A0A096N0G1_PAPAN Loading...

Epigen

Promotes the growth of epithelial cells. May stimulate the phosphorylation of EGFR and mitogen-activated protein kinases.

AlphaFold DB , UniProt , Accession A0A096N0G1, Species PAPAN (Papio anubis, Olive baboon), Gene EPGN, Length 154 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M49.5Very low62.3Low203 Ų203102.5 Ų102.5100%154%0.543SS*.  0-23.70-47-135-71.200115.3E4M1-E4 WeakPolarHBondContact CA-OE2 3.2Å
2A49.3Very low63.4Low33 Ų33103.1 Ų103.127%0.27355%0.546SS..  trans-107-7.8-174.400000115.5P6 Y132A2-P6 WeakPolarHBondContact O-CD 3.41Å; A2-Y132 PolarHBondContact O-OH 3.32Å
3L52.1Low64.3Low132 Ų132101.3 Ų101.369%0.69153%0.531SS*.SBendtrans-91-18.4170.5-82.5152.5000112.3P6 I7L3-P6 VanDerWaalsContact O-CD 3.28Å; L3-P6 WeakPolarHBondContact O-CD 3.45Å; L3-P6 VanDerWaalsContact O-CG 3.28Å; L3-P6 WeakPolarHBondContact O-CG 3.31Å; L3-I7 WeakPolarHBondContact O-CD1 3.2Å; L3-I7 WeakPolarHBondContact O-CG1 3.41Å; L3-I7 PolarHBondContact O-N 3.38Å
4E53.7Low65Low133 Ų13398.4 Ų98.462%0.62152%0.516SS*.Hα-helixtrans-75-34.4-176-68169.6149.400112.4M1 S8M1-E4 WeakPolarHBondContact CA-OE2 3.2Å; E4-S8 VanDerWaalsContact O-CB 3.24Å; E4-S8 WeakPolarHBondContact O-CB 3.36Å; E4-S8 PolarHBondContact O-N 3.47Å
5V56.8Low65.6Low96 Ų9695.1 Ų95.158%0.58251%0.509SS*.Hα-helixtrans-65-48.8177.7-173.90000112.8I7 S8 V9V5-I7 VanDerWaalsContact C-N 3.34Å; V5-I7 PolarHBondContact O-N 2.88Å; V5-S8 PolarHBondContact O-N 3.5Å; V5-V9 VanDerWaalsContact O-CG2 3.27Å; V5-V9 WeakPolarHBondContact O-CG2 3.29Å; V5-V9 PolarHBondContact O-N 2.77Å
6P61.5Low65.7Low68 Ų6896.6 Ų96.644%0.44251%0.514SS..Hα-helixtrans-67.8-32.9178.224.9-33.8000112.9A2 L3 Y10A2-P6 WeakPolarHBondContact O-CD 3.41Å; L3-P6 VanDerWaalsContact O-CD 3.28Å; L3-P6 WeakPolarHBondContact O-CD 3.45Å; L3-P6 VanDerWaalsContact O-CG 3.28Å; L3-P6 WeakPolarHBondContact O-CG 3.31Å; P6-Y10 VanDerWaalsContact O-CB 3.24Å; P6-Y10 WeakPolarHBondContact O-CB 3.46Å; P6-Y10 PolarHBondContact O-N 3.48Å
7I69.3Low65.9Low94 Ų9494.8 Ų94.848%0.48251%0.507SS..Hα-helixtrans-67.6-45.3175.1-64.3167.1000110L3 V5 V9 Y10 L11L3-I7 WeakPolarHBondContact O-CD1 3.2Å; L3-I7 WeakPolarHBondContact O-CG1 3.41Å; L3-I7 PolarHBondContact O-N 3.38Å; V5-I7 VanDerWaalsContact C-N 3.34Å; V5-I7 PolarHBondContact O-N 2.88Å; I7-V9 PolarHBondContact O-N 2.86Å; I7-Y10 PolarHBondContact O-N 3.34Å; I7-L11 HydrophobicContact CG2-CD1 3.84Å; I7-L11 HydrophobicContact CG2-CG 4.26Å; I7-L11 WeakPolarHBondContact O-CB 3.29Å; I7-L11 WeakPolarHBondContact O-CG 3.29Å; I7-L11 PolarHBondContact O-N 3.33Å
8S67.8Low66Low62 Ų6292.7 Ų92.743%0.43451%0.505SS..Hα-helixtrans-60.2-44.5177.1176.20000112E4 V5 L11 L12E4-S8 VanDerWaalsContact O-CB 3.24Å; E4-S8 WeakPolarHBondContact O-CB 3.36Å; E4-S8 PolarHBondContact O-N 3.47Å; V5-S8 PolarHBondContact O-N 3.5Å; S8-L11 PolarHBondContact O-N 2.84Å; S8-L12 VanDerWaalsContact O-CG 3.27Å; S8-L12 WeakPolarHBondContact O-CG 3.38Å; S8-L12 PolarHBondContact O-N 3.15Å
9V74.7Confident65.6Low52 Ų5293.8 Ų93.832%0.31551%0.51SS..Hα-helixtrans-64.8-41.8177.2169.30000111.9V5 I7 L12 F13 F125V5-V9 VanDerWaalsContact O-CG2 3.27Å; V5-V9 WeakPolarHBondContact O-CG2 3.29Å; V5-V9 PolarHBondContact O-N 2.77Å; I7-V9 PolarHBondContact O-N 2.86Å; V9-L12 PolarHBondContact O-N 3.45Å; V9-F13 PolarHBondContact O-N 2.95Å; V9-F125 HydrophobicContact CG1-CD1 4.14Å; V9-F125 HydrophobicContact CG1-CE1 3.26Å; V9-F125 HydrophobicContact CG1-CZ 3.8Å
10Y74Confident65.1Low150 Ų15093.8 Ų93.859%0.58851%0.513SS*.Hα-helixtrans-64.2-41.8176.3-178.3-106.9000111.9P6 I7 F13 N14P6-Y10 VanDerWaalsContact O-CB 3.24Å; P6-Y10 WeakPolarHBondContact O-CB 3.46Å; P6-Y10 PolarHBondContact O-N 3.48Å; I7-Y10 PolarHBondContact O-N 3.34Å; Y10-F13 PolarHBondContact O-N 3.38Å; Y10-N14 WeakPolarHBondContact CD1-ND2 3.36Å; Y10-N14 WeakPolarHBondContact CE1-ND2 3.38Å; Y10-N14 VanDerWaalsContact CZ-ND2 3.32Å; Y10-N14 WeakPolarHBondContact O-CB 3.43Å; Y10-N14 VanDerWaalsContact O-CG 3.31Å; Y10-N14 PolarHBondContact O-N 3.44Å; Y10-N14 PolarHBondContact O-ND2 3.31Å
11L77Confident64.5Low105 Ų10596.4 Ų96.455%0.5552%0.522SS..Hα-helixtrans-64.1-39.8175-70.8172.8000112I7 S8 N14 A15I7-L11 HydrophobicContact CG2-CD1 3.84Å; I7-L11 HydrophobicContact CG2-CG 4.26Å; I7-L11 WeakPolarHBondContact O-CB 3.29Å; I7-L11 WeakPolarHBondContact O-CG 3.29Å; I7-L11 PolarHBondContact O-N 3.33Å; S8-L11 PolarHBondContact O-N 2.84Å; L11-N14 PolarHBondContact O-N 2.93Å; L11-A15 VanDerWaalsContact O-CB 3.31Å; L11-A15 WeakPolarHBondContact O-CB 3.32Å; L11-A15 PolarHBondContact O-N 2.81Å
12L75.7Confident64.4Low109 Ų10993.3 Ų93.357%0.57151%0.505SS*.Hα-helixtrans-66-39.5175.8-72.5171.1000112S8 V9 A15 M16S8-L12 VanDerWaalsContact O-CG 3.27Å; S8-L12 WeakPolarHBondContact O-CG 3.38Å; S8-L12 PolarHBondContact O-N 3.15Å; V9-L12 PolarHBondContact O-N 3.45Å; L12-A15 PolarHBondContact O-N 2.83Å; L12-M16 WeakPolarHBondContact O-CG 3.24Å; L12-M16 PolarHBondContact O-N 2.97Å
13F75.1Confident64.1Low80 Ų8094.6 Ų94.635%0.35152%0.515SS..Hα-helixtrans-65.4-45.3176.4-164.7-95.4000111.4V9 Y10 A15 M16 T17 L121 F125V9-F13 PolarHBondContact O-N 2.95Å; Y10-F13 PolarHBondContact O-N 3.38Å; F13-A15 VanDerWaalsContact C-N 3.33Å; F13-A15 PolarHBondContact O-N 3.07Å; F13-M16 PolarHBondContact O-N 2.89Å; F13-T17 HydrophobicContact CD1-CG2 4.29Å; F13-T17 HydrophobicContact CE1-CG2 4.08Å; F13-T17 PolarHBondContact O-N 2.95Å; F13-T17 PolarHBondContact O-OG1 3.19Å; F13-L121 HydrophobicContact CE2-CD1 4.19Å; F13-F125 HydrophobicContact CD2-CE2 4.14Å; F13-F125 HydrophobicContact CE2-CE2 4.31Å
14N73.6Confident63.6Low61 Ų6192 Ų9233%0.32651%0.513SS..Hα-helixtrans-63-37.5175.6-71.2-21.6000112.6Y10 L11 T17 A18Y10-N14 WeakPolarHBondContact CD1-ND2 3.36Å; Y10-N14 WeakPolarHBondContact CE1-ND2 3.38Å; Y10-N14 VanDerWaalsContact CZ-ND2 3.32Å; Y10-N14 WeakPolarHBondContact O-CB 3.43Å; Y10-N14 VanDerWaalsContact O-CG 3.31Å; Y10-N14 PolarHBondContact O-N 3.44Å; Y10-N14 PolarHBondContact O-ND2 3.31Å; L11-N14 PolarHBondContact O-N 2.93Å; N14-T17 VanDerWaalsContact CA-OG1 3.27Å; N14-T17 WeakPolarHBondContact CA-OG1 3.32Å; N14-T17 PolarHBondContact O-N 3.41Å; N14-T17 PolarHBondContact O-OG1 3.17Å; N14-A18 WeakPolarHBondContact O-CB 3.27Å; N14-A18 PolarHBondContact O-N 2.82Å
15A73.7Confident62.9Low49 Ų4991.2 Ų91.241%0.40552%0.517SS..Hα-helixtrans-66.7-40.217600000111.7L11 L12 F13 A18 L19L11-A15 VanDerWaalsContact O-CB 3.31Å; L11-A15 WeakPolarHBondContact O-CB 3.32Å; L11-A15 PolarHBondContact O-N 2.81Å; L12-A15 PolarHBondContact O-N 2.83Å; F13-A15 VanDerWaalsContact C-N 3.33Å; F13-A15 PolarHBondContact O-N 3.07Å; A15-A18 PolarHBondContact O-N 3.33Å; A15-L19 WeakPolarHBondContact O-CG 3.28Å; A15-L19 PolarHBondContact O-N 2.85Å
16M68.1Low61.9Low119 Ų11992.3 Ų92.359%0.58652%0.524SS*.Hα-helixtrans-66.4-39.7175.2-77.1-61.2-64.700112.3L12 F13 L19 T20L12-M16 WeakPolarHBondContact O-CG 3.24Å; L12-M16 PolarHBondContact O-N 2.97Å; F13-M16 PolarHBondContact O-N 2.89Å; M16-L19 PolarHBondContact O-N 3.37Å; M16-L19 HydrophobicContact SD-CD1 4.41Å; M16-T20 PolarHBondContact O-N 2.87Å; M16-T20 VanDerWaalsContact O-N 3.1Å; M16-T20 PolarHBondContact O-OG1 3.45Å
17T67.6Low60.6Low66 Ų6694.8 Ų94.841%0.40554%0.538SS..Hα-helixtrans-64.8-39.4174.848.50000112F13 N14 T20 E21F13-T17 HydrophobicContact CD1-CG2 4.29Å; F13-T17 HydrophobicContact CE1-CG2 4.08Å; F13-T17 PolarHBondContact O-N 2.95Å; F13-T17 PolarHBondContact O-OG1 3.19Å; N14-T17 VanDerWaalsContact CA-OG1 3.27Å; N14-T17 WeakPolarHBondContact CA-OG1 3.32Å; N14-T17 PolarHBondContact O-N 3.41Å; N14-T17 PolarHBondContact O-OG1 3.17Å; T17-T20 PolarHBondContact O-N 3.15Å; T17-E21 PolarHBondContact O-N 3.41Å
