A0A087XNZ1_POEFO Loading...

RISC-loading complex subunit TARBP2

Required for formation of the RNA induced silencing complex (RISC). Component of the RISC loading complex (RLC), also known as the micro-RNA (miRNA) loading complex (miRLC), which is composed of DICER1, AGO2 and TARBP2. Within the RLC/miRLC, DICER1 and TARBP2 are required to process precursor miRNAs (pre-miRNAs) to mature miRNAs and then load them onto AGO2. AGO2 bound to the mature miRNA constitutes the minimal RISC and may subsequently dissociate from DICER1 and TARBP2. May also play a role in the production of short interfering RNAs (siRNAs) from double-stranded RNA (dsRNA) by DICER1.

AlphaFold DB , UniProt , Accession A0A087XNZ1, Species POEFO (Poecilia formosa, Amazon molly), Gene TARBP2, Length 345 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
1M34.5Very low34.7Very low231 Ų231166.8 Ų166.8100%1.13883%0.832SS**  0800-71.4132.9163.900105.4
2N36.2Very low34.7Very low150 Ų150172.9 Ų172.980%0.80284%0.838SS**  58.8114.992.1-63.727.3000110.1
3D33.2Very low34.5Very low151 Ų151172 Ų17281%0.80784%0.84SS**  -170.914488.8-138.7-123.8000111.4
4E44.7Very low35.1Very low175 Ų175167.7 Ų167.782%0.81884%0.836SS**  trans-70.5148.9172.3-65173.199.200111.1
5T34.1Very low35.2Very low145 Ų145160.6 Ų160.689%0.8982%0.822SS**  trans-164.697.1145.3-2.10000111.6
6E37.8Very low35.6Very low175 Ų175157.2 Ų157.282%0.81882%0.817SS**  trans-84.3168.3137-86.1-109.1155.200107.5
7P42.6Very low36.5Very low101 Ų101150.4 Ų150.466%0.65679%0.786SS**  cis-136.3165.28.734.3-14.2000114.5
8E28.8Very low38.3Very low177 Ų177145.1 Ų145.183%0.82776%0.763SS**  trans-116.2111.2160.4-92.8-66.8157.400110.8W10E8-W10 PolarHBondContact O-N 3.05Å
9S30Very low40.1Very low87 Ų87138.2 Ų138.261%0.60873%0.727SS**  trans-70.8111.7-174.7630000111.7K11S9-K11 PolarHBondContact O-N 3.34Å
10W29.3Very low41.6Very low249 Ų249137.3 Ų137.394%0.94372%0.719SS**  trans-71.8101.9155.7-68.7-20.9000108.6E8 R12E8-W10 PolarHBondContact O-N 3.05Å; W10-R12 PolarHBondContact O-N 2.94Å
11K30.4Very low42.9Very low194 Ų194136.5 Ų136.584%0.84371%0.712SS**  trans-43.9106170.9-73.8179.4177177.30109.6S9 N13S9-K11 PolarHBondContact O-N 3.34Å; K11-N13 PolarHBondContact O-N 2.91Å
12R34.8Very low44.6Very low240 Ų240126.1 Ų126.191%0.90666%0.661SS**  trans-57.3101.5160.9-84.8179.3-84.2-144.2-5.3107W10 S14W10-R12 PolarHBondContact O-N 2.94Å; R12-S14 VanDerWaalsContact C-N 3.29Å; R12-S14 PolarHBondContact O-N 2.92Å
13N32.5Very low46.1Very low161 Ų161120.5 Ų120.586%0.86163%0.63SS**  trans-67.895.8169.6-165.435.7000107.3K11 G15K11-N13 PolarHBondContact O-N 2.91Å; N13-G15 PolarHBondContact O-N 3.02Å
14S43.3Very low47.6Very low112 Ų112117.1 Ų117.178%0.78362%0.623SS**  trans-69.495174.8-1640000108.3R12R12-S14 VanDerWaalsContact C-N 3.29Å; R12-S14 PolarHBondContact O-N 2.92Å
15G36.7Very low48.6Very low61 Ų61113.7 Ų113.763%0.62961%0.614SS**  trans-130.26016600000108.1N13 S17N13-G15 PolarHBondContact O-N 3.02Å; G15-S17 PolarHBondContact O-N 3.18Å
16S40.5Very low50.1Low106 Ų106109.1 Ų109.174%0.74158%0.584SS**  trans-65.483.4170.856.10000108.4S18S16-S18 PolarHBondContact O-N 2.95Å
17S51.3Low51.4Low42 Ų42106.8 Ų106.829%0.29458%0.584SS.*  trans-61106.3162.959.10000105.8G15 I19 R41G15-S17 PolarHBondContact O-N 3.18Å; S17-I19 PolarHBondContact O-N 3.2Å; S17-R41 PolarHBondContact OG-NH1 3.44Å
18S69.3Low52.8Low54 Ų54105.7 Ų105.738%0.37859%0.591SS.*  trans-50.6138.1179.41770000108.5S16 E20 Q21 M22S16-S18 PolarHBondContact O-N 2.95Å; S18-E20 PolarHBondContact O-N 2.79Å; S18-E20 VanDerWaalsContact O-N 3.08Å; S18-E20 PolarHBondContact OG-N 3.35Å; S18-Q21 WeakPolarHBondContact O-CA 3.23Å; S18-Q21 VanDerWaalsContact O-CB 3.23Å; S18-Q21 WeakPolarHBondContact O-CB 3.39Å; S18-Q21 PolarHBondContact O-N 3.4Å; S18-M22 PolarHBondContact O-N 3.39Å
19I71.5Confident55.4Low15 Ų15100.9 Ų100.98%0.07757%0.567CS.*Hα-helixtrans-53.9-31.2177.6-169.4169.5000111S17 Q21 M22 L23 Y38 L92 L95 K96S17-I19 PolarHBondContact O-N 3.2Å; I19-Q21 VanDerWaalsContact C-N 3.33Å; I19-Q21 PolarHBondContact O-N 3.47Å; I19-M22 PolarHBondContact O-N 3.48Å; I19-L23 HydrophobicContact CG1-CD1 4.12Å; I19-L23 WeakPolarHBondContact O-CD1 3.45Å; I19-L23 WeakPolarHBondContact O-CG 3.06Å; I19-L23 PolarHBondContact O-N 3.08Å; I19-L23 VanDerWaalsContact O-N 3.09Å; I19-Y38 HydrophobicContact CB-CD2 4.2Å; I19-Y38 HydrophobicContact CB-CE2 3.88Å; I19-Y38 HydrophobicContact CD1-CD1 4.25Å; I19-Y38 HydrophobicContact CD1-CD2 3.98Å; I19-Y38 HydrophobicContact CD1-CE1 4.19Å; I19-Y38 HydrophobicContact CD1-CE2 3.93Å; I19-Y38 HydrophobicContact CD1-CG 4.14Å; I19-Y38 HydrophobicContact CG1-CD2 3.91Å; I19-Y38 HydrophobicContact CG1-CE2 4Å; I19-Y38 HydrophobicContact CG1-CG 4.43Å; I19-L92 HydrophobicContact CD1-CD2 4Å; I19-L95 HydrophobicContact CD1-CB 3.37Å; I19-L95 HydrophobicContact CD1-CD1 4.2Å; I19-L95 HydrophobicContact CD1-CG 4.4Å; I19-K96 HydrophobicContact CG2-CB 4.42Å; I19-K96 HydrophobicContact CG2-CG 4.03Å
20E70.6Confident58.2Low120 Ų12099.7 Ų99.756%0.56156%0.557SS**Hα-helixtrans-60.6-40.8172.5-62.3-172.1147.200112.6S18 L23 A24S18-E20 PolarHBondContact O-N 2.79Å; S18-E20 VanDerWaalsContact O-N 3.08Å; S18-E20 PolarHBondContact OG-N 3.35Å; E20-L23 PolarHBondContact O-N 2.86Å; E20-A24 WeakPolarHBondContact O-CB 3.44Å; E20-A24 PolarHBondContact O-N 2.75Å
21Q70Confident61.1Low121 Ų12188.9 Ų88.957%0.56552%0.519SS*.Hα-helixtrans-67.8-39.5179.2-142.5164.311.200111S18 I19 L23 A24 V25S18-Q21 WeakPolarHBondContact O-CA 3.23Å; S18-Q21 VanDerWaalsContact O-CB 3.23Å; S18-Q21 WeakPolarHBondContact O-CB 3.39Å; S18-Q21 PolarHBondContact O-N 3.4Å; I19-Q21 VanDerWaalsContact C-N 3.33Å; I19-Q21 PolarHBondContact O-N 3.47Å; Q21-L23 VanDerWaalsContact C-N 3.33Å; Q21-L23 PolarHBondContact O-N 3.06Å; Q21-A24 PolarHBondContact O-N 2.8Å; Q21-V25 WeakPolarHBondContact O-CB 3.49Å; Q21-V25 WeakPolarHBondContact O-CG2 3.41Å; Q21-V25 PolarHBondContact O-N 3.46Å
22M68.8Low64.1Low13 Ų1381.7 Ų81.76%0.06449%0.489CS..Hα-helixtrans-65.5-36.8174.7-74.5-173.66000113S18 I19 E37 Y38S18-M22 PolarHBondContact O-N 3.39Å; I19-M22 PolarHBondContact O-N 3.48Å; M22-E37 HydrophobicContact CE-CB 3.96Å; M22-E37 HydrophobicContact CE-CG 3.69Å; M22-Y38 HydrophobicContact SD-CD2 4.29Å
23L69.1Low66.8Low31 Ų3172.7 Ų72.716%0.16246%0.462CS..Hα-helixtrans-74.5-32.9178.6-65172.7000112I19 E20 Q21 L34 L92 K96I19-L23 HydrophobicContact CG1-CD1 4.12Å; I19-L23 WeakPolarHBondContact O-CD1 3.45Å; I19-L23 WeakPolarHBondContact O-CG 3.06Å; I19-L23 PolarHBondContact O-N 3.08Å; I19-L23 VanDerWaalsContact O-N 3.09Å; E20-L23 PolarHBondContact O-N 2.86Å; Q21-L23 VanDerWaalsContact C-N 3.33Å; Q21-L23 PolarHBondContact O-N 3.06Å; L23-L34 HydrophobicContact CD2-CB 3.99Å; L23-L34 HydrophobicContact CD2-CD1 3.63Å; L23-L34 HydrophobicContact CD2-CD2 4.16Å; L23-L34 HydrophobicContact CD2-CG 4.12Å; L23-L92 HydrophobicContact CD2-CD1 4.2Å; L23-L92 HydrophobicContact CD2-CD2 4.5Å; L23-K96 HydrophobicContact CD1-CD 3.86Å; L23-K96 HydrophobicContact CD1-CG 3.93Å; L23-K96 VanDerWaalsContact CD1-NZ 3.26Å
24A64.7Low69.5Low80 Ų8065.7 Ų65.766%0.66143%0.425SS*.Hα-helixtrans-71.6-32.6174.300000113E20 Q21 N26E20-A24 WeakPolarHBondContact O-CB 3.44Å; E20-A24 PolarHBondContact O-N 2.75Å; Q21-A24 PolarHBondContact O-N 2.8Å; A24-N26 PolarHBondContact O-N 3.48Å
25V64Low71.8Confident104 Ų10460.4 Ų60.463%0.6339%0.388SS*.Hα-helixtrans-78.5-16.3-175.8175.30000113Q21Q21-V25 WeakPolarHBondContact O-CB 3.49Å; Q21-V25 WeakPolarHBondContact O-CG2 3.41Å; Q21-V25 PolarHBondContact O-N 3.46Å
26N67.4Low74.4Confident49 Ų4961.1 Ų61.126%0.26238%0.375SS..  trans-14167.8-175.4-64.1-82.6000114.4A24 G28 K29 L34A24-N26 PolarHBondContact O-N 3.48Å; N26-G28 PolarHBondContact O-N 3.17Å; N26-K29 HydrophobicContact CB-CB 4.45Å; N26-K29 HydrophobicContact CB-CD 3.81Å; N26-K29 HydrophobicContact CB-CG 4.08Å; N26-K29 PolarHBondContact O-N 3.05Å; N26-L34 HydrophobicContact CB-CD2 4.33Å
27P64.3Low76.8Confident126 Ų12658.5 Ų58.582%0.81835%0.351SS*.THydrogen-bonded Turntrans-64.7-11.7-178.525.8-34.2000114.6
28G72.3Confident78.6Confident77 Ų7758.5 Ų58.579%0.79435%0.345SS*.THydrogen-bonded Turntrans-92.7-6.3179.400000115.9N26N26-G28 PolarHBondContact O-N 3.17Å
29K82.7Confident79.5Confident76 Ų7655.9 Ų55.933%0.3333%0.327SS..SBendtrans-86.6145.9-178.6-73.4-179-179.9169.80110.8N26 L34 E37N26-K29 HydrophobicContact CB-CB 4.45Å; N26-K29 HydrophobicContact CB-CD 3.81Å; N26-K29 HydrophobicContact CB-CG 4.08Å; N26-K29 PolarHBondContact O-N 3.05Å; K29-L34 HydrophobicContact CB-CD1 4.2Å; K29-L34 HydrophobicContact CB-CD2 3.96Å; K29-L34 HydrophobicContact CB-CG 3.82Å; K29-L34 HydrophobicContact CD-CD2 4.12Å; K29-E37 IonicContact NZ-OE2 2.63Å; K29-E37 PolarHBondContact NZ-OE2 3.13Å
30T89.3Confident80.4Confident63 Ų6359.3 Ų59.339%0.38735%0.348SS..  trans-68.4148.9174.866.60000110.9I32 S33 L34T30-I32 PolarHBondContact O-N 3.04Å; T30-I32 VanDerWaalsContact O-N 3.12Å; T30-S33 WeakPolarHBondContact O-CA 3.48Å; T30-S33 WeakPolarHBondContact O-CB 3.16Å; T30-S33 PolarHBondContact O-N 3.34Å; T30-S33 PolarHBondContact OG1-N 3.44Å; T30-L34 PolarHBondContact O-N 3.11Å
31P90.6Very high81.1Confident22 Ų2260.3 Ų60.314%0.14335%0.347CS..Hα-helixtrans-50.1-35.3172.6-30.338.2000113.4L34 L35 H85 A88 E89 L92P31-L34 PolarHBondContact O-N 3.45Å; P31-L35 VanDerWaalsContact O-CB 3.25Å; P31-L35 WeakPolarHBondContact O-CB 3.5Å; P31-L35 PolarHBondContact O-N 2.82Å; P31-H85 WeakPolarHBondContact CD-CE1 3.47Å; P31-H85 WeakPolarHBondContact CD-NE2 3.31Å; P31-H85 WeakPolarHBondContact CG-NE2 3.33Å; P31-A88 HydrophobicContact CB-CB 4.12Å; P31-E89 HydrophobicContact CB-CB 4.22Å; P31-E89 HydrophobicContact CG-CB 4.38Å; P31-L92 HydrophobicContact CB-CD1 3.94Å; P31-L92 WeakPolarHBondContact O-CD1 3.26Å
32I92.3Very high81.9Confident42 Ų4258 Ų5822%0.21534%0.338CS..Hα-helixtrans-61.4-48.7174.9-56.7171.3000110.6T30 L35 Q36 Y48 K84 H85 A88T30-I32 PolarHBondContact O-N 3.04Å; T30-I32 VanDerWaalsContact O-N 3.12Å; I32-L35 PolarHBondContact O-N 3.07Å; I32-Q36 WeakPolarHBondContact O-CB 3.47Å; I32-Q36 PolarHBondContact O-N 3.32Å; I32-Y48 HydrophobicContact CG2-CE2 4.42Å; I32-K84 HydrophobicContact CD1-CB 3.95Å; I32-H85 HydrophobicContact CD1-CB 4.16Å; I32-H85 HydrophobicContact CG1-CB 4.44Å; I32-A88 HydrophobicContact CG1-CB 3.97Å
33S91.1Very high82.7Confident51 Ų5160.6 Ų60.636%0.35737%0.368SS..Hα-helixtrans-66.1-37.7179.1-177.10000112.4T30 E37T30-S33 WeakPolarHBondContact O-CA 3.48Å; T30-S33 WeakPolarHBondContact O-CB 3.16Å; T30-S33 PolarHBondContact O-N 3.34Å; T30-S33 PolarHBondContact OG1-N 3.44Å; S33-E37 WeakPolarHBondContact O-CB 3.48Å; S33-E37 PolarHBondContact O-N 3.49Å
34L90.5Very high83.7Confident15 Ų1563.7 Ų63.78%0.07938%0.38CS..Hα-helixtrans-68.6-43.6179.2-71.1162.2000111.1L23 N26 K29 T30 P31 Q36 E37 Y38 L92L23-L34 HydrophobicContact CD2-CB 3.99Å; L23-L34 HydrophobicContact CD2-CD1 3.63Å; L23-L34 HydrophobicContact CD2-CD2 4.16Å; L23-L34 HydrophobicContact CD2-CG 4.12Å; N26-L34 HydrophobicContact CB-CD2 4.33Å; K29-L34 HydrophobicContact CB-CD1 4.2Å; K29-L34 HydrophobicContact CB-CD2 3.96Å; K29-L34 HydrophobicContact CB-CG 3.82Å; K29-L34 HydrophobicContact CD-CD2 4.12Å; T30-L34 PolarHBondContact O-N 3.11Å; P31-L34 PolarHBondContact O-N 3.45Å; L34-Q36 VanDerWaalsContact C-N 3.34Å; L34-E37 PolarHBondContact O-N 2.88Å; L34-Y38 WeakPolarHBondContact O-CB 3.44Å; L34-Y38 PolarHBondContact O-N 2.96Å; L34-L92 HydrophobicContact CB-CD1 4.02Å
35L90.9Very high84.9Confident0 Ų063.7 Ų63.70%037%0.372CS..Hα-helixtrans-66.1-37.5176.1-169.766000111.9P31 I32 G39 P46 V66 V68 A88 A91 L92 L95P31-L35 VanDerWaalsContact O-CB 3.25Å; P31-L35 WeakPolarHBondContact O-CB 3.5Å; P31-L35 PolarHBondContact O-N 2.82Å; I32-L35 PolarHBondContact O-N 3.07Å; L35-G39 PolarHBondContact O-N 3.01Å; L35-P46 HydrophobicContact CD2-CB 4.07Å; L35-P46 HydrophobicContact CG-CB 4.13Å; L35-P46 HydrophobicContact CG-CG 4.31Å; L35-V66 HydrophobicContact CD2-CG1 4.4Å; L35-V66 HydrophobicContact CD2-CG2 3.73Å; L35-V68 HydrophobicContact CD1-CG2 4Å; L35-V68 HydrophobicContact CD2-CG2 3.93Å; L35-V68 HydrophobicContact CG-CG2 4.07Å; L35-A88 HydrophobicContact CD2-CB 3.94Å; L35-A91 HydrophobicContact CD1-CB 4.21Å; L35-A91 HydrophobicContact CD2-CB 3.83Å; L35-L92 HydrophobicContact CB-CD1 4.46Å; L35-L92 HydrophobicContact CB-CD2 4.06Å; L35-L92 HydrophobicContact CB-CG 4.12Å; L35-L92 HydrophobicContact CD1-CD2 3.65Å; L35-L92 HydrophobicContact CD1-CG 3.96Å; L35-L92 HydrophobicContact CG-CD2 4.48Å; L35-L95 HydrophobicContact CD1-CD1 3.54Å
36Q92.3Very high86.3Confident77 Ų7759.2 Ų59.236%0.3635%0.345SS..Hα-helixtrans-61.6-50.2173.6-175.566.541.600111.4I32 L34 Y38 G39 T40 P46I32-Q36 WeakPolarHBondContact O-CB 3.47Å; I32-Q36 PolarHBondContact O-N 3.32Å; L34-Q36 VanDerWaalsContact C-N 3.34Å; Q36-Y38 PolarHBondContact O-N 3.1Å; Q36-G39 PolarHBondContact O-N 2.95Å; Q36-T40 PolarHBondContact O-N 3.48Å; Q36-T40 PolarHBondContact O-OG1 3.33Å; Q36-T40 VanDerWaalsContact O-OG1 3.11Å; Q36-P46 HydrophobicContact CB-CG 4.4Å
37E90.2Very high87.6Confident50 Ų5060.6 Ų60.623%0.23436%0.355CS..Hα-helixtrans-61.7-44.3179.8-166.7-176.5147.900111.3M22 K29 S33 L34 T40 R41M22-E37 HydrophobicContact CE-CB 3.96Å; M22-E37 HydrophobicContact CE-CG 3.69Å; K29-E37 IonicContact NZ-OE2 2.63Å; K29-E37 PolarHBondContact NZ-OE2 3.13Å; S33-E37 WeakPolarHBondContact O-CB 3.48Å; S33-E37 PolarHBondContact O-N 3.49Å; L34-E37 PolarHBondContact O-N 2.88Å; E37-T40 PolarHBondContact O-N 3.32Å; E37-R41 WeakPolarHBondContact O-CG 3.37Å; E37-R41 PolarHBondContact O-N 3.09Å; E37-R41 VanDerWaalsContact O-N 3.17Å; E37-R41 IonicContact OE1-CZ 3.67Å; E37-R41 IonicContact OE1-NE 2.75Å; E37-R41 IonicContact OE1-NH2 2.86Å; E37-R41 PolarHBondContact OE1-NH2 3.25Å
38Y88.2Confident89.2Confident42 Ų4256.6 Ų56.617%0.16532%0.324CS..Hα-helixtrans-60.8-50.4175.4178.1-99.1000111.5I19 M22 L34 Q36 T40 R41 I42 L95I19-Y38 HydrophobicContact CB-CD2 4.2Å; I19-Y38 HydrophobicContact CB-CE2 3.88Å; I19-Y38 HydrophobicContact CD1-CD1 4.25Å; I19-Y38 HydrophobicContact CD1-CD2 3.98Å; I19-Y38 HydrophobicContact CD1-CE1 4.19Å; I19-Y38 HydrophobicContact CD1-CE2 3.93Å; I19-Y38 HydrophobicContact CD1-CG 4.14Å; I19-Y38 HydrophobicContact CG1-CD2 3.91Å; I19-Y38 HydrophobicContact CG1-CE2 4Å; I19-Y38 HydrophobicContact CG1-CG 4.43Å; M22-Y38 HydrophobicContact SD-CD2 4.29Å; L34-Y38 WeakPolarHBondContact O-CB 3.44Å; L34-Y38 PolarHBondContact O-N 2.96Å; Q36-Y38 PolarHBondContact O-N 3.1Å; Y38-T40 VanDerWaalsContact C-N 3.31Å; Y38-T40 PolarHBondContact O-N 3.39Å; Y38-R41 WeakPolarHBondContact O-CB 3.13Å; Y38-R41 PolarHBondContact O-N 3.28Å; Y38-I42 HydrophobicContact CD1-CD1 4.01Å; Y38-I42 HydrophobicContact CD1-CG1 4.34Å; Y38-I42 HydrophobicContact CE1-CD1 3.45Å; Y38-I42 VanDerWaalsContact CE1-CD1 3.45Å; Y38-I42 HydrophobicContact CE1-CG1 4.12Å; Y38-I42 HydrophobicContact CE1-CG2 4.19Å; Y38-I42 HydrophobicContact CE2-CG2 4.03Å; Y38-I42 WeakPolarHBondContact O-CG1 3.35Å; Y38-I42 PolarHBondContact O-N 3.29Å; Y38-L95 HydrophobicContact CD1-CD1 3.91Å; Y38-L95 HydrophobicContact CE1-CD1 3.71Å; Y38-L95 HydrophobicContact CE1-CD2 3.86Å; Y38-L95 HydrophobicContact CE1-CG 4.28Å
39G89.3Confident90.3Very high0 Ų055.7 Ų55.70%030%0.301CS..Hα-helixtrans-57.8-40.7179.500000113.1L35 Q36 I42 G43 K44L35-G39 PolarHBondContact O-N 3.01Å; Q36-G39 PolarHBondContact O-N 2.95Å; G39-I42 WeakPolarHBondContact O-CG1 3.45Å; G39-I42 PolarHBondContact O-N 3.27Å; G39-G43 CarbonylContact O-C 3.58Å; G39-G43 PolarHBondContact O-N 2.85Å; G39-K44 CarbonylContact C-O 3.48Å; G39-K44 WeakPolarHBondContact CA-O 3.34Å; G39-K44 CarbonylContact O-C 3.31Å; G39-K44 VanDerWaalsContact O-C 3.31Å; G39-K44 PolarHBondContact O-N 3.34Å
40T89.3Confident91Very high86 Ų8655.8 Ų55.853%0.52831%0.305SS..Hα-helixtrans-65.5-36.9175.1-60.20000112.2Q36 E37 Y38 G43Q36-T40 PolarHBondContact O-N 3.48Å; Q36-T40 PolarHBondContact O-OG1 3.33Å; Q36-T40 VanDerWaalsContact O-OG1 3.11Å; E37-T40 PolarHBondContact O-N 3.32Å; Y38-T40 VanDerWaalsContact C-N 3.31Å; Y38-T40 PolarHBondContact O-N 3.39Å; T40-G43 PolarHBondContact O-N 2.95Å
41R86.9Confident91.3Very high142 Ų14256.6 Ų56.654%0.53631%0.307SS..Hα-helixtrans-68.5-37.3176.5-70.8-175.3-171-1603.5113.1S17 E37 Y38 G43S17-R41 PolarHBondContact OG-NH1 3.44Å; E37-R41 WeakPolarHBondContact O-CG 3.37Å; E37-R41 PolarHBondContact O-N 3.09Å; E37-R41 VanDerWaalsContact O-N 3.17Å; E37-R41 IonicContact OE1-CZ 3.67Å; E37-R41 IonicContact OE1-NE 2.75Å; E37-R41 IonicContact OE1-NH2 2.86Å; E37-R41 PolarHBondContact OE1-NH2 3.25Å; Y38-R41 WeakPolarHBondContact O-CB 3.13Å; Y38-R41 PolarHBondContact O-N 3.28Å; R41-G43 VanDerWaalsContact C-N 3.33Å
42I85.7Confident91.5Very high71 Ų7161 Ų6136%0.36432%0.323SS..THydrogen-bonded Turntrans-88.52.1179.465.6160.9000113.5Y38 G39 K44 V68Y38-I42 HydrophobicContact CD1-CD1 4.01Å; Y38-I42 HydrophobicContact CD1-CG1 4.34Å; Y38-I42 HydrophobicContact CE1-CD1 3.45Å; Y38-I42 VanDerWaalsContact CE1-CD1 3.45Å; Y38-I42 HydrophobicContact CE1-CG1 4.12Å; Y38-I42 HydrophobicContact CE1-CG2 4.19Å; Y38-I42 HydrophobicContact CE2-CG2 4.03Å; Y38-I42 WeakPolarHBondContact O-CG1 3.35Å; Y38-I42 PolarHBondContact O-N 3.29Å; G39-I42 WeakPolarHBondContact O-CG1 3.45Å; G39-I42 PolarHBondContact O-N 3.27Å; I42-K44 HydrophobicContact CD1-CB 3.83Å; I42-K44 HydrophobicContact CD1-CD 4.39Å; I42-K44 HydrophobicContact CD1-CG 4.16Å; I42-K44 HydrophobicContact CG1-CB 4Å; I42-K44 HydrophobicContact CG1-CG 4.33Å; I42-K44 PolarHBondContact O-N 3.04Å; I42-V68 HydrophobicContact CD1-CG1 4.33Å
43G86.5Confident91.6Very high69 Ų6962.1 Ų62.171%0.71134%0.339SS*.THydrogen-bonded Turntrans69.115.3-17700000114.7G39 T40 R41G39-G43 CarbonylContact O-C 3.58Å; G39-G43 PolarHBondContact O-N 2.85Å; T40-G43 PolarHBondContact O-N 2.95Å; R41-G43 VanDerWaalsContact C-N 3.33Å
44K88.4Confident91.6Very high96 Ų9664 Ų6442%0.41734%0.342SS..  trans-123.177.7180-54.2-163.1-177.6-173.50109.5G39 I42 V68G39-K44 CarbonylContact C-O 3.48Å; G39-K44 WeakPolarHBondContact CA-O 3.34Å; G39-K44 CarbonylContact O-C 3.31Å; G39-K44 VanDerWaalsContact O-C 3.31Å; G39-K44 PolarHBondContact O-N 3.34Å; I42-K44 HydrophobicContact CD1-CB 3.83Å; I42-K44 HydrophobicContact CD1-CD 4.39Å; I42-K44 HydrophobicContact CD1-CG 4.16Å; I42-K44 HydrophobicContact CG1-CB 4Å; I42-K44 HydrophobicContact CG1-CG 4.33Å; I42-K44 PolarHBondContact O-N 3.04Å; K44-V68 HydrophobicContact CB-CG1 4.44Å; K44-V68 WeakPolarHBondContact O-CG1 3.24Å
45T90.5Very high91.6Very high79 Ų7966.2 Ų66.249%0.48537%0.368SS..  trans-64.7134.8-177.651.20000111.6V47T45-V47 PolarHBondContact O-N 3.38Å
46P94Very high91.5Very high11 Ų1172 Ų727%0.07140%0.395CS..  trans-66.8129.8-178.526.8-34.2000112.1L35 Q36 Y48 V66 S67 V68L35-P46 HydrophobicContact CD2-CB 4.07Å; L35-P46 HydrophobicContact CG-CB 4.13Å; L35-P46 HydrophobicContact CG-CG 4.31Å; Q36-P46 HydrophobicContact CB-CG 4.4Å; P46-Y48 HydrophobicContact CB-CE2 4.04Å; P46-Y48 HydrophobicContact CG-CE2 4.31Å; P46-V66 HydrophobicContact CB-CG2 3.83Å; P46-S67 WeakPolarHBondContact CA-O 3.38Å; P46-V68 HydrophobicContact CB-CG2 3.74Å
47V95.3Very high91.1Very high77 Ų7773.6 Ų73.647%0.46742%0.422SS..EExtended strand (participates in β ladder)trans-104.4133.3174.3-178.10000109.2T45 V66 S67T45-V47 PolarHBondContact O-N 3.38Å; V47-V66 CarbonylContact O-C 3.56Å; V47-V66 VanDerWaalsContact O-CA 3.25Å; V47-V66 WeakPolarHBondContact O-CA 3.49Å; V47-S67 PolarHBondContact N-O 3.42Å; V47-S67 PolarHBondContact O-N 3.5Å
