A0A096MLY5_PAPAN Loading...

Gremlin

AlphaFold DB (Q9H772), UniProt , Accession A0A096MLY5, Species PAPAN (Papio anubis, Olive baboon), Gene GREM2, Length 168 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
1M62.6Low78.8Confident215 Ų215137.5 Ų137.5100%1.05967%0.666SS**  0-270-130.2164.183.600113.9W3M1-W3 PolarHBondContact O-N 2.84Å
2F67.1Low79.4Confident171 Ų171133.6 Ų133.675%0.7566%0.656SS**Hα-helixtrans-65-25.6-175.4-60.5-75.7000116.3K4 L5 S6F2-K4 PolarHBondContact O-N 3.05Å; F2-L5 PolarHBondContact O-N 3.43Å; F2-S6 PolarHBondContact O-N 2.03Å
3W69.4Low79.6Confident212 Ų212127.5 Ų127.580%0.80364%0.64SS**Hα-helixtrans-64.7-38.6-178.5-167.6-8.5000113.1M1 L5 S6 L7M1-W3 PolarHBondContact O-N 2.84Å; W3-L5 VanDerWaalsContact C-N 3.28Å; W3-L5 PolarHBondContact O-N 2.76Å; W3-S6 PolarHBondContact O-N 3.4Å; W3-L7 PolarHBondContact O-N 2.91Å
4K77.2Confident79.9Confident179 Ų179124.4 Ų124.478%0.77863%0.631SS**Hα-helixtrans-63.7-35.6178.4-71.1-159.7173.2-171.70112.3F2 L7 S8F2-K4 PolarHBondContact O-N 3.05Å; K4-L7 PolarHBondContact O-N 3.41Å; K4-S8 PolarHBondContact O-N 3.18Å; K4-S8 VanDerWaalsContact O-N 3.14Å
5L81.4Confident79.7Confident114 Ų114123.7 Ų123.760%0.59763%0.628SS**Hα-helixtrans-67.1-45.1176.5-66.4171.9000110.9F2 W3 L7 S8 L9F2-L5 PolarHBondContact O-N 3.43Å; W3-L5 VanDerWaalsContact C-N 3.28Å; W3-L5 PolarHBondContact O-N 2.76Å; L5-L7 VanDerWaalsContact C-N 3.33Å; L5-L7 PolarHBondContact O-N 2.89Å; L5-S8 PolarHBondContact O-N 3.03Å; L5-S8 PolarHBondContact O-OG 2.81Å; L5-L9 PolarHBondContact O-N 2.83Å
6S81.8Confident79.4Confident64 Ų64121.1 Ų121.145%0.44862%0.62SS.*Hα-helixtrans-58.2-44.7175.2-64.60000112.1F2 W3 S8 L9 F10F2-S6 PolarHBondContact O-N 2.03Å; W3-S6 PolarHBondContact O-N 3.4Å; S6-S8 VanDerWaalsContact C-N 3.32Å; S6-S8 PolarHBondContact O-N 2.83Å; S6-L9 PolarHBondContact O-N 3.4Å; S6-F10 WeakPolarHBondContact O-CD2 3.15Å; S6-F10 PolarHBondContact O-N 2.85Å
7L84.3Confident78.8Confident105 Ų105123.4 Ų123.455%0.5563%0.625SS.*Hα-helixtrans-61.6-40.6179.8-155.890.9000112.1W3 K4 L5 F10 L11W3-L7 PolarHBondContact O-N 2.91Å; K4-L7 PolarHBondContact O-N 3.41Å; L5-L7 VanDerWaalsContact C-N 3.33Å; L5-L7 PolarHBondContact O-N 2.89Å; L7-F10 PolarHBondContact O-N 3.47Å; L7-L11 PolarHBondContact O-N 3.18Å
8S84.5Confident78.1Confident58 Ų58120.8 Ų120.841%0.40662%0.616SS.*Hα-helixtrans-66.6-39.1176.768.90000112.5K4 L5 S6 L11 V12K4-S8 PolarHBondContact O-N 3.18Å; K4-S8 VanDerWaalsContact O-N 3.14Å; L5-S8 PolarHBondContact O-N 3.03Å; L5-S8 PolarHBondContact O-OG 2.81Å; S6-S8 VanDerWaalsContact C-N 3.32Å; S6-S8 PolarHBondContact O-N 2.83Å; S8-L11 PolarHBondContact O-N 2.88Å; S8-V12 WeakPolarHBondContact O-CG2 3.5Å; S8-V12 PolarHBondContact O-N 2.7Å
9L85.2Confident77Confident135 Ų135118 Ų11871%0.70761%0.613SS**Hα-helixtrans-65.2-41.5178-147.589.9000111.2L5 S6 V12 A13L5-L9 PolarHBondContact O-N 2.83Å; S6-L9 PolarHBondContact O-N 3.4Å; L9-V12 PolarHBondContact O-N 3.01Å; L9-A13 WeakPolarHBondContact O-CB 3.45Å; L9-A13 PolarHBondContact O-N 2.85Å
10F85.6Confident75.9Confident153 Ų153119 Ų11967%0.67161%0.614SS**Hα-helixtrans-62.6-44.2174.5-87.3-71.8000112.1S6 L7 V12 A13 V14S6-F10 WeakPolarHBondContact O-CD2 3.15Å; S6-F10 PolarHBondContact O-N 2.85Å; L7-F10 PolarHBondContact O-N 3.47Å; F10-V12 PolarHBondContact O-N 2.92Å; F10-A13 PolarHBondContact O-N 2.8Å; F10-V14 VanDerWaalsContact O-CG2 3.31Å; F10-V14 WeakPolarHBondContact O-CG2 3.32Å; F10-V14 PolarHBondContact O-N 3.48Å
11L88.3Confident74.9Confident106 Ų106117 Ų11756%0.55562%0.616SS**Hα-helixtrans-60.4-45177.4-96.5162000112.3L7 S8 V14 L15L7-L11 PolarHBondContact O-N 3.18Å; S8-L11 PolarHBondContact O-N 2.88Å; L11-V14 PolarHBondContact O-N 2.73Å; L11-L15 WeakPolarHBondContact O-CG 3.5Å; L11-L15 PolarHBondContact O-N 2.75Å
12V86.1Confident74.4Confident91 Ų91117 Ų11755%0.55260%0.604SS**Hα-helixtrans-64.4-43.2177.2175.90000111S8 L9 F10 V14 L15 V16S8-V12 WeakPolarHBondContact O-CG2 3.5Å; S8-V12 PolarHBondContact O-N 2.7Å; L9-V12 PolarHBondContact O-N 3.01Å; F10-V12 PolarHBondContact O-N 2.92Å; V12-V14 VanDerWaalsContact C-N 3.34Å; V12-V14 PolarHBondContact O-N 2.81Å; V12-L15 PolarHBondContact O-N 3.4Å; V12-V16 HydrophobicContact CG1-CG2 4.4Å; V12-V16 WeakPolarHBondContact O-CG2 3.11Å; V12-V16 PolarHBondContact O-N 2.99Å
13A81.6Confident73.2Confident54 Ų54117.3 Ų117.345%0.44661%0.605SS.*Hα-helixtrans-61.6-40.2177.300000112.5L9 F10 V16 K17L9-A13 WeakPolarHBondContact O-CB 3.45Å; L9-A13 PolarHBondContact O-N 2.85Å; F10-A13 PolarHBondContact O-N 2.8Å; A13-V16 PolarHBondContact O-N 2.9Å; A13-K17 WeakPolarHBondContact O-CB 3.22Å; A13-K17 VanDerWaalsContact O-CG 3.22Å; A13-K17 WeakPolarHBondContact O-CG 3.05Å; A13-K17 PolarHBondContact O-N 2.96Å
14V84.1Confident72Confident84 Ų84114 Ų11451%0.50960%0.603SS.*Hα-helixtrans-65.1-43.3174.9172.60000110.9F10 L11 V12 V16 K17 V18F10-V14 VanDerWaalsContact O-CG2 3.31Å; F10-V14 WeakPolarHBondContact O-CG2 3.32Å; F10-V14 PolarHBondContact O-N 3.48Å; L11-V14 PolarHBondContact O-N 2.73Å; V12-V14 VanDerWaalsContact C-N 3.34Å; V12-V14 PolarHBondContact O-N 2.81Å; V14-V16 PolarHBondContact O-N 2.88Å; V14-K17 PolarHBondContact O-N 2.88Å; V14-V18 HydrophobicContact CG1-CG2 4.36Å; V14-V18 VanDerWaalsContact O-CG2 3.29Å; V14-V18 WeakPolarHBondContact O-CG2 3.28Å; V14-V18 PolarHBondContact O-N 2.82Å
15L76.4Confident70.5Confident114 Ų114116.4 Ų116.460%0.59761%0.607SS**Hα-helixtrans-63.6-39.8177.9-71.7172.1000112.4L11 V12 V18 A19L11-L15 WeakPolarHBondContact O-CG 3.5Å; L11-L15 PolarHBondContact O-N 2.75Å; V12-L15 PolarHBondContact O-N 3.4Å; L15-V18 PolarHBondContact O-N 2.86Å; L15-A19 WeakPolarHBondContact O-CB 3.32Å; L15-A19 PolarHBondContact O-N 2.8Å
16V75.7Confident68.6Low82 Ų82116.3 Ų116.350%0.49761%0.613SS.*Hα-helixtrans-64.3-44.8174.5174.40000110.7V12 A13 V14 V18 A19 E20V12-V16 HydrophobicContact CG1-CG2 4.4Å; V12-V16 WeakPolarHBondContact O-CG2 3.11Å; V12-V16 PolarHBondContact O-N 2.99Å; A13-V16 PolarHBondContact O-N 2.9Å; V14-V16 PolarHBondContact O-N 2.88Å; V16-V18 VanDerWaalsContact C-N 3.32Å; V16-V18 PolarHBondContact O-N 3.34Å; V16-A19 PolarHBondContact O-N 2.83Å; V16-E20 PolarHBondContact O-N 2.93Å
17K68.7Low66.9Low160 Ų160118.6 Ų118.670%0.69664%0.636SS**Hα-helixtrans-61.1-38.4176.2-72.2-85.4-179.11680112.6A13 V14 A21A13-K17 WeakPolarHBondContact O-CB 3.22Å; A13-K17 VanDerWaalsContact O-CG 3.22Å; A13-K17 WeakPolarHBondContact O-CG 3.05Å; A13-K17 PolarHBondContact O-N 2.96Å; V14-K17 PolarHBondContact O-N 2.88Å; K17-A21 WeakPolarHBondContact O-CB 3.29Å; K17-A21 PolarHBondContact O-N 2.75Å
18V66.8Low65.1Low77 Ų77117 Ų11747%0.46765%0.645SS.*Hα-helixtrans-69.9-37.8176.7171.70000111.6V14 L15 V16 E20 R22V14-V18 HydrophobicContact CG1-CG2 4.36Å; V14-V18 VanDerWaalsContact O-CG2 3.29Å; V14-V18 WeakPolarHBondContact O-CG2 3.28Å; V14-V18 PolarHBondContact O-N 2.82Å; L15-V18 PolarHBondContact O-N 2.86Å; V16-V18 VanDerWaalsContact C-N 3.32Å; V16-V18 PolarHBondContact O-N 3.34Å; V18-E20 VanDerWaalsContact C-N 3.35Å; V18-R22 PolarHBondContact O-N 3.35Å
19A57.1Low62.9Low68 Ų68118.3 Ų118.356%0.56266%0.66SS**Hα-helixtrans-65.6-38.7175.900000111.8L15 V16 R22L15-A19 WeakPolarHBondContact O-CB 3.32Å; L15-A19 PolarHBondContact O-N 2.8Å; V16-A19 PolarHBondContact O-N 2.83Å; A19-R22 PolarHBondContact O-N 3.26Å
20E55Low61Low137 Ų137118.3 Ų118.364%0.6466%0.659SS**Hα-helixtrans-72.7-36.8178.8-156.1134.1-145.300112.3V16 V18 R22 K23V16-E20 PolarHBondContact O-N 2.93Å; V18-E20 VanDerWaalsContact C-N 3.35Å; E20-R22 PolarHBondContact O-N 3.43Å; E20-K23 PolarHBondContact O-N 2.85Å
21A53.7Low59.3Low78 Ų78115.1 Ų115.165%0.64565%0.654SS**Hα-helixtrans-64.4-19.6173.600000113.5K17 K23K17-A21 WeakPolarHBondContact O-CB 3.29Å; K17-A21 PolarHBondContact O-N 2.75Å; A21-K23 VanDerWaalsContact C-N 3.32Å
22R52Low57.1Low214 Ų214114.3 Ų114.381%0.80866%0.657SS**THydrogen-bonded Turntrans-78.8-10174.1-79.1-173.5171.8179.7-0.7114V18 A19 E20V18-R22 PolarHBondContact O-N 3.35Å; A19-R22 PolarHBondContact O-N 3.26Å; E20-R22 PolarHBondContact O-N 3.43Å