18A68.8Low58.6Low57 Ų5796.1 Ų96.147%0.47155%0.55SS.*Hα-helixtrans-64.7-41176.100000112.3N14 A15 T20 E21 E22N14-A18 WeakPolarHBondContact O-CB 3.27Å; N14-A18 PolarHBondContact O-N 2.82Å; A15-A18 PolarHBondContact O-N 3.33Å; A18-T20 PolarHBondContact O-N 3.47Å; A18-E21 PolarHBondContact O-N 3.36Å; A18-E22 PolarHBondContact O-N 3.01Å
19L58.8Low57Low114 Ų11497.6 Ų97.660%0.59756%0.559SS**Hα-helixtrans-65.6-27.5175.2-76163.1000113.2A15 M16 A23A15-L19 WeakPolarHBondContact O-CG 3.28Å; A15-L19 PolarHBondContact O-N 2.85Å; M16-L19 PolarHBondContact O-N 3.37Å; M16-L19 HydrophobicContact SD-CD1 4.41Å; L19-A23 PolarHBondContact O-N 2.84Å
20T55.3Low54.9Low93 Ų93100.8 Ų100.857%0.57158%0.58SS**Hα-helixtrans-75.3-29.9178.6-44.50000111.5M16 T17 A18 A24M16-T20 PolarHBondContact O-N 2.87Å; M16-T20 VanDerWaalsContact O-N 3.1Å; M16-T20 PolarHBondContact O-OG1 3.45Å; T17-T20 PolarHBondContact O-N 3.15Å; A18-T20 PolarHBondContact O-N 3.47Å; T20-A24 PolarHBondContact O-N 3Å
21E51.7Low52.9Low149 Ų149101.5 Ų101.570%0.69659%0.592SS**Hα-helixtrans-69.3-40.2173.3-63.5-118.6143.100111.7T17 A18 A23 A24T17-E21 PolarHBondContact O-N 3.41Å; A18-E21 PolarHBondContact O-N 3.36Å; E21-A23 VanDerWaalsContact C-N 3.33Å; E21-A23 PolarHBondContact O-N 3.09Å; E21-A24 PolarHBondContact O-N 3.46Å
22E46.9Very low50.5Low137 Ų137101.7 Ų101.764%0.6460%0.598SS**Hα-helixtrans-69.6-28.9177.8-61-64.2147.200112.7A18 V25A18-E22 PolarHBondContact O-N 3.01Å; E22-V25 PolarHBondContact O-N 3.45Å
23A44.2Very low48.6Very low60 Ų60101 Ų10150%0.49661%0.609SS.*Hα-helixtrans-73.7-28.8175.600000112.8L19 E21 V25 T26L19-A23 PolarHBondContact O-N 2.84Å; E21-A23 VanDerWaalsContact C-N 3.33Å; E21-A23 PolarHBondContact O-N 3.09Å; A23-V25 PolarHBondContact O-N 2.9Å; A23-T26 PolarHBondContact O-N 3.43Å
24A41Very low46.4Very low77 Ų77106.1 Ų106.164%0.63663%0.633SS**Hα-helixtrans-67.9-21.9176.500000112.7T20 E21T20-A24 PolarHBondContact O-N 3Å; E21-A24 PolarHBondContact O-N 3.46Å
25V39.9Very low44.4Very low117 Ų117110.5 Ų110.571%0.70965%0.652SS**THydrogen-bonded Turntrans-80.6-14.4-179.6178.20000112.9E22 A23E22-V25 PolarHBondContact O-N 3.45Å; A23-V25 PolarHBondContact O-N 2.9Å
26T34.8Very low42.4Very low119 Ų119111.5 Ų111.573%0.7367%0.667SS**SBendtrans-110.34-170.8-36.60000115A23A23-T26 PolarHBondContact O-N 3.43Å
27V34.6Very low40.6Very low121 Ų121111.6 Ų111.673%0.73367%0.67SS**  trans-120.863.9175.8-165.50000110.9
28T28.1Very low39.2Very low122 Ų122119.6 Ų119.675%0.74869%0.693SS**  trans-135.197.4155.9-51.70000108.1
29P33.8Very low37.2Very low93 Ų93121.3 Ų121.360%0.60470%0.698SS**  trans-64.3141.3165.226.1-30.1000108.9I31P29-I31 PolarHBondContact O-N 2.89Å
30P30.5Very low36.1Very low119 Ų119122.3 Ų122.377%0.77371%0.708SS**  trans-69.9105.8179.729.7-31.3000108T32P30-T32 VanDerWaalsContact C-N 3.28Å; P30-T32 PolarHBondContact O-N 3.34Å
31I31.1Very low34.9Very low164 Ų164123.5 Ų123.584%0.84171%0.711SS**  trans-7793.2168-60179.4000106.6P29 A33P29-I31 PolarHBondContact O-N 2.89Å; I31-A33 PolarHBondContact O-N 3.3Å
32T27.3Very low34.2Very low110 Ų110125.2 Ų125.268%0.67572%0.716SS**  trans-48124.5160.8-55.80000109.2P30 Q34P30-T32 VanDerWaalsContact C-N 3.28Å; P30-T32 PolarHBondContact O-N 3.34Å; T32-Q34 PolarHBondContact O-N 3.25Å
33A35.8Very low33.4Very low95 Ų95124.5 Ų124.579%0.78572%0.721SS**  trans-56.8103.3164.800000108.9I31 Q35I31-A33 PolarHBondContact O-N 3.3Å; A33-Q35 PolarHBondContact O-N 3Å
34Q29.6Very low33.5Very low187 Ų187130.2 Ų130.287%0.87474%0.738SS**  trans-82.791167.1-103.7-131.10.600108.6T32 G36T32-Q34 PolarHBondContact O-N 3.25Å; Q34-G36 PolarHBondContact O-N 3.45Å; Q34-G36 VanDerWaalsContact O-N 3.16Å
35Q30.8Very low33.1Very low152 Ų152130.8 Ų130.871%0.7174%0.742SS**  trans-68.899162.7179165.3-20.400108.6A33 N37A33-Q35 PolarHBondContact O-N 3Å; Q35-N37 VanDerWaalsContact C-N 3.29Å; Q35-N37 WeakPolarHBondContact CG-OD1 3.39Å; Q35-N37 PolarHBondContact NE2-ND2 3.32Å; Q35-N37 PolarHBondContact NE2-OD1 3.47Å; Q35-N37 PolarHBondContact O-N 3.46Å
36G32.6Very low32.6Very low71 Ų71132 Ų13273%0.73275%0.745SS**  trans-74.881167.200000110.4Q34 W38Q34-G36 PolarHBondContact O-N 3.45Å; Q34-G36 VanDerWaalsContact O-N 3.16Å; G36-W38 PolarHBondContact O-N 3.5Å
37N29.6Very low33.1Very low120 Ų120133 Ų13364%0.64275%0.746SS**  trans-71.4103165.8-80.70000108.6Q35Q35-N37 VanDerWaalsContact C-N 3.29Å; Q35-N37 WeakPolarHBondContact CG-OD1 3.39Å; Q35-N37 PolarHBondContact NE2-ND2 3.32Å; Q35-N37 PolarHBondContact NE2-OD1 3.47Å; Q35-N37 PolarHBondContact O-N 3.46Å
38W38.4Very low33.2Very low234 Ų234133.4 Ų133.489%0.88675%0.748SS**  trans-92.5100.4158.5-166.6-77.8000108.5G36 V40G36-W38 PolarHBondContact O-N 3.5Å; W38-V40 PolarHBondContact O-N 2.97Å
39T25.7Very low33.8Very low94 Ų94135.7 Ų135.758%0.57775%0.75SS**  trans-56.5124.7165.843.60000108.9N41T39-N41 VanDerWaalsContact CB-OD1 3.23Å; T39-N41 WeakPolarHBondContact CB-OD1 3.28Å; T39-N41 PolarHBondContact O-N 2.83Å; T39-N41 PolarHBondContact O-OD1 3.37Å; T39-N41 PolarHBondContact OG1-OD1 2.96Å
40V36.7Very low34.4Very low134 Ų134134.8 Ų134.881%0.81276%0.759SS**  trans-71.889.1166.11730000106.5W38 K42W38-V40 PolarHBondContact O-N 2.97Å; V40-K42 VanDerWaalsContact C-N 3.3Å; V40-K42 PolarHBondContact O-N 2.93Å
41N29.4Very low35Very low118 Ų118132.6 Ų132.663%0.63174%0.744SS**  trans-75.690.1171.6-46.413000106.2T39 T43T39-N41 VanDerWaalsContact CB-OD1 3.23Å; T39-N41 WeakPolarHBondContact CB-OD1 3.28Å; T39-N41 PolarHBondContact O-N 2.83Å; T39-N41 PolarHBondContact O-OD1 3.37Å; T39-N41 PolarHBondContact OG1-OD1 2.96Å; N41-T43 VanDerWaalsContact C-N 3.29Å; N41-T43 PolarHBondContact O-N 3.37Å
42K38.5Very low35.9Very low185 Ų185131 Ų13180%0.80474%0.736SS**  trans-76.289.4166.6-170.6166.8179.9160.50107.3V40V40-K42 VanDerWaalsContact C-N 3.3Å; V40-K42 PolarHBondContact O-N 2.93Å
43T30.2Very low36.9Very low122 Ų122128.9 Ų128.975%0.74873%0.73SS**  trans-109.9111.4166.7-50.60000107.4N41N41-T43 VanDerWaalsContact C-N 3.29Å; N41-T43 PolarHBondContact O-N 3.37Å
44E45.4Very low37.6Very low180 Ų180129.7 Ų129.784%0.84172%0.72SS**  trans-62.9127.9165.9-74.1177.5144.500109.7
45A31.4Very low38.7Very low89 Ų89128.7 Ų128.774%0.73671%0.713SS**  trans-151.996.1157.800000104.5
46D30.4Very low39.9Very low143 Ų143124 Ų12477%0.76569%0.69SS**  62.2106.387.3-160.133.1000113.2
47N46Very low40.9Very low141 Ų141123 Ų12375%0.75467%0.672SS**  trans26119.6162.1-65.9-66.1000120.5
48V36Very low42.2Very low128 Ų128121.5 Ų121.578%0.77666%0.661SS**  163.6132120.3162.60000108.6
49E39.6Very low43.3Very low170 Ų170115.3 Ų115.379%0.79465%0.645SS**SBendtrans70.5112.8176.5-128.475.9-147.500116.8
50G47.1Very low45.1Very low75 Ų75113.6 Ų113.677%0.77364%0.636SS**  trans-53.3125.8177.900000111.9
51P42.3Very low46.2Very low73 Ų73113.2 Ų113.247%0.47463%0.629SS.*  trans-90.3129.4-146.932.5-33000111.2A53 L54P51-A53 HydrophobicContact CB-CB 4.24Å; P51-A53 PolarHBondContact O-N 3.45Å; P51-L54 HydrophobicContact CG-CB 4.36Å; P51-L54 HydrophobicContact CG-CD1 4.36Å; P51-L54 WeakPolarHBondContact O-CB 3.21Å; P51-L54 PolarHBondContact O-N 3.38Å
52I50.9Low47.4Very low129 Ų129113 Ų11366%0.66262%0.624SS**Hα-helixtrans-46.1-27.6168.2-64.7159.5000112.1L54 K55 F56I52-L54 VanDerWaalsContact C-N 3.28Å; I52-L54 PolarHBondContact O-N 2.96Å; I52-K55 PolarHBondContact O-N 3.3Å; I52-F56 HydrophobicContact CG2-CD2 3.67Å; I52-F56 HydrophobicContact CG2-CE2 3.22Å; I52-F56 HydrophobicContact CG2-CZ 4.13Å; I52-F56 VanDerWaalsContact O-CD2 3.23Å; I52-F56 WeakPolarHBondContact O-CD2 3.34Å; I52-F56 PolarHBondContact O-N 2.97Å
