A0A087X9I8_POEFO Loading...

Agouti-related protein-like

AlphaFold DB , UniProt , Accession A0A087X9I8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 141 aa.

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

Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M60.4Low69.8Low212 Ų212110.6 Ų110.6100%1.04462%0.624SS**  0-53.60-62.1-178.281.300112.1G3 M4M1-G3 VanDerWaalsContact C-N 3.33Å; M1-G3 PolarHBondContact O-N 3.36Å; M1-M4 PolarHBondContact O-N 3.46Å; M1-M4 VanDerWaalsContact O-N 3.1Å
2F66.7Low69.4Low175 Ų175108.3 Ų108.377%0.76862%0.62SS**Hα-helixtrans-51.1-38.9-179.3-66.9-80.2000116.3M4 L5 L6F2-M4 PolarHBondContact O-N 2.86Å; F2-L5 PolarHBondContact O-N 2.74Å; F2-L6 PolarHBondContact O-N 3.13Å; F2-L6 VanDerWaalsContact O-N 3.14Å
3G71.6Confident68.9Low43 Ų43105.2 Ų105.244%0.44363%0.626SS.*Hα-helixtrans-59.2-30.3178.800000114.7M1 L6 L7M1-G3 VanDerWaalsContact C-N 3.33Å; M1-G3 PolarHBondContact O-N 3.36Å; G3-L6 PolarHBondContact O-N 3.46Å; G3-L7 VanDerWaalsContact O-CD1 3.29Å; G3-L7 WeakPolarHBondContact O-CD1 3.49Å; G3-L7 PolarHBondContact O-N 3.31Å; G3-L7 VanDerWaalsContact O-N 3.1Å
4M74.3Confident68.3Low141 Ų141108.3 Ų108.370%0.69564%0.637SS**Hα-helixtrans-72.8-38.1178.1-128.1-62.117400111.6M1 F2 L6 L7 C8M1-M4 PolarHBondContact O-N 3.46Å; M1-M4 VanDerWaalsContact O-N 3.1Å; F2-M4 PolarHBondContact O-N 2.86Å; M4-L6 VanDerWaalsContact C-N 3.34Å; M4-L7 PolarHBondContact O-N 2.78Å; M4-C8 WeakPolarHBondContact O-CB 2.98Å; M4-C8 PolarHBondContact O-N 3.37Å
5L73.4Confident67.7Low117 Ų117109.8 Ų109.861%0.61364%0.64SS**Hα-helixtrans-62-42.9171.8-92.872.3000111.1F2 C8 C9F2-L5 PolarHBondContact O-N 2.74Å; L5-C8 PolarHBondContact O-N 3.3Å; L5-C9 WeakPolarHBondContact O-CB 3.35Å; L5-C9 PolarHBondContact O-N 2.95Å; L5-C9 PolarHBondContact O-SG 3.07Å
6L72.8Confident67.3Low124 Ų124117.7 Ų117.765%0.64966%0.656SS**Hα-helixtrans-63.7-41.8179.5-67173.5000112.4F2 G3 M4 A10F2-L6 PolarHBondContact O-N 3.13Å; F2-L6 VanDerWaalsContact O-N 3.14Å; G3-L6 PolarHBondContact O-N 3.46Å; M4-L6 VanDerWaalsContact C-N 3.34Å; L6-A10 WeakPolarHBondContact O-CB 3.47Å; L6-A10 PolarHBondContact O-N 2.03Å; L6-A10 VanDerWaalsContact O-N 3.08Å
7L71.4Confident66.8Low126 Ų126117.5 Ų117.566%0.6666%0.661SS**Hα-helixtrans-63-44.2172.7-95.478.6000111.8G3 M4 C9 A10 S11G3-L7 VanDerWaalsContact O-CD1 3.29Å; G3-L7 WeakPolarHBondContact O-CD1 3.49Å; G3-L7 PolarHBondContact O-N 3.31Å; G3-L7 VanDerWaalsContact O-N 3.1Å; M4-L7 PolarHBondContact O-N 2.78Å; L7-C9 PolarHBondContact O-N 2.84Å; L7-A10 PolarHBondContact O-N 3.12Å; L7-S11 PolarHBondContact O-N 2.04Å; L7-S11 VanDerWaalsContact O-N 3.07Å; L7-S11 PolarHBondContact O-OG 3.36Å
8C73.8Confident66.4Low71 Ų71116.4 Ų116.448%0.4867%0.669SS.*Hα-helixtrans-63.1-43-179-159.70000111.8M4 L5 A10 S11 S12M4-C8 WeakPolarHBondContact O-CB 2.98Å; M4-C8 PolarHBondContact O-N 3.37Å; L5-C8 PolarHBondContact O-N 3.3Å; C8-A10 PolarHBondContact O-N 2.83Å; C8-S11 WeakPolarHBondContact CA-OG 2.93Å; C8-S11 PolarHBondContact O-N 2.04Å; C8-S11 PolarHBondContact O-OG 2.83Å; C8-S12 PolarHBondContact O-N 2.92Å; C8-S12 PolarHBondContact O-OG 2.77Å; C8-S12 VanDerWaalsContact O-OG 3.09Å
9C69.3Low65.9Low88 Ų88115.2 Ų115.260%0.59567%0.674SS**Hα-helixtrans-64.1-37.8174.7-68.20000112.5L5 L7 S12 G13L5-C9 WeakPolarHBondContact O-CB 3.35Å; L5-C9 PolarHBondContact O-N 2.95Å; L5-C9 PolarHBondContact O-SG 3.07Å; L7-C9 PolarHBondContact O-N 2.84Å; C9-S12 PolarHBondContact O-N 2.91Å; C9-G13 PolarHBondContact O-N 2.88Å
10A68.6Low65.4Low61 Ų61115.6 Ų115.650%0.50468%0.683SS.*Hα-helixtrans-64.7-40.417700000112.3L6 L7 C8 G13L6-A10 WeakPolarHBondContact O-CB 3.47Å; L6-A10 PolarHBondContact O-N 2.03Å; L6-A10 VanDerWaalsContact O-N 3.08Å; L7-A10 PolarHBondContact O-N 3.12Å; C8-A10 PolarHBondContact O-N 2.83Å; A10-G13 PolarHBondContact O-N 3.12Å
11S66.1Low64.8Low59 Ų59117.9 Ų117.941%0.41369%0.692SS.*Hα-helixtrans-63.5-39.8173.141.20000112.9L7 C8 G13 L14 L15L7-S11 PolarHBondContact O-N 2.04Å; L7-S11 VanDerWaalsContact O-N 3.07Å; L7-S11 PolarHBondContact O-OG 3.36Å; C8-S11 WeakPolarHBondContact CA-OG 2.93Å; C8-S11 PolarHBondContact O-N 2.04Å; C8-S11 PolarHBondContact O-OG 2.83Å; S11-G13 VanDerWaalsContact C-N 3.26Å; S11-G13 PolarHBondContact O-N 3.2Å; S11-L14 PolarHBondContact O-N 2.87Å; S11-L14 VanDerWaalsContact O-N 3.17Å; S11-L15 WeakPolarHBondContact O-CD1 3.05Å; S11-L15 PolarHBondContact O-N 3.07Å
12S64.9Low64.4Low83 Ų83113.5 Ų113.558%0.5868%0.677SS**Hα-helixtrans-65.5-27.4178.3-56.40000113.4C8 C9 L14C8-S12 PolarHBondContact O-N 2.92Å; C8-S12 PolarHBondContact O-OG 2.77Å; C8-S12 VanDerWaalsContact O-OG 3.09Å; C9-S12 PolarHBondContact O-N 2.91Å; S12-L14 VanDerWaalsContact C-N 3.33Å