48Y96Very high90.7Very high43 Ų4377.8 Ų77.817%0.16944%0.441CS..EExtended strand (participates in β ladder)trans-114.5115.3-178.8-69.8-90.6000111.8I32 P46 R65 V66 K84 A88I32-Y48 HydrophobicContact CG2-CE2 4.42Å; P46-Y48 HydrophobicContact CB-CE2 4.04Å; P46-Y48 HydrophobicContact CG-CE2 4.31Å; Y48-R65 CarbonylContact C-O 3.57Å; Y48-R65 VanDerWaalsContact CA-O 3.3Å; Y48-R65 WeakPolarHBondContact CA-O 3.48Å; Y48-V66 HydrophobicContact CD1-CB 3.84Å; Y48-V66 HydrophobicContact CD1-CG2 3.9Å; Y48-V66 HydrophobicContact CD2-CG2 4.4Å; Y48-V66 HydrophobicContact CE1-CB 3.66Å; Y48-V66 HydrophobicContact CE1-CG2 3.52Å; Y48-V66 HydrophobicContact CE2-CG2 4.06Å; Y48-V66 HydrophobicContact CG-CG2 4.33Å; Y48-K84 HydrophobicContact CD1-CB 4.14Å; Y48-K84 HydrophobicContact CD1-CD 4.24Å; Y48-K84 HydrophobicContact CD1-CG 3.85Å; Y48-K84 HydrophobicContact CE1-CB 4.15Å; Y48-K84 HydrophobicContact CE1-CG 4.37Å; Y48-K84 HydrophobicContact CG-CD 4.33Å; Y48-K84 HydrophobicContact CG-CG 4.4Å; Y48-A88 HydrophobicContact CE1-CB 4.33Å; Y48-A88 VanDerWaalsContact OH-CB 3.31Å; Y48-A88 WeakPolarHBondContact OH-CB 3.3Å
49D96.6Very high90.6Very high57 Ų5781.2 Ų81.231%0.30546%0.458SS..EExtended strand (participates in β ladder)trans-106.2132.3177.7-58-33.9000110.7L51 F64 R65D49-L51 HydrophobicContact CB-CD2 4.5Å; D49-L51 PolarHBondContact O-N 2.96Å; D49-F64 CarbonylContact O-C 2.99Å; D49-F64 VanDerWaalsContact O-CA 3.32Å; D49-F64 WeakPolarHBondContact O-CA 3.38Å; D49-F64 VanDerWaalsContact O-CD1 3.24Å; D49-F64 WeakPolarHBondContact O-CD1 3.43Å; D49-R65 PolarHBondContact N-O 3.31Å; D49-R65 PolarHBondContact O-N 3Å; D49-R65 IonicContact OD2-CZ 3.69Å; D49-R65 IonicContact OD2-NE 2.82Å; D49-R65 IonicContact OD2-NH2 3.1Å; D49-R65 PolarHBondContact OD2-NH2 3.32Å
50L96.8Very high90.7Very high79 Ų7983.4 Ų83.441%0.41447%0.472SS..EExtended strand (participates in β ladder)trans-79.4110.9169.2177.165.4000108.4K52 A53 F62 F64L50-K52 WeakPolarHBondContact CD1-O 3.48Å; L50-A53 HydrophobicContact CD2-CB 4.42Å; L50-F62 HydrophobicContact CD1-CB 4.5Å; L50-F62 HydrophobicContact CD1-CD1 4.23Å; L50-F64 HydrophobicContact CB-CD1 4.49Å; L50-F64 HydrophobicContact CB-CE1 3.84Å; L50-F64 HydrophobicContact CB-CE2 4.26Å; L50-F64 HydrophobicContact CB-CZ 3.73Å; L50-F64 HydrophobicContact CD1-CD2 3.9Å; L50-F64 HydrophobicContact CD1-CE2 3.43Å; L50-F64 VanDerWaalsContact CD1-CE2 3.43Å; L50-F64 HydrophobicContact CD1-CZ 3.8Å; L50-F64 HydrophobicContact CG-CE2 4.38Å; L50-F64 HydrophobicContact CG-CZ 4.27Å
51L96Very high90.9Very high80 Ų8081.6 Ų81.642%0.41946%0.459SS..EExtended strand (participates in β ladder)trans-87-44.6179.2-64.3-174.5000112.2D49 T63 R65 T74D49-L51 HydrophobicContact CB-CD2 4.5Å; D49-L51 PolarHBondContact O-N 2.96Å; L51-T63 HydrophobicContact CB-CG2 4.28Å; L51-T63 HydrophobicContact CD1-CG2 4.39Å; L51-T63 PolarHBondContact N-O 3.16Å; L51-R65 HydrophobicContact CD1-CB 3.78Å; L51-R65 HydrophobicContact CD2-CB 4.27Å; L51-R65 HydrophobicContact CG-CB 3.91Å; L51-T74 HydrophobicContact CD1-CG2 3.98Å
52K94.1Very high91.4Very high113 Ų11376.6 Ų76.649%0.49144%0.442SS..EExtended strand (participates in β ladder)trans-140.6141.4-177.6-61.5-173.8176.8-173.50111.2L50 F62 T63L50-K52 WeakPolarHBondContact CD1-O 3.48Å; K52-F62 WeakPolarHBondContact O-CA 3.49Å; K52-T63 PolarHBondContact N-O 2.82Å; K52-T63 PolarHBondContact O-N 2.92Å
53A95.2Very high91.9Very high66 Ų6673.7 Ų73.755%0.54543%0.427SS..EExtended strand (participates in β ladder)trans-133.898.9167.500000106.9L50 F62L50-A53 HydrophobicContact CD2-CB 4.42Å; A53-F62 HydrophobicContact CB-CD1 3.8Å; A53-F62 HydrophobicContact CB-CE1 3.86Å
54E91.8Very high92.4Very high92 Ų9270.8 Ų70.843%0.4340%0.395SS..EExtended strand (participates in β ladder)trans-135.1-178.8-173.266.2-166.3163.600110.2N61E54-N61 HydrophobicContact CG-CB 4.37Å; E54-N61 PolarHBondContact N-O 3.3Å; E54-N61 PolarHBondContact O-N 2.96Å; E54-N61 VanDerWaalsContact O-O 3.09Å
55G90.6Very high92.8Very high60 Ų6070.5 Ų70.562%0.61939%0.391SS*.EExtended strand (participates in β ladder)trans95.7169.9-177.500000113.7
56Q88.7Confident93.2Very high123 Ų12366.7 Ų66.758%0.57537%0.368SS*.EExtended strand (participates in β ladder)trans-76.6156.1-177.4-65.8-179.6-24.900110.3H58 Q59 P60Q56-H58 PolarHBondContact O-N 2.95Å; Q56-H58 VanDerWaalsContact O-N 3.08Å; Q56-H58 PolarHBondContact OE1-CE1 3.3Å; Q56-H58 PolarHBondContact OE1-NE2 3.07Å; Q56-Q59 PolarHBondContact N-O 3.25Å; Q56-Q59 CarbonylContact O-C 3.55Å; Q56-Q59 WeakPolarHBondContact O-CA 3.25Å; Q56-Q59 PolarHBondContact O-N 3.42Å; Q56-P60 VanDerWaalsContact O-N 3.09Å
57A82.9Confident93.2Very high110 Ų11067.7 Ų67.791%0.90938%0.375SS*.THydrogen-bonded Turntrans-56.3-30.6-178.600000113.4
58H81.6Confident93Very high137 Ų13764.3 Ų64.363%0.63436%0.355SS*.THydrogen-bonded Turntrans-88.7-10.7176.364.9-93000113.8Q56Q56-H58 PolarHBondContact O-N 2.95Å; Q56-H58 VanDerWaalsContact O-N 3.08Å; Q56-H58 PolarHBondContact OE1-CE1 3.3Å; Q56-H58 PolarHBondContact OE1-NE2 3.07Å
59Q85.4Confident92.6Very high115 Ų11564.1 Ų64.154%0.53737%0.366SS..EExtended strand (participates in β ladder)trans-144.770.3177-167.917772.100110.4Q56Q56-Q59 PolarHBondContact N-O 3.25Å; Q56-Q59 CarbonylContact O-C 3.55Å; Q56-Q59 WeakPolarHBondContact O-CA 3.25Å; Q56-Q59 PolarHBondContact O-N 3.42Å
60P91.4Very high92.2Very high45 Ų4569.4 Ų69.429%0.29239%0.389SS..EExtended strand (participates in β ladder)trans-74.6150.5-179.731.4-35.5000110.8Q56 F62 P78Q56-P60 VanDerWaalsContact O-N 3.09Å; P60-F62 HydrophobicContact CB-CE2 3.72Å; P60-F62 HydrophobicContact CB-CZ 4.1Å; P60-F62 HydrophobicContact CG-CE2 4.06Å; P60-P78 VanDerWaalsContact O-CA 3.28Å; P60-P78 WeakPolarHBondContact O-CA 3.49Å
61N94.9Very high91.7Very high48 Ų4867.7 Ų67.726%0.25738%0.38SS..EExtended strand (participates in β ladder)trans-128126.4173.9-172.422.1000110.1E54E54-N61 HydrophobicContact CG-CB 4.37Å; E54-N61 PolarHBondContact N-O 3.3Å; E54-N61 PolarHBondContact O-N 2.96Å; E54-N61 VanDerWaalsContact O-O 3.09Å
62F96.7Very high91.6Very high37 Ų3767.4 Ų67.416%0.16238%0.384CS..EExtended strand (participates in β ladder)trans-115.7132.9178.7-60.3-87.1000109.5L50 K52 A53 P60 Q76 G77 K80 A83L50-F62 HydrophobicContact CD1-CB 4.5Å; L50-F62 HydrophobicContact CD1-CD1 4.23Å; K52-F62 WeakPolarHBondContact O-CA 3.49Å; A53-F62 HydrophobicContact CB-CD1 3.8Å; A53-F62 HydrophobicContact CB-CE1 3.86Å; P60-F62 HydrophobicContact CB-CE2 3.72Å; P60-F62 HydrophobicContact CB-CZ 4.1Å; P60-F62 HydrophobicContact CG-CE2 4.06Å; F62-Q76 CarbonylContact O-C 3.43Å; F62-Q76 VanDerWaalsContact O-CA 3.24Å; F62-Q76 WeakPolarHBondContact O-CA 3.46Å; F62-G77 PolarHBondContact N-O 3.46Å; F62-G77 PolarHBondContact O-N 2.9Å; F62-K80 HydrophobicContact CD1-CG 3.77Å; F62-K80 HydrophobicContact CE1-CG 3.95Å; F62-K80 HydrophobicContact CG-CG 4.08Å; F62-K80 HydrophobicContact CZ-CG 4.4Å; F62-A83 HydrophobicContact CB-CB 3.97Å; F62-A83 WeakPolarHBondContact O-CB 3.15Å
63T96.3Very high91.6Very high10 Ų1062.8 Ų62.86%0.06137%0.366CS..EExtended strand (participates in β ladder)trans-110.4119.6171.7-54.40000109.1L51 K52 G75 Q76L51-T63 HydrophobicContact CB-CG2 4.28Å; L51-T63 HydrophobicContact CD1-CG2 4.39Å; L51-T63 PolarHBondContact N-O 3.16Å; K52-T63 PolarHBondContact N-O 2.82Å; K52-T63 PolarHBondContact O-N 2.92Å; T63-G75 WeakPolarHBondContact CA-O 3.46Å; T63-Q76 HydrophobicContact CG2-CG 3.87Å; T63-Q76 WeakPolarHBondContact OG1-CG 3.35Å; T63-Q76 PolarHBondContact OG1-NE2 2.88Å
64F97.9Very high91.7Very high9 Ų963.6 Ų63.64%0.03937%0.365CS..EExtended strand (participates in β ladder)trans-110143.5172.4-92.4-92.3000110.8D49 L50 T74 G75 K80 A83 K84D49-F64 CarbonylContact O-C 2.99Å; D49-F64 VanDerWaalsContact O-CA 3.32Å; D49-F64 WeakPolarHBondContact O-CA 3.38Å; D49-F64 VanDerWaalsContact O-CD1 3.24Å; D49-F64 WeakPolarHBondContact O-CD1 3.43Å; L50-F64 HydrophobicContact CB-CD1 4.49Å; L50-F64 HydrophobicContact CB-CE1 3.84Å; L50-F64 HydrophobicContact CB-CE2 4.26Å; L50-F64 HydrophobicContact CB-CZ 3.73Å; L50-F64 HydrophobicContact CD1-CD2 3.9Å; L50-F64 HydrophobicContact CD1-CE2 3.43Å; L50-F64 VanDerWaalsContact CD1-CE2 3.43Å; L50-F64 HydrophobicContact CD1-CZ 3.8Å; L50-F64 HydrophobicContact CG-CE2 4.38Å; L50-F64 HydrophobicContact CG-CZ 4.27Å; F64-T74 CarbonylContact O-C 3Å; F64-T74 VanDerWaalsContact O-CA 3.25Å; F64-T74 WeakPolarHBondContact O-CA 3.45Å; F64-G75 PolarHBondContact N-O 2.93Å; F64-G75 PolarHBondContact O-N 2.81Å; F64-K80 HydrophobicContact CE2-CB 3.83Å; F64-K80 HydrophobicContact CE2-CG 4.02Å; F64-K80 HydrophobicContact CZ-CB 4.33Å; F64-K80 HydrophobicContact CZ-CG 4.5Å; F64-A83 HydrophobicContact CB-CB 4.31Å; F64-A83 HydrophobicContact CD2-CB 3.76Å; F64-A83 HydrophobicContact CG-CB 4.49Å; F64-K84 HydrophobicContact CB-CG 4.17Å; F64-K84 HydrophobicContact CD1-CD 4.27Å; F64-K84 HydrophobicContact CD1-CG 3.61Å; F64-K84 HydrophobicContact CD2-CG 3.96Å; F64-K84 HydrophobicContact CE1-CD 4.17Å; F64-K84 HydrophobicContact CE1-CG 3.95Å; F64-K84 HydrophobicContact CE2-CG 4.23Å; F64-K84 HydrophobicContact CG-CG 3.61Å; F64-K84 HydrophobicContact CZ-CD 4.43Å; F64-K84 VanDerWaalsContact CZ-CE 3.44Å; F64-K84 HydrophobicContact CZ-CG 4.23Å
65R97Very high91.9Very high89 Ų8959.4 Ų59.434%0.33635%0.346SS..EExtended strand (participates in β ladder)trans-104.2137.9164.1-175.4175.362.1-166-0.7109Y48 D49 L51 C73 T74Y48-R65 CarbonylContact C-O 3.57Å; Y48-R65 VanDerWaalsContact CA-O 3.3Å; Y48-R65 WeakPolarHBondContact CA-O 3.48Å; D49-R65 PolarHBondContact N-O 3.31Å; D49-R65 PolarHBondContact O-N 3Å; D49-R65 IonicContact OD2-CZ 3.69Å; D49-R65 IonicContact OD2-NE 2.82Å; D49-R65 IonicContact OD2-NH2 3.1Å; D49-R65 PolarHBondContact OD2-NH2 3.32Å; L51-R65 HydrophobicContact CD1-CB 3.78Å; L51-R65 HydrophobicContact CD2-CB 4.27Å; L51-R65 HydrophobicContact CG-CB 3.91Å; R65-C73 CarbonylContact C-O 3.08Å; R65-C73 VanDerWaalsContact CA-O 3.31Å; R65-C73 WeakPolarHBondContact CA-O 3.45Å; R65-T74 HydrophobicContact CB-CG2 4.13Å; R65-T74 HydrophobicContact CG-CG2 4.18Å
66V96.9Very high92.2Very high0 Ų061.2 Ų61.20%034%0.338CS..EExtended strand (participates in β ladder)trans-112.1135.8166.7680000109.1L35 P46 V47 Y48 V68 S72 C73 A87 A91L35-V66 HydrophobicContact CD2-CG1 4.4Å; L35-V66 HydrophobicContact CD2-CG2 3.73Å; P46-V66 HydrophobicContact CB-CG2 3.83Å; V47-V66 CarbonylContact O-C 3.56Å; V47-V66 VanDerWaalsContact O-CA 3.25Å; V47-V66 WeakPolarHBondContact O-CA 3.49Å; Y48-V66 HydrophobicContact CD1-CB 3.84Å; Y48-V66 HydrophobicContact CD1-CG2 3.9Å; Y48-V66 HydrophobicContact CD2-CG2 4.4Å; Y48-V66 HydrophobicContact CE1-CB 3.66Å; Y48-V66 HydrophobicContact CE1-CG2 3.52Å; Y48-V66 HydrophobicContact CE2-CG2 4.06Å; Y48-V66 HydrophobicContact CG-CG2 4.33Å; V66-V68 HydrophobicContact CG2-CG2 4.18Å; V66-S72 CarbonylContact O-C 3.57Å; V66-S72 VanDerWaalsContact O-CA 3.24Å; V66-S72 WeakPolarHBondContact O-CA 3.25Å; V66-C73 HydrophobicContact CG1-CB 4.17Å; V66-C73 PolarHBondContact N-O 3.36Å; V66-C73 PolarHBondContact O-N 2.89Å; V66-A87 HydrophobicContact CB-CB 4.22Å; V66-A87 HydrophobicContact CG1-CB 3.97Å; V66-A87 WeakPolarHBondContact CG1-O 3.24Å; V66-A91 HydrophobicContact CG1-CB 3.63Å
67S94.7Very high92.5Very high32 Ų3255.8 Ų55.822%0.22432%0.315CS..EExtended strand (participates in β ladder)trans-122.1125.4177.5-58.40000109.7P46 V47 I71P46-S67 WeakPolarHBondContact CA-O 3.38Å; V47-S67 PolarHBondContact N-O 3.42Å; V47-S67 PolarHBondContact O-N 3.5Å; S67-I71 CarbonylContact C-O 3.46Å; S67-I71 WeakPolarHBondContact CA-O 3.45Å
68V92.1Very high92.9Very high5 Ų555 Ų553%0.0330%0.301CS..EExtended strand (participates in β ladder)trans-131.990.3-179.3-170.70000108.7L35 I42 K44 P46 V66 E70 I71 L95L35-V68 HydrophobicContact CD1-CG2 4Å; L35-V68 HydrophobicContact CD2-CG2 3.93Å; L35-V68 HydrophobicContact CG-CG2 4.07Å; I42-V68 HydrophobicContact CD1-CG1 4.33Å; K44-V68 HydrophobicContact CB-CG1 4.44Å; K44-V68 WeakPolarHBondContact O-CG1 3.24Å; P46-V68 HydrophobicContact CB-CG2 3.74Å; V66-V68 HydrophobicContact CG2-CG2 4.18Å; V68-E70 PolarHBondContact O-N 3.12Å; V68-I71 PolarHBondContact N-O 2.99Å; V68-I71 PolarHBondContact O-N 2.91Å; V68-L95 HydrophobicContact CG1-CD1 4.45Å
69G87.9Confident93.5Very high40 Ų4050.8 Ų50.841%0.41229%0.287SS..THydrogen-bonded Turntrans65.3-123.2-169.300000111.5I71G69-I71 VanDerWaalsContact C-N 3.34Å
70E86.5Confident93.9Very high167 Ų16750.9 Ų50.978%0.7829%0.286SS*.THydrogen-bonded Turntrans-82.2-14.6179.8-53-51.3137.800113.1V68V68-E70 PolarHBondContact O-N 3.12Å
71I87.5Confident94Very high43 Ų4356.3 Ų56.322%0.22131%0.305CS..EExtended strand (participates in β ladder)trans-90.1127.1-177-63.2162.9000107.9S67 V68 G69 M94 L95S67-I71 CarbonylContact C-O 3.46Å; S67-I71 WeakPolarHBondContact CA-O 3.45Å; V68-I71 PolarHBondContact N-O 2.99Å; V68-I71 PolarHBondContact O-N 2.91Å; G69-I71 VanDerWaalsContact C-N 3.34Å; I71-M94 HydrophobicContact CG2-CB 4.18Å; I71-L95 HydrophobicContact CD1-CD2 3.42Å; I71-L95 VanDerWaalsContact CD1-CD2 3.42Å; I71-L95 HydrophobicContact CD1-CG 4.05Å
72S93Very high93.9Very high74 Ų7455.7 Ų55.752%0.51731%0.307SS..EExtended strand (participates in β ladder)trans-125139.8167.770.30000110.2V66V66-S72 CarbonylContact O-C 3.57Å; V66-S72 VanDerWaalsContact O-CA 3.24Å; V66-S72 WeakPolarHBondContact O-CA 3.25Å
73C95.6Very high93.9Very high16 Ų1654 Ų5411%0.10830%0.299CS..EExtended strand (participates in β ladder)trans-136.7151178.3-62.90000109.6R65 V66 A90 A91R65-C73 CarbonylContact C-O 3.08Å; R65-C73 VanDerWaalsContact CA-O 3.31Å; R65-C73 WeakPolarHBondContact CA-O 3.45Å; V66-C73 HydrophobicContact CG1-CB 4.17Å; V66-C73 PolarHBondContact N-O 3.36Å; V66-C73 PolarHBondContact O-N 2.89Å; C73-A90 HydrophobicContact CB-CB 3.86Å; C73-A91 HydrophobicContact CB-CB 4.24Å
74T96Very high93.9Very high84 Ų8456.9 Ų56.952%0.51531%0.311SS..EExtended strand (participates in β ladder)trans-111.6153.5176.659.40000110.7L51 F64 R65L51-T74 HydrophobicContact CD1-CG2 3.98Å; F64-T74 CarbonylContact O-C 3Å; F64-T74 VanDerWaalsContact O-CA 3.25Å; F64-T74 WeakPolarHBondContact O-CA 3.45Å; R65-T74 HydrophobicContact CB-CG2 4.13Å; R65-T74 HydrophobicContact CG-CG2 4.18Å
75G96.4Very high93.7Very high4 Ų459.8 Ų59.84%0.04132%0.324CS..EExtended strand (participates in β ladder)trans-147.6138.9177.200000110.6T63 F64T63-G75 WeakPolarHBondContact CA-O 3.46Å; F64-G75 PolarHBondContact N-O 2.93Å; F64-G75 PolarHBondContact O-N 2.81Å
76Q95.9Very high93.7Very high97 Ų9761.3 Ų61.345%0.45333%0.333SS..EExtended strand (participates in β ladder)trans-115.5150.5-179-64.1-173.9-35.100111.3F62 T63 K86F62-Q76 CarbonylContact O-C 3.43Å; F62-Q76 VanDerWaalsContact O-CA 3.24Å; F62-Q76 WeakPolarHBondContact O-CA 3.46Å; T63-Q76 HydrophobicContact CG2-CG 3.87Å; T63-Q76 WeakPolarHBondContact OG1-CG 3.35Å; T63-Q76 PolarHBondContact OG1-NE2 2.88Å; Q76-K86 VanDerWaalsContact O-CD 3.26Å; Q76-K86 WeakPolarHBondContact O-CD 3.25Å
77G94.9Very high93.7Very high9 Ų961.3 Ų61.39%0.09333%0.333CS..EExtended strand (participates in β ladder)trans-178.6170.3173.100000114.5F62 S79F62-G77 PolarHBondContact N-O 3.46Å; F62-G77 PolarHBondContact O-N 2.9Å; G77-S79 PolarHBondContact O-N 2.86Å; G77-S79 VanDerWaalsContact O-N 3.09Å
78P92.7Very high93.7Very high93 Ų9359.8 Ų59.860%0.60432%0.323SS*.SBendtrans-73.9-2.1-173.230.5-37000114.1P60P60-P78 VanDerWaalsContact O-CA 3.28Å; P60-P78 WeakPolarHBondContact O-CA 3.49Å
79S93.8Very high93.7Very high49 Ų4964.8 Ų64.834%0.34335%0.346SS..SBendtrans-146.4155.2174.367.10000109.9G77 K81 A82 A83G77-S79 PolarHBondContact O-N 2.86Å; G77-S79 VanDerWaalsContact O-N 3.09Å; S79-K81 PolarHBondContact O-N 2.83Å; S79-K81 VanDerWaalsContact O-N 3.14Å; S79-A82 PolarHBondContact O-N 3.05Å; S79-A82 VanDerWaalsContact O-N 3.07Å; S79-A82 WeakPolarHBondContact OG-CB 3.46Å; S79-A82 PolarHBondContact OG-N 3.36Å; S79-A82 VanDerWaalsContact OG-N 3.13Å; S79-A83 WeakPolarHBondContact O-CB 3.32Å; S79-A83 PolarHBondContact O-N 3.45Å
80K94.2Very high94Very high118 Ų11864.6 Ų64.651%0.51334%0.341SS..Hα-helixtrans-52-37.8174.2-61.8-175.6179.8178.90112.1F62 F64 K84F62-K80 HydrophobicContact CD1-CG 3.77Å; F62-K80 HydrophobicContact CE1-CG 3.95Å; F62-K80 HydrophobicContact CG-CG 4.08Å; F62-K80 HydrophobicContact CZ-CG 4.4Å; F64-K80 HydrophobicContact CE2-CB 3.83Å; F64-K80 HydrophobicContact CE2-CG 4.02Å; F64-K80 HydrophobicContact CZ-CB 4.33Å; F64-K80 HydrophobicContact CZ-CG 4.5Å; K80-K84 WeakPolarHBondContact O-CB 3.31Å; K80-K84 VanDerWaalsContact O-CG 3.31Å; K80-K84 WeakPolarHBondContact O-CG 3.21Å; K80-K84 PolarHBondContact O-N 2.93Å; K80-K84 VanDerWaalsContact O-N 3.09Å
81K93.7Very high94.3Very high158 Ų15856.7 Ų56.769%0.68730%0.304SS*.Hα-helixtrans-68.5-45178-173.7-179.9177.8-175.70112.1S79 H85S79-K81 PolarHBondContact O-N 2.83Å; S79-K81 VanDerWaalsContact O-N 3.14Å; K81-H85 WeakPolarHBondContact O-CB 3.43Å; K81-H85 PolarHBondContact O-N 3.26Å
82A92.3Very high94.4Very high36 Ų3655.2 Ų55.230%0.29830%0.296SS..Hα-helixtrans-65.1-43.2178.500000111.8S79 H85 K86S79-A82 PolarHBondContact O-N 3.05Å; S79-A82 VanDerWaalsContact O-N 3.07Å; S79-A82 WeakPolarHBondContact OG-CB 3.46Å; S79-A82 PolarHBondContact OG-N 3.36Å; S79-A82 VanDerWaalsContact OG-N 3.13Å; A82-H85 WeakPolarHBondContact O-CB 3.45Å; A82-H85 PolarHBondContact O-N 2.94Å; A82-K86 PolarHBondContact O-N 3.24Å
83A96.1Very high94.2Very high0 Ų059.5 Ų59.50%031%0.305CS..Hα-helixtrans-61.4-47.4176.700000112.2F62 F64 S79 H85 K86 A87F62-A83 HydrophobicContact CB-CB 3.97Å; F62-A83 WeakPolarHBondContact O-CB 3.15Å; F64-A83 HydrophobicContact CB-CB 4.31Å; F64-A83 HydrophobicContact CD2-CB 3.76Å; F64-A83 HydrophobicContact CG-CB 4.49Å; S79-A83 WeakPolarHBondContact O-CB 3.32Å; S79-A83 PolarHBondContact O-N 3.45Å; A83-H85 VanDerWaalsContact C-N 3.31Å; A83-H85 PolarHBondContact O-N 3.49Å; A83-K86 PolarHBondContact O-N 2.98Å; A83-A87 WeakPolarHBondContact O-CB 3.31Å; A83-A87 PolarHBondContact O-N 3.41Å
84K96Very high93.8Very high72 Ų7264.4 Ų64.431%0.31333%0.328SS..Hα-helixtrans-60.1-39.7173.7-75.2-174.3-179.9-167.30112.6I32 Y48 F64 K80 A87 A88I32-K84 HydrophobicContact CD1-CB 3.95Å; Y48-K84 HydrophobicContact CD1-CB 4.14Å; Y48-K84 HydrophobicContact CD1-CD 4.24Å; Y48-K84 HydrophobicContact CD1-CG 3.85Å; Y48-K84 HydrophobicContact CE1-CB 4.15Å; Y48-K84 HydrophobicContact CE1-CG 4.37Å; Y48-K84 HydrophobicContact CG-CD 4.33Å; Y48-K84 HydrophobicContact CG-CG 4.4Å; F64-K84 HydrophobicContact CB-CG 4.17Å; F64-K84 HydrophobicContact CD1-CD 4.27Å; F64-K84 HydrophobicContact CD1-CG 3.61Å; F64-K84 HydrophobicContact CD2-CG 3.96Å; F64-K84 HydrophobicContact CE1-CD 4.17Å; F64-K84 HydrophobicContact CE1-CG 3.95Å; F64-K84 HydrophobicContact CE2-CG 4.23Å; F64-K84 HydrophobicContact CG-CG 3.61Å; F64-K84 HydrophobicContact CZ-CD 4.43Å; F64-K84 VanDerWaalsContact CZ-CE 3.44Å; F64-K84 HydrophobicContact CZ-CG 4.23Å; K80-K84 WeakPolarHBondContact O-CB 3.31Å; K80-K84 VanDerWaalsContact O-CG 3.31Å; K80-K84 WeakPolarHBondContact O-CG 3.21Å; K80-K84 PolarHBondContact O-N 2.93Å; K80-K84 VanDerWaalsContact O-N 3.09Å; K84-A87 PolarHBondContact O-N 2.79Å; K84-A88 WeakPolarHBondContact O-CB 3.32Å; K84-A88 PolarHBondContact O-N 2.87Å