53A49.1Very low48.2Very low67 Ų67109.6 Ų109.655%0.55462%0.615SS**Hα-helixtrans-56.1-34.7172.400000114.3P51 F56 S57P51-A53 HydrophobicContact CB-CB 4.24Å; P51-A53 PolarHBondContact O-N 3.45Å; A53-F56 PolarHBondContact O-N 2.86Å; A53-S57 PolarHBondContact O-N 3.07Å; A53-S57 PolarHBondContact O-OG 3.22Å
54L50.7Low48.9Very low111 Ų111111.5 Ų111.558%0.58162%0.615SS**Hα-helixtrans-71.7-32.4-179.3-124.6163.5000111.9P51 I52 S57 H58P51-L54 HydrophobicContact CG-CB 4.36Å; P51-L54 HydrophobicContact CG-CD1 4.36Å; P51-L54 WeakPolarHBondContact O-CB 3.21Å; P51-L54 PolarHBondContact O-N 3.38Å; I52-L54 VanDerWaalsContact C-N 3.28Å; I52-L54 PolarHBondContact O-N 2.96Å; L54-S57 VanDerWaalsContact C-OG 3.24Å; L54-S57 VanDerWaalsContact CA-OG 3.23Å; L54-S57 WeakPolarHBondContact CA-OG 3.25Å; L54-S57 PolarHBondContact O-OG 3.35Å; L54-H58 PolarHBondContact O-N 2.96Å
55K52.3Low49.2Very low167 Ų167110.1 Ų110.173%0.72661%0.613SS**Hα-helixtrans-73-36.4175.9-160178.2-178-173.60111.5I52 H58I52-K55 PolarHBondContact O-N 3.3Å; K55-H58 WeakPolarHBondContact O-CB 3.18Å; K55-H58 PolarHBondContact O-N 3.07Å
56F54.5Low50.7Low52 Ų52109.5 Ų109.523%0.22860%0.603CS.*Hα-helixtrans-74.7-33.9175.1-69.3-53.8000113.1I52 A53 H58 L59 F75I52-F56 HydrophobicContact CG2-CD2 3.67Å; I52-F56 HydrophobicContact CG2-CE2 3.22Å; I52-F56 HydrophobicContact CG2-CZ 4.13Å; I52-F56 VanDerWaalsContact O-CD2 3.23Å; I52-F56 WeakPolarHBondContact O-CD2 3.34Å; I52-F56 PolarHBondContact O-N 2.97Å; A53-F56 PolarHBondContact O-N 2.86Å; F56-H58 PolarHBondContact O-N 3.47Å; F56-L59 HydrophobicContact CD1-CD1 4.06Å; F56-L59 WeakPolarHBondContact O-CB 3.27Å; F56-L59 PolarHBondContact O-N 3.43Å; F56-F75 HydrophobicContact CB-CD1 3.97Å; F56-F75 HydrophobicContact CB-CD2 4.43Å; F56-F75 HydrophobicContact CB-CE1 4.22Å; F56-F75 HydrophobicContact CB-CG 4.08Å; F56-F75 AromaticContact CD1-CD1 3.79Å; F56-F75 HydrophobicContact CD1-CD1 3.79Å; F56-F75 HydrophobicContact CD1-CD2 4.1Å; F56-F75 AromaticContact CD1-CE1 3.15Å; F56-F75 HydrophobicContact CD1-CE1 3.15Å; F56-F75 AromaticContact CD1-CE2 3.53Å; F56-F75 HydrophobicContact CD1-CE2 3.53Å; F56-F75 HydrophobicContact CD1-CG 4.22Å; F56-F75 AromaticContact CD1-CZ 3Å; F56-F75 HydrophobicContact CD1-CZ 3Å; F56-F75 HydrophobicContact CD2-CD1 4.37Å; F56-F75 HydrophobicContact CD2-CE1 4.05Å; F56-F75 HydrophobicContact CE1-CD1 4.35Å; F56-F75 AromaticContact CE1-CE1 3.31Å; F56-F75 HydrophobicContact CE1-CE1 3.31Å; F56-F75 AromaticContact CE1-CE2 3.99Å; F56-F75 HydrophobicContact CE1-CE2 3.99Å; F56-F75 AromaticContact CE1-CZ 3.08Å; F56-F75 HydrophobicContact CE1-CZ 3.08Å; F56-F75 HydrophobicContact CE2-CE1 4.12Å; F56-F75 AromaticContact CG-CD1 3.81Å; F56-F75 HydrophobicContact CG-CD1 3.81Å; F56-F75 AromaticContact CG-CE1 3.57Å; F56-F75 HydrophobicContact CG-CE1 3.57Å; F56-F75 HydrophobicContact CG-CE2 4.4Å; F56-F75 HydrophobicContact CG-CG 4.32Å; F56-F75 AromaticContact CG-CZ 3.9Å; F56-F75 HydrophobicContact CG-CZ 3.9Å; F56-F75 AromaticContact CZ-CE1 3.8Å; F56-F75 HydrophobicContact CZ-CE1 3.8Å; F56-F75 AromaticContact CZ-CZ 3.99Å; F56-F75 HydrophobicContact CZ-CZ 3.99Å
57S55Low52.8Low50 Ų50106.2 Ų106.235%0.3558%0.581SS.*Hα-helixtrans-62.3-33.1169.250.10000112A53 L54 L59 C60 L61A53-S57 PolarHBondContact O-N 3.07Å; A53-S57 PolarHBondContact O-OG 3.22Å; L54-S57 VanDerWaalsContact C-OG 3.24Å; L54-S57 VanDerWaalsContact CA-OG 3.23Å; L54-S57 WeakPolarHBondContact CA-OG 3.25Å; L54-S57 PolarHBondContact O-OG 3.35Å; S57-L59 PolarHBondContact O-N 2.94Å; S57-C60 CarbonylContact O-C 3.49Å; S57-C60 WeakPolarHBondContact O-CA 3.48Å; S57-C60 PolarHBondContact O-N 3.5Å; S57-L61 WeakPolarHBondContact O-CB 3.23Å; S57-L61 PolarHBondContact O-N 3.49Å
58H57Low54.4Low90 Ų9099.8 Ų99.842%0.41755%0.547SS..Hα-helixtrans-57.9-33.1176.1-134-90.4000113L54 K55 F56 C60 L61 E62L54-H58 PolarHBondContact O-N 2.96Å; K55-H58 WeakPolarHBondContact O-CB 3.18Å; K55-H58 PolarHBondContact O-N 3.07Å; F56-H58 PolarHBondContact O-N 3.47Å; H58-C60 PolarHBondContact O-N 3.44Å; H58-L61 PolarHBondContact O-N 3.41Å; H58-L61 VanDerWaalsContact O-N 3.11Å; H58-E62 IonicContact CD2-OE2 3.29Å; H58-E62 IonicContact CE1-OE1 2.88Å; H58-E62 PolarHBondContact CE1-OE1 2.97Å; H58-E62 IonicContact CE1-OE2 3.36Å; H58-E62 PolarHBondContact CE1-OE2 3.36Å; H58-E62 IonicContact CG-OE2 3.93Å; H58-E62 IonicContact ND1-OE2 3.33Å; H58-E62 PolarHBondContact ND1-OE2 2.95Å; H58-E62 IonicContact NE2-OE2 2.78Å; H58-E62 PolarHBondContact NE2-OE2 2.91Å; H58-E62 PolarHBondContact O-N 3.34Å
59L60.3Low56.8Low104 Ų10497.6 Ų97.655%0.54553%0.53SS..Hα-helixtrans-65.9-25.1174.9-75.2157.8000113.3F56 S57 F75F56-L59 HydrophobicContact CD1-CD1 4.06Å; F56-L59 WeakPolarHBondContact O-CB 3.27Å; F56-L59 PolarHBondContact O-N 3.43Å; S57-L59 PolarHBondContact O-N 2.94Å; L59-F75 HydrophobicContact CD1-CD2 4.03Å; L59-F75 HydrophobicContact CD1-CE2 3.51Å; L59-F75 HydrophobicContact CD1-CZ 4.34Å
60C63.2Low59Low57 Ų5791.5 Ų91.539%0.38550%0.503SS..Hα-helixtrans-98.6-7.7172-70.40000112.8S57 H58 C73S57-C60 CarbonylContact O-C 3.49Å; S57-C60 WeakPolarHBondContact O-CA 3.48Å; S57-C60 PolarHBondContact O-N 3.5Å; H58-C60 PolarHBondContact O-N 3.44Å; C60-C73 HydrophobicContact CB-CB 3.81Å; C60-C73 WeakPolarHBondContact CB-SG 3.4Å; C60-C73 WeakPolarHBondContact SG-CB 3.5Å; C60-C73 CovalentContact SG-SG 2.06Å; C60-C73 PolarHBondContact SG-SG 3.34Å
61L61.4Low60.7Low127 Ų12788.6 Ų88.667%0.66547%0.473SS*.Hα-helixtrans-115.9-26.7-167.2-161.9137.3000113.7S57 H58 D63S57-L61 WeakPolarHBondContact O-CB 3.23Å; S57-L61 PolarHBondContact O-N 3.49Å; H58-L61 PolarHBondContact O-N 3.41Å; H58-L61 VanDerWaalsContact O-N 3.11Å; L61-D63 PolarHBondContact O-N 3.47Å
62E53.3Low62.7Low114 Ų11487.6 Ų87.653%0.53347%0.471SS..SBendtrans-86.888.2-178.4-143.176.2169.100111.7H58H58-E62 IonicContact CD2-OE2 3.29Å; H58-E62 IonicContact CE1-OE1 2.88Å; H58-E62 PolarHBondContact CE1-OE1 2.97Å; H58-E62 IonicContact CE1-OE2 3.36Å; H58-E62 PolarHBondContact CE1-OE2 3.36Å; H58-E62 IonicContact CG-OE2 3.93Å; H58-E62 IonicContact ND1-OE2 3.33Å; H58-E62 PolarHBondContact ND1-OE2 2.95Å; H58-E62 IonicContact NE2-OE2 2.78Å; H58-E62 PolarHBondContact NE2-OE2 2.91Å; H58-E62 PolarHBondContact O-N 3.34Å
63D56Low64.1Low113 Ų11383.7 Ų83.760%0.60446%0.455SS*.SBend61.784.6126.4-141.54.4000117.2L61L61-D63 PolarHBondContact O-N 3.47Å
64H45.9Very low65.4Low162 Ų16281.8 Ų81.875%0.7544%0.439SS*.SBend164.490.7115.7-70.9-32.9000107
65N50.6Low66.4Low151 Ų15178.2 Ų78.281%0.80742%0.419SS*.SBendtrans7084.7174.9-130.620.5000115.3Y67N65-Y67 PolarHBondContact O-N 3.25Å
66S63.9Low67.3Low76 Ų7674 Ų7453%0.53140%0.401SS..  trans17.197.8164.462.40000115.9C68S66-C68 VanDerWaalsContact CB-O 3.25Å; S66-C68 WeakPolarHBondContact CB-O 3.27Å; S66-C68 CarbonylContact O-C 3.49Å; S66-C68 VanDerWaalsContact O-C 3.28Å; S66-C68 PolarHBondContact O-N 2.96Å; S66-C68 PolarHBondContact OG-O 2.97Å
67Y72.9Confident67.6Low73 Ų7378.1 Ų78.129%0.28642%0.421SS..SBendtrans-44.6-40.3174.6172.2-110.5000111.7N65 A82 C84 E93 R94N65-Y67 PolarHBondContact O-N 3.25Å; Y67-A82 HydrophobicContact CD1-CB 4.44Å; Y67-A82 HydrophobicContact CE1-CB 4.42Å; Y67-C84 WeakPolarHBondContact CD1-SG 3.2Å; Y67-C84 WeakPolarHBondContact CE1-SG 3.39Å; Y67-E93 PolarHBondContact OH-OE1 3.22Å; Y67-R94 HydrophobicContact CD2-CG 4.31Å; Y67-R94 HydrophobicContact CE2-CG 3.93Å; Y67-R94 WeakPolarHBondContact O-CB 3.42Å; Y67-R94 WeakPolarHBondContact O-CG 3.47Å; Y67-R94 PolarHBondContact O-NE 2.98Å; Y67-R94 PolarHBondContact O-NH2 3.22Å