13G62.4Low63.5Low67 Ų67114.5 Ų114.569%0.69168%0.683SS**Hα-helixtrans-74.3-18.8175.200000114.7C9 A10 S11C9-G13 PolarHBondContact O-N 2.88Å; A10-G13 PolarHBondContact O-N 3.12Å; S11-G13 VanDerWaalsContact C-N 3.26Å; S11-G13 PolarHBondContact O-N 3.2Å
14L60.5Low62.2Low149 Ų149115.7 Ų115.778%0.7870%0.695SS**Hα-helixtrans-92.9-25.8178.9-66.3173.8000112.8S11 S12 R16S11-L14 PolarHBondContact O-N 2.87Å; S11-L14 VanDerWaalsContact O-N 3.17Å; S12-L14 VanDerWaalsContact C-N 3.33Å; L14-R16 VanDerWaalsContact C-N 3.34Å; L14-R16 PolarHBondContact O-N 2.03Å
15L59.8Low61.5Low131 Ų131112.6 Ų112.669%0.68670%0.7SS**  trans-80.283.8170.9-83.777.4000109.7S11 P17S11-L15 WeakPolarHBondContact O-CD1 3.05Å; S11-L15 PolarHBondContact O-N 3.07Å; L15-P17 WeakPolarHBondContact O-CD 3.33Å
16R60.6Low60.2Low236 Ų236114.6 Ų114.689%0.89171%0.71SS**  trans-68.1108171.3-157.7176.1-167.7164.52.2108.7L14 A18L14-R16 VanDerWaalsContact C-N 3.34Å; L14-R16 PolarHBondContact O-N 2.03Å; R16-A18 PolarHBondContact O-N 2.74Å; R16-A18 VanDerWaalsContact O-N 3.07Å
17P60Low58.9Low115 Ų115118.2 Ų118.275%0.74772%0.715SS**  trans-76.6104.9-179.231.3-30000108.3L15 A19L15-P17 WeakPolarHBondContact O-CD 3.33Å; P17-A19 PolarHBondContact O-N 2.94Å
18A59.3Low57.7Low97 Ų97120.5 Ų120.580%0.80273%0.727SS**  trans-73.670.316900000109.6R16 S20R16-A18 PolarHBondContact O-N 2.74Å; R16-A18 VanDerWaalsContact O-N 3.07Å; A18-S20 PolarHBondContact O-N 3.13Å
19A57Low56.3Low93 Ų93122.2 Ų122.277%0.76973%0.731SS**PPolyproline II helixtrans-65117.1169.700000108.5P17P17-A19 PolarHBondContact O-N 2.94Å
20S54.6Low54.9Low123 Ų123126 Ų12686%0.8675%0.745SS**PPolyproline II helixtrans-58.4134.7-166.8-48.50000113.3A18A18-S20 PolarHBondContact O-N 3.13Å
21L53.6Low53.3Low165 Ų165129.1 Ų129.186%0.86476%0.758SS**PPolyproline II helixtrans-89.8117.6168.1-155.8111.3000110.1
22V52.4Low52.3Low119 Ų119131.7 Ų131.772%0.72177%0.773SS**  trans66.3120.6152.51680000119
23H47.1Very low51.4Low197 Ų197133.4 Ų133.491%0.91278%0.782SS**  trans-72.6119.6158.9-176.985.1000109.8
24G45.5Very low50Low67 Ų67135.1 Ų135.169%0.69179%0.79SS**  trans162.8108.717700000111.4
25G57.9Low49.3Very low77 Ų77132.6 Ų132.679%0.79479%0.791SS**  trans-86162.9-169.300000115.1
26I46Very low48.5Very low159 Ų159132.9 Ų132.982%0.81580%0.798SS**  trans-151.6130.6143.1-104162.6000106.3
27R46.7Very low48Very low200 Ų200131.7 Ų131.776%0.75579%0.793SS**  trans-76.6133.3162.5-78.5-164.984.4-159.37.4107.6D29R27-D29 IonicContact CZ-OD1 3.73Å; R27-D29 IonicContact NH2-OD1 2.68Å; R27-D29 PolarHBondContact NH2-OD1 3.03Å; R27-D29 IonicContact NH2-OD2 3.98Å
28L46.4Very low47.3Very low174 Ų174131.4 Ų131.491%0.91179%0.792SS**  trans-126.5112.4144.9-133.186000106.8
29D43.1Very low46.3Very low107 Ų107131.4 Ų131.457%0.57278%0.778SS**  trans-141.7130.5177.3-171.5-122.2000105.1R27R27-D29 IonicContact CZ-OD1 3.73Å; R27-D29 IonicContact NH2-OD1 2.68Å; R27-D29 PolarHBondContact NH2-OD1 3.03Å; R27-D29 IonicContact NH2-OD2 3.98Å
30D40.5Very low45.8Very low168 Ų168131.4 Ų131.490%0.89878%0.778SS**  trans-65145.1-168.7-86.1-76000113.2
31T34.5Very low45.5Very low126 Ų126129.5 Ų129.577%0.77377%0.769SS**  trans-98.3164.7-173.9-720000109.6
32P45.4Very low45.1Very low112 Ų112132 Ų13273%0.72777%0.769SS**  cis-131.9-148.21.527.9-1000112.4
33P46Very low44.7Very low119 Ų119133.9 Ų133.977%0.77377%0.774SS**  -124.2135.9-63.532.3-16.7000113
34A33.8Very low44.6Very low104 Ų104128.9 Ų128.986%0.8677%0.767SS**  trans-150141157.800000110.6
35A46Very low44.5Very low96 Ų96132.6 Ų132.679%0.79377%0.771SS**  trans-68.3150.3179.500000111.9
36V41.7Very low44.2Very low136 Ų136136 Ų13682%0.82477%0.77SS**  -174.3131.9126.9154.30000108.9P38V36-P38 VanDerWaalsContact CG1-CD 3.49Å
37R49.6Very low43.9Very low211 Ų211136.2 Ų136.280%0.79677%0.772SS**  trans-115.5114.3162.5172.7-168.4173161.74.1104.8D39R37-D39 IonicContact CZ-OD2 2.74Å; R37-D39 VanDerWaalsContact CZ-OD2 3.25Å; R37-D39 IonicContact NE-OD2 3.31Å; R37-D39 PolarHBondContact NE-OD2 3.03Å; R37-D39 IonicContact NH2-OD1 2.78Å; R37-D39 IonicContact NH2-OD2 3.92Å; R37-D39 PolarHBondContact NH2-OD2 3.49Å
38P45.6Very low44Very low110 Ų110138.3 Ų138.371%0.71478%0.78SS**  -146.7163.1102.239.1-25.1000113.8V36V36-P38 VanDerWaalsContact CG1-CD 3.49Å
39D38.6Very low43.7Very low97 Ų97132.9 Ų132.952%0.51977%0.767SS.*  cis-162.3-165.6-32.7-155.5-90.5000106.6R37R37-D39 IonicContact CZ-OD2 2.74Å; R37-D39 VanDerWaalsContact CZ-OD2 3.25Å; R37-D39 IonicContact NE-OD2 3.31Å; R37-D39 PolarHBondContact NE-OD2 3.03Å; R37-D39 IonicContact NH2-OD1 2.78Å; R37-D39 IonicContact NH2-OD2 3.92Å; R37-D39 PolarHBondContact NH2-OD2 3.49Å
40A46.5Very low43.3Very low92 Ų92137.4 Ų137.476%0.7678%0.784SS**SBendtrans-134.515.7-175.300000114.5
