A0A087YBQ4_POEFO Loading...

Tumor suppressor 2, mitochondrial calcium regulator a

AlphaFold DB , UniProt , Accession A0A087YBQ4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 109 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
1M41.5Very low47.7Very low246 Ų246131.7 Ų131.7100%1.21285%0.851SS**  0124.10-89.2135.969.800108.7
2G45.9Very low47.9Very low85 Ų85140.2 Ų140.288%0.87685%0.854SS**  trans71.2120.2168.700000115.1
3G42.6Very low48.5Very low73 Ų73139.5 Ų139.575%0.75385%0.854SS**  cis101.993.126.400000109.5
4S45.2Very low48.3Very low135 Ų135143.4 Ų143.494%0.94485%0.853SS**  trans179.8131.6166.5-850000109
5G40.9Very low48Very low71 Ų71142.3 Ų142.373%0.73286%0.856SS**  cis-161.3136.2-700000107.2K7G5-K7 PolarHBondContact O-N 3.44Å
6S54.3Low47.6Very low125 Ų125136.9 Ų136.987%0.87484%0.839SS**  trans-71.3122.2-177.7-58.10000110.6V8S6-V8 PolarHBondContact O-N 3.23Å; S6-V8 VanDerWaalsContact O-N 3.09Å
7K52.6Low47.3Very low211 Ų211136.3 Ų136.392%0.91784%0.841SS**  trans-73.895.3166.1-70.7-171.3174.7179.30108.6G5 K9G5-K7 PolarHBondContact O-N 3.44Å; K7-K9 PolarHBondContact O-N 2.97Å; K7-K9 VanDerWaalsContact O-N 3.13Å
8V53Low46.8Very low135 Ų135133.1 Ų133.182%0.81884%0.839SS**  trans-75.496.816660.30000108.3S6 G10S6-V8 PolarHBondContact O-N 3.23Å; S6-V8 VanDerWaalsContact O-N 3.09Å; V8-G10 PolarHBondContact O-N 3Å
9K53.8Low46.2Very low197 Ų197130.3 Ų130.386%0.85784%0.839SS**  trans-77.695.9165.2-169.4177.6-178.9-1710106.2K7 S11K7-K9 PolarHBondContact O-N 2.97Å; K7-K9 VanDerWaalsContact O-N 3.13Å; K9-S11 PolarHBondContact O-N 3.48Å
10G46Very low45.9Very low55 Ų55131.3 Ų131.357%0.56784%0.837SS**  trans-56.1110.3176.200000110V8V8-G10 PolarHBondContact O-N 3Å
11S49.1Very low45.7Very low116 Ų116129.9 Ų129.981%0.81183%0.831SS**  trans-80.8114.9173.8-168.40000108.2K9K9-S11 PolarHBondContact O-N 3.48Å
12W49.9Very low45.5Very low233 Ų233122 Ų12288%0.88381%0.814SS**  trans-81.2130.6171.3-75.755.6000108.6F14W12-F14 VanDerWaalsContact C-N 3.28Å; W12-F14 PolarHBondContact O-N 2.79Å
13P56.5Low45Very low132 Ų132123.1 Ų123.186%0.85781%0.814SS**  trans-87.467.8-177.936.4-33.2000110
14F45.7Very low45Very low193 Ų193128 Ų12885%0.84682%0.823SS**  trans-122.572.9160.6-169-98.3000108.2W12W12-F14 VanDerWaalsContact C-N 3.28Å; W12-F14 PolarHBondContact O-N 2.79Å
15S43.7Very low44.6Very low127 Ų127125 Ų12589%0.88881%0.813SS**  trans-100.888.1164.5-166.10000106.9
16G40.8Very low44.9Very low57 Ų57129.2 Ų129.259%0.58882%0.819SS**  trans-90.5114170.500000109.1
17S42.3Very low44.3Very low126 Ų126131.6 Ų131.688%0.88182%0.816SS**  trans-62.1140.9171.8-174.40000111
18G38.6Very low44.3Very low78 Ų78130.8 Ų130.880%0.80482%0.816SS**  trans-78.1175.4-174.300000116.3
19G36.5Very low43.8Very low81 Ų81129.4 Ų129.484%0.83581%0.812SS**  trans172123.9170.200000109.8
20D39.4Very low43.8Very low150 Ų150126.3 Ų126.380%0.80281%0.81SS**  trans-96.2163.3-168.2109.578.5000113.6
21S41.2Very low44Very low101 Ų101128.3 Ų128.371%0.70682%0.82SS**  trans130.9104.4143.5-750000116.2
22G38.2Very low44.1Very low82 Ų82133.7 Ų133.785%0.84582%0.823SS**  trans50.6118.3132.200000122.4
23A35.4Very low44.3Very low108 Ų108128.3 Ų128.389%0.89381%0.811SS**  168.8136.1117.800000111.3
24D42.1Very low44.1Very low176 Ų176132.2 Ų132.294%0.94181%0.814SS**  trans-49.5145.3173.8-81.2-64.1000114.7
25G36.1Very low44.4Very low71 Ų71126.1 Ų126.173%0.73281%0.806SS**  trans161.598.7167.100000113.8E27G25-E27 PolarHBondContact O-N 3.37Å
26N48.9Very low45Very low159 Ų159122.4 Ų122.485%0.8578%0.78SS**  trans-52.499.2168.8169.150.2000112.8
27E40.8Very low45.7Very low175 Ų175130.6 Ų130.682%0.81879%0.794SS**  trans-147.7129.5152.6-64.5-167.99400107.7G25 S29G25-E27 PolarHBondContact O-N 3.37Å; E27-S29 PolarHBondContact O-N 3.33Å
28Q51.6Low46.4Very low194 Ų194132.2 Ų132.291%0.90779%0.792SS**  trans-60.185.6174.8-76.4177-5.900110.1V30Q28-V30 PolarHBondContact O-N 3.26Å; Q28-V30 VanDerWaalsContact O-N 3.08Å
29S43.5Very low47.5Very low107 Ų107130.6 Ų130.675%0.74877%0.771SS**  trans-81.688.5172.561.50000107.6E27 A31E27-S29 PolarHBondContact O-N 3.33Å; S29-A31 PolarHBondContact O-N 3.42Å
30V54Low49.3Very low132 Ų132131 Ų13180%0.876%0.758SS**  trans-51.2109.1155.4-770000106.3Q28 R32Q28-V30 PolarHBondContact O-N 3.26Å; Q28-V30 VanDerWaalsContact O-N 3.08Å; V30-R32 PolarHBondContact O-N 3.35Å