68C81.1Confident67.8Low7 Ų784.1 Ų84.15%0.04744%0.443CS..SBendtrans-90.9117.8167.4-47.30000110.4S66 G71 C84S66-C68 VanDerWaalsContact CB-O 3.25Å; S66-C68 WeakPolarHBondContact CB-O 3.27Å; S66-C68 CarbonylContact O-C 3.49Å; S66-C68 VanDerWaalsContact O-C 3.28Å; S66-C68 PolarHBondContact O-N 2.96Å; S66-C68 PolarHBondContact OG-O 2.97Å; C68-G71 WeakPolarHBondContact CB-O 3.24Å; C68-C84 WeakPolarHBondContact CA-SG 3.43Å; C68-C84 HydrophobicContact CB-CB 3.73Å; C68-C84 WeakPolarHBondContact CB-SG 3.27Å; C68-C84 WeakPolarHBondContact SG-CA 3.33Å; C68-C84 WeakPolarHBondContact SG-CB 3.31Å; C68-C84 CovalentContact SG-SG 2.03Å; C68-C84 PolarHBondContact SG-SG 2.87Å
69I85.1Confident68Low82 Ų8285.1 Ų85.142%0.42145%0.451SS..SBendtrans-75-51.6-177.3-53.9-178.2000110.2R94 E96I69-R94 PolarHBondContact N-O 3.03Å; I69-E96 HydrophobicContact CD1-CB 3.75Å
70N85.8Confident68.3Low41 Ų4187.3 Ų87.322%0.21946%0.459CS..SBendtrans-124.554.9-178.9-57.2-69.7000110.8F87 Y90 C95N70-F87 HydrophobicContact CB-CD2 4.46Å; N70-F87 WeakPolarHBondContact O-CD2 2.97Å; N70-F87 WeakPolarHBondContact O-CG 3.44Å; N70-F87 PolarHBondContact O-N 2.94Å; N70-Y90 HydrophobicContact CB-CD1 3.56Å; N70-Y90 HydrophobicContact CB-CD2 3.72Å; N70-Y90 HydrophobicContact CB-CE1 3.82Å; N70-Y90 HydrophobicContact CB-CE2 3.97Å; N70-Y90 HydrophobicContact CB-CG 3.5Å; N70-Y90 VanDerWaalsContact CB-CG 3.5Å; N70-Y90 VanDerWaalsContact ND2-CD1 3.29Å; N70-Y90 WeakPolarHBondContact ND2-CD1 3.44Å; N70-Y90 WeakPolarHBondContact ND2-CE1 3.18Å; N70-C95 HydrophobicContact CB-CB 4.29Å; N70-C95 PolarHBondContact ND2-O 3.27Å
71G83.7Confident68.5Low14 Ų1489.6 Ų89.614%0.14446%0.462CS..EExtended strand (participates in β ladder)trans-170.3173.9-176.800000113.9C68 R85C68-G71 WeakPolarHBondContact CB-O 3.24Å; G71-R85 CarbonylContact C-O 3.43Å; G71-R85 WeakPolarHBondContact CA-O 3.49Å
72A83.4Confident69Low53 Ų5384.2 Ų84.244%0.43844%0.436SS..EExtended strand (participates in β ladder)trans-94.9133.3176.400000111R85A72-R85 PolarHBondContact N-O 3.47Å; A72-R85 PolarHBondContact O-N 3.46Å
73C81.1Confident70.3Confident47 Ų4782 Ų8232%0.31843%0.427SS..EExtended strand (participates in β ladder)trans-76.2130.3173.3-166.90000110C60C60-C73 HydrophobicContact CB-CB 3.81Å; C60-C73 WeakPolarHBondContact CB-SG 3.4Å; C60-C73 WeakPolarHBondContact SG-CB 3.5Å; C60-C73 CovalentContact SG-SG 2.06Å; C60-C73 PolarHBondContact SG-SG 3.34Å
74A77.1Confident71.7Confident26 Ų2677.4 Ų77.422%0.21540%0.404CS..EExtended strand (participates in β ladder)trans-130.9137.2172.900000109.5I83A74-I83 PolarHBondContact N-O 3.26Å; A74-I83 PolarHBondContact O-N 3.38Å; A74-I83 VanDerWaalsContact O-O 3.12Å
75F71.7Confident73.6Confident37 Ų3778.3 Ų78.316%0.16240%0.4CS..EExtended strand (participates in β ladder)trans-89.4128.1176.6-172.9-100.5000110.3F56 L59 E80F56-F75 HydrophobicContact CB-CD1 3.97Å; F56-F75 HydrophobicContact CB-CD2 4.43Å; F56-F75 HydrophobicContact CB-CE1 4.22Å; F56-F75 HydrophobicContact CB-CG 4.08Å; F56-F75 AromaticContact CD1-CD1 3.79Å; F56-F75 HydrophobicContact CD1-CD1 3.79Å; F56-F75 HydrophobicContact CD1-CD2 4.1Å; F56-F75 AromaticContact CD1-CE1 3.15Å; F56-F75 HydrophobicContact CD1-CE1 3.15Å; F56-F75 AromaticContact CD1-CE2 3.53Å; F56-F75 HydrophobicContact CD1-CE2 3.53Å; F56-F75 HydrophobicContact CD1-CG 4.22Å; F56-F75 AromaticContact CD1-CZ 3Å; F56-F75 HydrophobicContact CD1-CZ 3Å; F56-F75 HydrophobicContact CD2-CD1 4.37Å; F56-F75 HydrophobicContact CD2-CE1 4.05Å; F56-F75 HydrophobicContact CE1-CD1 4.35Å; F56-F75 AromaticContact CE1-CE1 3.31Å; F56-F75 HydrophobicContact CE1-CE1 3.31Å; F56-F75 AromaticContact CE1-CE2 3.99Å; F56-F75 HydrophobicContact CE1-CE2 3.99Å; F56-F75 AromaticContact CE1-CZ 3.08Å; F56-F75 HydrophobicContact CE1-CZ 3.08Å; F56-F75 HydrophobicContact CE2-CE1 4.12Å; F56-F75 AromaticContact CG-CD1 3.81Å; F56-F75 HydrophobicContact CG-CD1 3.81Å; F56-F75 AromaticContact CG-CE1 3.57Å; F56-F75 HydrophobicContact CG-CE1 3.57Å; F56-F75 HydrophobicContact CG-CE2 4.4Å; F56-F75 HydrophobicContact CG-CG 4.32Å; F56-F75 AromaticContact CG-CZ 3.9Å; F56-F75 HydrophobicContact CG-CZ 3.9Å; F56-F75 AromaticContact CZ-CE1 3.8Å; F56-F75 HydrophobicContact CZ-CE1 3.8Å; F56-F75 AromaticContact CZ-CZ 3.99Å; F56-F75 HydrophobicContact CZ-CZ 3.99Å; L59-F75 HydrophobicContact CD1-CD2 4.03Å; L59-F75 HydrophobicContact CD1-CE2 3.51Å; L59-F75 HydrophobicContact CD1-CZ 4.34Å; F75-E80 VanDerWaalsContact CE2-C 3.47Å; F75-E80 VanDerWaalsContact CZ-C 3.43Å; F75-E80 HydrophobicContact CZ-CB 4.37Å
76H70.4Confident75.4Confident78 Ų7873.5 Ų73.536%0.36138%0.378SS..EExtended strand (participates in β ladder)trans-98.9112.8177-159.9-19000110.2E78 L79 E80 K81 I83H76-E78 VanDerWaalsContact C-N 3.33Å; H76-E78 PolarHBondContact O-N 3.09Å; H76-L79 HydrophobicContact CB-CD1 4.32Å; H76-L79 WeakPolarHBondContact CD2-CD1 3.19Å; H76-L79 PolarHBondContact O-N 3.4Å; H76-E80 PolarHBondContact O-N 3.47Å; H76-E80 VanDerWaalsContact O-N 3.12Å; H76-K81 PolarHBondContact N-O 3.42Å; H76-I83 HydrophobicContact CB-CD1 3.58Å; H76-I83 HydrophobicContact CB-CG1 4.24Å
77H60.4Low76.5Confident139 Ų13975.6 Ų75.664%0.64438%0.378SS*.THydrogen-bonded Turntrans-61.7-31.3-172.7-75.3-72.7000115.4
78E59.8Low76.8Confident175 Ų17579 Ų7982%0.81841%0.406SS*.THydrogen-bonded Turntrans-82.4-29.1-178-63.7-173.1177.900113.7H76H76-E78 VanDerWaalsContact C-N 3.33Å; H76-E78 PolarHBondContact O-N 3.09Å
79L61.1Low76.7Confident111 Ų11180.4 Ų80.458%0.58142%0.421SS*.THydrogen-bonded Turntrans-95.9-4179.5-68.599.2000112.7H76 K81H76-L79 HydrophobicContact CB-CD1 4.32Å; H76-L79 WeakPolarHBondContact CD2-CD1 3.19Å; H76-L79 PolarHBondContact O-N 3.4Å; L79-K81 HydrophobicContact CB-CB 4.46Å; L79-K81 PolarHBondContact O-N 3.01Å
80E65.4Low76.6Confident151 Ų15180.3 Ų80.371%0.70642%0.416SS*.THydrogen-bonded Turntrans49.229.3-174.3-61.6-176.1158.900113.8F75 H76F75-E80 VanDerWaalsContact CE2-C 3.47Å; F75-E80 VanDerWaalsContact CZ-C 3.43Å; F75-E80 HydrophobicContact CZ-CB 4.37Å; H76-E80 PolarHBondContact O-N 3.47Å; H76-E80 VanDerWaalsContact O-N 3.12Å
81K67.4Low76.4Confident105 Ų10581.5 Ų81.546%0.45743%0.425SS..EExtended strand (participates in β ladder)trans-128.1148.5-173.2-164.9-176.1169.5-169.80111.7H76 L79 E93H76-K81 PolarHBondContact N-O 3.42Å; L79-K81 HydrophobicContact CB-CB 4.46Å; L79-K81 PolarHBondContact O-N 3.01Å; K81-E93 IonicContact NZ-OE1 3.92Å; K81-E93 PolarHBondContact NZ-OE1 3.1Å
82A73.6Confident76.4Confident13 Ų1382.5 Ų82.511%0.10744%0.436CS..EExtended strand (participates in β ladder)trans-74.4136.9168.300000111.2Y67Y67-A82 HydrophobicContact CD1-CB 4.44Å; Y67-A82 HydrophobicContact CE1-CB 4.42Å
83I80Confident76.4Confident69 Ų6986 Ų8635%0.35444%0.443SS..EExtended strand (participates in β ladder)trans-128.6145.1179.8-57.2-178.7000109A74 H76A74-I83 PolarHBondContact N-O 3.26Å; A74-I83 PolarHBondContact O-N 3.38Å; A74-I83 VanDerWaalsContact O-O 3.12Å; H76-I83 HydrophobicContact CB-CD1 3.58Å; H76-I83 HydrophobicContact CB-CG1 4.24Å
84C85.8Confident76.5Confident16 Ų1688 Ų8811%0.10844%0.444CS..EExtended strand (participates in β ladder)trans-97133176.6-63.50000112.7Y67 C68 E93Y67-C84 WeakPolarHBondContact CD1-SG 3.2Å; Y67-C84 WeakPolarHBondContact CE1-SG 3.39Å; C68-C84 WeakPolarHBondContact CA-SG 3.43Å; C68-C84 HydrophobicContact CB-CB 3.73Å; C68-C84 WeakPolarHBondContact CB-SG 3.27Å; C68-C84 WeakPolarHBondContact SG-CA 3.33Å; C68-C84 WeakPolarHBondContact SG-CB 3.31Å; C68-C84 CovalentContact SG-SG 2.03Å; C68-C84 PolarHBondContact SG-SG 2.87Å; C84-E93 WeakPolarHBondContact CB-O 3.48Å