41A48.1Very low43.5Very low83 Ų83133.5 Ų133.569%0.68678%0.775SS**  trans-86.8-13.2-172.200000116.1L43A41-L43 PolarHBondContact O-N 3.2Å
42Y45.5Very low43.8Very low219 Ų219133.5 Ų133.586%0.85978%0.777SS**THydrogen-bonded Turntrans-83.1-9.1-167.7-162.2-102.6000115.4
43L44Very low43.3Very low158 Ų158133.4 Ų133.483%0.82778%0.779SS**THydrogen-bonded Turntrans-97.64.2-171.3-111.6171.3000115.4A41A41-L43 PolarHBondContact O-N 3.2Å
44A45Very low43.2Very low92 Ų92132.9 Ų132.976%0.7678%0.776SS**SBendtrans-95.1-6.1-175.500000115.2
45D43.8Very low43.4Very low144 Ų144134.6 Ų134.677%0.7777%0.77SS**SBendtrans-93.5-19.6-165.9-152.3-104.4000114.7D47D45-D47 PolarHBondContact O-N 2.88Å
46I52Low43Very low150 Ų150138 Ų13877%0.76977%0.769SS**THydrogen-bonded Turntrans-81.1-16.1-168.7-64.6-178.3000113.7R48I46-R48 PolarHBondContact O-N 3.47Å
47D40.2Very low42.3Very low163 Ų163139.6 Ų139.687%0.87277%0.773SS**THydrogen-bonded Turntrans-90.220.6-170.2-153.2-121.1000115.2D45D45-D47 PolarHBondContact O-N 2.88Å
48R48.4Very low41.4Very low243 Ų243132.9 Ų132.992%0.91777%0.769SS**  trans-129.935.4-171.5-151.6177.8169.585.70.8116I46I46-R48 PolarHBondContact O-N 3.47Å
49G38.8Very low40.6Very low61 Ų61131.4 Ų131.463%0.62977%0.774SS**  trans-143.876.7-178.700000116.1
50H34.8Very low40.3Very low201 Ų201134.3 Ų134.393%0.93179%0.789SS**  trans-172.6123.9134.2-104.374.9000110.9
51A44.6Very low39.7Very low86 Ų86137.4 Ų137.471%0.71179%0.792SS**  trans-103165.4166.800000108.9
52P40.8Very low39.6Very low127 Ų127138.8 Ų138.883%0.82579%0.794SS**  -144.3155.973.635.9-16.9000116.7
53S35.5Very low39.1Very low110 Ų110134.6 Ų134.677%0.76979%0.791SS**  trans-87.2-179.6158.7-43.30000109.4
54P44.4Very low38.5Very low108 Ų108133.9 Ų133.970%0.70179%0.788SS**  cis-141.4171.89.537.6-16.4000117.2
55L37.2Very low38.2Very low140 Ų140133.5 Ų133.573%0.73378%0.779SS**  169147.5119.5-89.1163.5000114.5
56Q37.1Very low38.2Very low167 Ų167134.6 Ų134.678%0.7878%0.78SS**  trans-8.4129.3165.8-67.8138.620.700118.5
57D28.2Very low37.7Very low169 Ų169136.4 Ų136.490%0.90479%0.785SS**  74.512662.1-169.553.9000115.1
58G31Very low38Very low70 Ų70135 Ų13572%0.72278%0.778SS**  trans131.5110.1166.900000118.4
59G28.1Very low38Very low79 Ų79133.1 Ų133.181%0.81477%0.771SS**  trans102.879.213100000122.6
60L31.7Very low38.6Very low158 Ų158138 Ų13883%0.82778%0.781SS**  37.4108.9129.7-61.4170.8000123.7
61L33.8Very low39.6Very low157 Ų157135.7 Ų135.782%0.82278%0.775SS**  trans65.6-179.6135.5-47.1-172.5000119.1
62P46.1Very low40.1Very low112 Ų112139.9 Ų139.973%0.72778%0.782SS**  -129.7-158-97.640.2-19.4000113.2
63V34.9Very low40.3Very low132 Ų132143 Ų14380%0.879%0.786SS**  trans114.4122.9160.91800000116.1
64D31.8Very low41.2Very low143 Ų143143 Ų14377%0.76579%0.792SS**  trans40.1121.4156.7-93.7-147.1000124.5
65S38.6Very low41.6Very low83 Ų83140.9 Ų140.958%0.5879%0.79SS**  47.2132.8108.7-137.20000122.4
66E45Very low42.1Very low168 Ų168139.6 Ų139.679%0.78579%0.793SS**  trans53.291.6143.175.3-155.5104.800121.3
67E41.7Very low42.9Very low187 Ų187139 Ų13987%0.87480%0.795SS**  trans-134.7106.213252.5-170.3113.600112.8
68D45.9Very low44.2Very low135 Ų135137 Ų13772%0.72279%0.785SS**  trans-56.1147.7155.5-175.3-91.4000109.6
69R49.2Very low45.3Very low202 Ų202142.2 Ų142.276%0.76279%0.79SS**  trans107118.9-169.4-60.7148.887.783.86.3110.8
70L49.9Very low46.4Very low163 Ų163144.5 Ų144.585%0.85378%0.784SS**  cis-138108.141.4-71.1163.3000112.3M72L70-M72 PolarHBondContact O-N 3.48Å
71L55.5Low47.2Very low154 Ų154141 Ų14181%0.80677%0.772SS**  trans-70.389.2162.5-70.4166.1000110
72M56.6Low48Very low173 Ų173137.1 Ų137.185%0.85276%0.759SS**  trans163.898.1144.8-94.6-178.2-78.700110.9L70L70-M72 PolarHBondContact O-N 3.48Å
73E45Very low48.1Very low192 Ų192134.8 Ų134.890%0.89775%0.748SS**  trans-141.478149.8-165.475.8-162.300107.1G75E73-G75 PolarHBondContact O-N 2.68Å
74A54Low48.9Very low110 Ų110134.2 Ų134.291%0.90974%0.74SS**  trans-83.798.1178.500000109.8
75G52.1Low49.7Very low64 Ų64134.6 Ų134.666%0.6674%0.738SS**  trans-164.6129.5177.800000114.1E73E73-G75 PolarHBondContact O-N 2.68Å
76S48.7Very low50.2Low113 Ų113136.9 Ų136.979%0.7974%0.743SS**  trans68.174.8169.7-167.40000117.5N78S76-N78 PolarHBondContact O-N 2.75Å
77N54.4Low50.4Low154 Ų154135.2 Ų135.282%0.82474%0.735SS**  trans-74.6106.6162.2-170.3-17.8000110.1
78N54.7Low50.6Low128 Ų128128.4 Ų128.468%0.68472%0.715SS**  trans-148.731.9-175.4-172.658.3000115.3S76S76-N78 PolarHBondContact O-N 2.75Å
79E54Low50.9Low179 Ų179132.5 Ų132.584%0.83672%0.72SS**  trans-131.935.6-176.4-66.4-157.5127.800116.9
80D50.4Low51Low127 Ų127127 Ų12768%0.67972%0.718SS**  trans-106.229.2169.7-80.3-49.2000114.4S82D80-S82 PolarHBondContact O-N 3.34Å