31A48.9Very low51.2Low96 Ų96125.9 Ų125.979%0.79373%0.733SS**  trans-55.1107-177.800000107.6S29 L33S29-A31 PolarHBondContact O-N 3.42Å; A31-L33 VanDerWaalsContact C-N 3.33Å; A31-L33 PolarHBondContact O-N 2.94Å
32R53Low53.2Low229 Ų229126 Ų12686%0.86472%0.721SS**  trans-60.9100.4175.4-93.9178.4170.9126.9-3.8106.6V30 K34V30-R32 PolarHBondContact O-N 3.35Å; R32-K34 VanDerWaalsContact C-N 3.32Å; R32-K34 PolarHBondContact O-N 3.08Å
33L53.4Low55.5Low121 Ų121124 Ų12463%0.63469%0.692SS**  trans-59.8101165.2-170.369.3000105.9A31 G35A31-L33 VanDerWaalsContact C-N 3.33Å; A31-L33 PolarHBondContact O-N 2.94Å; L33-G35 PolarHBondContact O-N 3.43Å
34K52.6Low58Low213 Ų213124.5 Ų124.593%0.92667%0.674SS**THydrogen-bonded Turntrans-69.454.8-175.7-65.3-170.7-177-179.90111.6R32R32-K34 VanDerWaalsContact C-N 3.32Å; R32-K34 PolarHBondContact O-N 3.08Å
35G51.9Low60.2Low65 Ų65119.5 Ų119.567%0.6765%0.65SS**THydrogen-bonded Turntrans-146.3-31.8-177.700000114.3L33 R37L33-G35 PolarHBondContact O-N 3.43Å; G35-R37 PolarHBondContact O-N 2.87Å
36S55.4Low62.8Low50 Ų50123.5 Ų123.535%0.3564%0.643SS.*  trans-97.196.9177.256.20000110.2N38 F102S36-N38 PolarHBondContact O-N 2.85Å; S36-F102 WeakPolarHBondContact OG-CE1 3.07Å; S36-F102 VanDerWaalsContact OG-CZ 3.22Å; S36-F102 WeakPolarHBondContact OG-CZ 3.22Å
37R56.8Low64.8Low229 Ų229126.2 Ų126.286%0.86464%0.641SS**SBendtrans-61.8106.3168.4-72.2-176.5-97.1-171.2-4.2107.9G35G35-R37 PolarHBondContact O-N 2.87Å
38N55.5Low67.1Low159 Ų159119.1 Ų119.185%0.8561%0.611SS**SBendtrans89.4-0.5151.9-35.8-11.8000119S36S36-N38 PolarHBondContact O-N 2.85Å
39A63.3Low69Low44 Ų44112.4 Ų112.436%0.36459%0.585SS.*  trans-94.2129.2-179.200000111.9F102A39-F102 HydrophobicContact CB-CE2 3.67Å; A39-F102 HydrophobicContact CB-CZ 3.72Å; A39-F102 WeakPolarHBondContact O-CZ 3.12Å
40T72.8Confident71.4Confident91 Ų91109.1 Ų109.156%0.55856%0.559SS**  trans-76.4145.6170.951.10000109.8F42T40-F42 PolarHBondContact O-N 2.9Å; T40-F42 PolarHBondContact OG1-O 3.41Å
41P80.8Confident73.4Confident42 Ų42107.1 Ų107.127%0.27354%0.538SS..SBendtrans-61.5-24.417623.4-32.9000112.8I98 H99 F102 I104P41-I98 CarbonylContact O-C 3.53Å; P41-I98 WeakPolarHBondContact O-CA 3.33Å; P41-H99 PolarHBondContact O-N 2.89Å; P41-F102 HydrophobicContact CB-CB 4.43Å; P41-I104 HydrophobicContact CB-CD1 3.2Å; P41-I104 HydrophobicContact CB-CG1 4.44Å; P41-I104 HydrophobicContact CG-CD1 4.26Å
42F82.9Confident75.5Confident103 Ų103106 Ų10645%0.45252%0.515SS..EExtended strand (participates in β ladder)trans-92.6127.3178.1-58.4-68.4000111.4T40 F44 P96 C97T40-F42 PolarHBondContact O-N 2.9Å; T40-F42 PolarHBondContact OG1-O 3.41Å; F42-F44 HydrophobicContact CB-CD2 4.39Å; F42-F44 HydrophobicContact CB-CE2 3.63Å; F42-F44 HydrophobicContact CB-CZ 3.97Å; F42-P96 HydrophobicContact CB-CB 4.05Å; F42-P96 HydrophobicContact CD1-CB 4.12Å; F42-P96 HydrophobicContact CD1-CG 4.41Å; F42-P96 HydrophobicContact CG-CB 4.44Å; F42-C97 CarbonylContact C-O 3.6Å
43V86.3Confident77.4Confident40 Ų4096.6 Ų96.624%0.24248%0.482CS..EExtended strand (participates in β ladder)trans-106.5114.7175-179.30000108T45 P96 C97 H99V43-T45 WeakPolarHBondContact CG1-O 3.15Å; V43-P96 WeakPolarHBondContact O-CA 3.1Å; V43-C97 PolarHBondContact N-O 2.81Å; V43-C97 PolarHBondContact O-N 2.78Å; V43-H99 HydrophobicContact CG2-CB 3.78Å
44F86.7Confident79.1Confident118 Ų11897.9 Ų97.952%0.51849%0.485SS..EExtended strand (participates in β ladder)trans-97.2-6.1179.2-64.7-89.2000112.9F42 K92 L93 P96F42-F44 HydrophobicContact CB-CD2 4.39Å; F42-F44 HydrophobicContact CB-CE2 3.63Å; F42-F44 HydrophobicContact CB-CZ 3.97Å; F44-K92 WeakPolarHBondContact O-CA 3.42Å; F44-L93 PolarHBondContact O-N 2.81Å; F44-P96 HydrophobicContact CD1-CB 3.96Å; F44-P96 HydrophobicContact CE1-CB 3.67Å; F44-P96 HydrophobicContact CE1-CG 4.03Å; F44-P96 HydrophobicContact CZ-CB 3.99Å; F44-P96 HydrophobicContact CZ-CG 4.47Å
45T90Very high80.9Confident71 Ų7194.7 Ų94.744%0.43648%0.478SS..EExtended strand (participates in β ladder)trans-138.4136.9-175.5600000111.2V43 I90 V91 K92V43-T45 WeakPolarHBondContact CG1-O 3.15Å; T45-I90 HydrophobicContact CG2-CG2 4.1Å; T45-V91 CarbonylContact C-O 3.51Å; T45-V91 VanDerWaalsContact CA-O 3.27Å; T45-V91 WeakPolarHBondContact CA-O 2.8Å; T45-K92 HydrophobicContact CG2-CG 4.33Å
46R89.7Confident82.7Confident156 Ų15693.8 Ų93.859%0.58947%0.469SS*.EExtended strand (participates in β ladder)trans-122146176.5176-178.6167.8-166.5-1.9110.4S48 I90 V91 L93R46-S48 PolarHBondContact O-N 2.87Å; R46-I90 WeakPolarHBondContact O-CA 3.49Å; R46-V91 PolarHBondContact N-O 2.92Å; R46-V91 PolarHBondContact O-N 3.03Å; R46-L93 HydrophobicContact CB-CD1 4.24Å; R46-L93 HydrophobicContact CB-CD2 3.95Å; R46-L93 HydrophobicContact CB-CG 4.25Å
