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Mitochondrial fission regulator

Mitochondrial protein required for adaptation of miochondrial dynamics to metabolic changes. Regulates mitochondrial morphology at steady state and mediates AMPK-dependent stress-induced mitochondrial fragmentation via the control of OPA1 levels. Plays a role in mitochondrial aerobic respiration. Regulates mitochondrial organization and fission.

AlphaFold DB , UniProt , Accession A0A096MZ02, Species PAPAN (Papio anubis, Olive baboon), Gene MTFR1L, Length 292 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
1V36.8Very low46.6Very low198 Ų198129.4 Ų129.4100%1.278%0.776SS**  093.10-179.10000106.9
2L37.7Very low47.4Very low174 Ų174129.1 Ų129.191%0.91177%0.765SS**  trans-81.3115.4179.1-122.284.4000107.4M4L2-M4 PolarHBondContact O-N 3.05Å
3G37.1Very low47.9Very low76 Ų76136 Ų13678%0.78477%0.77SS**  trans-74113172.200000109.2E5G3-E5 PolarHBondContact O-N 3.44Å
4M41.1Very low48.5Very low187 Ų187136.6 Ų136.692%0.92176%0.763SS**  trans-62.4118.1173.9-72164.477.600108.8L2 A6L2-M4 PolarHBondContact O-N 3.05Å; M4-A6 PolarHBondContact O-N 2.97Å
5E42.8Very low48.8Very low178 Ų178136.6 Ų136.683%0.83276%0.761SS**  trans-52.5116.8167.4-173.2-161.2163.800108.2G3 S7G3-E5 PolarHBondContact O-N 3.44Å; E5-S7 PolarHBondContact O-N 3.08Å
6A50Low49.6Very low84 Ų84136.3 Ų136.369%0.69475%0.749SS**  trans-63.5102.3171.300000107.4M4 V8M4-A6 PolarHBondContact O-N 2.97Å; A6-V8 PolarHBondContact O-N 3.5Å
7S50.9Low50.2Low94 Ų94135.9 Ų135.966%0.65776%0.755SS**  trans-52.9104169.9540000108E5 T9E5-S7 PolarHBondContact O-N 3.08Å; S7-T9 PolarHBondContact O-N 3.19Å
8V54Low51Low124 Ų124133.8 Ų133.875%0.75274%0.738SS**  trans-68.487169.7-179.10000105.6A6 I10A6-V8 PolarHBondContact O-N 3.5Å; V8-I10 HydrophobicContact CG1-CG1 4.03Å; V8-I10 PolarHBondContact O-N 3.06Å
9T56Low51.6Low118 Ų118129.4 Ų129.472%0.72473%0.727SS**  trans-66.489.9170.3-57.60000106.5S7 P11S7-T9 PolarHBondContact O-N 3.19Å; T9-P11 WeakPolarHBondContact O-CD 3.11Å; T9-P11 VanDerWaalsContact O-N 3.13Å
10I51.3Low52.2Low126 Ų126128 Ų12865%0.64673%0.732SS**  trans-63.7113.3174.7-59.4171.1000105.9V8 I12V8-I10 HydrophobicContact CG1-CG1 4.03Å; V8-I10 PolarHBondContact O-N 3.06Å; I10-I12 PolarHBondContact O-N 2.99Å
11P55.2Low53.2Low64 Ų64127 Ų12742%0.41674%0.74SS.*  trans-60.9115.5174.524-31.3000107.6T9 W13 Q14T9-P11 WeakPolarHBondContact O-CD 3.11Å; T9-P11 VanDerWaalsContact O-N 3.13Å; P11-W13 PolarHBondContact O-N 3.15Å; P11-Q14 HydrophobicContact CG-CG 3.94Å; P11-Q14 PolarHBondContact O-N 3.38Å
12I56Low55.2Low126 Ų126122.5 Ų122.565%0.64670%0.701SS**THydrogen-bonded Turntrans-59.4-0.5-174.9-47.6165.4000112.7I10I10-I12 PolarHBondContact O-N 2.99Å
13W54.1Low57.5Low219 Ų219116.7 Ų116.783%0.8368%0.675SS**THydrogen-bonded Turntrans-102.9-9.8-179-54.494.6000113.9P11 N15P11-W13 PolarHBondContact O-N 3.15Å; W13-N15 PolarHBondContact O-N 3.04Å
14Q55.5Low59.9Low144 Ų144117.3 Ų117.367%0.67366%0.664SS**SBendtrans-73.6103.5173.9-82.1-161.525.400110P11 K16P11-Q14 HydrophobicContact CG-CG 3.94Å; P11-Q14 PolarHBondContact O-N 3.38Å; Q14-K16 PolarHBondContact O-N 2.96Å
15N54.2Low62.2Low137 Ų137114 Ų11473%0.73365%0.653SS**  trans5359.8158.6-62.3-47.5000115.9W13W13-N15 PolarHBondContact O-N 3.04Å
16K61.6Low64.2Low131 Ų131112.9 Ų112.957%0.5764%0.642SS**  trans-63.1124.8149.2-80.3159.7177.9164.40107.4Q14 H18Q14-K16 PolarHBondContact O-N 2.96Å; K16-H18 PolarHBondContact O-CE1 3.48Å; K16-H18 VanDerWaalsContact O-CE1 3.32Å; K16-H18 PolarHBondContact O-N 2.84Å; K16-H18 PolarHBondContact O-ND1 2.88Å
17P59.5Low65.8Low130 Ų130115.4 Ų115.484%0.84463%0.633SS**  trans-57.1104.8174.523.4-31.9000107.6G19P17-G19 PolarHBondContact O-N 3.35Å
18H64.2Low67.4Low98 Ų98115.8 Ų115.845%0.45463%0.627SS.*  trans-69.2107.6-171.8-67.4-34000108.3K16K16-H18 PolarHBondContact O-CE1 3.48Å; K16-H18 VanDerWaalsContact O-CE1 3.32Å; K16-H18 PolarHBondContact O-N 2.84Å; K16-H18 PolarHBondContact O-ND1 2.88Å
19G63.3Low68.9Low51 Ų51111.5 Ų111.553%0.52661%0.608SS.*  trans-61.5168.5-178.800000113.7P17 A21 R22P17-G19 PolarHBondContact O-N 3.35Å; G19-A21 PolarHBondContact O-N 2.92Å; G19-R22 PolarHBondContact O-N 2.77Å
20A61.9Low69.9Low101 Ų101110.1 Ų110.184%0.83560%0.599SS**THydrogen-bonded Turntrans-57.1-7.5-176.700000115.6R22A20-R22 PolarHBondContact O-N 3.15Å
21A74.8Confident71.3Confident108 Ų108110.7 Ų110.789%0.89360%0.604SS**THydrogen-bonded Turntrans-70.7-7.7179.200000114.8G19G19-A21 PolarHBondContact O-N 2.92Å
22R79.1Confident72.7Confident103 Ų103111.8 Ų111.839%0.38961%0.605SS.*SBendtrans-82.3140.2175.3-68.8-168.3-179.2-827.5111.2G19 A20 R26 R27G19-R22 PolarHBondContact O-N 2.77Å; A20-R22 PolarHBondContact O-N 3.15Å; R22-R26 HydrophobicContact CB-CB 4.31Å; R22-R27 HydrophobicContact CB-CG 4.14Å
23S85.8Confident73.8Confident51 Ų51112.1 Ų112.136%0.35762%0.616SS.*  trans-55.5148.6170.2650000111.7V25 R26 R27S23-V25 PolarHBondContact O-N 3.16Å; S23-R26 PolarHBondContact O-N 3.49Å; S23-R26 PolarHBondContact OG-NH1 2.82Å; S23-R27 PolarHBondContact O-N 3.27Å; S23-R27 VanDerWaalsContact O-N 3.14Å
24V86.4Confident75Confident90 Ų90107.6 Ų107.655%0.54561%0.607SS.*Hα-helixtrans-51-42178.3171.60000111.6R26 R27 I28V24-R26 VanDerWaalsContact C-N 3.35Å; V24-R26 PolarHBondContact O-N 2.87Å; V24-R27 PolarHBondContact O-N 3.43Å; V24-I28 HydrophobicContact CG1-CD1 3.73Å; V24-I28 HydrophobicContact CG1-CG1 4.35Å; V24-I28 WeakPolarHBondContact O-CG1 3.25Å; V24-I28 PolarHBondContact O-N 2.83Å
25V90.5Very high76.2Confident117 Ų117110.2 Ų110.271%0.70962%0.616SS**Hα-helixtrans-56.2-45.2176.41790000112.3S23 I28 G29S23-V25 PolarHBondContact O-N 3.16Å; V25-I28 PolarHBondContact O-N 2.86Å; V25-G29 PolarHBondContact O-N 3.37Å
26R84.3Confident77.4Confident155 Ų155109.6 Ų109.659%0.58562%0.62SS**Hα-helixtrans-69.5-35.1179.7-75.8179176.190.3-2.2112R22 S23 V24 G29 T30R22-R26 HydrophobicContact CB-CB 4.31Å; S23-R26 PolarHBondContact O-N 3.49Å; S23-R26 PolarHBondContact OG-NH1 2.82Å; V24-R26 VanDerWaalsContact C-N 3.35Å; V24-R26 PolarHBondContact O-N 2.87Å; R26-G29 PolarHBondContact O-N 3.36Å; R26-T30 WeakPolarHBondContact O-CG2 3.27Å; R26-T30 PolarHBondContact O-N 2.92Å; R26-T30 PolarHBondContact O-OG1 2.91Å
27R83.2Confident78Confident137 Ų137107.5 Ų107.552%0.51762%0.621SS.*Hα-helixtrans-67.6-40.6176.3-71.2171.351.1-155.4-6.6112.3R22 S23 V24 T30 N31R22-R27 HydrophobicContact CB-CG 4.14Å; S23-R27 PolarHBondContact O-N 3.27Å; S23-R27 VanDerWaalsContact O-N 3.14Å; V24-R27 PolarHBondContact O-N 3.43Å; R27-T30 PolarHBondContact O-OG1 3.34Å; R27-N31 PolarHBondContact O-ND2 2.95Å
28I84.8Confident79Confident102 Ų102107.6 Ų107.652%0.52362%0.621SS.*Hα-helixtrans-66.5-46.6174.6-65.4169.6000109.3V24 V25 T30 N31 L32V24-I28 HydrophobicContact CG1-CD1 3.73Å; V24-I28 HydrophobicContact CG1-CG1 4.35Å; V24-I28 WeakPolarHBondContact O-CG1 3.25Å; V24-I28 PolarHBondContact O-N 2.83Å; V25-I28 PolarHBondContact O-N 2.86Å; I28-T30 VanDerWaalsContact C-N 3.28Å; I28-T30 PolarHBondContact O-N 3.21Å; I28-N31 PolarHBondContact O-N 3.48Å; I28-L32 PolarHBondContact O-N 2.9Å
29G85.1Confident79.7Confident34 Ų34112.6 Ų112.635%0.35164%0.636SS.*Hα-helixtrans-58-32.9-179.300000114.9V25 R26 N31 L32V25-G29 PolarHBondContact O-N 3.37Å; R26-G29 PolarHBondContact O-N 3.36Å; G29-N31 VanDerWaalsContact C-N 3.31Å; G29-N31 PolarHBondContact O-N 3.17Å; G29-L32 PolarHBondContact O-N 3.36Å
30T78.2Confident80.5Confident89 Ų89114.5 Ų114.555%0.54665%0.647SS.*THydrogen-bonded Turntrans-73.5-18.1176.348.70000114.2R26 R27 I28R26-T30 WeakPolarHBondContact O-CG2 3.27Å; R26-T30 PolarHBondContact O-N 2.92Å; R26-T30 PolarHBondContact O-OG1 2.91Å; R27-T30 PolarHBondContact O-OG1 3.34Å; I28-T30 VanDerWaalsContact C-N 3.28Å; I28-T30 PolarHBondContact O-N 3.21Å
31N80Confident81.2Confident138 Ų138114.4 Ų114.474%0.73864%0.64SS**THydrogen-bonded Turntrans-94.6-4.3177.5-72.7-78.7000112.8R27 I28 G29R27-N31 PolarHBondContact O-ND2 2.95Å; I28-N31 PolarHBondContact O-N 3.48Å; G29-N31 VanDerWaalsContact C-N 3.31Å; G29-N31 PolarHBondContact O-N 3.17Å
32L83.4Confident81.3Confident86 Ų86118.5 Ų118.545%0.4564%0.638SS.*SBendtrans-76.2143.3175.3-59.9177.5000109.6I28 G29 L34I28-L32 PolarHBondContact O-N 2.9Å; G29-L32 PolarHBondContact O-N 3.36Å; L32-L34 HydrophobicContact CB-CD1 3.89Å; L32-L34 HydrophobicContact CB-CG 3.72Å; L32-L34 HydrophobicContact CD1-CD1 3.82Å; L32-L34 HydrophobicContact CD1-CG 4.49Å; L32-L34 PolarHBondContact O-N 3.24Å
33P80.9Confident81.3Confident133 Ų133121.9 Ų121.986%0.86466%0.658SS**  trans-75.751.7176.534.1-37000111.2
34L79.3Confident80.6Confident124 Ų124126.2 Ų126.265%0.64968%0.683SS**PPolyproline II helixtrans-94.6132179.6-60.9177.4000109.2L32 P36L32-L34 HydrophobicContact CB-CD1 3.89Å; L32-L34 HydrophobicContact CB-CG 3.72Å; L32-L34 HydrophobicContact CD1-CD1 3.82Å; L32-L34 HydrophobicContact CD1-CG 4.49Å; L32-L34 PolarHBondContact O-N 3.24Å; L34-P36 WeakPolarHBondContact O-CD 3.26Å
35K80.4Confident79.8Confident199 Ų199128.2 Ų128.287%0.86569%0.69SS**PPolyproline II helixtrans-64.8126.5169.1-69.6-178.7178.41760108.1C37K35-C37 PolarHBondContact O-N 3.36Å
36P78.1Confident78.9Confident124 Ų124127.7 Ų127.781%0.80569%0.689SS**PPolyproline II helixtrans-52.9131.3170.1-24.734.1000109.2L34L34-P36 WeakPolarHBondContact O-CD 3.26Å
37C74.3Confident77.8Confident88 Ų88125.2 Ų125.260%0.59569%0.687SS**PPolyproline II helixtrans-63142.5171.755.10000109K35 R39K35-C37 PolarHBondContact O-N 3.36Å; C37-R39 PolarHBondContact O-N 3.4Å
38P80.9Confident76.4Confident132 Ų132124.1 Ų124.186%0.85769%0.69SS**  trans-56.7113172.4-20.131.1000108.5
39R79Confident75.1Confident203 Ų203122 Ų12277%0.76668%0.684SS**  trans-88.5135.1170.1-69.1-175.4178.1-173.6-0.7107.1C37 S41C37-R39 PolarHBondContact O-N 3.4Å; R39-S41 PolarHBondContact O-N 3.02Å
