WeakPolarHBondContact O-CG1 3.49Å; R208-I212 PolarHBondContact O-N 3.42Å; Q209-I212 PolarHBondContact O-N 3.28Å; I210-I212 PolarHBondContact O-N 3.26Å; I212-Q215 WeakPolarHBondContact O-CB 3.42Å; I212-Q215 PolarHBondContact O-N 3.46Å; I212-N216 VanDerWaalsContact O-CG 3.28Å; I212-N216 PolarHBondContact O-N 3.45Å
213W98.4Very high97Very high31 Ų3174.8 Ų74.812%0.11735%0.346CS..Hα-helixtrans-60.3-49.1178.5-168.8100.8000111.3Y173 L181 E182 F185 Q209 I210 Q215 N216 R217Y173-W213 AromaticContact CD2-CD1 3.86Å; Y173-W213 AromaticContact CE2-CD1 3.63Å; L181-W213 HydrophobicContact CB-CD2 3.93Å; L181-W213 HydrophobicContact CB-CE3 3.92Å; L181-W213 HydrophobicContact CB-CH2 3.62Å; L181-W213 HydrophobicContact CB-CZ2 3.61Å; L181-W213 HydrophobicContact CB-CZ3 3.77Å; L181-W213 HydrophobicContact CD1-CD2 3.87Å; L181-W213 HydrophobicContact CD1-CG 3.84Å; L181-W213 HydrophobicContact CD1-CZ2 4.5Å; L181-W213 HydrophobicContact CD2-CD2 4.37Å; L181-W213 HydrophobicContact CD2-CE3 4.28Å; L181-W213 HydrophobicContact CG-CD2 4.28Å; L181-W213 HydrophobicContact CG-CE3 4.48Å; L181-W213 WeakPolarHBondContact O-CH2 3.33Å; L181-W213 WeakPolarHBondContact O-CZ3 3.49Å; E182-W213 HydrophobicContact CG-CH2 3.91Å; E182-W213 HydrophobicContact CG-CZ2 3.99Å; F185-W213 HydrophobicContact CB-CH2 4.39Å; F185-W213 HydrophobicContact CB-CZ3 4.09Å; Q209-W213 WeakPolarHBondContact O-CB 3.38Å; Q209-W213 PolarHBondContact O-N 3.06Å; I210-W213 PolarHBondContact O-N 3.26Å; W213-Q215 VanDerWaalsContact C-N 3.29Å; W213-Q215 PolarHBondContact O-N 3.48Å; W213-N216 PolarHBondContact O-N 2.86Å; W213-R217 HydrophobicContact CE3-CB 3.96Å; W213-R217 HydrophobicContact CH2-CB 4.07Å; W213-R217 HydrophobicContact CH2-CG 3.79Å; W213-R217 HydrophobicContact CZ3-CB 3.69Å; W213-R217 HydrophobicContact CZ3-CG 3.74Å; W213-R217 WeakPolarHBondContact O-CB 3.31Å; W213-R217 PolarHBondContact O-N 3.25Å
214F98.6Very high96.4Very high8 Ų878.9 Ų78.94%0.03537%0.368CS..Hα-helixtrans-63.7-33.2177.1-92-103.5000112.9L181 E184 F185 L191 I210 R218L181-F214 HydrophobicContact CD2-CE2 4.06Å; E184-F214 HydrophobicContact CB-CZ 4.03Å; F185-F214 HydrophobicContact CB-CE1 4.18Å; F185-F214 HydrophobicContact CB-CZ 4.29Å; F185-F214 AromaticContact CD2-CD1 3.97Å; F185-F214 HydrophobicContact CD2-CD1 3.97Å; F185-F214 AromaticContact CD2-CE1 3.91Å; F185-F214 HydrophobicContact CD2-CE1 3.91Å; L191-F214 HydrophobicContact CD1-CD1 4.17Å; L191-F214 HydrophobicContact CD1-CD2 3.65Å; L191-F214 HydrophobicContact CD1-CE1 3.96Å; L191-F214 HydrophobicContact CD1-CE2 3.44Å; L191-F214 VanDerWaalsContact CD1-CE2 3.44Å; L191-F214 HydrophobicContact CD1-CG 4.02Å; L191-F214 HydrophobicContact CD1-CZ 3.61Å; L191-F214 HydrophobicContact CD2-CE1 3.75Å; L191-F214 HydrophobicContact CD2-CE2 4.4Å; L191-F214 HydrophobicContact CD2-CZ 3.7Å; L191-F214 HydrophobicContact CG-CD1 3.82Å; L191-F214 HydrophobicContact CG-CD2 4.22Å; L191-F214 