23K42.4Very low55.7Low179 Ų179115.9 Ų115.978%0.77867%0.669SS**THydrogen-bonded Turntrans-89.4-6.1-176.2-154.6173.6177.8-174.70115.2E20 A21E20-K23 PolarHBondContact O-N 2.85Å; A21-K23 VanDerWaalsContact C-N 3.32Å
24N43.8Very low54.4Low141 Ų141123.1 Ų123.175%0.75469%0.686SS**  trans-114.442.1-175.3-65.7-23.5000114.4
25R46.1Very low52.7Low230 Ų230128.6 Ų128.687%0.86870%0.703SS**  trans-95.9118.5160.1-97.8-173.6171.1100.60.1108.9A27R25-A27 PolarHBondContact O-N 2.86Å
26P42.1Very low51Low112 Ų112130.6 Ų130.673%0.72772%0.715SS**  trans-59.3126.7167.923.5-29.7000108.4G28P26-G28 PolarHBondContact O-N 3.3Å
27A46.5Very low49.4Very low112 Ų112129.6 Ų129.693%0.92672%0.72SS**THydrogen-bonded Turntrans-62.9108.217100000107.7R25R25-A27 PolarHBondContact O-N 2.86Å
28G45.6Very low48.1Very low72 Ų72127.7 Ų127.774%0.74273%0.728SS**THydrogen-bonded Turntrans152.9-12171.700000117.8P26 I30P26-G28 PolarHBondContact O-N 3.3Å; G28-I30 PolarHBondContact O-N 2.02Å
29A37.7Very low47.5Very low86 Ų86128.4 Ų128.471%0.71174%0.736SS**  trans-77.9109.7176.500000110.7P31A29-P31 WeakPolarHBondContact O-CD 3.44Å
30I45.6Very low47.2Very low135 Ų135132.4 Ų132.469%0.69275%0.748SS**PPolyproline II helixtrans-60.8121.6171.5-60.2170.2000108.2G28G28-I30 PolarHBondContact O-N 2.02Å
31P49.8Very low47.1Very low86 Ų86129.3 Ų129.356%0.55874%0.735SS**PPolyproline II helixtrans-67.7144.3174.3-16.229.9000111.6A29A29-P31 WeakPolarHBondContact O-CD 3.44Å
32S42.4Very low47.3Very low88 Ų88129.9 Ų129.962%0.61574%0.735SS**PPolyproline II helixtrans-58.6135171.3169.50000111.1Y34S32-Y34 PolarHBondContact O-N 2.04Å; S32-Y34 PolarHBondContact OG-N 3.36Å
33P57.1Low47.6Very low125 Ų125127.1 Ų127.181%0.81273%0.731SS**SBendtrans-65.2-17.2178.1-20.432000114.7
34Y53Low48.2Very low205 Ų205126.9 Ų126.980%0.80473%0.725SS**  trans-96.899.4180-68.9-85.4000109.8S32S32-Y34 PolarHBondContact O-N 2.04Å; S32-Y34 PolarHBondContact OG-N 3.36Å
35K48.3Very low48.7Very low199 Ų199126.9 Ų126.987%0.86572%0.715SS**  trans-122109.6161.6-167.9173.6-177.2178.90109.2
36D41.7Very low49.3Very low157 Ų157121.8 Ų121.884%0.8470%0.701SS**  trans-60.8135171.2-63.5-44.6000110.6
37G42.4Very low50.3Low60 Ų60123 Ų12362%0.61970%0.697SS**  trans176.1100179.800000114
38S42.2Very low50.9Low121 Ų121122 Ų12285%0.84667%0.673SS**  trans-54.7145.9-179.1-173.90000116.5
39S52.5Low51.4Low92 Ų92123.7 Ų123.764%0.64366%0.664SS**SBendtrans57.269.1149.8-166.10000119.8
40N51.8Low52.6Low151 Ų151127.4 Ų127.481%0.80766%0.664SS**  trans-170.150.8139.8-95.3-9000109.6
41N52.1Low53.3Low72 Ų72126.1 Ų126.139%0.38566%0.655SS.*Hα-helixtrans-90.4-28.9-154.6-111.2-14.2000114.7E43 R44 W45N41-E43 PolarHBondContact O-N 3.15Å; N41-R44 PolarHBondContact O-N 2.04Å; N41-W45 PolarHBondContact ND2-NE1 3.34Å; N41-W45 VanDerWaalsContact O-CB 3.31Å; N41-W45 WeakPolarHBondContact O-CB 3.43Å; N41-W45 PolarHBondContact O-N 3.17Å; N41-W45 PolarHBondContact OD1-NE1 3.13Å
42S57.8Low53.3Low90 Ų90125.4 Ų125.463%0.62965%0.649SS**Hα-helixtrans-59.4-49.2-166.5-172.80000114.3Q46S42-Q46 PolarHBondContact O-N 3.04Å
43E59.9Low53.8Low156 Ų156126.3 Ų126.373%0.72965%0.646SS**Hα-helixtrans-71.2-37.9-179-62.4-175.3159.800112.2N41 Q46 H47N41-E43 PolarHBondContact O-N 3.15Å; E43-Q46 PolarHBondContact O-N 2.78Å; E43-H47 PolarHBondContact O-CD2 2.9Å; E43-H47 PolarHBondContact O-N 3.02Å; E43-H47 VanDerWaalsContact O-N 3.09Å
44R54.2Low53.4Low174 Ų174125.6 Ų125.666%0.65765%0.651SS**Hα-helixtrans-67.9-39.4178.2-173.5168-179.4137.91.7112N41 H47 Q48N41-R44 PolarHBondContact O-N 2.04Å; R44-H47 PolarHBondContact O-N 3.04Å; R44-Q48 WeakPolarHBondContact O-CG 3.44Å; R44-Q48 PolarHBondContact O-N 3.42Å
45W54.4Low53.2Low142 Ų142119.4 Ų119.454%0.53864%0.638SS.*Hα-helixtrans-62.6-42.7174.1-88.983.8000111.6N41 H47 Q48 I49N41-W45 PolarHBondContact ND2-NE1 3.34Å; N41-W45 VanDerWaalsContact O-CB 3.31Å; N41-W45 WeakPolarHBondContact O-CB 3.43Å; N41-W45 PolarHBondContact O-N 3.17Å; N41-W45 PolarHBondContact OD1-NE1 3.13Å; W45-H47 VanDerWaalsContact C-N 3.34Å; W45-H47 PolarHBondContact O-N 3.39Å; W45-Q48 PolarHBondContact O-N 2.72Å; W45-I49 VanDerWaalsContact O-CG1 3.31Å; W45-I49 WeakPolarHBondContact O-CG1 3.42Å; W45-I49 PolarHBondContact O-N 3.28Å
46Q59.3Low53.5Low122 Ų122115.6 Ų115.657%0.5764%0.636SS**Hα-helixtrans-64.2-37.9176.9-78.4172.8-20.100112.6S42 E43 K50S42-Q46 PolarHBondContact O-N 3.04Å; E43-Q46 PolarHBondContact O-N 2.78Å; Q46-K50 PolarHBondContact O-N 3.13Å
47H61.6Low54Low139 Ų139117.1 Ų117.164%0.64464%0.638SS**Hα-helixtrans-64.9-41.3172.3-91-86.4000112.2E43 R44 W45 K50 E51E43-H47 PolarHBondContact O-CD2 2.9Å; E43-H47 PolarHBondContact O-N 3.02Å; E43-H47 VanDerWaalsContact O-N 3.09Å; R44-H47 PolarHBondContact O-N 3.04Å; W45-H47 VanDerWaalsContact C-N 3.34Å; W45-H47 PolarHBondContact O-N 3.39Å; H47-K50 PolarHBondContact O-N 2.79Å; H47-E51 PolarHBondContact O-N 3.07Å
48Q59.7Low54.5Low90 Ų90123.1 Ų123.142%0.42165%0.65SS.*Hα-helixtrans-65.4-39.3176.4-74.8-178.4-75.100112.6R44 W45 K50 E51 V52R44-Q48 WeakPolarHBondContact O-CG 3.44Å; R44-Q48 PolarHBondContact O-N 3.42Å; W45-Q48 PolarHBondContact O-N 2.72Å; Q48-K50 VanDerWaalsContact C-N 3.28Å; Q48-K50 PolarHBondContact O-N 3Å; Q48-E51 WeakPolarHBondContact O-CB 3.15Å; Q48-E51 PolarHBondContact O-N 3.1Å; Q48-E51 VanDerWaalsContact O-N 3.07Å; Q48-V52 WeakPolarHBondContact O-CG2 3.19Å; Q48-V52 PolarHBondContact O-N 2.77Å
49I57Low55.4Low108 Ų108119.4 Ų119.455%0.55463%0.626SS**Hα-helixtrans-61.7-35.4178.2-68.9166.2000111.6W45 E51 V52W45-I49 VanDerWaalsContact O-CG1 3.31Å; W45-I49 WeakPolarHBondContact O-CG1 3.42Å; W45-I49 PolarHBondContact O-N 3.28Å; I49-E51 VanDerWaalsContact C-N 3.31Å; I49-E51 PolarHBondContact O-N 2.7Å; I49-V52 PolarHBondContact O-N 3.42Å; I49-V52 VanDerWaalsContact O-N 3.17Å
50K61.4Low55.9Low163 Ų163119.9 Ų119.971%0.70962%0.621SS**Hα-helixtrans-70.4-25.6176-74.2-179.2179.3174.90113.5Q46 H47 Q48 V52 R65Q46-K50 PolarHBondContact O-N 3.13Å; H47-K50 PolarHBondContact O-N 2.79Å; Q48-K50 VanDerWaalsContact C-N 3.28Å; Q48-K50 PolarHBondContact O-N 3Å; K50-V52 VanDerWaalsContact C-N 3.31Å; K50-R65 PolarHBondContact O-NH1 3.21Å; K50-R65 VanDerWaalsContact O-NH1 3.15Å
51E60.5Low56.6Low109 Ų109117.5 Ų117.551%0.50961%0.612SS.*Hα-helixtrans-75.4-23.1171.8-69.9-176167.800111.8H47 Q48 I49 R65H47-E51 PolarHBondContact O-N 3.07Å; Q48-E51 WeakPolarHBondContact O-CB 3.15Å; Q48-E51 PolarHBondContact O-N 3.1Å; Q48-E51 VanDerWaalsContact O-N 3.07Å; I49-E51 VanDerWaalsContact C-N 3.31Å; I49-E51 PolarHBondContact O-N 2.7Å; E51-R65 HydrophobicContact CB-CB 4.49Å; E51-R65 VanDerWaalsContact O-CB 3.24Å; E51-R65 WeakPolarHBondContact O-CB 3.22Å; E51-R65 WeakPolarHBondContact O-CD 3.02Å
52V51.1Low57.5Low70 Ų70117.3 Ų117.342%0.42461%0.613SS.*SBendtrans-86.1126.8-178.9-179.90000110Q48 I49 K50 A54 V61Q48-V52 WeakPolarHBondContact O-CG2 3.19Å; Q48-V52 PolarHBondContact O-N 2.77Å; I49-V52 PolarHBondContact O-N 3.42Å; I49-V52 VanDerWaalsContact O-N 3.17Å; K50-V52 VanDerWaalsContact C-N 3.31Å; V52-A54 PolarHBondContact O-N 3.07Å; V52-V61 HydrophobicContact CG1-CG2 4.25Å
53L51.8Low58.5Low108 Ų108115 Ų11557%0.56560%0.595SS**PPolyproline II helixtrans-66.4122.9174.7-63.1174.9000109.2S55 L68L53-S55 PolarHBondContact O-N 3.47Å; L53-L68 HydrophobicContact CD1-CD1 3.88Å
54A48Very low59.4Low110 Ų110111 Ų11191%0.90958%0.577SS**PPolyproline II helixtrans-66.2117.3178.100000110.6V52V52-A54 PolarHBondContact O-N 3.07Å
55S49.7Very low60.5Low75 Ų75108.9 Ų108.952%0.52457%0.569SS.*  trans-110.1143.5167.8-166.50000109.5L53 Q57 A59L53-S55 PolarHBondContact O-N 3.47Å; S55-Q57 PolarHBondContact O-N 3.37Å; S55-A59 VanDerWaalsContact CB-CA 3.49Å
56S54Low61.9Low119 Ų119108.7 Ų108.783%0.83257%0.572SS**SBendtrans-79.5-16.3-163.148.60000115.8
57Q53Low62.9Low188 Ų188109 Ų10988%0.87957%0.568SS**SBendtrans-143-25.3179.2-66.5-172.31.200116.9S55S55-Q57 PolarHBondContact O-N 3.37Å
58E53.3Low64Low186 Ų186104.2 Ų104.287%0.86955%0.547SS*.  trans-164.591.4164.6-150165-174.300107.4L60E58-L60 PolarHBondContact O-N 3.15Å; E58-L60 VanDerWaalsContact O-N 3.09Å