85H95.4Very high93.2Very high69 Ų6961.6 Ų61.632%0.31931%0.31SS..Hα-helixtrans-61.8-48.4178.1-172.8114.9000111.1P31 I32 K81 A82 A83 A87 A88 E89P31-H85 WeakPolarHBondContact CD-CE1 3.47Å; P31-H85 WeakPolarHBondContact CD-NE2 3.31Å; P31-H85 WeakPolarHBondContact CG-NE2 3.33Å; I32-H85 HydrophobicContact CD1-CB 4.16Å; I32-H85 HydrophobicContact CG1-CB 4.44Å; K81-H85 WeakPolarHBondContact O-CB 3.43Å; K81-H85 PolarHBondContact O-N 3.26Å; A82-H85 WeakPolarHBondContact O-CB 3.45Å; A82-H85 PolarHBondContact O-N 2.94Å; A83-H85 VanDerWaalsContact C-N 3.31Å; A83-H85 PolarHBondContact O-N 3.49Å; H85-A87 PolarHBondContact O-N 3.05Å; H85-A88 PolarHBondContact O-N 2.86Å; H85-E89 WeakPolarHBondContact O-CB 3.49Å; H85-E89 PolarHBondContact O-N 3.39Å
86K95.6Very high92.5Very high121 Ų12166.3 Ų66.353%0.52633%0.329SS..Hα-helixtrans-64.5-39178.5-160.2172.5-168.4178.80112.3Q76 A82 A83 E89 A90Q76-K86 VanDerWaalsContact O-CD 3.26Å; Q76-K86 WeakPolarHBondContact O-CD 3.25Å; A82-K86 PolarHBondContact O-N 3.24Å; A83-K86 PolarHBondContact O-N 2.98Å; K86-E89 PolarHBondContact O-N 2.87Å; K86-A90 PolarHBondContact O-N 2.87Å
87A96.6Very high91.2Very high0 Ų064.8 Ų64.80%034%0.34CS..Hα-helixtrans-63.4-44.5175.100000111.2V66 A83 K84 H85 A90 A91V66-A87 HydrophobicContact CB-CB 4.22Å; V66-A87 HydrophobicContact CG1-CB 3.97Å; V66-A87 WeakPolarHBondContact CG1-O 3.24Å; A83-A87 WeakPolarHBondContact O-CB 3.31Å; A83-A87 PolarHBondContact O-N 3.41Å; K84-A87 PolarHBondContact O-N 2.79Å; H85-A87 PolarHBondContact O-N 3.05Å; A87-A90 PolarHBondContact O-N 2.87Å; A87-A91 PolarHBondContact O-N 3.2Å
88A94.9Very high89.1Confident0 Ų066.8 Ų66.80%036%0.361CS..Hα-helixtrans-64.6-40.3178.500000112.5P31 I32 L35 Y48 K84 H85 A91 L92P31-A88 HydrophobicContact CB-CB 4.12Å; I32-A88 HydrophobicContact CG1-CB 3.97Å; L35-A88 HydrophobicContact CD2-CB 3.94Å; Y48-A88 HydrophobicContact CE1-CB 4.33Å; Y48-A88 VanDerWaalsContact OH-CB 3.31Å; Y48-A88 WeakPolarHBondContact OH-CB 3.3Å; K84-A88 WeakPolarHBondContact O-CB 3.32Å; K84-A88 PolarHBondContact O-N 2.87Å; H85-A88 PolarHBondContact O-N 2.86Å; A88-A91 PolarHBondContact O-N 2.84Å; A88-L92 WeakPolarHBondContact O-CG 3.33Å; A88-L92 PolarHBondContact O-N 3.06Å
89E93Very high87.1Confident110 Ų11071.3 Ų71.351%0.51438%0.379SS..Hα-helixtrans-61.2-45.5175-177.6179.4-161.900111.8P31 H85 K86 A91 L92 K93P31-E89 HydrophobicContact CB-CB 4.22Å; P31-E89 HydrophobicContact CG-CB 4.38Å; H85-E89 WeakPolarHBondContact O-CB 3.49Å; H85-E89 PolarHBondContact O-N 3.39Å; K86-E89 PolarHBondContact O-N 2.87Å; E89-A91 VanDerWaalsContact C-N 3.35Å; E89-A91 PolarHBondContact O-N 3.48Å; E89-L92 PolarHBondContact O-N 2.81Å; E89-K93 PolarHBondContact O-N 3.1Å
90A93.6Very high84.3Confident37 Ų3772.6 Ų72.631%0.30640%0.4SS..Hα-helixtrans-60.1-44.2175.400000111.8C73 K86 A87 K93 M94C73-A90 HydrophobicContact CB-CB 3.86Å; K86-A90 PolarHBondContact O-N 2.87Å; A87-A90 PolarHBondContact O-N 2.87Å; A90-K93 PolarHBondContact O-N 2.97Å; A90-M94 WeakPolarHBondContact O-CG 3.47Å; A90-M94 PolarHBondContact O-N 3.34Å; A90-M94 VanDerWaalsContact O-N 3.07Å
91A92.9Very high81.3Confident1 Ų170.7 Ų70.71%0.00841%0.413CS..Hα-helixtrans-63.5-43.2176.500000112.5L35 V66 C73 A87 A88 E89 K93 M94 L95L35-A91 HydrophobicContact CD1-CB 4.21Å; L35-A91 HydrophobicContact CD2-CB 3.83Å; V66-A91 HydrophobicContact CG1-CB 3.63Å; C73-A91 HydrophobicContact CB-CB 4.24Å; A87-A91 PolarHBondContact O-N 3.2Å; A88-A91 PolarHBondContact O-N 2.84Å; E89-A91 VanDerWaalsContact C-N 3.35Å; E89-A91 PolarHBondContact O-N 3.48Å; A91-K93 VanDerWaalsContact C-N 3.3Å; A91-K93 PolarHBondContact O-N 3.46Å; A91-M94 PolarHBondContact O-N 2.97Å; A91-L95 WeakPolarHBondContact O-CB 2.96Å; A91-L95 WeakPolarHBondContact O-CD1 3.42Å; A91-L95 VanDerWaalsContact O-CG 3.25Å; A91-L95 WeakPolarHBondContact O-CG 3.28Å; A91-L95 PolarHBondContact O-N 2.72Å
92L89.7Confident79.1Confident12 Ų1269 Ų696%0.06342%0.418CS..Hα-helixtrans-61.5-38.8175.1-74.3173.9000111.9I19 L23 P31 L34 L35 A88 E89 L95 K96I19-L92 HydrophobicContact CD1-CD2 4Å; L23-L92 HydrophobicContact CD2-CD1 4.2Å; L23-L92 HydrophobicContact CD2-CD2 4.5Å; P31-L92 HydrophobicContact CB-CD1 3.94Å; P31-L92 WeakPolarHBondContact O-CD1 3.26Å; L34-L92 HydrophobicContact CB-CD1 4.02Å; L35-L92 HydrophobicContact CB-CD1 4.46Å; L35-L92 HydrophobicContact CB-CD2 4.06Å; L35-L92 HydrophobicContact CB-CG 4.12Å; L35-L92 HydrophobicContact CD1-CD2 3.65Å; L35-L92 HydrophobicContact CD1-CG 3.96Å; L35-L92 HydrophobicContact CG-CD2 4.48Å; A88-L92 WeakPolarHBondContact O-CG 3.33Å; A88-L92 PolarHBondContact O-N 3.06Å; E89-L92 PolarHBondContact O-N 2.81Å; L92-L95 PolarHBondContact O-N 2.94Å; L92-K96 WeakPolarHBondContact O-CG 3.15Å; L92-K96 PolarHBondContact O-N 3.13Å
93K89.1Confident76.7Confident163 Ų16373.8 Ų73.871%0.70944%0.444SS*.Hα-helixtrans-62.9-43.9176.6-172177.2178.6-178.80111.8E89 A90 A91 L95 K96 G97E89-K93 PolarHBondContact O-N 3.1Å; A90-K93 PolarHBondContact O-N 2.97Å; A91-K93 VanDerWaalsContact C-N 3.3Å; A91-K93 PolarHBondContact O-N 3.46Å; K93-L95 VanDerWaalsContact C-N 3.34Å; K93-K96 PolarHBondContact O-N 3.07Å; K93-G97 PolarHBondContact O-N 2.85Å
94M87.5Confident73.6Confident119 Ų11977.3 Ų77.359%0.58648%0.48SS*.Hα-helixtrans-64.4-38.5175.3-67.5-63.1-71.300112I71 A90 A91 G97I71-M94 HydrophobicContact CG2-CB 4.18Å; A90-M94 WeakPolarHBondContact O-CG 3.47Å; A90-M94 PolarHBondContact O-N 3.34Å; A90-M94 VanDerWaalsContact O-N 3.07Å; A91-M94 PolarHBondContact O-N 2.97Å; M94-G97 PolarHBondContact O-N 2.8Å
95L84Confident71Confident26 Ų2680.4 Ų80.414%0.13651%0.505CS..Hα-helixtrans-71-30.3178.4-71.8165.4000113.4I19 L35 Y38 V68 I71 A91 L92 K93 G97I19-L95 HydrophobicContact CD1-CB 3.37Å; I19-L95 HydrophobicContact CD1-CD1 4.2Å; I19-L95 HydrophobicContact CD1-CG 4.4Å; L35-L95 HydrophobicContact CD1-CD1 3.54Å; Y38-L95 HydrophobicContact CD1-CD1 3.91Å; Y38-L95 HydrophobicContact CE1-CD1 3.71Å; Y38-L95 HydrophobicContact CE1-CD2 3.86Å; Y38-L95 HydrophobicContact CE1-CG 4.28Å; V68-L95 HydrophobicContact CG1-CD1 4.45Å; I71-L95 HydrophobicContact CD1-CD2 3.42Å; I71-L95 VanDerWaalsContact CD1-CD2 3.42Å; I71-L95 HydrophobicContact CD1-CG 4.05Å; A91-L95 WeakPolarHBondContact O-CB 2.96Å; A91-L95 WeakPolarHBondContact O-CD1 3.42Å; A91-L95 VanDerWaalsContact O-CG 3.25Å; A91-L95 WeakPolarHBondContact O-CG 3.28Å; A91-L95 PolarHBondContact O-N 2.72Å; L92-L95 PolarHBondContact O-N 2.94Å; K93-L95 VanDerWaalsContact C-N 3.34Å; L95-G97 VanDerWaalsContact C-N 3.34Å
96K80.3Confident68Low102 Ų10281.9 Ų81.944%0.44353%0.529SS..Hα-helixtrans-68.4-33170.7-71-168.2-141.1-145.30112.7I19 L23 L92 K93 G98I19-K96 HydrophobicContact CG2-CB 4.42Å; I19-K96 HydrophobicContact CG2-CG 4.03Å; L23-K96 HydrophobicContact CD1-CD 3.86Å; L23-K96 HydrophobicContact CD1-CG 3.93Å; L23-K96 VanDerWaalsContact CD1-NZ 3.26Å; L92-K96 WeakPolarHBondContact O-CG 3.15Å; L92-K96 PolarHBondContact O-N 3.13Å; K93-K96 PolarHBondContact O-N 3.07Å; K96-G98 PolarHBondContact O-N 3.09Å; K96-G98 VanDerWaalsContact O-N 3.13Å
97G68.3Low65Low66 Ų6684 Ų8468%0.6855%0.545SS*.THydrogen-bonded Turntrans-68.9-4.7-175.100000115.4K93 M94 L95K93-G97 PolarHBondContact O-N 2.85Å; M94-G97 PolarHBondContact O-N 2.8Å; L95-G97 VanDerWaalsContact C-N 3.34Å
98G51.7Low61.8Low51 Ų5187.3 Ų87.353%0.52658%0.579SS.*  trans74.8138-179.900000112.7K96 G100K96-G98 PolarHBondContact O-N 3.09Å; K96-G98 VanDerWaalsContact O-N 3.13Å; G98-G100 PolarHBondContact O-N 2.88Å; G98-G100 VanDerWaalsContact O-N 3.1Å
99L49.8Very low58.7Low188 Ų18896 Ų9698%0.98462%0.62SS**  trans-53.1112.9170-79147.8000110.6
100G36.6Very low55.7Low76 Ų7698.2 Ų98.278%0.78464%0.635SS**  trans-149.774.3173.300000111.9G98G98-G100 PolarHBondContact O-N 2.88Å; G98-G100 VanDerWaalsContact O-N 3.1Å
101G31Very low52.4Low77 Ų77100 Ų10079%0.79466%0.657SS**  trans99.9151.4157.700000117.7
102P46.1Very low49.4Very low123 Ų123109.3 Ų109.380%0.79970%0.698SS**  trans-99.3157.1-146.336.6-30.1000115.8
103V41.8Very low46.3Very low137 Ų137115.4 Ų115.483%0.8374%0.736SS**  trans31.6113146.7-167.50000117.8
104G32.8Very low43.3Very low74 Ų74115.9 Ų115.976%0.76374%0.74SS**  trans-166.492.3165.500000112
105V40.8Very low40.5Very low136 Ų136117.3 Ų117.382%0.82476%0.755SS**  trans-56.3130.4166.5-159.40000108.7
106A32Very low37.7Very low100 Ų100122.1 Ų122.183%0.82678%0.781SS**  trans-14396.5163.400000110.4
107L33.3Very low35.1Very low165 Ų165124 Ų12486%0.86480%0.801SS**  trans-77134.5151.5-82.4150.1000107.8
108G28.8Very low33.2Very low70 Ų70125.1 Ų125.172%0.72280%0.798SS**  trans87115.4141.400000120.3
109E30Very low32.1Very low184 Ų184129.6 Ų129.686%0.8682%0.815SS**  trans73.4132.9137.8-79174.8123.600124
110D29.4Very low31Very low156 Ų156128 Ų12883%0.83481%0.808SS**  trans57.4126.4154.8-70.1-39.1000122.2
111G24.9Very low30.5Very low74 Ų74127.7 Ų127.776%0.76381%0.805SS**  trans140.899.5154.800000115.4
112F29.1Very low30.1Very low197 Ų197130.2 Ų130.286%0.86480%0.8SS**  trans-22.1137160.5-91.9-111.3000116.5
113T24.8Very low29.2Very low140 Ų140129.4 Ų129.486%0.85980%0.797SS**  trans-159.3119.3132.616.90000109.9
114E27Very low28.8Very low173 Ų173127.6 Ų127.681%0.80879%0.791SS**  trans-58.4140.2167-70.7169.2118.200110.9
115V27.8Very low28.6Very low148 Ų148132.7 Ų132.790%0.89779%0.794SS**  trans-145.4110.3142.2-96.70000108.9
116D24.3Very low28Very low128 Ų128132 Ų13268%0.68480%0.796SS**  trans-52.7129.4165.716756.2000112.4S118D116-S118 PolarHBondContact OD1-OG 3.3Å; D116-S118 VanDerWaalsContact OD1-OG 3.08Å
117V26.7Very low27.9Very low141 Ų141134.7 Ų134.786%0.85579%0.792SS**  trans-143.7103.3146.7-176.90000108.4
118S27.6Very low27.7Very low89 Ų89135.9 Ų135.962%0.62280%0.795SS**  trans-77.4131.3168.5-59.40000111.2D116D116-S118 PolarHBondContact OD1-OG 3.3Å; D116-S118 VanDerWaalsContact OD1-OG 3.08Å
119V29.9Very low27.8Very low145 Ų145141.2 Ų141.288%0.87980%0.798SS**  trans-147.4121.9141.1-176.80000109.8
120D26.1Very low27.7Very low155 Ų155139 Ų13983%0.82980%0.797SS**  trans-77.9165.9-175.5-113.7-81.5000116.2
121G26.3Very low27.9Very low70 Ų70136.9 Ų136.972%0.72280%0.795SS**  trans129.767.6159.500000114.4
122D23.1Very low28.1Very low129 Ų129141 Ų14169%0.6980%0.8SS**  73.5112.379.1-169.942000116.5
123S27.3Very low28.3Very low106 Ų106137 Ų13774%0.74180%0.796SS**  -17995.5124.2-90.10000112.2
124S32.7Very low28.6Very low100 Ų100135.5 Ų135.570%0.69979%0.791SS**  58.9107.1128-36.80000122.6
125Q28.8Very low29.1Very low180 Ų180136 Ų13684%0.84179%0.793SS**  trans-5.5141.7140.8-67.51725.300120.4
126S28.5Very low29.5Very low123 Ų123137.5 Ų137.586%0.8679%0.791SS**  -149108.112265.90000110.7
127E28.6Very low30.1Very low156 Ų156136.9 Ų136.973%0.72980%0.796SS**  trans-75.4139166.4-63.8-175.6107.900110
128M30.1Very low31.1Very low189 Ų189136.8 Ų136.893%0.93179%0.786SS**  trans-136.2108.1148.9-137.5173.2-165.600108.6
129K31.7Very low32.8Very low182 Ų182138.2 Ų138.279%0.79180%0.795SS**  trans-65.8124.7171.6-77.1171.8173.3172.30109.3
130T27.7Very low35.7Very low137 Ų137135.2 Ų135.284%0.8477%0.774SS**  trans-123.2114.2149.531.90000108.6N132T130-N132 PolarHBondContact O-N 2.81Å
131S32Very low38.8Very low113 Ų113128.7 Ų128.779%0.7974%0.74SS**  trans-54.3121.5170.942.30000111.3
132N29Very low42.1Very low161 Ų161126.7 Ų126.786%0.86171%0.714SS**  trans-151.5116.5141.7-115.28.8000111.3T130 S134T130-N132 PolarHBondContact O-N 2.81Å; N132-S134 PolarHBondContact O-N 3.28Å
133S34.5Very low45.5Very low112 Ų112121.4 Ų121.478%0.78369%0.69SS**  trans-72.9109.5177.448.10000110.7
134S31.8Very low48.7Very low108 Ų108118.4 Ų118.476%0.75567%0.671SS**  trans-177.873.6147.2-74.40000109.7N132N132-S134 PolarHBondContact O-N 3.28Å
135Q37.5Very low51.6Low183 Ų183113.6 Ų113.686%0.85564%0.638SS**  trans32.2100.7134.6-61.6177.5-1400117.8S137Q135-S137 VanDerWaalsContact C-N 3.34Å; Q135-S137 PolarHBondContact O-N 2.79Å
136Q36.1Very low54.8Low181 Ų181109.7 Ų109.785%0.84662%0.62SS**  trans40.445.1131.6-78.8175.8-8.600118.3E138Q136-E138 VanDerWaalsContact C-N 3.25Å; Q136-E138 PolarHBondContact O-N 2.86Å
137S37.1Very low57.9Low114 Ų114110.7 Ų110.780%0.79761%0.611SS**  trans-76.385.6158.139.90000108.4Q135 C139Q135-S137 VanDerWaalsContact C-N 3.34Å; Q135-S137 PolarHBondContact O-N 2.79Å; S137-C139 PolarHBondContact O-N 2.77Å
138E47.6Very low60.8Low139 Ų139105.5 Ų105.565%0.6559%0.588SS**  trans-44.4100.3-179.2-69-175.6149.600113.7Q136 N140Q136-E138 VanDerWaalsContact C-N 3.25Å; Q136-E138 PolarHBondContact O-N 2.86Å; E138-N140 VanDerWaalsContact C-N 3.27Å; E138-N140 PolarHBondContact O-N 3.41Å
139C63.5Low63.8Low119 Ų11996.5 Ų96.580%0.80454%0.544SS*.  trans37.628141.3810000120.3S137 P141S137-C139 PolarHBondContact O-N 2.77Å; C139-P141 WeakPolarHBondContact O-CD 3.48Å
140N89.1Confident66.7Low83 Ų8392.1 Ų92.144%0.44453%0.532SS..  trans-77.4100.1172.3179.318.6000109.5E138 V142 G143 A144E138-N140 VanDerWaalsContact C-N 3.27Å; E138-N140 PolarHBondContact O-N 3.41Å; N140-V142 PolarHBondContact O-N 2.99Å; N140-V142 VanDerWaalsContact O-N 3.11Å; N140-V142 WeakPolarHBondContact OD1-CB 3.25Å; N140-V142 PolarHBondContact OD1-N 3.44Å; N140-G143 PolarHBondContact ND2-N 3.48Å; N140-G143 PolarHBondContact O-N 3.31Å; N140-A144 PolarHBondContact O-N 2.98Å
141P92.3Very high69.6Low17 Ų1793.7 Ų93.711%0.1153%0.529CS..Hα-helixtrans-64.9-23.3-175.930.9-38.4000111.9C139 L145 R196 A199 A200 L203C139-P141 WeakPolarHBondContact O-CD 3.48Å; P141-L145 WeakPolarHBondContact O-CB 3.5Å; P141-L145 PolarHBondContact O-N 2.85Å; P141-R196 HydrophobicContact CG-CB 4.36Å; P141-R196 HydrophobicContact CG-CG 3.26Å; P141-R196 VanDerWaalsContact CG-O 3.26Å; P141-R196 WeakPolarHBondContact CG-O 3.41Å; P141-A199 HydrophobicContact CB-CB 4.26Å; P141-A199 HydrophobicContact CG-CB 4.49Å; P141-A200 HydrophobicContact CB-CB 3.86Å; P141-A200 HydrophobicContact CG-CB 4.11Å; P141-L203 HydrophobicContact CB-CD1 3.79Å; P141-L203 WeakPolarHBondContact O-CD1 3.34Å
142V95.5Very high72.1Confident28 Ų2892.5 Ų92.517%0.1751%0.51CS..Hα-helixtrans-68.2-44.4175.7-175.80000110.5N140 Q146 Y159 K195 R196 A199N140-V142 PolarHBondContact O-N 2.99Å; N140-V142 VanDerWaalsContact O-N 3.11Å; N140-V142 WeakPolarHBondContact OD1-CB 3.25Å; N140-V142 PolarHBondContact OD1-N 3.44Å; V142-Q146 WeakPolarHBondContact O-CB 3.35Å; V142-Q146 PolarHBondContact O-N 3.3Å; V142-Q146 VanDerWaalsContact O-N 3.07Å; V142-Y159 HydrophobicContact CG1-CE2 4.43Å; V142-K195 HydrophobicContact CG1-CD 4.43Å; V142-K195 HydrophobicContact CG2-CG 4.15Å; V142-R196 HydrophobicContact CG2-CB 4.42Å; V142-A199 HydrophobicContact CB-CB 4.35Å; V142-A199 HydrophobicContact CG2-CB 3.86Å
143G94.7Very high74.9Confident18 Ų1886.6 Ų86.619%0.18649%0.488CS..Hα-helixtrans-69.5-47.8177.600000111.4N140 L145 Q146 E147N140-G143 PolarHBondContact ND2-N 3.48Å; N140-G143 PolarHBondContact O-N 3.31Å; G143-L145 VanDerWaalsContact C-N 3.28Å; G143-L145 PolarHBondContact O-N 3.18Å; G143-Q146 WeakPolarHBondContact O-CB 3.47Å; G143-Q146 PolarHBondContact O-N 3.09Å; G143-E147 WeakPolarHBondContact O-CG 3.08Å; G143-E147 PolarHBondContact O-N 3Å
144A93.9Very high77.6Confident43 Ų4384.7 Ų84.736%0.35546%0.463SS..Hα-helixtrans-59.4-38.6176.900000112.3N140 L148 L203N140-A144 PolarHBondContact O-N 2.98Å; A144-L148 VanDerWaalsContact O-CB 3.28Å; A144-L148 WeakPolarHBondContact O-CB 3.42Å; A144-L148 PolarHBondContact O-N 2.88Å; A144-L203 HydrophobicContact CB-CD1 3.94Å
145L94.7Very high80.4Confident0 Ų086.5 Ų86.50%045%0.454CS..Hα-helixtrans-65.3-44.5173.6-178.861.7000111.6P141 G143 L148 V149 P157 V179 A199 M202 L203 I206P141-L145 WeakPolarHBondContact O-CB 3.5Å; P141-L145 PolarHBondContact O-N 2.85Å; G143-L145 VanDerWaalsContact C-N 3.28Å; G143-L145 PolarHBondContact O-N 3.18Å; L145-L148 PolarHBondContact O-N 3.13Å; L145-V149 HydrophobicContact CD1-CG2 4.03Å; L145-V149 HydrophobicContact CG-CG2 4.33Å; L145-V149 WeakPolarHBondContact O-CB 3.47Å; L145-V149 WeakPolarHBondContact O-CG2 3.36Å; L145-V149 PolarHBondContact O-N 3.14Å; L145-P157 HydrophobicContact CD2-CB 4.27Å; L145-P157 HydrophobicContact CD2-CG 4.16Å; L145-P157 HydrophobicContact CG-CG 4.02Å; L145-V179 HydrophobicContact CD1-CG2 4.44Å; L145-V179 HydrophobicContact CD2-CG2 4.24Å; L145-A199 HydrophobicContact CB-CB 4.46Å; L145-A199 HydrophobicContact CD2-CB 3.95Å; L145-M202 HydrophobicContact CD1-CB 4.28Å; L145-M202 HydrophobicContact CD1-CG 3.69Å; L145-M202 HydrophobicContact CD2-CB 3.83Å; L145-M202 HydrophobicContact CD2-CG 3.69Å; L145-M202 HydrophobicContact CG-CG 4.36Å; L145-L203 HydrophobicContact CB-CD1 4.34Å; L145-L203 HydrophobicContact CB-CD2 3.98Å; L145-L203 HydrophobicContact CB-CG 3.92Å; L145-L203 HydrophobicContact CD1-CD2 3.95Å; L145-L203 HydrophobicContact CD1-CG 4.14Å; L145-I206 HydrophobicContact CD1-CD1 3.58Å
146Q95Very high83.1Confident98 Ų9883 Ų8346%0.45844%0.44SS..Hα-helixtrans-61.7-45.6178.6-178.8171.3-19.600111.5V142 G143 V149 V150 L156V142-Q146 WeakPolarHBondContact O-CB 3.35Å; V142-Q146 PolarHBondContact O-N 3.3Å; V142-Q146 VanDerWaalsContact O-N 3.07Å; G143-Q146 WeakPolarHBondContact O-CB 3.47Å; G143-Q146 PolarHBondContact O-N 3.09Å; Q146-V149 PolarHBondContact O-N 2.94Å; Q146-V150 WeakPolarHBondContact O-CB 3.23Å; Q146-V150 VanDerWaalsContact O-CG2 3.26Å; Q146-V150 WeakPolarHBondContact O-CG2 3.42Å; Q146-V150 PolarHBondContact O-N 2.89Å; Q146-L156 HydrophobicContact CG-CD2 4.22Å
147E93.5Very high86Confident143 Ų14375.4 Ų75.467%0.66841%0.406SS*.Hα-helixtrans-60.6-46175.2-72.1171.5-166.400111.6G143 V149 V150 Q151G143-E147 WeakPolarHBondContact O-CG 3.08Å; G143-E147 PolarHBondContact O-N 3Å; E147-V149 VanDerWaalsContact C-N 3.33Å; E147-V149 PolarHBondContact O-N 3.05Å; E147-V150 PolarHBondContact O-N 2.78Å; E147-Q151 VanDerWaalsContact O-CB 3.27Å; E147-Q151 WeakPolarHBondContact O-CB 3.28Å; E147-Q151 PolarHBondContact O-N 2.98Å
148L90Very high88.8Confident48 Ų4875.3 Ų75.325%0.25139%0.393SS..Hα-helixtrans-59.8-43.3177.6-179.866.1000112.3A144 L145 Q151 K152 L203 I206A144-L148 VanDerWaalsContact O-CB 3.28Å; A144-L148 WeakPolarHBondContact O-CB 3.42Å; A144-L148 PolarHBondContact O-N 2.88Å; L145-L148 PolarHBondContact O-N 3.13Å; L148-Q151 PolarHBondContact O-N 3Å; L148-K152 HydrophobicContact CD1-CD 4.33Å; L148-K152 HydrophobicContact CG-CD 4.36Å; L148-K152 WeakPolarHBondContact O-CB 3.24Å; L148-K152 WeakPolarHBondContact O-CG 3.41Å; L148-K152 PolarHBondContact O-N 2.85Å; L148-L203 HydrophobicContact CB-CD2 4.4Å; L148-L203 HydrophobicContact CD2-CD2 3.67Å; L148-I206 HydrophobicContact CD2-CB 4.3Å; L148-I206 HydrophobicContact CD2-CG2 3.73Å
149V92.8Very high91.1Very high0 Ų071.1 Ų71.10%037%0.372CS..Hα-helixtrans-66.2-44179.6166.50000110.8L145 Q146 E147 K152 G153 W154 R155 P157 V179L145-V149 HydrophobicContact CD1-CG2 4.03Å; L145-V149 HydrophobicContact CG-CG2 4.33Å; L145-V149 WeakPolarHBondContact O-CB 3.47Å; L145-V149 WeakPolarHBondContact O-CG2 3.36Å; L145-V149 PolarHBondContact O-N 3.14Å; Q146-V149 PolarHBondContact O-N 2.94Å; E147-V149 VanDerWaalsContact C-N 3.33Å; E147-V149 PolarHBondContact O-N 3.05Å; V149-K152 PolarHBondContact O-N 3.45Å; V149-G153 PolarHBondContact O-N 2.94Å; V149-W154 HydrophobicContact CG1-CB 3.72Å; V149-W154 WeakPolarHBondContact CG1-O 3.34Å; V149-W154 HydrophobicContact CG2-CE3 4.26Å; V149-W154 PolarHBondContact O-N 3.36Å; V149-R155 WeakPolarHBondContact CG1-O 3.31Å; V149-P157 HydrophobicContact CB-CG 4.43Å; V149-P157 HydrophobicContact CG1-CG 4.46Å; V149-P157 HydrophobicContact CG2-CG 4.11Å; V149-V179 HydrophobicContact CG1-CG1 4.47Å; V149-V179 HydrophobicContact CG2-CG1 3.5Å; V149-V179 VanDerWaalsContact CG2-CG1 3.5Å; V149-V179 HydrophobicContact CG2-CG2 4.22Å