81S49.8Very low50.9Low84 Ų84124.5 Ų124.559%0.58771%0.71SS**  trans-76.4-4.1172.6-72.10000114.3
82S49.9Very low51.3Low77 Ų77125.6 Ų125.654%0.53870%0.703SS.*Hα-helixtrans-72.2-37.3178.157.20000112.7D80 L84 Q85D80-S82 PolarHBondContact O-N 3.34Å; S82-L84 VanDerWaalsContact C-N 3.31Å; S82-L84 PolarHBondContact O-N 2.04Å; S82-Q85 PolarHBondContact O-N 3.25Å
83A48.7Very low51.1Low62 Ų62122 Ų12251%0.51270%0.695SS.*Hα-helixtrans-67.1-28.8178.400000113.4
84L50.1Low52Low120 Ų120118.2 Ų118.263%0.62869%0.687SS**Hα-helixtrans-75.5-26.4177.2-118.2166.5000112.6S82 L86 Q87 G88S82-L84 VanDerWaalsContact C-N 3.31Å; S82-L84 PolarHBondContact O-N 2.04Å; L84-L86 VanDerWaalsContact C-N 3.31Å; L84-L86 PolarHBondContact O-N 2.93Å; L84-Q87 PolarHBondContact O-N 3.45Å; L84-Q87 VanDerWaalsContact O-N 3.16Å; L84-G88 PolarHBondContact O-N 2.96Å
85Q50.1Low52.7Low152 Ų152118 Ų11871%0.7166%0.662SS**Hα-helixtrans-71.2-25.3-175.3-130.3169.799.100113.3S82S82-Q85 PolarHBondContact O-N 3.25Å
86L49Very low54.1Low131 Ų131125.7 Ų125.769%0.68667%0.672SS**Hα-helixtrans-74.3-31.4171.3-85.6148.8000112.9L84 G88L84-L86 VanDerWaalsContact C-N 3.31Å; L84-L86 PolarHBondContact O-N 2.93Å; L86-G88 VanDerWaalsContact C-N 3.33Å
87Q48.6Very low55.9Low133 Ų133122.1 Ų122.162%0.62165%0.646SS**Hα-helixtrans-72-29.3172.9-66.2-179.141.500111.7L84 R89 A90 V91L84-Q87 PolarHBondContact O-N 3.45Å; L84-Q87 VanDerWaalsContact O-N 3.16Å; Q87-R89 PolarHBondContact O-N 2.89Å; Q87-R89 VanDerWaalsContact O-N 3.15Å; Q87-A90 PolarHBondContact O-N 3.43Å; Q87-V91 PolarHBondContact O-N 3.37Å
88G45.1Very low57.6Low44 Ų44115.9 Ų115.945%0.45461%0.612SS.*THydrogen-bonded Turntrans-57.7-25175.400000115.1L84 L86 A90 V91L84-G88 PolarHBondContact O-N 2.96Å; L86-G88 VanDerWaalsContact C-N 3.33Å; G88-A90 VanDerWaalsContact C-N 3.32Å; G88-A90 PolarHBondContact O-N 3.21Å; G88-V91 PolarHBondContact O-N 2.79Å
89R53.9Low59.2Low220 Ų220110.9 Ų110.983%0.8359%0.587SS**THydrogen-bonded Turntrans-76.5-14.7176.1-73.8-177.3173.6143.8-0.2114.2Q87Q87-R89 PolarHBondContact O-N 2.89Å; Q87-R89 VanDerWaalsContact O-N 3.15Å
90A51Low60.9Low88 Ų88105 Ų10573%0.72756%0.56SS**THydrogen-bonded Turntrans-97.4-17.9172.500000113.1Q87 G88 R92Q87-A90 PolarHBondContact O-N 3.43Å; G88-A90 VanDerWaalsContact C-N 3.32Å; G88-A90 PolarHBondContact O-N 3.21Å; A90-R92 PolarHBondContact O-N 3.03Å
91V47.7Very low62.8Low110 Ų110104.7 Ų104.767%0.66755%0.554SS**  trans-77.267.8170-170.70000109.6Q87 G88 S93Q87-V91 PolarHBondContact O-N 3.37Å; G88-V91 PolarHBondContact O-N 2.79Å; V91-S93 PolarHBondContact O-N 3.15Å
92R62.8Low64.7Low177 Ų177104.8 Ų104.867%0.66855%0.545SS*.  trans-58.1124.8159.3-74.3-167.5-179.6-145.82.2106.8A90A90-R92 PolarHBondContact O-N 3.03Å
93S53.1Low66.7Low97 Ų97106.8 Ų106.868%0.67854%0.544SS*.  trans-31.1132.2173.4175.50000111.3V91 R95V91-S93 PolarHBondContact O-N 3.15Å; S93-R95 WeakPolarHBondContact O-CA 3.05Å; S93-R95 PolarHBondContact O-N 3.18Å
94P63.4Low68.6Low113 Ų113104.1 Ų104.173%0.73452%0.522SS*.  trans-44.2100.4-173.1-29.934.5000110.5R96P94-R96 PolarHBondContact O-N 3.16Å
95R69Low70.1Confident104 Ų104104.9 Ų104.939%0.39253%0.526SS..  trans-64.1111.4-164.4-73.3-164.2-171.9-133.615.9106.4S93 C97 P99 L109S93-R95 WeakPolarHBondContact O-CA 3.05Å; S93-R95 PolarHBondContact O-N 3.18Å; R95-C97 WeakPolarHBondContact CB-O 3.3Å; R95-C97 PolarHBondContact O-N 3.38Å; R95-P99 VanDerWaalsContact NH1-CG 3.26Å; R95-L109 WeakPolarHBondContact O-CD2 3.16Å
96R81.1Confident71Confident227 Ų227100.4 Ų100.486%0.85752%0.521SS*.SBendtrans-64.3-4.8-176-64.2-172.4179.3-161.90.5114.3P94P94-R96 PolarHBondContact O-N 3.16Å
97C88.3Confident71.7Confident37 Ų37103.3 Ų103.325%0.2552%0.524CS..SBendtrans-150.8158.5177.561.70000110.8R95 P110 C112R95-C97 WeakPolarHBondContact CB-O 3.3Å; R95-C97 PolarHBondContact O-N 3.38Å; C97-P110 CarbonylContact C-O 3.59Å; C97-P110 WeakPolarHBondContact CA-O 3.48Å; C97-P110 WeakPolarHBondContact CB-O 3.36Å; C97-C112 HydrophobicContact CB-CB 3.83Å; C97-C112 WeakPolarHBondContact CB-SG 2.78Å; C97-C112 PolarHBondContact O-SG 3.07Å; C97-C112 VanDerWaalsContact O-SG 3.36Å; C97-C112 WeakPolarHBondContact SG-CA 3.42Å; C97-C112 WeakPolarHBondContact SG-CB 3.27Å; C97-C112 CovalentContact SG-SG 2.04Å; C97-C112 PolarHBondContact SG-SG 3.25Å
98I89.5Confident73Confident23 Ų23101.6 Ų101.612%0.11853%0.527CS..BIsolated β-bridgetrans-92.8123.1177.6-61.5137.7000109.2Q102 C104 L109 P110 C111 C112 C129I98-Q102 HydrophobicContact CG2-CB 3.87Å; I98-C104 HydrophobicContact CD1-CB 3.8Å; I98-C104 HydrophobicContact CG2-CB 4.5Å; I98-L109 HydrophobicContact CD1-CB 3.94Å; I98-L109 VanDerWaalsContact CD1-O 3.27Å; I98-L109 WeakPolarHBondContact CD1-O 3.38Å; I98-L109 HydrophobicContact CG1-CB 4.28Å; I98-P110 PolarHBondContact N-O 3.32Å; I98-C111 CarbonylContact O-C 3.47Å; I98-C111 VanDerWaalsContact O-CA 3.3Å; I98-C111 WeakPolarHBondContact O-CA 3.29Å; I98-C112 VanDerWaalsContact C-SG 3.54Å; I98-C112 PolarHBondContact O-N 3.03Å; I98-C129 HydrophobicContact CG2-CB 4.48Å; I98-C129 VanDerWaalsContact CG2-SG 3.59Å