40A79.7Confident73.8Confident90 Ų90126.9 Ų126.974%0.74470%0.702SS**  trans-55115.6167.900000108.1
41S76.9Confident72.7Confident99 Ų99130.2 Ų130.269%0.69272%0.716SS**  trans-87.9129169.7480000107.7R39 E43R39-S41 PolarHBondContact O-N 3.02Å; S41-E43 PolarHBondContact O-N 3.39Å
42F77.9Confident71.5Confident194 Ų194127.4 Ų127.485%0.85171%0.707SS**  trans-81.9109.9166.9-60.2-78.3000106.9T44F42-T44 PolarHBondContact O-N 3.49Å
43E78.9Confident70.2Confident175 Ų175128.6 Ų128.682%0.81871%0.713SS**  trans-68.1126.8162.4-69.9-179.1174.300107.1S41 L45S41-E43 PolarHBondContact O-N 3.39Å; E43-L45 PolarHBondContact O-N 2.95Å; E43-L45 VanDerWaalsContact O-N 3.1Å
44T70.9Confident69.1Low141 Ų141133.7 Ų133.787%0.86572%0.715SS**  trans-65.8113.7171.5-44.90000106.3F42F42-T44 PolarHBondContact O-N 3.49Å
45L68.9Low68.2Low133 Ų133135.4 Ų135.470%0.69673%0.725SS**  trans-51.9139.3178-123.4119.7000108.9E43 N47 I48E43-L45 PolarHBondContact O-N 2.95Å; E43-L45 VanDerWaalsContact O-N 3.1Å; L45-N47 PolarHBondContact O-N 3.21Å; L45-I48 HydrophobicContact CD2-CG2 3.88Å
46P72.6Confident67.3Low106 Ų106130.1 Ų130.169%0.68871%0.709SS**  trans-52.4142.8171.520.7-29.8000109.2I48P46-I48 PolarHBondContact O-N 3.25Å
47N59.8Low66.3Low102 Ų102128.6 Ų128.655%0.54570%0.699SS.*  trans-48.4103.2-169.8-170.9-0.6000111.4L45 S49 D50L45-N47 PolarHBondContact O-N 3.21Å; N47-S49 PolarHBondContact O-N 3.42Å; N47-S49 WeakPolarHBondContact OD1-CB 3.33Å; N47-S49 PolarHBondContact OD1-N 2.89Å; N47-S49 VanDerWaalsContact OD1-N 3.15Å; N47-S49 PolarHBondContact OD1-OG 2.89Å; N47-D50 PolarHBondContact O-N 3.48Å
48I55.4Low65.9Low115 Ų115130.1 Ų130.159%0.5971%0.708SS**G310 helixtrans-62.7-9.1-179.854169.7000112.8L45 P46 D50 L51 C52L45-I48 HydrophobicContact CD2-CG2 3.88Å; P46-I48 PolarHBondContact O-N 3.25Å; I48-D50 PolarHBondContact O-N 2.84Å; I48-L51 PolarHBondContact O-N 3.17Å; I48-C52 PolarHBondContact O-N 2.92Å
49S57.6Low65.1Low57 Ų57128.4 Ų128.440%0.39970%0.695SS.*G310 helixtrans-58.6-28.8171.2-62.20000113.2N47 L53N47-S49 PolarHBondContact O-N 3.42Å; N47-S49 WeakPolarHBondContact OD1-CB 3.33Å; N47-S49 PolarHBondContact OD1-N 2.89Å; N47-S49 VanDerWaalsContact OD1-N 3.15Å; N47-S49 PolarHBondContact OD1-OG 2.89Å; S49-L53 WeakPolarHBondContact O-CD1 3.43Å
50D56.4Low64.5Low136 Ų136124.2 Ų124.273%0.72769%0.693SS**G310 helixtrans-87.1-15.4-175.7-66.7-22000113.7N47 I48N47-D50 PolarHBondContact O-N 3.48Å; I48-D50 PolarHBondContact O-N 2.84Å
51L54.8Low63.9Low159 Ų159123.2 Ų123.283%0.83268%0.678SS**THydrogen-bonded Turntrans-108.5-11.3-174.5-62.8179.7000114.6I48I48-L51 PolarHBondContact O-N 3.17Å
52C55.9Low63.2Low80 Ų80125.1 Ų125.154%0.54168%0.68SS.*SBendtrans-135.220.6-170.3-150.10000115.3I48I48-C52 PolarHBondContact O-N 2.92Å
53L55.9Low62.5Low110 Ų110120 Ų12058%0.57667%0.673SS**SBendtrans-116.437.8-178.8-72.3-179.2000113.8S49S49-L53 WeakPolarHBondContact O-CD1 3.43Å
54R58.5Low62.1Low241 Ų241116.5 Ų116.591%0.90966%0.66SS**SBendtrans-122.9-13.1172.3-59.3-58.4-99.1-107.44.2116.8
55D58.8Low61.8Low160 Ų160114.3 Ų114.386%0.85664%0.642SS**SBendtrans-154.918179.9-137.98.3000116.5
56V61.9Low61.3Low88 Ų88112.4 Ų112.453%0.53365%0.646SS.*SBendtrans-129.9132.8177.6-176.20000109.4
57P57.9Low60.5Low92 Ų92117 Ų11760%0.59765%0.65SS**  trans-55.3141.4174.7-21.130.1000110.7V59P57-V59 PolarHBondContact O-N 3.41Å
58P64.8Low60.4Low120 Ų120118 Ų11878%0.77965%0.654SS**SBendtrans-67.50.7-177.927.9-35.1000113.9
59V65.2Low60.2Low96 Ų96115.6 Ų115.658%0.58265%0.651SS**SBendtrans-116.7111.2-177.5-176.50000107.7P57 T61P57-V59 PolarHBondContact O-N 3.41Å; V59-T61 PolarHBondContact O-N 3.18Å; V59-T61 VanDerWaalsContact O-N 3.14Å
60P65.6Low59.9Low114 Ų114117.6 Ų117.674%0.7467%0.671SS**  trans-61.2119.6169.424.9-30.1000107.9
61T68.3Low59.9Low69 Ų69113.9 Ų113.942%0.42365%0.651SS.*  trans-90.4161.2179.262.80000109.8V59 A63 D64V59-T61 PolarHBondContact O-N 3.18Å; V59-T61 VanDerWaalsContact O-N 3.14Å; T61-A63 PolarHBondContact O-N 2.86Å; T61-D64 PolarHBondContact N-OD2 2.92Å; T61-D64 WeakPolarHBondContact O-CB 3.49Å; T61-D64 PolarHBondContact O-N 2.82Å; T61-D64 PolarHBondContact OG1-OD2 2.98Å
62L62.1Low59.9Low139 Ų139115.6 Ų115.673%0.72866%0.655SS**G310 helixtrans-60.1-19.7178.4-161.270.9000112.6D64 I65 I68L62-D64 VanDerWaalsContact C-N 3.3Å; L62-D64 PolarHBondContact O-N 2.82Å; L62-I65 HydrophobicContact CD1-CD1 4.06Å; L62-I65 PolarHBondContact O-N 3.02Å; L62-I68 HydrophobicContact CD1-CD1 4.3Å
63A61.6Low59.9Low86 Ų86120.5 Ų120.571%0.71167%0.67SS**G310 helixtrans-70.6-22.5175.100000113.7T61 I65T61-A63 PolarHBondContact O-N 2.86Å; A63-I65 PolarHBondContact O-N 2.95Å
64D70.5Confident59.7Low103 Ų103118.5 Ų118.555%0.55166%0.657SS**G310 helixtrans-79.1-11.4179.2-57.4-51000112.2T61 L62 A66T61-D64 PolarHBondContact N-OD2 2.92Å; T61-D64 WeakPolarHBondContact O-CB 3.49Å; T61-D64 PolarHBondContact O-N 2.82Å; T61-D64 PolarHBondContact OG1-OD2 2.98Å; L62-D64 VanDerWaalsContact C-N 3.3Å; L62-D64 PolarHBondContact O-N 2.82Å; D64-A66 VanDerWaalsContact C-N 3.35Å; D64-A66 PolarHBondContact O-N 3.35Å
65I65.8Low59.4Low95 Ų95113.2 Ų113.249%0.48765%0.652SS.*  trans-88.176.6172.9-47.1-178.8000108L62 A63 W67 I68L62-I65 HydrophobicContact CD1-CD1 4.06Å; L62-I65 PolarHBondContact O-N 3.02Å; A63-I65 PolarHBondContact O-N 2.95Å; I65-W67 PolarHBondContact O-N 3.15Å; I65-I68 HydrophobicContact CB-CG1 4.45Å; I65-I68 HydrophobicContact CG2-CD1 4.28Å; I65-I68 HydrophobicContact CG2-CG1 3.76Å
66A58.8Low59.1Low93 Ų93116.3 Ų116.377%0.76965%0.654SS**  trans-61.9-2.5179.400000114.6D64D64-A66 VanDerWaalsContact C-N 3.35Å; D64-A66 PolarHBondContact O-N 3.35Å
67W55.1Low58.7Low203 Ų203116.4 Ų116.477%0.76966%0.664SS**  trans-131.966.3-178.5-9344.4000111I65 A69I65-W67 PolarHBondContact O-N 3.15Å; W67-A69 VanDerWaalsContact C-N 3.3Å
68I57.1Low58.7Low122 Ų122119 Ų11963%0.62666%0.661SS**  trans-103.269.3146.1-51.3179.1000105L62 I65 A70L62-I68 HydrophobicContact CD1-CD1 4.3Å; I65-I68 HydrophobicContact CB-CG1 4.45Å; I65-I68 HydrophobicContact CG2-CD1 4.28Å; I65-I68 HydrophobicContact CG2-CG1 3.76Å; I68-A70 PolarHBondContact O-N 3.04Å; I68-A70 VanDerWaalsContact O-N 3.15Å
69A51.8Low58.5Low64 Ų64118.4 Ų118.453%0.52966%0.656SS.*  trans-61.8119.5169.900000106.7W67 D71W67-A69 VanDerWaalsContact C-N 3.3Å; A69-D71 WeakPolarHBondContact O-CB 3.49Å; A69-D71 PolarHBondContact O-N 3.26Å
70A50.9Low58.1Low100 Ų100126.1 Ų126.183%0.82667%0.674SS**  trans-43.498.7173.800000110.8I68I68-A70 PolarHBondContact O-N 3.04Å; I68-A70 VanDerWaalsContact O-N 3.15Å
71D56.2Low57.5Low57 Ų57125.3 Ų125.331%0.30567%0.671SS.*  trans-131.170.6179.5-170.15.9000106.9A69 E73 E74 R78A69-D71 WeakPolarHBondContact O-CB 3.49Å; A69-D71 PolarHBondContact O-N 3.26Å; D71-E73 PolarHBondContact O-N 2.86Å; D71-E74 VanDerWaalsContact CG-CD 3.44Å; D71-E74 WeakPolarHBondContact OD1-CB 3.48Å; D71-E74 WeakPolarHBondContact OD1-CG 3.2Å; D71-E74 PolarHBondContact OD1-N 2.71Å; D71-E74 WeakPolarHBondContact OD2-CB 3.25Å; D71-E74 WeakPolarHBondContact OD2-CG 3.3Å; D71-R78 IonicContact OD2-NH1 3.86Å
72E55.8Low56.9Low196 Ų196126.8 Ų126.892%0.91668%0.676SS**SBendtrans-63.3-2.8-180-73.8-89.515300112.4
73E54.9Low56.6Low182 Ų182125.9 Ų125.985%0.8568%0.677SS**SBendtrans-131.5-11.9-168.5-131.3171.4-160.800116.5D71D71-E73 PolarHBondContact O-N 2.86Å
74E52.8Low56.3Low68 Ų68128 Ų12832%0.31867%0.667SS.*SBendtrans-97.5109.5-176.3-56.6167.5176.500112.2D71 Y76 R78D71-E74 VanDerWaalsContact CG-CD 3.44Å; D71-E74 WeakPolarHBondContact OD1-CB 3.48Å; D71-E74 WeakPolarHBondContact OD1-CG 3.2Å; D71-E74 PolarHBondContact OD1-N 2.71Å; D71-E74 WeakPolarHBondContact OD2-CB 3.25Å; D71-E74 WeakPolarHBondContact OD2-CG 3.3Å; E74-Y76 PolarHBondContact O-N 3.48Å; E74-R78 VanDerWaalsContact CB-NH1 3.27Å; E74-R78 VanDerWaalsContact CD-NH2 3.28Å; E74-R78 IonicContact OE1-NH2 2.6Å; E74-R78 IonicContact OE2-CZ 3.66Å; E74-R78 IonicContact OE2-NH1 3.96Å; E74-R78 PolarHBondContact OE2-NH1 2.85Å; E74-R78 IonicContact OE2-NH2 2.94Å; E74-R78 PolarHBondContact OE2-NH2 3.18Å
75T52.5Low55.6Low131 Ų131126.2 Ų126.280%0.80466%0.66SS**  trans-57.5120.5-176.4-28.70000111.3A77T75-A77 PolarHBondContact O-N 3.4Å
76Y51.3Low54.6Low225 Ų225127.5 Ų127.588%0.88267%0.668SS**SBendtrans-53.783.7-178.1-57.9-90.1000114.1E74E74-Y76 PolarHBondContact O-N 3.48Å
77A54.8Low54.4Low90 Ų90132.2 Ų132.274%0.74467%0.665SS**  trans-156.153.3167.200000111T75T75-A77 PolarHBondContact O-N 3.4Å
78R57.5Low54.2Low145 Ų145129.7 Ų129.755%0.54766%0.662SS.*  trans-98125.9173.1-72-167.9175.2100.51.2111.7D71 E74 D82D71-R78 IonicContact OD2-NH1 3.86Å; E74-R78 VanDerWaalsContact CB-NH1 3.27Å; E74-R78 VanDerWaalsContact CD-NH2 3.28Å; E74-R78 IonicContact OE1-NH2 2.6Å; E74-R78 IonicContact OE2-CZ 3.66Å; E74-R78 IonicContact OE2-NH1 3.96Å; E74-R78 PolarHBondContact OE2-NH1 2.85Å; E74-R78 IonicContact OE2-NH2 2.94Å; E74-R78 PolarHBondContact OE2-NH2 3.18Å; R78-D82 IonicContact NE-OD2 2.64Å
79V60.1Low53.8Low109 Ų109128.9 Ų128.966%0.66166%0.663SS**  trans-81.7142.9171.5172.70000108.6S81 D82V79-S81 WeakPolarHBondContact CG1-OG 3.38Å; V79-S81 PolarHBondContact O-N 3Å; V79-D82 PolarHBondContact O-N 3.15Å
80R57Low53.3Low257 Ų257133.2 Ų133.297%0.9767%0.666SS**THydrogen-bonded Turntrans-54.4-8.2-175.2-71.1-176162.488.10.6116.4
81S53.4Low53.2Low97 Ų97137.3 Ų137.368%0.67867%0.665SS**THydrogen-bonded Turntrans-85.4-4177.936.30000114.4V79 T83V79-S81 WeakPolarHBondContact CG1-OG 3.38Å; V79-S81 PolarHBondContact O-N 3Å; S81-T83 VanDerWaalsContact C-N 3.33Å; S81-T83 PolarHBondContact O-N 3.3Å
82D54.7Low52.9Low100 Ų100139.7 Ų139.754%0.53568%0.683SS.*  trans-79.479.6179-155.72.4000111R78 V79 R84R78-D82 IonicContact NE-OD2 2.64Å; V79-D82 PolarHBondContact O-N 3.15Å; D82-R84 PolarHBondContact O-N 2.92Å