59A59.5Low65.2Low43 Ų43108 Ų10836%0.35556%0.563SS.*  trans-71.7105.8177.400000108S55 V61S55-A59 VanDerWaalsContact CB-CA 3.49Å; A59-V61 PolarHBondContact O-N 3.33Å
60L63.3Low66.9Low103 Ų103107.9 Ų107.954%0.53957%0.571SS.*  trans-63.1108.9160.9178.759.8000107.4E58 V62 I106E58-L60 PolarHBondContact O-N 3.15Å; E58-L60 VanDerWaalsContact O-N 3.09Å; L60-V62 WeakPolarHBondContact O-CG2 3.18Å; L60-V62 PolarHBondContact O-N 3.17Å; L60-I106 HydrophobicContact CD2-CD1 3.57Å; L60-I106 HydrophobicContact CD2-CG2 4.23Å; L60-I106 HydrophobicContact CG-CD1 4.33Å
61V67.4Low68.4Low100 Ų100103.7 Ų103.761%0.60656%0.557SS**  trans-73.698.3176.6-178.20000108V52 A59V52-V61 HydrophobicContact CG1-CG2 4.25Å; A59-V61 PolarHBondContact O-N 3.33Å
62V70.3Confident70.2Confident68 Ų68102.8 Ų102.841%0.41255%0.548SS..  trans-76.6-45-176.1-168.90000111.6L60 F104 I106L60-V62 WeakPolarHBondContact O-CG2 3.18Å; L60-V62 PolarHBondContact O-N 3.17Å; V62-F104 HydrophobicContact CG1-CD1 4.29Å; V62-I106 HydrophobicContact CB-CD1 4.08Å; V62-I106 HydrophobicContact CG1-CD1 3.63Å; V62-I106 HydrophobicContact CG1-CG1 3.9Å; V62-I106 HydrophobicContact CG2-CD1 3.35Å; V62-I106 HydrophobicContact CG2-CG1 4.48Å
63T78.1Confident72.5Confident42 Ų42100.9 Ų100.926%0.25854%0.538SS..SBendtrans-162.8164.9-173.4-168.80000111.6Y67 L68T63-Y67 WeakPolarHBondContact OG1-CD2 3.28Å; T63-L68 HydrophobicContact CG2-CD1 4.05Å; T63-L68 HydrophobicContact CG2-CD2 3.42Å; T63-L68 VanDerWaalsContact CG2-CD2 3.42Å; T63-L68 HydrophobicContact CG2-CG 3.57Å
64E78.9Confident74.7Confident72 Ų72100.6 Ų100.634%0.33653%0.532SS..  trans-67.2145.7173.9-58.8177.6-107.400111.3K66 Y67E64-K66 HydrophobicContact CB-CD 4.5Å; E64-K66 HydrophobicContact CB-CG 4.13Å; E64-K66 VanDerWaalsContact CD-CE 3.47Å; E64-K66 PolarHBondContact O-N 3.43Å; E64-K66 VanDerWaalsContact O-N 3.07Å; E64-K66 VanDerWaalsContact OE1-CE 3.3Å; E64-K66 WeakPolarHBondContact OE1-CE 3.36Å; E64-K66 IonicContact OE1-NZ 2.86Å; E64-K66 PolarHBondContact OE1-NZ 3.38Å; E64-K66 VanDerWaalsContact OE2-CE 3.22Å; E64-K66 WeakPolarHBondContact OE2-CE 3.45Å; E64-K66 IonicContact OE2-NZ 2.65Å; E64-K66 PolarHBondContact OE2-NZ 3.09Å; E64-Y67 HydrophobicContact CB-CD2 3.89Å; E64-Y67 HydrophobicContact CB-CE2 4.16Å; E64-Y67 HydrophobicContact CG-CE2 4.37Å; E64-Y67 PolarHBondContact O-N 3.45Å; E64-Y67 WeakPolarHBondContact OE1-CE2 3.47Å
65R78.7Confident77.1Confident130 Ų13097.2 Ų97.249%0.49150%0.5SS..G310 helixtrans-56.4-28.9-179.6-176.7171.4-174.8151.33.8114.5K50 E51 Y67 L68K50-R65 PolarHBondContact O-NH1 3.21Å; K50-R65 VanDerWaalsContact O-NH1 3.15Å; E51-R65 HydrophobicContact CB-CB 4.49Å; E51-R65 VanDerWaalsContact O-CB 3.24Å; E51-R65 WeakPolarHBondContact O-CB 3.22Å; E51-R65 WeakPolarHBondContact O-CD 3.02Å; R65-Y67 PolarHBondContact O-N 3.35Å; R65-L68 PolarHBondContact O-N 3.39Å; R65-L68 VanDerWaalsContact O-N 3.1Å; R65-L68 VanDerWaalsContact O-O 3.05Å
66K82.5Confident79.4Confident138 Ų13897.1 Ų97.160%0.649%0.492SS*.G310 helixtrans-63.7-25.1177.773.1-168.4-176.7-153.90113.5E64E64-K66 HydrophobicContact CB-CD 4.5Å; E64-K66 HydrophobicContact CB-CG 4.13Å; E64-K66 VanDerWaalsContact CD-CE 3.47Å; E64-K66 PolarHBondContact O-N 3.43Å; E64-K66 VanDerWaalsContact O-N 3.07Å; E64-K66 VanDerWaalsContact OE1-CE 3.3Å; E64-K66 WeakPolarHBondContact OE1-CE 3.36Å; E64-K66 IonicContact OE1-NZ 2.86Å; E64-K66 PolarHBondContact OE1-NZ 3.38Å; E64-K66 VanDerWaalsContact OE2-CE 3.22Å; E64-K66 WeakPolarHBondContact OE2-CE 3.45Å; E64-K66 IonicContact OE2-NZ 2.65Å; E64-K66 PolarHBondContact OE2-NZ 3.09Å
67Y80.8Confident81.5Confident127 Ų12795.2 Ų95.250%0.49848%0.476SS..G310 helixtrans-88.4-18.1176-59.6-62.6000112.3T63 E64 R65T63-Y67 WeakPolarHBondContact OG1-CD2 3.28Å; E64-Y67 HydrophobicContact CB-CD2 3.89Å; E64-Y67 HydrophobicContact CB-CE2 4.16Å; E64-Y67 HydrophobicContact CG-CE2 4.37Å; E64-Y67 PolarHBondContact O-N 3.45Å; E64-Y67 WeakPolarHBondContact OE1-CE2 3.47Å; R65-Y67 PolarHBondContact O-N 3.35Å
68L84.3Confident83.7Confident39 Ų3990 Ų9020%0.20445%0.454CS..SBendtrans-87.9113.5176.4-61.5179.6000110.4L53 T63 R65 F104L53-L68 HydrophobicContact CD1-CD1 3.88Å; T63-L68 HydrophobicContact CG2-CD1 4.05Å; T63-L68 HydrophobicContact CG2-CD2 3.42Å; T63-L68 VanDerWaalsContact CG2-CD2 3.42Å; T63-L68 HydrophobicContact CG2-CG 3.57Å; R65-L68 PolarHBondContact O-N 3.39Å; R65-L68 VanDerWaalsContact O-N 3.1Å; R65-L68 VanDerWaalsContact O-O 3.05Å; L68-F104 HydrophobicContact CD2-CE1 3.56Å; L68-F104 HydrophobicContact CD2-CZ 3.75Å
69K86.5Confident85.8Confident171 Ų17190.9 Ų90.974%0.74345%0.449SS*.PPolyproline II helixtrans-74.5140.8168.7-64.2-156.6177.4-174.40109.3D71 N102K69-D71 PolarHBondContact O-N 3.28Å; K69-N102 PolarHBondContact O-ND2 3.33Å
70S91.2Very high87.6Confident104 Ų10492 Ų9273%0.72745%0.447SS*.PPolyproline II helixtrans-65.1131.8174-58.50000110.3
71D94.2Very high89.3Confident76 Ų7691 Ų9141%0.40645%0.446SS..PPolyproline II helixtrans-57.3141.4170.2-73.4-6.6000110.3K69 C101 N102 C157K69-D71 PolarHBondContact O-N 3.28Å; D71-C101 WeakPolarHBondContact OD1-CA 3.46Å; D71-N102 VanDerWaalsContact OD1-CG 3.28Å; D71-N102 PolarHBondContact OD1-N 2.88Å; D71-N102 PolarHBondContact OD1-ND2 3.26Å; D71-C157 HydrophobicContact CB-CB 4.43Å
72W97.4Very high90.7Very high89 Ų8986.5 Ų86.534%0.33742%0.418SS..EExtended strand (participates in β ladder)trans-140136.9166.566.4-89.6000109.8K74 Y98 G99 Q100W72-K74 HydrophobicContact CE3-CD 4.07Å; W72-K74 HydrophobicContact CE3-CG 4.05Å; W72-K74 HydrophobicContact CZ3-CD 4.02Å; W72-K74 HydrophobicContact CZ3-CG 4.28Å; W72-Y98 AromaticContact CH2-CD2 3.67Å; W72-Y98 HydrophobicContact CH2-CD2 3.67Å; W72-Y98 AromaticContact CH2-CE2 3.57Å; W72-Y98 HydrophobicContact CH2-CE2 3.57Å; W72-Y98 AromaticContact CZ3-CD2 3.7Å; W72-Y98 HydrophobicContact CZ3-CD2 3.7Å; W72-Y98 AromaticContact CZ3-CE2 3.5Å; W72-Y98 HydrophobicContact CZ3-CE2 3.5Å; W72-Y98 VanDerWaalsContact CZ3-CE2 3.5Å; W72-Y98 HydrophobicContact CZ3-CG 4.42Å; W72-G99 VanDerWaalsContact CZ3-CA 3.48Å; W72-G99 CarbonylContact O-C 3.55Å; W72-G99 WeakPolarHBondContact O-CA 3.41Å; W72-Q100 HydrophobicContact CZ2-CB 4.29Å; W72-Q100 HydrophobicContact CZ2-CG 3.73Å; W72-Q100 PolarHBondContact N-O 3.07Å; W72-Q100 PolarHBondContact O-N 3.19Å; W72-Q100 VanDerWaalsContact O-O 3.13Å
73C98.6Very high92Very high30 Ų3086.3 Ų86.320%0.20342%0.42CS..EExtended strand (participates in β ladder)trans-143.7125.9177.3178.10000108.1C123 R156C73-C123 VanDerWaalsContact CA-SG 3.58Å; C73-C123 HydrophobicContact CB-CB 3.84Å; C73-C123 WeakPolarHBondContact CB-SG 3.38Å; C73-C123 VanDerWaalsContact SG-CA 3.52Å; C73-C123 WeakPolarHBondContact SG-CB 3.46Å; C73-C123 CovalentContact SG-SG 2.04Å; C73-C123 PolarHBondContact SG-SG 3.06Å; C73-R156 VanDerWaalsContact SG-CA 3.54Å; C73-R156 PolarHBondContact SG-N 3.23Å; C73-R156 VanDerWaalsContact SG-N 3.36Å
74K98.5Very high92.8Very high103 Ų10387.6 Ų87.645%0.44842%0.423SS..EExtended strand (participates in β ladder)trans-114.9144.5-172.1-74.6175.4179.2177.40110.8W72 C97 Y98W72-K74 HydrophobicContact CE3-CD 4.07Å; W72-K74 HydrophobicContact CE3-CG 4.05Å; W72-K74 HydrophobicContact CZ3-CD 4.02Å; W72-K74 HydrophobicContact CZ3-CG 4.28Å; K74-C97 WeakPolarHBondContact O-CA 3.34Å; K74-Y98 HydrophobicContact CB-CD1 3.95Å; K74-Y98 HydrophobicContact CB-CE1 3.42Å; K74-Y98 VanDerWaalsContact CB-CE1 3.42Å; K74-Y98 HydrophobicContact CD-CE1 3.9Å; K74-Y98 HydrophobicContact CD-CE2 4.46Å; K74-Y98 WeakPolarHBondContact CD-OH 3.26Å; K74-Y98 HydrophobicContact CG-CE1 4.3Å; K74-Y98 PolarHBondContact N-O 3.34Å; K74-Y98 PolarHBondContact O-N 3.32Å
75T98.8Very high93.6Very high38 Ų3892.9 Ų92.923%0.23345%0.448CS..EExtended strand (participates in β ladder)trans-105.4114.3171.2-47.20000108R95 V152 C155T75-R95 HydrophobicContact CG2-CB 3.76Å; T75-R95 HydrophobicContact CG2-CG 4.17Å; T75-V152 HydrophobicContact CG2-CG1 4.25Å; T75-C155 WeakPolarHBondContact OG1-CB 3.33Å; T75-C155 PolarHBondContact OG1-N 3.19Å; T75-C155 PolarHBondContact OG1-SG 3.43Å; T75-C155 VanDerWaalsContact OG1-SG 3.34Å