99P88.3Confident75Confident23 Ų23102.7 Ų102.715%0.14952%0.522CS..PPolyproline II helixtrans-64.1159.1176-21.732.6000113.4R95 Q101 Q102R95-P99 VanDerWaalsContact NH1-CG 3.26Å; P99-Q101 PolarHBondContact O-N 3.26Å; P99-Q102 HydrophobicContact CB-CB 4.48Å; P99-Q102 HydrophobicContact CB-CG 3.98Å; P99-Q102 VanDerWaalsContact CD-OE1 3.25Å; P99-Q102 HydrophobicContact CG-CG 4.26Å; P99-Q102 WeakPolarHBondContact O-CB 3.05Å; P99-Q102 PolarHBondContact O-N 3.39Å
100H89.4Confident76.6Confident57 Ų5796.4 Ų96.426%0.26451%0.509SS..THydrogen-bonded Turntrans-46.2137.7169.4-177.467.9000112.3Q102 D116 P131H100-Q102 PolarHBondContact O-N 3.18Å; H100-D116 WeakPolarHBondContact CA-OD2 3.44Å; H100-D116 IonicContact CE1-OD2 3.9Å; H100-D116 IonicContact CG-OD2 3.51Å; H100-D116 IonicContact ND1-OD1 3.59Å; H100-D116 IonicContact ND1-OD2 2.77Å; H100-D116 PolarHBondContact ND1-OD2 3.09Å; H100-P131 WeakPolarHBondContact CE1-CD 3.5Å
101Q89.7Confident78.5Confident119 Ų11993.1 Ų93.156%0.55648%0.481SS*.THydrogen-bonded Turntrans58.23.7-175.2-73.617456.400116.7P99 C129P99-Q101 PolarHBondContact O-N 3.26Å; Q101-C129 WeakPolarHBondContact CA-O 3.17Å; Q101-C129 PolarHBondContact N-O 3.18Å
102Q91.1Very high80.5Confident86 Ų8690.5 Ų90.540%0.40247%0.467SS..SBendtrans-86.7155.7171.4-61.2-164.6-1.800111.8I98 P99 H100 C104 Y128 C129I98-Q102 HydrophobicContact CG2-CB 3.87Å; P99-Q102 HydrophobicContact CB-CB 4.48Å; P99-Q102 HydrophobicContact CB-CG 3.98Å; P99-Q102 VanDerWaalsContact CD-OE1 3.25Å; P99-Q102 HydrophobicContact CG-CG 4.26Å; P99-Q102 WeakPolarHBondContact O-CB 3.05Å; P99-Q102 PolarHBondContact O-N 3.39Å; H100-Q102 PolarHBondContact O-N 3.18Å; Q102-C104 PolarHBondContact O-N 3.29Å; Q102-Y128 VanDerWaalsContact O-CA 3.25Å; Q102-Y128 WeakPolarHBondContact O-CA 3.04Å; Q102-Y128 WeakPolarHBondContact O-CB 3.41Å; Q102-C129 PolarHBondContact O-N 3.5Å; Q102-C129 VanDerWaalsContact O-N 3.13Å
103F90.4Very high81.7Confident119 Ų11984 Ų8452%0.52245%0.445SS..BIsolated β-bridgetrans-65.7126.7-177.1-88.5-98.1000111.9L105 I126 C127F103-L105 HydrophobicContact CB-CD1 4.2Å; F103-L105 HydrophobicContact CB-CG 4.27Å; F103-L105 HydrophobicContact CD1-CD1 4.42Å; F103-L105 HydrophobicContact CD1-CG 4.34Å; F103-L105 PolarHBondContact O-N 3.34Å; F103-I126 HydrophobicContact CE1-CB 4.39Å; F103-I126 HydrophobicContact CE1-CG2 3.82Å; F103-I126 HydrophobicContact CZ-CG2 3.92Å; F103-C127 CarbonylContact C-O 3.54Å; F103-C127 VanDerWaalsContact CA-O 3.26Å; F103-C127 WeakPolarHBondContact CA-O 3.22Å; F103-C127 WeakPolarHBondContact CD1-O 3.39Å
104C90.1Very high83.3Confident7 Ų785.8 Ų85.85%0.04746%0.455CS..  trans-9967.6173.453.10000110.6I98 Q102 G106 C118 C127 Y128I98-C104 HydrophobicContact CD1-CB 3.8Å; I98-C104 HydrophobicContact CG2-CB 4.5Å; Q102-C104 PolarHBondContact O-N 3.29Å; C104-G106 PolarHBondContact O-N 3.43Å; C104-C118 HydrophobicContact CB-CB 3.77Å; C104-C118 WeakPolarHBondContact CB-SG 3.1Å; C104-C118 WeakPolarHBondContact SG-CA 3.25Å; C104-C118 WeakPolarHBondContact SG-CB 3.39Å; C104-C118 CovalentContact SG-SG 2.03Å; C104-C118 PolarHBondContact SG-SG 3.17Å; C104-C127 PolarHBondContact N-O 3.4Å; C104-Y128 VanDerWaalsContact SG-C 3.51Å; C104-Y128 VanDerWaalsContact SG-CA 3.5Å; C104-Y128 PolarHBondContact SG-N 3.36Å
105L80.6Confident84.5Confident135 Ų13582.3 Ų82.371%0.70743%0.433SS*.  trans-77.8109.1177.2-72.1160.1000110.3F103F103-L105 HydrophobicContact CB-CD1 4.2Å; F103-L105 HydrophobicContact CB-CG 4.27Å; F103-L105 HydrophobicContact CD1-CD1 4.42Å; F103-L105 HydrophobicContact CD1-CG 4.34Å; F103-L105 PolarHBondContact O-N 3.34Å
106G68Low85.6Confident59 Ų5978.1 Ų78.161%0.60842%0.418SS*.SBendtrans94.118.6161.500000118.2C104 S108C104-G106 PolarHBondContact O-N 3.43Å; G106-S108 PolarHBondContact O-N 3.08Å
107Y64.6Low86.1Confident191 Ų19171 Ų7175%0.74940%0.4SS*.SBendtrans56.9-7.9169.5-63.3-82.2000118.7L109Y107-L109 PolarHBondContact O-N 3.37Å; Y107-L109 VanDerWaalsContact O-N 3.12Å
108S76.9Confident86.2Confident98 Ų9871 Ų7169%0.68540%0.4SS*.SBendtrans-69.1-10-174.845.20000114.1G106G106-S108 PolarHBondContact O-N 3.08Å
109L85.1Confident86.3Confident66 Ų6673.8 Ų73.835%0.34641%0.41SS..SBendtrans-136.3141.2177.9-64.195.4000110.7R95 I98 Y107R95-L109 WeakPolarHBondContact O-CD2 3.16Å; I98-L109 HydrophobicContact CD1-CB 3.94Å; I98-L109 VanDerWaalsContact CD1-O 3.27Å; I98-L109 WeakPolarHBondContact CD1-O 3.38Å; I98-L109 HydrophobicContact CG1-CB 4.28Å; Y107-L109 PolarHBondContact O-N 3.37Å; Y107-L109 VanDerWaalsContact O-N 3.12Å