83T56Low52.9Low121 Ų121134 Ų13474%0.74267%0.665SS**  trans-81.9109.4175.1-480000107.9S81 P85S81-T83 VanDerWaalsContact C-N 3.33Å; S81-T83 PolarHBondContact O-N 3.3Å; T83-P85 WeakPolarHBondContact O-CD 3.14Å
84R55.6Low52.7Low131 Ų131131.3 Ų131.349%0.49466%0.664SS.*PPolyproline II helixtrans-61.3123.1-179.2-68.6-156.9-90.1-147.7-1.5111.2D82D82-R84 PolarHBondContact O-N 2.92Å
85P54.8Low52.5Low64 Ų64134.7 Ų134.742%0.41668%0.683SS.*PPolyproline II helixtrans-61.1136.1155.7-18.728.4000110.2T83 R87T83-P85 WeakPolarHBondContact O-CD 3.14Å; P85-R87 PolarHBondContact O-N 2.93Å
86L46.3Very low52.4Low122 Ų122135.8 Ų135.864%0.63968%0.683SS**PPolyproline II helixtrans-47.2130.2176-175.660.8000111.3H88 T89L86-H88 WeakPolarHBondContact CD2-CE1 3.35Å; L86-H88 WeakPolarHBondContact CD2-NE2 3.36Å; L86-H88 WeakPolarHBondContact CG-CE1 3.25Å; L86-H88 VanDerWaalsContact CG-NE2 3.31Å; L86-H88 WeakPolarHBondContact CG-NE2 3.49Å; L86-H88 PolarHBondContact O-N 3.45Å; L86-T89 PolarHBondContact O-N 2.74Å
87R54.3Low52.2Low192 Ų192131.3 Ų131.373%0.72568%0.678SS**THydrogen-bonded Turntrans-62.46.8-159.6-70.1-83.4-97.3-165.4-6.9117.3P85P85-R87 PolarHBondContact O-N 2.93Å
88H51.2Low51.9Low150 Ų150134.8 Ų134.869%0.69468%0.681SS**THydrogen-bonded Turntrans-103.5-5.4179.925.2-89000115.2L86L86-H88 WeakPolarHBondContact CD2-CE1 3.35Å; L86-H88 WeakPolarHBondContact CD2-NE2 3.36Å; L86-H88 WeakPolarHBondContact CG-CE1 3.25Å; L86-H88 VanDerWaalsContact CG-NE2 3.31Å; L86-H88 WeakPolarHBondContact CG-NE2 3.49Å; L86-H88 PolarHBondContact O-N 3.45Å
89T48.3Very low51.6Low106 Ų106135.3 Ų135.365%0.6569%0.69SS**SBendtrans-123.211.8178.460.20000114L86 K91L86-T89 PolarHBondContact O-N 2.74Å; T89-K91 PolarHBondContact O-N 3.04Å
90W40.4Very low51.1Low154 Ų154141.1 Ų141.158%0.58370%0.7SS**  trans-69.599.1173.4-105.482.9000110.2
91K49.6Very low50.8Low187 Ų187135.5 Ų135.581%0.81369%0.689SS**  trans-86.6117.3155-67.5-73.2-179.4178.20105.9T89 S93T89-K91 PolarHBondContact O-N 3.04Å; K91-S93 PolarHBondContact O-N 3.46Å
92P49.5Very low50.7Low106 Ų106134 Ų13469%0.68868%0.683SS**  trans-61.5112.8171.9-6.919000107.1
93S55.3Low50.7Low76 Ų76135.2 Ų135.253%0.53170%0.699SS.*  trans-60.5135.1160.91780000106.9K91 L95K91-S93 PolarHBondContact O-N 3.46Å; S93-L95 PolarHBondContact O-N 3.32Å
94P51.5Low50.6Low127 Ų127134 Ų13483%0.82569%0.691SS**  trans-7270.8175.630.6-31.8000108.7I96P94-I96 PolarHBondContact O-N 3Å
95L48.9Very low50.3Low139 Ų139132.6 Ų132.673%0.72870%0.699SS**  trans-81.7112.3169.9-65.6179000106.8S93 V97S93-L95 PolarHBondContact O-N 3.32Å; L95-V97 PolarHBondContact O-N 3.44Å; L95-V97 VanDerWaalsContact O-N 3.07Å
96I50.6Low50.1Low154 Ų154135.5 Ų135.579%0.7971%0.711SS**  trans-41.9115170.7-60.8-177.7000108.4P94 M98P94-I96 PolarHBondContact O-N 3Å; I96-M98 VanDerWaalsContact C-N 3.3Å; I96-M98 PolarHBondContact O-N 2.81Å
97V46.9Very low50.5Low130 Ų130137.6 Ų137.679%0.78872%0.722SS**  trans-59.198.4169.2173.50000106.2L95 Q99L95-V97 PolarHBondContact O-N 3.44Å; L95-V97 VanDerWaalsContact O-N 3.07Å; V97-Q99 PolarHBondContact O-N 2.86Å
98M48.1Very low50.7Low164 Ų164140 Ų14081%0.80873%0.731SS**  trans-70.792.4170.4-130.3139.982.300105.8I96 R100I96-M98 VanDerWaalsContact C-N 3.3Å; I96-M98 PolarHBondContact O-N 2.81Å; M98-R100 VanDerWaalsContact C-N 3.32Å; M98-R100 PolarHBondContact O-N 3.26Å
99Q50.5Low50.9Low155 Ų155136.1 Ų136.172%0.72473%0.732SS**  trans-57.396.1177.6-169.1-178.5-2700107.6V97 N101V97-Q99 PolarHBondContact O-N 2.86Å; Q99-N101 PolarHBondContact O-N 3.04Å
100R50.4Low50.8Low231 Ų231133.6 Ų133.687%0.87272%0.719SS**  trans-67.2102.7172.9-74.3-173.3176.190.1-1.7106.4M98 A102M98-R100 VanDerWaalsContact C-N 3.32Å; M98-R100 PolarHBondContact O-N 3.26Å; R100-A102 VanDerWaalsContact C-N 3.34Å; R100-A102 PolarHBondContact O-N 3.44Å
101N51.2Low51.3Low140 Ų140134.8 Ų134.875%0.74973%0.73SS**  trans-61.8102.7164.4-66.1-54.3000106.7Q99 S103Q99-N101 PolarHBondContact O-N 3.04Å; N101-S103 PolarHBondContact O-N 2.99Å; N101-S103 VanDerWaalsContact O-N 3.12Å
102A50.8Low51.6Low66 Ų66133.2 Ų133.255%0.54573%0.726SS.*  trans-56.6118.7172.100000107.5R100 V104R100-A102 VanDerWaalsContact C-N 3.34Å; R100-A102 PolarHBondContact O-N 3.44Å; A102-V104 HydrophobicContact CB-CG2 3.88Å; A102-V104 PolarHBondContact O-N 3.19Å; A102-V104 VanDerWaalsContact O-N 3.13Å
103S55.6Low51.9Low124 Ų124135.9 Ų135.987%0.86772%0.722SS**SBendtrans-72.15.7176.352.90000113N101N101-S103 PolarHBondContact O-N 2.99Å; N101-S103 VanDerWaalsContact O-N 3.12Å
104V53.6Low51.8Low97 Ų97139 Ų13959%0.58873%0.733SS**SBendtrans-92.6127.4173-73.90000109.2A102 N106A102-V104 HydrophobicContact CB-CG2 3.88Å; A102-V104 PolarHBondContact O-N 3.19Å; A102-V104 VanDerWaalsContact O-N 3.13Å; V104-N106 PolarHBondContact O-N 3.01Å
105P48.5Very low52Low100 Ų100138.8 Ų138.865%0.64972%0.723SS**  trans-59.7114.8172-16.928.8000108.7L107P105-L107 PolarHBondContact O-N 3.3Å
106N51.5Low52.3Low125 Ų125136 Ų13667%0.66872%0.721SS**  trans-64102.9164.3-87-53.5000107.5V104 R108V104-N106 PolarHBondContact O-N 3.01Å; N106-R108 PolarHBondContact O-N 3.37Å; N106-R108 VanDerWaalsContact O-N 3.14Å
107L54.2Low52.5Low167 Ų167134.4 Ų134.487%0.87471%0.713SS**  trans-76.515.9177.2-67.6172.6000112.8P105 G109P105-L107 PolarHBondContact O-N 3.3Å; L107-G109 PolarHBondContact O-N 3.07Å; L107-G109 VanDerWaalsContact O-N 3.17Å
108R57.4Low52.9Low241 Ų241134.3 Ų134.391%0.90970%0.702SS**SBendtrans-87.781.7175.4-98.5-110-85.4-115.5-6.2109.2N106N106-R108 PolarHBondContact O-N 3.37Å; N106-R108 VanDerWaalsContact O-N 3.14Å
109G57Low53.5Low69 Ų69135.8 Ų135.871%0.71170%0.704SS**SBendtrans97.297.3164.900000114L107L107-G109 PolarHBondContact O-N 3.07Å; L107-G109 VanDerWaalsContact O-N 3.17Å
110S44.5Very low53.8Low54 Ų54133.6 Ų133.638%0.37870%0.703SS.*  trans-178.798147.41790000108.6E112 R113S110-E112 PolarHBondContact O-N 3.1Å; S110-E112 WeakPolarHBondContact OG-CB 3.31Å; S110-E112 PolarHBondContact OG-N 3.47Å; S110-R113 PolarHBondContact O-N 3.14Å; S110-R113 PolarHBondContact OG-N 2.8Å
111E52.1Low54.1Low178 Ų178123.9 Ų123.983%0.83267%0.673SS**G310 helixtrans-52-30.3161.1-92.4-178.913500111.1R113 L114E111-R113 VanDerWaalsContact C-N 3.33Å; E111-R113 PolarHBondContact O-N 2.82Å; E111-L114 PolarHBondContact O-N 3.18Å
112E55.9Low54.6Low154 Ų154121.3 Ų121.372%0.7266%0.658SS**G310 helixtrans-67.7-26.7-178.6-148.9176.6-174.900113.6S110 L115S110-E112 PolarHBondContact O-N 3.1Å; S110-E112 WeakPolarHBondContact OG-CB 3.31Å; S110-E112 PolarHBondContact OG-N 3.47Å; E112-L115 PolarHBondContact O-N 3.38Å
113R54.7Low55.3Low163 Ų163120.8 Ų120.862%0.61565%0.649SS**G310 helixtrans-79.2-16.8177.5-84.9-170177.6148.81.3114.7S110 E111 L115 A116S110-R113 PolarHBondContact O-N 3.14Å; S110-R113 PolarHBondContact OG-N 2.8Å; E111-R113 VanDerWaalsContact C-N 3.33Å; E111-R113 PolarHBondContact O-N 2.82Å; R113-L115 PolarHBondContact O-N 2.9Å; R113-A116 PolarHBondContact O-N 3.34Å
114L54.4Low56.1Low142 Ų142117.5 Ų117.574%0.74363%0.63SS**G310 helixtrans-64.9-27.5170.5-64.9177.2000111.3E111E111-L114 PolarHBondContact O-N 3.18Å
115L54.2Low57.1Low121 Ų121117.9 Ų117.963%0.63463%0.628SS**THydrogen-bonded Turntrans-79.5-22.1177.4-59.9173000113.1E112 R113 K118E112-L115 PolarHBondContact O-N 3.38Å; R113-L115 PolarHBondContact O-N 2.9Å; L115-K118 WeakPolarHBondContact O-CB 3.47Å
116A55.7Low58.6Low82 Ų82115.3 Ų115.368%0.67861%0.612SS**THydrogen-bonded Turntrans-83.9-17.3-179.400000113.7R113 K118R113-A116 PolarHBondContact O-N 3.34Å; A116-K118 PolarHBondContact O-N 3.19Å
117L54.2Low60.4Low120 Ų120116.5 Ų116.563%0.62861%0.607SS**THydrogen-bonded Turntrans-8110.7173.2-114.276.8000113.8K119 A121L117-K119 VanDerWaalsContact C-N 3.33Å; L117-K119 PolarHBondContact O-N 3.14Å; L117-K119 VanDerWaalsContact O-N 3.13Å; L117-A121 HydrophobicContact CD2-CB 4.46Å; L117-A121 WeakPolarHBondContact O-CB 3.44Å
118K57.1Low62.1Low128 Ų128111.7 Ų111.756%0.55759%0.585SS**THydrogen-bonded Turntrans-72.8-6.8-160.6-169.6162.1179.9170.50116.9L115 A116 L122L115-K118 WeakPolarHBondContact O-CB 3.47Å; A116-K118 PolarHBondContact O-N 3.19Å; K118-L122 HydrophobicContact CB-CD2 4.34Å; K118-L122 HydrophobicContact CG-CD2 4.15Å; K118-L122 HydrophobicContact CG-CG 4.08Å; K118-L122 WeakPolarHBondContact O-CG 3.42Å
119K60.8Low63.7Low195 Ų195104 Ų10485%0.84857%0.565SS**THydrogen-bonded Turntrans-106.7-31.6-167.9-68.2-178.5178.7177.10116.8L117L117-K119 VanDerWaalsContact C-N 3.33Å; L117-K119 PolarHBondContact O-N 3.14Å; L117-K119 VanDerWaalsContact O-N 3.13Å
120P56.6Low65.5Low109 Ų109106 Ų10671%0.70856%0.556SS**THydrogen-bonded Turntrans-110.9-15.6169.324-9.8000115.1
121A57Low68Low27 Ų27108.6 Ų108.622%0.22357%0.565CS.*SBendtrans-83.2-28.3-178.900000113.4L117 A124 L125L117-A121 HydrophobicContact CD2-CB 4.46Å; L117-A121 WeakPolarHBondContact O-CB 3.44Å; A121-A124 PolarHBondContact O-N 3.45Å; A121-L125 WeakPolarHBondContact O-CB 3.18Å; A121-L125 VanDerWaalsContact O-CG 3.31Å; A121-L125 WeakPolarHBondContact O-CG 3.26Å; A121-L125 PolarHBondContact O-N 3.19Å
122L59.8Low70.1Confident85 Ų85106.5 Ų106.545%0.44556%0.555SS.*Hα-helixtrans-62.9-44.8-176.8-82-86.6000112.6K118 A124 L125 S126K118-L122 HydrophobicContact CB-CD2 4.34Å; K118-L122 HydrophobicContact CG-CD2 4.15Å; K118-L122 HydrophobicContact CG-CG 4.08Å; K118-L122 WeakPolarHBondContact O-CG 3.42Å; L122-A124 VanDerWaalsContact C-N 3.28Å; L122-A124 PolarHBondContact O-N 3.44Å; L122-L125 PolarHBondContact O-N 3.01Å; L122-S126 WeakPolarHBondContact O-CB 3.49Å; L122-S126 PolarHBondContact O-N 3.48Å; L122-S126 PolarHBondContact O-OG 2.67Å