47R90Very high84.5Confident215 Ų21596.4 Ų96.481%0.81148%0.479SS*.EExtended strand (participates in β ladder)trans-75.3118167-173.7171.1167.3145.4-3.1110
48S90.3Very high86.3Confident27 Ų2789 Ų8919%0.18946%0.456CS..  trans-79.9149.9179.1-175.10000111.8R46 L50 Q88 G89R46-S48 PolarHBondContact O-N 2.87Å; S48-L50 WeakPolarHBondContact OG-CB 3.43Å; S48-L50 PolarHBondContact OG-N 3.43Å; S48-L50 VanDerWaalsContact OG-N 3.08Å; S48-Q88 VanDerWaalsContact CB-OE1 3.27Å; S48-Q88 PolarHBondContact OG-OE1 2.73Å; S48-G89 WeakPolarHBondContact CB-O 3.27Å; S48-G89 PolarHBondContact N-O 2.71Å
49S91.1Very high88.2Confident52 Ų5282.8 Ų82.836%0.36443%0.427SS..  trans-98.84.6170.643.10000112.8Y51 H60S49-Y51 WeakPolarHBondContact O-CD2 3.3Å; S49-Y51 WeakPolarHBondContact O-CE2 3.24Å; S49-H60 PolarHBondContact OG-CD2 2.83Å; S49-H60 PolarHBondContact OG-NE2 3.17Å
50L94.1Very high89.6Confident38 Ų3886 Ų8620%0.19943%0.434CS..  trans-87.8152.6179.8-63.9164.3000111.6S48 L58 A59 H60 Q88S48-L50 WeakPolarHBondContact OG-CB 3.43Å; S48-L50 PolarHBondContact OG-N 3.43Å; S48-L50 VanDerWaalsContact OG-N 3.08Å; L50-L58 HydrophobicContact CB-CD1 3.56Å; L50-L58 HydrophobicContact CB-CG 3.95Å; L50-L58 HydrophobicContact CD1-CD1 4.45Å; L50-L58 HydrophobicContact CD1-CD2 3.9Å; L50-L58 HydrophobicContact CD1-CG 4.05Å; L50-L58 HydrophobicContact CD2-CG 4.38Å; L50-L58 HydrophobicContact CG-CD1 4.47Å; L50-L58 HydrophobicContact CG-CG 4.36Å; L50-A59 WeakPolarHBondContact CA-O 3.35Å; L50-A59 VanDerWaalsContact CD2-C 3.49Å; L50-H60 WeakPolarHBondContact CD2-CE1 3.35Å; L50-H60 VanDerWaalsContact CD2-ND1 3.31Å; L50-H60 WeakPolarHBondContact CD2-ND1 3.4Å; L50-Q88 HydrophobicContact CB-CB 4.27Å; L50-Q88 WeakPolarHBondContact O-CB 3.38Å; L50-Q88 PolarHBondContact O-N 3.45Å
51Y94.9Very high90.6Very high91 Ų9185.6 Ų85.636%0.35743%0.426SS..EExtended strand (participates in β ladder)trans-132.1148.5177.1-62.1-98.4000110.1S49 L58 A59 F62 L85 I86 P87S49-Y51 WeakPolarHBondContact O-CD2 3.3Å; S49-Y51 WeakPolarHBondContact O-CE2 3.24Å; Y51-L58 WeakPolarHBondContact O-CA 3.23Å; Y51-A59 PolarHBondContact N-O 2.84Å; Y51-A59 PolarHBondContact O-N 2.79Å; Y51-F62 VanDerWaalsContact O-CE2 3.24Å; Y51-F62 WeakPolarHBondContact O-CE2 3.2Å; Y51-F62 VanDerWaalsContact O-CZ 3.3Å; Y51-F62 WeakPolarHBondContact O-CZ 3.38Å; Y51-L85 HydrophobicContact CD1-CB 3.96Å; Y51-L85 HydrophobicContact CG-CB 4.24Å; Y51-I86 CarbonylContact C-O 3.59Å; Y51-I86 VanDerWaalsContact CA-O 3.27Å; Y51-I86 WeakPolarHBondContact CA-O 3.48Å; Y51-P87 HydrophobicContact CD1-CB 3.94Å; Y51-P87 HydrophobicContact CE1-CB 3.78Å
52F94.3Very high91.2Very high72 Ų7284.7 Ų84.732%0.31642%0.418SS..EExtended strand (participates in β ladder)trans-91137.5166-63.7-81.2000109.8D57 L58 L85 I86 Q88F52-D57 VanDerWaalsContact CA-O 3.25Å; F52-D57 WeakPolarHBondContact CA-O 3.27Å; F52-L58 HydrophobicContact CD1-CB 4.2Å; F52-L58 HydrophobicContact CD1-CD1 3.92Å; F52-L58 HydrophobicContact CD2-CD1 4.12Å; F52-L58 HydrophobicContact CE1-CB 4.02Å; F52-L58 HydrophobicContact CE1-CD1 3.73Å; F52-L58 HydrophobicContact CE1-CD2 4.42Å; F52-L58 HydrophobicContact CE1-CG 4.27Å; F52-L58 HydrophobicContact CE2-CD1 3.93Å; F52-L58 HydrophobicContact CG-CD1 4.12Å; F52-L58 HydrophobicContact CZ-CD1 3.74Å; F52-L58 HydrophobicContact CZ-CD2 4.43Å; F52-L85 CarbonylContact O-C 3.58Å; F52-L85 WeakPolarHBondContact O-CA 3.25Å; F52-I86 HydrophobicContact CB-CB 4.33Å; F52-I86 PolarHBondContact N-O 2.98Å; F52-I86 PolarHBondContact O-N 3.47Å; F52-Q88 HydrophobicContact CE2-CB 4.16Å; F52-Q88 HydrophobicContact CE2-CG 3.98Å; F52-Q88 HydrophobicContact CZ-CG 4.45Å
53D92.1Very high91.6Very high31 Ų3185.5 Ų85.517%0.16642%0.419CS..  trans-90.1-170.6167.168.94.2000112.3D55 G56 D57 F62 L85D53-D55 PolarHBondContact O-N 2.64Å; D53-D55 PolarHBondContact OD1-N 3.02Å; D53-D55 VanDerWaalsContact OD1-N 3.08Å; D53-G56 PolarHBondContact O-N 2.84Å; D53-G56 PolarHBondContact OD1-N 3.16Å; D53-D57 PolarHBondContact N-O 2.87Å; D53-D57 VanDerWaalsContact N-O 3.17Å; D53-D57 PolarHBondContact OD1-N 2.67Å; D53-F62 HydrophobicContact CB-CD1 3.68Å; D53-F62 HydrophobicContact CB-CE1 3.49Å; D53-F62 VanDerWaalsContact CB-CE1 3.49Å; D53-F62 HydrophobicContact CB-CE2 4.41Å; D53-F62 HydrophobicContact CB-CG 4.22Å; D53-F62 HydrophobicContact CB-CZ 3.88Å; D53-F62 VanDerWaalsContact CG-CE1 3.41Å; D53-F62 WeakPolarHBondContact OD2-CD1 3.46Å; D53-F62 WeakPolarHBondContact OD2-CE1 3.31Å; D53-L85 HydrophobicContact CB-CD2 3.89Å