HydrophobicContact CG-CE1 3.53Å; L191-F214 HydrophobicContact CG-CE2 3.99Å; L191-F214 HydrophobicContact CG-CG 4.16Å; L191-F214 HydrophobicContact CG-CZ 3.64Å; I210-F214 HydrophobicContact CG2-CD2 4.09Å; I210-F214 HydrophobicContact CG2-CE2 4.3Å; I210-F214 WeakPolarHBondContact O-CD2 3.44Å; I210-F214 PolarHBondContact O-N 3.37Å; F214-R218 WeakPolarHBondContact O-CB 3.29Å; F214-R218 WeakPolarHBondContact O-CG 3.42Å; F214-R218 PolarHBondContact O-N 2.9Å; F214-R218 PolarHBondContact O-NE 3.21Å
215Q98.2Very high95.7Very high83 Ų8378.2 Ų78.239%0.38836%0.356SS..Hα-helixtrans-65.6-48.6173.2-173.86351.600111.1K211 I212 W213 R217 R218 M219K211-Q215 WeakPolarHBondContact O-CB 3.46Å; K211-Q215 PolarHBondContact O-N 2.91Å; I212-Q215 WeakPolarHBondContact O-CB 3.42Å; I212-Q215 PolarHBondContact O-N 3.46Å; W213-Q215 VanDerWaalsContact C-N 3.29Å; W213-Q215 PolarHBondContact O-N 3.48Å; Q215-R217 VanDerWaalsContact C-N 3.34Å; Q215-R217 PolarHBondContact O-N 2.96Å; Q215-R218 PolarHBondContact O-N 2.83Å; Q215-M219 WeakPolarHBondContact O-CG 3.38Å; Q215-M219 PolarHBondContact O-N 3.49Å; Q215-M219 VanDerWaalsContact O-N 3.09Å
216N97.8Very high94.1Very high99 Ų9984.6 Ų84.653%0.52938%0.383SS..Hα-helixtrans-62-43177.7-68.8-16.1000111.2I212 W213 R218 M219 K220I212-N216 VanDerWaalsContact O-CG 3.28Å; I212-N216 PolarHBondContact O-N 3.45Å; W213-N216 PolarHBondContact O-N 2.86Å; N216-R218 PolarHBondContact O-N 3.31Å; N216-M219 PolarHBondContact O-N 3.09Å; N216-K220 PolarHBondContact O-N 2.87Å
217R98.1Very high92.4Very high40 Ų4089.2 Ų89.215%0.15140%0.402CS..Hα-helixtrans-62.8-42.3179.6-17464.9-173.1108-7.7112F185 W213 Q215 K220 W221F185-R217 HydrophobicContact CB-CG 4.42Å; F185-R217 HydrophobicContact CD1-CG 3.74Å; F185-R217 HydrophobicContact CD2-CB 4.16Å; F185-R217 HydrophobicContact CD2-CG 3.56Å; F185-R217 HydrophobicContact CE1-CG 3.8Å; F185-R217 HydrophobicContact CE2-CB 4.14Å; F185-R217 HydrophobicContact CE2-CG 3.63Å; F185-R217 HydrophobicContact CG-CG 3.61Å; F185-R217 HydrophobicContact CZ-CG 3.75Å; W213-R217 HydrophobicContact CE3-CB 3.96Å; W213-R217 HydrophobicContact CH2-CB 4.07Å; W213-R217 HydrophobicContact CH2-CG 3.79Å; W213-R217 HydrophobicContact CZ3-CB 3.69Å; W213-R217 HydrophobicContact CZ3-CG 3.74Å; W213-R217 WeakPolarHBondContact O-CB 3.31Å; W213-R217 PolarHBondContact O-N 3.25Å; Q215-R217 VanDerWaalsContact C-N 3.34Å; Q215-R217 PolarHBondContact O-N 2.96Å; R217-K220 PolarHBondContact O-N 3.3Å; R217-W221 WeakPolarHBondContact O-CB 3.35Å; R217-W221 PolarHBondContact O-N 3.49Å
218R97.3Very high90.1Very high63 Ų6392.4 Ų92.424%0.23843%0.429CS..Hα-helixtrans-63.6-39.7173.6-76.2-173.3-71.5139.8-0.8112.6F185 R189 F214 Q215 N216 W221 K222F185-R218 HydrophobicContact CE2-CG 3.73Å; F185-R218 HydrophobicContact CZ-CG 4.27Å; R189-R218 WeakPolarHBondContact O-CD 3.39Å; F214-R218 WeakPolarHBondContact O-CB 3.29Å; F214-R218 WeakPolarHBondContact O-CG 3.42Å; F214-R218 PolarHBondContact O-N 2.9Å; F214-R218 PolarHBondContact O-NE 3.21Å; Q215-R218 PolarHBondContact O-N 2.83Å; N216-R218 PolarHBondContact O-N 3.31Å; R218-W221 PolarHBondContact O-N 2.78Å; R218-K222 WeakPolarHBondContact O-CB 3.13Å; R218-K222 PolarHBondContact O-N 3.35Å