85R85.9Confident77Confident181 Ų18186.8 Ų86.868%0.68343%0.434SS*.EExtended strand (participates in β ladder)trans-100.3108.3165.9-69.9-176.9173.4151.2-0.9109.2G71 A72G71-R85 CarbonylContact C-O 3.43Å; G71-R85 WeakPolarHBondContact CA-O 3.49Å; A72-R85 PolarHBondContact N-O 3.47Å; A72-R85 PolarHBondContact O-N 3.46Å
86C87.4Confident77.7Confident49 Ų4990.7 Ų90.733%0.33145%0.453SS..EExtended strand (participates in β ladder)trans-73.3144.6-174.6-53.90000113.2Y90 C95C86-Y90 WeakPolarHBondContact CB-O 3.38Å; C86-C95 WeakPolarHBondContact CA-SG 3.5Å; C86-C95 HydrophobicContact CB-CB 3.65Å; C86-C95 WeakPolarHBondContact CB-SG 3.43Å; C86-C95 PolarHBondContact N-SG 3.48Å; C86-C95 VanDerWaalsContact N-SG 3.41Å; C86-C95 WeakPolarHBondContact SG-CA 3.05Å; C86-C95 WeakPolarHBondContact SG-CB 3.44Å; C86-C95 CovalentContact SG-SG 2.03Å; C86-C95 PolarHBondContact SG-SG 3.18Å
87F86.4Confident78.3Confident121 Ų12190.8 Ų90.853%0.53145%0.453SS..PPolyproline II helixtrans-68.3159.8169.2-61.5-32.5000111.3N70 G89 Y90N70-F87 HydrophobicContact CB-CD2 4.46Å; N70-F87 WeakPolarHBondContact O-CD2 2.97Å; N70-F87 WeakPolarHBondContact O-CG 3.44Å; N70-F87 PolarHBondContact O-N 2.94Å; F87-G89 PolarHBondContact O-N 2.88Å; F87-Y90 HydrophobicContact CB-CD2 4.25Å; F87-Y90 PolarHBondContact O-N 3.04Å
88T80.8Confident79.2Confident145 Ų14588.5 Ų88.589%0.8945%0.445SS*.THydrogen-bonded Turntrans-54.9124.4179.251.60000110.5
89G77.4Confident79.7Confident35 Ų3582.3 Ų82.336%0.36142%0.419SS..THydrogen-bonded Turntrans89.110.3-17800000114.9F87 L98 T99F87-G89 PolarHBondContact O-N 2.88Å; G89-L98 CarbonylContact O-C 3.28Å; G89-L98 WeakPolarHBondContact O-CA 2.82Å; G89-L98 WeakPolarHBondContact O-CD1 3.35Å; G89-T99 VanDerWaalsContact CA-OG1 3.27Å; G89-T99 WeakPolarHBondContact CA-OG1 2.91Å; G89-T99 PolarHBondContact O-N 3.24Å; G89-T99 PolarHBondContact O-OG1 3.25Å; G89-T99 VanDerWaalsContact O-OG1 3.08Å
90Y84.1Confident79.7Confident80 Ų8082.8 Ų82.831%0.31442%0.422SS..EExtended strand (participates in β ladder)trans-124.2151.8169.4-65-90.2000112.5N70 C86 F87 H97 L98 T99N70-Y90 HydrophobicContact CB-CD1 3.56Å; N70-Y90 HydrophobicContact CB-CD2 3.72Å; N70-Y90 HydrophobicContact CB-CE1 3.82Å; N70-Y90 HydrophobicContact CB-CE2 3.97Å; N70-Y90 HydrophobicContact CB-CG 3.5Å; N70-Y90 VanDerWaalsContact CB-CG 3.5Å; N70-Y90 VanDerWaalsContact ND2-CD1 3.29Å; N70-Y90 WeakPolarHBondContact ND2-CD1 3.44Å; N70-Y90 WeakPolarHBondContact ND2-CE1 3.18Å; C86-Y90 WeakPolarHBondContact CB-O 3.38Å; F87-Y90 HydrophobicContact CB-CD2 4.25Å; F87-Y90 PolarHBondContact O-N 3.04Å; Y90-H97 CarbonylContact C-O 3.54Å; Y90-H97 WeakPolarHBondContact CA-O 3.03Å; Y90-L98 HydrophobicContact CD1-CD1 3.87Å; Y90-L98 HydrophobicContact CD2-CD1 4.48Å; Y90-L98 HydrophobicContact CE1-CD1 3.33Å; Y90-L98 HydrophobicContact CE2-CD1 4.03Å; Y90-L98 HydrophobicContact CG-CD1 4.42Å; Y90-L98 VanDerWaalsContact CZ-CD1 3.43Å; Y90-T99 PolarHBondContact N-OG1 3.21Å; Y90-T99 VanDerWaalsContact N-OG1 3.12Å
91T82.3Confident79.2Confident66 Ų6679.3 Ų79.341%0.40541%0.411SS..EExtended strand (participates in β ladder)trans-147.2170.2179.5-1720000111.4C95 E96 H97T91-C95 CarbonylContact O-C 3.44Å; T91-C95 WeakPolarHBondContact O-CA 3.01Å; T91-E96 PolarHBondContact O-N 3.21Å; T91-H97 HydrophobicContact CG2-CB 3.89Å; T91-H97 PolarHBondContact N-O 3.4Å; T91-H97 WeakPolarHBondContact O-CB 3.26Å; T91-H97 PolarHBondContact O-N 3.35Å
92G82.9Confident78.7Confident36 Ų3677.6 Ų77.637%0.37141%0.412SS..SBendtrans105.1163.3-176.200000113.6R94 C95G92-R94 PolarHBondContact O-N 3.4Å; G92-R94 VanDerWaalsContact O-N 3.13Å; G92-C95 PolarHBondContact O-N 2.68Å; G92-C95 VanDerWaalsContact O-N 3.08Å
93E82.9Confident77.6Confident126 Ų12685.8 Ų85.859%0.58944%0.441SS*.THydrogen-bonded Turntrans-56.4-32.5-178.1-174.5178.9177.600112.1Y67 K81 C84Y67-E93 PolarHBondContact OH-OE1 3.22Å; K81-E93 IonicContact NZ-OE1 3.92Å; K81-E93 PolarHBondContact NZ-OE1 3.1Å; C84-E93 WeakPolarHBondContact CB-O 3.48Å
94R84.4Confident76.4Confident89 Ų8984.8 Ų84.834%0.33644%0.443SS..THydrogen-bonded Turntrans-1139.7179-61.6-17864.8-152-3114.1Y67 I69 G92 E96Y67-R94 HydrophobicContact CD2-CG 4.31Å; Y67-R94 HydrophobicContact CE2-CG 3.93Å; Y67-R94 WeakPolarHBondContact O-CB 3.42Å; Y67-R94 WeakPolarHBondContact O-CG 3.47Å; Y67-R94 PolarHBondContact O-NE 2.98Å; Y67-R94 PolarHBondContact O-NH2 3.22Å; I69-R94 PolarHBondContact N-O 3.03Å; G92-R94 PolarHBondContact O-N 3.4Å; G92-R94 VanDerWaalsContact O-N 3.13Å; R94-E96 VanDerWaalsContact C-N 3.27Å; R94-E96 PolarHBondContact O-N 2.81Å
95C86.5Confident75.1Confident0 Ų087 Ų870%046%0.456CS..SBendtrans58.837.2-176.1-46.10000113.6N70 C86 T91 G92N70-C95 HydrophobicContact CB-CB 4.29Å; N70-C95 PolarHBondContact ND2-O 3.27Å; C86-C95 WeakPolarHBondContact CA-SG 3.5Å; C86-C95 HydrophobicContact CB-CB 3.65Å; C86-C95 WeakPolarHBondContact CB-SG 3.43Å; C86-C95 PolarHBondContact N-SG 3.48Å; C86-C95 VanDerWaalsContact N-SG 3.41Å; C86-C95 WeakPolarHBondContact SG-CA 3.05Å; C86-C95 WeakPolarHBondContact SG-CB 3.44Å; C86-C95 CovalentContact SG-SG 2.03Å; C86-C95 PolarHBondContact SG-SG 3.18Å; T91-C95 CarbonylContact O-C 3.44Å; T91-C95 WeakPolarHBondContact O-CA 3.01Å; G92-C95 PolarHBondContact O-N 2.68Å; G92-C95 VanDerWaalsContact O-N 3.08Å
96E85.8Confident73.9Confident120 Ų12083.2 Ų83.256%0.56145%0.45SS*.  trans-82.7-21.8-177.864.6-154.9-154.500113.5I69 T91 R94I69-E96 HydrophobicContact CD1-CB 3.75Å; T91-E96 PolarHBondContact O-N 3.21Å; R94-E96 VanDerWaalsContact C-N 3.27Å; R94-E96 PolarHBondContact O-N 2.81Å
97H83.6Confident72.7Confident80 Ų8082.9 Ų82.937%0.3745%0.448SS..EExtended strand (participates in β ladder)trans-102.9135.5-173.4-168.663.7000111.7Y90 T91 T101Y90-H97 CarbonylContact C-O 3.54Å; Y90-H97 WeakPolarHBondContact CA-O 3.03Å; T91-H97 HydrophobicContact CG2-CB 3.89Å; T91-H97 PolarHBondContact N-O 3.4Å; T91-H97 WeakPolarHBondContact O-CB 3.26Å; T91-H97 PolarHBondContact O-N 3.35Å; H97-T101 PolarHBondContact CD2-OG1 3.39Å; H97-T101 WeakPolarHBondContact NE2-CG2 3.36Å; H97-T101 PolarHBondContact NE2-OG1 3.01Å
98L79.5Confident71.9Confident91 Ų9182.2 Ų82.248%0.47644%0.442SS..EExtended strand (participates in β ladder)trans-80.2136.4174.5-158.376.4000109.4G89 Y90 L100G89-L98 CarbonylContact O-C 3.28Å; G89-L98 WeakPolarHBondContact O-CA 2.82Å; G89-L98 WeakPolarHBondContact O-CD1 3.35Å; Y90-L98 HydrophobicContact CD1-CD1 3.87Å; Y90-L98 HydrophobicContact CD2-CD1 4.48Å; Y90-L98 HydrophobicContact CE1-CD1 3.33Å; Y90-L98 HydrophobicContact CE2-CD1 4.03Å; Y90-L98 HydrophobicContact CG-CD1 4.42Å; Y90-L98 VanDerWaalsContact CZ-CD1 3.43Å; L98-L100 PolarHBondContact O-N 3.43Å
99T70.1Confident71.6Confident45 Ų4580.5 Ų80.528%0.27643%0.425SS..THydrogen-bonded Turntrans-69.633.5-177.7-46.30000113.5G89 Y90 T101G89-T99 VanDerWaalsContact CA-OG1 3.27Å; G89-T99 WeakPolarHBondContact CA-OG1 2.91Å; G89-T99 PolarHBondContact O-N 3.24Å; G89-T99 PolarHBondContact O-OG1 3.25Å; G89-T99 VanDerWaalsContact O-OG1 3.08Å; Y90-T99 PolarHBondContact N-OG1 3.21Å; Y90-T99 VanDerWaalsContact N-OG1 3.12Å; T99-T101 VanDerWaalsContact C-N 3.35Å
100L61.6Low71.6Confident121 Ų12185.3 Ų85.363%0.63444%0.435SS*.Hα-helixtrans-71.8-34.6169.2-153.8177.2000110.2L98 S102 A104L98-L100 PolarHBondContact O-N 3.43Å; L100-S102 PolarHBondContact O-N 3.44Å; L100-A104 HydrophobicContact CD2-CB 4.34Å; L100-A104 VanDerWaalsContact O-CB 3.29Å; L100-A104 WeakPolarHBondContact O-CB 2.97Å; L100-A104 PolarHBondContact O-N 3.48Å