54E89.3Confident91.8Very high149 Ų14988.9 Ų88.970%0.69643%0.432SS*.THydrogen-bonded Turntrans-68.4-24.8-178.9-62.6-175.817700112.6N84E54-N84 HydrophobicContact CG-CB 4.4Å; E54-N84 WeakPolarHBondContact OE1-CB 3.49Å; E54-N84 PolarHBondContact OE1-ND2 3.06Å
55D89.9Confident91.9Very high145 Ų14589.1 Ų89.178%0.77543%0.434SS*.THydrogen-bonded Turntrans-90.5-9.2-179.9-64.3-43.7000112.3D53D53-D55 PolarHBondContact O-N 2.64Å; D53-D55 PolarHBondContact OD1-N 3.02Å; D53-D55 VanDerWaalsContact OD1-N 3.08Å
56G91.1Very high91.6Very high46 Ų4687.7 Ų87.747%0.47443%0.426SS..  trans90.111.2178.400000113.9D53D53-G56 PolarHBondContact O-N 2.84Å; D53-G56 PolarHBondContact OD1-N 3.16Å
57D93.3Very high91.2Very high105 Ų10584.9 Ų84.956%0.56143%0.426SS*.  trans-71.7142.4174.2-78.6-17.7000110.1F52 D53 F62F52-D57 VanDerWaalsContact CA-O 3.25Å; F52-D57 WeakPolarHBondContact CA-O 3.27Å; D53-D57 PolarHBondContact N-O 2.87Å; D53-D57 VanDerWaalsContact N-O 3.17Å; D53-D57 PolarHBondContact OD1-N 2.67Å; D57-F62 HydrophobicContact CB-CE1 4.05Å; D57-F62 VanDerWaalsContact O-CZ 3.23Å; D57-F62 WeakPolarHBondContact O-CZ 3.48Å
58L94Very high90.5Very high74 Ų7477.2 Ų77.239%0.38740%0.403SS..EExtended strand (participates in β ladder)trans-109.7112.2-177.6-174.667.2000110.6L50 Y51 F52 Q88L50-L58 HydrophobicContact CB-CD1 3.56Å; L50-L58 HydrophobicContact CB-CG 3.95Å; L50-L58 HydrophobicContact CD1-CD1 4.45Å; L50-L58 HydrophobicContact CD1-CD2 3.9Å; L50-L58 HydrophobicContact CD1-CG 4.05Å; L50-L58 HydrophobicContact CD2-CG 4.38Å; L50-L58 HydrophobicContact CG-CD1 4.47Å; L50-L58 HydrophobicContact CG-CG 4.36Å; Y51-L58 WeakPolarHBondContact O-CA 3.23Å; F52-L58 HydrophobicContact CD1-CB 4.2Å; F52-L58 HydrophobicContact CD1-CD1 3.92Å; F52-L58 HydrophobicContact CD2-CD1 4.12Å; F52-L58 HydrophobicContact CE1-CB 4.02Å; F52-L58 HydrophobicContact CE1-CD1 3.73Å; F52-L58 HydrophobicContact CE1-CD2 4.42Å; F52-L58 HydrophobicContact CE1-CG 4.27Å; F52-L58 HydrophobicContact CE2-CD1 3.93Å; F52-L58 HydrophobicContact CG-CD1 4.12Å; F52-L58 HydrophobicContact CZ-CD1 3.74Å; F52-L58 HydrophobicContact CZ-CD2 4.43Å; L58-Q88 HydrophobicContact CD1-CB 4.24Å; L58-Q88 HydrophobicContact CD1-CG 4.36Å
59A94.9Very high89.8Confident29 Ų2980.5 Ų80.524%0.2442%0.422CS..EExtended strand (participates in β ladder)trans-145.8165.6-179.400000112.8L50 Y51 F62L50-A59 WeakPolarHBondContact CA-O 3.35Å; L50-A59 VanDerWaalsContact CD2-C 3.49Å; Y51-A59 PolarHBondContact N-O 2.84Å; Y51-A59 PolarHBondContact O-N 2.79Å; A59-F62 HydrophobicContact CB-CD2 4.46Å; A59-F62 HydrophobicContact CB-CE1 3.97Å; A59-F62 HydrophobicContact CB-CE2 3.83Å; A59-F62 HydrophobicContact CB-CZ 3.56Å
60H94.1Very high88.9Confident110 Ų11085.3 Ų85.351%0.50944%0.436SS..SBendtrans-75.2-31.7172.8-74.288.8000111.8S49 L50S49-H60 PolarHBondContact OG-CD2 2.83Å; S49-H60 PolarHBondContact OG-NE2 3.17Å; L50-H60 WeakPolarHBondContact CD2-CE1 3.35Å; L50-H60 VanDerWaalsContact CD2-ND1 3.31Å; L50-H60 WeakPolarHBondContact CD2-ND1 3.4Å
61E92.3Very high87.8Confident84 Ų8491.8 Ų91.839%0.39347%0.471SS..  trans-148.5139.5-175-50.7-165.9162.500110.2Y63 R80E61-Y63 HydrophobicContact CB-CE2 3.8Å; E61-Y63 PolarHBondContact OE2-OH 2.83Å; E61-R80 IonicContact OE1-CZ 3.17Å; E61-R80 IonicContact OE1-NH1 3.9Å; E61-R80 PolarHBondContact OE1-NH1 3.23Å; E61-R80 IonicContact OE1-NH2 2.87Å; E61-R80 PolarHBondContact OE1-NH2 3.14Å; E61-R80 IonicContact OE2-CZ 3.43Å; E61-R80 IonicContact OE2-NE 3.96Å; E61-R80 IonicContact OE2-NH1 3.29Å; E61-R80 PolarHBondContact OE2-NH1 2.85Å; E61-R80 VanDerWaalsContact OE2-NH1 3.16Å; E61-R80 IonicContact OE2-NH2 3.16Å