76Q98.6Very high94.4Very high74 Ų7489 Ų8935%0.34645%0.449SS..EExtended strand (participates in β ladder)trans-116.9144.9-175.9-71.2-61.9-60.100112.2R95 F96 Y98Q76-R95 CarbonylContact O-C 3.24Å; Q76-R95 WeakPolarHBondContact O-CA 3.47Å; Q76-R95 VanDerWaalsContact O-CB 3.22Å; Q76-R95 WeakPolarHBondContact O-CB 2.95Å; Q76-F96 HydrophobicContact CB-CD1 3.81Å; Q76-F96 HydrophobicContact CB-CE1 3.31Å; Q76-F96 HydrophobicContact CB-CE2 4.35Å; Q76-F96 HydrophobicContact CB-CZ 3.62Å; Q76-F96 HydrophobicContact CG-CE1 4.35Å; Q76-F96 HydrophobicContact CG-CZ 4.21Å; Q76-F96 PolarHBondContact N-O 3.38Å; Q76-F96 WeakPolarHBondContact O-CD1 3.48Å; Q76-F96 PolarHBondContact O-N 3.46Å; Q76-Y98 HydrophobicContact CB-CE1 4.43Å; Q76-Y98 HydrophobicContact CG-CD1 3.99Å; Q76-Y98 HydrophobicContact CG-CE1 3.34Å
77P98.4Very high95.2Very high79 Ų7983.4 Ų83.451%0.51343%0.426SS..EExtended strand (participates in β ladder)trans-62.3140.817526.6-33000111.5L93P77-L93 HydrophobicContact CB-CD1 3.75Å
78L97.9Very high96Very high79 Ų7984.3 Ų84.341%0.41443%0.429SS..EExtended strand (participates in β ladder)trans-134131.2173.7178.263.2000109.2Q80 N94 F96L78-Q80 PolarHBondContact O-N 3.31Å; L78-N94 PolarHBondContact N-O 2.97Å; L78-N94 CarbonylContact O-C 3.47Å; L78-N94 PolarHBondContact O-N 3Å; L78-F96 HydrophobicContact CB-CD1 4.04Å
79R98Very high96.7Very high203 Ų20385.9 Ų85.977%0.76644%0.443SS*.EExtended strand (participates in β ladder)trans-80.5109.6167.4-68.8178.669.2136.80.4108.1T91R79-T91 HydrophobicContact CB-CG2 3.89Å; R79-T91 HydrophobicContact CG-CG2 4.43Å
80Q97.7Very high97.2Very high66 Ų6684.3 Ų84.331%0.30843%0.432SS..EExtended strand (participates in β ladder)trans-107.4128.2178.4-179178.6-2.800109.2L78 T91 I92 N94L78-Q80 PolarHBondContact O-N 3.31Å; Q80-T91 WeakPolarHBondContact O-CA 3.12Å; Q80-I92 HydrophobicContact CB-CG1 4.35Å; Q80-I92 PolarHBondContact N-O 3.48Å; Q80-I92 PolarHBondContact O-N 3.21Å; Q80-N94 HydrophobicContact CB-CB 4.19Å; Q80-N94 PolarHBondContact OE1-ND2 3Å
81T97.9Very high97.5Very high84 Ų8482.5 Ų82.552%0.51542%0.417SS..EExtended strand (participates in β ladder)trans-88.1132.6173.7-61.40000110T91T81-T91 PolarHBondContact OG1-OG1 3.46Å
82V98.1Very high97.6Very high4 Ų480.1 Ų80.12%0.02440%0.404CS..EExtended strand (participates in β ladder)trans-108.8119.3177.5-173.90000107.1S89 R90 I92 V133 L135 K147 I149V82-S89 CarbonylContact O-C 3.59Å; V82-S89 WeakPolarHBondContact O-CA 3.49Å; V82-S89 WeakPolarHBondContact O-CB 3.11Å; V82-R90 WeakPolarHBondContact CB-O 3.31Å; V82-R90 PolarHBondContact N-O 2.95Å; V82-R90 PolarHBondContact O-N 3.27Å; V82-I92 HydrophobicContact CG2-CD1 3.97Å; V82-I92 HydrophobicContact CG2-CG1 3.81Å; V82-I92 HydrophobicContact CG2-CG2 4.18Å; V82-V133 HydrophobicContact CG1-CG1 4.45Å; V82-V133 HydrophobicContact CG2-CG1 4.48Å; V82-L135 HydrophobicContact CB-CD2 4.32Å; V82-L135 HydrophobicContact CG1-CD1 4.22Å; V82-L135 HydrophobicContact CG1-CD2 4.08Å; V82-K147 HydrophobicContact CG1-CB 4.19Å; V82-K147 HydrophobicContact CG1-CD 3.69Å; V82-K147 HydrophobicContact CG1-CG 4.02Å; V82-I149 HydrophobicContact CB-CD1 3.85Å; V82-I149 HydrophobicContact CG1-CD1 3.39Å; V82-I149 HydrophobicContact CG1-CG1 4.49Å; V82-I149 HydrophobicContact CG2-CD1 3.11Å
83S96.9Very high97.6Very high65 Ų6580.1 Ų80.146%0.45541%0.41SS..  trans-124.9151-179.955.90000110.9S89 K147S83-S89 WeakPolarHBondContact CA-OG 3.1Å; S83-S89 WeakPolarHBondContact CB-OG 3.02Å; S83-K147 PolarHBondContact O-NZ 3Å
84E96Very high97.6Very high68 Ų6879.1 Ų79.132%0.31840%0.403SS..  trans-149.6147.6172.6-170163.1162.400107.9C87 L135E84-C87 HydrophobicContact CB-CB 4.19Å; E84-C87 PolarHBondContact O-N 3.46Å; E84-L135 HydrophobicContact CB-CD1 3.48Å; E84-L135 VanDerWaalsContact CB-CD1 3.48Å
85E95.1Very high97.6Very high184 Ų18478.2 Ų78.286%0.8640%0.397SS*.THydrogen-bonded Turntrans-62.1139.2-178.6-171.3177.3-179.900110.9C87E85-C87 PolarHBondContact O-N 3.48Å
86G96.1Very high97.6Very high49 Ų4980.6 Ų80.651%0.50540%0.404SS..THydrogen-bonded Turntrans71.51.8-177.100000114.9
87C97.8Very high97.6Very high19 Ų1978.6 Ų78.613%0.12840%0.398CS..SBendtrans-118.7149.5-177.8-55.20000112.7E84 E85 S89 L135 E136 C137E84-C87 HydrophobicContact CB-CB 4.19Å; E84-C87 PolarHBondContact O-N 3.46Å; E85-C87 PolarHBondContact O-N 3.48Å; C87-S89 PolarHBondContact O-N 3.38Å; C87-L135 HydrophobicContact CB-CB 3.97Å; C87-L135 HydrophobicContact CB-CD1 4.38Å; C87-E136 CarbonylContact C-O 3.56Å; C87-E136 VanDerWaalsContact CA-O 3.28Å; C87-E136 WeakPolarHBondContact CA-O 3.47Å; C87-C137 HydrophobicContact CB-CB 4Å; C87-C137 WeakPolarHBondContact CB-SG 3.02Å; C87-C137 WeakPolarHBondContact SG-CB 3.33Å; C87-C137 CovalentContact SG-SG 2.03Å; C87-C137 PolarHBondContact SG-SG 2.86Å
88R98.1Very high97.6Very high147 Ų14779 Ų7956%0.55539%0.39SS*.  trans-70.2125.7170.1-67.6-178.2177.9167.6-1.1109.6E136R88-E136 HydrophobicContact CB-CB 4.47Å; R88-E136 WeakPolarHBondContact CD-OE2 3.32Å; R88-E136 IonicContact CZ-OE1 3.5Å; R88-E136 IonicContact CZ-OE2 3.68Å; R88-E136 PolarHBondContact N-O 2.93Å; R88-E136 IonicContact NE-OE2 3.86Å; R88-E136 IonicContact NH1-OE1 2.91Å; R88-E136 PolarHBondContact NH1-OE1 2.91Å; R88-E136 IonicContact NH1-OE2 2.84Å; R88-E136 PolarHBondContact NH1-OE2 3.41Å
89S98.1Very high97.6Very high72 Ų7276.7 Ų76.750%0.50339%0.385SS..  trans-68.4141.3178.9-65.20000111.2V82 S83 C87V82-S89 CarbonylContact O-C 3.59Å; V82-S89 WeakPolarHBondContact O-CA 3.49Å; V82-S89 WeakPolarHBondContact O-CB 3.11Å; S83-S89 WeakPolarHBondContact CA-OG 3.1Å; S83-S89 WeakPolarHBondContact CB-OG 3.02Å; C87-S89 PolarHBondContact O-N 3.38Å
90R97.5Very high97.5Very high137 Ų13773.1 Ų73.152%0.51738%0.377SS..EExtended strand (participates in β ladder)trans-120.4132.1179.9-174.8176.2176.5167.33.5110.7V82 I92 E134 L135V82-R90 WeakPolarHBondContact CB-O 3.31Å; V82-R90 PolarHBondContact N-O 2.95Å; V82-R90 PolarHBondContact O-N 3.27Å; R90-I92 HydrophobicContact CG-CG2 4.47Å; R90-E134 PolarHBondContact NH1-O 3.06Å; R90-L135 HydrophobicContact CB-CD2 3.76Å
91T98Very high97.4Very high66 Ų6671.5 Ų71.541%0.40537%0.373SS..EExtended strand (participates in β ladder)trans-86.5128.7171-54.90000110.4R79 Q80 T81R79-T91 HydrophobicContact CB-CG2 3.89Å; R79-T91 HydrophobicContact CG-CG2 4.43Å; Q80-T91 WeakPolarHBondContact O-CA 3.12Å; T81-T91 PolarHBondContact OG1-OG1 3.46Å
92I97.1Very high97.1Very high26 Ų2669.8 Ų69.813%0.13336%0.361CS..EExtended strand (participates in β ladder)trans-117.1155.6173.665.9164000110.8Q80 V82 R90 N94 V133 I149Q80-I92 HydrophobicContact CB-CG1 4.35Å; Q80-I92 PolarHBondContact N-O 3.48Å; Q80-I92 PolarHBondContact O-N 3.21Å; V82-I92 HydrophobicContact CG2-CD1 3.97Å; V82-I92 HydrophobicContact CG2-CG1 3.81Å; V82-I92 HydrophobicContact CG2-CG2 4.18Å; R90-I92 HydrophobicContact CG-CG2 4.47Å; I92-N94 PolarHBondContact O-N 3.21Å; I92-V133 HydrophobicContact CD1-CG2 4.16Å; I92-V133 HydrophobicContact CG2-CG1 4.13Å; I92-V133 HydrophobicContact CG2-CG2 4.1Å; I92-I149 HydrophobicContact CD1-CD1 3.94Å; I92-I149 HydrophobicContact CD1-CG2 4.33Å
93L97.6Very high96.8Very high89 Ų8973.5 Ų73.547%0.46639%0.387SS..EExtended strand (participates in β ladder)trans-84.5110.5170.3-175.365.9000109.9P77 K151P77-L93 HydrophobicContact CB-CD1 3.75Å; L93-K151 WeakPolarHBondContact O-CE 3.47Å; L93-K151 PolarHBondContact O-NZ 3Å
94N97.9Very high96.4Very high10 Ų1073.2 Ų73.25%0.05338%0.377CS..EExtended strand (participates in β ladder)trans-108.4-170167.8-154.9-12.9000110.2L78 Q80 I92 Q150 K151 V152L78-N94 PolarHBondContact N-O 2.97Å; L78-N94 CarbonylContact O-C 3.47Å; L78-N94 PolarHBondContact O-N 3Å; Q80-N94 HydrophobicContact CB-CB 4.19Å; Q80-N94 PolarHBondContact OE1-ND2 3Å; I92-N94 PolarHBondContact O-N 3.21Å; N94-Q150 PolarHBondContact ND2-O 3.32Å; N94-K151 VanDerWaalsContact OD1-CA 3.28Å; N94-K151 WeakPolarHBondContact OD1-CA 3.32Å; N94-V152 PolarHBondContact OD1-N 3.38Å