219M96Very high87.6Confident88 Ų8890.9 Ų90.943%0.43343%0.433SS..Hα-helixtrans-64-43.2176.4-66.6-63.2-90.200111.6Q215 N216 K222 K223Q215-M219 WeakPolarHBondContact O-CG 3.38Å; Q215-M219 PolarHBondContact O-N 3.49Å; Q215-M219 VanDerWaalsContact O-N 3.09Å; N216-M219 PolarHBondContact O-N 3.09Å; M219-K222 PolarHBondContact O-N 3.4Å; M219-K223 PolarHBondContact O-N 2.81Å; M219-K223 VanDerWaalsContact O-N 3.13Å
220K94.7Very high85.4Confident124 Ų12493.8 Ų93.854%0.53946%0.455SS..Hα-helixtrans-62.3-49.8173.7-178.9176179.3-1720111.4N216 R217 K222 K223 D224N216-K220 PolarHBondContact O-N 2.87Å; R217-K220 PolarHBondContact O-N 3.3Å; K220-K222 VanDerWaalsContact C-N 3.31Å; K220-K222 PolarHBondContact O-N 3.05Å; K220-K223 WeakPolarHBondContact O-CA 3.16Å; K220-K223 WeakPolarHBondContact O-CB 3.37Å; K220-K223 PolarHBondContact O-N 3.24Å; K220-D224 WeakPolarHBondContact CE-OD2 3.45Å; K220-D224 VanDerWaalsContact CG-OD2 3.25Å; K220-D224 WeakPolarHBondContact CG-OD2 3.07Å; K220-D224 VanDerWaalsContact O-CG 3.22Å; K220-D224 PolarHBondContact O-N 3.44Å
221W93.8Very high82.8Confident82 Ų82103.6 Ų103.631%0.31150%0.498SS..Hα-helixtrans-55.2-45.2177.1-176.482.3000112F185 R217 R218 K223 D224 H225F185-W221 HydrophobicContact CE1-CB 4.32Å; F185-W221 HydrophobicContact CE1-CG 4.23Å; F185-W221 HydrophobicContact CZ-CB 4.02Å; F185-W221 HydrophobicContact CZ-CG 4.14Å; R217-W221 WeakPolarHBondContact O-CB 3.35Å; R217-W221 PolarHBondContact O-N 3.49Å; R218-W221 PolarHBondContact O-N 2.78Å; W221-K223 VanDerWaalsContact C-N 3.27Å; W221-K223 PolarHBondContact O-N 3.05Å; W221-D224 PolarHBondContact O-N 3.47Å; W221-H225 AromaticContact CD1-CD2 3.21Å; W221-H225 AromaticContact CD1-NE2 3.33Å; W221-H225 VanDerWaalsContact CD1-NE2 3.33Å; W221-H225 AromaticContact CD2-CD2 3.88Å; W221-H225 AromaticContact CE2-CD2 3.5Å; W221-H225 VanDerWaalsContact CE2-CD2 3.5Å; W221-H225 AromaticContact CE2-CG 3.97Å; W221-H225 AromaticContact CE2-NE2 3.89Å; W221-H225 AromaticContact CG-CD2 3.71Å; W221-H225 AromaticContact NE1-CD2 3.03Å; W221-H225 PolarHBondContact NE1-CD2 3.45Å; W221-H225 AromaticContact NE1-CE1 3.87Å; W221-H225 AromaticContact NE1-CG 3.85Å; W221-H225 AromaticContact NE1-NE2 3.01Å; W221-H225 PolarHBondContact NE1-NE2 3.26Å; W221-H225 WeakPolarHBondContact O-CB 3.13Å; W221-H225 PolarHBondContact O-CD2 2.84Å; W221-H225 VanDerWaalsContact O-CD2 3.24Å; W221-H225 PolarHBondContact O-N 3.47Å
222K92.4Very high80.5Confident125 Ų125101.5 Ų101.554%0.54351%0.509SS..Hα-helixtrans-62.5-31.4175.3-174.7-178.366.1173.50113R218 M219 K220 K226R218-K222 WeakPolarHBondContact O-CB 3.13Å; R218-K222 PolarHBondContact O-N 3.35Å; M219-K222 PolarHBondContact O-N 3.4Å; K220-K222 VanDerWaalsContact C-N 3.31Å; K220-K222 PolarHBondContact O-N 3.05Å; K222-K226 WeakPolarHBondContact O-CG 3.32Å