62F93.5Very high87Confident22 Ų2291.3 Ų91.310%0.09649%0.494CS..EExtended strand (participates in β ladder)trans-115.4143.1176.7-67.8-91.2000110.4Y51 D53 D57 A59 R80 I81 L85Y51-F62 VanDerWaalsContact O-CE2 3.24Å; Y51-F62 WeakPolarHBondContact O-CE2 3.2Å; Y51-F62 VanDerWaalsContact O-CZ 3.3Å; Y51-F62 WeakPolarHBondContact O-CZ 3.38Å; D53-F62 HydrophobicContact CB-CD1 3.68Å; D53-F62 HydrophobicContact CB-CE1 3.49Å; D53-F62 VanDerWaalsContact CB-CE1 3.49Å; D53-F62 HydrophobicContact CB-CE2 4.41Å; D53-F62 HydrophobicContact CB-CG 4.22Å; D53-F62 HydrophobicContact CB-CZ 3.88Å; D53-F62 VanDerWaalsContact CG-CE1 3.41Å; D53-F62 WeakPolarHBondContact OD2-CD1 3.46Å; D53-F62 WeakPolarHBondContact OD2-CE1 3.31Å; D57-F62 HydrophobicContact CB-CE1 4.05Å; D57-F62 VanDerWaalsContact O-CZ 3.23Å; D57-F62 WeakPolarHBondContact O-CZ 3.48Å; A59-F62 HydrophobicContact CB-CD2 4.46Å; A59-F62 HydrophobicContact CB-CE1 3.97Å; A59-F62 HydrophobicContact CB-CE2 3.83Å; A59-F62 HydrophobicContact CB-CZ 3.56Å; F62-R80 WeakPolarHBondContact O-CA 3.4Å; F62-I81 HydrophobicContact CB-CB 4.44Å; F62-I81 PolarHBondContact O-N 2.81Å; F62-L85 HydrophobicContact CB-CD1 4.43Å; F62-L85 HydrophobicContact CB-CD2 4.17Å; F62-L85 HydrophobicContact CD2-CD1 3.69Å; F62-L85 HydrophobicContact CD2-CD2 3.4Å; F62-L85 HydrophobicContact CD2-CG 4.18Å; F62-L85 HydrophobicContact CE2-CD1 4.47Å; F62-L85 HydrophobicContact CE2-CD2 3.89Å; F62-L85 HydrophobicContact CG-CD1 4.45Å; F62-L85 HydrophobicContact CG-CD2 3.8Å
63Y92.8Very high86.1Confident120 Ų12096.6 Ų96.647%0.47151%0.512SS..EExtended strand (participates in β ladder)trans-132.7132.5178.9-67.9-97.3000109.3E61 L78 K79 R80E61-Y63 HydrophobicContact CB-CE2 3.8Å; E61-Y63 PolarHBondContact OE2-OH 2.83Å; Y63-L78 HydrophobicContact CD1-CB 4.43Å; Y63-K79 CarbonylContact C-O 3.54Å; Y63-K79 VanDerWaalsContact CA-O 3.31Å; Y63-K79 WeakPolarHBondContact CA-O 3.31Å; Y63-R80 HydrophobicContact CD1-CB 3.92Å; Y63-R80 HydrophobicContact CE1-CB 3.57Å; Y63-R80 HydrophobicContact CE1-CG 4.06Å
64E88.8Confident85.6Confident111 Ų111103 Ų10352%0.51954%0.538SS..EExtended strand (participates in β ladder)trans-107.2138.8174168.7-175.4-149.800110T66 L78 K79 I81E64-T66 PolarHBondContact O-N 3.4Å; E64-L78 CarbonylContact O-C 3.6Å; E64-L78 WeakPolarHBondContact O-CA 3.42Å; E64-K79 PolarHBondContact N-O 2.95Å; E64-K79 PolarHBondContact O-N 3.08Å; E64-I81 HydrophobicContact CB-CD1 3.28Å; E64-I81 HydrophobicContact CB-CG1 3.96Å; E64-I81 HydrophobicContact CG-CD1 4.36Å
65E89.1Confident85.1Confident123 Ų123103.8 Ų103.858%0.57554%0.535SS*.EExtended strand (participates in β ladder)trans-76.5116.6173.4-171.4175.8-163.100110.3S76 L78E65-S76 WeakPolarHBondContact OE1-CB 3.34Å; E65-S76 PolarHBondContact OE1-OG 3.17Å; E65-L78 HydrophobicContact CB-CD2 3.99Å; E65-L78 HydrophobicContact CG-CD2 4.48Å
66T83.3Confident84.8Confident42 Ų42100.6 Ų100.626%0.25852%0.524SS..EExtended strand (participates in β ladder)trans-106.2125.417459.70000109.5E64 V68 K77 K79E64-T66 PolarHBondContact O-N 3.4Å; T66-V68 PolarHBondContact O-N 3.14Å; T66-K77 PolarHBondContact N-O 3.29Å; T66-K77 PolarHBondContact O-N 2.89Å; T66-K77 PolarHBondContact OG1-O 3Å; T66-K79 HydrophobicContact CG2-CB 4.22Å
67V81.3Confident84.7Confident96 Ų96104.9 Ų104.958%0.58253%0.529SS*.EExtended strand (participates in β ladder)trans-84.7108.2174.6-172.80000108.4K74V67-K74 HydrophobicContact CG1-CB 4.17Å; V67-K74 HydrophobicContact CG1-CG 4.35Å
68V75.9Confident84.6Confident55 Ų55105.4 Ų105.433%0.33353%0.532SS..EExtended strand (participates in β ladder)trans-100.6115.7176.9-173.40000108.5T66 K70 R75 K77T66-V68 PolarHBondContact O-N 3.14Å; V68-K70 HydrophobicContact CG1-CG 4.15Å; V68-K70 PolarHBondContact O-N 2.83Å; V68-R75 PolarHBondContact N-O 2.89Å; V68-R75 PolarHBondContact O-N 2.87Å; V68-K77 HydrophobicContact CG2-CB 4.38Å
69T75.1Confident84.5Confident96 Ų96108.1 Ų108.159%0.58954%0.54SS*.EExtended strand (participates in β ladder)trans-84.6108.9170.349.90000109.3K74T69-K74 HydrophobicContact CG2-CG 3.93Å
70K73.4Confident84.3Confident153 Ų153112 Ų11267%0.66555%0.549SS*.EExtended strand (participates in β ladder)trans-119.2125.8166.8-79.4-170.1174.7-170.50108.9V68 G72 R73V68-K70 HydrophobicContact CG1-CG 4.15Å; V68-K70 PolarHBondContact O-N 2.83Å; K70-G72 PolarHBondContact O-N 3.49Å; K70-R73 PolarHBondContact N-O 3.45Å; K70-R73 PolarHBondContact O-N 2.94Å
71N70.9Confident84.1Confident173 Ų173109 Ų10993%0.92554%0.536SS*.THydrogen-bonded Turntrans53.947.3179.2-60.4-1000113.9R73N71-R73 PolarHBondContact O-N 2.76Å
72G77Confident84Confident82 Ų82112.3 Ų112.385%0.84555%0.552SS**THydrogen-bonded Turntrans70.5-7178.600000115.4K70K70-G72 PolarHBondContact O-N 3.49Å
73R75.9Confident83.8Confident182 Ų182119.3 Ų119.369%0.68758%0.582SS**EExtended strand (participates in β ladder)trans-98.3118.1176.4-157.2166.2-178.4176.30.2109.5K70 N71 R75K70-R73 PolarHBondContact N-O 3.45Å; K70-R73 PolarHBondContact O-N 2.94Å; N71-R73 PolarHBondContact O-N 2.76Å; R73-R75 PolarHBondContact O-N 2.97Å