150V91.6Very high92.6Very high90 Ų9068.8 Ų68.855%0.54535%0.354SS..Hα-helixtrans-62.2-45.21741700000111Q146 E147 K152 G153 L156Q146-V150 WeakPolarHBondContact O-CB 3.23Å; Q146-V150 VanDerWaalsContact O-CG2 3.26Å; Q146-V150 WeakPolarHBondContact O-CG2 3.42Å; Q146-V150 PolarHBondContact O-N 2.89Å; E147-V150 PolarHBondContact O-N 2.78Å; V150-K152 PolarHBondContact O-N 3.38Å; V150-G153 PolarHBondContact O-N 3.47Å; V150-L156 HydrophobicContact CG2-CD2 3.79Å
151Q88.8Confident93Very high169 Ų16967.3 Ų67.379%0.7935%0.348SS*.Hα-helixtrans-61.4-32.7178-176.263.440.100112.5E147 L148 G153E147-Q151 VanDerWaalsContact O-CB 3.27Å; E147-Q151 WeakPolarHBondContact O-CB 3.28Å; E147-Q151 PolarHBondContact O-N 2.98Å; L148-Q151 PolarHBondContact O-N 3Å; Q151-G153 VanDerWaalsContact C-N 3.32Å
152K85.7Confident92.9Very high88 Ų8870.3 Ų70.338%0.38337%0.366SS..THydrogen-bonded Turntrans-84.6-1.6175.3-72.8-179.4175.4-80.20113.8L148 V149 V150 W154 I206L148-K152 HydrophobicContact CD1-CD 4.33Å; L148-K152 HydrophobicContact CG-CD 4.36Å; L148-K152 WeakPolarHBondContact O-CB 3.24Å; L148-K152 WeakPolarHBondContact O-CG 3.41Å; L148-K152 PolarHBondContact O-N 2.85Å; V149-K152 PolarHBondContact O-N 3.45Å; V150-K152 PolarHBondContact O-N 3.38Å; K152-W154 HydrophobicContact CB-CD2 3.77Å; K152-W154 HydrophobicContact CB-CE3 4.21Å; K152-W154 HydrophobicContact CB-CG 3.99Å; K152-W154 HydrophobicContact CB-CZ2 4.39Å; K152-W154 HydrophobicContact CD-CD2 4.07Å; K152-W154 HydrophobicContact CD-CE3 3.87Å; K152-W154 HydrophobicContact CD-CH2 3.42Å; K152-W154 VanDerWaalsContact CD-CH2 3.42Å; K152-W154 HydrophobicContact CD-CZ2 3.61Å; K152-W154 HydrophobicContact CD-CZ3 3.55Å; K152-W154 PolarHBondContact O-N 2.89Å; K152-I206 HydrophobicContact CD-CG2 4.39Å
153G86.8Confident92.7Very high38 Ų3874.1 Ų74.139%0.39238%0.382SS..THydrogen-bonded Turntrans67.122.8-176.700000113.8V149 V150 Q151V149-G153 PolarHBondContact O-N 2.94Å; V150-G153 PolarHBondContact O-N 3.47Å; Q151-G153 VanDerWaalsContact C-N 3.32Å
154W91.8Very high92.7Very high71 Ų7178 Ų7827%0.26940%0.396SS..PPolyproline II helixtrans-87.2160.4179.7-67-12.3000111.5V149 K152 V179 F182 I206V149-W154 HydrophobicContact CG1-CB 3.72Å; V149-W154 WeakPolarHBondContact CG1-O 3.34Å; V149-W154 HydrophobicContact CG2-CE3 4.26Å; V149-W154 PolarHBondContact O-N 3.36Å; K152-W154 HydrophobicContact CB-CD2 3.77Å; K152-W154 HydrophobicContact CB-CE3 4.21Å; K152-W154 HydrophobicContact CB-CG 3.99Å; K152-W154 HydrophobicContact CB-CZ2 4.39Å; K152-W154 HydrophobicContact CD-CD2 4.07Å; K152-W154 HydrophobicContact CD-CE3 3.87Å; K152-W154 HydrophobicContact CD-CH2 3.42Å; K152-W154 VanDerWaalsContact CD-CH2 3.42Å; K152-W154 HydrophobicContact CD-CZ2 3.61Å; K152-W154 HydrophobicContact CD-CZ3 3.55Å; K152-W154 PolarHBondContact O-N 2.89Å; W154-V179 HydrophobicContact CE3-CG1 3.78Å; W154-V179 HydrophobicContact CZ3-CG1 4.27Å; W154-F182 HydrophobicContact CH2-CE2 4.14Å; W154-I206 HydrophobicContact CH2-CG2 3.81Å; W154-I206 HydrophobicContact CZ3-CD1 3.95Å; W154-I206 HydrophobicContact CZ3-CG1 4.05Å; W154-I206 HydrophobicContact CZ3-CG2 3.62Å
155R91.2Very high92.6Very high147 Ų14778 Ų7856%0.55539%0.392SS*.PPolyproline II helixtrans-63.9142.7173.4-66.9-176.9-176.8161.63.6110.7V149V149-R155 WeakPolarHBondContact CG1-O 3.31Å
156L94.1Very high92.4Very high110 Ų11080.3 Ų80.358%0.57642%0.417SS*.PPolyproline II helixtrans-53.8144.3-179-65.9178.8000111.7Q146 V150 E158Q146-L156 HydrophobicContact CG-CD2 4.22Å; V150-L156 HydrophobicContact CG2-CD2 3.79Å; L156-E158 PolarHBondContact O-N 3.12Å
157P95.4Very high92Very high20 Ų2078.8 Ų78.813%0.1342%0.415CS..PPolyproline II helixtrans-61.7131.2-178.4-19.230.8000112.2L145 V149 Y159 V179L145-P157 HydrophobicContact CD2-CB 4.27Å; L145-P157 HydrophobicContact CD2-CG 4.16Å; L145-P157 HydrophobicContact CG-CG 4.02Å; V149-P157 HydrophobicContact CB-CG 4.43Å; V149-P157 HydrophobicContact CG1-CG 4.46Å; V149-P157 HydrophobicContact CG2-CG 4.11Å; P157-Y159 HydrophobicContact CB-CE2 3.78Å; P157-V179 HydrophobicContact CB-CG2 3.66Å; P157-V179 HydrophobicContact CG-CG2 3.94Å
158E96.4Very high91.6Very high113 Ų11376.3 Ų76.353%0.52842%0.419SS..EExtended strand (participates in β ladder)trans-93.4139.9172.9-171-177.3173.600110L156 C177 R178L156-E158 PolarHBondContact O-N 3.12Å; E158-C177 CarbonylContact O-C 3.58Å; E158-C177 VanDerWaalsContact O-CA 3.31Å; E158-C177 WeakPolarHBondContact O-CA 3.41Å; E158-R178 HydrophobicContact CB-CB 4.36Å; E158-R178 PolarHBondContact N-O 2.92Å; E158-R178 PolarHBondContact O-N 3.37Å
159Y96.4Very high91.2Very high50 Ų5082.1 Ų82.120%0.19645%0.445CS..EExtended strand (participates in β ladder)trans-129.7121.4179.7-65.5-84.6000111.1V142 P157 M175 T176 C177 K195 A199V142-Y159 HydrophobicContact CG1-CE2 4.43Å; P157-Y159 HydrophobicContact CB-CE2 3.78Å; Y159-M175 HydrophobicContact CD1-CG 4.13Å; Y159-T176 WeakPolarHBondContact CA-O 3.43Å; Y159-C177 HydrophobicContact CD1-CB 3.84Å; Y159-C177 HydrophobicContact CE1-CB 3.71Å; Y159-C177 WeakPolarHBondContact CE1-SG 3.42Å; Y159-K195 HydrophobicContact CD1-CD 4.3Å; Y159-K195 HydrophobicContact CD1-CG 3.64Å; Y159-K195 HydrophobicContact CD2-CD 4.3Å; Y159-K195 HydrophobicContact CD2-CG 4.47Å; Y159-K195 HydrophobicContact CE1-CD 4.47Å; Y159-K195 HydrophobicContact CE1-CG 3.68Å; Y159-K195 HydrophobicContact CE2-CD 4.48Å; Y159-K195 HydrophobicContact CG-CD 4.18Å; Y159-K195 HydrophobicContact CG-CG 4.03Å; Y159-A199 HydrophobicContact CE1-CB 4.31Å; Y159-A199 WeakPolarHBondContact OH-CB 3.37Å
160T95.6Very high90.8Very high70 Ų7091.2 Ų91.243%0.42948%0.479SS..EExtended strand (participates in β ladder)trans-127.7130.3-178.7-54.50000110.3T162 T176T160-T162 PolarHBondContact O-N 2.95Å; T160-T176 PolarHBondContact N-O 3.47Å; T160-T176 PolarHBondContact O-N 3.4Å
161V95.9Very high90.6Very high52 Ų5291.7 Ų91.732%0.31547%0.474SS..EExtended strand (participates in β ladder)trans-74.7114.9172.9-178.60000107.4E164 M175 K191V161-E164 HydrophobicContact CG1-CG 3.93Å; V161-M175 HydrophobicContact CG2-CE 3.42Å; V161-M175 VanDerWaalsContact CG2-CE 3.42Å; V161-M175 HydrophobicContact CG2-SD 4.05Å; V161-K191 HydrophobicContact CG2-CD 4.18Å; V161-K191 HydrophobicContact CG2-CG 4.41Å
162T91.6Very high90.9Very high81 Ų8188.1 Ų88.150%0.49746%0.457SS..EExtended strand (participates in β ladder)trans-97.7-25.8-177.443.50000112.9T160 T174 T176T160-T162 PolarHBondContact O-N 2.95Å; T162-T174 PolarHBondContact N-O 3.4Å; T162-T174 PolarHBondContact OG1-O 2.99Å; T162-T176 WeakPolarHBondContact CG2-OG1 3.49Å; T162-T176 PolarHBondContact OG1-OG1 2.93Å
163Q90.8Very high91.3Very high107 Ų10784.9 Ų84.950%0.544%0.443SS..EExtended strand (participates in β ladder)trans-148.1141.5179.8-165.2-179.7-11.600111.5F173 T174Q163-F173 WeakPolarHBondContact O-CA 3.26Å; Q163-T174 PolarHBondContact N-O 3.46Å; Q163-T174 PolarHBondContact O-N 3.25Å
164E95.4Very high91.7Very high101 Ų10184 Ų8447%0.47243%0.43SS..EExtended strand (participates in β ladder)trans-125.2124.5165.2-54-163.4179.100108.2V161 E172 F173 K191V161-E164 HydrophobicContact CG1-CG 3.93Å; E164-E172 WeakPolarHBondContact CA-O 3.42Å; E164-F173 HydrophobicContact CB-CD1 4.34Å; E164-F173 HydrophobicContact CB-CE1 4.44Å; E164-F173 VanDerWaalsContact CD-CE1 3.46Å; E164-F173 HydrophobicContact CG-CD1 3.71Å; E164-F173 HydrophobicContact CG-CE1 3.92Å; E164-F173 WeakPolarHBondContact OE2-CE1 3.45Å; E164-K191 WeakPolarHBondContact OE1-CE 3.47Å; E164-K191 IonicContact OE1-NZ 3.8Å; E164-K191 PolarHBondContact OE1-NZ 3.42Å
165S90.8Very high91.9Very high41 Ų4181 Ų8129%0.28742%0.42SS..EExtended strand (participates in β ladder)trans-140.1177.3-176.769.90000111.7K171 E172S165-K171 WeakPolarHBondContact O-CA 3.37Å; S165-E172 PolarHBondContact N-O 2.88Å; S165-E172 PolarHBondContact O-N 3.32Å
166G90.4Very high92.2Very high50 Ų5075.2 Ų75.252%0.51540%0.4SS..SBendtrans83.2162.8177.300000114.4
167P87.3Confident92.3Very high65 Ų6570 Ų7042%0.42237%0.373SS..  trans-69.7159.1-179.230.6-35.4000111.2H169 R170 K171P167-H169 VanDerWaalsContact CB-CE1 3.47Å; P167-H169 WeakPolarHBondContact CB-CE1 3.2Å; P167-H169 PolarHBondContact O-N 3.06Å; P167-R170 HydrophobicContact CG-CB 4.04Å; P167-R170 CarbonylContact O-C 3.57Å; P167-R170 WeakPolarHBondContact O-CA 3.43Å; P167-R170 PolarHBondContact O-N 2.73Å; P167-K171 PolarHBondContact O-N 3.08Å; P167-K171 VanDerWaalsContact O-N 3.16Å
168A84.7Confident92.3Very high91 Ų9176 Ų7675%0.75239%0.393SS*.THydrogen-bonded Turntrans-53.7-31.1-176.300000114.2
169H81.7Confident92.2Very high170 Ų17070.7 Ų70.779%0.78737%0.368SS*.THydrogen-bonded Turntrans-86-4.2178.560.8-93.3000114.3P167P167-H169 VanDerWaalsContact CB-CE1 3.47Å; P167-H169 WeakPolarHBondContact CB-CE1 3.2Å; P167-H169 PolarHBondContact O-N 3.06Å
170R83.6Confident91.9Very high192 Ų19272.6 Ų72.673%0.72538%0.379SS*.SBendtrans-153.462178.8-169.9-178.7168.3162.3-3110P167P167-R170 HydrophobicContact CG-CB 4.04Å; P167-R170 CarbonylContact O-C 3.57Å; P167-R170 WeakPolarHBondContact O-CA 3.43Å; P167-R170 PolarHBondContact O-N 2.73Å
171K89.4Confident91.5Very high99 Ų9978.6 Ų78.643%0.4339%0.394SS..  trans-67.5146177.3-68.9-170.8173.8-117.30111.2S165 P167 F173 T189S165-K171 WeakPolarHBondContact O-CA 3.37Å; P167-K171 PolarHBondContact O-N 3.08Å; P167-K171 VanDerWaalsContact O-N 3.16Å; K171-F173 HydrophobicContact CB-CD2 4.46Å; K171-F173 HydrophobicContact CB-CE2 3.67Å; K171-F173 HydrophobicContact CB-CZ 4.04Å; K171-F173 HydrophobicContact CD-CE2 4.34Å; K171-F173 HydrophobicContact CD-CZ 3.88Å; K171-T189 WeakPolarHBondContact O-CA 3.31Å
172E93.3Very high91.4Very high94 Ų9477 Ų7744%0.43938%0.383SS..EExtended strand (participates in β ladder)trans-124.8136.9171.5-179.7166.6-152.500109.2E164 S165E164-E172 WeakPolarHBondContact CA-O 3.42Å; S165-E172 PolarHBondContact N-O 2.88Å; S165-E172 PolarHBondContact O-N 3.32Å
173F94.9Very high91.5Very high21 Ų2176.9 Ų76.99%0.09238%0.382CS..EExtended strand (participates in β ladder)trans-124.5134.3-178.7-61.1-92.7000108.7Q163 E164 K171 S187 G188 S190 K191 A194Q163-F173 WeakPolarHBondContact O-CA 3.26Å; E164-F173 HydrophobicContact CB-CD1 4.34Å; E164-F173 HydrophobicContact CB-CE1 4.44Å; E164-F173 VanDerWaalsContact CD-CE1 3.46Å; E164-F173 HydrophobicContact CG-CD1 3.71Å; E164-F173 HydrophobicContact CG-CE1 3.92Å; E164-F173 WeakPolarHBondContact OE2-CE1 3.45Å; K171-F173 HydrophobicContact CB-CD2 4.46Å; K171-F173 HydrophobicContact CB-CE2 3.67Å; K171-F173 HydrophobicContact CB-CZ 4.04Å; K171-F173 HydrophobicContact CD-CE2 4.34Å; K171-F173 HydrophobicContact CD-CZ 3.88Å; F173-S187 CarbonylContact O-C 3.09Å; F173-S187 VanDerWaalsContact O-CA 3.23Å; F173-S187 WeakPolarHBondContact O-CA 3.11Å; F173-G188 PolarHBondContact N-O 3.04Å; F173-G188 PolarHBondContact O-N 2.92Å; F173-S190 VanDerWaalsContact CD2-CA 3.45Å; F173-K191 HydrophobicContact CB-CG 4.48Å; F173-K191 HydrophobicContact CD1-CD 4.29Å; F173-K191 HydrophobicContact CD1-CG 3.5Å; F173-K191 VanDerWaalsContact CD1-CG 3.5Å; F173-K191 HydrophobicContact CE1-CD 4.28Å; F173-K191 VanDerWaalsContact CE1-CE 3.41Å; F173-K191 HydrophobicContact CE1-CG 3.79Å; F173-K191 HydrophobicContact CG-CG 3.95Å; F173-K191 HydrophobicContact CZ-CG 4.43Å; F173-A194 HydrophobicContact CB-CB 4.12Å; F173-A194 VanDerWaalsContact O-CB 3.28Å; F173-A194 WeakPolarHBondContact O-CB 3.47Å
174T94.3Very high91.8Very high20 Ų2074 Ų7412%0.12337%0.368CS..EExtended strand (participates in β ladder)trans-108.9127.6172.5-52.90000108.6T162 Q163 I185T162-T174 PolarHBondContact N-O 3.4Å; T162-T174 PolarHBondContact OG1-O 2.99Å; Q163-T174 PolarHBondContact N-O 3.46Å; Q163-T174 PolarHBondContact O-N 3.25Å; T174-I185 HydrophobicContact CG2-CG2 3.23Å
175M97.9Very high91.8Very high8 Ų873.1 Ų73.14%0.03937%0.366CS..EExtended strand (participates in β ladder)trans-118.3128.5-179.6-174.871.265.500109Y159 V161 I185 G186 A194 K195 A198Y159-M175 HydrophobicContact CD1-CG 4.13Å; V161-M175 HydrophobicContact CG2-CE 3.42Å; V161-M175 VanDerWaalsContact CG2-CE 3.42Å; V161-M175 HydrophobicContact CG2-SD 4.05Å; M175-I185 WeakPolarHBondContact O-CA 3.49Å; M175-G186 PolarHBondContact N-O 3.11Å; M175-G186 PolarHBondContact O-N 2.91Å; M175-A194 HydrophobicContact CB-CB 3.76Å; M175-K195 HydrophobicContact CE-CB 4.29Å; M175-K195 HydrophobicContact CG-CB 4.33Å; M175-A198 HydrophobicContact CB-CB 4.39Å; M175-A198 HydrophobicContact CG-CB 4.39Å
176T95.9Very high92Very high25 Ų2571.2 Ų71.215%0.15335%0.352CS..EExtended strand (participates in β ladder)trans-96.3129.3170-60.30000109Y159 T160 T162 V183 I185Y159-T176 WeakPolarHBondContact CA-O 3.43Å; T160-T176 PolarHBondContact N-O 3.47Å; T160-T176 PolarHBondContact O-N 3.4Å; T162-T176 WeakPolarHBondContact CG2-OG1 3.49Å; T162-T176 PolarHBondContact OG1-OG1 2.93Å; T176-V183 HydrophobicContact CG2-CG1 3.48Å; T176-V183 VanDerWaalsContact CG2-CG1 3.48Å; T176-I185 HydrophobicContact CG2-CG1 4.33Å
177C97.2Very high92.2Very high0 Ų071.3 Ų71.30%035%0.345CS..EExtended strand (participates in β ladder)trans-107.9128.6172.5-178.10000109E158 Y159 V183 E184 A198 M202E158-C177 CarbonylContact O-C 3.58Å; E158-C177 VanDerWaalsContact O-CA 3.31Å; E158-C177 WeakPolarHBondContact O-CA 3.41Å; Y159-C177 HydrophobicContact CD1-CB 3.84Å; Y159-C177 HydrophobicContact CE1-CB 3.71Å; Y159-C177 WeakPolarHBondContact CE1-SG 3.42Å; C177-V183 WeakPolarHBondContact O-CA 3.46Å; C177-E184 PolarHBondContact N-O 2.9Å; C177-E184 PolarHBondContact O-N 2.96Å; C177-A198 HydrophobicContact CB-CB 3.84Å; C177-M202 HydrophobicContact CB-CE 4.31Å; C177-M202 WeakPolarHBondContact O-CE 3.34Å
178R95.4Very high92.5Very high147 Ų14768.7 Ų68.756%0.55533%0.33SS*.EExtended strand (participates in β ladder)trans-118127.3176.9-176.3176.6-175.8167.23109.9E158 V183E158-R178 HydrophobicContact CB-CB 4.36Å; E158-R178 PolarHBondContact N-O 2.92Å; E158-R178 PolarHBondContact O-N 3.37Å; R178-V183 HydrophobicContact CG-CG2 4.24Å
179V94.3Very high92.9Very high1 Ų169 Ų691%0.00632%0.323CS..EExtended strand (participates in β ladder)trans-138.6112175.5177.30000107.4L145 V149 W154 P157 R181 F182 M202 I206L145-V179 HydrophobicContact CD1-CG2 4.44Å; L145-V179 HydrophobicContact CD2-CG2 4.24Å; V149-V179 HydrophobicContact CG1-CG1 4.47Å; V149-V179 HydrophobicContact CG2-CG1 3.5Å; V149-V179 VanDerWaalsContact CG2-CG1 3.5Å; V149-V179 HydrophobicContact CG2-CG2 4.22Å; W154-V179 HydrophobicContact CE3-CG1 3.78Å; W154-V179 HydrophobicContact CZ3-CG1 4.27Å; P157-V179 HydrophobicContact CB-CG2 3.66Å; P157-V179 HydrophobicContact CG-CG2 3.94Å; V179-R181 PolarHBondContact O-N 3.5Å; V179-F182 PolarHBondContact N-O 2.98Å; V179-F182 WeakPolarHBondContact O-CA 3.44Å; V179-F182 WeakPolarHBondContact O-CB 3.13Å; V179-F182 PolarHBondContact O-N 3.31Å; V179-M202 HydrophobicContact CB-CE 4.15Å; V179-M202 HydrophobicContact CB-CG 4.33Å; V179-M202 HydrophobicContact CB-SD 4.1Å; V179-M202 HydrophobicContact CG2-CE 4.16Å; V179-M202 HydrophobicContact CG2-CG 3.93Å; V179-M202 HydrophobicContact CG2-SD 4.29Å; V179-I206 HydrophobicContact CB-CD1 4.41Å; V179-I206 HydrophobicContact CG1-CD1 4.05Å
180E89.2Confident93.4Very high90 Ų9063.1 Ų63.142%0.42130%0.3SS..THydrogen-bonded Turntrans54.8-122.4-177-158.959.3-150.700111.2
181R88.6Confident93.9Very high196 Ų19658.6 Ų58.674%0.7429%0.286SS*.THydrogen-bonded Turntrans-84.5-7.8173.665.1179.4170.7-126.42.1114.2V179V179-R181 PolarHBondContact O-N 3.5Å
182F93.3Very high94.1Very high19 Ų1961.1 Ų61.18%0.08330%0.297CS..EExtended strand (participates in β ladder)trans-90.6135.1-177.6-56.1-72.8000110.2W154 V179 M202 R205 I206 V209W154-F182 HydrophobicContact CH2-CE2 4.14Å; V179-F182 PolarHBondContact N-O 2.98Å; V179-F182 WeakPolarHBondContact O-CA 3.44Å; V179-F182 WeakPolarHBondContact O-CB 3.13Å; V179-F182 PolarHBondContact O-N 3.31Å; F182-M202 HydrophobicContact CB-CE 3.99Å; F182-M202 HydrophobicContact CB-SD 3.51Å; F182-M202 VanDerWaalsContact CB-SD 3.51Å; F182-M202 WeakPolarHBondContact O-CE 3.47Å; F182-R205 HydrophobicContact CD1-CG 3.96Å; F182-I206 HydrophobicContact CD2-CG1 4.06Å; F182-I206 HydrophobicContact CE2-CG1 4.41Å; F182-V209 HydrophobicContact CE1-CG2 3.95Å; F182-V209 HydrophobicContact CZ-CG2 4.08Å
183V93.8Very high94.1Very high78 Ų7859.1 Ų59.147%0.47329%0.289SS..EExtended strand (participates in β ladder)trans-129.7126.7174.2-177.40000107.2T176 C177 R178T176-V183 HydrophobicContact CG2-CG1 3.48Å; T176-V183 VanDerWaalsContact CG2-CG1 3.48Å; C177-V183 WeakPolarHBondContact O-CA 3.46Å; R178-V183 HydrophobicContact CG-CG2 4.24Å
184E96.6Very high94.1Very high46 Ų4658.1 Ų58.122%0.21529%0.285CS..EExtended strand (participates in β ladder)trans-133.7147.8178.2-75.7-64.3162.700110.6C177 K201 M202 R205C177-E184 PolarHBondContact N-O 2.9Å; C177-E184 PolarHBondContact O-N 2.96Å; E184-K201 HydrophobicContact CB-CB 4.21Å; E184-K201 HydrophobicContact CG-CB 4.37Å; E184-M202 HydrophobicContact CB-CB 4.16Å; E184-M202 HydrophobicContact CB-CE 3.84Å; E184-M202 HydrophobicContact CB-SD 4.42Å; E184-M202 HydrophobicContact CG-CB 4.27Å; E184-M202 HydrophobicContact CG-CE 3.99Å; E184-M202 HydrophobicContact CG-SD 4.04Å; E184-R205 HydrophobicContact CG-CB 4.09Å; E184-R205 HydrophobicContact CG-CG 4.37Å; E184-R205 WeakPolarHBondContact OE1-CG 3.26Å
185I94.8Very high94.2Very high83 Ų8361 Ų6143%0.42630%0.295SS..EExtended strand (participates in β ladder)trans-121.5124.4-173.1-56.8176.8000110.1T174 M175 T176 K201T174-I185 HydrophobicContact CG2-CG2 3.23Å; M175-I185 WeakPolarHBondContact O-CA 3.49Å; T176-I185 HydrophobicContact CG2-CG1 4.33Å; I185-K201 WeakPolarHBondContact O-CD 3.5Å; I185-K201 WeakPolarHBondContact O-CE 3Å; I185-K201 PolarHBondContact O-NZ 2.85Å
186G95.7Very high94.2Very high0 Ų065.1 Ų65.10%031%0.311CS..EExtended strand (participates in β ladder)trans-117.6133.9175.100000111.9M175M175-G186 PolarHBondContact N-O 3.11Å; M175-G186 PolarHBondContact O-N 2.91Å
187S94.3Very high94.1Very high52 Ų5266.8 Ų66.836%0.36432%0.319SS..EExtended strand (participates in β ladder)trans-102.8158.4172.159.40000111.5F173 N197F173-S187 CarbonylContact O-C 3.09Å; F173-S187 VanDerWaalsContact O-CA 3.23Å; F173-S187 WeakPolarHBondContact O-CA 3.11Å; S187-N197 PolarHBondContact O-ND2 3.27Å
188G94.3Very high94.1Very high10 Ų1066.8 Ų66.810%0.10332%0.319CS..EExtended strand (participates in β ladder)trans-175.7164.8173.400000113.3F173 S190F173-G188 PolarHBondContact N-O 3.04Å; F173-G188 PolarHBondContact O-N 2.92Å; G188-S190 PolarHBondContact O-N 2.74Å; G188-S190 VanDerWaalsContact O-N 3.1Å
189T91.9Very high94.2Very high99 Ų9959.8 Ų59.861%0.60729%0.292SS*.SBendtrans-71.8-1.1179.756.20000114.4K171K171-T189 WeakPolarHBondContact O-CA 3.31Å
190S93.4Very high94.3Very high45 Ų4561.6 Ų61.632%0.31531%0.307SS..SBendtrans-149.3155173.4650000110.1F173 G188 K192 L193 A194F173-S190 VanDerWaalsContact CD2-CA 3.45Å; G188-S190 PolarHBondContact O-N 2.74Å; G188-S190 VanDerWaalsContact O-N 3.1Å; S190-K192 PolarHBondContact O-N 2.93Å; S190-L193 PolarHBondContact O-N 3.39Å; S190-L193 WeakPolarHBondContact OG-CB 3.49Å; S190-L193 PolarHBondContact OG-N 2.86Å; S190-L193 VanDerWaalsContact OG-N 3.13Å; S190-A194 WeakPolarHBondContact O-CB 2.95Å; S190-A194 PolarHBondContact O-N 3.07Å