123P67.1Low72.1Confident56 Ų56104.6 Ų104.636%0.36455%0.55SS..Hα-helixtrans-71-21.2176.2-17.832000114S126 R127P123-S126 WeakPolarHBondContact CA-OG 3.47Å; P123-S126 PolarHBondContact O-OG 2.75Å; P123-R127 VanDerWaalsContact O-CG 3.25Å; P123-R127 WeakPolarHBondContact O-CG 3.48Å; P123-R127 PolarHBondContact O-N 3.22Å; P123-R127 PolarHBondContact O-NH1 3.01Å
124A71.7Confident74.1Confident55 Ų55102.6 Ų102.646%0.45555%0.547SS..Hα-helixtrans-79.4-44175.500000109.9A121 L122 R127 T128A121-A124 PolarHBondContact O-N 3.45Å; L122-A124 VanDerWaalsContact C-N 3.28Å; L122-A124 PolarHBondContact O-N 3.44Å; A124-R127 PolarHBondContact O-N 3.31Å; A124-T128 WeakPolarHBondContact O-CG2 3.46Å; A124-T128 PolarHBondContact O-N 2.97Å; A124-T128 PolarHBondContact O-OG1 3.02Å
125L73.5Confident76.2Confident105 Ų10599.8 Ų99.855%0.5553%0.533SS..Hα-helixtrans-64.3-41.1175.2-67.5174.6000111.9A121 L122 R127 T128 T129A121-L125 WeakPolarHBondContact O-CB 3.18Å; A121-L125 VanDerWaalsContact O-CG 3.31Å; A121-L125 WeakPolarHBondContact O-CG 3.26Å; A121-L125 PolarHBondContact O-N 3.19Å; L122-L125 PolarHBondContact O-N 3.01Å; L125-R127 PolarHBondContact O-N 2.98Å; L125-T128 WeakPolarHBondContact CA-OG1 3.5Å; L125-T128 PolarHBondContact O-N 3.49Å; L125-T128 PolarHBondContact O-OG1 2.98Å; L125-T129 PolarHBondContact O-N 2.77Å; L125-T129 PolarHBondContact O-OG1 3.46Å
126S81.5Confident78.3Confident45 Ų4596.9 Ų96.932%0.31552%0.522SS..Hα-helixtrans-62.5-42.5176.3730000112.3L122 P123 T128 T129 E130L122-S126 WeakPolarHBondContact O-CB 3.49Å; L122-S126 PolarHBondContact O-N 3.48Å; L122-S126 PolarHBondContact O-OG 2.67Å; P123-S126 WeakPolarHBondContact CA-OG 3.47Å; P123-S126 PolarHBondContact O-OG 2.75Å; S126-T128 VanDerWaalsContact C-N 3.32Å; S126-T128 PolarHBondContact O-N 3.04Å; S126-T129 WeakPolarHBondContact CA-OG1 3.13Å; S126-T129 PolarHBondContact O-N 3.4Å; S126-T129 PolarHBondContact O-OG1 3.42Å; S126-E130 VanDerWaalsContact O-CG 3.29Å; S126-E130 WeakPolarHBondContact O-CG 3.44Å; S126-E130 PolarHBondContact O-N 2.91Å
127R88.9Confident80.3Confident151 Ų15198 Ų9857%0.5751%0.514SS*.Hα-helixtrans-63.3-37.9174.2-75.6-177-173.796.6-6.1112.2P123 A124 L125 T129 L131P123-R127 VanDerWaalsContact O-CG 3.25Å; P123-R127 WeakPolarHBondContact O-CG 3.48Å; P123-R127 PolarHBondContact O-N 3.22Å; P123-R127 PolarHBondContact O-NH1 3.01Å; A124-R127 PolarHBondContact O-N 3.31Å; L125-R127 PolarHBondContact O-N 2.98Å; R127-T129 VanDerWaalsContact C-N 3.34Å; R127-L131 WeakPolarHBondContact O-CB 3.22Å; R127-L131 VanDerWaalsContact O-CG 3.28Å; R127-L131 WeakPolarHBondContact O-CG 3.47Å; R127-L131 PolarHBondContact O-N 3.47Å
128T89.1Confident82.4Confident66 Ų6697 Ų9741%0.40551%0.508SS..Hα-helixtrans-66.3-37.2175.354.20000112.3A124 L125 S126 Q132A124-T128 WeakPolarHBondContact O-CG2 3.46Å; A124-T128 PolarHBondContact O-N 2.97Å; A124-T128 PolarHBondContact O-OG1 3.02Å; L125-T128 WeakPolarHBondContact CA-OG1 3.5Å; L125-T128 PolarHBondContact O-N 3.49Å; L125-T128 PolarHBondContact O-OG1 2.98Å; S126-T128 VanDerWaalsContact C-N 3.32Å; S126-T128 PolarHBondContact O-N 3.04Å; T128-Q132 WeakPolarHBondContact O-CB 3.28Å; T128-Q132 WeakPolarHBondContact O-CG 3.47Å; T128-Q132 PolarHBondContact O-N 3.47Å
129T91.5Very high84.3Confident80 Ų8099 Ų9949%0.49151%0.512SS..Hα-helixtrans-70.8-39.4176.951.30000112.1L125 S126 R127 Q132 D133L125-T129 PolarHBondContact O-N 2.77Å; L125-T129 PolarHBondContact O-OG1 3.46Å; S126-T129 WeakPolarHBondContact CA-OG1 3.13Å; S126-T129 PolarHBondContact O-N 3.4Å; S126-T129 PolarHBondContact O-OG1 3.42Å; R127-T129 VanDerWaalsContact C-N 3.34Å; T129-Q132 PolarHBondContact O-N 2.99Å; T129-D133 PolarHBondContact O-N 2.97Å
130E94.6Very high86.1Confident111 Ų11192.4 Ų92.452%0.51949%0.49SS..Hα-helixtrans-60-48.2174.6-73.4162.3-159.800111.2S126 Q132 D133 E134S126-E130 VanDerWaalsContact O-CG 3.29Å; S126-E130 WeakPolarHBondContact O-CG 3.44Å; S126-E130 PolarHBondContact O-N 2.91Å; E130-Q132 VanDerWaalsContact C-N 3.3Å; E130-Q132 PolarHBondContact O-N 3.22Å; E130-D133 PolarHBondContact O-N 3.48Å; E130-E134 PolarHBondContact O-N 3.32Å
131L97Very high88Confident108 Ų10891.3 Ų91.357%0.56548%0.476SS*.Hα-helixtrans-63.7-35.3177.7-71.4173.7000112.7R127 L135R127-L131 WeakPolarHBondContact O-CB 3.22Å; R127-L131 VanDerWaalsContact O-CG 3.28Å; R127-L131 WeakPolarHBondContact O-CG 3.47Å; R127-L131 PolarHBondContact O-N 3.47Å; L131-L135 VanDerWaalsContact O-CB 3.26Å; L131-L135 WeakPolarHBondContact O-CB 3.45Å; L131-L135 PolarHBondContact O-N 2.96Å
132Q97Very high89.9Confident134 Ų13494.8 Ų94.863%0.62649%0.49SS*.Hα-helixtrans-66-40.9175.3-77.6173.7-7.200111.7T128 T129 E130 L135 S136T128-Q132 WeakPolarHBondContact O-CB 3.28Å; T128-Q132 WeakPolarHBondContact O-CG 3.47Å; T128-Q132 PolarHBondContact O-N 3.47Å; T129-Q132 PolarHBondContact O-N 2.99Å; E130-Q132 VanDerWaalsContact C-N 3.3Å; E130-Q132 PolarHBondContact O-N 3.22Å; Q132-L135 PolarHBondContact O-N 3.17Å; Q132-S136 WeakPolarHBondContact O-CB 3.29Å; Q132-S136 PolarHBondContact O-N 3.4Å
133D97.1Very high91.7Very high114 Ų11493.5 Ų93.561%0.6149%0.491SS*.Hα-helixtrans-65.3-47.2177.5-167.554000111.3T129 E130 L135 S136 H137T129-D133 PolarHBondContact O-N 2.97Å; E130-D133 PolarHBondContact O-N 3.48Å; D133-L135 VanDerWaalsContact C-N 3.32Å; D133-L135 PolarHBondContact O-N 3.21Å; D133-S136 WeakPolarHBondContact O-CB 3.39Å; D133-S136 PolarHBondContact O-N 2.91Å; D133-S136 VanDerWaalsContact O-N 3.15Å; D133-S136 PolarHBondContact O-OG 3.36Å; D133-H137 WeakPolarHBondContact O-CB 3.45Å; D133-H137 PolarHBondContact O-N 2.96Å
134E97.6Very high93Very high120 Ų12097.6 Ų97.656%0.56150%0.503SS*.Hα-helixtrans-58-42.5174.8-72.3-177.6176.900112.4E130 S136 H137 L138E130-E134 PolarHBondContact O-N 3.32Å; E134-S136 VanDerWaalsContact C-N 3.35Å; E134-H137 WeakPolarHBondContact O-CB 3.33Å; E134-H137 PolarHBondContact O-N 3.48Å; E134-L138 WeakPolarHBondContact O-CG 3.38Å; E134-L138 PolarHBondContact O-N 3.44Å
135L98.3Very high94.2Very high83 Ų83100.4 Ų100.444%0.43551%0.51SS..Hα-helixtrans-68.1-37.1179.1-153.9158.8000111.1L131 Q132 D133 R139L131-L135 VanDerWaalsContact O-CB 3.26Å; L131-L135 WeakPolarHBondContact O-CB 3.45Å; L131-L135 PolarHBondContact O-N 2.96Å; Q132-L135 PolarHBondContact O-N 3.17Å; D133-L135 VanDerWaalsContact C-N 3.32Å; D133-L135 PolarHBondContact O-N 3.21Å; L135-R139 HydrophobicContact CD2-CG 4.2Å; L135-R139 WeakPolarHBondContact O-CB 3.25Å; L135-R139 VanDerWaalsContact O-CG 3.31Å; L135-R139 WeakPolarHBondContact O-CG 3.4Å; L135-R139 PolarHBondContact O-N 3.46Å
136S97.5Very high95.2Very high60 Ų6099.9 Ų99.942%0.4251%0.51SS..Hα-helixtrans-64.8-40.8172.885.90000111.7Q132 D133 E134 R139 S140Q132-S136 WeakPolarHBondContact O-CB 3.29Å; Q132-S136 PolarHBondContact O-N 3.4Å; D133-S136 WeakPolarHBondContact O-CB 3.39Å; D133-S136 PolarHBondContact O-N 2.91Å; D133-S136 VanDerWaalsContact O-N 3.15Å; D133-S136 PolarHBondContact O-OG 3.36Å; E134-S136 VanDerWaalsContact C-N 3.35Å; S136-R139 PolarHBondContact O-N 2.91Å; S136-S140 PolarHBondContact O-N 2.91Å
137H97.9Very high95.7Very high107 Ų107100.6 Ų100.650%0.49552%0.519SS..Hα-helixtrans-64.8-46.1177.7-170.276.2000111.5D133 E134 R139 S140 Q141D133-H137 WeakPolarHBondContact O-CB 3.45Å; D133-H137 PolarHBondContact O-N 2.96Å; E134-H137 WeakPolarHBondContact O-CB 3.33Å; E134-H137 PolarHBondContact O-N 3.48Å; H137-R139 PolarHBondContact O-N 3.34Å; H137-S140 WeakPolarHBondContact O-CB 3.44Å; H137-S140 PolarHBondContact O-N 3.25Å; H137-Q141 PolarHBondContact CD2-NE2 2.93Å; H137-Q141 PolarHBondContact NE2-NE2 3.45Å; H137-Q141 WeakPolarHBondContact O-CG 3.41Å; H137-Q141 PolarHBondContact O-N 2.95Å
138L98.4Very high95.4Very high97 Ų9796.1 Ų96.151%0.50852%0.515SS..Hα-helixtrans-60.8-44.1175.1-76.5172.2000111.9E134 S140 Q141 I142E134-L138 WeakPolarHBondContact O-CG 3.38Å; E134-L138 PolarHBondContact O-N 3.44Å; L138-S140 VanDerWaalsContact C-N 3.31Å; L138-S140 PolarHBondContact O-N 2.78Å; L138-Q141 PolarHBondContact O-N 2.92Å; L138-I142 VanDerWaalsContact O-CG1 3.25Å; L138-I142 WeakPolarHBondContact O-CG1 3.31Å; L138-I142 PolarHBondContact O-N 3Å
139R98.1Very high95.1Very high172 Ų17298.4 Ų98.465%0.64952%0.524SS*.Hα-helixtrans-60.1-41.3174.9-76.7174.5173.3159.31.1111.9L135 S136 H137 I142 A143L135-R139 HydrophobicContact CD2-CG 4.2Å; L135-R139 WeakPolarHBondContact O-CB 3.25Å; L135-R139 VanDerWaalsContact O-CG 3.31Å; L135-R139 WeakPolarHBondContact O-CG 3.4Å; L135-R139 PolarHBondContact O-N 3.46Å; S136-R139 PolarHBondContact O-N 2.91Å; H137-R139 PolarHBondContact O-N 3.34Å; R139-I142 PolarHBondContact O-N 3.5Å; R139-A143 WeakPolarHBondContact O-CB 3.48Å; R139-A143 PolarHBondContact O-N 3.29Å
140S97.1Very high94.3Very high55 Ų5597.5 Ų97.539%0.38553%0.525SS..Hα-helixtrans-64.1-43.8175.3-174.70000112.1S136 H137 L138 A143 K144S136-S140 PolarHBondContact O-N 2.91Å; H137-S140 WeakPolarHBondContact O-CB 3.44Å; H137-S140 PolarHBondContact O-N 3.25Å; L138-S140 VanDerWaalsContact C-N 3.31Å; L138-S140 PolarHBondContact O-N 2.78Å; S140-A143 PolarHBondContact O-N 2.98Å; S140-K144 WeakPolarHBondContact O-CG 3.45Å; S140-K144 PolarHBondContact O-N 2.8Å
141Q97.9Very high92.9Very high86 Ų8694.3 Ų94.340%0.40252%0.518SS..Hα-helixtrans-62-45.5175.7-72.8-172.116.400111.9H137 L138 A143 K144 I145H137-Q141 PolarHBondContact CD2-NE2 2.93Å; H137-Q141 PolarHBondContact NE2-NE2 3.45Å; H137-Q141 WeakPolarHBondContact O-CG 3.41Å; H137-Q141 PolarHBondContact O-N 2.95Å; L138-Q141 PolarHBondContact O-N 2.92Å; Q141-A143 VanDerWaalsContact C-N 3.34Å; Q141-A143 PolarHBondContact O-N 2.97Å; Q141-K144 WeakPolarHBondContact O-CB 3.44Å; Q141-K144 PolarHBondContact O-N 3.27Å; Q141-I145 WeakPolarHBondContact O-CG1 3.19Å; Q141-I145 PolarHBondContact O-N 2.89Å