74K81.2Confident83.5Confident167 Ų167119.2 Ų119.273%0.72659%0.589SS**EExtended strand (participates in β ladder)trans-68.5124.5172.2-68.1179.4-179-177.30108.3V67 T69V67-K74 HydrophobicContact CG1-CB 4.17Å; V67-K74 HydrophobicContact CG1-CG 4.35Å; T69-K74 HydrophobicContact CG2-CG 3.93Å
75R79.3Confident83.6Confident164 Ų164115.6 Ų115.662%0.61957%0.573SS**EExtended strand (participates in β ladder)trans-123.4128.7169.8-67.8-172.4177.8-174-0.5107.9V68 R73V68-R75 PolarHBondContact N-O 2.89Å; V68-R75 PolarHBondContact O-N 2.87Å; R73-R75 PolarHBondContact O-N 2.97Å
76S84.8Confident83.8Confident78 Ų78114.9 Ų114.955%0.54557%0.573SS.*EExtended strand (participates in β ladder)trans-77.2142.3166.643.70000110.2E65E65-S76 WeakPolarHBondContact OE1-CB 3.34Å; E65-S76 PolarHBondContact OE1-OG 3.17Å
77K88.3Confident84.3Confident136 Ų136116.8 Ų116.859%0.59159%0.586SS**EExtended strand (participates in β ladder)trans-138.4126.2174.4-177.1176.1-178.6-179.20108.7T66 V68T66-K77 PolarHBondContact N-O 3.29Å; T66-K77 PolarHBondContact O-N 2.89Å; T66-K77 PolarHBondContact OG1-O 3Å; V68-K77 HydrophobicContact CG2-CB 4.38Å
78L91.8Very high84.8Confident116 Ų116115 Ų11561%0.60757%0.571SS**EExtended strand (participates in β ladder)trans-74.1131.9169.6-63.7176.3000109.9Y63 E64 E65Y63-L78 HydrophobicContact CD1-CB 4.43Å; E64-L78 CarbonylContact O-C 3.6Å; E64-L78 WeakPolarHBondContact O-CA 3.42Å; E65-L78 HydrophobicContact CB-CD2 3.99Å; E65-L78 HydrophobicContact CG-CD2 4.48Å
79K90.6Very high85.5Confident132 Ų132113.8 Ų113.857%0.57457%0.57SS**EExtended strand (participates in β ladder)trans-121.9128.7175.4-175.3-175.5174.6-170.80108.5Y63 E64 T66 I81Y63-K79 CarbonylContact C-O 3.54Å; Y63-K79 VanDerWaalsContact CA-O 3.31Å; Y63-K79 WeakPolarHBondContact CA-O 3.31Å; E64-K79 PolarHBondContact N-O 2.95Å; E64-K79 PolarHBondContact O-N 3.08Å; T66-K79 HydrophobicContact CG2-CB 4.22Å; K79-I81 PolarHBondContact O-N 3.3Å
80R92.1Very high86.3Confident110 Ų110115.4 Ų115.442%0.41557%0.573SS.*EExtended strand (participates in β ladder)trans-63.9131.8175-171.3175.8174.9151.14.2110.3E61 F62 Y63E61-R80 IonicContact OE1-CZ 3.17Å; E61-R80 IonicContact OE1-NH1 3.9Å; E61-R80 PolarHBondContact OE1-NH1 3.23Å; E61-R80 IonicContact OE1-NH2 2.87Å; E61-R80 PolarHBondContact OE1-NH2 3.14Å; E61-R80 IonicContact OE2-CZ 3.43Å; E61-R80 IonicContact OE2-NE 3.96Å; E61-R80 IonicContact OE2-NH1 3.29Å; E61-R80 PolarHBondContact OE2-NH1 2.85Å; E61-R80 VanDerWaalsContact OE2-NH1 3.16Å; E61-R80 IonicContact OE2-NH2 3.16Å; F62-R80 WeakPolarHBondContact O-CA 3.4Å; Y63-R80 HydrophobicContact CD1-CB 3.92Å; Y63-R80 HydrophobicContact CE1-CB 3.57Å; Y63-R80 HydrophobicContact CE1-CG 4.06Å
81I90.1Very high87.1Confident48 Ų48110.2 Ų110.225%0.24655%0.554CS.*EExtended strand (participates in β ladder)trans-99.3138.6172.9-61.6167.9000109F62 E64 K79 K83F62-I81 HydrophobicContact CB-CB 4.44Å; F62-I81 PolarHBondContact O-N 2.81Å; E64-I81 HydrophobicContact CB-CD1 3.28Å; E64-I81 HydrophobicContact CB-CG1 3.96Å; E64-I81 HydrophobicContact CG-CD1 4.36Å; K79-I81 PolarHBondContact O-N 3.3Å; I81-K83 WeakPolarHBondContact CG2-O 3.45Å
82Q88.8Confident88.1Confident153 Ų153110.5 Ų110.572%0.71555%0.547SS*.  trans-131.20.9170.8-64.8-178.2-9.400111.9
83K89.3Confident88.6Confident169 Ų169109 Ų10974%0.73552%0.52SS*.SBendtrans-100.4153.3-179.8-61.6-174.7178.3-173.30108.7I81 L85I81-K83 WeakPolarHBondContact CG2-O 3.45Å; K83-L85 PolarHBondContact O-N 3.08Å
84N86.6Confident89.2Confident117 Ų117107.9 Ų107.963%0.62653%0.527SS*.SBendtrans59.315.3177.5-51.6-8.6000115.1E54E54-N84 HydrophobicContact CG-CB 4.4Å; E54-N84 WeakPolarHBondContact OE1-CB 3.49Å; E54-N84 PolarHBondContact OE1-ND2 3.06Å
85L91.3Very high89.4Confident35 Ų35107 Ų10718%0.18353%0.525CS..PPolyproline II helixtrans-90.4129.9175.3-64-177.5000110Y51 F52 D53 F62 K83Y51-L85 HydrophobicContact CD1-CB 3.96Å; Y51-L85 HydrophobicContact CG-CB 4.24Å; F52-L85 CarbonylContact O-C 3.58Å; F52-L85 WeakPolarHBondContact O-CA 3.25Å; D53-L85 HydrophobicContact CB-CD2 3.89Å; F62-L85 HydrophobicContact CB-CD1 4.43Å; F62-L85 HydrophobicContact CB-CD2 4.17Å; F62-L85 HydrophobicContact CD2-CD1 3.69Å; F62-L85 HydrophobicContact CD2-CD2 3.4Å; F62-L85 HydrophobicContact CD2-CG 4.18Å; F62-L85 HydrophobicContact CE2-CD1 4.47Å; F62-L85 HydrophobicContact CE2-CD2 3.89Å; F62-L85 HydrophobicContact CG-CD1 4.45Å; F62-L85 HydrophobicContact CG-CD2 3.8Å; K83-L85 PolarHBondContact O-N 3.08Å