191K93.3Very high94.5Very high98 Ų9862.3 Ų62.343%0.42631%0.309SS..Hα-helixtrans-54.1-37.2173.9-61.2-174.8-177.9-165.60112.5V161 E164 F173 K195V161-K191 HydrophobicContact CG2-CD 4.18Å; V161-K191 HydrophobicContact CG2-CG 4.41Å; E164-K191 WeakPolarHBondContact OE1-CE 3.47Å; E164-K191 IonicContact OE1-NZ 3.8Å; E164-K191 PolarHBondContact OE1-NZ 3.42Å; F173-K191 HydrophobicContact CB-CG 4.48Å; F173-K191 HydrophobicContact CD1-CD 4.29Å; F173-K191 HydrophobicContact CD1-CG 3.5Å; F173-K191 VanDerWaalsContact CD1-CG 3.5Å; F173-K191 HydrophobicContact CE1-CD 4.28Å; F173-K191 VanDerWaalsContact CE1-CE 3.41Å; F173-K191 HydrophobicContact CE1-CG 3.79Å; F173-K191 HydrophobicContact CG-CG 3.95Å; F173-K191 HydrophobicContact CZ-CG 4.43Å; K191-K195 VanDerWaalsContact O-CB 3.31Å; K191-K195 WeakPolarHBondContact O-CB 3.46Å; K191-K195 PolarHBondContact O-N 3.41Å
192K93.8Very high94.9Very high152 Ų15253 Ų5366%0.66127%0.274SS*.Hα-helixtrans-66.6-42.7177.2-173.2176-177.6176.20112S190 R196S190-K192 PolarHBondContact O-N 2.93Å; K192-R196 WeakPolarHBondContact O-CB 3.32Å; K192-R196 PolarHBondContact O-N 2.98Å
193L92.6Very high94.9Very high52 Ų5253.9 Ų53.927%0.27228%0.279SS..Hα-helixtrans-70.9-42.8178.2-175.860.7000111.6S190 K195 R196 N197S190-L193 PolarHBondContact O-N 3.39Å; S190-L193 WeakPolarHBondContact OG-CB 3.49Å; S190-L193 PolarHBondContact OG-N 2.86Å; S190-L193 VanDerWaalsContact OG-N 3.13Å; L193-K195 VanDerWaalsContact C-N 3.33Å; L193-K195 PolarHBondContact O-N 3.01Å; L193-R196 WeakPolarHBondContact O-CB 3.31Å; L193-R196 PolarHBondContact O-N 3.08Å; L193-N197 WeakPolarHBondContact O-CB 3.31Å; L193-N197 PolarHBondContact O-N 3.29Å
194A96.2Very high94.7Very high0 Ų053.4 Ų53.40%028%0.279CS..Hα-helixtrans-57.9-45.6174.900000111.4F173 M175 S190 R196 N197 A198F173-A194 HydrophobicContact CB-CB 4.12Å; F173-A194 VanDerWaalsContact O-CB 3.28Å; F173-A194 WeakPolarHBondContact O-CB 3.47Å; M175-A194 HydrophobicContact CB-CB 3.76Å; S190-A194 WeakPolarHBondContact O-CB 2.95Å; S190-A194 PolarHBondContact O-N 3.07Å; A194-R196 PolarHBondContact O-N 3.09Å; A194-N197 PolarHBondContact O-N 2.88Å; A194-A198 WeakPolarHBondContact O-CB 3.26Å; A194-A198 PolarHBondContact O-N 3.48Å
195K96.7Very high94.4Very high79 Ų7957.7 Ų57.734%0.34329%0.293SS..Hα-helixtrans-57.5-47.8172.9-175.4176.9-66.7-1660112.7V142 Y159 M175 K191 L193 N197 A198 A199V142-K195 HydrophobicContact CG1-CD 4.43Å; V142-K195 HydrophobicContact CG2-CG 4.15Å; Y159-K195 HydrophobicContact CD1-CD 4.3Å; Y159-K195 HydrophobicContact CD1-CG 3.64Å; Y159-K195 HydrophobicContact CD2-CD 4.3Å; Y159-K195 HydrophobicContact CD2-CG 4.47Å; Y159-K195 HydrophobicContact CE1-CD 4.47Å; Y159-K195 HydrophobicContact CE1-CG 3.68Å; Y159-K195 HydrophobicContact CE2-CD 4.48Å; Y159-K195 HydrophobicContact CG-CD 4.18Å; Y159-K195 HydrophobicContact CG-CG 4.03Å; M175-K195 HydrophobicContact CE-CB 4.29Å; M175-K195 HydrophobicContact CG-CB 4.33Å; K191-K195 VanDerWaalsContact O-CB 3.31Å; K191-K195 WeakPolarHBondContact O-CB 3.46Å; K191-K195 PolarHBondContact O-N 3.41Å; L193-K195 VanDerWaalsContact C-N 3.33Å; L193-K195 PolarHBondContact O-N 3.01Å; K195-N197 VanDerWaalsContact C-N 3.33Å; K195-N197 PolarHBondContact O-N 3.45Å; K195-A198 PolarHBondContact O-N 3.22Å; K195-A199 WeakPolarHBondContact O-CB 3.37Å; K195-A199 PolarHBondContact O-N 3.31Å
196R96.4Very high94Very high96 Ų9654.1 Ų54.136%0.36228%0.275SS..Hα-helixtrans-59.4-45.2177.9-172.3-174.9-69.2131.4-9.3111.6P141 V142 K192 L193 A194 A199 A200P141-R196 HydrophobicContact CG-CB 4.36Å; P141-R196 HydrophobicContact CG-CG 3.26Å; P141-R196 VanDerWaalsContact CG-O 3.26Å; P141-R196 WeakPolarHBondContact CG-O 3.41Å; V142-R196 HydrophobicContact CG2-CB 4.42Å; K192-R196 WeakPolarHBondContact O-CB 3.32Å; K192-R196 PolarHBondContact O-N 2.98Å; L193-R196 WeakPolarHBondContact O-CB 3.31Å; L193-R196 PolarHBondContact O-N 3.08Å; A194-R196 PolarHBondContact O-N 3.09Å; R196-A199 PolarHBondContact O-N 2.95Å; R196-A200 PolarHBondContact O-N 2.87Å
197N95.3Very high93.3Very high60 Ų6061.6 Ų61.632%0.32131%0.31SS..Hα-helixtrans-67.9-38.3-179.6-71.2-8.9000111.9S187 L193 A194 K195 A200 K201S187-N197 PolarHBondContact O-ND2 3.27Å; L193-N197 WeakPolarHBondContact O-CB 3.31Å; L193-N197 PolarHBondContact O-N 3.29Å; A194-N197 PolarHBondContact O-N 2.88Å; K195-N197 VanDerWaalsContact C-N 3.33Å; K195-N197 PolarHBondContact O-N 3.45Å; N197-A200 PolarHBondContact O-N 3.2Å; N197-K201 PolarHBondContact O-N 3.19Å; N197-K201 VanDerWaalsContact O-N 3.12Å
198A97.4Very high91.9Very high0 Ų065.1 Ų65.10%033%0.325CS..Hα-helixtrans-63.3-45175.300000110.8M175 C177 A194 K195 A200 K201 M202M175-A198 HydrophobicContact CB-CB 4.39Å; M175-A198 HydrophobicContact CG-CB 4.39Å; C177-A198 HydrophobicContact CB-CB 3.84Å; A194-A198 WeakPolarHBondContact O-CB 3.26Å; A194-A198 PolarHBondContact O-N 3.48Å; K195-A198 PolarHBondContact O-N 3.22Å; A198-A200 PolarHBondContact O-N 2.83Å; A198-K201 PolarHBondContact O-N 3.35Å; A198-M202 WeakPolarHBondContact O-CB 3.5Å; A198-M202 PolarHBondContact O-N 2.93Å
199A96.8Very high90.1Very high0 Ų067.2 Ų67.20%034%0.335CS..Hα-helixtrans-63.3-39.5176.900000112.8P141 V142 L145 Y159 K195 R196 M202 L203P141-A199 HydrophobicContact CB-CB 4.26Å; P141-A199 HydrophobicContact CG-CB 4.49Å; V142-A199 HydrophobicContact CB-CB 4.35Å; V142-A199 HydrophobicContact CG2-CB 3.86Å; L145-A199 HydrophobicContact CB-CB 4.46Å; L145-A199 HydrophobicContact CD2-CB 3.95Å; Y159-A199 HydrophobicContact CE1-CB 4.31Å; Y159-A199 WeakPolarHBondContact OH-CB 3.37Å; K195-A199 WeakPolarHBondContact O-CB 3.37Å; K195-A199 PolarHBondContact O-N 3.31Å; R196-A199 PolarHBondContact O-N 2.95Å; A199-M202 PolarHBondContact O-N 3.07Å; A199-L203 WeakPolarHBondContact O-CG 3.17Å; A199-L203 PolarHBondContact O-N 3.34Å
200A95.1Very high87.8Confident39 Ų3967.4 Ų67.432%0.32234%0.338SS..Hα-helixtrans-62.8-45.1177.300000111.9P141 R196 N197 A198 M202 L203 S204P141-A200 HydrophobicContact CB-CB 3.86Å; P141-A200 HydrophobicContact CG-CB 4.11Å; R196-A200 PolarHBondContact O-N 2.87Å; N197-A200 PolarHBondContact O-N 3.2Å; A198-A200 PolarHBondContact O-N 2.83Å; A200-M202 VanDerWaalsContact C-N 3.34Å; A200-M202 PolarHBondContact O-N 2.82Å; A200-L203 PolarHBondContact O-N 2.85Å; A200-S204 PolarHBondContact O-N 3.08Å; A200-S204 PolarHBondContact O-OG 3.46Å
201K95.2Very high85.9Confident105 Ų10571.2 Ų71.246%0.45736%0.36SS..Hα-helixtrans-62.1-42.4174.5-71.2-178.9179.9-174.40111.9E184 I185 N197 A198 L203 S204 R205E184-K201 HydrophobicContact CB-CB 4.21Å; E184-K201 HydrophobicContact CG-CB 4.37Å; I185-K201 WeakPolarHBondContact O-CD 3.5Å; I185-K201 WeakPolarHBondContact O-CE 3Å; I185-K201 PolarHBondContact O-NZ 2.85Å; N197-K201 PolarHBondContact O-N 3.19Å; N197-K201 VanDerWaalsContact O-N 3.12Å; A198-K201 PolarHBondContact O-N 3.35Å; K201-L203 PolarHBondContact O-N 2.96Å; K201-S204 PolarHBondContact O-N 3.06Å; K201-R205 WeakPolarHBondContact O-CB 3.28Å; K201-R205 PolarHBondContact O-N 3.01Å
202M95.9Very high83.4Confident0 Ų073.3 Ų73.30%038%0.375CS..Hα-helixtrans-60.8-42.7177-174.761.480.200112.6L145 C177 V179 F182 E184 A198 A199 A200 S204 R205 I206L145-M202 HydrophobicContact CD1-CB 4.28Å; L145-M202 HydrophobicContact CD1-CG 3.69Å; L145-M202 HydrophobicContact CD2-CB 3.83Å; L145-M202 HydrophobicContact CD2-CG 3.69Å; L145-M202 HydrophobicContact CG-CG 4.36Å; C177-M202 HydrophobicContact CB-CE 4.31Å; C177-M202 WeakPolarHBondContact O-CE 3.34Å; V179-M202 HydrophobicContact CB-CE 4.15Å; V179-M202 HydrophobicContact CB-CG 4.33Å; V179-M202 HydrophobicContact CB-SD 4.1Å; V179-M202 HydrophobicContact CG2-CE 4.16Å; V179-M202 HydrophobicContact CG2-CG 3.93Å; V179-M202 HydrophobicContact CG2-SD 4.29Å; F182-M202 HydrophobicContact CB-CE 3.99Å; F182-M202 HydrophobicContact CB-SD 3.51Å; F182-M202 VanDerWaalsContact CB-SD 3.51Å; F182-M202 WeakPolarHBondContact O-CE 3.47Å; E184-M202 HydrophobicContact CB-CB 4.16Å; E184-M202 HydrophobicContact CB-CE 3.84Å; E184-M202 HydrophobicContact CB-SD 4.42Å; E184-M202 HydrophobicContact CG-CB 4.27Å; E184-M202 HydrophobicContact CG-CE 3.99Å; E184-M202 HydrophobicContact CG-SD 4.04Å; A198-M202 WeakPolarHBondContact O-CB 3.5Å; A198-M202 PolarHBondContact O-N 2.93Å; A199-M202 PolarHBondContact O-N 3.07Å; A200-M202 VanDerWaalsContact C-N 3.34Å; A200-M202 PolarHBondContact O-N 2.82Å; M202-S204 PolarHBondContact O-N 2.76Å; M202-R205 PolarHBondContact O-N 3.35Å; M202-I206 HydrophobicContact CG-CD1 3.64Å; M202-I206 HydrophobicContact CG-CG1 4.35Å; M202-I206 WeakPolarHBondContact O-CB 3.47Å; M202-I206 VanDerWaalsContact O-CG1 3.31Å; M202-I206 WeakPolarHBondContact O-CG1 3.47Å; M202-I206 PolarHBondContact O-N 3.02Å; M202-I206 HydrophobicContact SD-CD1 3.88Å; M202-I206 HydrophobicContact SD-CG1 4.1Å
203L94Very high80.6Confident38 Ų3873.9 Ų73.920%0.19939%0.385CS..Hα-helixtrans-58.4-47.3174.2-80.2170.7000111.9P141 A144 L145 L148 A199 A200 K201 R205 I206 H207P141-L203 HydrophobicContact CB-CD1 3.79Å; P141-L203 WeakPolarHBondContact O-CD1 3.34Å; A144-L203 HydrophobicContact CB-CD1 3.94Å; L145-L203 HydrophobicContact CB-CD1 4.34Å; L145-L203 HydrophobicContact CB-CD2 3.98Å; L145-L203 HydrophobicContact CB-CG 3.92Å; L145-L203 HydrophobicContact CD1-CD2 3.95Å; L145-L203 HydrophobicContact CD1-CG 4.14Å; L148-L203 HydrophobicContact CB-CD2 4.4Å; L148-L203 HydrophobicContact CD2-CD2 3.67Å; A199-L203 WeakPolarHBondContact O-CG 3.17Å; A199-L203 PolarHBondContact O-N 3.34Å; A200-L203 PolarHBondContact O-N 2.85Å; K201-L203 PolarHBondContact O-N 2.96Å; L203-R205 VanDerWaalsContact C-N 3.31Å; L203-R205 PolarHBondContact O-N 2.87Å; L203-I206 PolarHBondContact O-N 3.39Å; L203-H207 VanDerWaalsContact O-CB 3.32Å; L203-H207 WeakPolarHBondContact O-CB 3.47Å; L203-H207 PolarHBondContact O-N 2.91Å
204S90.1Very high78.4Confident68 Ų6881.5 Ų81.548%0.47641%0.41SS..Hα-helixtrans-61.8-39.8175.7-57.70000111.9A200 K201 M202 N208A200-S204 PolarHBondContact O-N 3.08Å; A200-S204 PolarHBondContact O-OG 3.46Å; K201-S204 PolarHBondContact O-N 3.06Å; M202-S204 PolarHBondContact O-N 2.76Å; S204-N208 VanDerWaalsContact O-CB 3.26Å; S204-N208 WeakPolarHBondContact O-CB 3.45Å; S204-N208 VanDerWaalsContact O-CG 3.3Å; S204-N208 PolarHBondContact O-N 3.18Å; S204-N208 PolarHBondContact O-ND2 3.3Å; S204-N208 VanDerWaalsContact O-ND2 3.09Å
205R88.8Confident75.7Confident135 Ų13586.5 Ų86.551%0.50945%0.445SS..Hα-helixtrans-64.8-45.2178.3-173.664.8174.7167.6-0.5111.9F182 E184 K201 M202 L203 V209F182-R205 HydrophobicContact CD1-CG 3.96Å; E184-R205 HydrophobicContact CG-CB 4.09Å; E184-R205 HydrophobicContact CG-CG 4.37Å; E184-R205 WeakPolarHBondContact OE1-CG 3.26Å; K201-R205 WeakPolarHBondContact O-CB 3.28Å; K201-R205 PolarHBondContact O-N 3.01Å; M202-R205 PolarHBondContact O-N 3.35Å; L203-R205 VanDerWaalsContact C-N 3.31Å; L203-R205 PolarHBondContact O-N 2.87Å; R205-V209 WeakPolarHBondContact O-CG2 3.39Å
206I87.4Confident73.1Confident8 Ų887.8 Ų87.84%0.04146%0.464CS..Hα-helixtrans-69.4-35.3-179.8-67.4163.8000111.4L145 L148 K152 W154 V179 F182 M202 L203L145-I206 HydrophobicContact CD1-CD1 3.58Å; L148-I206 HydrophobicContact CD2-CB 4.3Å; L148-I206 HydrophobicContact CD2-CG2 3.73Å; K152-I206 HydrophobicContact CD-CG2 4.39Å; W154-I206 HydrophobicContact CH2-CG2 3.81Å; W154-I206 HydrophobicContact CZ3-CD1 3.95Å; W154-I206 HydrophobicContact CZ3-CG1 4.05Å; W154-I206 HydrophobicContact CZ3-CG2 3.62Å; V179-I206 HydrophobicContact CB-CD1 4.41Å; V179-I206 HydrophobicContact CG1-CD1 4.05Å; F182-I206 HydrophobicContact CD2-CG1 4.06Å; F182-I206 HydrophobicContact CE2-CG1 4.41Å; M202-I206 HydrophobicContact CG-CD1 3.64Å; M202-I206 HydrophobicContact CG-CG1 4.35Å; M202-I206 WeakPolarHBondContact O-CB 3.47Å; M202-I206 VanDerWaalsContact O-CG1 3.31Å; M202-I206 WeakPolarHBondContact O-CG1 3.47Å; M202-I206 PolarHBondContact O-N 3.02Å; M202-I206 HydrophobicContact SD-CD1 3.88Å; M202-I206 HydrophobicContact SD-CG1 4.1Å; L203-I206 PolarHBondContact O-N 3.39Å
207H79.6Confident70.1Confident157 Ų15790.9 Ų90.973%0.72749%0.487SS*.Hα-helixtrans-77.9-30-179.6-163.6-72.5000113.2L203 V209L203-H207 VanDerWaalsContact O-CB 3.32Å; L203-H207 WeakPolarHBondContact O-CB 3.47Å; L203-H207 PolarHBondContact O-N 2.91Å; H207-V209 VanDerWaalsContact C-N 3.3Å; H207-V209 PolarHBondContact O-N 3.41Å
208N65.7Low67.4Low126 Ų12695.8 Ų95.867%0.67451%0.513SS*.THydrogen-bonded Turntrans-84.54.9179.4-75.2-34.7000114.3S204 P210S204-N208 VanDerWaalsContact O-CB 3.26Å; S204-N208 WeakPolarHBondContact O-CB 3.45Å; S204-N208 VanDerWaalsContact O-CG 3.3Å; S204-N208 PolarHBondContact O-N 3.18Å; S204-N208 PolarHBondContact O-ND2 3.3Å; S204-N208 VanDerWaalsContact O-ND2 3.09Å; N208-P210 VanDerWaalsContact O-CD 3.31Å; N208-P210 WeakPolarHBondContact O-CD 3.23Å
209V56.7Low64.5Low54 Ų54100.5 Ų100.533%0.32755%0.553SS.*SBendtrans-94.9105.7171.1176.20000107.5F182 R205 H207 V211F182-V209 HydrophobicContact CE1-CG2 3.95Å; F182-V209 HydrophobicContact CZ-CG2 4.08Å; R205-V209 WeakPolarHBondContact O-CG2 3.39Å; H207-V209 VanDerWaalsContact C-N 3.3Å; H207-V209 PolarHBondContact O-N 3.41Å; V209-V211 PolarHBondContact O-N 2.98Å
210P43.6Very low61.9Low103 Ų103109 Ų10967%0.66959%0.593SS**  trans-59.4132.3171.2-15.229.7000108.2N208 D212N208-P210 VanDerWaalsContact O-CD 3.31Å; N208-P210 WeakPolarHBondContact O-CD 3.23Å; P210-D212 PolarHBondContact O-N 3.38Å
211V52.7Low59.1Low126 Ų126113.2 Ų113.276%0.76461%0.614SS**SBendtrans-71.578.1164.5-179.30000106.1V209V209-V211 PolarHBondContact O-N 2.98Å
212D41.5Very low56.4Low141 Ų141116.8 Ų116.875%0.75463%0.632SS**  trans161.897.7156.1-84.7-24.9000108.6P210P210-D212 PolarHBondContact O-N 3.38Å
213L34.7Very low53.6Low165 Ų165125.4 Ų125.486%0.86467%0.673SS**  trans-172.394.8146-98.6161000107.8S215L213-S215 PolarHBondContact O-N 3.42Å
214R46.3Very low50.8Low212 Ų212131.8 Ų131.880%0.871%0.707SS**  trans-60.2112.4146-64.6176.5126.7168.93.2106.7
215S39.5Very low48.2Very low104 Ų104133.1 Ų133.173%0.72771%0.713SS**  trans165.5124.2141.2-77.30000110.7L213L213-S215 PolarHBondContact O-N 3.42Å
216S42.6Very low45.2Very low106 Ų106137 Ų13774%0.74173%0.733SS**  trans35.1108137.8-48.30000118.9
217N32.8Very low42.5Very low161 Ų161141.8 Ų141.886%0.86176%0.759SS**  178.6111.7107.5-100.56.7000109.2
218D39.7Very low40.3Very low163 Ų163142.3 Ų142.387%0.87277%0.766SS**  trans-71.2125.3164.7-69.4-54.9000108.5
219A36.7Very low38.9Very low100 Ų100143.5 Ų143.583%0.82677%0.767SS**  trans-93.4115.7156.800000106.4
220E42.3Very low37.8Very low179 Ų179150.4 Ų150.484%0.83680%0.798SS**  trans-60.5143-178.9-55.6176.414100111.4
221T34.7Very low37.2Very low126 Ų126149 Ų14977%0.77380%0.802SS**  trans-162.9103137.43.30000110.4
222E39.3Very low36.3Very low180 Ų180149.1 Ų149.184%0.84181%0.809SS**  trans52.592133.4-55-176.3-162.600116.4
223E36.7Very low35.7Very low182 Ų182154.1 Ų154.185%0.8582%0.817SS**  43.7102.992.4-68.4-144.4137.400114.8
224D35.4Very low35.7Very low171 Ų171150.7 Ų150.791%0.91481%0.812SS**  trans-130.6123.8143.1-122.4-16.4000109.5
225T35.8Very low34.9Very low97 Ų97149.3 Ų149.360%0.59582%0.815SS**  trans-78.3138.5-159.8-49.10000113N227T225-N227 HydrophobicContact CG2-CB 4.44Å
226F26.9Very low34.4Very low215 Ų215149.6 Ų149.694%0.94382%0.817SS**  trans-145.894.8144.6-102.3-81.3000109.5
227N30Very low34Very low110 Ų110147.9 Ų147.959%0.58882%0.816SS**  trans-106.5119.1178.7-147.734.4000109.2T225 H229T225-N227 HydrophobicContact CG2-CB 4.44Å; N227-H229 PolarHBondContact ND2-CE1 3.47Å; N227-H229 PolarHBondContact ND2-ND1 3.41Å
228I34.1Very low34Very low168 Ų168149.4 Ų149.486%0.86282%0.815SS**  trans-96.5115163.2-69.7-166.3000107.9
229H35.4Very low33.9Very low151 Ų151147.8 Ų147.870%0.69982%0.816SS**  trans-89.5132.1176.8-77.584.3000111.8N227N227-H229 PolarHBondContact ND2-CE1 3.47Å; N227-H229 PolarHBondContact ND2-ND1 3.41Å
230M33.7Very low34.1Very low199 Ų199149.1 Ų149.198%0.9880%0.804SS**  trans-169.9124.8147.1-124.5-178.7-168.200106
231G30.8Very low34.3Very low73 Ų73144.9 Ų144.975%0.75381%0.808SS**  cis173.8124.1-4.600000106.6
232S33.1Very low35.2Very low129 Ų129142 Ų14290%0.90278%0.783SS**  trans60.7114.1161.5-106.10000120.4
233R29.8Very low36.4Very low246 Ų246136.9 Ų136.993%0.92877%0.767SS**  -177.3133.585.1-147.4162.2122.3176.5-1.1109.7
234A34.3Very low38.5Very low93 Ų93128.3 Ų128.377%0.76973%0.727SS**  trans-66142.5-17500000113.4
235E28.6Very low40.9Very low182 Ų182120.9 Ų120.985%0.8569%0.688SS**  trans-174128130.9-89-99119.400110
236S29.9Very low43.2Very low111 Ų111117.4 Ų117.478%0.77666%0.664SS**  trans46.295.8155-73.40000121.3
237G34.8Very low45.7Very low69 Ų69109.5 Ų109.571%0.71163%0.632SS**  52.1105.9118.300000120.1
238K32.1Very low48.4Very low193 Ų193106.9 Ų106.984%0.83962%0.622SS**  165.181.4129.4-87.9159.9-169.4174.50109.3K240K238-K240 PolarHBondContact O-N 2.8Å; K238-K240 VanDerWaalsContact O-N 3.08Å
239S36.8Very low50.9Low129 Ų12998.9 Ų98.990%0.90258%0.581SS**  trans-75.789.8163.3520000109
240K41.7Very low53.3Low129 Ų12996 Ų9656%0.56156%0.564SS**  trans-108.7122.7165-84.6-172.3177.6-179.80107.8K238 Y242K238-K240 PolarHBondContact O-N 2.8Å; K238-K240 VanDerWaalsContact O-N 3.08Å; K240-Y242 HydrophobicContact CB-CD2 3.59Å; K240-Y242 HydrophobicContact CB-CE1 4.29Å; K240-Y242 HydrophobicContact CB-CE2 3.28Å; K240-Y242 HydrophobicContact CB-CG 4.24Å; K240-Y242 HydrophobicContact CD-CE1 4.34Å; K240-Y242 HydrophobicContact CD-CE2 3.71Å; K240-Y242 VanDerWaalsContact CD-CZ 3.46Å; K240-Y242 WeakPolarHBondContact CD-OH 3.1Å; K240-Y242 HydrophobicContact CG-CE2 4.12Å; K240-Y242 WeakPolarHBondContact O-CD2 3.45Å; K240-Y242 PolarHBondContact O-N 2.81Å
241G47.3Very low55.6Low90 Ų9092.3 Ų92.393%0.92855%0.548SS*.  trans-64.179.717700000112.2
242Y53.6Low58.2Low66 Ų6690 Ų9026%0.25952%0.521SS..  trans-101.981.8176.8-70.2-48000108.7K240 R285K240-Y242 HydrophobicContact CB-CD2 3.59Å; K240-Y242 HydrophobicContact CB-CE1 4.29Å; K240-Y242 HydrophobicContact CB-CE2 3.28Å; K240-Y242 HydrophobicContact CB-CG 4.24Å; K240-Y242 HydrophobicContact CD-CE1 4.34Å; K240-Y242 HydrophobicContact CD-CE2 3.71Å; K240-Y242 VanDerWaalsContact CD-CZ 3.46Å; K240-Y242 WeakPolarHBondContact CD-OH 3.1Å; K240-Y242 HydrophobicContact CG-CE2 4.12Å; K240-Y242 WeakPolarHBondContact O-CD2 3.45Å; K240-Y242 PolarHBondContact O-N 2.81Å; Y242-R285 WeakPolarHBondContact CB-O 3.48Å; Y242-R285 HydrophobicContact CD1-CB 3.75Å; Y242-R285 HydrophobicContact CD1-CG 4.34Å; Y242-R285 HydrophobicContact CE1-CB 4.26Å; Y242-R285 HydrophobicContact CE1-CG 4.39Å; Y242-R285 HydrophobicContact CG-CB 4.38Å; Y242-R285 PolarHBondContact OH-NH1 3Å
243S63.1Low60.7Low72 Ų7288.1 Ų88.150%0.50351%0.513SS..  trans-93.898.5170.1880000109.6T245S243-T245 PolarHBondContact O-N 3.32Å
244C81.2Confident63.4Low2 Ų277.1 Ų77.11%0.01448%0.476CS..EExtended strand (participates in β ladder)trans-78.3107.9168.4-173.10000108.3L249 Q284 F286 T310 Q311C244-L249 VanDerWaalsContact SG-CG 3.56Å; C244-Q284 PolarHBondContact SG-O 3.47Å; C244-F286 HydrophobicContact CB-CB 3.65Å; C244-F286 HydrophobicContact CB-CD1 3.81Å; C244-F286 HydrophobicContact CB-CG 4.16Å; C244-T310 HydrophobicContact CB-CG2 4.29Å; C244-T310 CarbonylContact O-C 3.58Å; C244-T310 WeakPolarHBondContact O-CA 3.44Å; C244-T310 WeakPolarHBondContact O-CB 3.46Å; C244-Q311 PolarHBondContact O-N 3.45Å
245T86.4Confident66Low15 Ų1578.9 Ų78.99%0.09247%0.469CS..EExtended strand (participates in β ladder)trans-90.8160.8177.873.90000111.1S243 D247 S248 L249 Q311S243-T245 PolarHBondContact O-N 3.32Å; T245-D247 PolarHBondContact O-N 3.33Å; T245-D247 PolarHBondContact OG1-N 3.09Å; T245-S248 VanDerWaalsContact O-CB 3.3Å; T245-S248 WeakPolarHBondContact O-CB 3.49Å; T245-S248 PolarHBondContact O-N 3.28Å; T245-S248 VanDerWaalsContact O-N 3.07Å; T245-S248 PolarHBondContact OG1-N 2.83Å; T245-S248 VanDerWaalsContact OG1-N 3.11Å; T245-S248 PolarHBondContact OG1-OG 3.18Å; T245-L249 PolarHBondContact O-N 2.81Å; T245-L249 VanDerWaalsContact O-N 3.08Å; T245-Q311 HydrophobicContact CG2-CB 4.3Å