223K91.3Very high77.9Confident148 Ų148110.1 Ų110.164%0.64354%0.538SS*.Hα-helixtrans-74.9-42.4176.8-175.2-177.6175.2-176.10111.4M219 K220 W221 K226M219-K223 PolarHBondContact O-N 2.81Å; M219-K223 VanDerWaalsContact O-N 3.13Å; K220-K223 WeakPolarHBondContact O-CA 3.16Å; K220-K223 WeakPolarHBondContact O-CB 3.37Å; K220-K223 PolarHBondContact O-N 3.24Å; W221-K223 VanDerWaalsContact C-N 3.27Å; W221-K223 PolarHBondContact O-N 3.05Å; K223-K226 WeakPolarHBondContact O-CD 3.42Å; K223-K226 WeakPolarHBondContact O-CG 3.48Å
224D85.9Confident75.5Confident95 Ų95114.4 Ų114.451%0.50857%0.573SS.*Hα-helixtrans-74.8-32.8-176-57.6-14.5000111.1K220 W221 K226K220-D224 WeakPolarHBondContact CE-OD2 3.45Å; K220-D224 VanDerWaalsContact CG-OD2 3.25Å; K220-D224 WeakPolarHBondContact CG-OD2 3.07Å; K220-D224 VanDerWaalsContact O-CG 3.22Å; K220-D224 PolarHBondContact O-N 3.44Å; W221-D224 PolarHBondContact O-N 3.47Å; D224-K226 VanDerWaalsContact C-N 3.35Å; D224-K226 PolarHBondContact O-N 2.93Å
225H82Confident73Confident115 Ų115118.7 Ų118.753%0.53261%0.61SS.*THydrogen-bonded Turntrans-95.232.9177.7-68-86.2000113.5W221 L227W221-H225 AromaticContact CD1-CD2 3.21Å; W221-H225 AromaticContact CD1-NE2 3.33Å; W221-H225 VanDerWaalsContact CD1-NE2 3.33Å; W221-H225 AromaticContact CD2-CD2 3.88Å; W221-H225 AromaticContact CE2-CD2 3.5Å; W221-H225 VanDerWaalsContact CE2-CD2 3.5Å; W221-H225 AromaticContact CE2-CG 3.97Å; W221-H225 AromaticContact CE2-NE2 3.89Å; W221-H225 AromaticContact CG-CD2 3.71Å; W221-H225 AromaticContact NE1-CD2 3.03Å; W221-H225 PolarHBondContact NE1-CD2 3.45Å; W221-H225 AromaticContact NE1-CE1 3.87Å; W221-H225 AromaticContact NE1-CG 3.85Å; W221-H225 AromaticContact NE1-NE2 3.01Å; W221-H225 PolarHBondContact NE1-NE2 3.26Å; W221-H225 WeakPolarHBondContact O-CB 3.13Å; W221-H225 PolarHBondContact O-CD2 2.84Å; W221-H225 VanDerWaalsContact O-CD2 3.24Å; W221-H225 PolarHBondContact O-N 3.47Å; H225-L227 PolarHBondContact O-N 3.23Å
226K65.1Low70.2Confident151 Ų151119.6 Ų119.666%0.65763%0.625SS**  trans-66.9101.7178.7-82.2175.2170.4-720111.6K222 K223 D224K222-K226 WeakPolarHBondContact O-CG 3.32Å; K223-K226 WeakPolarHBondContact O-CD 3.42Å; K223-K226 WeakPolarHBondContact O-CG 3.48Å; D224-K226 VanDerWaalsContact C-N 3.35Å; D224-K226 PolarHBondContact O-N 2.93Å
227L61.5Low67.5Low153 Ų153119.6 Ų119.680%0.80164%0.639SS**  trans-21.5135.3141.3-71.1144.6000111.9H225 N229H225-L227 PolarHBondContact O-N 3.23Å; L227-N229 PolarHBondContact O-N 3.24Å
228P50Low64.7Low132 Ų132123 Ų12386%0.85767%0.669SS**  trans-66102.7178.128.5-33.2000109
229N46.8Very low62Low138 Ų138125 Ų12574%0.73869%0.693SS**  trans-137.2101158.5-159.326.2000108.7L227L227-N229 PolarHBondContact O-N 3.24Å
230T50.3Low59.5Low121 Ų121129.7 Ų129.774%0.74271%0.714SS**  trans64.175150570000118.7