110P89.1Confident86.5Confident88 Ų8873.9 Ų73.957%0.57141%0.41SS*.  trans-77.3165.8173.133.3-35.7000111.7C97 I98C97-P110 CarbonylContact C-O 3.59Å; C97-P110 WeakPolarHBondContact CA-O 3.48Å; C97-P110 WeakPolarHBondContact CB-O 3.36Å; I98-P110 PolarHBondContact N-O 3.32Å
111C89.7Confident86.6Confident20 Ų2076.8 Ų76.814%0.13542%0.419CS..BIsolated β-bridgetrans-66149.5165-59.30000110.5I98 D116 C129I98-C111 CarbonylContact O-C 3.47Å; I98-C111 VanDerWaalsContact O-CA 3.3Å; I98-C111 WeakPolarHBondContact O-CA 3.29Å; C111-D116 HydrophobicContact CB-CB 3.65Å; C111-D116 WeakPolarHBondContact CB-O 3.5Å; C111-C129 VanDerWaalsContact CA-SG 3.54Å; C111-C129 HydrophobicContact CB-CB 3.87Å; C111-C129 WeakPolarHBondContact CB-SG 3.39Å; C111-C129 WeakPolarHBondContact SG-CB 3.28Å; C111-C129 CovalentContact SG-SG 2.04Å; C111-C129 PolarHBondContact SG-SG 3.32Å
112C89.5Confident86.8Confident54 Ų5478 Ų7837%0.36542%0.423SS..SBendtrans-71.6-34.4-177.6-66.90000113.5C97 I98C97-C112 HydrophobicContact CB-CB 3.83Å; C97-C112 WeakPolarHBondContact CB-SG 2.78Å; C97-C112 PolarHBondContact O-SG 3.07Å; C97-C112 VanDerWaalsContact O-SG 3.36Å; C97-C112 WeakPolarHBondContact SG-CA 3.42Å; C97-C112 WeakPolarHBondContact SG-CB 3.27Å; C97-C112 CovalentContact SG-SG 2.04Å; C97-C112 PolarHBondContact SG-SG 3.25Å; I98-C112 VanDerWaalsContact C-SG 3.54Å; I98-C112 PolarHBondContact O-N 3.03Å
113D88.8Confident86.8Confident40 Ų4085.3 Ų85.321%0.21445%0.448CS..SBendtrans-92.3129.3175.6-70.1-67000108.5C115 D116 R139D113-C115 PolarHBondContact O-N 3.06Å; D113-C115 VanDerWaalsContact O-N 3.13Å; D113-D116 HydrophobicContact CB-CB 4.39Å; D113-D116 WeakPolarHBondContact O-CB 3.06Å; D113-D116 PolarHBondContact O-N 2.75Å; D113-R139 IonicContact OD1-CZ 3.69Å; D113-R139 IonicContact OD1-NH1 3.77Å; D113-R139 IonicContact OD1-NH2 2.86Å; D113-R139 PolarHBondContact OD1-NH2 3.43Å; D113-R139 IonicContact OD2-CZ 3.45Å; D113-R139 IonicContact OD2-NH1 2.84Å; D113-R139 PolarHBondContact OD2-NH1 2.85Å; D113-R139 IonicContact OD2-NH2 3.25Å; D113-R139 PolarHBondContact OD2-NH2 3.14Å
114P86.9Confident86.7Confident135 Ų13585.3 Ų85.388%0.87745%0.454SS*.THydrogen-bonded Turntrans-68.4-12.6-178.228.9-36.4000113.4
115C89.3Confident86.6Confident40 Ų4088.5 Ų88.527%0.2748%0.48SS..THydrogen-bonded Turntrans-77.4-20.2171.1-78.80000113.6D113 P131 V132 C136D113-C115 PolarHBondContact O-N 3.06Å; D113-C115 VanDerWaalsContact O-N 3.13Å; C115-P131 WeakPolarHBondContact O-CA 3.03Å; C115-V132 PolarHBondContact O-N 3.24Å; C115-V132 VanDerWaalsContact O-N 3.07Å; C115-C136 HydrophobicContact CB-CB 3.59Å; C115-C136 WeakPolarHBondContact CB-SG 3.29Å; C115-C136 WeakPolarHBondContact SG-CB 3.46Å; C115-C136 CovalentContact SG-SG 2.03Å; C115-C136 PolarHBondContact SG-SG 3.18Å
116D91.6Very high87.1Confident17 Ų1785.1 Ų85.19%0.09146%0.462CS..EExtended strand (participates in β ladder)trans-92134.3-176-89.122.8000111.1H100 C111 D113 C129 R130 P131H100-D116 WeakPolarHBondContact CA-OD2 3.44Å; H100-D116 IonicContact CE1-OD2 3.9Å; H100-D116 IonicContact CG-OD2 3.51Å; H100-D116 IonicContact ND1-OD1 3.59Å; H100-D116 IonicContact ND1-OD2 2.77Å; H100-D116 PolarHBondContact ND1-OD2 3.09Å; C111-D116 HydrophobicContact CB-CB 3.65Å; C111-D116 WeakPolarHBondContact CB-O 3.5Å; D113-D116 HydrophobicContact CB-CB 4.39Å; D113-D116 WeakPolarHBondContact O-CB 3.06Å; D113-D116 PolarHBondContact O-N 2.75Å; D116-C129 HydrophobicContact CB-CB 4.21Å; D116-R130 CarbonylContact C-O 3.5Å; D116-R130 WeakPolarHBondContact CA-O 3.44Å; D116-R130 VanDerWaalsContact CG-C 3.49Å; D116-R130 VanDerWaalsContact OD1-C 3.29Å; D116-P131 VanDerWaalsContact OD1-CA 3.28Å; D116-P131 WeakPolarHBondContact OD1-CA 3.38Å; D116-P131 VanDerWaalsContact OD1-CD 3.29Å; D116-P131 WeakPolarHBondContact OD1-CD 3.49Å
117T90.6Very high88.3Confident76 Ų7683 Ų8347%0.46644%0.438SS..EExtended strand (participates in β ladder)trans-118.1144.7170.8-50.30000109.3Y119 R130T117-Y119 PolarHBondContact O-N 3.37Å; T117-R130 PolarHBondContact N-O 3.31Å; T117-R130 PolarHBondContact O-N 3.18Å; T117-R130 VanDerWaalsContact O-N 3.07Å
118C91.6Very high89.6Confident37 Ų3776 Ų7625%0.2541%0.411CS..EExtended strand (participates in β ladder)trans-62117.8171-178.20000109.6C104C104-C118 HydrophobicContact CB-CB 3.77Å; C104-C118 WeakPolarHBondContact CB-SG 3.1Å; C104-C118 WeakPolarHBondContact SG-CA 3.25Å; C104-C118 WeakPolarHBondContact SG-CB 3.39Å; C104-C118 CovalentContact SG-SG 2.03Å; C104-C118 PolarHBondContact SG-SG 3.17Å