86I92.7Very high89.7Confident109 Ų109102.1 Ų102.156%0.55952%0.515SS*.EExtended strand (participates in β ladder)trans-94.9118178.9-59.2169.6000108.2Y51 F52 Q88Y51-I86 CarbonylContact C-O 3.59Å; Y51-I86 VanDerWaalsContact CA-O 3.27Å; Y51-I86 WeakPolarHBondContact CA-O 3.48Å; F52-I86 HydrophobicContact CB-CB 4.33Å; F52-I86 PolarHBondContact N-O 2.98Å; F52-I86 PolarHBondContact O-N 3.47Å; I86-Q88 PolarHBondContact O-N 3.08Å
87P93.7Very high89.8Confident82 Ų82101.7 Ų101.753%0.53251%0.511SS..EExtended strand (participates in β ladder)trans-66.2136.4178.827-33.2000110.7Y51 G89Y51-P87 HydrophobicContact CD1-CB 3.94Å; Y51-P87 HydrophobicContact CE1-CB 3.78Å; P87-G89 PolarHBondContact O-N 3.45Å
88Q92.2Very high89.8Confident59 Ų5998.8 Ų98.828%0.27650%0.501SS..  trans-62.2-28.3175-168.9-174.221.600111.9S48 L50 F52 L58 I86 V91S48-Q88 VanDerWaalsContact CB-OE1 3.27Å; S48-Q88 PolarHBondContact OG-OE1 2.73Å; L50-Q88 HydrophobicContact CB-CB 4.27Å; L50-Q88 WeakPolarHBondContact O-CB 3.38Å; L50-Q88 PolarHBondContact O-N 3.45Å; F52-Q88 HydrophobicContact CE2-CB 4.16Å; F52-Q88 HydrophobicContact CE2-CG 3.98Å; F52-Q88 HydrophobicContact CZ-CG 4.45Å; L58-Q88 HydrophobicContact CD1-CB 4.24Å; L58-Q88 HydrophobicContact CD1-CG 4.36Å; I86-Q88 PolarHBondContact O-N 3.08Å; Q88-V91 VanDerWaalsContact CD-CG2 3.41Å; Q88-V91 HydrophobicContact CG-CG2 3.77Å
89G91.1Very high89.4Confident29 Ų2995.9 Ų95.930%0.29949%0.485SS..  trans79.5-135.2173.500000113.5S48 P87S48-G89 WeakPolarHBondContact CB-O 3.27Å; S48-G89 PolarHBondContact N-O 2.71Å; P87-G89 PolarHBondContact O-N 3.45Å
90I92Very high88.9Confident129 Ų12996.1 Ų96.166%0.66250%0.497SS*.EExtended strand (participates in β ladder)trans-90.1119.3-178.7-59.7176.1000108.8T45 R46T45-I90 HydrophobicContact CG2-CG2 4.1Å; R46-I90 WeakPolarHBondContact O-CA 3.49Å
91V90.3Very high88.5Confident45 Ų4596.7 Ų96.727%0.27351%0.508SS..EExtended strand (participates in β ladder)trans-105.1135.1-178.9-179.10000109.2T45 R46 Q88T45-V91 CarbonylContact C-O 3.51Å; T45-V91 VanDerWaalsContact CA-O 3.27Å; T45-V91 WeakPolarHBondContact CA-O 2.8Å; R46-V91 PolarHBondContact N-O 2.92Å; R46-V91 PolarHBondContact O-N 3.03Å; Q88-V91 VanDerWaalsContact CD-CG2 3.41Å; Q88-V91 HydrophobicContact CG-CG2 3.77Å
92K91.3Very high87.9Confident178 Ų17896 Ų9677%0.77450%0.503SS*.EExtended strand (participates in β ladder)trans-73.1134.8171.5-68.7-177.8179.7178.50109.2F44 T45F44-K92 WeakPolarHBondContact O-CA 3.42Å; T45-K92 HydrophobicContact CG2-CG 4.33Å
93L87.3Confident87.4Confident51 Ų5194.3 Ų94.327%0.26751%0.506SS..EExtended strand (participates in β ladder)trans-89.1136.2176.5-60.7171.3000108.8F44 R46 H95 C97F44-L93 PolarHBondContact O-N 2.81Å; R46-L93 HydrophobicContact CB-CD1 4.24Å; R46-L93 HydrophobicContact CB-CD2 3.95Å; R46-L93 HydrophobicContact CB-CG 4.25Å; L93-H95 WeakPolarHBondContact CB-O 3.34Å; L93-H95 PolarHBondContact O-N 2.82Å; L93-C97 HydrophobicContact CD1-CB 4.29Å
94D88Confident86.9Confident158 Ų15889.7 Ų89.785%0.84549%0.488SS*.EExtended strand (participates in β ladder)trans-63.2-34.8175.2-61.2-34.3000111.3
95H86.3Confident86.6Confident149 Ų14990.2 Ų90.269%0.6950%0.495SS*.EExtended strand (participates in β ladder)trans-123.1134.8177.9-58.483.2000109.7L93 C97L93-H95 WeakPolarHBondContact CB-O 3.34Å; L93-H95 PolarHBondContact O-N 2.82Å; H95-C97 PolarHBondContact O-N 2.83Å
96P86.6Confident86Confident62 Ų6295 Ų9540%0.40352%0.52SS..EExtended strand (participates in β ladder)trans-64.313717825.2-31.8000111.1F42 V43 F44F42-P96 HydrophobicContact CB-CB 4.05Å; F42-P96 HydrophobicContact CD1-CB 4.12Å; F42-P96 HydrophobicContact CD1-CG 4.41Å; F42-P96 HydrophobicContact CG-CB 4.44Å; V43-P96 WeakPolarHBondContact O-CA 3.1Å; F44-P96 HydrophobicContact CD1-CB 3.96Å; F44-P96 HydrophobicContact CE1-CB 3.67Å; F44-P96 HydrophobicContact CE1-CG 4.03Å; F44-P96 HydrophobicContact CZ-CB 3.99Å; F44-P96 HydrophobicContact CZ-CG 4.47Å
97C86.6Confident85.3Confident69 Ų6995.3 Ų95.347%0.46653%0.531SS..EExtended strand (participates in β ladder)trans-98.7154.1171.9-66.40000111F42 V43 L93 H95F42-C97 CarbonylContact C-O 3.6Å; V43-C97 PolarHBondContact N-O 2.81Å; V43-C97 PolarHBondContact O-N 2.78Å; L93-C97 HydrophobicContact CD1-CB 4.29Å; H95-C97 PolarHBondContact O-N 2.83Å