246W84.1Confident68.9Low23 Ų2373.1 Ų73.19%0.08744%0.441CS..Hα-helixtrans-56.6-35172.9-63.2121.8000113.7L249 R250 Y337 L338 M341W246-L249 HydrophobicContact CE3-CD1 3.57Å; W246-L249 HydrophobicContact CH2-CD1 4.48Å; W246-L249 HydrophobicContact CZ3-CD1 3.46Å; W246-L249 VanDerWaalsContact CZ3-CD1 3.46Å; W246-L249 PolarHBondContact O-N 2.83Å; W246-R250 PolarHBondContact O-N 3.43Å; W246-R250 VanDerWaalsContact O-N 3.1Å; W246-Y337 AromaticContact CH2-CD1 3.65Å; W246-Y337 HydrophobicContact CH2-CD1 3.65Å; W246-Y337 AromaticContact CH2-CE1 2.95Å; W246-Y337 HydrophobicContact CH2-CE1 2.95Å; W246-Y337 AromaticContact CH2-CZ 3.57Å; W246-Y337 HydrophobicContact CZ2-CD1 4.35Å; W246-Y337 AromaticContact CZ2-CE1 3.25Å; W246-Y337 HydrophobicContact CZ2-CE1 3.25Å; W246-Y337 AromaticContact CZ2-CZ 3.48Å; W246-Y337 VanDerWaalsContact CZ2-CZ 3.48Å; W246-Y337 WeakPolarHBondContact CZ2-OH 3.44Å; W246-Y337 HydrophobicContact CZ3-CD1 4.41Å; W246-Y337 AromaticContact CZ3-CE1 3.97Å; W246-Y337 HydrophobicContact CZ3-CE1 3.97Å; W246-L338 HydrophobicContact CH2-CD2 4.3Å; W246-L338 HydrophobicContact CZ3-CD2 4.04Å; W246-M341 HydrophobicContact CB-CE 4.23Å; W246-M341 HydrophobicContact CD2-CB 3.91Å; W246-M341 HydrophobicContact CD2-CE 3.21Å; W246-M341 HydrophobicContact CD2-CG 4Å; W246-M341 HydrophobicContact CD2-SD 4.46Å; W246-M341 VanDerWaalsContact CE2-CE 3.43Å; W246-M341 HydrophobicContact CE3-CB 3.04Å; W246-M341 HydrophobicContact CE3-CE 3.69Å; W246-M341 HydrophobicContact CE3-CG 3.47Å; W246-M341 VanDerWaalsContact CE3-CG 3.47Å; W246-M341 HydrophobicContact CE3-SD 4.45Å; W246-M341 HydrophobicContact CG-CE 3.44Å; W246-M341 VanDerWaalsContact CG-CE 3.44Å; W246-M341 HydrophobicContact CH2-CB 4.13Å; W246-M341 HydrophobicContact CH2-CG 3.78Å; W246-M341 HydrophobicContact CZ2-CE 4.14Å; W246-M341 HydrophobicContact CZ2-CG 4.23Å; W246-M341 HydrophobicContact CZ3-CB 3.16Å; W246-M341 HydrophobicContact CZ3-CE 4.32Å; W246-M341 HydrophobicContact CZ3-CG 3.32Å
247D79.8Confident71.8Confident49 Ų4967.8 Ų67.826%0.26240%0.404SS..Hα-helixtrans-73.3-32.4178.6-58.1-45.2000111.4T245 R250 N251T245-D247 PolarHBondContact O-N 3.33Å; T245-D247 PolarHBondContact OG1-N 3.09Å; D247-R250 IonicContact OD1-CZ 3.63Å; D247-R250 IonicContact OD1-NE 3.52Å; D247-R250 IonicContact OD1-NH2 2.84Å; D247-R250 PolarHBondContact OD1-NH2 3.08Å; D247-N251 WeakPolarHBondContact O-CB 3.27Å; D247-N251 PolarHBondContact O-N 2.83Å; D247-N251 PolarHBondContact O-ND2 2.93Å
248S85.9Confident74.3Confident55 Ų5568.4 Ų68.439%0.38539%0.39SS..Hα-helixtrans-61.4-47.1169.8-51.90000111.1T245 R250 N251 S252T245-S248 VanDerWaalsContact O-CB 3.3Å; T245-S248 WeakPolarHBondContact O-CB 3.49Å; T245-S248 PolarHBondContact O-N 3.28Å; T245-S248 VanDerWaalsContact O-N 3.07Å; T245-S248 PolarHBondContact OG1-N 2.83Å; T245-S248 VanDerWaalsContact OG1-N 3.11Å; T245-S248 PolarHBondContact OG1-OG 3.18Å; S248-R250 PolarHBondContact O-N 2.98Å; S248-N251 PolarHBondContact O-N 3.25Å; S248-S252 VanDerWaalsContact O-CB 3.22Å; S248-S252 WeakPolarHBondContact O-CB 3.35Å; S248-S252 PolarHBondContact O-N 3.07Å
249L85.6Confident77Confident0 Ų062.9 Ų62.90%037%0.367CS..Hα-helixtrans-64.2-39.9-179.6-72.2166.3000113.1C244 T245 W246 I257 Q284 L338 A342C244-L249 VanDerWaalsContact SG-CG 3.56Å; T245-L249 PolarHBondContact O-N 2.81Å; T245-L249 VanDerWaalsContact O-N 3.08Å; W246-L249 HydrophobicContact CE3-CD1 3.57Å; W246-L249 HydrophobicContact CH2-CD1 4.48Å; W246-L249 HydrophobicContact CZ3-CD1 3.46Å; W246-L249 VanDerWaalsContact CZ3-CD1 3.46Å; W246-L249 PolarHBondContact O-N 2.83Å; L249-I257 HydrophobicContact CD2-CD1 4.02Å; L249-Q284 HydrophobicContact CD2-CB 3.98Å; L249-Q284 HydrophobicContact CD2-CG 3.77Å; L249-L338 HydrophobicContact CD1-CD2 3.66Å; L249-A342 HydrophobicContact CB-CB 4.28Å
250R86.8Confident79.4Confident91 Ų9157.1 Ų57.134%0.34333%0.326SS..Hα-helixtrans-66.1-42.1178.6-79.3-171.6-86-108.95.1113.4W246 D247 S248 S252 R261 M341W246-R250 PolarHBondContact O-N 3.43Å; W246-R250 VanDerWaalsContact O-N 3.1Å; D247-R250 IonicContact OD1-CZ 3.63Å; D247-R250 IonicContact OD1-NE 3.52Å; D247-R250 IonicContact OD1-NH2 2.84Å; D247-R250 PolarHBondContact OD1-NH2 3.08Å; S248-R250 PolarHBondContact O-N 2.98Å; R250-S252 VanDerWaalsContact C-N 3.34Å; R250-R261 PolarHBondContact O-NH1 2.78Å; R250-R261 VanDerWaalsContact O-NH1 3.13Å; R250-M341 WeakPolarHBondContact CG-O 3.22Å; R250-M341 PolarHBondContact NH1-O 3.08Å
251N82.1Confident81.6Confident121 Ų12155.5 Ų55.565%0.64732%0.317SS*.Hα-helixtrans-90.7-0.7-176-63.7-51.1000113.1D247 S248 A253D247-N251 WeakPolarHBondContact O-CB 3.27Å; D247-N251 PolarHBondContact O-N 2.83Å; D247-N251 PolarHBondContact O-ND2 2.93Å; S248-N251 PolarHBondContact O-N 3.25Å; N251-A253 PolarHBondContact O-N 3.2Å
252S85.8Confident83.2Confident25 Ų2555 Ų5518%0.17530%0.299CS..  trans-70.5129.6-178.1-172.10000111.3S248 R250 G254 Q284S248-S252 VanDerWaalsContact O-CB 3.22Å; S248-S252 WeakPolarHBondContact O-CB 3.35Å; S248-S252 PolarHBondContact O-N 3.07Å; R250-S252 VanDerWaalsContact C-N 3.34Å; S252-G254 VanDerWaalsContact C-N 3.33Å; S252-G254 PolarHBondContact OG-N 2.85Å; S252-Q284 VanDerWaalsContact OG-CD 3.23Å; S252-Q284 PolarHBondContact OG-NE2 3.11Å; S252-Q284 PolarHBondContact OG-OE1 3.38Å
253A84.9Confident84.4Confident90 Ų9057.6 Ų57.674%0.74431%0.313SS*.  trans-96.117.2174.700000112.3N251N251-A253 PolarHBondContact O-N 3.2Å
254G86.8Confident85Confident15 Ų1559.4 Ų59.416%0.15532%0.323CS..  trans-64.6146.9178.300000112.6S252 K256 I257 L258 E283S252-G254 VanDerWaalsContact C-N 3.33Å; S252-G254 PolarHBondContact OG-N 2.85Å; G254-K256 PolarHBondContact O-N 3.47Å; G254-I257 WeakPolarHBondContact O-CG2 3.33Å; G254-L258 WeakPolarHBondContact O-CB 3.45Å; G254-L258 WeakPolarHBondContact O-CD1 3.34Å; G254-L258 WeakPolarHBondContact O-CG 3.42Å; G254-L258 PolarHBondContact O-N 2.88Å; G254-L258 VanDerWaalsContact O-N 3.08Å; G254-E283 VanDerWaalsContact CA-CD 3.47Å; G254-E283 WeakPolarHBondContact CA-OE1 3.4Å; G254-E283 WeakPolarHBondContact CA-OE2 3.43Å
255E89.2Confident84.9Confident130 Ų13061 Ų6161%0.60733%0.331SS*.Hα-helixtrans-65.1-42.4-178.3-169.3-172.315800111L258 Q259 E283E255-L258 PolarHBondContact O-N 3.42Å; E255-Q259 WeakPolarHBondContact O-CB 3.27Å; E255-Q259 VanDerWaalsContact O-CG 3.3Å; E255-Q259 WeakPolarHBondContact O-CG 3.41Å; E255-Q259 PolarHBondContact O-N 2.84Å; E255-Q259 PolarHBondContact OE1-NE2 3.38Å; E255-Q259 VanDerWaalsContact OE1-NE2 3.08Å; E255-E283 PolarHBondContact N-OE2 2.84Å
256K89.9Confident84Confident60 Ų6062.4 Ų62.426%0.26135%0.348SS..Hα-helixtrans-69.7-41.8-176.8-57.3-68.4-179157.30111.6G254 L258 Q259 L260 D279 L280 E283G254-K256 PolarHBondContact O-N 3.47Å; K256-L258 VanDerWaalsContact C-N 3.35Å; K256-Q259 PolarHBondContact O-N 2.7Å; K256-L260 WeakPolarHBondContact O-CB 3.43Å; K256-L260 PolarHBondContact O-N 2.69Å; K256-D279 HydrophobicContact CD-CB 4.24Å; K256-D279 HydrophobicContact CG-CB 4.37Å; K256-D279 IonicContact NZ-OD2 2.79Å; K256-D279 PolarHBondContact NZ-OD2 3.5Å; K256-L280 HydrophobicContact CB-CD1 3.84Å; K256-E283 WeakPolarHBondContact CB-OE1 3.37Å; K256-E283 WeakPolarHBondContact CG-OE2 3.49Å; K256-E283 PolarHBondContact N-OE1 2.98Å; K256-E283 PolarHBondContact N-OE2 3.31Å
257I89.6Confident83.2Confident0 Ų067.8 Ų67.80%038%0.376CS..Hα-helixtrans-67-35.4175.6-167.267.2000112L249 G254 L260 R261 L280 E283 Q284 A342L249-I257 HydrophobicContact CD2-CD1 4.02Å; G254-I257 WeakPolarHBondContact O-CG2 3.33Å; I257-L260 HydrophobicContact CD1-CD2 4.25Å; I257-L260 PolarHBondContact O-N 2.98Å; I257-R261 VanDerWaalsContact O-CG 3.23Å; I257-R261 WeakPolarHBondContact O-CG 3.15Å; I257-R261 PolarHBondContact O-N 3.31Å; I257-L280 HydrophobicContact CB-CD1 3.9Å; I257-L280 HydrophobicContact CD1-CD1 4.01Å; I257-E283 PolarHBondContact N-OE1 2.86Å; I257-Q284 VanDerWaalsContact CG2-NE2 3.29Å; I257-A342 HydrophobicContact CD1-CB 3.76Å; I257-A342 HydrophobicContact CG1-CB 4.16Å
258L88.5Confident82.3Confident82 Ų8267.4 Ų67.443%0.42938%0.376SS..Hα-helixtrans-68.5-39.8174.6-72.2172.9000111.8G254 E255 K256 R261 S262G254-L258 WeakPolarHBondContact O-CB 3.45Å; G254-L258 WeakPolarHBondContact O-CD1 3.34Å; G254-L258 WeakPolarHBondContact O-CG 3.42Å; G254-L258 PolarHBondContact O-N 2.88Å; G254-L258 VanDerWaalsContact O-N 3.08Å; E255-L258 PolarHBondContact O-N 3.42Å; K256-L258 VanDerWaalsContact C-N 3.35Å; L258-R261 PolarHBondContact O-N 2.97Å; L258-S262 WeakPolarHBondContact O-CB 3.3Å; L258-S262 PolarHBondContact O-N 2.84Å; L258-S262 PolarHBondContact O-OG 2.87Å
259Q87.2Confident81Confident77 Ų7769.8 Ų69.836%0.3639%0.393SS..Hα-helixtrans-61.5-45.7172.9-77.1174.9200111.4E255 K256 R261 S262 H263E255-Q259 WeakPolarHBondContact O-CB 3.27Å; E255-Q259 VanDerWaalsContact O-CG 3.3Å; E255-Q259 WeakPolarHBondContact O-CG 3.41Å; E255-Q259 PolarHBondContact O-N 2.84Å; E255-Q259 PolarHBondContact OE1-NE2 3.38Å; E255-Q259 VanDerWaalsContact OE1-NE2 3.08Å; K256-Q259 PolarHBondContact O-N 2.7Å; Q259-R261 VanDerWaalsContact C-N 3.3Å; Q259-R261 PolarHBondContact O-N 2.88Å; Q259-S262 WeakPolarHBondContact CA-OG 3.44Å; Q259-S262 PolarHBondContact O-N 3.49Å; Q259-S262 PolarHBondContact O-OG 2.83Å; Q259-S262 VanDerWaalsContact O-OG 3.09Å; Q259-H263 PolarHBondContact O-N 3.1Å; Q259-H263 VanDerWaalsContact O-N 3.08Å; Q259-H263 PolarHBondContact O-ND1 2.87Å
260L88.9Confident79.7Confident8 Ų876.2 Ų76.24%0.04243%0.427CS..Hα-helixtrans-59.5-39.7176.9-177.665.4000112.2K256 I257 L265 L280 L335 L338 K339K256-L260 WeakPolarHBondContact O-CB 3.43Å; K256-L260 PolarHBondContact O-N 2.69Å; I257-L260 HydrophobicContact CD1-CD2 4.25Å; I257-L260 PolarHBondContact O-N 2.98Å; L260-L265 HydrophobicContact CD1-CD1 4Å; L260-L265 HydrophobicContact CD1-CD2 3.77Å; L260-L265 HydrophobicContact CD1-CG 4.07Å; L260-L280 HydrophobicContact CD2-CD2 3.66Å; L260-L335 HydrophobicContact CD1-CB 4.27Å; L260-L335 HydrophobicContact CD1-CD2 4.24Å; L260-L335 HydrophobicContact CD2-CD2 4.3Å; L260-L338 HydrophobicContact CD2-CB 4.13Å; L260-K339 HydrophobicContact CD1-CB 4.29Å; L260-K339 HydrophobicContact CD2-CB 4.15Å; L260-K339 HydrophobicContact CG-CB 3.93Å; L260-K339 HydrophobicContact CG-CG 4.35Å; L260-K339 VanDerWaalsContact O-CD 3.22Å; L260-K339 WeakPolarHBondContact O-CD 3.4Å; L260-K339 WeakPolarHBondContact O-CE 3.42Å; L260-K339 PolarHBondContact O-NZ 3.5Å
261R86.6Confident78.6Confident95 Ų9575 Ų7536%0.35843%0.433SS..Hα-helixtrans-68.3-44.2178-72.9167.865.5166.15.3112.4R250 I257 L258 Q259 K339 A342R250-R261 PolarHBondContact O-NH1 2.78Å; R250-R261 VanDerWaalsContact O-NH1 3.13Å; I257-R261 VanDerWaalsContact O-CG 3.23Å; I257-R261 WeakPolarHBondContact O-CG 3.15Å; I257-R261 PolarHBondContact O-N 3.31Å; L258-R261 PolarHBondContact O-N 2.97Å; Q259-R261 VanDerWaalsContact C-N 3.3Å; Q259-R261 PolarHBondContact O-N 2.88Å; R261-K339 WeakPolarHBondContact O-CE 3.38Å; R261-A342 HydrophobicContact CG-CB 4.24Å
262S82.3Confident78.6Confident78 Ų7876 Ų7655%0.54544%0.438SS..Hα-helixtrans-76.9-30-172.748.50000114.2L258 Q259L258-S262 WeakPolarHBondContact O-CB 3.3Å; L258-S262 PolarHBondContact O-N 2.84Å; L258-S262 PolarHBondContact O-OG 2.87Å; Q259-S262 WeakPolarHBondContact CA-OG 3.44Å; Q259-S262 PolarHBondContact O-N 3.49Å; Q259-S262 PolarHBondContact O-OG 2.83Å; Q259-S262 VanDerWaalsContact O-OG 3.09Å
263H78.9Confident78.9Confident121 Ų12175 Ų7556%0.5643%0.43SS*.SBendtrans-110.3133-174.3-62.980.6000112.1Q259 L265 K339Q259-H263 PolarHBondContact O-N 3.1Å; Q259-H263 VanDerWaalsContact O-N 3.08Å; Q259-H263 PolarHBondContact O-ND1 2.87Å; H263-L265 PolarHBondContact O-N 2.84Å; H263-K339 VanDerWaalsContact C-NZ 3.34Å; H263-K339 PolarHBondContact O-NZ 3.49Å
264P74.6Confident79.2Confident110 Ų11072.8 Ų72.871%0.71441%0.41SS*.  trans-61.3135.5169.626-31000109.8G266P264-G266 PolarHBondContact O-N 3.38Å
265L78.1Confident79.5Confident37 Ų3775.3 Ų75.319%0.19443%0.425CS..  trans-68124.8171.8-70.3165.4000107.7L260 H263 F273 L276 L335 Q336L260-L265 HydrophobicContact CD1-CD1 4Å; L260-L265 HydrophobicContact CD1-CD2 3.77Å; L260-L265 HydrophobicContact CD1-CG 4.07Å; H263-L265 PolarHBondContact O-N 2.84Å; L265-F273 HydrophobicContact CD2-CE1 4.17Å; L265-L276 HydrophobicContact CD2-CD2 4.33Å; L265-L335 HydrophobicContact CD1-CB 3.79Å; L265-L335 HydrophobicContact CD2-CB 4.37Å; L265-Q336 HydrophobicContact CD1-CB 4.23Å; L265-Q336 HydrophobicContact CD1-CG 3.54Å
266G68.6Low79.6Confident43 Ų4371.6 Ų71.644%0.44341%0.409SS..  trans-70.2-177.9177.800000112.7P264 H332P264-G266 PolarHBondContact O-N 3.38Å; G266-H332 PolarHBondContact O-NE2 3.08Å
267M67.4Low79.8Confident136 Ų13668.8 Ų68.867%0.6740%0.396SS*.  trans-61.6147.9177.5-78.9-91.191.400111.7S269 D270M267-S269 PolarHBondContact O-N 3.05Å; M267-D270 PolarHBondContact O-N 3.23Å
268P59.7Low80.1Confident41 Ų4172 Ų7227%0.26642%0.419SS..THydrogen-bonded Turntrans-54.2-18.7-178.5-28.134.4000115.9F273P268-F273 VanDerWaalsContact CA-CE2 3.45Å
269S59.4Low80.3Confident105 Ų10571 Ų7173%0.73441%0.414SS*.THydrogen-bonded Turntrans-83.6-19.3-170.2-44.40000114.6M267M267-S269 PolarHBondContact O-N 3.05Å
270D57.8Low80.6Confident135 Ų13567.4 Ų67.472%0.72240%0.397SS*.SBendtrans-116.68.5-163.1-60.8-35.5000114.1M267M267-D270 PolarHBondContact O-N 3.23Å
271S64Low80.9Confident67 Ų6767.8 Ų67.847%0.46940%0.4SS..SBendtrans-150.5143.1-173.9-70.50000114.2F273S271-F273 WeakPolarHBondContact O-CD2 3.27Å; S271-F273 WeakPolarHBondContact O-CE2 3.48Å; S271-F273 PolarHBondContact O-N 3.3Å
272N83.4Confident81.2Confident140 Ų14066.5 Ų66.575%0.74941%0.41SS*.  trans-7669.4178.7-71.1-58.5000111.2C274 S275 L276N272-C274 VanDerWaalsContact C-N 3.27Å; N272-C274 PolarHBondContact O-N 3.46Å; N272-S275 WeakPolarHBondContact O-CB 3.32Å; N272-S275 PolarHBondContact O-N 2.63Å; N272-L276 PolarHBondContact O-N 2.85Å; N272-L276 VanDerWaalsContact O-N 3.12Å
273F90.4Very high81.7Confident4 Ų465.6 Ų65.62%0.01840%0.397CS..Hα-helixtrans-59.9-33.6-176.6-64-69.4000113.5L265 P268 S271 S275 L276 L277 A331 H332 L335L265-F273 HydrophobicContact CD2-CE1 4.17Å; P268-F273 VanDerWaalsContact CA-CE2 3.45Å; S271-F273 WeakPolarHBondContact O-CD2 3.27Å; S271-F273 WeakPolarHBondContact O-CE2 3.48Å; S271-F273 PolarHBondContact O-N 3.3Å; F273-S275 VanDerWaalsContact C-N 3.32Å; F273-S275 PolarHBondContact O-N 2.74Å; F273-L276 PolarHBondContact O-N 3.43Å; F273-L277 WeakPolarHBondContact O-CB 3.3Å; F273-L277 PolarHBondContact O-N 3.39Å; F273-A331 HydrophobicContact CB-CB 4.04Å; F273-H332 HydrophobicContact CB-CB 4.24Å; F273-H332 HydrophobicContact CD1-CB 4.12Å; F273-H332 AromaticContact CD1-CD2 3.91Å; F273-H332 HydrophobicContact CD2-CB 3.98Å; F273-H332 AromaticContact CE1-CD2 3.51Å; F273-H332 HydrophobicContact CE2-CB 4.42Å; F273-H332 HydrophobicContact CG-CB 3.82Å; F273-H332 AromaticContact CZ-CD2 3.6Å; F273-L335 HydrophobicContact CB-CD1 4.07Å; F273-L335 HydrophobicContact CD1-CD1 3.9Å; F273-L335 HydrophobicContact CG-CD1 4.48Å
274C92.1Very high82.3Confident45 Ų4560.6 Ų60.630%0.30437%0.374SS..Hα-helixtrans-61.3-41174.1-590000111.7N272 S278N272-C274 VanDerWaalsContact C-N 3.27Å; N272-C274 PolarHBondContact O-N 3.46Å; C274-S278 WeakPolarHBondContact O-CB 3.29Å; C274-S278 PolarHBondContact O-N 2.86Å
275S92.3Very high83Confident67 Ų6761 Ų6147%0.46936%0.361SS..Hα-helixtrans-67.1-43.6176.8-169.50000111.2N272 F273 L277 S278 D279N272-S275 WeakPolarHBondContact O-CB 3.32Å; N272-S275 PolarHBondContact O-N 2.63Å; F273-S275 VanDerWaalsContact C-N 3.32Å; F273-S275 PolarHBondContact O-N 2.74Å; S275-L277 PolarHBondContact O-N 3.1Å; S275-S278 PolarHBondContact O-N 2.82Å; S275-D279 PolarHBondContact O-N 3.47Å
276L92.5Very high83.8Confident53 Ų5359.4 Ų59.428%0.27735%0.353SS..Hα-helixtrans-64.3-40.8178.4-178.859.8000111.9L265 N272 F273 D279 L280 L335L265-L276 HydrophobicContact CD2-CD2 4.33Å; N272-L276 PolarHBondContact O-N 2.85Å; N272-L276 VanDerWaalsContact O-N 3.12Å; F273-L276 PolarHBondContact O-N 3.43Å; L276-D279 PolarHBondContact O-N 3.48Å; L276-L280 WeakPolarHBondContact O-CB 3.05Å; L276-L280 PolarHBondContact O-N 3.27Å; L276-L335 HydrophobicContact CB-CD1 4.14Å; L276-L335 HydrophobicContact CD2-CD1 3.92Å; L276-L335 HydrophobicContact CD2-CD2 4.5Å; L276-L335 HydrophobicContact CG-CD1 4.06Å; L276-L335 HydrophobicContact CG-CD2 4.21Å
277L94.6Very high85Confident0 Ų061.5 Ų61.50%035%0.354CS..Hα-helixtrans-66.4-39.6175.7-176.860.1000111.5F273 S275 L280 S281 F286 V288 V306 L308 A331 A334 L335 L338F273-L277 WeakPolarHBondContact O-CB 3.3Å; F273-L277 PolarHBondContact O-N 3.39Å; S275-L277 PolarHBondContact O-N 3.1Å; L277-L280 PolarHBondContact O-N 2.94Å; L277-S281 VanDerWaalsContact O-CB 3.3Å; L277-S281 WeakPolarHBondContact O-CB 3.22Å; L277-S281 PolarHBondContact O-N 3.23Å; L277-S281 PolarHBondContact O-OG 3.45Å; L277-F286 HydrophobicContact CD1-CE2 4.25Å; L277-F286 HydrophobicContact CD1-CZ 4.27Å; L277-V288 HydrophobicContact CD2-CG1 3.94Å; L277-V288 HydrophobicContact CG-CG1 4.34Å; L277-V288 HydrophobicContact CG-CG2 4.15Å; L277-V306 HydrophobicContact CD2-CG2 4.12Å; L277-L308 HydrophobicContact CD1-CD2 4.24Å; L277-L308 HydrophobicContact CD2-CD2 4.15Å; L277-A331 HydrophobicContact CB-CB 4.46Å; L277-A331 HydrophobicContact CD2-CB 3.93Å; L277-A334 HydrophobicContact CD1-CB 4.4Å; L277-A334 HydrophobicContact CD2-CB 3.9Å; L277-L335 HydrophobicContact CB-CD1 4.3Å; L277-L335 HydrophobicContact CB-CD2 4.19Å; L277-L335 HydrophobicContact CB-CG 4.12Å; L277-L335 HydrophobicContact CD1-CD2 3.98Å; L277-L335 HydrophobicContact CD1-CG 4.17Å; L277-L338 HydrophobicContact CD1-CD1 3.74Å
278S94.3Very high86.3Confident67 Ų6756.9 Ų56.947%0.46933%0.333SS..Hα-helixtrans-61.5-48.4174-175.80000111.6C274 S275 L280 S281 A282C274-S278 WeakPolarHBondContact O-CB 3.29Å; C274-S278 PolarHBondContact O-N 2.86Å; S275-S278 PolarHBondContact O-N 2.82Å; S278-L280 VanDerWaalsContact C-N 3.3Å; S278-L280 PolarHBondContact O-N 3Å; S278-S281 PolarHBondContact O-N 2.88Å; S278-S281 PolarHBondContact O-OG 2.88Å; S278-A282 PolarHBondContact O-N 3.4Å
279D94.2Very high88.1Confident63 Ų6358.3 Ų58.334%0.33735%0.345SS..Hα-helixtrans-56.1-46.5175.6-78.94.7000111.4K256 S275 L276 A282 E283K256-D279 HydrophobicContact CD-CB 4.24Å; K256-D279 HydrophobicContact CG-CB 4.37Å; K256-D279 IonicContact NZ-OD2 2.79Å; K256-D279 PolarHBondContact NZ-OD2 3.5Å; S275-D279 PolarHBondContact O-N 3.47Å; L276-D279 PolarHBondContact O-N 3.48Å; D279-A282 PolarHBondContact O-N 3.49Å; D279-E283 PolarHBondContact O-N 3.13Å
280L93.6Very high89.8Confident1 Ų156.2 Ų56.21%0.00532%0.321CS..Hα-helixtrans-66.3-38.9-179.6-170.268.5000111.8K256 I257 L260 L276 L277 S278 A282 E283 Q284 F286 L335 L338K256-L280 HydrophobicContact CB-CD1 3.84Å; I257-L280 HydrophobicContact CB-CD1 3.9Å; I257-L280 HydrophobicContact CD1-CD1 4.01Å; L260-L280 HydrophobicContact CD2-CD2 3.66Å; L276-L280 WeakPolarHBondContact O-CB 3.05Å; L276-L280 PolarHBondContact O-N 3.27Å; L277-L280 PolarHBondContact O-N 2.94Å; S278-L280 VanDerWaalsContact C-N 3.3Å; S278-L280 PolarHBondContact O-N 3Å; L280-A282 VanDerWaalsContact C-N 3.34Å; L280-A282 PolarHBondContact O-N 3.37Å; L280-E283 PolarHBondContact O-N 3.48Å; L280-Q284 HydrophobicContact CD1-CG 3.92Å; L280-Q284 HydrophobicContact CG-CG 4.14Å; L280-Q284 VanDerWaalsContact O-CB 3.31Å; L280-Q284 WeakPolarHBondContact O-CB 3.31Å; L280-Q284 VanDerWaalsContact O-CG 3.29Å; L280-Q284 WeakPolarHBondContact O-CG 3.44Å; L280-Q284 PolarHBondContact O-N 2.8Å; L280-F286 HydrophobicContact CG-CZ 4.48Å; L280-L335 HydrophobicContact CD2-CD2 3.78Å; L280-L338 HydrophobicContact CD2-CB 4.48Å; L280-L338 HydrophobicContact CD2-CD1 3.63Å