95R98.6Very high95.9Very high84 Ų8476.8 Ų76.832%0.31739%0.389SS..EExtended strand (participates in β ladder)trans-137.9152.1174.6-58.3-174.8177.278.5-0.5111.3T75 Q76 V152T75-R95 HydrophobicContact CG2-CB 3.76Å; T75-R95 HydrophobicContact CG2-CG 4.17Å; Q76-R95 CarbonylContact O-C 3.24Å; Q76-R95 WeakPolarHBondContact O-CA 3.47Å; Q76-R95 VanDerWaalsContact O-CB 3.22Å; Q76-R95 WeakPolarHBondContact O-CB 2.95Å; R95-V152 HydrophobicContact CB-CB 4.05Å; R95-V152 HydrophobicContact CB-CG1 4.25Å; R95-V152 WeakPolarHBondContact O-CB 3.07Å; R95-V152 WeakPolarHBondContact O-CG2 3Å
96F98.2Very high95.4Very high87 Ų8769.5 Ų69.538%0.38236%0.355SS..EExtended strand (participates in β ladder)trans-120161.2172.274.5-81.3000111Q76 L78 Y98Q76-F96 HydrophobicContact CB-CD1 3.81Å; Q76-F96 HydrophobicContact CB-CE1 3.31Å; Q76-F96 HydrophobicContact CB-CE2 4.35Å; Q76-F96 HydrophobicContact CB-CZ 3.62Å; Q76-F96 HydrophobicContact CG-CE1 4.35Å; Q76-F96 HydrophobicContact CG-CZ 4.21Å; Q76-F96 PolarHBondContact N-O 3.38Å; Q76-F96 WeakPolarHBondContact O-CD1 3.48Å; Q76-F96 PolarHBondContact O-N 3.46Å; L78-F96 HydrophobicContact CB-CD1 4.04Å; F96-Y98 HydrophobicContact CD2-CD1 4.44Å; F96-Y98 AromaticContact CE2-CD1 3.78Å; F96-Y98 HydrophobicContact CE2-CD1 3.78Å; F96-Y98 HydrophobicContact CE2-CG 4.15Å; F96-Y98 HydrophobicContact CZ-CD1 4.36Å
97C98.7Very high94.9Very high33 Ų3371.1 Ų71.122%0.22336%0.357CS..EExtended strand (participates in β ladder)trans-108.5135.3178.8-580000110.3K74 P125 C155K74-C97 WeakPolarHBondContact O-CA 3.34Å; C97-P125 VanDerWaalsContact SG-N 3.41Å; C97-C155 WeakPolarHBondContact CA-SG 3.36Å; C97-C155 HydrophobicContact CB-CB 3.65Å; C97-C155 WeakPolarHBondContact CB-SG 3.44Å; C97-C155 WeakPolarHBondContact SG-CB 3.37Å; C97-C155 CovalentContact SG-SG 2.02Å; C97-C155 PolarHBondContact SG-SG 3.01Å
98Y98.2Very high94Very high87 Ų8776.2 Ų76.234%0.34137%0.373SS..EExtended strand (participates in β ladder)trans-151146.5168.881.1-68.3000109.8W72 K74 Q76 F96 C123W72-Y98 AromaticContact CH2-CD2 3.67Å; W72-Y98 HydrophobicContact CH2-CD2 3.67Å; W72-Y98 AromaticContact CH2-CE2 3.57Å; W72-Y98 HydrophobicContact CH2-CE2 3.57Å; W72-Y98 AromaticContact CZ3-CD2 3.7Å; W72-Y98 HydrophobicContact CZ3-CD2 3.7Å; W72-Y98 AromaticContact CZ3-CE2 3.5Å; W72-Y98 HydrophobicContact CZ3-CE2 3.5Å; W72-Y98 VanDerWaalsContact CZ3-CE2 3.5Å; W72-Y98 HydrophobicContact CZ3-CG 4.42Å; K74-Y98 HydrophobicContact CB-CD1 3.95Å; K74-Y98 HydrophobicContact CB-CE1 3.42Å; K74-Y98 VanDerWaalsContact CB-CE1 3.42Å; K74-Y98 HydrophobicContact CD-CE1 3.9Å; K74-Y98 HydrophobicContact CD-CE2 4.46Å; K74-Y98 WeakPolarHBondContact CD-OH 3.26Å; K74-Y98 HydrophobicContact CG-CE1 4.3Å; K74-Y98 PolarHBondContact N-O 3.34Å; K74-Y98 PolarHBondContact O-N 3.32Å; Q76-Y98 HydrophobicContact CB-CE1 4.43Å; Q76-Y98 HydrophobicContact CG-CD1 3.99Å; Q76-Y98 HydrophobicContact CG-CE1 3.34Å; F96-Y98 HydrophobicContact CD2-CD1 4.44Å; F96-Y98 AromaticContact CE2-CD1 3.78Å; F96-Y98 HydrophobicContact CE2-CD1 3.78Å; F96-Y98 HydrophobicContact CE2-CG 4.15Å; F96-Y98 HydrophobicContact CZ-CD1 4.36Å; Y98-C123 PolarHBondContact O-SG 3.03Å
99G97.8Very high92.4Very high30 Ų3077.4 Ų77.431%0.30939%0.385SS..EExtended strand (participates in β ladder)trans-179.8176.2-168.700000113.6W72W72-G99 VanDerWaalsContact CZ3-CA 3.48Å; W72-G99 CarbonylContact O-C 3.55Å; W72-G99 WeakPolarHBondContact O-CA 3.41Å
100Q96.4Very high90.6Very high128 Ų12879.3 Ų79.360%0.59839%0.394SS*.EExtended strand (participates in β ladder)trans-129.5124.4168.3-66.4175.1-30.500107.9W72W72-Q100 HydrophobicContact CZ2-CB 4.29Å; W72-Q100 HydrophobicContact CZ2-CG 3.73Å; W72-Q100 PolarHBondContact N-O 3.07Å; W72-Q100 PolarHBondContact O-N 3.19Å; W72-Q100 VanDerWaalsContact O-O 3.13Å
101C95.5Very high88.8Confident32 Ų3281.7 Ų81.722%0.21641%0.407CS..  trans-123145.3-179.2-50.40000108.8D71 A121 C123 C157D71-C101 WeakPolarHBondContact OD1-CA 3.46Å; C101-A121 HydrophobicContact CB-CB 3.89Å; C101-A121 WeakPolarHBondContact CB-O 3.29Å; C101-C123 PolarHBondContact SG-N 2.76Å; C101-C123 VanDerWaalsContact SG-N 3.42Å; C101-C157 HydrophobicContact CB-CB 3.74Å; C101-C157 WeakPolarHBondContact CB-SG 3.5Å; C101-C157 WeakPolarHBondContact SG-CA 3.24Å; C101-C157 WeakPolarHBondContact SG-CB 3.47Å; C101-C157 CovalentContact SG-SG 2.04Å; C101-C157 PolarHBondContact SG-SG 3.1Å
102N91.9Very high87.1Confident49 Ų4989.2 Ų89.226%0.26244%0.435SS..  trans-72.1149.6177.1-70.2-62000111.9K69 D71 F104K69-N102 PolarHBondContact O-ND2 3.33Å; D71-N102 VanDerWaalsContact OD1-CG 3.28Å; D71-N102 PolarHBondContact OD1-N 2.88Å; D71-N102 PolarHBondContact OD1-ND2 3.26Å; N102-F104 HydrophobicContact CB-CE2 3.87Å; N102-F104 HydrophobicContact CB-CZ 3.94Å
103S91.3Very high85.6Confident82 Ų8296.9 Ų96.957%0.57347%0.47SS*.EExtended strand (participates in β ladder)trans-132152.2166.761.10000109.5S119S103-S119 CarbonylContact C-O 3.49Å; S103-S119 VanDerWaalsContact CA-O 3.29Å; S103-S119 WeakPolarHBondContact CA-O 3.46Å
104F87.9Confident84Confident58 Ų5898.7 Ų98.725%0.25448%0.476SS..EExtended strand (participates in β ladder)trans-134.6131.4-175.9-60.3-77.6000109.7V62 L68 N102 F117 Q118 S119V62-F104 HydrophobicContact CG1-CD1 4.29Å; L68-F104 HydrophobicContact CD2-CE1 3.56Å; L68-F104 HydrophobicContact CD2-CZ 3.75Å; N102-F104 HydrophobicContact CB-CE2 3.87Å; N102-F104 HydrophobicContact CB-CZ 3.94Å; F104-F117 HydrophobicContact CB-CE1 4.22Å; F104-Q118 WeakPolarHBondContact O-CA 3.22Å; F104-S119 PolarHBondContact N-O 3.24Å; F104-S119 PolarHBondContact O-N 3.39Å
105Y87.3Confident82.9Confident144 Ų144106.5 Ų106.557%0.56551%0.512SS*.EExtended strand (participates in β ladder)trans-126.3116.4166.3179.4-90.9000107.2P107 S116 Q118Y105-P107 HydrophobicContact CD1-CG 4.3Å; Y105-P107 HydrophobicContact CE1-CG 3.92Å; Y105-S116 WeakPolarHBondContact CE2-OG 3.43Å; Y105-S116 WeakPolarHBondContact OH-CB 3.29Å; Y105-S116 PolarHBondContact OH-OG 3.22Å; Y105-Q118 HydrophobicContact CD2-CG 4.36Å
106I84.5Confident82.1Confident30 Ų30104.4 Ų104.415%0.15451%0.51CS..EExtended strand (participates in β ladder)trans-120.2108.8-178.1-52.5170.7000107.4L60 V62 R108 F117L60-I106 HydrophobicContact CD2-CD1 3.57Å; L60-I106 HydrophobicContact CD2-CG2 4.23Å; L60-I106 HydrophobicContact CG-CD1 4.33Å; V62-I106 HydrophobicContact CB-CD1 4.08Å; V62-I106 HydrophobicContact CG1-CD1 3.63Å; V62-I106 HydrophobicContact CG1-CG1 3.9Å; V62-I106 HydrophobicContact CG2-CD1 3.35Å; V62-I106 HydrophobicContact CG2-CG1 4.48Å; I106-R108 PolarHBondContact O-N 3.28Å; I106-F117 HydrophobicContact CB-CB 4.22Å; I106-F117 HydrophobicContact CB-CD1 4.18Å; I106-F117 HydrophobicContact CD1-CD1 3.52Å; I106-F117 HydrophobicContact CD1-CE1 3.95Å; I106-F117 HydrophobicContact CD1-CG 4.4Å; I106-F117 HydrophobicContact CG1-CD1 3.89Å; I106-F117 PolarHBondContact N-O 3.34Å; I106-F117 PolarHBondContact O-N 3.43Å
107P84.3Confident81.4Confident83 Ų83104 Ų10454%0.53951%0.508SS..PPolyproline II helixtrans-57.9126170.1-18.229000109.2Y105Y105-P107 HydrophobicContact CD1-CG 4.3Å; Y105-P107 HydrophobicContact CE1-CG 3.92Å
108R79.2Confident80.7Confident126 Ų126107.6 Ų107.648%0.47552%0.522SS..PPolyproline II helixtrans-90.4131.6163-67.8-174.1178.4-170.53.3107.5I106 E114I106-R108 PolarHBondContact O-N 3.28Å; R108-E114 IonicContact CZ-OE2 3.86Å; R108-E114 IonicContact NH1-OE2 2.79Å; R108-E114 PolarHBondContact NH1-OE2 3.21Å
109H65.2Low80.3Confident173 Ų173105.5 Ų105.580%0.80152%0.52SS*.PPolyproline II helixtrans-82.1141.8158.3-64.4-59.7000107
110V59.3Low80Confident112 Ų112105.6 Ų105.668%0.67952%0.516SS*.SBendtrans123.8125.4154.4-170.20000114.2
111K60.7Low79.9Confident186 Ų186100.5 Ų100.581%0.80950%0.496SS*.SBendtrans40.596.8167.2-64.9177.5-175-177.70116.8E113K111-E113 PolarHBondContact O-N 3.04Å
112K62.5Low79.9Confident225 Ų225105.3 Ų105.398%0.97851%0.513SS*.THydrogen-bonded Turntrans25.2-18.8157.4-104.4-174.8-177.9-175.70123.6
113E64.4Low80.2Confident186 Ų186103.5 Ų103.587%0.86950%0.504SS*.THydrogen-bonded Turntrans-121.9-10.4-169.1-68.7-179.8178.600114.4K111K111-E113 PolarHBondContact O-N 3.04Å