142I96.9Very high91.1Very high101 Ų10192.5 Ų92.552%0.51851%0.514SS..Hα-helixtrans-60-46.7176.1-67.4164.2000110L138 R139 K144 I145 V146L138-I142 VanDerWaalsContact O-CG1 3.25Å; L138-I142 WeakPolarHBondContact O-CG1 3.31Å; L138-I142 PolarHBondContact O-N 3Å; R139-I142 PolarHBondContact O-N 3.5Å; I142-K144 VanDerWaalsContact C-N 3.3Å; I142-K144 PolarHBondContact O-N 3.18Å; I142-I145 PolarHBondContact O-N 3.43Å; I142-V146 HydrophobicContact CG2-CG2 4.2Å; I142-V146 WeakPolarHBondContact O-CB 3.24Å; I142-V146 VanDerWaalsContact O-CG2 3.3Å; I142-V146 WeakPolarHBondContact O-CG2 3.47Å; I142-V146 PolarHBondContact O-N 2.82Å
143A96.8Very high89.2Confident58 Ų5889.6 Ų89.648%0.47951%0.513SS..Hα-helixtrans-59.5-40.1177.200000112.1R139 S140 Q141 V146 A147R139-A143 WeakPolarHBondContact O-CB 3.48Å; R139-A143 PolarHBondContact O-N 3.29Å; S140-A143 PolarHBondContact O-N 2.98Å; Q141-A143 VanDerWaalsContact C-N 3.34Å; Q141-A143 PolarHBondContact O-N 2.97Å; A143-V146 PolarHBondContact O-N 3.25Å; A143-A147 WeakPolarHBondContact O-CB 3.44Å; A143-A147 PolarHBondContact O-N 3.43Å
144K95.4Very high87.2Confident142 Ų14288.2 Ų88.262%0.61751%0.512SS*.Hα-helixtrans-64.1-42.3174.9-73.9175.9-174.9178.90112.4S140 Q141 I142 A148S140-K144 WeakPolarHBondContact O-CG 3.45Å; S140-K144 PolarHBondContact O-N 2.8Å; Q141-K144 WeakPolarHBondContact O-CB 3.44Å; Q141-K144 PolarHBondContact O-N 3.27Å; I142-K144 VanDerWaalsContact C-N 3.3Å; I142-K144 PolarHBondContact O-N 3.18Å; K144-A148 WeakPolarHBondContact O-CB 3.18Å; K144-A148 PolarHBondContact O-N 2.93Å
145I95.6Very high85Confident114 Ų11489.1 Ų89.159%0.58552%0.52SS*.Hα-helixtrans-64.9-47.9177.3-67165.5000109.9Q141 I142 A147 A148 D149Q141-I145 WeakPolarHBondContact O-CG1 3.19Å; Q141-I145 PolarHBondContact O-N 2.89Å; I142-I145 PolarHBondContact O-N 3.43Å; I145-A147 VanDerWaalsContact C-N 3.34Å; I145-A147 PolarHBondContact O-N 3.44Å; I145-A148 PolarHBondContact O-N 3.44Å; I145-D149 VanDerWaalsContact O-CB 3.26Å; I145-D149 WeakPolarHBondContact O-CB 3.29Å; I145-D149 PolarHBondContact O-N 3.27Å
146V95.4Very high82.3Confident93 Ų9391 Ų9156%0.56454%0.535SS*.Hα-helixtrans-62.1-41.6178.9172.50000111.3I142 A143 A150I142-V146 HydrophobicContact CG2-CG2 4.2Å; I142-V146 WeakPolarHBondContact O-CB 3.24Å; I142-V146 VanDerWaalsContact O-CG2 3.3Å; I142-V146 WeakPolarHBondContact O-CG2 3.47Å; I142-V146 PolarHBondContact O-N 2.82Å; A143-V146 PolarHBondContact O-N 3.25Å; V146-A150 VanDerWaalsContact O-CB 3.27Å; V146-A150 WeakPolarHBondContact O-CB 3.38Å; V146-A150 PolarHBondContact O-N 3.48Å
147A90.9Very high79.9Confident60 Ų6093.6 Ų93.650%0.49655%0.55SS.*Hα-helixtrans-70.5-37.8176.600000112.6A143 I145 A150 A151A143-A147 WeakPolarHBondContact O-CB 3.44Å; A143-A147 PolarHBondContact O-N 3.43Å; I145-A147 VanDerWaalsContact C-N 3.34Å; I145-A147 PolarHBondContact O-N 3.44Å; A147-A150 PolarHBondContact O-N 3.23Å; A147-A151 VanDerWaalsContact O-CB 3.25Å; A147-A151 WeakPolarHBondContact O-CB 3.47Å; A147-A151 PolarHBondContact O-N 3.47Å
148A83.7Confident77.8Confident58 Ų5895.6 Ų95.648%0.47957%0.565SS.*Hα-helixtrans-68.2-38.1175.600000111.9K144 I145 A151 S152K144-A148 WeakPolarHBondContact O-CB 3.18Å; K144-A148 PolarHBondContact O-N 2.93Å; I145-A148 PolarHBondContact O-N 3.44Å; A148-A151 PolarHBondContact O-N 2.92Å; A148-S152 WeakPolarHBondContact O-CB 3.47Å; A148-S152 PolarHBondContact O-N 3.42Å; A148-S152 PolarHBondContact O-OG 3.38Å; A148-S152 VanDerWaalsContact O-OG 3.04Å
149D82.3Confident75.2Confident114 Ų114101 Ų10161%0.6158%0.584SS**Hα-helixtrans-68.3-39.4174.3-165.749.2000111.5I145 A151 S152 A153I145-D149 VanDerWaalsContact O-CB 3.26Å; I145-D149 WeakPolarHBondContact O-CB 3.29Å; I145-D149 PolarHBondContact O-N 3.27Å; D149-A151 VanDerWaalsContact C-N 3.34Å; D149-S152 WeakPolarHBondContact CA-OG 3.3Å; D149-S152 PolarHBondContact O-OG 3.48Å; D149-A153 VanDerWaalsContact O-CB 3.25Å; D149-A153 WeakPolarHBondContact O-CB 3.2Å; D149-A153 PolarHBondContact O-N 3.08Å
150A75.1Confident72.5Confident60 Ų60101.5 Ų101.550%0.49660%0.599SS.*Hα-helixtrans-66.1-35.5171.600000112.5V146 A147 S154V146-A150 VanDerWaalsContact O-CB 3.27Å; V146-A150 WeakPolarHBondContact O-CB 3.38Å; V146-A150 PolarHBondContact O-N 3.48Å; A147-A150 PolarHBondContact O-N 3.23Å; A150-S154 PolarHBondContact O-N 2.9Å; A150-S154 VanDerWaalsContact O-N 3.15Å
151A65Low69.9Low45 Ų45104.2 Ų104.237%0.37262%0.618SS.*Hα-helixtrans-75.9-37.9178.100000112.7A147 A148 D149 A153 S154 L155A147-A151 VanDerWaalsContact O-CB 3.25Å; A147-A151 WeakPolarHBondContact O-CB 3.47Å; A147-A151 PolarHBondContact O-N 3.47Å; A148-A151 PolarHBondContact O-N 2.92Å; D149-A151 VanDerWaalsContact C-N 3.34Å; A151-A153 VanDerWaalsContact C-N 3.33Å; A151-S154 WeakPolarHBondContact CA-OG 3.47Å; A151-S154 PolarHBondContact O-N 2.92Å; A151-S154 VanDerWaalsContact O-N 3.08Å; A151-S154 PolarHBondContact O-OG 2.66Å; A151-L155 WeakPolarHBondContact O-CG 3.27Å; A151-L155 PolarHBondContact O-N 3.07Å
152S59Low67.9Low70 Ų70105.9 Ų105.949%0.4964%0.637SS.*Hα-helixtrans-68-34172.857.40000111.6A148 D149 S154 L155A148-S152 WeakPolarHBondContact O-CB 3.47Å; A148-S152 PolarHBondContact O-N 3.42Å; A148-S152 PolarHBondContact O-OG 3.38Å; A148-S152 VanDerWaalsContact O-OG 3.04Å; D149-S152 WeakPolarHBondContact CA-OG 3.3Å; D149-S152 PolarHBondContact O-OG 3.48Å; S152-S154 VanDerWaalsContact C-N 3.26Å; S152-S154 PolarHBondContact O-N 3.49Å; S152-L155 PolarHBondContact O-N 2.89Å
153A57.5Low64.9Low72 Ų72104.7 Ų104.760%0.59565%0.649SS**Hα-helixtrans-67.3-22.7168.400000113.4D149 A151D149-A153 VanDerWaalsContact O-CB 3.25Å; D149-A153 WeakPolarHBondContact O-CB 3.2Å; D149-A153 PolarHBondContact O-N 3.08Å; A151-A153 VanDerWaalsContact C-N 3.33Å
154S55.8Low62.2Low86 Ų86107.6 Ų107.660%0.60167%0.666SS**Hα-helixtrans-90.7-10.9177.477.90000115.5A150 A151 S152A150-S154 PolarHBondContact O-N 2.9Å; A150-S154 VanDerWaalsContact O-N 3.15Å; A151-S154 WeakPolarHBondContact CA-OG 3.47Å; A151-S154 PolarHBondContact O-N 2.92Å; A151-S154 VanDerWaalsContact O-N 3.08Å; A151-S154 PolarHBondContact O-OG 2.66Å; S152-S154 VanDerWaalsContact C-N 3.26Å; S152-S154 PolarHBondContact O-N 3.49Å
155L50.9Low59.5Low139 Ų139106.1 Ų106.173%0.72867%0.674SS**  trans-9721.1-177.3-73.7179.1000114.5A151 S152 P157A151-L155 WeakPolarHBondContact O-CG 3.27Å; A151-L155 PolarHBondContact O-N 3.07Å; S152-L155 PolarHBondContact O-N 2.89Å; L155-P157 VanDerWaalsContact C-CD 3.41Å; L155-P157 WeakPolarHBondContact O-CD 3.42Å
156T41.3Very low57Low121 Ų121108.1 Ų108.174%0.74269%0.685SS**  trans-103.390.3164.220.50000110.5
157P46.8Very low54.3Low115 Ų115110.7 Ų110.775%0.74770%0.701SS**  trans-81.6131.315832.2-27.1000109.6L155L155-P157 VanDerWaalsContact C-CD 3.41Å; L155-P157 WeakPolarHBondContact O-CD 3.42Å
158D53Low51.8Low150 Ų150113 Ų11380%0.80271%0.714SS**  trans-21.8131.1173.2-81-40.9000117.8
159F44.3Very low49.8Very low209 Ų209115.2 Ų115.292%0.91773%0.726SS**  trans-16590.1137.1-91.4-70.4000110.1
160L41.5Very low48.1Very low183 Ų183115.4 Ų115.496%0.95873%0.733SS**  trans-160.5111139.7-77.7-165.7000110
161S42.4Very low46.7Very low112 Ų112120.2 Ų120.278%0.78375%0.75SS**  trans-122.5169.8167.7-177.10000106.6
162P56.8Low45.8Very low122 Ų122123.9 Ų123.979%0.79277%0.769SS**  cis-123.6158.8-40.532.2-15.6000111.7
163G33.8Very low45.2Very low76 Ų76124.7 Ų124.778%0.78477%0.774SS**  trans173.486.6170.100000117.6
164S40.5Very low44.4Very low119 Ų119130.9 Ų130.983%0.83279%0.788SS**  trans22.8112.9148.4175.80000119.3
165S37.7Very low43.7Very low111 Ų111130.3 Ų130.378%0.77680%0.795SS**  -176136.5103.153.20000110.9
166N43Very low43.6Very low155 Ų155129 Ų12983%0.82980%0.798SS**  trans-66.1138-175.6-54.5-53.3000111.8
167V39.5Very low43.7Very low147 Ų147127.1 Ų127.189%0.89179%0.79SS**  -169.6121.5119.9-92.60000111.7
168S37.3Very low43.7Very low109 Ų109130.5 Ų130.576%0.76279%0.793SS**  trans82.197.7148.5-146.30000122
169S42.8Very low43.3Very low105 Ų105131.5 Ų131.573%0.73479%0.793SS**  75.1146.4129.6630000120.8
170P46.5Very low43.4Very low118 Ų118126.8 Ų126.877%0.76679%0.786SS**  trans-98.1139.7-136.635.9-32.1000114
171L46.3Very low43.8Very low161 Ų161124.5 Ų124.584%0.84378%0.78SS**  trans-71.9135.6149.8-99.591000109.1
172P45Very low44Very low121 Ų121125 Ų12579%0.78678%0.778SS**  trans-90.7115.3139.630.8-19.5000108.1
173C46.2Very low43.4Very low88 Ų88123.9 Ų123.960%0.59577%0.773SS**  trans-70139.4153.1-172.10000107.5
174F41.5Very low43.8Very low202 Ų202129.3 Ų129.389%0.88678%0.775SS**  trans150.1123.3138.9-75.1-60.9000111.8
175G40.9Very low44Very low73 Ų73129.6 Ų129.675%0.75377%0.772SS**  trans101.4105.1148.200000116.5S177G175-S177 PolarHBondContact O-N 2.8Å
176S48.6Very low44.1Very low112 Ų112132 Ų13278%0.78377%0.774SS**  trans-65.6101.4155.863.50000108.7
177S44Very low44.3Very low81 Ų81129 Ų12957%0.56677%0.766SS**  trans-98.398.9165.2-172.90000108.8G175 H179G175-S177 PolarHBondContact O-N 2.8Å; S177-H179 PolarHBondContact O-N 3.15Å; S177-H179 PolarHBondContact OG-CD2 3.48Å; S177-H179 PolarHBondContact OG-NE2 3.43Å
178F46Very low44.3Very low187 Ų187129.3 Ų129.382%0.8276%0.763SS**  trans-84.293.5160.8-70.9-77000107.8S180F178-S180 VanDerWaalsContact C-N 3.3Å; F178-S180 PolarHBondContact O-N 3.39Å; F178-S180 VanDerWaalsContact O-N 3.16Å
179H44.4Very low44.4Very low170 Ų170132.1 Ų132.179%0.78777%0.767SS**  trans-77.488.2156.7-69.1-71.5000107.9S177S177-H179 PolarHBondContact O-N 3.15Å; S177-H179 PolarHBondContact OG-CD2 3.48Å; S177-H179 PolarHBondContact OG-NE2 3.43Å
180S47.7Very low44.1Very low111 Ų111133 Ų13378%0.77677%0.768SS**  trans-80.4114.3158.7-100.60000108.6F178 T182F178-S180 VanDerWaalsContact C-N 3.3Å; F178-S180 PolarHBondContact O-N 3.39Å; F178-S180 VanDerWaalsContact O-N 3.16Å; S180-T182 PolarHBondContact O-N 3.02Å; S180-T182 VanDerWaalsContact O-N 3.15Å