281S94.4Very high91.7Very high15 Ų1554.7 Ų54.711%0.10531%0.312CS..Hα-helixtrans-63.5-40.1177.2780000112.2L277 S278 R285 F286 V288L277-S281 VanDerWaalsContact O-CB 3.3Å; L277-S281 WeakPolarHBondContact O-CB 3.22Å; L277-S281 PolarHBondContact O-N 3.23Å; L277-S281 PolarHBondContact O-OG 3.45Å; S278-S281 PolarHBondContact O-N 2.88Å; S278-S281 PolarHBondContact O-OG 2.88Å; S281-R285 WeakPolarHBondContact O-CA 3.32Å; S281-R285 PolarHBondContact O-N 2.99Å; S281-F286 CarbonylContact C-O 3.56Å; S281-F286 VanDerWaalsContact CB-O 3.27Å; S281-F286 WeakPolarHBondContact CB-O 3.11Å; S281-F286 PolarHBondContact O-N 3.4Å; S281-F286 VanDerWaalsContact O-N 3.09Å; S281-V288 VanDerWaalsContact CB-CG2 3.45Å
282A92.9Very high93.1Very high68 Ų6854 Ų5456%0.56230%0.303SS*.Hα-helixtrans-66.8-40.3175.400000112S278 D279 L280S278-A282 PolarHBondContact O-N 3.4Å; D279-A282 PolarHBondContact O-N 3.49Å; L280-A282 VanDerWaalsContact C-N 3.34Å; L280-A282 PolarHBondContact O-N 3.37Å
283E93.4Very high93.5Very high60 Ų6050.4 Ų50.428%0.2828%0.284SS..Hα-helixtrans-66.4-50.7177.1-173.5-178.282.300111.5G254 E255 K256 I257 D279 L280 R285G254-E283 VanDerWaalsContact CA-CD 3.47Å; G254-E283 WeakPolarHBondContact CA-OE1 3.4Å; G254-E283 WeakPolarHBondContact CA-OE2 3.43Å; E255-E283 PolarHBondContact N-OE2 2.84Å; K256-E283 WeakPolarHBondContact CB-OE1 3.37Å; K256-E283 WeakPolarHBondContact CG-OE2 3.49Å; K256-E283 PolarHBondContact N-OE1 2.98Å; K256-E283 PolarHBondContact N-OE2 3.31Å; I257-E283 PolarHBondContact N-OE1 2.86Å; D279-E283 PolarHBondContact O-N 3.13Å; L280-E283 PolarHBondContact O-N 3.48Å; E283-R285 VanDerWaalsContact C-N 3.33Å; E283-R285 PolarHBondContact O-N 3.16Å
284Q90.4Very high93.5Very high16 Ų1659.9 Ų59.98%0.07533%0.328CS..Hα-helixtrans-89.1-0.4-171.9-57.6-56.2-39.700113.7C244 L249 S252 I257 L280 F286C244-Q284 PolarHBondContact SG-O 3.47Å; L249-Q284 HydrophobicContact CD2-CB 3.98Å; L249-Q284 HydrophobicContact CD2-CG 3.77Å; S252-Q284 VanDerWaalsContact OG-CD 3.23Å; S252-Q284 PolarHBondContact OG-NE2 3.11Å; S252-Q284 PolarHBondContact OG-OE1 3.38Å; I257-Q284 VanDerWaalsContact CG2-NE2 3.29Å; L280-Q284 HydrophobicContact CD1-CG 3.92Å; L280-Q284 HydrophobicContact CG-CG 4.14Å; L280-Q284 VanDerWaalsContact O-CB 3.31Å; L280-Q284 WeakPolarHBondContact O-CB 3.31Å; L280-Q284 VanDerWaalsContact O-CG 3.29Å; L280-Q284 WeakPolarHBondContact O-CG 3.44Å; L280-Q284 PolarHBondContact O-N 2.8Å; Q284-F286 HydrophobicContact CB-CD1 3.76Å; Q284-F286 HydrophobicContact CB-CE1 3.66Å; Q284-F286 HydrophobicContact CG-CE1 4.34Å
285R90.4Very high93.4Very high117 Ų11765.3 Ų65.344%0.44235%0.349SS..THydrogen-bonded Turntrans56.862.6177.3-56.8-65.4-175131.3-0.6111.5Y242 S281 E283Y242-R285 WeakPolarHBondContact CB-O 3.48Å; Y242-R285 HydrophobicContact CD1-CB 3.75Å; Y242-R285 HydrophobicContact CD1-CG 4.34Å; Y242-R285 HydrophobicContact CE1-CB 4.26Å; Y242-R285 HydrophobicContact CE1-CG 4.39Å; Y242-R285 HydrophobicContact CG-CB 4.38Å; Y242-R285 PolarHBondContact OH-NH1 3Å; S281-R285 WeakPolarHBondContact O-CA 3.32Å; S281-R285 PolarHBondContact O-N 2.99Å; E283-R285 VanDerWaalsContact C-N 3.33Å; E283-R285 PolarHBondContact O-N 3.16Å
286F93.1Very high93.3Very high4 Ų469 Ų692%0.01835%0.353CS..  trans-133.3158.3161.158.7-92.1000109.7C244 L277 L280 S281 Q284 V288 L308 S309 T310 L338C244-F286 HydrophobicContact CB-CB 3.65Å; C244-F286 HydrophobicContact CB-CD1 3.81Å; C244-F286 HydrophobicContact CB-CG 4.16Å; L277-F286 HydrophobicContact CD1-CE2 4.25Å; L277-F286 HydrophobicContact CD1-CZ 4.27Å; L280-F286 HydrophobicContact CG-CZ 4.48Å; S281-F286 CarbonylContact C-O 3.56Å; S281-F286 VanDerWaalsContact CB-O 3.27Å; S281-F286 WeakPolarHBondContact CB-O 3.11Å; S281-F286 PolarHBondContact O-N 3.4Å; S281-F286 VanDerWaalsContact O-N 3.09Å; Q284-F286 HydrophobicContact CB-CD1 3.76Å; Q284-F286 HydrophobicContact CB-CE1 3.66Å; Q284-F286 HydrophobicContact CG-CE1 4.34Å; F286-V288 HydrophobicContact CD2-CG2 3.89Å; F286-V288 HydrophobicContact CE2-CG2 3.6Å; F286-L308 HydrophobicContact CD2-CB 4.16Å; F286-L308 HydrophobicContact CD2-CD2 4.49Å; F286-L308 HydrophobicContact CE2-CB 4.37Å; F286-L308 HydrophobicContact CE2-CD1 4.45Å; F286-L308 HydrophobicContact CE2-CD2 4.04Å; F286-S309 WeakPolarHBondContact CA-OG 3.34Å; F286-S309 WeakPolarHBondContact CB-OG 3.23Å; F286-T310 HydrophobicContact CB-CG2 4.48Å; F286-T310 HydrophobicContact CD1-CG2 4.48Å; F286-T310 HydrophobicContact CG-CG2 4.32Å; F286-L338 HydrophobicContact CE1-CD1 4.31Å; F286-L338 HydrophobicContact CE2-CD1 4.4Å; F286-L338 HydrophobicContact CZ-CD1 3.65Å
287D94Very high93.2Very high87 Ų8767.5 Ų67.547%0.46535%0.347SS..  trans-93.2148.3175.2-62.1-47.5000110.2L308 S309D287-L308 WeakPolarHBondContact O-CA 3.33Å; D287-S309 PolarHBondContact N-OG 3.33Å; D287-S309 PolarHBondContact O-N 2.87Å
288V95.8Very high92.9Very high39 Ų3976.7 Ų76.724%0.23640%0.395CS..EExtended strand (participates in β ladder)trans-122.1122.2178.2-177.20000108.2L277 S281 F286 Y290 V306 E307 L308L277-V288 HydrophobicContact CD2-CG1 3.94Å; L277-V288 HydrophobicContact CG-CG1 4.34Å; L277-V288 HydrophobicContact CG-CG2 4.15Å; S281-V288 VanDerWaalsContact CB-CG2 3.45Å; F286-V288 HydrophobicContact CD2-CG2 3.89Å; F286-V288 HydrophobicContact CE2-CG2 3.6Å; V288-Y290 HydrophobicContact CG1-CD2 4.21Å; V288-Y290 HydrophobicContact CG1-CE2 3.6Å; V288-V306 HydrophobicContact CG1-CG2 3.52Å; V288-E307 WeakPolarHBondContact CA-O 3.36Å; V288-L308 HydrophobicContact CG1-CD2 4.15Å; V288-L308 HydrophobicContact CG2-CD2 3.96Å
289S96.4Very high92.7Very high72 Ų7277.8 Ų77.850%0.50340%0.403SS..EExtended strand (participates in β ladder)trans-120.4135.7176.2-172.60000110.1V306 E307S289-V306 CarbonylContact O-C 3.52Å; S289-V306 WeakPolarHBondContact O-CA 3.2Å; S289-E307 PolarHBondContact N-O 2.99Å; S289-E307 PolarHBondContact O-N 3.48Å
290Y96.2Very high92.6Very high61 Ų6176.6 Ų76.624%0.23941%0.405CS..EExtended strand (participates in β ladder)trans-108.9132.8176.2-68.6-89.3000109.8V288 L305 V306 R327 A331V288-Y290 HydrophobicContact CG1-CD2 4.21Å; V288-Y290 HydrophobicContact CG1-CE2 3.6Å; Y290-L305 WeakPolarHBondContact CA-O 3.49Å; Y290-V306 HydrophobicContact CD1-CB 3.91Å; Y290-V306 HydrophobicContact CD1-CG2 3.92Å; Y290-V306 HydrophobicContact CE1-CB 3.84Å; Y290-V306 HydrophobicContact CE1-CG2 3.64Å; Y290-V306 HydrophobicContact CE2-CG2 4.4Å; Y290-V306 HydrophobicContact CG-CG2 4.44Å; Y290-R327 HydrophobicContact CD1-CB 4.25Å; Y290-R327 HydrophobicContact CD1-CG 4.08Å; Y290-R327 HydrophobicContact CE1-CB 4.32Å; Y290-A331 HydrophobicContact CE1-CB 4.31Å; Y290-A331 WeakPolarHBondContact OH-CB 3.17Å
291L96.7Very high92.7Very high102 Ų10278.4 Ų78.453%0.53442%0.415SS..EExtended strand (participates in β ladder)trans-119.9106.3172.9177.464.7000108.6L293 C304 L305L291-L293 HydrophobicContact CD2-CD2 4.34Å; L291-L293 HydrophobicContact CG-CD2 4.34Å; L291-C304 WeakPolarHBondContact O-CA 3.12Å; L291-L305 HydrophobicContact CB-CB 4.35Å; L291-L305 HydrophobicContact CD2-CD1 4.39Å; L291-L305 PolarHBondContact N-O 2.82Å; L291-L305 PolarHBondContact O-N 2.89Å
292D94.2Very high92.7Very high53 Ų5378.4 Ų78.428%0.28341%0.414SS..EExtended strand (participates in β ladder)trans-78.3132.3171.6-56.7-34.4000109.2V323 R327D292-V323 HydrophobicContact CB-CG1 4.21Å; D292-V323 VanDerWaalsContact CG-CG1 3.48Å; D292-V323 WeakPolarHBondContact OD2-CG1 3.33Å; D292-R327 WeakPolarHBondContact OD1-CG 3.5Å; D292-R327 IonicContact OD1-CZ 3.63Å; D292-R327 IonicContact OD1-NE 3.68Å; D292-R327 PolarHBondContact OD1-NE 3.24Å; D292-R327 IonicContact OD1-NH2 3.55Å; D292-R327 IonicContact OD2-CZ 2.72Å; D292-R327 IonicContact OD2-NE 3.21Å; D292-R327 PolarHBondContact OD2-NE 3.34Å; D292-R327 VanDerWaalsContact OD2-NE 3.1Å; D292-R327 IonicContact OD2-NH2 2.83Å; D292-R327 PolarHBondContact OD2-NH2 2.89Å
293L92.8Very high92.8Very high65 Ų6577 Ų7734%0.3440%0.396SS..EExtended strand (participates in β ladder)trans-91.7127.7176.6-58.2177.1000109.1L291 E295 Q303L291-L293 HydrophobicContact CD2-CD2 4.34Å; L291-L293 HydrophobicContact CG-CD2 4.34Å; L293-E295 PolarHBondContact O-N 3.05Å; L293-Q303 HydrophobicContact CB-CB 4.07Å; L293-Q303 HydrophobicContact CD1-CB 3.91Å; L293-Q303 HydrophobicContact CG-CB 4.36Å; L293-Q303 PolarHBondContact N-O 3.46Å
294E89Confident92.9Very high203 Ų20374.2 Ų74.295%0.94938%0.383SS*.SBendtrans-64.9-30.4178.2-63.9-176.5173.500111.9
295E89.8Confident93.3Very high159 Ų15975.9 Ų75.974%0.74339%0.392SS*.SBendtrans-81.1127.6-179.9-165176.2-175.700111.8L293 Q303L293-E295 PolarHBondContact O-N 3.05Å; E295-Q303 PolarHBondContact O-NE2 2.89Å
296R91.4Very high93.6Very high143 Ų14370.3 Ų70.354%0.5437%0.371SS..PPolyproline II helixtrans-73.5149.3173.5-70.4-179.2176.5-87.6-6.6110.5G300 L301R296-G300 PolarHBondContact NH1-O 2.83Å; R296-L301 CarbonylContact C-O 3.59Å; R296-L301 WeakPolarHBondContact CA-O 3.48Å
297S89.8Confident93.8Very high23 Ų2374.6 Ų74.616%0.16139%0.391CS..PPolyproline II helixtrans-60.6167.6172.373.40000111.3S299 G300 L301S297-S299 PolarHBondContact O-N 3.29Å; S297-S299 PolarHBondContact OG-N 2.9Å; S297-S299 PolarHBondContact OG-OG 3.47Å; S297-G300 WeakPolarHBondContact O-CA 3.35Å; S297-G300 PolarHBondContact O-N 3.05Å; S297-G300 PolarHBondContact OG-N 3.38Å; S297-L301 PolarHBondContact N-O 3.01Å; S297-L301 WeakPolarHBondContact OG-CB 3.42Å; S297-L301 PolarHBondContact OG-N 3.39Å
298L88.1Confident93.8Very high193 Ų19370.5 Ų70.5100%1.0137%0.369SS*.THydrogen-bonded Turntrans-57.6-22.2173-63.3176.8000113.6
299S91.2Very high93.6Very high90 Ų9070.2 Ų70.263%0.62937%0.369SS*.THydrogen-bonded Turntrans-926.3174.753.30000113.8S297S297-S299 PolarHBondContact O-N 3.29Å; S297-S299 PolarHBondContact OG-N 2.9Å; S297-S299 PolarHBondContact OG-OG 3.47Å
300G92.1Very high93.3Very high37 Ų3767 Ų6738%0.38135%0.346SS..SBendtrans79.512.1179.300000115.1R296 S297R296-G300 PolarHBondContact NH1-O 2.83Å; S297-G300 WeakPolarHBondContact O-CA 3.35Å; S297-G300 PolarHBondContact O-N 3.05Å; S297-G300 PolarHBondContact OG-N 3.38Å
301L94.3Very high92.7Very high40 Ų4068.2 Ų68.221%0.20935%0.354CS..  trans-86.1144.3-176.9-56.7177.4000111.2R296 S297 F319 A320 Q321R296-L301 CarbonylContact C-O 3.59Å; R296-L301 WeakPolarHBondContact CA-O 3.48Å; S297-L301 PolarHBondContact N-O 3.01Å; S297-L301 WeakPolarHBondContact OG-CB 3.42Å; S297-L301 PolarHBondContact OG-N 3.39Å; L301-F319 HydrophobicContact CB-CB 4.39Å; L301-F319 HydrophobicContact CD1-CD2 3.51Å; L301-F319 HydrophobicContact CD1-CE2 4.06Å; L301-F319 HydrophobicContact CD1-CG 4.47Å; L301-A320 CarbonylContact C-O 3.51Å; L301-A320 WeakPolarHBondContact CA-O 3.34Å; L301-A320 WeakPolarHBondContact CB-O 3.45Å; L301-Q321 HydrophobicContact CD2-CG 4.17Å
302C94.3Very high92.3Very high14 Ų1467.1 Ų67.110%0.09535%0.353CS..EExtended strand (participates in β ladder)trans-65.5145.7167.8-62.60000109.6F319 A320 V323 A326C302-F319 CarbonylContact O-C 3.55Å; C302-F319 WeakPolarHBondContact O-CA 3.34Å; C302-A320 PolarHBondContact N-O 2.9Å; C302-A320 PolarHBondContact O-N 2.99Å; C302-V323 HydrophobicContact CB-CG2 4.31Å; C302-A326 HydrophobicContact CB-CB 4.17Å
303Q95.9Very high92.1Very high40 Ų4070 Ų7019%0.18737%0.367CS..EExtended strand (participates in β ladder)trans-125.4143.6-176.1-61.7-179.5103.400110.4L293 E295 G318 F319L293-Q303 HydrophobicContact CB-CB 4.07Å; L293-Q303 HydrophobicContact CD1-CB 3.91Å; L293-Q303 HydrophobicContact CG-CB 4.36Å; L293-Q303 PolarHBondContact N-O 3.46Å; E295-Q303 PolarHBondContact O-NE2 2.89Å; Q303-G318 WeakPolarHBondContact CA-O 3.49Å; Q303-F319 HydrophobicContact CG-CB 4.49Å
304C95.7Very high92.2Very high0 Ų067.3 Ų67.30%035%0.353CS..EExtended strand (participates in β ladder)trans-143.1137.6178.2179.50000110.1L291 H317 G318 A326 R327 A330L291-C304 WeakPolarHBondContact O-CA 3.12Å; C304-H317 PolarHBondContact O-CD2 3.44Å; C304-H317 VanDerWaalsContact O-CD2 3.31Å; C304-G318 PolarHBondContact N-O 2.86Å; C304-G318 PolarHBondContact O-N 3.36Å; C304-A326 HydrophobicContact CB-CB 4.07Å; C304-R327 HydrophobicContact CB-CG 4.23Å; C304-R327 VanDerWaalsContact SG-CG 3.51Å; C304-A330 HydrophobicContact CB-CB 4.37Å
305L97.3Very high92.5Very high51 Ų5161.4 Ų61.427%0.26733%0.331SS..EExtended strand (participates in β ladder)trans-102.3140.1166.1-62.7172.8000109.3Y290 L291 V315 C316 H317Y290-L305 WeakPolarHBondContact CA-O 3.49Å; L291-L305 HydrophobicContact CB-CB 4.35Å; L291-L305 HydrophobicContact CD2-CD1 4.39Å; L291-L305 PolarHBondContact N-O 2.82Å; L291-L305 PolarHBondContact O-N 2.89Å; L305-V315 HydrophobicContact CB-CG1 4.21Å; L305-V315 HydrophobicContact CD2-CG1 4.1Å; L305-C316 CarbonylContact C-O 3.56Å; L305-C316 WeakPolarHBondContact CA-O 3.47Å; L305-H317 HydrophobicContact CD2-CB 3.75Å
306V97.4Very high92.8Very high0 Ų054.6 Ų54.60%030%0.301CS..EExtended strand (participates in β ladder)trans-116.3124.7167.864.70000108.9L277 V288 S289 Y290 L308 V315 C316 A330 A334L277-V306 HydrophobicContact CD2-CG2 4.12Å; V288-V306 HydrophobicContact CG1-CG2 3.52Å; S289-V306 CarbonylContact O-C 3.52Å; S289-V306 WeakPolarHBondContact O-CA 3.2Å; Y290-V306 HydrophobicContact CD1-CB 3.91Å; Y290-V306 HydrophobicContact CD1-CG2 3.92Å; Y290-V306 HydrophobicContact CE1-CB 3.84Å; Y290-V306 HydrophobicContact CE1-CG2 3.64Å; Y290-V306 HydrophobicContact CE2-CG2 4.4Å; Y290-V306 HydrophobicContact CG-CG2 4.44Å; V306-L308 HydrophobicContact CG2-CD2 4.06Å; V306-V315 CarbonylContact O-C 3.52Å; V306-V315 VanDerWaalsContact O-CA 3.27Å; V306-V315 WeakPolarHBondContact O-CA 3.45Å; V306-C316 HydrophobicContact CG1-CB 3.68Å; V306-C316 PolarHBondContact N-O 2.93Å; V306-C316 PolarHBondContact O-N 3.33Å; V306-A330 HydrophobicContact CB-CB 4.18Å; V306-A330 HydrophobicContact CG1-CB 3.91Å; V306-A330 WeakPolarHBondContact CG1-O 3.15Å; V306-A334 HydrophobicContact CG1-CB 3.78Å
307E96.8Very high93.1Very high95 Ų9551.4 Ų51.444%0.44429%0.292SS..EExtended strand (participates in β ladder)trans-101.8131174.3-175.6-177.211100109.3V288 S289 I313 T314 V315V288-E307 WeakPolarHBondContact CA-O 3.36Å; S289-E307 PolarHBondContact N-O 2.99Å; S289-E307 PolarHBondContact O-N 3.48Å; E307-I313 HydrophobicContact CG-CG2 3.79Å; E307-T314 CarbonylContact C-O 3.54Å; E307-T314 WeakPolarHBondContact CA-O 3.44Å; E307-V315 HydrophobicContact CB-CG2 4.36Å; E307-V315 HydrophobicContact CG-CG2 4.21Å
308L95.1Very high93.3Very high0 Ų050.3 Ų50.30%028%0.284CS..EExtended strand (participates in β ladder)trans-110131.7171.2-40.4178.5000108.6L277 F286 D287 V288 V306 T310 T314 A334 L338L277-L308 HydrophobicContact CD1-CD2 4.24Å; L277-L308 HydrophobicContact CD2-CD2 4.15Å; F286-L308 HydrophobicContact CD2-CB 4.16Å; F286-L308 HydrophobicContact CD2-CD2 4.49Å; F286-L308 HydrophobicContact CE2-CB 4.37Å; F286-L308 HydrophobicContact CE2-CD1 4.45Å; F286-L308 HydrophobicContact CE2-CD2 4.04Å; D287-L308 WeakPolarHBondContact O-CA 3.33Å; V288-L308 HydrophobicContact CG1-CD2 4.15Å; V288-L308 HydrophobicContact CG2-CD2 3.96Å; V306-L308 HydrophobicContact CG2-CD2 4.06Å; L308-T310 HydrophobicContact CB-CG2 3.97Å; L308-T310 PolarHBondContact O-N 2.94Å; L308-T314 HydrophobicContact CD1-CG2 4.07Å; L308-T314 HydrophobicContact CG-CG2 4.42Å; L308-T314 PolarHBondContact N-O 3.46Å; L308-T314 PolarHBondContact O-N 3.28Å; L308-A334 HydrophobicContact CD1-CB 4.18Å; L308-A334 HydrophobicContact CD2-CB 4.31Å; L308-L338 HydrophobicContact CD1-CD1 3.99Å; L308-L338 HydrophobicContact CD1-CD2 3.96Å; L308-L338 HydrophobicContact CD1-CG 3.99Å
309S92.1Very high93.6Very high33 Ų3346.2 Ų46.223%0.23126%0.259CS..  trans-73.430.417782.10000113.7F286 D287F286-S309 WeakPolarHBondContact CA-OG 3.34Å; F286-S309 WeakPolarHBondContact CB-OG 3.23Å; D287-S309 PolarHBondContact N-OG 3.33Å; D287-S309 PolarHBondContact O-N 2.87Å
310T90.3Very high93.7Very high4 Ų442.8 Ų42.83%0.02524%0.235CC..EExtended strand (participates in β ladder)trans-68.9170.9175.157.60000110.9C244 F286 L308 P312 I313 T314 L338C244-T310 HydrophobicContact CB-CG2 4.29Å; C244-T310 CarbonylContact O-C 3.58Å; C244-T310 WeakPolarHBondContact O-CA 3.44Å; C244-T310 WeakPolarHBondContact O-CB 3.46Å; F286-T310 HydrophobicContact CB-CG2 4.48Å; F286-T310 HydrophobicContact CD1-CG2 4.48Å; F286-T310 HydrophobicContact CG-CG2 4.32Å; L308-T310 HydrophobicContact CB-CG2 3.97Å; L308-T310 PolarHBondContact O-N 2.94Å; T310-P312 VanDerWaalsContact C-C 3.45Å; T310-P312 CarbonylContact C-O 3.55Å; T310-P312 CarbonylContact O-C 3.59Å; T310-P312 PolarHBondContact OG1-O 3.04Å; T310-I313 VanDerWaalsContact O-CA 3.23Å; T310-I313 WeakPolarHBondContact O-CA 3.34Å; T310-I313 PolarHBondContact O-N 3.46Å; T310-T314 WeakPolarHBondContact OG1-CB 3.43Å; T310-T314 PolarHBondContact OG1-N 3.42Å; T310-T314 PolarHBondContact OG1-OG1 3.08Å; T310-L338 HydrophobicContact CG2-CD2 4.33Å
311Q83.5Confident93.7Very high88 Ų8848.9 Ų48.941%0.41125%0.254SS..EExtended strand (participates in β ladder)trans-121.4112.1174.7-163.417211.500112.5C244 T245C244-Q311 PolarHBondContact O-N 3.45Å; T245-Q311 HydrophobicContact CG2-CB 4.3Å
312P88.2Confident93.6Very high79 Ų7950.9 Ų50.951%0.51327%0.265SS..SBendcis-59.9159.7-7.225.8-38.6000114.4T310 T314T310-P312 VanDerWaalsContact C-C 3.45Å; T310-P312 CarbonylContact C-O 3.55Å; T310-P312 CarbonylContact O-C 3.59Å; T310-P312 PolarHBondContact OG1-O 3.04Å; P312-T314 PolarHBondContact O-N 2.89Å
313I89.8Confident93.4Very high113 Ų11353.2 Ų53.258%0.57928%0.279SS*.  trans-56.9136.1174.4-69.7168.4000108.5E307 T310 V315E307-I313 HydrophobicContact CG-CG2 3.79Å; T310-I313 VanDerWaalsContact O-CA 3.23Å; T310-I313 WeakPolarHBondContact O-CA 3.34Å; T310-I313 PolarHBondContact O-N 3.46Å; I313-V315 HydrophobicContact CG2-CG2 4.38Å
314T93.4Very high93.2Very high8 Ų857 Ų575%0.04930%0.3CS..EExtended strand (participates in β ladder)trans-110.9130.2-180-57.50000109.4E307 L308 T310 P312 Y337E307-T314 CarbonylContact C-O 3.54Å; E307-T314 WeakPolarHBondContact CA-O 3.44Å; L308-T314 HydrophobicContact CD1-CG2 4.07Å; L308-T314 HydrophobicContact CG-CG2 4.42Å; L308-T314 PolarHBondContact N-O 3.46Å; L308-T314 PolarHBondContact O-N 3.28Å; T310-T314 WeakPolarHBondContact OG1-CB 3.43Å; T310-T314 PolarHBondContact OG1-N 3.42Å; T310-T314 PolarHBondContact OG1-OG1 3.08Å; P312-T314 PolarHBondContact O-N 2.89Å; T314-Y337 HydrophobicContact CG2-CD1 3.35Å; T314-Y337 HydrophobicContact CG2-CE1 3.27Å; T314-Y337 HydrophobicContact CG2-CG 4.32Å; T314-Y337 VanDerWaalsContact OG1-CE1 3.32Å; T314-Y337 WeakPolarHBondContact OG1-CE1 3.34Å
315V96.5Very high93Very high79 Ų7958.8 Ų58.848%0.47932%0.315SS..EExtended strand (participates in β ladder)trans-120.6130.7169.6-177.60000108.8L305 V306 E307 I313L305-V315 HydrophobicContact CB-CG1 4.21Å; L305-V315 HydrophobicContact CD2-CG1 4.1Å; V306-V315 CarbonylContact O-C 3.52Å; V306-V315 VanDerWaalsContact O-CA 3.27Å; V306-V315 WeakPolarHBondContact O-CA 3.45Å; E307-V315 HydrophobicContact CB-CG2 4.36Å; E307-V315 HydrophobicContact CG-CG2 4.21Å; I313-V315 HydrophobicContact CG2-CG2 4.38Å