114E64.9Low80.5Confident128 Ų128102.9 Ų102.960%0.59849%0.491SS*.PPolyproline II helixtrans-95.1117.8171.5-71.2-168.7-157.400111.7R108R108-E114 IonicContact CZ-OE2 3.86Å; R108-E114 IonicContact NH1-OE2 2.79Å; R108-E114 PolarHBondContact NH1-OE2 3.21Å
115E75.4Confident81Confident174 Ų174102.8 Ų102.881%0.81350%0.496SS*.PPolyproline II helixtrans-66.2151.8172.9-64.8-179.4170.100111.4
116S81.8Confident81.5Confident40 Ų4099.1 Ų99.128%0.2848%0.484SS..PPolyproline II helixtrans-55.7141171.6520000110.8Y105 Q118Y105-S116 WeakPolarHBondContact CE2-OG 3.43Å; Y105-S116 WeakPolarHBondContact OH-CB 3.29Å; Y105-S116 PolarHBondContact OH-OG 3.22Å; S116-Q118 PolarHBondContact O-N 3.01Å
117F82.4Confident82.1Confident77 Ų77105 Ų10534%0.33851%0.505SS..EExtended strand (participates in β ladder)trans-70.5125.6174.2171-89.9000109.6F104 I106F104-F117 HydrophobicContact CB-CE1 4.22Å; I106-F117 HydrophobicContact CB-CB 4.22Å; I106-F117 HydrophobicContact CB-CD1 4.18Å; I106-F117 HydrophobicContact CD1-CD1 3.52Å; I106-F117 HydrophobicContact CD1-CE1 3.95Å; I106-F117 HydrophobicContact CD1-CG 4.4Å; I106-F117 HydrophobicContact CG1-CD1 3.89Å; I106-F117 PolarHBondContact N-O 3.34Å; I106-F117 PolarHBondContact O-N 3.43Å
118Q85Confident82.8Confident110 Ų110104.3 Ų104.351%0.51450%0.498SS..EExtended strand (participates in β ladder)trans-131.5130.6178.1-165.6173.126.100110.3F104 Y105 S116 L162F104-Q118 WeakPolarHBondContact O-CA 3.22Å; Y105-Q118 HydrophobicContact CD2-CG 4.36Å; S116-Q118 PolarHBondContact O-N 3.01Å; Q118-L162 HydrophobicContact CG-CD1 3.76Å
119S88.3Confident83.7Confident43 Ų43100.9 Ų100.930%0.30149%0.492SS..EExtended strand (participates in β ladder)trans-137.9125.8174.6-173.50000109.1S103 F104S103-S119 CarbonylContact C-O 3.49Å; S103-S119 VanDerWaalsContact CA-O 3.29Å; S103-S119 WeakPolarHBondContact CA-O 3.46Å; F104-S119 PolarHBondContact N-O 3.24Å; F104-S119 PolarHBondContact O-N 3.39Å
120C92Very high85.2Confident32 Ų3295.9 Ų95.922%0.21648%0.476CS..EExtended strand (participates in β ladder)trans-131.2137.1178.3-173.90000109.2S159 V160 L162C120-S159 CarbonylContact O-C 3.56Å; C120-S159 VanDerWaalsContact O-CA 3.26Å; C120-S159 WeakPolarHBondContact O-CA 3.49Å; C120-V160 HydrophobicContact CB-CG2 3.96Å; C120-V160 PolarHBondContact O-N 3.25Å; C120-L162 HydrophobicContact CB-CD1 4.01Å; C120-L162 HydrophobicContact CB-CD2 4.14Å; C120-L162 HydrophobicContact CB-CG 4.2Å
121A93.9Very high87Confident21 Ų2192.8 Ų92.817%0.17446%0.457CS..EExtended strand (participates in β ladder)trans-121144.7173.300000111C101 C157 M158C101-A121 HydrophobicContact CB-CB 3.89Å; C101-A121 WeakPolarHBondContact CB-O 3.29Å; A121-C157 HydrophobicContact CB-CB 4.48Å; A121-M158 CarbonylContact C-O 3.53Å; A121-M158 VanDerWaalsContact CA-O 3.26Å; A121-M158 WeakPolarHBondContact CA-O 3.19Å
122F95.7Very high88.8Confident132 Ų13289.5 Ų89.558%0.57945%0.448SS*.EExtended strand (participates in β ladder)trans-125.6141.6178.1-173.5-108.4000110.7K124 M158 V160F122-K124 HydrophobicContact CD1-CB 3.82Å; F122-K124 HydrophobicContact CD1-CD 4.48Å; F122-K124 HydrophobicContact CD1-CG 4.43Å; F122-K124 HydrophobicContact CE1-CB 4.23Å; F122-K124 PolarHBondContact O-N 3.38Å; F122-K124 VanDerWaalsContact O-N 3.13Å; F122-M158 PolarHBondContact N-O 3.37Å; F122-M158 PolarHBondContact O-N 3.14Å; F122-V160 HydrophobicContact CB-CG1 3.96Å
123C98.1Very high90.5Very high11 Ų1179.2 Ų79.27%0.07440%0.404CS..EExtended strand (participates in β ladder)trans-78.895.7176.6176.20000109.6C73 Y98 C101C73-C123 VanDerWaalsContact CA-SG 3.58Å; C73-C123 HydrophobicContact CB-CB 3.84Å; C73-C123 WeakPolarHBondContact CB-SG 3.38Å; C73-C123 VanDerWaalsContact SG-CA 3.52Å; C73-C123 WeakPolarHBondContact SG-CB 3.46Å; C73-C123 CovalentContact SG-SG 2.04Å; C73-C123 PolarHBondContact SG-SG 3.06Å; Y98-C123 PolarHBondContact O-SG 3.03Å; C101-C123 PolarHBondContact SG-N 2.76Å; C101-C123 VanDerWaalsContact SG-N 3.42Å
124K97.5Very high92.1Very high70 Ų7075.7 Ų75.730%0.30439%0.388SS..EExtended strand (participates in β ladder)trans-129.2167.5-175.761.2-178.8-178.11800113.1F122 Q126 C155 R156 M158F122-K124 HydrophobicContact CD1-CB 3.82Å; F122-K124 HydrophobicContact CD1-CD 4.48Å; F122-K124 HydrophobicContact CD1-CG 4.43Å; F122-K124 HydrophobicContact CE1-CB 4.23Å; F122-K124 PolarHBondContact O-N 3.38Å; F122-K124 VanDerWaalsContact O-N 3.13Å; K124-Q126 PolarHBondContact O-N 3.47Å; K124-Q126 VanDerWaalsContact O-N 3.13Å; K124-C155 VanDerWaalsContact O-CA 3.31Å; K124-C155 WeakPolarHBondContact O-CA 3.42Å; K124-R156 PolarHBondContact N-O 3.09Å; K124-R156 PolarHBondContact O-N 3.48Å; K124-M158 HydrophobicContact CG-CB 4.28Å; K124-M158 HydrophobicContact CG-SD 4.13Å
125P98.1Very high93.6Very high56 Ų5669.7 Ų69.736%0.36436%0.36SS..EExtended strand (participates in β ladder)trans-58.2117.2174.4-25.135.3000111.3C97 V128 V152 Q154C97-P125 VanDerWaalsContact SG-N 3.41Å; P125-V128 HydrophobicContact CB-CG2 3.4Å; P125-V128 HydrophobicContact CG-CG2 4.37Å; P125-V152 HydrophobicContact CB-CG1 4.09Å; P125-V152 HydrophobicContact CB-CG2 4.15Å; P125-V152 HydrophobicContact CG-CG1 4.25Å; P125-V152 HydrophobicContact CG-CG2 3.81Å; P125-Q154 CarbonylContact C-O 3.54Å; P125-Q154 WeakPolarHBondContact CA-O 3.26Å
126Q97.6Very high94.7Very high67 Ų6766.1 Ų66.131%0.31334%0.343SS..EExtended strand (participates in β ladder)trans-82.6-36.8171.1-172.8-168.88.100110.7K124 Q154 R156 M158K124-Q126 PolarHBondContact O-N 3.47Å; K124-Q126 VanDerWaalsContact O-N 3.13Å; Q126-Q154 PolarHBondContact N-O 3.31Å; Q126-R156 HydrophobicContact CB-CB 4.01Å; Q126-R156 HydrophobicContact CG-CB 4.37Å; Q126-M158 HydrophobicContact CB-SD 3.98Å; Q126-M158 HydrophobicContact CG-SD 4.1Å
127R98.4Very high95.5Very high153 Ų15364.2 Ų64.258%0.57733%0.33SS*.EExtended strand (participates in β ladder)trans-128.1121.6179.3-64.5-178.9179.8164.7-6.1109.5K153 Q154R127-K153 HydrophobicContact CB-CB 3.95Å; R127-K153 WeakPolarHBondContact O-CB 3.41Å; R127-K153 PolarHBondContact O-N 2.85Å; R127-Q154 HydrophobicContact CB-CB 4.07Å; R127-Q154 HydrophobicContact CG-CB 4.31Å; R127-Q154 PolarHBondContact N-O 3.02Å; R127-Q154 VanDerWaalsContact N-O 3.15Å; R127-Q154 VanDerWaalsContact NH1-OE1 3.11Å; R127-Q154 PolarHBondContact O-N 2.89Å
128V98.5Very high96.2Very high68 Ų6864.7 Ų64.741%0.41234%0.34SS..EExtended strand (participates in β ladder)trans-125.7143.1176.6-174.90000108.6P125 Q150 K151P125-V128 HydrophobicContact CB-CG2 3.4Å; P125-V128 HydrophobicContact CG-CG2 4.37Å; V128-Q150 HydrophobicContact CG1-CB 3.96Å; V128-Q150 HydrophobicContact CG1-CG 4.32Å; V128-K151 WeakPolarHBondContact CA-O 3.42Å
129T97.8Very high96.7Very high55 Ų5562.9 Ų62.934%0.33735%0.351SS..EExtended strand (participates in β ladder)trans-128.4148173.755.20000109.2K151 K153T129-K151 PolarHBondContact N-O 3.14Å; T129-K151 PolarHBondContact O-N 3.07Å; T129-K151 PolarHBondContact OG1-O 3.22Å; T129-K153 HydrophobicContact CG2-CD 4.46Å; T129-K153 HydrophobicContact CG2-CG 3.87Å; T129-K153 WeakPolarHBondContact OG1-CE 3.31Å
130S98Very high97Very high68 Ų6863.7 Ų63.748%0.47635%0.352SS..EExtended strand (participates in β ladder)trans-89.8139.1168.3-64.80000110.3K148 I149S130-K148 VanDerWaalsContact CB-CE 3.41Å; S130-K148 VanDerWaalsContact OG-CE 3.32Å; S130-K148 WeakPolarHBondContact OG-CE 3.31Å; S130-I149 CarbonylContact C-O 3.35Å; S130-I149 WeakPolarHBondContact CA-O 3.21Å
131V96.5Very high97.2Very high46 Ų4669.4 Ų69.428%0.27938%0.38SS..EExtended strand (participates in β ladder)trans-125.8142.1172.6-63.60000109.5V133 K148 I149 K151V131-V133 HydrophobicContact CG2-CG2 4.34Å; V131-K148 WeakPolarHBondContact O-CA 3.31Å; V131-I149 HydrophobicContact CG2-CB 4.37Å; V131-I149 PolarHBondContact N-O 3.17Å; V131-I149 PolarHBondContact O-N 3.2Å; V131-K151 HydrophobicContact CG1-CB 4.45Å; V131-K151 HydrophobicContact CG1-CD 4.4Å; V131-K151 HydrophobicContact CG2-CB 4.39Å
132L97.8Very high97.3Very high117 Ų11770.8 Ų70.861%0.61339%0.388SS*.EExtended strand (participates in β ladder)trans-89.3126.4168.8-66.5175.3000108.3K148L132-K148 HydrophobicContact CD2-CB 3.82Å; L132-K148 HydrophobicContact CD2-CG 4.21Å