231K45.3Very low56.6Low206 Ų206130.6 Ų130.690%0.89672%0.72SS**  -121.3103.8128.8-166.177.4175.6-179.40106.7R233K231-R233 PolarHBondContact O-N 2.98Å
232G48.9Very low53.7Low72 Ų72134.1 Ų134.174%0.74274%0.744SS**  trans-60.8125.7179.700000111.6
233R43.3Very low51.2Low238 Ų238136 Ų13690%0.89876%0.755SS**  164.9103.5127.4-92.2179.6-174.1-130.71108.7K231K231-R233 PolarHBondContact O-N 2.98Å
234S48.5Very low48.4Very low121 Ų121133.9 Ų133.985%0.84676%0.758SS**  trans41.7103.5138.6-16.40000118.6
235A46.5Very low46.2Very low99 Ų99136.5 Ų136.582%0.81877%0.771SS**  trans-144.2108.9135.400000108.2
236S38.2Very low44.1Very low101 Ų101139.7 Ų139.771%0.70679%0.785SS**  trans7.4119.4172.660.80000119.7
237A42.2Very low42.9Very low99 Ų99142.2 Ų142.282%0.81880%0.797SS**  trans-56.7132.6142.600000109.9
238S38.8Very low41.8Very low111 Ų111142.6 Ų142.678%0.77680%0.799SS**  trans-133.997.6155.9-51.50000106.8
239S40Very low41Very low106 Ų106143.6 Ų143.674%0.74180%0.798SS**  trans-67.8130.8167-73.80000110.5
240Q43.3Very low40.7Very low187 Ų187145.9 Ų145.987%0.87480%0.804SS**  trans-148.680.5146.6-72.1-75.7-39.600104.9
241H35.5Very low40.5Very low143 Ų143146.4 Ų146.466%0.66281%0.807SS**  8.9109.1102-167.679.7000116.4
242L32.3Very low40.2Very low156 Ų156144.5 Ų144.582%0.81781%0.807SS**  trans-153.7120.7133.8-160.764.3000110.7
243Q39Very low39.9Very low165 Ų165148.4 Ų148.477%0.77181%0.809SS**  trans-93.4136.7164-74.6175.2-7.500109.2
244S32.7Very low40.2Very low102 Ų102143 Ų14371%0.71380%0.802SS**  trans-164.6106.7148.161.40000107.5
245I39.9Very low40.3Very low151 Ų151143 Ų14377%0.77480%0.798SS**  63.4107.189.1-63.3-73.5000112.4
246Q36.9Very low40.3Very low181 Ų181149.8 Ų149.885%0.84682%0.819SS**  trans142.2109.5142-88.7169.5-18.400112.8
247K40.1Very low40.4Very low205 Ų205152.3 Ų152.389%0.89183%0.825SS**  trans-171.470136.4-103171.4-173.8-176.80109.4
248D39Very low40.3Very low160 Ų160155.1 Ų155.186%0.85683%0.825SS**  trans-83.3114.2145.9-67.9-45.4000105.9
249N34.1Very low40.4Very low154 Ų154157.5 Ų157.582%0.82483%0.828SS**  trans-174.687.9162.3-101.1-7.2000107.8
250Q40Very low40.4Very low185 Ų185160.5 Ų160.586%0.86483%0.833SS**  trans179.5105.8136.3-147.795.348.500108.5
251T46.1Very low40.2Very low133 Ų133158.9 Ų158.982%0.81683%0.83SS**  trans173.486.113348.20000109.1
252D39.2Very low40.5Very low166 Ų166159.9 Ų159.989%0.88884%0.841SS**  trans-130.399.8149.8-86.8-35.2000106.9
253I43.2Very low41.1Very low154 Ų154160.2 Ų160.279%0.7984%0.843SS**  trans-138.6142.3157.5-74.3-164.5000105.8
254T48.4Very low41.3Very low124 Ų124159.8 Ų159.876%0.76185%0.849SS**  trans77.8125.9172.918.90000115.5
255T50.7Low42Very low122 Ų122164.7 Ų164.775%0.74886%0.86SS**  cis-164.2157.68.5-41.70000107.9
256L46Very low42.1Very low241 Ų241165.9 Ų165.9100%1.26287%0.868SS**  trans-46.50160-70.1162000113.5

Retrieved 256 of 256 residues in 232.6 ms (Link to these results)