316C96.6Very high92.8Very high16 Ų1656.4 Ų56.411%0.10830%0.303CS..EExtended strand (participates in β ladder)trans-120.7140.6174.2-67.30000110.1L305 V306 N333 A334L305-C316 CarbonylContact C-O 3.56Å; L305-C316 WeakPolarHBondContact CA-O 3.47Å; V306-C316 HydrophobicContact CG1-CB 3.68Å; V306-C316 PolarHBondContact N-O 2.93Å; V306-C316 PolarHBondContact O-N 3.33Å; C316-N333 HydrophobicContact CB-CB 4.22Å; C316-A334 HydrophobicContact CB-CB 4.17Å
317H96.1Very high92.6Very high76 Ų7660.6 Ų60.635%0.35232%0.319SS..EExtended strand (participates in β ladder)trans-101.8141.7178.3-178.5-133.8000110.2C304 L305 N333C304-H317 PolarHBondContact O-CD2 3.44Å; C304-H317 VanDerWaalsContact O-CD2 3.31Å; L305-H317 HydrophobicContact CD2-CB 3.75Å; H317-N333 PolarHBondContact O-ND2 3Å
318G94.3Very high92.5Very high0 Ų057.1 Ų57.10%031%0.306CS..EExtended strand (participates in β ladder)trans-137.7148.3171.700000111.9Q303 C304 N329Q303-G318 WeakPolarHBondContact CA-O 3.49Å; C304-G318 PolarHBondContact N-O 2.86Å; C304-G318 PolarHBondContact O-N 3.36Å; G318-N329 WeakPolarHBondContact CA-OD1 3.33Å
319F94.6Very high92.4Very high108 Ų10858.4 Ų58.447%0.47431%0.313SS..EExtended strand (participates in β ladder)trans-138.1142.7179.158.6-95.8000111.1L301 C302 Q303 N329L301-F319 HydrophobicContact CB-CB 4.39Å; L301-F319 HydrophobicContact CD1-CD2 3.51Å; L301-F319 HydrophobicContact CD1-CE2 4.06Å; L301-F319 HydrophobicContact CD1-CG 4.47Å; C302-F319 CarbonylContact O-C 3.55Å; C302-F319 WeakPolarHBondContact O-CA 3.34Å; Q303-F319 HydrophobicContact CG-CB 4.49Å; F319-N329 PolarHBondContact N-OD1 3.22Å
320A93.8Very high92.6Very high17 Ų1756.8 Ų56.814%0.1430%0.302CS..EExtended strand (participates in β ladder)trans-160.8178.9178.200000112.3L301 C302 N322 A325 A326L301-A320 CarbonylContact C-O 3.51Å; L301-A320 WeakPolarHBondContact CA-O 3.34Å; L301-A320 WeakPolarHBondContact CB-O 3.45Å; C302-A320 PolarHBondContact N-O 2.9Å; C302-A320 PolarHBondContact O-N 2.99Å; A320-N322 VanDerWaalsContact C-N 3.29Å; A320-N322 PolarHBondContact O-N 3.45Å; A320-A325 HydrophobicContact CB-CB 3.45Å; A320-A325 VanDerWaalsContact CB-CB 3.45Å; A320-A326 HydrophobicContact CB-CB 4.13Å; A320-A326 VanDerWaalsContact CB-N 3.33Å
321Q92.4Very high92.8Very high165 Ų16556.6 Ų56.677%0.77130%0.3SS*.SBendtrans-68.1-26.4-179-64.61806.700113.7L301L301-Q321 HydrophobicContact CD2-CG 4.17Å
322N91.9Very high93.3Very high82 Ų8252.9 Ų52.944%0.43928%0.283SS..SBendtrans-133.9164.917860.654000110.6A320 A325 A326A320-N322 VanDerWaalsContact C-N 3.29Å; A320-N322 PolarHBondContact O-N 3.45Å; N322-A325 WeakPolarHBondContact OD1-CA 3.25Å; N322-A325 WeakPolarHBondContact OD1-CB 3.35Å; N322-A325 PolarHBondContact OD1-N 2.88Å; N322-A326 WeakPolarHBondContact O-CB 3.46Å; N322-A326 PolarHBondContact O-N 3.27Å
323V90.4Very high93.7Very high64 Ų6451.4 Ų51.439%0.38827%0.271SS..Hα-helixtrans-65.7-43.1-173.7179.60000111.6D292 C302 A325 A326 R327D292-V323 HydrophobicContact CB-CG1 4.21Å; D292-V323 VanDerWaalsContact CG-CG1 3.48Å; D292-V323 WeakPolarHBondContact OD2-CG1 3.33Å; C302-V323 HydrophobicContact CB-CG2 4.31Å; V323-A325 PolarHBondContact O-N 2.85Å; V323-A326 WeakPolarHBondContact O-CB 3.49Å; V323-A326 PolarHBondContact O-N 3.43Å; V323-A326 VanDerWaalsContact O-N 3.08Å; V323-R327 PolarHBondContact O-N 2.88Å
324D91.1Very high94Very high119 Ų11946 Ų4664%0.63624%0.243SC*.Hα-helixtrans-63.4-41-179.8-63.6-43.9000112.2A326 R327 A328D324-A326 VanDerWaalsContact C-N 3.33Å; D324-R327 PolarHBondContact O-N 3.42Å; D324-A328 WeakPolarHBondContact O-CB 3.45Å; D324-A328 PolarHBondContact O-N 3.3Å
325A91Very high94Very high37 Ų3745.7 Ų45.731%0.30624%0.241SC..Hα-helixtrans-69.7-31.3174.100000111.9A320 N322 V323 A328 N329A320-A325 HydrophobicContact CB-CB 3.45Å; A320-A325 VanDerWaalsContact CB-CB 3.45Å; N322-A325 WeakPolarHBondContact OD1-CA 3.25Å; N322-A325 WeakPolarHBondContact OD1-CB 3.35Å; N322-A325 PolarHBondContact OD1-N 2.88Å; V323-A325 PolarHBondContact O-N 2.85Å; A325-A328 PolarHBondContact O-N 3.31Å; A325-N329 VanDerWaalsContact O-CB 3.25Å; A325-N329 WeakPolarHBondContact O-CB 3.16Å; A325-N329 PolarHBondContact O-N 3.3Å
326A93.1Very high93.8Very high1 Ų145.9 Ų45.91%0.00824%0.237CC..Hα-helixtrans-68.4-41.2175.500000110.6C302 C304 A320 N322 V323 D324 N329 A330C302-A326 HydrophobicContact CB-CB 4.17Å; C304-A326 HydrophobicContact CB-CB 4.07Å; A320-A326 HydrophobicContact CB-CB 4.13Å; A320-A326 VanDerWaalsContact CB-N 3.33Å; N322-A326 WeakPolarHBondContact O-CB 3.46Å; N322-A326 PolarHBondContact O-N 3.27Å; V323-A326 WeakPolarHBondContact O-CB 3.49Å; V323-A326 PolarHBondContact O-N 3.43Å; V323-A326 VanDerWaalsContact O-N 3.08Å; D324-A326 VanDerWaalsContact C-N 3.33Å; A326-N329 PolarHBondContact O-N 2.88Å; A326-A330 WeakPolarHBondContact O-CB 3.46Å; A326-A330 PolarHBondContact O-N 3.3Å
327R93.9Very high93.7Very high89 Ų8948.8 Ų48.834%0.33625%0.246SC..Hα-helixtrans-61.8-46171-75.3177.6175.6-162.5-0.6112.1Y290 D292 C304 V323 D324 N329 A330 A331Y290-R327 HydrophobicContact CD1-CB 4.25Å; Y290-R327 HydrophobicContact CD1-CG 4.08Å; Y290-R327 HydrophobicContact CE1-CB 4.32Å; D292-R327 WeakPolarHBondContact OD1-CG 3.5Å; D292-R327 IonicContact OD1-CZ 3.63Å; D292-R327 IonicContact OD1-NE 3.68Å; D292-R327 PolarHBondContact OD1-NE 3.24Å; D292-R327 IonicContact OD1-NH2 3.55Å; D292-R327 IonicContact OD2-CZ 2.72Å; D292-R327 IonicContact OD2-NE 3.21Å; D292-R327 PolarHBondContact OD2-NE 3.34Å; D292-R327 VanDerWaalsContact OD2-NE 3.1Å; D292-R327 IonicContact OD2-NH2 2.83Å; D292-R327 PolarHBondContact OD2-NH2 2.89Å; C304-R327 HydrophobicContact CB-CG 4.23Å; C304-R327 VanDerWaalsContact SG-CG 3.51Å; V323-R327 PolarHBondContact O-N 2.88Å; D324-R327 PolarHBondContact O-N 3.42Å; R327-N329 VanDerWaalsContact C-N 3.31Å; R327-N329 PolarHBondContact O-N 3.39Å; R327-A330 PolarHBondContact O-N 3.47Å; R327-A331 WeakPolarHBondContact O-CB 3.42Å; R327-A331 PolarHBondContact O-N 2.89Å
328A93.4Very high93.5Very high21 Ų2145.2 Ų45.217%0.17423%0.229CC..Hα-helixtrans-62.1-39.3176.700000111.8D324 A325 A331 H332D324-A328 WeakPolarHBondContact O-CB 3.45Å; D324-A328 PolarHBondContact O-N 3.3Å; A325-A328 PolarHBondContact O-N 3.31Å; A328-A331 PolarHBondContact O-N 3Å; A328-H332 WeakPolarHBondContact O-CB 3.4Å; A328-H332 PolarHBondContact O-N 3.3Å
329N94Very high93.4Very high27 Ų2747.8 Ų47.814%0.14424%0.24CC..Hα-helixtrans-65.3-44.3174.6-173.4-99.2000111.9G318 F319 A325 A326 R327 A331 H332 N333G318-N329 WeakPolarHBondContact CA-OD1 3.33Å; F319-N329 PolarHBondContact N-OD1 3.22Å; A325-N329 VanDerWaalsContact O-CB 3.25Å; A325-N329 WeakPolarHBondContact O-CB 3.16Å; A325-N329 PolarHBondContact O-N 3.3Å; A326-N329 PolarHBondContact O-N 2.88Å; R327-N329 VanDerWaalsContact C-N 3.31Å; R327-N329 PolarHBondContact O-N 3.39Å; N329-A331 VanDerWaalsContact C-N 3.33Å; N329-A331 PolarHBondContact O-N 2.92Å; N329-H332 WeakPolarHBondContact O-CB 3.35Å; N329-H332 PolarHBondContact O-N 3.5Å; N329-N333 VanDerWaalsContact O-CG 3.27Å; N329-N333 PolarHBondContact O-N 2.75Å; N329-N333 PolarHBondContact O-ND2 3.12Å; N329-N333 PolarHBondContact OD1-ND2 3.44Å
330A95.6Very high93.2Very high0 Ų048.5 Ų48.50%025%0.248CC..Hα-helixtrans-61.1-43.9175.300000111C304 V306 A326 R327 H332 N333 A334C304-A330 HydrophobicContact CB-CB 4.37Å; V306-A330 HydrophobicContact CB-CB 4.18Å; V306-A330 HydrophobicContact CG1-CB 3.91Å; V306-A330 WeakPolarHBondContact CG1-O 3.15Å; A326-A330 WeakPolarHBondContact O-CB 3.46Å; A326-A330 PolarHBondContact O-N 3.3Å; R327-A330 PolarHBondContact O-N 3.47Å; A330-H332 PolarHBondContact O-N 3.43Å; A330-N333 PolarHBondContact O-N 2.99Å; A330-A334 PolarHBondContact O-N 2.91Å
331A95.4Very high92.9Very high0 Ų049.7 Ų49.70%025%0.251CS..Hα-helixtrans-62.9-41.4176.600000112.4F273 L277 Y290 R327 A328 N329 A334 L335F273-A331 HydrophobicContact CB-CB 4.04Å; L277-A331 HydrophobicContact CB-CB 4.46Å; L277-A331 HydrophobicContact CD2-CB 3.93Å; Y290-A331 HydrophobicContact CE1-CB 4.31Å; Y290-A331 WeakPolarHBondContact OH-CB 3.17Å; R327-A331 WeakPolarHBondContact O-CB 3.42Å; R327-A331 PolarHBondContact O-N 2.89Å; A328-A331 PolarHBondContact O-N 3Å; N329-A331 VanDerWaalsContact C-N 3.33Å; N329-A331 PolarHBondContact O-N 2.92Å; A331-A334 WeakPolarHBondContact O-CB 3.44Å; A331-A334 PolarHBondContact O-N 2.79Å; A331-L335 WeakPolarHBondContact O-CG 2.99Å; A331-L335 PolarHBondContact O-N 3.02Å
332H94.6Very high92.6Very high10 Ų1041.8 Ų41.85%0.04621%0.214CC..Hα-helixtrans-61.1-45174.5171-98.3000111.6G266 F273 A328 N329 A330 A334 L335 Q336G266-H332 PolarHBondContact O-NE2 3.08Å; F273-H332 HydrophobicContact CB-CB 4.24Å; F273-H332 HydrophobicContact CD1-CB 4.12Å; F273-H332 AromaticContact CD1-CD2 3.91Å; F273-H332 HydrophobicContact CD2-CB 3.98Å; F273-H332 AromaticContact CE1-CD2 3.51Å; F273-H332 HydrophobicContact CE2-CB 4.42Å; F273-H332 HydrophobicContact CG-CB 3.82Å; F273-H332 AromaticContact CZ-CD2 3.6Å; A328-H332 WeakPolarHBondContact O-CB 3.4Å; A328-H332 PolarHBondContact O-N 3.3Å; N329-H332 WeakPolarHBondContact O-CB 3.35Å; N329-H332 PolarHBondContact O-N 3.5Å; A330-H332 PolarHBondContact O-N 3.43Å; H332-A334 VanDerWaalsContact C-N 3.33Å; H332-A334 PolarHBondContact O-N 2.93Å; H332-L335 PolarHBondContact O-N 3.35Å; H332-Q336 PolarHBondContact CE1-NE2 2.8Å; H332-Q336 PolarHBondContact NE2-NE2 3.47Å; H332-Q336 WeakPolarHBondContact O-CG 3.48Å; H332-Q336 PolarHBondContact O-N 3.5Å
333N95.2Very high91.8Very high48 Ų4839.8 Ų39.826%0.25721%0.213SC..Hα-helixtrans-64.1-39.3177.1-65.5-16.6000111.6C316 H317 N329 A330 Q336 Y337C316-N333 HydrophobicContact CB-CB 4.22Å; H317-N333 PolarHBondContact O-ND2 3Å; N329-N333 VanDerWaalsContact O-CG 3.27Å; N329-N333 PolarHBondContact O-N 2.75Å; N329-N333 PolarHBondContact O-ND2 3.12Å; N329-N333 PolarHBondContact OD1-ND2 3.44Å; A330-N333 PolarHBondContact O-N 2.99Å; N333-Q336 PolarHBondContact O-N 3.04Å; N333-Y337 WeakPolarHBondContact O-CB 3.45Å; N333-Y337 PolarHBondContact O-N 2.87Å
334A95.8Very high90.5Very high0 Ų039.3 Ų39.30%022%0.221CC..Hα-helixtrans-61.6-45.3172.500000112.3L277 V306 L308 C316 A330 A331 H332 Q336 Y337 L338L277-A334 HydrophobicContact CD1-CB 4.4Å; L277-A334 HydrophobicContact CD2-CB 3.9Å; V306-A334 HydrophobicContact CG1-CB 3.78Å; L308-A334 HydrophobicContact CD1-CB 4.18Å; L308-A334 HydrophobicContact CD2-CB 4.31Å; C316-A334 HydrophobicContact CB-CB 4.17Å; A330-A334 PolarHBondContact O-N 2.91Å; A331-A334 WeakPolarHBondContact O-CB 3.44Å; A331-A334 PolarHBondContact O-N 2.79Å; H332-A334 VanDerWaalsContact C-N 3.33Å; H332-A334 PolarHBondContact O-N 2.93Å; A334-Q336 PolarHBondContact O-N 3.37Å; A334-Y337 WeakPolarHBondContact O-CB 3.45Å; A334-Y337 PolarHBondContact O-N 2.89Å; A334-L338 VanDerWaalsContact O-CG 3.32Å; A334-L338 WeakPolarHBondContact O-CG 3.43Å; A334-L338 PolarHBondContact O-N 2.77Å
335L94Very high88.2Confident0 Ų047.3 Ų47.30%025%0.25CC..Hα-helixtrans-63.5-39.2176.4-74.3166.4000112.4L260 L265 F273 L276 L277 L280 A331 H332 Y337 L338 K339L260-L335 HydrophobicContact CD1-CB 4.27Å; L260-L335 HydrophobicContact CD1-CD2 4.24Å; L260-L335 HydrophobicContact CD2-CD2 4.3Å; L265-L335 HydrophobicContact CD1-CB 3.79Å; L265-L335 HydrophobicContact CD2-CB 4.37Å; F273-L335 HydrophobicContact CB-CD1 4.07Å; F273-L335 HydrophobicContact CD1-CD1 3.9Å; F273-L335 HydrophobicContact CG-CD1 4.48Å; L276-L335 HydrophobicContact CB-CD1 4.14Å; L276-L335 HydrophobicContact CD2-CD1 3.92Å; L276-L335 HydrophobicContact CD2-CD2 4.5Å; L276-L335 HydrophobicContact CG-CD1 4.06Å; L276-L335 HydrophobicContact CG-CD2 4.21Å; L277-L335 HydrophobicContact CB-CD1 4.3Å; L277-L335 HydrophobicContact CB-CD2 4.19Å; L277-L335 HydrophobicContact CB-CG 4.12Å; L277-L335 HydrophobicContact CD1-CD2 3.98Å; L277-L335 HydrophobicContact CD1-CG 4.17Å; L280-L335 HydrophobicContact CD2-CD2 3.78Å; A331-L335 WeakPolarHBondContact O-CG 2.99Å; A331-L335 PolarHBondContact O-N 3.02Å; H332-L335 PolarHBondContact O-N 3.35Å; L335-Y337 VanDerWaalsContact C-N 3.33Å; L335-L338 PolarHBondContact O-N 3.37Å; L335-K339 WeakPolarHBondContact O-CB 3.3Å; L335-K339 PolarHBondContact O-N 3.3Å
336Q92.7Very high88.1Confident84 Ų8447.8 Ų47.839%0.39325%0.247SC..Hα-helixtrans-60.8-45.1173.5-75.8-170.1-700111.3L265 H332 N333 A334 K339 I340L265-Q336 HydrophobicContact CD1-CB 4.23Å; L265-Q336 HydrophobicContact CD1-CG 3.54Å; H332-Q336 PolarHBondContact CE1-NE2 2.8Å; H332-Q336 PolarHBondContact NE2-NE2 3.47Å; H332-Q336 WeakPolarHBondContact O-CG 3.48Å; H332-Q336 PolarHBondContact O-N 3.5Å; N333-Q336 PolarHBondContact O-N 3.04Å; A334-Q336 PolarHBondContact O-N 3.37Å; Q336-K339 WeakPolarHBondContact O-CB 3.46Å; Q336-K339 PolarHBondContact O-N 3.08Å; Q336-I340 WeakPolarHBondContact O-CG1 3.18Å; Q336-I340 PolarHBondContact O-N 3.37Å
337Y93.4Very high87.8Confident77 Ų7750.3 Ų50.330%0.30226%0.259SS..Hα-helixtrans-62.6-48.3177.4179.3-109.2000112W246 T314 N333 A334 L335 K339 I340 M341W246-Y337 AromaticContact CH2-CD1 3.65Å; W246-Y337 HydrophobicContact CH2-CD1 3.65Å; W246-Y337 AromaticContact CH2-CE1 2.95Å; W246-Y337 HydrophobicContact CH2-CE1 2.95Å; W246-Y337 AromaticContact CH2-CZ 3.57Å; W246-Y337 HydrophobicContact CZ2-CD1 4.35Å; W246-Y337 AromaticContact CZ2-CE1 3.25Å; W246-Y337 HydrophobicContact CZ2-CE1 3.25Å; W246-Y337 AromaticContact CZ2-CZ 3.48Å; W246-Y337 VanDerWaalsContact CZ2-CZ 3.48Å; W246-Y337 WeakPolarHBondContact CZ2-OH 3.44Å; W246-Y337 HydrophobicContact CZ3-CD1 4.41Å; W246-Y337 AromaticContact CZ3-CE1 3.97Å; W246-Y337 HydrophobicContact CZ3-CE1 3.97Å; T314-Y337 HydrophobicContact CG2-CD1 3.35Å; T314-Y337 HydrophobicContact CG2-CE1 3.27Å; T314-Y337 HydrophobicContact CG2-CG 4.32Å; T314-Y337 VanDerWaalsContact OG1-CE1 3.32Å; T314-Y337 WeakPolarHBondContact OG1-CE1 3.34Å; N333-Y337 WeakPolarHBondContact O-CB 3.45Å; N333-Y337 PolarHBondContact O-N 2.87Å; A334-Y337 WeakPolarHBondContact O-CB 3.45Å; A334-Y337 PolarHBondContact O-N 2.89Å; L335-Y337 VanDerWaalsContact C-N 3.33Å; Y337-K339 VanDerWaalsContact C-N 3.26Å; Y337-K339 PolarHBondContact O-N 3.09Å; Y337-I340 PolarHBondContact O-N 2.72Å; Y337-I340 VanDerWaalsContact O-N 3.16Å; Y337-M341 HydrophobicContact CD1-CG 4.49Å; Y337-M341 HydrophobicContact CD2-CG 4.3Å; Y337-M341 HydrophobicContact CE1-CG 4.21Å; Y337-M341 HydrophobicContact CE2-CG 3.91Å; Y337-M341 HydrophobicContact CE2-SD 4.19Å; Y337-M341 WeakPolarHBondContact O-CG 3.34Å; Y337-M341 PolarHBondContact O-N 3.31Å
338L92.9Very high87.5Confident0 Ų048.1 Ų48.10%026%0.255CS..Hα-helixtrans-58-39.3175.3-69.4174.7000111.9W246 L249 L260 L277 L280 F286 L308 T310 A334 L335 M341 A342W246-L338 HydrophobicContact CH2-CD2 4.3Å; W246-L338 HydrophobicContact CZ3-CD2 4.04Å; L249-L338 HydrophobicContact CD1-CD2 3.66Å; L260-L338 HydrophobicContact CD2-CB 4.13Å; L277-L338 HydrophobicContact CD1-CD1 3.74Å; L280-L338 HydrophobicContact CD2-CB 4.48Å; L280-L338 HydrophobicContact CD2-CD1 3.63Å; F286-L338 HydrophobicContact CE1-CD1 4.31Å; F286-L338 HydrophobicContact CE2-CD1 4.4Å; F286-L338 HydrophobicContact CZ-CD1 3.65Å; L308-L338 HydrophobicContact CD1-CD1 3.99Å; L308-L338 HydrophobicContact CD1-CD2 3.96Å; L308-L338 HydrophobicContact CD1-CG 3.99Å; T310-L338 HydrophobicContact CG2-CD2 4.33Å; A334-L338 VanDerWaalsContact O-CG 3.32Å; A334-L338 WeakPolarHBondContact O-CG 3.43Å; A334-L338 PolarHBondContact O-N 2.77Å; L335-L338 PolarHBondContact O-N 3.37Å; L338-M341 PolarHBondContact O-N 3.41Å; L338-A342 WeakPolarHBondContact O-CB 3.02Å; L338-A342 PolarHBondContact O-N 3.39Å
339K91.8Very high87.1Confident54 Ų5449.7 Ų49.724%0.23526%0.26CS..Hα-helixtrans-61.4-47.9175.2-175.9177.4-178.4166.20112.1L260 R261 H263 L335 Q336 Y337 M341 A342 G343L260-K339 HydrophobicContact CD1-CB 4.29Å; L260-K339 HydrophobicContact CD2-CB 4.15Å; L260-K339 HydrophobicContact CG-CB 3.93Å; L260-K339 HydrophobicContact CG-CG 4.35Å; L260-K339 VanDerWaalsContact O-CD 3.22Å; L260-K339 WeakPolarHBondContact O-CD 3.4Å; L260-K339 WeakPolarHBondContact O-CE 3.42Å; L260-K339 PolarHBondContact O-NZ 3.5Å; R261-K339 WeakPolarHBondContact O-CE 3.38Å; H263-K339 VanDerWaalsContact C-NZ 3.34Å; H263-K339 PolarHBondContact O-NZ 3.49Å; L335-K339 WeakPolarHBondContact O-CB 3.3Å; L335-K339 PolarHBondContact O-N 3.3Å; Q336-K339 WeakPolarHBondContact O-CB 3.46Å; Q336-K339 PolarHBondContact O-N 3.08Å; Y337-K339 VanDerWaalsContact C-N 3.26Å; Y337-K339 PolarHBondContact O-N 3.09Å; K339-M341 VanDerWaalsContact C-N 3.26Å; K339-M341 PolarHBondContact O-N 3.36Å; K339-A342 PolarHBondContact O-N 2.93Å; K339-G343 PolarHBondContact O-N 3.3Å
340I90.4Very high86.7Confident123 Ų12351.1 Ų51.163%0.63127%0.267SS*.Hα-helixtrans-58.7-43.7178.2-69.7164000109.9Q336 Y337 G343Q336-I340 WeakPolarHBondContact O-CG1 3.18Å; Q336-I340 PolarHBondContact O-N 3.37Å; Y337-I340 PolarHBondContact O-N 2.72Å; Y337-I340 VanDerWaalsContact O-N 3.16Å; I340-G343 PolarHBondContact O-N 2.92Å
341M88.1Confident86.1Confident42 Ų4254.5 Ų54.521%0.20729%0.285CS..Hα-helixtrans-77.1-29.4-175.4-62.2-61.3-73.800113.4W246 R250 Y337 L338 K339W246-M341 HydrophobicContact CB-CE 4.23Å; W246-M341 HydrophobicContact CD2-CB 3.91Å; W246-M341 HydrophobicContact CD2-CE 3.21Å; W246-M341 HydrophobicContact CD2-CG 4Å; W246-M341 HydrophobicContact CD2-SD 4.46Å; W246-M341 VanDerWaalsContact CE2-CE 3.43Å; W246-M341 HydrophobicContact CE3-CB 3.04Å; W246-M341 HydrophobicContact CE3-CE 3.69Å; W246-M341 HydrophobicContact CE3-CG 3.47Å; W246-M341 VanDerWaalsContact CE3-CG 3.47Å; W246-M341 HydrophobicContact CE3-SD 4.45Å; W246-M341 HydrophobicContact CG-CE 3.44Å; W246-M341 VanDerWaalsContact CG-CE 3.44Å; W246-M341 HydrophobicContact CH2-CB 4.13Å; W246-M341 HydrophobicContact CH2-CG 3.78Å; W246-M341 HydrophobicContact CZ2-CE 4.14Å; W246-M341 HydrophobicContact CZ2-CG 4.23Å; W246-M341 HydrophobicContact CZ3-CB 3.16Å; W246-M341 HydrophobicContact CZ3-CE 4.32Å; W246-M341 HydrophobicContact CZ3-CG 3.32Å; R250-M341 WeakPolarHBondContact CG-O 3.22Å; R250-M341 PolarHBondContact NH1-O 3.08Å; Y337-M341 HydrophobicContact CD1-CG 4.49Å; Y337-M341 HydrophobicContact CD2-CG 4.3Å; Y337-M341 HydrophobicContact CE1-CG 4.21Å; Y337-M341 HydrophobicContact CE2-CG 3.91Å; Y337-M341 HydrophobicContact CE2-SD 4.19Å; Y337-M341 WeakPolarHBondContact O-CG 3.34Å; Y337-M341 PolarHBondContact O-N 3.31Å; L338-M341 PolarHBondContact O-N 3.41Å; K339-M341 VanDerWaalsContact C-N 3.26Å; K339-M341 PolarHBondContact O-N 3.36Å
342A85.6Confident85.4Confident0 Ų058.4 Ų58.40%031%0.305CS..Hα-helixtrans-79.8-21.5173.800000113.5L249 I257 R261 L338 K339 G344L249-A342 HydrophobicContact CB-CB 4.28Å; I257-A342 HydrophobicContact CD1-CB 3.76Å; I257-A342 HydrophobicContact CG1-CB 4.16Å; R261-A342 HydrophobicContact CG-CB 4.24Å; L338-A342 WeakPolarHBondContact O-CB 3.02Å; L338-A342 PolarHBondContact O-N 3.39Å; K339-A342 PolarHBondContact O-N 2.93Å; A342-G344 PolarHBondContact O-N 3.35Å
343G75.6Confident84.7Confident39 Ų3962.2 Ų62.240%0.40233%0.325SS..SBendtrans-76.6102.9172.600000111.3K339 I340K339-G343 PolarHBondContact O-N 3.3Å; I340-G343 PolarHBondContact O-N 2.92Å
344G62.8Low83.9Confident54 Ų5463.3 Ų63.356%0.55733%0.331SS*.  trans-64.9139.9166.300000110.7A342A342-G344 PolarHBondContact O-N 3.35Å
345K43.4Very low82.8Confident287 Ų28769.1 Ų69.1100%1.24836%0.361SS*.  trans-640168-93.4-178.2173.9177.80111.4

Retrieved 345 of 345 residues in 206.2 ms (Link to these results)