133V97.8Very high97.4Very high10 Ų1068.1 Ų68.16%0.06138%0.384CS..EExtended strand (participates in β ladder)trans-108.5117.3175.7-179.60000107.5V82 I92 V131 L135 K147 I149V82-V133 HydrophobicContact CG1-CG1 4.45Å; V82-V133 HydrophobicContact CG2-CG1 4.48Å; I92-V133 HydrophobicContact CD1-CG2 4.16Å; I92-V133 HydrophobicContact CG2-CG1 4.13Å; I92-V133 HydrophobicContact CG2-CG2 4.1Å; V131-V133 HydrophobicContact CG2-CG2 4.34Å; V133-L135 HydrophobicContact CG1-CD2 4.1Å; V133-K147 PolarHBondContact N-O 2.9Å; V133-K147 PolarHBondContact O-N 3.28Å; V133-I149 HydrophobicContact CB-CD1 4.18Å; V133-I149 HydrophobicContact CG2-CD1 3.63Å; V133-I149 HydrophobicContact CG2-CG1 4.16Å
134E97.8Very high97.3Very high112 Ų11271.7 Ų71.752%0.52340%0.398SS..EExtended strand (participates in β ladder)trans-77.8127.1170.7-166.2179.4119.300110.2R90 F144 R145 L146R90-E134 PolarHBondContact NH1-O 3.06Å; E134-F144 HydrophobicContact CG-CB 4.09Å; E134-F144 HydrophobicContact CG-CD2 4.27Å; E134-F144 HydrophobicContact CG-CG 4.47Å; E134-R145 WeakPolarHBondContact CA-O 3.34Å; E134-L146 HydrophobicContact CB-CD2 3.75Å; E134-L146 HydrophobicContact CG-CD2 3.92Å
135L98.4Very high97.3Very high2 Ų273 Ų731%0.0140%0.401CS..EExtended strand (participates in β ladder)trans-109.2139.2174.4-58.1178.7000108.9V82 E84 C87 R90 V133 C137 F144 R145 K147V82-L135 HydrophobicContact CB-CD2 4.32Å; V82-L135 HydrophobicContact CG1-CD1 4.22Å; V82-L135 HydrophobicContact CG1-CD2 4.08Å; E84-L135 HydrophobicContact CB-CD1 3.48Å; E84-L135 VanDerWaalsContact CB-CD1 3.48Å; C87-L135 HydrophobicContact CB-CB 3.97Å; C87-L135 HydrophobicContact CB-CD1 4.38Å; R90-L135 HydrophobicContact CB-CD2 3.76Å; V133-L135 HydrophobicContact CG1-CD2 4.1Å; L135-C137 PolarHBondContact O-SG 2.65Å; L135-C137 VanDerWaalsContact O-SG 3.41Å; L135-F144 CarbonylContact O-C 3.59Å; L135-F144 WeakPolarHBondContact O-CA 3.37Å; L135-F144 WeakPolarHBondContact O-CB 3.44Å; L135-R145 PolarHBondContact N-O 3.32Å; L135-R145 PolarHBondContact O-N 2.96Å; L135-K147 HydrophobicContact CD1-CB 4.31Å; L135-K147 HydrophobicContact CD1-CD 4.39Å
136E98.3Very high97.3Very high99 Ų9974.8 Ų74.846%0.46341%0.407SS..EExtended strand (participates in β ladder)trans-82.8126176.2-173.9-168.2167.700109.4C87 R88C87-E136 CarbonylContact C-O 3.56Å; C87-E136 VanDerWaalsContact CA-O 3.28Å; C87-E136 WeakPolarHBondContact CA-O 3.47Å; R88-E136 HydrophobicContact CB-CB 4.47Å; R88-E136 WeakPolarHBondContact CD-OE2 3.32Å; R88-E136 IonicContact CZ-OE1 3.5Å; R88-E136 IonicContact CZ-OE2 3.68Å; R88-E136 PolarHBondContact N-O 2.93Å; R88-E136 IonicContact NE-OE2 3.86Å; R88-E136 IonicContact NH1-OE1 2.91Å; R88-E136 PolarHBondContact NH1-OE1 2.91Å; R88-E136 IonicContact NH1-OE2 2.84Å; R88-E136 PolarHBondContact NH1-OE2 3.41Å
137C97.8Very high97.2Very high0 Ų075.3 Ų75.30%041%0.408CS..  trans-130.775.4-173.2-45.50000110.3C87 L135 G139 L140 P143 R145C87-C137 HydrophobicContact CB-CB 4Å; C87-C137 WeakPolarHBondContact CB-SG 3.02Å; C87-C137 WeakPolarHBondContact SG-CB 3.33Å; C87-C137 CovalentContact SG-SG 2.03Å; C87-C137 PolarHBondContact SG-SG 2.86Å; L135-C137 PolarHBondContact O-SG 2.65Å; L135-C137 VanDerWaalsContact O-SG 3.41Å; C137-G139 PolarHBondContact O-N 3.25Å; C137-L140 HydrophobicContact CB-CB 4.03Å; C137-L140 HydrophobicContact CB-CD1 3.77Å; C137-L140 HydrophobicContact CB-CG 3.97Å; C137-L140 PolarHBondContact O-N 3.48Å; C137-P143 PolarHBondContact N-O 2.98Å; C137-P143 CarbonylContact O-C 3.49Å; C137-P143 WeakPolarHBondContact O-CA 3.3Å; C137-R145 WeakPolarHBondContact SG-CG 3.22Å; C137-R145 PolarHBondContact SG-N 3.31Å; C137-R145 VanDerWaalsContact SG-N 3.4Å
138P96.5Very high97.2Very high86 Ų8675.1 Ų75.156%0.55841%0.412SS*.THydrogen-bonded Turntrans-64.5-17.5-167.625.5-35.1000114.8
139G95.5Very high97.1Very high72 Ų7272.7 Ų72.774%0.74240%0.396SS*.THydrogen-bonded Turntrans-97.13176.800000114.9C137C137-G139 PolarHBondContact O-N 3.25Å
140L95.5Very high97.1Very high60 Ų6076.8 Ų76.831%0.31441%0.411SS..SBendtrans-112.6156.9-178.1-56.9-175.5000111C137 P142 P143 R145C137-L140 HydrophobicContact CB-CB 4.03Å; C137-L140 HydrophobicContact CB-CD1 3.77Å; C137-L140 HydrophobicContact CB-CG 3.97Å; C137-L140 PolarHBondContact O-N 3.48Å; L140-P142 CarbonylContact C-O 3.44Å; L140-P142 CarbonylContact O-C 3.51Å; L140-P142 VanDerWaalsContact O-C 3.24Å; L140-P143 VanDerWaalsContact O-CA 3.29Å; L140-P143 WeakPolarHBondContact O-CA 3.48Å; L140-R145 HydrophobicContact CD1-CG 4.2Å
141D95.8Very high97.1Very high152 Ų15275.6 Ų75.681%0.81340%0.398SS*.SBendtrans-118.1116.5166.8-17430.9000109.2
142P95.6Very high97.2Very high51 Ų5174.2 Ų74.233%0.33139%0.39SS..SBendcis-68.2161.1-1.731.5-36.6000112.5L140 F144L140-P142 CarbonylContact C-O 3.44Å; L140-P142 CarbonylContact O-C 3.51Å; L140-P142 VanDerWaalsContact O-C 3.24Å; P142-F144 HydrophobicContact CB-CD1 3.98Å; P142-F144 HydrophobicContact CB-CE1 3.72Å; P142-F144 HydrophobicContact CB-CZ 4.3Å; P142-F144 HydrophobicContact CG-CE1 4.25Å; P142-F144 HydrophobicContact CG-CZ 4.37Å; P142-F144 PolarHBondContact O-N 2.84Å
143P97.3Very high97.2Very high76 Ų7673.3 Ų73.349%0.49438%0.381SS..SBendtrans-76.426-175.833-37.6000113.7C137 L140C137-P143 PolarHBondContact N-O 2.98Å; C137-P143 CarbonylContact O-C 3.49Å; C137-P143 WeakPolarHBondContact O-CA 3.3Å; L140-P143 VanDerWaalsContact O-CA 3.29Å; L140-P143 WeakPolarHBondContact O-CA 3.48Å
144F97.7Very high97.2Very high86 Ų8676.1 Ų76.138%0.37739%0.393SS..EExtended strand (participates in β ladder)trans-150.7156.1177.667.3-89.6000111.9E134 L135 P142 L146E134-F144 HydrophobicContact CG-CB 4.09Å; E134-F144 HydrophobicContact CG-CD2 4.27Å; E134-F144 HydrophobicContact CG-CG 4.47Å; L135-F144 CarbonylContact O-C 3.59Å; L135-F144 WeakPolarHBondContact O-CA 3.37Å; L135-F144 WeakPolarHBondContact O-CB 3.44Å; P142-F144 HydrophobicContact CB-CD1 3.98Å; P142-F144 HydrophobicContact CB-CE1 3.72Å; P142-F144 HydrophobicContact CB-CZ 4.3Å; P142-F144 HydrophobicContact CG-CE1 4.25Å; P142-F144 HydrophobicContact CG-CZ 4.37Å; P142-F144 PolarHBondContact O-N 2.84Å; F144-L146 HydrophobicContact CD2-CG 4.37Å; F144-L146 HydrophobicContact CE2-CG 4.35Å
145R97.5Very high97.3Very high97 Ų9771.2 Ų71.237%0.36637%0.371SS..EExtended strand (participates in β ladder)trans-129.5142170.7-67.3-68-178.3-167.7-3110.1E134 L135 C137 L140E134-R145 WeakPolarHBondContact CA-O 3.34Å; L135-R145 PolarHBondContact N-O 3.32Å; L135-R145 PolarHBondContact O-N 2.96Å; C137-R145 WeakPolarHBondContact SG-CG 3.22Å; C137-R145 PolarHBondContact SG-N 3.31Å; C137-R145 VanDerWaalsContact SG-N 3.4Å; L140-R145 HydrophobicContact CD1-CG 4.2Å
146L97.1Very high97.3Very high94 Ų9478.2 Ų78.249%0.49240%0.397SS..EExtended strand (participates in β ladder)trans-103110.3176.6-66176.5000109.8E134 F144E134-L146 HydrophobicContact CB-CD2 3.75Å; E134-L146 HydrophobicContact CG-CD2 3.92Å; F144-L146 HydrophobicContact CD2-CG 4.37Å; F144-L146 HydrophobicContact CE2-CG 4.35Å
147K96.8Very high97.3Very high77 Ų7774.5 Ų74.534%0.33538%0.382SS..EExtended strand (participates in β ladder)trans-100.9121.4179.3-172.6149.8178.5164.60111.4V82 S83 V133 L135 I149V82-K147 HydrophobicContact CG1-CB 4.19Å; V82-K147 HydrophobicContact CG1-CD 3.69Å; V82-K147 HydrophobicContact CG1-CG 4.02Å; S83-K147 PolarHBondContact O-NZ 3Å; V133-K147 PolarHBondContact N-O 2.9Å; V133-K147 PolarHBondContact O-N 3.28Å; L135-K147 HydrophobicContact CD1-CB 4.31Å; L135-K147 HydrophobicContact CD1-CD 4.39Å; K147-I149 HydrophobicContact CG-CD1 4.48Å; K147-I149 HydrophobicContact CG-CG1 4.19Å
148K97.2Very high97.2Very high150 Ų15077.6 Ų77.665%0.65240%0.397SS*.EExtended strand (participates in β ladder)trans-80.6128.1175.6-169.8177.9-178.5178.40110.7S130 V131 L132S130-K148 VanDerWaalsContact CB-CE 3.41Å; S130-K148 VanDerWaalsContact OG-CE 3.32Å; S130-K148 WeakPolarHBondContact OG-CE 3.31Å; V131-K148 WeakPolarHBondContact O-CA 3.31Å; L132-K148 HydrophobicContact CD2-CB 3.82Å; L132-K148 HydrophobicContact CD2-CG 4.21Å