181T49.4Very low43.9Very low135 Ų135135.9 Ų135.983%0.82877%0.772SS**  trans-63100173.6-54.50000111.1
182T45.5Very low43.6Very low121 Ų121136.7 Ų136.774%0.74277%0.771SS**  trans-143.5101146.756.30000109.1S180 F184S180-T182 PolarHBondContact O-N 3.02Å; S180-T182 VanDerWaalsContact O-N 3.15Å; T182-F184 PolarHBondContact O-N 3.31Å
183S44.2Very low43.1Very low100 Ų100137.1 Ų137.170%0.69977%0.772SS**  trans-72.6108.4165136.80000108
184F42.2Very low42.8Very low189 Ų189141.3 Ų141.383%0.82978%0.783SS**  trans-135.1116.1146.6-73.1-74.5000107.7T182 I186T182-F184 PolarHBondContact O-N 3.31Å; F184-I186 PolarHBondContact O-N 3.13Å
185V46Very low42.5Very low125 Ų125137 Ų13776%0.75877%0.773SS**  trans-67.9117.7172.2-171.10000106.5
186I39.3Very low42Very low161 Ų161141.6 Ų141.683%0.82678%0.775SS**  trans-109.2104.9156.9-59.5-179.8000104.4F184F184-I186 PolarHBondContact O-N 3.13Å
187S47.9Very low41.7Very low94 Ų94142.7 Ų142.766%0.65778%0.776SS**  trans-58.4136.7171.8-58.50000109.5I189S187-I189 PolarHBondContact O-N 2.85Å
188D39.1Very low41.5Very low153 Ų153144.3 Ų144.382%0.81879%0.785SS**  trans-48126.3159.8-61-52000110.2
189I39.1Very low40.9Very low167 Ų167144.1 Ų144.186%0.85679%0.786SS**  trans-128.791.8144.944.7161.6000107.2S187 E191S187-I189 PolarHBondContact O-N 2.85Å; I189-E191 PolarHBondContact O-N 3.33Å
190T35.8Very low40.5Very low124 Ų124143.9 Ų143.976%0.76179%0.79SS**  trans-50.3117.6146.439.60000109.7
191E42.9Very low39.8Very low179 Ų179144.6 Ų144.684%0.83679%0.792SS**  trans-148.7116.2139.5-156.4172.9-177.900109.3I189I189-E191 PolarHBondContact O-N 3.33Å
192E39.6Very low39Very low177 Ų177143.4 Ų143.483%0.82779%0.789SS**  trans-72.5123.2174.5-33.4-112.9135.500107
193T36Very low38.7Very low131 Ų131143.9 Ų143.980%0.80479%0.792SS**  trans-152.1109.2152.1-49.60000109.4
194E39.2Very low38.4Very low176 Ų176145.1 Ų145.182%0.82280%0.797SS**  trans-62.7161.2166.7-165.1-178.8-179.600110.7
195V34Very low38.3Very low112 Ų112143 Ų14368%0.67979%0.794SS**  trans118.7122.2151.2-170.10000117.4
196E31.4Very low37.7Very low169 Ų169145.3 Ų145.379%0.7980%0.801SS**  trans83.6104.3153.5-96.2168.9112.500122.8
197V42.7Very low37.2Very low135 Ų135142.3 Ų142.382%0.81879%0.793SS**  trans-71.4136.4148.4175.60000109.3
198P39Very low36.4Very low115 Ų115143.6 Ų143.675%0.74780%0.802SS**  trans-127.8127.91429.812.1000114.1
199E32.6Very low36Very low182 Ų182141.1 Ų141.185%0.8580%0.803SS**  trans-1.1134.3157.6-57.9-169.9129.100121.8
200L36.4Very low35.7Very low166 Ų166138.4 Ų138.487%0.86980%0.799SS**PPolyproline II helixtrans-66145.6156.1-66.3167.1000111.2
201P34.6Very low36.1Very low126 Ų126137.4 Ų137.482%0.81880%0.795SS**PPolyproline II helixtrans-101.3129.9153.731.4-24.1000112
202S32.4Very low35.3Very low109 Ų109137.2 Ų137.276%0.76279%0.794SS**PPolyproline II helixtrans-64.4150.7178.1-56.10000115
203V37.5Very low34.8Very low132 Ų132133.3 Ų133.380%0.879%0.785SS**  trans-20.2158.4159.1-91.10000118.6
204P38.6Very low34.6Very low126 Ų126133.5 Ų133.582%0.81879%0.79SS**  -132.5139104.835-24.1000115.7
205L39.7Very low34.5Very low145 Ų145133 Ų13376%0.75979%0.785SS**  trans-55.1132.9160.3-172.377.5000111.3
206L33.9Very low34.7Very low173 Ų173133.8 Ų133.891%0.90679%0.792SS**  trans-136.6113.2159.4-99.8162.5000110
207C28.3Very low34.5Very low98 Ų98132.9 Ų132.966%0.66279%0.788SS**  trans-80.4145.3172.8-680000111.5
208S31Very low34.4Very low120 Ų120136 Ų13684%0.83979%0.793SS**  trans57.2117.5141.2-179.90000120.7
209A30.6Very low34.3Very low101 Ų101139.6 Ų139.684%0.83580%0.797SS**  -167.2125.3128.500000112.4
210S34.6Very low34.2Very low111 Ų111135.9 Ų135.978%0.77680%0.798SS**  trans-101.9159.7147.1179.70000105.5
211P43.7Very low34.2Very low103 Ų103133.6 Ų133.667%0.66979%0.791SS**  cis-142.1-177.129.233-7.5000114.6
212E26.3Very low34.1Very low175 Ų175133.2 Ų133.282%0.81879%0.79SS**  165.3141.2119.2-152.271.9-138.600112.1
213C28.5Very low34.2Very low94 Ų94132.5 Ų132.564%0.63579%0.785SS**  trans-45.4144176.8-175.40000117.5
214C31.7Very low34Very low136 Ų136131.6 Ų131.692%0.91978%0.784SS**  trans-146.1107.9144-84.50000110.1
215K37.2Very low33.7Very low166 Ų166130.4 Ų130.472%0.72278%0.779SS**  trans-84.6160154.6-73.3-161.5174.1-176.90109.1
216P37.6Very low33.9Very low127 Ų127130.4 Ų130.483%0.82578%0.775SS**  -138.4156101.629.6-12.6000114.6
217E28.7Very low34.5Very low151 Ų151129.9 Ų129.971%0.70677%0.768SS**  trans-78.6147.6177-54-176.5125.400112
218H38.8Very low34.9Very low199 Ų199133 Ų13392%0.92178%0.778SS**  trans-141.5133.2140.9-79.2-74000110.6
219K36.8Very low35.7Very low191 Ų191134.5 Ų134.583%0.8378%0.777SS**  trans-92.1135.7-172.7169.5-175-178.6-1800110.3
220A31.4Very low36.1Very low104 Ų104134.2 Ų134.286%0.8677%0.767SS**  trans-154.5120.3147.600000110.3
221T36.1Very low36.9Very low119 Ų119134.8 Ų134.873%0.7376%0.761SS**  trans-86.5139.9174.1-630000109.7
222C32.3Very low36.9Very low117 Ų117133.9 Ų133.979%0.79176%0.757SS**  trans-178.2100.2148.4-93.10000107.4
223S34.1Very low37.8Very low95 Ų95133 Ų13366%0.66476%0.757SS**  61113.490.167.70000115.5
224S33.6Very low38.4Very low113 Ų113133.9 Ų133.979%0.7976%0.764SS**  trans36.5130.6147.766.20000120.5
225S33.4Very low39.1Very low101 Ų101136.1 Ų136.171%0.70676%0.758SS**  -178.716397.969.20000110
226E42.8Very low39.5Very low144 Ų144133.5 Ų133.567%0.67377%0.767SS**  trans-57.9167.2177.853.1-110.2103.300115.6
227E48Very low40.1Very low163 Ų163132.8 Ų132.876%0.76277%0.765SS**  trans49.1107.5150.673.4-162.7-178.100118.2
228D36.4Very low41.2Very low163 Ų163130.4 Ų130.487%0.87277%0.765SS**  trans-158.5117.4136.9-93.8-46.4000109.6C230D228-C230 PolarHBondContact O-N 2.64Å
229D48.3Very low42Very low152 Ų152128.9 Ų128.981%0.81376%0.756SS**  trans-65.373.5168.7-17021.7000109.1
230C37.6Very low43.6Very low94 Ų94122.5 Ų122.564%0.63574%0.739SS**  trans-92.997.3164.8-171.60000107.4D228 S232D228-C230 PolarHBondContact O-N 2.64Å; C230-S232 PolarHBondContact O-N 3.25Å; C230-S232 PolarHBondContact O-OG 3.04Å
231I51.6Low46Very low124 Ų124122.2 Ų122.264%0.63672%0.723SS**  trans-54.179.8162.1-52.8173.3000107.6L233I231-L233 HydrophobicContact CG2-CD1 4.47Å; I231-L233 HydrophobicContact CG2-CD2 3.74Å; I231-L233 HydrophobicContact CG2-CG 3.8Å; I231-L233 PolarHBondContact O-N 3.24Å
232S43.6Very low48.6Very low84 Ų84122.2 Ų122.259%0.58772%0.717SS**  trans-77.982.8176.8-69.70000106.6C230 S234C230-S232 PolarHBondContact O-N 3.25Å; C230-S232 PolarHBondContact O-OG 3.04Å; S232-S234 PolarHBondContact O-N 3.33Å
233L45.6Very low51.4Low155 Ų155121.8 Ų121.881%0.81270%0.704SS**  trans-6637.1166.7-60.9-179.3000112.1I231I231-L233 HydrophobicContact CG2-CD1 4.47Å; I231-L233 HydrophobicContact CG2-CD2 3.74Å; I231-L233 HydrophobicContact CG2-CG 3.8Å; I231-L233 PolarHBondContact O-N 3.24Å
234S39.9Very low54Low113 Ų113118.1 Ų118.179%0.7968%0.682SS**  trans-116.718.3-176.2-57.50000112.9S232S232-S234 PolarHBondContact O-N 3.33Å
235K46.8Very low56.8Low183 Ų183117.1 Ų117.180%0.79667%0.666SS**  trans-13458169.6-108.4171.8-178156.40110.9S237 S238K235-S237 PolarHBondContact O-N 3.21Å; K235-S238 PolarHBondContact O-N 2.83Å
236A45.7Very low59.5Low111 Ų111117 Ų11792%0.91766%0.657SS**  trans-73.747166.300000112.4
237S51Low61.9Low112 Ų112115.8 Ų115.878%0.78365%0.65SS**  trans-13349.7158.7166.10000106.1K235 F239K235-S237 PolarHBondContact O-N 3.21Å; S237-F239 VanDerWaalsContact C-N 3.34Å; S237-F239 PolarHBondContact O-N 3.43Å
238S51.3Low63.8Low101 Ų101112.3 Ų112.371%0.70664%0.636SS**  trans-7395.8171.8-176.20000106.5K235 A240K235-S238 PolarHBondContact O-N 2.83Å; S238-A240 VanDerWaalsContact C-N 3.29Å; S238-A240 PolarHBondContact O-N 2.93Å
239F56.3Low66.3Low167 Ų167110.5 Ų110.573%0.73262%0.621SS**  trans-52.6105.4158.7176.8-95.2000105.3S237 D241S237-F239 VanDerWaalsContact C-N 3.34Å; S237-F239 PolarHBondContact O-N 3.43Å; F239-D241 PolarHBondContact O-N 3.21Å
240A70.1Confident68.2Low57 Ų57108.5 Ų108.547%0.47161%0.607SS.*  trans-55118.5-175.200000107.7S238 M242 I245S238-A240 VanDerWaalsContact C-N 3.29Å; S238-A240 PolarHBondContact O-N 2.93Å; A240-M242 PolarHBondContact O-N 3.18Å; A240-I245 HydrophobicContact CB-CD1 3.74Å
241D82.8Confident70.5Confident98 Ų98110.5 Ų110.552%0.52460%0.601SS.*  trans-55.7105-177.4172.413.2000108.4F239 M243 G244 I245F239-D241 PolarHBondContact O-N 3.21Å; D241-M243 PolarHBondContact O-N 2.93Å; D241-M243 VanDerWaalsContact O-N 3.16Å; D241-M243 VanDerWaalsContact OD1-CB 3.27Å; D241-M243 WeakPolarHBondContact OD1-CB 3.49Å; D241-M243 PolarHBondContact OD1-N 3.36Å; D241-G244 VanDerWaalsContact CG-N 3.26Å; D241-G244 CarbonylContact O-C 3.55Å; D241-G244 VanDerWaalsContact O-CA 3.31Å; D241-G244 WeakPolarHBondContact O-CA 3.34Å; D241-G244 PolarHBondContact O-N 3.37Å; D241-G244 PolarHBondContact OD1-N 2.88Å; D241-G244 PolarHBondContact OD2-N 2.85Å; D241-I245 WeakPolarHBondContact O-CG1 3.21Å; D241-I245 PolarHBondContact O-N 3.33Å
242M90.6Very high71.7Confident119 Ų119109.8 Ų109.859%0.58660%0.596SS**Hα-helixtrans-60.3-29.6-176.2-157.2-162.2-5200110.7A240 I245 L246A240-M242 PolarHBondContact O-N 3.18Å; M242-I245 PolarHBondContact O-N 2.96Å; M242-L246 WeakPolarHBondContact O-CB 3.09Å; M242-L246 VanDerWaalsContact O-CG 3.24Å; M242-L246 WeakPolarHBondContact O-CG 3.5Å; M242-L246 PolarHBondContact O-N 3.05Å
243M89.1Confident73.2Confident109 Ų109111.2 Ų111.254%0.53759%0.592SS.*Hα-helixtrans-72.2-38.6174.7-159.859.757.600111.3D241 L246 K247D241-M243 PolarHBondContact O-N 2.93Å; D241-M243 VanDerWaalsContact O-N 3.16Å; D241-M243 VanDerWaalsContact OD1-CB 3.27Å; D241-M243 WeakPolarHBondContact OD1-CB 3.49Å; D241-M243 PolarHBondContact OD1-N 3.36Å; M243-L246 PolarHBondContact O-N 2.77Å; M243-K247 WeakPolarHBondContact O-CB 3.28Å; M243-K247 WeakPolarHBondContact O-CG 3.26Å; M243-K247 PolarHBondContact O-N 3.02Å