119Y90.8Very high90.4Very high83 Ų8371.3 Ų71.333%0.32538%0.378SS..EExtended strand (participates in β ladder)trans-121133.4-179.8171.2-105.5000110.9T117 R121 C127 Y128 R130T117-Y119 PolarHBondContact O-N 3.37Å; Y119-R121 HydrophobicContact CD1-CG 4.19Å; Y119-R121 HydrophobicContact CE1-CG 3.46Å; Y119-R121 VanDerWaalsContact CE1-CG 3.46Å; Y119-C127 CarbonylContact O-C 3.58Å; Y119-C127 VanDerWaalsContact O-CA 3.29Å; Y119-C127 WeakPolarHBondContact O-CA 3.26Å; Y119-Y128 HydrophobicContact CD1-CE1 4.13Å; Y119-Y128 PolarHBondContact N-O 3.33Å; Y119-Y128 PolarHBondContact O-N 3.36Å; Y119-R130 HydrophobicContact CG-CG 4.46Å
120C92.7Very high90.7Very high24 Ų2472.1 Ų72.116%0.16238%0.376CS..EExtended strand (participates in β ladder)trans-109.4136.6-174.6-67.70000112.1N124 I126 C127C120-N124 HydrophobicContact CB-CB 4.24Å; C120-N124 WeakPolarHBondContact CB-OD1 3.47Å; C120-I126 CarbonylContact C-O 3.55Å; C120-I126 WeakPolarHBondContact CA-O 3.36Å; C120-C127 HydrophobicContact CB-CB 4.16Å; C120-C127 WeakPolarHBondContact CB-SG 3.07Å; C120-C127 WeakPolarHBondContact SG-CB 3.13Å; C120-C127 CovalentContact SG-SG 2.04Å; C120-C127 PolarHBondContact SG-SG 3.22Å
121R90.9Very high90.7Very high119 Ų11969.9 Ų69.945%0.44936%0.362SS..EExtended strand (participates in β ladder)trans-114.9170170.3-64.7-174.6-176.9-109.4-1.8110.1Y119 Y123 N124 A125 I126 Y128Y119-R121 HydrophobicContact CD1-CG 4.19Å; Y119-R121 HydrophobicContact CE1-CG 3.46Å; Y119-R121 VanDerWaalsContact CE1-CG 3.46Å; R121-Y123 PolarHBondContact O-N 3Å; R121-N124 PolarHBondContact O-N 3.28Å; R121-A125 PolarHBondContact O-N 3.46Å; R121-I126 PolarHBondContact N-O 3.1Å; R121-I126 PolarHBondContact O-N 3.25Å; R121-Y128 HydrophobicContact CG-CE1 4.29Å; R121-Y128 PolarHBondContact NE-OH 3.48Å; R121-Y128 PolarHBondContact NH2-OH 3.08Å
122F94.2Very high90.5Very high145 Ų14572.5 Ų72.564%0.63638%0.377SS*.THydrogen-bonded Turntrans50.555.5173.6-54.4-77.6000112.9N124 A125 I126F122-N124 VanDerWaalsContact C-N 3.29Å; F122-N124 PolarHBondContact O-N 2.91Å; F122-A125 HydrophobicContact CB-CB 4.25Å; F122-A125 WeakPolarHBondContact O-CB 3.29Å; F122-A125 PolarHBondContact O-N 3.07Å; F122-A125 VanDerWaalsContact O-N 3.08Å; F122-I126 HydrophobicContact CD2-CB 4.32Å; F122-I126 HydrophobicContact CD2-CD1 3.86Å; F122-I126 HydrophobicContact CD2-CG1 4.27Å; F122-I126 HydrophobicContact CE2-CD1 4.12Å
123Y91.9Very high89.9Confident238 Ų23871.8 Ų71.893%0.93338%0.379SS*.THydrogen-bonded Turntrans55.240.5-179.7-51.5-84.2000114R121 A125R121-Y123 PolarHBondContact O-N 3Å; Y123-A125 VanDerWaalsContact C-N 3.29Å; Y123-A125 PolarHBondContact O-N 3.41Å
124N87.1Confident89.1Confident119 Ų11979.1 Ų79.164%0.63641%0.412SS*.THydrogen-bonded Turntrans69.515.1-177.3-47.6-39.9000116C120 R121 F122C120-N124 HydrophobicContact CB-CB 4.24Å; C120-N124 WeakPolarHBondContact CB-OD1 3.47Å; R121-N124 PolarHBondContact O-N 3.28Å; F122-N124 VanDerWaalsContact C-N 3.29Å; F122-N124 PolarHBondContact O-N 2.91Å
125A89.5Confident88.4Confident74 Ų7479.2 Ų79.261%0.61241%0.41SS*.THydrogen-bonded Turntrans-71.8-28.5172.300000113.6R121 F122 Y123R121-A125 PolarHBondContact O-N 3.46Å; F122-A125 HydrophobicContact CB-CB 4.25Å; F122-A125 WeakPolarHBondContact O-CB 3.29Å; F122-A125 PolarHBondContact O-N 3.07Å; F122-A125 VanDerWaalsContact O-N 3.08Å; Y123-A125 VanDerWaalsContact C-N 3.29Å; Y123-A125 PolarHBondContact O-N 3.41Å
126I91.2Very high87.8Confident64 Ų6478.3 Ų78.333%0.32840%0.404SS..EExtended strand (participates in β ladder)trans-130.6109.7-179-61.2-177.2000109F103 C120 R121 F122 Y128F103-I126 HydrophobicContact CE1-CB 4.39Å; F103-I126 HydrophobicContact CE1-CG2 3.82Å; F103-I126 HydrophobicContact CZ-CG2 3.92Å; C120-I126 CarbonylContact C-O 3.55Å; C120-I126 WeakPolarHBondContact CA-O 3.36Å; R121-I126 PolarHBondContact N-O 3.1Å; R121-I126 PolarHBondContact O-N 3.25Å; F122-I126 HydrophobicContact CD2-CB 4.32Å; F122-I126 HydrophobicContact CD2-CD1 3.86Å; F122-I126 HydrophobicContact CD2-CG1 4.27Å; F122-I126 HydrophobicContact CE2-CD1 4.12Å; I126-Y128 HydrophobicContact CG2-CD1 4.35Å
127C93.1Very high87Confident15 Ų1583.2 Ų83.210%0.10144%0.437CS..EExtended strand (participates in β ladder)trans-122.1129.2-179.1-57.50000110.8F103 C104 Y119 C120F103-C127 CarbonylContact C-O 3.54Å; F103-C127 VanDerWaalsContact CA-O 3.26Å; F103-C127 WeakPolarHBondContact CA-O 3.22Å; F103-C127 WeakPolarHBondContact CD1-O 3.39Å; C104-C127 PolarHBondContact N-O 3.4Å; Y119-C127 CarbonylContact O-C 3.58Å; Y119-C127 VanDerWaalsContact O-CA 3.29Å; Y119-C127 WeakPolarHBondContact O-CA 3.26Å; C120-C127 HydrophobicContact CB-CB 4.16Å; C120-C127 WeakPolarHBondContact CB-SG 3.07Å; C120-C127 WeakPolarHBondContact SG-CB 3.13Å; C120-C127 CovalentContact SG-SG 2.04Å; C120-C127 PolarHBondContact SG-SG 3.22Å