101T55.6Low71.5Confident78 Ų7889 Ų8948%0.47945%0.45SS..Hα-helixtrans-79.6-13-174.960.70000114.6H97 T99 V105H97-T101 PolarHBondContact CD2-OG1 3.39Å; H97-T101 WeakPolarHBondContact NE2-CG2 3.36Å; H97-T101 PolarHBondContact NE2-OG1 3.01Å; T99-T101 VanDerWaalsContact C-N 3.35Å; T101-V105 WeakPolarHBondContact O-CB 3.24Å; T101-V105 WeakPolarHBondContact O-CG2 3.24Å
102S55.2Low71.7Confident68 Ų6889.9 Ų89.948%0.47645%0.451SS..Hα-helixtrans-100-39.8178.2-167.90000112.4L100 V105 D106L100-S102 PolarHBondContact O-N 3.44Å; S102-V105 PolarHBondContact O-N 3.28Å; S102-D106 PolarHBondContact O-N 3.3Å
103Y51.3Low71.9Confident185 Ų18591.2 Ų91.273%0.72546%0.459SS*.Hα-helixtrans-73.2-35.6-179.9-172.4-99.5000112.2V105 S107Y103-V105 PolarHBondContact O-N 3.35Å; Y103-S107 VanDerWaalsContact O-CB 3.24Å; Y103-S107 WeakPolarHBondContact O-CB 3.31Å; Y103-S107 PolarHBondContact O-N 3.37Å
104A55.6Low72.2Confident48 Ų4890.2 Ų90.240%0.39746%0.456SS..Hα-helixtrans-66-31.1171.700000111.4L100 Y108L100-A104 HydrophobicContact CD2-CB 4.34Å; L100-A104 VanDerWaalsContact O-CB 3.29Å; L100-A104 WeakPolarHBondContact O-CB 2.97Å; L100-A104 PolarHBondContact O-N 3.48Å; A104-Y108 VanDerWaalsContact O-CB 3.31Å; A104-Y108 WeakPolarHBondContact O-CB 3.49Å; A104-Y108 WeakPolarHBondContact O-CD1 3.29Å; A104-Y108 VanDerWaalsContact O-CG 3.31Å; A104-Y108 PolarHBondContact O-N 3.37Å
105V57.5Low72.5Confident62 Ų6288.1 Ų88.138%0.37646%0.462SS..Hα-helixtrans-86.2-30.1-174.1177.10000113.4T101 S102 Y103 Y108 E109T101-V105 WeakPolarHBondContact O-CB 3.24Å; T101-V105 WeakPolarHBondContact O-CG2 3.24Å; S102-V105 PolarHBondContact O-N 3.28Å; Y103-V105 PolarHBondContact O-N 3.35Å; V105-Y108 HydrophobicContact CB-CD1 4.25Å; V105-Y108 HydrophobicContact CB-CE1 3.65Å; V105-Y108 HydrophobicContact CG1-CD1 4.46Å; V105-Y108 HydrophobicContact CG1-CE1 3.46Å; V105-Y108 VanDerWaalsContact CG1-CE1 3.46Å; V105-Y108 HydrophobicContact CG2-CE1 3.95Å; V105-Y108 WeakPolarHBondContact O-CD1 3.36Å; V105-Y108 WeakPolarHBondContact O-CE1 3.37Å; V105-E109 WeakPolarHBondContact O-CG 3Å
106D60.2Low72.8Confident103 Ų10393 Ų9355%0.55149%0.488SS*.Hα-helixtrans-82.9-24.8175.2-144.1-27.6000112.3S102 K110S102-D106 PolarHBondContact O-N 3.3Å; D106-K110 IonicContact OD1-NZ 3.99Å
107S64.1Low73.1Confident41 Ų4188.8 Ų88.829%0.28748%0.476SS..Hα-helixtrans-81.3-46.9-178.8-164.20000112.2Y103 E109 Y111Y103-S107 VanDerWaalsContact O-CB 3.24Å; Y103-S107 WeakPolarHBondContact O-CB 3.31Å; Y103-S107 PolarHBondContact O-N 3.37Å; S107-E109 PolarHBondContact O-N 3.34Å; S107-Y111 WeakPolarHBondContact O-CD2 3.44Å; S107-Y111 WeakPolarHBondContact O-CE2 3.48Å; S107-Y111 WeakPolarHBondContact OG-CE2 3.27Å
108Y69.6Low73.5Confident107 Ų10788.4 Ų88.442%0.4248%0.479SS..Hα-helixtrans-64.8-33-176.782-43.7000114.5A104 V105 K110 Y111 I112A104-Y108 VanDerWaalsContact O-CB 3.31Å; A104-Y108 WeakPolarHBondContact O-CB 3.49Å; A104-Y108 WeakPolarHBondContact O-CD1 3.29Å; A104-Y108 VanDerWaalsContact O-CG 3.31Å; A104-Y108 PolarHBondContact O-N 3.37Å; V105-Y108 HydrophobicContact CB-CD1 4.25Å; V105-Y108 HydrophobicContact CB-CE1 3.65Å; V105-Y108 HydrophobicContact CG1-CD1 4.46Å; V105-Y108 HydrophobicContact CG1-CE1 3.46Å; V105-Y108 VanDerWaalsContact CG1-CE1 3.46Å; V105-Y108 HydrophobicContact CG2-CE1 3.95Å; V105-Y108 WeakPolarHBondContact O-CD1 3.36Å; V105-Y108 WeakPolarHBondContact O-CE1 3.37Å; Y108-K110 VanDerWaalsContact C-N 3.3Å; Y108-K110 PolarHBondContact O-N 2.78Å; Y108-Y111 PolarHBondContact O-N 3.27Å; Y108-I112 HydrophobicContact CD2-CD1 3.36Å; Y108-I112 HydrophobicContact CE2-CD1 3.85Å; Y108-I112 HydrophobicContact CG-CD1 3.98Å; Y108-I112 WeakPolarHBondContact O-CB 3.36Å; Y108-I112 WeakPolarHBondContact O-CD1 3.39Å; Y108-I112 WeakPolarHBondContact O-CG1 3.38Å; Y108-I112 PolarHBondContact O-N 3.41Å
109E73.4Confident74.2Confident110 Ų11085.9 Ų85.951%0.51448%0.476SS..Hα-helixtrans-62.9-39.3-177-66-170.117200111.9V105 S107 I112 A113V105-E109 WeakPolarHBondContact O-CG 3Å; S107-E109 PolarHBondContact O-N 3.34Å; E109-I112 PolarHBondContact O-N 3.4Å; E109-A113 PolarHBondContact O-N 3.36Å; E109-A113 VanDerWaalsContact O-N 3.09Å
110K76.8Confident75.4Confident135 Ų13589.5 Ų89.559%0.58749%0.493SS*.Hα-helixtrans-64.6-43.4177.3-66172.4-175.8159.20111.1D106 Y108 I114D106-K110 IonicContact OD1-NZ 3.99Å; Y108-K110 VanDerWaalsContact C-N 3.3Å; Y108-K110 PolarHBondContact O-N 2.78Å; K110-I114 WeakPolarHBondContact O-CD1 3.21Å; K110-I114 VanDerWaalsContact O-CG1 3.26Å; K110-I114 WeakPolarHBondContact O-CG1 3.42Å; K110-I114 PolarHBondContact O-N 2.81Å
111Y83.3Confident76.8Confident159 Ų15987.9 Ų87.962%0.62448%0.484SS*.Hα-helixtrans-71.4-33.1178.4-64.1-67.9000113.1S107 Y108 I114 G115S107-Y111 WeakPolarHBondContact O-CD2 3.44Å; S107-Y111 WeakPolarHBondContact O-CE2 3.48Å; S107-Y111 WeakPolarHBondContact OG-CE2 3.27Å; Y108-Y111 PolarHBondContact O-N 3.27Å; Y111-I114 PolarHBondContact O-N 3.43Å; Y111-G115 PolarHBondContact O-N 3.38Å
112I86.4Confident78.5Confident83 Ų8388.8 Ų88.843%0.42649%0.486SS..Hα-helixtrans-63.6-46.8175.1-70.1163.2000110.3Y108 E109 I114 G115 I116Y108-I112 HydrophobicContact CD2-CD1 3.36Å; Y108-I112 HydrophobicContact CE2-CD1 3.85Å; Y108-I112 HydrophobicContact CG-CD1 3.98Å; Y108-I112 WeakPolarHBondContact O-CB 3.36Å; Y108-I112 WeakPolarHBondContact O-CD1 3.39Å; Y108-I112 WeakPolarHBondContact O-CG1 3.38Å; Y108-I112 PolarHBondContact O-N 3.41Å; E109-I112 PolarHBondContact O-N 3.4Å; I112-I114 PolarHBondContact O-N 3.38Å; I112-G115 PolarHBondContact O-N 3.29Å; I112-I116 HydrophobicContact CG2-CD1 3.89Å; I112-I116 WeakPolarHBondContact O-CG1 3.47Å; I112-I116 PolarHBondContact O-N 3.12Å
113A86.6Confident80.4Confident65 Ų6588.8 Ų88.854%0.53749%0.486SS..Hα-helixtrans-60.9-44.217800000112E109 I116 G117E109-A113 PolarHBondContact O-N 3.36Å; E109-A113 VanDerWaalsContact O-N 3.09Å; A113-I116 PolarHBondContact O-N 3.02Å; A113-G117 PolarHBondContact O-N 3.08Å
114I89Confident82.3Confident104 Ų10481.4 Ų81.453%0.53347%0.466SS..Hα-helixtrans-62.5-45175.9-65.5165000110.7K110 Y111 I112 I116 G117 V118K110-I114 WeakPolarHBondContact O-CD1 3.21Å; K110-I114 VanDerWaalsContact O-CG1 3.26Å; K110-I114 WeakPolarHBondContact O-CG1 3.42Å; K110-I114 PolarHBondContact O-N 2.81Å; Y111-I114 PolarHBondContact O-N 3.43Å; I112-I114 PolarHBondContact O-N 3.38Å; I114-I116 PolarHBondContact O-N 3.03Å; I114-G117 PolarHBondContact O-N 3.13Å; I114-V118 HydrophobicContact CG2-CG2 4.28Å; I114-V118 WeakPolarHBondContact O-CG2 3.4Å; I114-V118 PolarHBondContact O-N 3.12Å
115G90.8Very high83.8Confident45 Ų4582.9 Ų82.946%0.46446%0.463SS..Hα-helixtrans-59.7-43.4179.800000112.9Y111 I112 G119Y111-G115 PolarHBondContact O-N 3.38Å; I112-G115 PolarHBondContact O-N 3.29Å; G115-G119 PolarHBondContact O-N 3.08Å
116I93.6Very high85.4Confident103 Ų10385.6 Ų85.653%0.52848%0.475SS..Hα-helixtrans-64.8-44.8176.2-65.1166.3000110.6I112 A113 I114 G119 L120I112-I116 HydrophobicContact CG2-CD1 3.89Å; I112-I116 WeakPolarHBondContact O-CG1 3.47Å; I112-I116 PolarHBondContact O-N 3.12Å; A113-I116 PolarHBondContact O-N 3.02Å; I114-I116 PolarHBondContact O-N 3.03Å; I116-G119 PolarHBondContact O-N 2.76Å; I116-L120 HydrophobicContact CG2-CD1 3.89Å; I116-L120 HydrophobicContact CG2-CG 4.31Å; I116-L120 WeakPolarHBondContact O-CB 3.12Å; I116-L120 WeakPolarHBondContact O-CG 3Å; I116-L120 PolarHBondContact O-N 3.4Å
117G91.8Very high86.9Confident31 Ų3184.8 Ų84.832%0.3247%0.474SS..Hα-helixtrans-58.4-50.8178.300000112.5A113 I114 G119 L120 L121A113-G117 PolarHBondContact O-N 3.08Å; I114-G117 PolarHBondContact O-N 3.13Å; G117-G119 PolarHBondContact O-N 2.91Å; G117-L120 PolarHBondContact O-N 3.01Å; G117-L121 VanDerWaalsContact O-CG 3.27Å; G117-L121 WeakPolarHBondContact O-CG 3.3Å; G117-L121 PolarHBondContact O-N 2.03Å