98I86.8Confident84.7Confident74 Ų74101 Ų10138%0.37955%0.551SS.*EExtended strand (participates in β ladder)trans-79.5134.2175.4-60.6173.5000109.6P41 I104 L106P41-I98 CarbonylContact O-C 3.53Å; P41-I98 WeakPolarHBondContact O-CA 3.33Å; I98-I104 HydrophobicContact CG2-CD1 3.68Å; I98-I104 HydrophobicContact CG2-CG1 4.42Å; I98-L106 HydrophobicContact CD1-CD1 4.03Å; I98-L106 HydrophobicContact CD1-CD2 4.31Å; I98-L106 HydrophobicContact CD1-CG 4.34Å
99H84.3Confident83Confident56 Ų56105.2 Ų105.226%0.25961%0.61SS.*PPolyproline II helixtrans-69.8130176.4-168.8-74.1000110.8P41 V43 D101 F102P41-H99 PolarHBondContact O-N 2.89Å; V43-H99 HydrophobicContact CG2-CB 3.78Å; H99-D101 IonicContact CE1-OD2 3.79Å; H99-D101 PolarHBondContact CE1-OD2 3.04Å; H99-D101 VanDerWaalsContact CE1-OD2 3.29Å; H99-D101 PolarHBondContact ND1-N 3.13Å; H99-D101 IonicContact ND1-OD2 2.89Å; H99-D101 PolarHBondContact O-N 3.2Å; H99-D101 VanDerWaalsContact O-N 3.14Å; H99-F102 HydrophobicContact CB-CD2 3.67Å; H99-F102 HydrophobicContact CB-CE2 4.27Å; H99-F102 AromaticContact CG-CD2 3.73Å; H99-F102 AromaticContact CG-CE2 3.99Å; H99-F102 AromaticContact ND1-CD2 3.51Å; H99-F102 AromaticContact ND1-CE2 3.76Å; H99-F102 PolarHBondContact O-N 3.02Å
100V80.4Confident82.6Confident136 Ų136109 Ų10982%0.82463%0.625SS**THydrogen-bonded Turntrans-58.5-30.7-171.7-63.90000114.5F102V100-F102 VanDerWaalsContact C-N 3.29Å; V100-F102 PolarHBondContact O-N 3.09Å
101D82.9Confident82.1Confident122 Ų122107.9 Ų107.965%0.65262%0.623SS**THydrogen-bonded Turntrans-82-3179.9-61.1-31.9000114.2H99 P103H99-D101 IonicContact CE1-OD2 3.79Å; H99-D101 PolarHBondContact CE1-OD2 3.04Å; H99-D101 VanDerWaalsContact CE1-OD2 3.29Å; H99-D101 PolarHBondContact ND1-N 3.13Å; H99-D101 IonicContact ND1-OD2 2.89Å; H99-D101 PolarHBondContact O-N 3.2Å; H99-D101 VanDerWaalsContact O-N 3.14Å; D101-P103 VanDerWaalsContact O-CD 3.28Å; D101-P103 WeakPolarHBondContact O-CD 3.49Å
102F78.4Confident81.7Confident33 Ų33111.4 Ų111.415%0.14564%0.643CS.*SBendtrans-10997.4179.3-69.1-95.5000109.4S36 A39 P41 H99 V100 I104S36-F102 WeakPolarHBondContact OG-CE1 3.07Å; S36-F102 VanDerWaalsContact OG-CZ 3.22Å; S36-F102 WeakPolarHBondContact OG-CZ 3.22Å; A39-F102 HydrophobicContact CB-CE2 3.67Å; A39-F102 HydrophobicContact CB-CZ 3.72Å; A39-F102 WeakPolarHBondContact O-CZ 3.12Å; P41-F102 HydrophobicContact CB-CB 4.43Å; H99-F102 HydrophobicContact CB-CD2 3.67Å; H99-F102 HydrophobicContact CB-CE2 4.27Å; H99-F102 AromaticContact CG-CD2 3.73Å; H99-F102 AromaticContact CG-CE2 3.99Å; H99-F102 AromaticContact ND1-CD2 3.51Å; H99-F102 AromaticContact ND1-CE2 3.76Å; H99-F102 PolarHBondContact O-N 3.02Å; V100-F102 VanDerWaalsContact C-N 3.29Å; V100-F102 PolarHBondContact O-N 3.09Å; F102-I104 HydrophobicContact CB-CD1 4.16Å; F102-I104 HydrophobicContact CB-CG1 4.2Å; F102-I104 WeakPolarHBondContact O-CG1 3.28Å; F102-I104 PolarHBondContact O-N 3.44Å; F102-I104 VanDerWaalsContact O-N 3.08Å
103P78.8Confident81.1Confident119 Ų119107.5 Ų107.577%0.77364%0.635SS**  trans-66.8109.8171.727.3-32.5000108.8D101D101-P103 VanDerWaalsContact O-CD 3.28Å; D101-P103 WeakPolarHBondContact O-CD 3.49Å
104I77.6Confident80.7Confident71 Ų71111.1 Ų111.136%0.36466%0.658SS.*  trans-121.4133.9-179.3-59.3168.2000108.5P41 I98 F102 L106P41-I104 HydrophobicContact CB-CD1 3.2Å; P41-I104 HydrophobicContact CB-CG1 4.44Å; P41-I104 HydrophobicContact CG-CD1 4.26Å; I98-I104 HydrophobicContact CG2-CD1 3.68Å; I98-I104 HydrophobicContact CG2-CG1 4.42Å; F102-I104 HydrophobicContact CB-CD1 4.16Å; F102-I104 HydrophobicContact CB-CG1 4.2Å; F102-I104 WeakPolarHBondContact O-CG1 3.28Å; F102-I104 PolarHBondContact O-N 3.44Å; F102-I104 VanDerWaalsContact O-N 3.08Å; I104-L106 HydrophobicContact CG2-CD2 4.27Å
105V79.6Confident80.3Confident128 Ų128107.9 Ų107.978%0.77665%0.646SS**  trans-95.8121.8170.8-1780000107.7
106L80.6Confident79.8Confident135 Ų135105 Ų10571%0.70764%0.642SS**  trans-91.3126.1172.5-61.3175.6000108.5I98 I104I98-L106 HydrophobicContact CD1-CD1 4.03Å; I98-L106 HydrophobicContact CD1-CD2 4.31Å; I98-L106 HydrophobicContact CD1-CG 4.34Å; I104-L106 HydrophobicContact CG2-CD2 4.27Å
107C77.6Confident79.3Confident117 Ų117108.3 Ų108.379%0.79166%0.661SS**  trans-105.8134.2173.3-59.60000108.9
108E80.2Confident78.7Confident201 Ų201111.6 Ų111.694%0.93968%0.677SS**  trans-77.9141.8166.4-171.4175.4-175.100108.8
109G57.6Low78Confident147 Ų147115 Ų115100%1.51570%0.704SS**  trans-126.70-179.100000111.8

Retrieved 109 of 109 residues in 24.2 ms (Link to these results)