128Y91.8Very high86Confident43 Ų4386.2 Ų86.217%0.16945%0.446CS..EExtended strand (participates in β ladder)trans-144.7154.7-17862.1-83.5000112.6Q102 C104 Y119 R121 I126 R130Q102-Y128 VanDerWaalsContact O-CA 3.25Å; Q102-Y128 WeakPolarHBondContact O-CA 3.04Å; Q102-Y128 WeakPolarHBondContact O-CB 3.41Å; C104-Y128 VanDerWaalsContact SG-C 3.51Å; C104-Y128 VanDerWaalsContact SG-CA 3.5Å; C104-Y128 PolarHBondContact SG-N 3.36Å; Y119-Y128 HydrophobicContact CD1-CE1 4.13Å; Y119-Y128 PolarHBondContact N-O 3.33Å; Y119-Y128 PolarHBondContact O-N 3.36Å; R121-Y128 HydrophobicContact CG-CE1 4.29Å; R121-Y128 PolarHBondContact NE-OH 3.48Å; R121-Y128 PolarHBondContact NH2-OH 3.08Å; I126-Y128 HydrophobicContact CG2-CD1 4.35Å; Y128-R130 HydrophobicContact CD2-CB 4.26Å; Y128-R130 HydrophobicContact CE2-CB 3.96Å
129C92.3Very high84.8Confident0 Ų091.8 Ų91.80%046%0.461CS..EExtended strand (participates in β ladder)trans-71127.4175.5-73.30000111.3I98 Q101 Q102 C111 D116I98-C129 HydrophobicContact CG2-CB 4.48Å; I98-C129 VanDerWaalsContact CG2-SG 3.59Å; Q101-C129 WeakPolarHBondContact CA-O 3.17Å; Q101-C129 PolarHBondContact N-O 3.18Å; Q102-C129 PolarHBondContact O-N 3.5Å; Q102-C129 VanDerWaalsContact O-N 3.13Å; C111-C129 VanDerWaalsContact CA-SG 3.54Å; C111-C129 HydrophobicContact CB-CB 3.87Å; C111-C129 WeakPolarHBondContact CB-SG 3.39Å; C111-C129 WeakPolarHBondContact SG-CB 3.28Å; C111-C129 CovalentContact SG-SG 2.04Å; C111-C129 PolarHBondContact SG-SG 3.32Å; D116-C129 HydrophobicContact CB-CB 4.21Å
130R91.4Very high83.5Confident83 Ų8393.7 Ų93.731%0.31348%0.484SS..EExtended strand (participates in β ladder)trans-145152.7174.887.2-176.4-143.3-65.35.3111.9D116 T117 Y119 Y128D116-R130 CarbonylContact C-O 3.5Å; D116-R130 WeakPolarHBondContact CA-O 3.44Å; D116-R130 VanDerWaalsContact CG-C 3.49Å; D116-R130 VanDerWaalsContact OD1-C 3.29Å; T117-R130 PolarHBondContact N-O 3.31Å; T117-R130 PolarHBondContact O-N 3.18Å; T117-R130 VanDerWaalsContact O-N 3.07Å; Y119-R130 HydrophobicContact CG-CG 4.46Å; Y128-R130 HydrophobicContact CD2-CB 4.26Å; Y128-R130 HydrophobicContact CE2-CB 3.96Å
131P90.1Very high81.8Confident41 Ų41101.5 Ų101.527%0.26653%0.531SS..EExtended strand (participates in β ladder)trans-66.4138.5179.525.3-35000110.8H100 C115 D116H100-P131 WeakPolarHBondContact CE1-CD 3.5Å; C115-P131 WeakPolarHBondContact O-CA 3.03Å; D116-P131 VanDerWaalsContact OD1-CA 3.28Å; D116-P131 WeakPolarHBondContact OD1-CA 3.38Å; D116-P131 VanDerWaalsContact OD1-CD 3.29Å; D116-P131 WeakPolarHBondContact OD1-CD 3.49Å
132V85.3Confident81.4Confident75 Ų75100.6 Ų100.646%0.45554%0.535SS..  trans-124.6102.5177.3-174.40000109.5C115C115-V132 PolarHBondContact O-N 3.24Å; C115-V132 VanDerWaalsContact O-N 3.07Å
133G76.1Confident80.7Confident40 Ų4098.3 Ų98.341%0.41253%0.529SS..SBendtrans127.4161.1178.200000113.2
134H72Confident80.1Confident194 Ų19490.5 Ų90.590%0.89851%0.507SS*.SBendtrans-90.3-6.1178.4-60.8-74.9000113.4
135T73.6Confident79.7Confident136 Ų13688.8 Ų88.883%0.83450%0.499SS*.SBendtrans-86.4-8.7-177.248.20000113.9
136C76.5Confident79.1Confident21 Ų2189.8 Ų89.814%0.14249%0.492CS..SBendtrans-97.5136.7179.8-71.60000110.9C115 Q138C115-C136 HydrophobicContact CB-CB 3.59Å; C115-C136 WeakPolarHBondContact CB-SG 3.29Å; C115-C136 WeakPolarHBondContact SG-CB 3.46Å; C115-C136 CovalentContact SG-SG 2.03Å; C115-C136 PolarHBondContact SG-SG 3.18Å; C136-Q138 PolarHBondContact O-N 3.1Å
137P73.8Confident78.3Confident120 Ų12091.5 Ų91.578%0.77950%0.503SS*.  trans-63.9129.8178.826.8-33.6000110.1R139P137-R139 PolarHBondContact O-N 3.22Å; P137-R139 VanDerWaalsContact O-N 3.12Å
138Q69.3Low77.2Confident140 Ų14096.9 Ų96.965%0.65453%0.532SS*.  trans-66.2111.5172.7-60.2-61.7-40.100108.1C136C136-Q138 PolarHBondContact O-N 3.1Å
139R68.3Low76.1Confident154 Ų154101.1 Ų101.158%0.58156%0.56SS**  trans-70.1129.7177.3-173.3176.4-79.2157.34.3108.5D113 P137 T141D113-R139 IonicContact OD1-CZ 3.69Å; D113-R139 IonicContact OD1-NH1 3.77Å; D113-R139 IonicContact OD1-NH2 2.86Å; D113-R139 PolarHBondContact OD1-NH2 3.43Å; D113-R139 IonicContact OD2-CZ 3.45Å; D113-R139 IonicContact OD2-NH1 2.84Å; D113-R139 PolarHBondContact OD2-NH1 2.85Å; D113-R139 IonicContact OD2-NH2 3.25Å; D113-R139 PolarHBondContact OD2-NH2 3.14Å; P137-R139 PolarHBondContact O-N 3.22Å; P137-R139 VanDerWaalsContact O-N 3.12Å; R139-T141 PolarHBondContact O-N 3.17Å
140P62.4Low74.7Confident122 Ų122109.5 Ų109.579%0.79261%0.607SS**  trans-57.5131.8170.4-22.333.3000110.1
141T57.9Low73.2Confident188 Ų188111.9 Ų111.9100%1.15363%0.633SS**  trans-81.90175.751.40000111.6R139R139-T141 PolarHBondContact O-N 3.17Å

Retrieved 141 of 141 residues in 228.3 ms (Link to these results)