244G89.7Confident74.2Confident18 Ų18109 Ų10919%0.18658%0.577CS.*Hα-helixtrans-57.1-49.5169.100000111.9D241 L246 K247 D248D241-G244 VanDerWaalsContact CG-N 3.26Å; D241-G244 CarbonylContact O-C 3.55Å; D241-G244 VanDerWaalsContact O-CA 3.31Å; D241-G244 WeakPolarHBondContact O-CA 3.34Å; D241-G244 PolarHBondContact O-N 3.37Å; D241-G244 PolarHBondContact OD1-N 2.88Å; D241-G244 PolarHBondContact OD2-N 2.85Å; G244-L246 PolarHBondContact O-N 3.22Å; G244-K247 WeakPolarHBondContact O-CB 3.4Å; G244-K247 PolarHBondContact O-N 3.13Å; G244-D248 PolarHBondContact O-N 3.14Å
245I91.5Very high75.3Confident91 Ų91106.1 Ų106.147%0.46756%0.557SS.*Hα-helixtrans-60.9-46.3178-61.1169.3000111.3A240 D241 M242 K247 D248 F249A240-I245 HydrophobicContact CB-CD1 3.74Å; D241-I245 WeakPolarHBondContact O-CG1 3.21Å; D241-I245 PolarHBondContact O-N 3.33Å; M242-I245 PolarHBondContact O-N 2.96Å; I245-K247 VanDerWaalsContact C-N 3.31Å; I245-K247 PolarHBondContact O-N 2.98Å; I245-D248 PolarHBondContact O-N 3.17Å; I245-F249 PolarHBondContact O-N 3.36Å
246L91.7Very high75.8Confident99 Ų99102.5 Ų102.552%0.51854%0.543SS..Hα-helixtrans-64.4-36.6178.7-73.3169.4000111.9M242 M243 G244 F249 H250M242-L246 WeakPolarHBondContact O-CB 3.09Å; M242-L246 VanDerWaalsContact O-CG 3.24Å; M242-L246 WeakPolarHBondContact O-CG 3.5Å; M242-L246 PolarHBondContact O-N 3.05Å; M243-L246 PolarHBondContact O-N 2.77Å; G244-L246 PolarHBondContact O-N 3.22Å; L246-F249 PolarHBondContact O-N 3.38Å; L246-H250 PolarHBondContact O-N 3.12Å
247K91.6Very high76.3Confident119 Ų119102.2 Ų102.252%0.51753%0.526SS..Hα-helixtrans-66.3-40.4173.5-75.6170.7177.91770111.8M243 G244 I245 H250 R251M243-K247 WeakPolarHBondContact O-CB 3.28Å; M243-K247 WeakPolarHBondContact O-CG 3.26Å; M243-K247 PolarHBondContact O-N 3.02Å; G244-K247 WeakPolarHBondContact O-CB 3.4Å; G244-K247 PolarHBondContact O-N 3.13Å; I245-K247 VanDerWaalsContact C-N 3.31Å; I245-K247 PolarHBondContact O-N 2.98Å; K247-H250 PolarHBondContact O-N 3.4Å; K247-R251 WeakPolarHBondContact O-CB 3.3Å; K247-R251 PolarHBondContact O-N 3.49Å
248D87.8Confident76.6Confident89 Ų89103 Ų10348%0.47652%0.52SS..Hα-helixtrans-65.2-41.5175.9-73.4-23.8000111.9G244 I245 H250 R251 M252G244-D248 PolarHBondContact O-N 3.14Å; I245-D248 PolarHBondContact O-N 3.17Å; D248-H250 VanDerWaalsContact C-N 3.34Å; D248-H250 PolarHBondContact O-N 3.23Å; D248-R251 WeakPolarHBondContact O-CB 3.45Å; D248-R251 PolarHBondContact O-N 3.3Å; D248-R251 IonicContact OD1-CZ 3.41Å; D248-R251 IonicContact OD1-NE 3.33Å; D248-R251 PolarHBondContact OD1-NE 3.34Å; D248-R251 IonicContact OD1-NH2 2.65Å; D248-R251 PolarHBondContact OD1-NH2 3.24Å; D248-M252 WeakPolarHBondContact O-CB 3.27Å; D248-M252 PolarHBondContact O-N 3.24Å
249F90.4Very high76.6Confident125 Ų125102.9 Ų102.955%0.54851%0.512SS..Hα-helixtrans-62.5-42.3175.3-171.3-99.5000111.8I245 L246 M252 K253I245-F249 PolarHBondContact O-N 3.36Å; L246-F249 PolarHBondContact O-N 3.38Å; F249-M252 HydrophobicContact CD2-CE 4.09Å; F249-M252 HydrophobicContact CE2-CE 4.3Å; F249-M252 PolarHBondContact O-N 3Å; F249-K253 WeakPolarHBondContact O-CB 3.48Å; F249-K253 PolarHBondContact O-N 3.43Å
250H88Confident76.3Confident111 Ų111104.1 Ų104.151%0.51451%0.512SS..Hα-helixtrans-64.8-42.6175.5-172.7-93.2000112.3L246 K247 D248 K253 Q254L246-H250 PolarHBondContact O-N 3.12Å; K247-H250 PolarHBondContact O-N 3.4Å; D248-H250 VanDerWaalsContact C-N 3.34Å; D248-H250 PolarHBondContact O-N 3.23Å; H250-K253 PolarHBondContact O-N 3.35Å; H250-Q254 PolarHBondContact CE1-NE2 3.37Å; H250-Q254 WeakPolarHBondContact O-CG 3.32Å; H250-Q254 PolarHBondContact O-N 2.9Å
251R85.5Confident75.2Confident136 Ų136106 Ų10651%0.51352%0.522SS..Hα-helixtrans-57.8-48172.6-107.9-173.8-63-82.10.9112.1K247 D248 K253 Q254 S255K247-R251 WeakPolarHBondContact O-CB 3.3Å; K247-R251 PolarHBondContact O-N 3.49Å; D248-R251 WeakPolarHBondContact O-CB 3.45Å; D248-R251 PolarHBondContact O-N 3.3Å; D248-R251 IonicContact OD1-CZ 3.41Å; D248-R251 IonicContact OD1-NE 3.33Å; D248-R251 PolarHBondContact OD1-NE 3.34Å; D248-R251 IonicContact OD1-NH2 2.65Å; D248-R251 PolarHBondContact OD1-NH2 3.24Å; R251-K253 VanDerWaalsContact C-N 3.33Å; R251-Q254 PolarHBondContact O-N 3.04Å; R251-S255 PolarHBondContact O-N 2.85Å; R251-S255 PolarHBondContact O-OG 2.96Å
252M77.2Confident73.5Confident108 Ų108105 Ų10553%0.53252%0.523SS..Hα-helixtrans-66.8-35.8-179.3-172.3177.868.500111.6D248 F249 S255 Q256D248-M252 WeakPolarHBondContact O-CB 3.27Å; D248-M252 PolarHBondContact O-N 3.24Å; F249-M252 HydrophobicContact CD2-CE 4.09Å; F249-M252 HydrophobicContact CE2-CE 4.3Å; F249-M252 PolarHBondContact O-N 3Å; M252-S255 WeakPolarHBondContact CA-OG 3.16Å; M252-S255 PolarHBondContact O-N 3.43Å; M252-S255 PolarHBondContact O-OG 2.92Å; M252-Q256 VanDerWaalsContact O-CB 3.27Å; M252-Q256 WeakPolarHBondContact O-CB 3.48Å; M252-Q256 PolarHBondContact O-N 3.01Å
253K74.9Confident71.4Confident115 Ų115106.1 Ų106.150%0.553%0.53SS..Hα-helixtrans-67.3-42175.8-163.2178.2179.5-173.20111.6F249 H250 R251 Q256 D257F249-K253 WeakPolarHBondContact O-CB 3.48Å; F249-K253 PolarHBondContact O-N 3.43Å; H250-K253 PolarHBondContact O-N 3.35Å; R251-K253 VanDerWaalsContact C-N 3.33Å; K253-Q256 PolarHBondContact O-N 2.88Å; K253-D257 PolarHBondContact O-N 3.4Å
254Q66.9Low69.8Low108 Ų108108.7 Ų108.751%0.50554%0.538SS..Hα-helixtrans-63.8-40.3173.9-73-174-23.700112.4H250 R251 Q256 L258H250-Q254 PolarHBondContact CE1-NE2 3.37Å; H250-Q254 WeakPolarHBondContact O-CG 3.32Å; H250-Q254 PolarHBondContact O-N 2.9Å; R251-Q254 PolarHBondContact O-N 3.04Å; Q254-Q256 VanDerWaalsContact C-N 3.35Å; Q254-L258 WeakPolarHBondContact O-CG 3.35Å; Q254-L258 PolarHBondContact O-N 3.38Å
255S61.7Low68.2Low52 Ų52117.1 Ų117.136%0.36457%0.573SS.*Hα-helixtrans-71.1-30.917567.70000112.2R251 M252 L258 N259R251-S255 PolarHBondContact O-N 2.85Å; R251-S255 PolarHBondContact O-OG 2.96Å; M252-S255 WeakPolarHBondContact CA-OG 3.16Å; M252-S255 PolarHBondContact O-N 3.43Å; M252-S255 PolarHBondContact O-OG 2.92Å; S255-L258 PolarHBondContact O-N 2.74Å; S255-N259 WeakPolarHBondContact O-CB 3.46Å; S255-N259 PolarHBondContact O-N 2.6Å; S255-N259 PolarHBondContact O-ND2 3.23Å
256Q58.9Low67Low107 Ų107118.8 Ų118.850%0.558%0.579SS.*Hα-helixtrans-66.5-41.1175.2-173.8173.517.100112.1M252 K253 Q254 L258 N259 R260M252-Q256 VanDerWaalsContact O-CB 3.27Å; M252-Q256 WeakPolarHBondContact O-CB 3.48Å; M252-Q256 PolarHBondContact O-N 3.01Å; K253-Q256 PolarHBondContact O-N 2.88Å; Q254-Q256 VanDerWaalsContact C-N 3.35Å; Q256-L258 PolarHBondContact O-N 3.12Å; Q256-N259 PolarHBondContact O-N 2.64Å; Q256-R260 VanDerWaalsContact O-CB 3.3Å; Q256-R260 WeakPolarHBondContact O-CB 3.42Å; Q256-R260 PolarHBondContact O-N 2.94Å
257D55.1Low66.5Low105 Ų105118.4 Ų118.456%0.56158%0.577SS**Hα-helixtrans-64.4-30.6176.2-69.5-32.9000111.8K253K253-D257 PolarHBondContact O-N 3.4Å
258L56.9Low66Low128 Ų128117 Ų11767%0.6758%0.58SS**Hα-helixtrans-81-25174.3-62.3174000114Q254 S255 Q256 S261Q254-L258 WeakPolarHBondContact O-CG 3.35Å; Q254-L258 PolarHBondContact O-N 3.38Å; S255-L258 PolarHBondContact O-N 2.74Å; Q256-L258 PolarHBondContact O-N 3.12Å; L258-S261 PolarHBondContact O-OG 3.43Å
259N52.8Low65.8Low100 Ų100115.4 Ų115.454%0.53558%0.579SS.*Hα-helixtrans-90.9-23.1177.2-78.5-75.1000112.8S255 Q256 S261 S262 L263S255-N259 WeakPolarHBondContact O-CB 3.46Å; S255-N259 PolarHBondContact O-N 2.6Å; S255-N259 PolarHBondContact O-ND2 3.23Å; Q256-N259 PolarHBondContact O-N 2.64Å; N259-S261 PolarHBondContact O-N 2.83Å; N259-S262 PolarHBondContact O-N 2.97Å; N259-S262 PolarHBondContact O-OG 3.06Å; N259-L263 PolarHBondContact O-N 2.95Å
260R49.7Very low65.6Low193 Ų193112.7 Ų112.773%0.72857%0.573SS**THydrogen-bonded Turntrans-72.3-19.6174.7-159174-173.5148.71.5112.5Q256Q256-R260 VanDerWaalsContact O-CB 3.3Å; Q256-R260 WeakPolarHBondContact O-CB 3.42Å; Q256-R260 PolarHBondContact O-N 2.94Å
261S46.3Very low65.5Low96 Ų96112.3 Ų112.367%0.67157%0.574SS**THydrogen-bonded Turntrans-84.1-13170.960.60000113.8L258 N259L258-S261 PolarHBondContact O-OG 3.43Å; N259-S261 PolarHBondContact O-N 2.83Å
262S47.7Very low65.6Low78 Ų78110.9 Ų110.955%0.54558%0.575SS.*THydrogen-bonded Turntrans-105-13.2179.9870000114.4N259 K264N259-S262 PolarHBondContact O-N 2.97Å; N259-S262 PolarHBondContact O-OG 3.06Å; S262-K264 PolarHBondContact O-N 3.49Å
263L46.6Very low66.1Low142 Ų142108.7 Ų108.774%0.74357%0.57SS**SBendtrans-7379.4163.1-149.1161.8000106.1N259 E265N259-L263 PolarHBondContact O-N 2.95Å; L263-E265 PolarHBondContact O-N 2.85Å; L263-E265 VanDerWaalsContact O-N 3.07Å
264K55.3Low66.7Low162 Ų162105.9 Ų105.970%0.70456%0.559SS**  trans-40.5123.8167.3-79.6-166.2172.6-174.60106.2S262 E266S262-K264 PolarHBondContact O-N 3.49Å; K264-E266 PolarHBondContact O-N 2.92Å
265E55.1Low67.8Low196 Ų196104.7 Ų104.792%0.91656%0.559SS**  trans-59.379.6170.1-174.5173.9-17200106.9L263 D267L263-E265 PolarHBondContact O-N 2.85Å; L263-E265 VanDerWaalsContact O-N 3.07Å; E265-D267 PolarHBondContact O-N 3.16Å
266E66.3Low69Low126 Ų126106.2 Ų106.259%0.58956%0.563SS**  trans-70.5119.7178.9-145.895.3-149.300105.1K264 V270K264-E266 PolarHBondContact O-N 2.92Å; E266-V270 HydrophobicContact CG-CG1 4.32Å
267D82.4Confident70.2Confident91 Ų91109 Ų10949%0.48757%0.568SS.*  trans-48.4125179.8174.1-1000108.8E265 A269 V270 L271E265-D267 PolarHBondContact O-N 3.16Å; D267-A269 PolarHBondContact O-N 2.88Å; D267-A269 WeakPolarHBondContact OD1-CB 3.43Å; D267-A269 PolarHBondContact OD1-N 3.33Å; D267-V270 HydrophobicContact CB-CG2 4.03Å; D267-V270 WeakPolarHBondContact O-CA 3.33Å; D267-V270 WeakPolarHBondContact O-CB 3.02Å; D267-V270 PolarHBondContact O-N 2.65Å; D267-L271 PolarHBondContact O-N 2.83Å