118V91.9Very high88Confident72 Ų7288.1 Ų88.144%0.43649%0.487SS..Hα-helixtrans-63.7-42.4178.6176.30000111.2I114 L120 L121 L122I114-V118 HydrophobicContact CG2-CG2 4.28Å; I114-V118 WeakPolarHBondContact O-CG2 3.4Å; I114-V118 PolarHBondContact O-N 3.12Å; V118-L120 PolarHBondContact O-N 3.35Å; V118-L121 PolarHBondContact O-N 3.02Å; V118-L122 HydrophobicContact CG1-CD1 3.87Å; V118-L122 HydrophobicContact CG1-CG 4.34Å; V118-L122 WeakPolarHBondContact O-CG 3.47Å; V118-L122 PolarHBondContact O-N 2.73Å
119G93.8Very high88.9Confident39 Ų3989.2 Ų89.240%0.40249%0.494SS..Hα-helixtrans-61.3-44.2178.300000113.1G115 I116 G117 S123G115-G119 PolarHBondContact O-N 3.08Å; I116-G119 PolarHBondContact O-N 2.76Å; G117-G119 PolarHBondContact O-N 2.91Å; G119-S123 WeakPolarHBondContact O-CB 3.49Å; G119-S123 PolarHBondContact O-N 2.77Å
120L95.3Very high89.5Confident121 Ų12190.8 Ų90.863%0.63450%0.496SS*.Hα-helixtrans-66.8-40177.4-71.4175.8000112.2I116 G117 V118 G124I116-L120 HydrophobicContact CG2-CD1 3.89Å; I116-L120 HydrophobicContact CG2-CG 4.31Å; I116-L120 WeakPolarHBondContact O-CB 3.12Å; I116-L120 WeakPolarHBondContact O-CG 3Å; I116-L120 PolarHBondContact O-N 3.4Å; G117-L120 PolarHBondContact O-N 3.01Å; V118-L120 PolarHBondContact O-N 3.35Å; L120-G124 PolarHBondContact O-N 2.06Å
121L91.6Very high90.1Very high87 Ų8787.6 Ų87.646%0.45549%0.49SS..Hα-helixtrans-62.7-51.8176.6-71.5170.1000111F13 G117 V118 S123 G124 F125F13-L121 HydrophobicContact CE2-CD1 4.19Å; G117-L121 VanDerWaalsContact O-CG 3.27Å; G117-L121 WeakPolarHBondContact O-CG 3.3Å; G117-L121 PolarHBondContact O-N 2.03Å; V118-L121 PolarHBondContact O-N 3.02Å; L121-S123 PolarHBondContact O-N 2.98Å; L121-G124 PolarHBondContact O-N 2.86Å; L121-F125 HydrophobicContact CB-CE2 4.31Å; L121-F125 WeakPolarHBondContact O-CD2 2.99Å; L121-F125 WeakPolarHBondContact O-CG 3.35Å; L121-F125 PolarHBondContact O-N 2.03Å
122L91.4Very high90.2Very high97 Ų9784.1 Ų84.151%0.50848%0.477SS..Hα-helixtrans-61.9-44.2179.1-70.3174.6000112.2V118 F125 L126V118-L122 HydrophobicContact CG1-CD1 3.87Å; V118-L122 HydrophobicContact CG1-CG 4.34Å; V118-L122 WeakPolarHBondContact O-CG 3.47Å; V118-L122 PolarHBondContact O-N 2.73Å; L122-F125 PolarHBondContact O-N 3.41Å; L122-L126 WeakPolarHBondContact O-CG 3.38Å; L122-L126 PolarHBondContact O-N 2.88Å
123S93.8Very high89.9Confident68 Ų6883.7 Ų83.748%0.47647%0.474SS..Hα-helixtrans-59.6-47.1175.7179.50000111.8G119 L121 F125 L126 V127G119-S123 WeakPolarHBondContact O-CB 3.49Å; G119-S123 PolarHBondContact O-N 2.77Å; L121-S123 PolarHBondContact O-N 2.98Å; S123-F125 PolarHBondContact O-N 3.02Å; S123-L126 PolarHBondContact O-N 2.81Å; S123-V127 WeakPolarHBondContact O-CG2 3.25Å; S123-V127 PolarHBondContact O-N 2.85Å
124G91.5Very high89.6Confident30 Ų3087.9 Ų87.931%0.30948%0.477SS..Hα-helixtrans-59.6-44.917700000112.6L120 L121 L126 V127 I128L120-G124 PolarHBondContact O-N 2.06Å; L121-G124 PolarHBondContact O-N 2.86Å; G124-L126 PolarHBondContact O-N 3Å; G124-V127 PolarHBondContact O-N 3.44Å; G124-I128 VanDerWaalsContact O-CG1 3.29Å; G124-I128 WeakPolarHBondContact O-CG1 3.42Å; G124-I128 PolarHBondContact O-N 3.37Å
125F88.4Confident89.2Confident78 Ų7889.8 Ų89.834%0.34248%0.481SS..Hα-helixtrans-62.9-42176.2-73.5-55.8000112.7V9 F13 L121 L122 S123 V127 I128 F129V9-F125 HydrophobicContact CG1-CD1 4.14Å; V9-F125 HydrophobicContact CG1-CE1 3.26Å; V9-F125 HydrophobicContact CG1-CZ 3.8Å; F13-F125 HydrophobicContact CD2-CE2 4.14Å; F13-F125 HydrophobicContact CE2-CE2 4.31Å; L121-F125 HydrophobicContact CB-CE2 4.31Å; L121-F125 WeakPolarHBondContact O-CD2 2.99Å; L121-F125 WeakPolarHBondContact O-CG 3.35Å; L121-F125 PolarHBondContact O-N 2.03Å; L122-F125 PolarHBondContact O-N 3.41Å; S123-F125 PolarHBondContact O-N 3.02Å; F125-V127 VanDerWaalsContact C-N 3.34Å; F125-V127 PolarHBondContact O-N 3.31Å; F125-I128 PolarHBondContact O-N 2.95Å; F125-F129 VanDerWaalsContact O-CB 3.25Å; F125-F129 WeakPolarHBondContact O-CB 2.97Å; F125-F129 PolarHBondContact O-N 2.89Å
126L90.5Very high88.4Confident120 Ų12093.4 Ų93.463%0.62848%0.48SS*.Hα-helixtrans-61.9-41.1176.4-73.6172.1000111.9L122 S123 G124 F129 Y130L122-L126 WeakPolarHBondContact O-CG 3.38Å; L122-L126 PolarHBondContact O-N 2.88Å; S123-L126 PolarHBondContact O-N 2.81Å; G124-L126 PolarHBondContact O-N 3Å; L126-F129 PolarHBondContact O-N 3.21Å; L126-Y130 VanDerWaalsContact O-CB 3.23Å; L126-Y130 WeakPolarHBondContact O-CB 3.14Å; L126-Y130 PolarHBondContact O-N 3.36Å
127V91.4Very high87.1Confident85 Ų8590.7 Ų90.752%0.51547%0.47SS..Hα-helixtrans-64.9-45.8176.3173.20000111S123 G124 F125 Y130 C131S123-V127 WeakPolarHBondContact O-CG2 3.25Å; S123-V127 PolarHBondContact O-N 2.85Å; G124-V127 PolarHBondContact O-N 3.44Å; F125-V127 VanDerWaalsContact C-N 3.34Å; F125-V127 PolarHBondContact O-N 3.31Å; V127-Y130 PolarHBondContact O-N 3Å; V127-C131 VanDerWaalsContact O-CB 3.32Å; V127-C131 WeakPolarHBondContact O-CB 3.04Å; V127-C131 PolarHBondContact O-N 2.79Å; V127-C131 PolarHBondContact O-SG 3.24Å; V127-C131 VanDerWaalsContact O-SG 3.33Å
128I87.9Confident85.9Confident112 Ų11294 Ų9457%0.57448%0.48SS*.Hα-helixtrans-62.2-45.6177.5-66.9166.1000110.4G124 F125 C131 Y132G124-I128 VanDerWaalsContact O-CG1 3.29Å; G124-I128 WeakPolarHBondContact O-CG1 3.42Å; G124-I128 PolarHBondContact O-N 3.37Å; F125-I128 PolarHBondContact O-N 2.95Å; I128-C131 PolarHBondContact O-N 2.94Å; I128-Y132 VanDerWaalsContact O-CB 3.29Å; I128-Y132 WeakPolarHBondContact O-CB 3.17Å; I128-Y132 PolarHBondContact O-N 3.23Å
129F88Confident84.3Confident129 Ų12998.9 Ų98.957%0.56650%0.495SS*.Hα-helixtrans-62.2-46.7178.1-176.1-100.3000111.5F125 L126 C131 Y132 I133F125-F129 VanDerWaalsContact O-CB 3.25Å; F125-F129 WeakPolarHBondContact O-CB 2.97Å; F125-F129 PolarHBondContact O-N 2.89Å; L126-F129 PolarHBondContact O-N 3.21Å; F129-C131 PolarHBondContact O-N 3.43Å; F129-Y132 WeakPolarHBondContact O-CB 3.29Å; F129-Y132 PolarHBondContact O-N 3.37Å; F129-Y132 VanDerWaalsContact O-N 3.17Å; F129-I133 HydrophobicContact CD1-CG1 4.16Å; F129-I133 HydrophobicContact CE1-CD1 4.32Å; F129-I133 HydrophobicContact CE1-CG1 3.8Å; F129-I133 HydrophobicContact CE2-CD1 4.32Å; F129-I133 HydrophobicContact CE2-CG1 4.38Å; F129-I133 HydrophobicContact CZ-CD1 3.94Å; F129-I133 HydrophobicContact CZ-CG1 3.92Å; F129-I133 WeakPolarHBondContact O-CG1 3.45Å; F129-I133 PolarHBondContact O-N 3.19Å
130Y86.6Confident82.6Confident143 Ų143103.6 Ų103.656%0.56151%0.511SS*.Hα-helixtrans-59.2-46.8175.4176.4-97000112L126 V127 Y132 I133 R134L126-Y130 VanDerWaalsContact O-CB 3.23Å; L126-Y130 WeakPolarHBondContact O-CB 3.14Å; L126-Y130 PolarHBondContact O-N 3.36Å; V127-Y130 PolarHBondContact O-N 3Å; Y130-Y132 VanDerWaalsContact C-N 3.29Å; Y130-Y132 PolarHBondContact O-N 3.22Å; Y130-I133 PolarHBondContact O-N 3.16Å; Y130-R134 VanDerWaalsContact O-CB 3.31Å; Y130-R134 WeakPolarHBondContact O-CB 3.23Å; Y130-R134 PolarHBondContact O-N 3.18Å
131C88.9Confident80.4Confident68 Ų68105 Ų10546%0.45951%0.511SS..Hα-helixtrans-61.4-38.8175.5-77.20000112V127 I128 F129 R134 K135V127-C131 VanDerWaalsContact O-CB 3.32Å; V127-C131 WeakPolarHBondContact O-CB 3.04Å; V127-C131 PolarHBondContact O-N 2.79Å; V127-C131 PolarHBondContact O-SG 3.24Å; V127-C131 VanDerWaalsContact O-SG 3.33Å; I128-C131 PolarHBondContact O-N 2.94Å; F129-C131 PolarHBondContact O-N 3.43Å; C131-R134 PolarHBondContact O-N 2.94Å; C131-K135 WeakPolarHBondContact O-CB 3.2Å; C131-K135 PolarHBondContact O-N 3.32Å