149I96.9Very high97Very high17 Ų1778 Ų789%0.08740%0.402CS..EExtended strand (participates in β ladder)trans-133.4141.1-177.2-47.7-175.8000110.3V82 I92 S130 V131 V133 K147V82-I149 HydrophobicContact CB-CD1 3.85Å; V82-I149 HydrophobicContact CG1-CD1 3.39Å; V82-I149 HydrophobicContact CG1-CG1 4.49Å; V82-I149 HydrophobicContact CG2-CD1 3.11Å; I92-I149 HydrophobicContact CD1-CD1 3.94Å; I92-I149 HydrophobicContact CD1-CG2 4.33Å; S130-I149 CarbonylContact C-O 3.35Å; S130-I149 WeakPolarHBondContact CA-O 3.21Å; V131-I149 HydrophobicContact CG2-CB 4.37Å; V131-I149 PolarHBondContact N-O 3.17Å; V131-I149 PolarHBondContact O-N 3.2Å; V133-I149 HydrophobicContact CB-CD1 4.18Å; V133-I149 HydrophobicContact CG2-CD1 3.63Å; V133-I149 HydrophobicContact CG2-CG1 4.16Å; K147-I149 HydrophobicContact CG-CD1 4.48Å; K147-I149 HydrophobicContact CG-CG1 4.19Å
150Q97.5Very high96.7Very high140 Ų14076.3 Ų76.365%0.65438%0.377SS*.EExtended strand (participates in β ladder)trans-80125.9171.2-69.5-172-23.900111N94 V128N94-Q150 PolarHBondContact ND2-O 3.32Å; V128-Q150 HydrophobicContact CG1-CB 3.96Å; V128-Q150 HydrophobicContact CG1-CG 4.32Å
151K97.6Very high96Very high43 Ų4378.7 Ų78.719%0.18739%0.39CS..EExtended strand (participates in β ladder)trans-112.3121.2177.1-176.4162-180155.80110.7L93 N94 V128 T129 V131L93-K151 WeakPolarHBondContact O-CE 3.47Å; L93-K151 PolarHBondContact O-NZ 3Å; N94-K151 VanDerWaalsContact OD1-CA 3.28Å; N94-K151 WeakPolarHBondContact OD1-CA 3.32Å; V128-K151 WeakPolarHBondContact CA-O 3.42Å; T129-K151 PolarHBondContact N-O 3.14Å; T129-K151 PolarHBondContact O-N 3.07Å; T129-K151 PolarHBondContact OG1-O 3.22Å; V131-K151 HydrophobicContact CG1-CB 4.45Å; V131-K151 HydrophobicContact CG1-CD 4.4Å; V131-K151 HydrophobicContact CG2-CB 4.39Å
152V98.6Very high94.9Very high18 Ų1874.4 Ų74.411%0.10937%0.367CS..EExtended strand (participates in β ladder)trans-75129.2174.8178.10000109.2T75 N94 R95 P125T75-V152 HydrophobicContact CG2-CG1 4.25Å; N94-V152 PolarHBondContact OD1-N 3.38Å; R95-V152 HydrophobicContact CB-CB 4.05Å; R95-V152 HydrophobicContact CB-CG1 4.25Å; R95-V152 WeakPolarHBondContact O-CB 3.07Å; R95-V152 WeakPolarHBondContact O-CG2 3Å; P125-V152 HydrophobicContact CB-CG1 4.09Å; P125-V152 HydrophobicContact CB-CG2 4.15Å; P125-V152 HydrophobicContact CG-CG1 4.25Å; P125-V152 HydrophobicContact CG-CG2 3.81Å
153K98.3Very high93.7Very high97 Ų9776.4 Ų76.442%0.42238%0.382SS..EExtended strand (participates in β ladder)trans-103.1-40.6177.2-64-69.6-178.4157.40111.8R127 T129R127-K153 HydrophobicContact CB-CB 3.95Å; R127-K153 WeakPolarHBondContact O-CB 3.41Å; R127-K153 PolarHBondContact O-N 2.85Å; T129-K153 HydrophobicContact CG2-CD 4.46Å; T129-K153 HydrophobicContact CG2-CG 3.87Å; T129-K153 WeakPolarHBondContact OG1-CE 3.31Å
154Q98.6Very high91.9Very high70 Ų7078 Ų7833%0.32739%0.387SS..EExtended strand (participates in β ladder)trans-152.3144-175.9-173.5172.46.700110.6P125 Q126 R127P125-Q154 CarbonylContact C-O 3.54Å; P125-Q154 WeakPolarHBondContact CA-O 3.26Å; Q126-Q154 PolarHBondContact N-O 3.31Å; R127-Q154 HydrophobicContact CB-CB 4.07Å; R127-Q154 HydrophobicContact CG-CB 4.31Å; R127-Q154 PolarHBondContact N-O 3.02Å; R127-Q154 VanDerWaalsContact N-O 3.15Å; R127-Q154 VanDerWaalsContact NH1-OE1 3.11Å; R127-Q154 PolarHBondContact O-N 2.89Å
155C98.7Very high89.9Confident8 Ų877.1 Ų77.15%0.05439%0.391CS..EExtended strand (participates in β ladder)trans-116148176-51.70000109.9T75 C97 K124T75-C155 WeakPolarHBondContact OG1-CB 3.33Å; T75-C155 PolarHBondContact OG1-N 3.19Å; T75-C155 PolarHBondContact OG1-SG 3.43Å; T75-C155 VanDerWaalsContact OG1-SG 3.34Å; C97-C155 WeakPolarHBondContact CA-SG 3.36Å; C97-C155 HydrophobicContact CB-CB 3.65Å; C97-C155 WeakPolarHBondContact CB-SG 3.44Å; C97-C155 WeakPolarHBondContact SG-CB 3.37Å; C97-C155 CovalentContact SG-SG 2.02Å; C97-C155 PolarHBondContact SG-SG 3.01Å; K124-C155 VanDerWaalsContact O-CA 3.31Å; K124-C155 WeakPolarHBondContact O-CA 3.42Å
156R98.3Very high87.8Confident149 Ų14979.7 Ų79.756%0.56241%0.412SS*.EExtended strand (participates in β ladder)trans-150.9153.4175.3-165.2-179.7172.9161.2-0.2110.3C73 K124 Q126 M158C73-R156 VanDerWaalsContact SG-CA 3.54Å; C73-R156 PolarHBondContact SG-N 3.23Å; C73-R156 VanDerWaalsContact SG-N 3.36Å; K124-R156 PolarHBondContact N-O 3.09Å; K124-R156 PolarHBondContact O-N 3.48Å; Q126-R156 HydrophobicContact CB-CB 4.01Å; Q126-R156 HydrophobicContact CG-CB 4.37Å; R156-M158 HydrophobicContact CB-CG 4.17Å; R156-M158 PolarHBondContact O-N 3.17Å
157C97.7Very high85.5Confident22 Ų2284.6 Ų84.615%0.14943%0.43CS..EExtended strand (participates in β ladder)trans-65119.1161.3-70.10000108.8D71 C101 A121D71-C157 HydrophobicContact CB-CB 4.43Å; C101-C157 HydrophobicContact CB-CB 3.74Å; C101-C157 WeakPolarHBondContact CB-SG 3.5Å; C101-C157 WeakPolarHBondContact SG-CA 3.24Å; C101-C157 WeakPolarHBondContact SG-CB 3.47Å; C101-C157 CovalentContact SG-SG 2.04Å; C101-C157 PolarHBondContact SG-SG 3.1Å; A121-C157 HydrophobicContact CB-CB 4.48Å
158M95.7Very high82.7Confident65 Ų6592.8 Ų92.832%0.3247%0.469SS..EExtended strand (participates in β ladder)trans-133.2139.4-176.8-65.4177.667.800109.6A121 F122 K124 Q126 R156A121-M158 CarbonylContact C-O 3.53Å; A121-M158 VanDerWaalsContact CA-O 3.26Å; A121-M158 WeakPolarHBondContact CA-O 3.19Å; F122-M158 PolarHBondContact N-O 3.37Å; F122-M158 PolarHBondContact O-N 3.14Å; K124-M158 HydrophobicContact CG-CB 4.28Å; K124-M158 HydrophobicContact CG-SD 4.13Å; Q126-M158 HydrophobicContact CB-SD 3.98Å; Q126-M158 HydrophobicContact CG-SD 4.1Å; R156-M158 HydrophobicContact CB-CG 4.17Å; R156-M158 PolarHBondContact O-N 3.17Å
159S93.4Very high82Confident94 Ų9489.9 Ų89.966%0.65746%0.46SS*.EExtended strand (participates in β ladder)trans-59.1143.3177.9-480000111.6C120C120-S159 CarbonylContact O-C 3.56Å; C120-S159 VanDerWaalsContact O-CA 3.26Å; C120-S159 WeakPolarHBondContact O-CA 3.49Å
160V88.9Confident81.2Confident36 Ų3693.7 Ų93.722%0.21848%0.479CS..EExtended strand (participates in β ladder)trans-126.2141.9175.3-64.60000109.5C120 F122 L162C120-V160 HydrophobicContact CB-CG2 3.96Å; C120-V160 PolarHBondContact O-N 3.25Å; F122-V160 HydrophobicContact CB-CG1 3.96Å; V160-L162 HydrophobicContact CG2-CD2 4.45Å
161N81.8Confident80.3Confident110 Ų11091.2 Ų91.259%0.58847%0.47SS*.  trans-83123.6169.5-62.6-33.1000108S163 D164N161-S163 VanDerWaalsContact C-N 3.25Å; N161-S163 PolarHBondContact O-N 3.04Å; N161-D164 PolarHBondContact O-N 3.37Å
162L71Confident79.3Confident63 Ų6394 Ų9433%0.3349%0.486SS..G310 helixtrans-75.3-19.2-178.7-66167.8000112.2Q118 C120 V160 D164 S165Q118-L162 HydrophobicContact CG-CD1 3.76Å; C120-L162 HydrophobicContact CB-CD1 4.01Å; C120-L162 HydrophobicContact CB-CD2 4.14Å; C120-L162 HydrophobicContact CB-CG 4.2Å; V160-L162 HydrophobicContact CG2-CD2 4.45Å; L162-D164 PolarHBondContact O-N 3.23Å; L162-D164 VanDerWaalsContact O-N 3.14Å; L162-S165 PolarHBondContact O-N 2.79Å
163S70.4Confident78.1Confident93 Ų9398.8 Ų98.865%0.6551%0.51SS*.G310 helixtrans-57.2-25.417258.60000114N161N161-S163 VanDerWaalsContact C-N 3.25Å; N161-S163 PolarHBondContact O-N 3.04Å
164D61.2Low76.7Confident109 Ų10998.9 Ų98.958%0.58352%0.516SS*.G310 helixtrans-93-11.6-174.7-57.6-24.9000112.4N161 L162N161-D164 PolarHBondContact O-N 3.37Å; L162-D164 PolarHBondContact O-N 3.23Å; L162-D164 VanDerWaalsContact O-N 3.14Å
165S55.5Low75.1Confident67 Ų67100.9 Ų100.947%0.46953%0.529SS..G310 helixtrans-87.3-16.8-170.5-58.50000114.2L162 K167L162-S165 PolarHBondContact O-N 2.79Å; S165-K167 PolarHBondContact O-N 2.64Å
166D52.8Low73.3Confident152 Ų152108.1 Ų108.181%0.81357%0.566SS**G310 helixtrans-79.34.3177.4-70-31.4000113.8
167K47.9Very low71.3Confident197 Ų197104.7 Ų104.786%0.85757%0.566SS**G310 helixtrans-105.819.6-178.8-73-171.1179179.40114.7S165S165-K167 PolarHBondContact O-N 2.64Å
168Q38.7Very low68.8Low248 Ų248112.2 Ų112.2100%1.15960%0.604SS**  trans-130.40179.3-153.4148.541.400111.8

Retrieved 168 of 168 residues in 76.1 ms (Link to these results)