268P80.6Confident71.6Confident90 Ų90111.1 Ų111.158%0.58457%0.569SS**Hα-helixtrans-52.6-27.9-179.520.8-34.2000112.7L271 I272P268-L271 PolarHBondContact O-N 3.3Å; P268-I272 WeakPolarHBondContact O-CB 3.38Å; P268-I272 WeakPolarHBondContact O-CD1 3.44Å; P268-I272 WeakPolarHBondContact O-CG1 3.32Å; P268-I272 PolarHBondContact O-N 3.47Å
269A84.3Confident72.8Confident54 Ų54111.7 Ų111.745%0.44657%0.566SS.*Hα-helixtrans-64.7-36.3173.900000113.2D267 S273D267-A269 PolarHBondContact O-N 2.88Å; D267-A269 WeakPolarHBondContact OD1-CB 3.43Å; D267-A269 PolarHBondContact OD1-N 3.33Å; A269-S273 VanDerWaalsContact O-CB 3.29Å; A269-S273 WeakPolarHBondContact O-CB 3.24Å; A269-S273 PolarHBondContact O-N 3.22Å; A269-S273 PolarHBondContact O-OG 3.47Å
270V85.2Confident74Confident69 Ų69111.7 Ų111.742%0.41856%0.561SS.*Hα-helixtrans-69.4-41176.7177.10000110.6E266 D267 S273 E274E266-V270 HydrophobicContact CG-CG1 4.32Å; D267-V270 HydrophobicContact CB-CG2 4.03Å; D267-V270 WeakPolarHBondContact O-CA 3.33Å; D267-V270 WeakPolarHBondContact O-CB 3.02Å; D267-V270 PolarHBondContact O-N 2.65Å; V270-S273 VanDerWaalsContact CA-OG 3.3Å; V270-S273 WeakPolarHBondContact CA-OG 3.43Å; V270-S273 PolarHBondContact O-N 2.95Å; V270-S273 PolarHBondContact O-OG 3.48Å; V270-E274 WeakPolarHBondContact O-CB 3.31Å; V270-E274 PolarHBondContact O-N 3.19Å
271L87.2Confident74.7Confident102 Ų102105.6 Ų105.653%0.53455%0.552SS.*Hα-helixtrans-65.9-43.6177.3-164.370.1000111.6D267 P268 E274 V275D267-L271 PolarHBondContact O-N 2.83Å; P268-L271 PolarHBondContact O-N 3.3Å; L271-E274 PolarHBondContact O-N 3.43Å; L271-V275 VanDerWaalsContact O-CG2 3.28Å; L271-V275 WeakPolarHBondContact O-CG2 3.44Å; L271-V275 PolarHBondContact O-N 3.44Å; L271-V275 VanDerWaalsContact O-N 3.08Å
272I86.3Confident75.1Confident106 Ų106108 Ų10854%0.54456%0.556SS.*Hα-helixtrans-64.4-45.7177.3-68.7165.1000110.4P268 E274 V275 L276P268-I272 WeakPolarHBondContact O-CB 3.38Å; P268-I272 WeakPolarHBondContact O-CD1 3.44Å; P268-I272 WeakPolarHBondContact O-CG1 3.32Å; P268-I272 PolarHBondContact O-N 3.47Å; I272-E274 PolarHBondContact O-N 3.23Å; I272-V275 PolarHBondContact O-N 2.89Å; I272-L276 HydrophobicContact CG2-CD1 3.8Å; I272-L276 HydrophobicContact CG2-CG 4.29Å; I272-L276 WeakPolarHBondContact O-CB 3.32Å; I272-L276 VanDerWaalsContact O-CG 3.24Å; I272-L276 WeakPolarHBondContact O-CG 3.48Å; I272-L276 PolarHBondContact O-N 3.44Å
273S87.6Confident75.5Confident62 Ų62111.4 Ų111.443%0.43456%0.562SS.*Hα-helixtrans-66.1-36.7179.6550000112.8A269 V270 L276 R277A269-S273 VanDerWaalsContact O-CB 3.29Å; A269-S273 WeakPolarHBondContact O-CB 3.24Å; A269-S273 PolarHBondContact O-N 3.22Å; A269-S273 PolarHBondContact O-OG 3.47Å; V270-S273 VanDerWaalsContact CA-OG 3.3Å; V270-S273 WeakPolarHBondContact CA-OG 3.43Å; V270-S273 PolarHBondContact O-N 2.95Å; V270-S273 PolarHBondContact O-OG 3.48Å; S273-L276 PolarHBondContact O-N 2.8Å; S273-R277 VanDerWaalsContact O-CB 3.26Å; S273-R277 WeakPolarHBondContact O-CB 3.2Å; S273-R277 PolarHBondContact O-N 2.85Å
274E87.9Confident75.8Confident57 Ų57111.9 Ų111.927%0.26656%0.56SS.*Hα-helixtrans-63.5-45.1173.4-173.7-179.2-139.500112V270 L271 I272 R277 R278V270-E274 WeakPolarHBondContact O-CB 3.31Å; V270-E274 PolarHBondContact O-N 3.19Å; L271-E274 PolarHBondContact O-N 3.43Å; I272-E274 PolarHBondContact O-N 3.23Å; E274-R277 PolarHBondContact O-N 2.9Å; E274-R277 IonicContact OE1-NH2 3.92Å; E274-R278 WeakPolarHBondContact O-CG 3.06Å; E274-R278 PolarHBondContact O-N 3Å; E274-R278 IonicContact OE1-CZ 3.15Å; E274-R278 IonicContact OE1-NE 3.88Å; E274-R278 IonicContact OE1-NH1 3.52Å; E274-R278 IonicContact OE1-NH2 2.64Å; E274-R278 PolarHBondContact OE1-NH2 2.98Å; E274-R278 IonicContact OE2-CZ 3.37Å; E274-R278 IonicContact OE2-NH1 2.85Å; E274-R278 PolarHBondContact OE2-NH1 2.95Å; E274-R278 IonicContact OE2-NH2 3.33Å; E274-R278 PolarHBondContact OE2-NH2 2.72Å
275V90.6Very high75.7Confident82 Ų82112 Ų11250%0.49756%0.563SS.*Hα-helixtrans-63.8-44177.8170.80000111.1L271 I272 R278 K279L271-V275 VanDerWaalsContact O-CG2 3.28Å; L271-V275 WeakPolarHBondContact O-CG2 3.44Å; L271-V275 PolarHBondContact O-N 3.44Å; L271-V275 VanDerWaalsContact O-N 3.08Å; I272-V275 PolarHBondContact O-N 2.89Å; V275-R278 PolarHBondContact O-N 3.32Å; V275-K279 VanDerWaalsContact O-CB 3.27Å; V275-K279 WeakPolarHBondContact O-CB 3.31Å; V275-K279 PolarHBondContact O-N 3.07Å
276L87.4Confident75.5Confident85 Ų85109.1 Ų109.145%0.44555%0.554SS.*Hα-helixtrans-62.4-45.9176.4-69.1172.4000111.1I272 S273 R278 K279 F280I272-L276 HydrophobicContact CG2-CD1 3.8Å; I272-L276 HydrophobicContact CG2-CG 4.29Å; I272-L276 WeakPolarHBondContact O-CB 3.32Å; I272-L276 VanDerWaalsContact O-CG 3.24Å; I272-L276 WeakPolarHBondContact O-CG 3.48Å; I272-L276 PolarHBondContact O-N 3.44Å; S273-L276 PolarHBondContact O-N 2.8Å; L276-R278 PolarHBondContact O-N 2.99Å; L276-K279 PolarHBondContact O-N 2.83Å; L276-F280 HydrophobicContact CB-CD2 4.43Å; L276-F280 HydrophobicContact CD2-CD2 4.41Å; L276-F280 HydrophobicContact CD2-CE2 3.86Å; L276-F280 WeakPolarHBondContact O-CB 3.33Å; L276-F280 WeakPolarHBondContact O-CD2 3.18Å; L276-F280 PolarHBondContact O-N 2.85Å
277R84.2Confident75Confident164 Ų164109.7 Ų109.762%0.61956%0.56SS**Hα-helixtrans-58.6-47.5176.3-178.7174.652.1119.70.8111.5S273 E274 K279 F280 A281S273-R277 VanDerWaalsContact O-CB 3.26Å; S273-R277 WeakPolarHBondContact O-CB 3.2Å; S273-R277 PolarHBondContact O-N 2.85Å; E274-R277 PolarHBondContact O-N 2.9Å; E274-R277 IonicContact OE1-NH2 3.92Å; R277-K279 PolarHBondContact O-N 3.42Å; R277-F280 PolarHBondContact O-N 3.02Å; R277-A281 WeakPolarHBondContact O-CA 3.36Å; R277-A281 WeakPolarHBondContact O-CB 3.49Å; R277-A281 PolarHBondContact O-N 2.79Å
278R82.6Confident73.5Confident151 Ų151110.3 Ų110.357%0.5757%0.571SS**Hα-helixtrans-62.7-41176.1-72.8-177.8-177135.5-3.9112.5E274 V275 L276E274-R278 WeakPolarHBondContact O-CG 3.06Å; E274-R278 PolarHBondContact O-N 3Å; E274-R278 IonicContact OE1-CZ 3.15Å; E274-R278 IonicContact OE1-NE 3.88Å; E274-R278 IonicContact OE1-NH1 3.52Å; E274-R278 IonicContact OE1-NH2 2.64Å; E274-R278 PolarHBondContact OE1-NH2 2.98Å; E274-R278 IonicContact OE2-CZ 3.37Å; E274-R278 IonicContact OE2-NH1 2.85Å; E274-R278 PolarHBondContact OE2-NH1 2.95Å; E274-R278 IonicContact OE2-NH2 3.33Å; E274-R278 PolarHBondContact OE2-NH2 2.72Å; V275-R278 PolarHBondContact O-N 3.32Å; L276-R278 PolarHBondContact O-N 2.99Å
279K82.6Confident72.1Confident140 Ų140117.3 Ų117.361%0.60959%0.586SS**Hα-helixtrans-66.7-36.1-179.4-169.2-148.6176.6-1750112.4V275 L276 R277V275-K279 VanDerWaalsContact O-CB 3.27Å; V275-K279 WeakPolarHBondContact O-CB 3.31Å; V275-K279 PolarHBondContact O-N 3.07Å; L276-K279 PolarHBondContact O-N 2.83Å; R277-K279 PolarHBondContact O-N 3.42Å
280F77.8Confident70.3Confident99 Ų99124.4 Ų124.443%0.43461%0.606SS.*Hα-helixtrans-101.2-11.7-175.5-66.9-70000114L276 R277 L282 K283L276-F280 HydrophobicContact CB-CD2 4.43Å; L276-F280 HydrophobicContact CD2-CD2 4.41Å; L276-F280 HydrophobicContact CD2-CE2 3.86Å; L276-F280 WeakPolarHBondContact O-CB 3.33Å; L276-F280 WeakPolarHBondContact O-CD2 3.18Å; L276-F280 PolarHBondContact O-N 2.85Å; R277-F280 PolarHBondContact O-N 3.02Å; F280-L282 PolarHBondContact O-N 3.42Å; F280-K283 HydrophobicContact CD1-CD 4.39Å; F280-K283 WeakPolarHBondContact O-CB 3.16Å; F280-K283 PolarHBondContact O-N 2.91Å
281A65.1Low68.6Low65 Ų65124 Ų12454%0.53762%0.616SS.*Hα-helixtrans-60.1-27.6172.400000113R277 K283R277-A281 WeakPolarHBondContact O-CA 3.36Å; R277-A281 WeakPolarHBondContact O-CB 3.49Å; R277-A281 PolarHBondContact O-N 2.79Å; A281-K283 VanDerWaalsContact C-N 3.26Å; A281-K283 PolarHBondContact O-N 3.28Å
282L55.4Low66.3Low146 Ų146130.8 Ų130.876%0.76465%0.653SS**THydrogen-bonded Turntrans-80.82.6175.6-82.6164.9000114.2F280F280-L282 PolarHBondContact O-N 3.42Å
283K54.7Low65.3Low151 Ų151132.1 Ų132.166%0.65766%0.659SS**THydrogen-bonded Turntrans-104.9-7.1-174.8-127.2-178178.9-169.90114.8F280 A281F280-K283 HydrophobicContact CD1-CD 4.39Å; F280-K283 WeakPolarHBondContact O-CB 3.16Å; F280-K283 PolarHBondContact O-N 2.91Å; A281-K283 VanDerWaalsContact C-N 3.26Å; A281-K283 PolarHBondContact O-N 3.28Å
284E52.5Low64.2Low151 Ų151135.7 Ų135.771%0.70667%0.671SS**SBendtrans-92-21.1-178.9-155.6163.9-154.200112.8I287E284-I287 HydrophobicContact CG-CD1 4.49Å; E284-I287 WeakPolarHBondContact O-CG1 3.27Å
285E53.2Low62.8Low165 Ų165140.1 Ų140.177%0.77169%0.693SS**SBendtrans-80.6-24178.5-64.1-157.2170.900114I287 S288E285-I287 VanDerWaalsContact C-N 3.33Å; E285-I287 PolarHBondContact O-N 2.65Å; E285-S288 PolarHBondContact O-N 2.84Å
286D51.8Low61.2Low136 Ų136143.5 Ų143.573%0.72771%0.705SS**THydrogen-bonded Turntrans-79.9-10.9-178.2-79.7-24.1000114.2
287I56.2Low59.6Low138 Ų138147.2 Ų147.271%0.70872%0.721SS**THydrogen-bonded Turntrans-91.8-8.6174.751.4162.1000113.5E284 E285E284-I287 HydrophobicContact CG-CD1 4.49Å; E284-I287 WeakPolarHBondContact O-CG1 3.27Å; E285-I287 VanDerWaalsContact C-N 3.33Å; E285-I287 PolarHBondContact O-N 2.65Å
288S49.9Very low57.9Low103 Ų103146.1 Ų146.172%0.7273%0.728SS**SBendtrans-94.7-12.3-179.7-164.30000113.7E285E285-S288 PolarHBondContact O-N 2.84Å
289R51.3Low56.2Low237 Ų237145.7 Ų145.789%0.89474%0.739SS**SBendtrans-103.935.4-179.7-156.5-178.5-79.4-139.1-2.1113.9
290K46.9Very low54.1Low203 Ų203146.2 Ų146.288%0.88375%0.749SS**SBendtrans-143.960.8168.6-158.7162.2-174.9173.40110.6
291G49.4Very low52.2Low60 Ų60150.1 Ų150.162%0.61978%0.775SS**  trans179.261.7178.700000110.8
292N39.5Very low51Low246 Ų246157.8 Ų157.8100%1.31680%0.797SS**  trans-154.90154.7-85.2-25.3000107.5

Retrieved 292 of 292 residues in 58 ms (Link to these results)