132Y84Confident78.7Confident87 Ų87105.3 Ų105.334%0.34152%0.521SS..Hα-helixtrans-65.4-47.8177178.7-100.3000111.8A2 I128 F129 Y130 K135 R136A2-Y132 PolarHBondContact O-OH 3.32Å; I128-Y132 VanDerWaalsContact O-CB 3.29Å; I128-Y132 WeakPolarHBondContact O-CB 3.17Å; I128-Y132 PolarHBondContact O-N 3.23Å; F129-Y132 WeakPolarHBondContact O-CB 3.29Å; F129-Y132 PolarHBondContact O-N 3.37Å; F129-Y132 VanDerWaalsContact O-N 3.17Å; Y130-Y132 VanDerWaalsContact C-N 3.29Å; Y130-Y132 PolarHBondContact O-N 3.22Å; Y132-K135 PolarHBondContact O-N 3.25Å; Y132-R136 HydrophobicContact CD1-CG 4.27Å; Y132-R136 HydrophobicContact CE1-CG 3.97Å; Y132-R136 HydrophobicContact CE2-CG 4.25Å; Y132-R136 WeakPolarHBondContact O-CB 3.11Å; Y132-R136 VanDerWaalsContact O-CG 3.29Å; Y132-R136 WeakPolarHBondContact O-CG 3.5Å; Y132-R136 PolarHBondContact O-N 3.29Å; Y132-R136 PolarHBondContact OH-NE 3.39Å; Y132-R136 VanDerWaalsContact OH-NE 3.07Å; Y132-R136 PolarHBondContact OH-NH2 3.11Å
133I80.4Confident77Confident73 Ų73106.1 Ų106.137%0.37453%0.532SS..Hα-helixtrans-60-48.9174.6-64.3-61.4000109.9F129 Y130 K135 R136 C137F129-I133 HydrophobicContact CD1-CG1 4.16Å; F129-I133 HydrophobicContact CE1-CD1 4.32Å; F129-I133 HydrophobicContact CE1-CG1 3.8Å; F129-I133 HydrophobicContact CE2-CD1 4.32Å; F129-I133 HydrophobicContact CE2-CG1 4.38Å; F129-I133 HydrophobicContact CZ-CD1 3.94Å; F129-I133 HydrophobicContact CZ-CG1 3.92Å; F129-I133 WeakPolarHBondContact O-CG1 3.45Å; F129-I133 PolarHBondContact O-N 3.19Å; Y130-I133 PolarHBondContact O-N 3.16Å; I133-K135 VanDerWaalsContact C-N 3.33Å; I133-K135 PolarHBondContact O-N 3.36Å; I133-R136 PolarHBondContact O-N 2.86Å; I133-R136 VanDerWaalsContact O-N 3.15Å; I133-C137 WeakPolarHBondContact O-CB 3.14Å; I133-C137 PolarHBondContact O-N 3.34Å; I133-C137 PolarHBondContact O-SG 2.94Å
134R81.8Confident74.9Confident154 Ų154112.5 Ų112.558%0.58155%0.547SS*.Hα-helixtrans-58.2-43.8177.7-170.9176.8176.6-171.6-0.4111.9Y130 C131 C137 L138Y130-R134 VanDerWaalsContact O-CB 3.31Å; Y130-R134 WeakPolarHBondContact O-CB 3.23Å; Y130-R134 PolarHBondContact O-N 3.18Å; C131-R134 PolarHBondContact O-N 2.94Å; R134-C137 PolarHBondContact O-N 2.97Å; R134-L138 HydrophobicContact CG-CD1 4.19Å; R134-L138 WeakPolarHBondContact O-CB 3.47Å; R134-L138 WeakPolarHBondContact O-CG 3.19Å; R134-L138 PolarHBondContact O-N 3.26Å
135K79.3Confident73Confident144 Ų144117.3 Ų117.363%0.62657%0.566SS**Hα-helixtrans-66-39177.2-171.2175.6-177.7178.50112C131 Y132 I133 L138 K139C131-K135 WeakPolarHBondContact O-CB 3.2Å; C131-K135 PolarHBondContact O-N 3.32Å; Y132-K135 PolarHBondContact O-N 3.25Å; I133-K135 VanDerWaalsContact C-N 3.33Å; I133-K135 PolarHBondContact O-N 3.36Å; K135-L138 PolarHBondContact O-N 2.88Å; K135-K139 WeakPolarHBondContact O-CB 3.38Å; K135-K139 WeakPolarHBondContact O-CG 3.23Å; K135-K139 PolarHBondContact O-N 3.33Å
136R75.5Confident71.3Confident120 Ų120119.2 Ų119.245%0.45358%0.584SS.*Hα-helixtrans-65.8-45.3174.4-76.6-71.7-161.2153.712111.8Y132 I133 L138 K139 L140Y132-R136 HydrophobicContact CD1-CG 4.27Å; Y132-R136 HydrophobicContact CE1-CG 3.97Å; Y132-R136 HydrophobicContact CE2-CG 4.25Å; Y132-R136 WeakPolarHBondContact O-CB 3.11Å; Y132-R136 VanDerWaalsContact O-CG 3.29Å; Y132-R136 WeakPolarHBondContact O-CG 3.5Å; Y132-R136 PolarHBondContact O-N 3.29Å; Y132-R136 PolarHBondContact OH-NE 3.39Å; Y132-R136 VanDerWaalsContact OH-NE 3.07Å; Y132-R136 PolarHBondContact OH-NH2 3.11Å; I133-R136 PolarHBondContact O-N 2.86Å; I133-R136 VanDerWaalsContact O-N 3.15Å; R136-L138 VanDerWaalsContact C-N 3.31Å; R136-L138 PolarHBondContact O-N 3.04Å; R136-K139 PolarHBondContact O-N 3.23Å; R136-L140 PolarHBondContact O-N 2.85Å
137C66.4Low69.7Low46 Ų46118.2 Ų118.231%0.31159%0.586SS.*Hα-helixtrans-63.3-36.2175.6-650000112.1I133 R134 L140 K141 C147I133-C137 WeakPolarHBondContact O-CB 3.14Å; I133-C137 PolarHBondContact O-N 3.34Å; I133-C137 PolarHBondContact O-SG 2.94Å; R134-C137 PolarHBondContact O-N 2.97Å; C137-L140 PolarHBondContact O-N 2.75Å; C137-K141 PolarHBondContact O-N 2.77Å; C137-C147 PolarHBondContact SG-SG 3.36Å
138L65.8Low67.9Low100 Ų100118.9 Ų118.952%0.52459%0.594SS.*Hα-helixtrans-70.6-36.4173.6-72.4168.1000112.4R134 K135 R136 L140 K141R134-L138 HydrophobicContact CG-CD1 4.19Å; R134-L138 WeakPolarHBondContact O-CB 3.47Å; R134-L138 WeakPolarHBondContact O-CG 3.19Å; R134-L138 PolarHBondContact O-N 3.26Å; K135-L138 PolarHBondContact O-N 2.88Å; R136-L138 VanDerWaalsContact C-N 3.31Å; R136-L138 PolarHBondContact O-N 3.04Å; L138-L140 VanDerWaalsContact C-N 3.26Å; L138-L140 PolarHBondContact O-N 3.03Å; L138-K141 HydrophobicContact CD2-CD 4.25Å; L138-K141 PolarHBondContact O-N 2.81Å
139K58.6Low66.2Low175 Ų175117.2 Ų117.276%0.76161%0.605SS**Hα-helixtrans-69.9-22.9173.1-76.7-74.9180178.10112.9K135 R136K135-K139 WeakPolarHBondContact O-CB 3.38Å; K135-K139 WeakPolarHBondContact O-CG 3.23Å; K135-K139 PolarHBondContact O-N 3.33Å; R136-K139 PolarHBondContact O-N 3.23Å
140L57.2Low64.5Low139 Ų139118.6 Ų118.673%0.72861%0.613SS**THydrogen-bonded Turntrans-86.4-1.5174.2-117.676.4000114.2R136 C137 L138 S142R136-L140 PolarHBondContact O-N 2.85Å; C137-L140 PolarHBondContact O-N 2.75Å; L138-L140 VanDerWaalsContact C-N 3.26Å; L138-L140 PolarHBondContact O-N 3.03Å; L140-S142 PolarHBondContact O-N 3.47Å
141K49.6Very low62.9Low149 Ų149123.3 Ų123.365%0.64863%0.629SS**  trans-71.368.5171.2-84.4-179.1174.2-179.20111.3C137 L138C137-K141 PolarHBondContact O-N 2.77Å; L138-K141 HydrophobicContact CD2-CD 4.25Å; L138-K141 PolarHBondContact O-N 2.81Å
142S55.5Low60.6Low94 Ų94130.4 Ų130.466%0.65765%0.647SS**SBendtrans-92.2161.8139.9-156.20000106.9L140 Y144L140-S142 PolarHBondContact O-N 3.47Å; S142-Y144 PolarHBondContact O-N 2.95Å
143P55.1Low59.1Low114 Ų114132.2 Ų132.274%0.7467%0.669SS**SBendtrans-84.158.3-135.537.6-40.7000116.5
144Y50.7Low57.6Low202 Ų202140.6 Ų140.679%0.79271%0.714SS**  trans-163.5115.3153.545.4-88000110.3S142S142-Y144 PolarHBondContact O-N 2.95Å
145N51.2Low56.4Low131 Ų131140 Ų14070%0.70172%0.72SS**  trans-94.5111.6-172.540.3-66.5000111
146V52.8Low55.1Low119 Ų119139.7 Ų139.772%0.72173%0.725SS**  trans-131.484.5157.3-172.10000109S148V146-S148 WeakPolarHBondContact CG1-OG 3.23Å
147C56.7Low54Low99 Ų99140.8 Ų140.867%0.66974%0.74SS**  trans-99.179.4149.2-71.90000106.4C137 G149C137-C147 PolarHBondContact SG-SG 3.36Å; C147-G149 VanDerWaalsContact C-N 3.3Å; C147-G149 PolarHBondContact O-N 3.05Å
148S53.8Low53.3Low99 Ų99146.4 Ų146.469%0.69277%0.765SS**  trans-72.589.9169.2-72.40000108.7V146 E150V146-S148 WeakPolarHBondContact CG1-OG 3.23Å; S148-E150 VanDerWaalsContact C-N 3.31Å; S148-E150 PolarHBondContact O-N 2.82Å
149G51.4Low52.5Low77 Ų77149.3 Ų149.379%0.79478%0.781SS**  trans-8877.9155.300000108C147 R151C147-G149 VanDerWaalsContact C-N 3.3Å; C147-G149 PolarHBondContact O-N 3.05Å; G149-R151 PolarHBondContact O-N 3.02Å; G149-R151 VanDerWaalsContact O-N 3.09Å
150E53.5Low52.1Low157 Ų157147.6 Ų147.673%0.73478%0.782SS**  trans-61108.6171.4-173136.5151.800109.4S148S148-E150 VanDerWaalsContact C-N 3.31Å; S148-E150 PolarHBondContact O-N 2.82Å
151R51.9Low51.7Low242 Ų242148.2 Ų148.291%0.91379%0.786SS**  trans-135.285.3152.5-111.6-164.1-121.4170-0.9107.6G149G149-R151 PolarHBondContact O-N 3.02Å; G149-R151 VanDerWaalsContact O-N 3.09Å
152R42.5Very low51.9Low217 Ų217148.2 Ų148.282%0.81980%0.796SS**  trans-82.6118.9151.6-65.9-164.5-146.8-149.76.6107.1
153P51.9Low51.6Low125 Ų125152.7 Ų152.781%0.81281%0.808SS**  trans-78.6130.4155.316.7-1.4000108.1
154L47.6Very low51.3Low250 Ų250156.2 Ų156.2100%1.30981%0.814SS**  trans-83.70160.1-151.3116.9000108.2

Retrieved 154 of 154 residues in 148.7 ms (Link to these results)