A0A3Q0KQJ1_SCHMA Loading...

Mitochondrial fission regulator 2 AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KQJ1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 485 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
1M53.1Low69Low221 Ų221129.3 Ų129.3100%1.08966%0.664SS**  0460-69.2-163.8111.400113.1
2T61.5Low69.7Low116 Ų116129.7 Ų129.771%0.71266%0.66SS**  trans-118.73.8-169.945.70000115
3T61.9Low70.3Confident102 Ų102128.2 Ų128.263%0.62665%0.654SS**SBendtrans-94.9-14.7-170.342.80000115.4
4Y61.7Low70.7Confident186 Ų186127.1 Ų127.173%0.72965%0.65SS**Hα-helixtrans-71-33-177.3-70.4-80000116.9L6Y4-L6 PolarHBondContact O-N 3.44Å
5P72Confident70.9Confident88 Ų88125 Ų12557%0.57165%0.645SS**Hα-helixtrans-76.2-24.8-176.528.7-32.4000113.2M9P5-M9 PolarHBondContact O-N 3.45Å
6L72.2Confident71.1Confident133 Ų133126.3 Ų126.370%0.69664%0.641SS**Hα-helixtrans-74-37.7180-70.3175.3000112.1Y4 M9 L10Y4-L6 PolarHBondContact O-N 3.44Å; L6-M9 PolarHBondContact O-N 3.37Å; L6-L10 WeakPolarHBondContact O-CB 3.45Å; L6-L10 PolarHBondContact O-N 3.22Å
7N72Confident70.9Confident98 Ų98123.8 Ų123.852%0.52463%0.633SS.*Hα-helixtrans-70.7-37-177.2-147.4-10.9000111.9L10 Q11N7-L10 PolarHBondContact O-N 3.18Å; N7-Q11 WeakPolarHBondContact O-CG 3.45Å; N7-Q11 PolarHBondContact O-N 3.03Å
8M74.5Confident70.6Confident129 Ų129129.2 Ų129.264%0.63564%0.644SS**Hα-helixtrans-66-41.5173.9-84.8-73.3168.200112.7H12M8-H12 PolarHBondContact O-N 3.44Å
9M75.8Confident70.3Confident142 Ų142127.5 Ų127.570%0.765%0.646SS**Hα-helixtrans-63.5-40.5173.8-87.4-87.6123.300111.9P5 L6 H12 L13P5-M9 PolarHBondContact O-N 3.45Å; L6-M9 PolarHBondContact O-N 3.37Å; M9-H12 PolarHBondContact O-N 3.39Å; M9-L13 WeakPolarHBondContact O-CB 3.5Å; M9-L13 PolarHBondContact O-N 3.04Å
10L77.5Confident69.9Low99 Ų99128.3 Ų128.352%0.51865%0.645SS.*Hα-helixtrans-66.9-42.5178.8-150.582.5000111.8L6 N7 L13 L14L6-L10 WeakPolarHBondContact O-CB 3.45Å; L6-L10 PolarHBondContact O-N 3.22Å; N7-L10 PolarHBondContact O-N 3.18Å; L10-L13 PolarHBondContact O-N 3.25Å; L10-L14 HydrophobicContact CD2-CD1 4.34Å; L10-L14 HydrophobicContact CG-CD1 4.22Å; L10-L14 WeakPolarHBondContact O-CB 3.41Å; L10-L14 WeakPolarHBondContact O-CD1 3.47Å; L10-L14 PolarHBondContact O-N 3.25Å
11Q76.5Confident69.2Low108 Ų108125 Ų12551%0.50563%0.633SS.*Hα-helixtrans-65.1-39.1176.2-73.7-171.81.900112.5N7 L14 T15N7-Q11 WeakPolarHBondContact O-CG 3.45Å; N7-Q11 PolarHBondContact O-N 3.03Å; Q11-L14 PolarHBondContact O-N 3.45Å; Q11-T15 WeakPolarHBondContact O-CB 3.49Å; Q11-T15 PolarHBondContact O-N 3.41Å; Q11-T15 PolarHBondContact O-OG1 2.99Å
12H78Confident69.3Low134 Ų134117.5 Ų117.562%0.6260%0.603SS**Hα-helixtrans-65.7-39.5174.5-119.3-80.1000111.7M8 M9 T15 Y16M8-H12 PolarHBondContact O-N 3.44Å; M9-H12 PolarHBondContact O-N 3.39Å; H12-T15 PolarHBondContact O-N 2.95Å; H12-Y16 VanDerWaalsContact O-CB 3.29Å; H12-Y16 WeakPolarHBondContact O-CB 3.41Å; H12-Y16 PolarHBondContact O-N 3.36Å
13L77.2Confident69.2Low110 Ų110117.2 Ų117.258%0.57660%0.6SS**Hα-helixtrans-65.7-45.5176-169.775.2000111.6M9 L10 T15 Y16 V17M9-L13 WeakPolarHBondContact O-CB 3.5Å; M9-L13 PolarHBondContact O-N 3.04Å; L10-L13 PolarHBondContact O-N 3.25Å; L13-T15 VanDerWaalsContact C-N 3.34Å; L13-T15 PolarHBondContact O-N 2.77Å; L13-Y16 PolarHBondContact O-N 3.39Å; L13-V17 WeakPolarHBondContact O-CB 3.27Å; L13-V17 VanDerWaalsContact O-CG2 3.27Å; L13-V17 WeakPolarHBondContact O-CG2 3.35Å; L13-V17 PolarHBondContact O-N 3.38Å
14L75.5Confident69.1Low113 Ų113122.3 Ų122.359%0.59261%0.608SS**Hα-helixtrans-61.6-40.5175.9-90.6144.1000112.1L10 Q11 R18L10-L14 HydrophobicContact CD2-CD1 4.34Å; L10-L14 HydrophobicContact CG-CD1 4.22Å; L10-L14 WeakPolarHBondContact O-CB 3.41Å; L10-L14 WeakPolarHBondContact O-CD1 3.47Å; L10-L14 PolarHBondContact O-N 3.25Å; Q11-L14 PolarHBondContact O-N 3.45Å; L14-R18 VanDerWaalsContact O-CB 3.22Å; L14-R18 WeakPolarHBondContact O-CB 3.32Å; L14-R18 PolarHBondContact O-N 2.92Å
15T74.9Confident68.9Low96 Ų96121.1 Ų121.159%0.58960%0.604SS**Hα-helixtrans-66.8-39.5175.8-53.80000111.4Q11 H12 L13 R18 S19Q11-T15 WeakPolarHBondContact O-CB 3.49Å; Q11-T15 PolarHBondContact O-N 3.41Å; Q11-T15 PolarHBondContact O-OG1 2.99Å; H12-T15 PolarHBondContact O-N 2.95Å; L13-T15 VanDerWaalsContact C-N 3.34Å; L13-T15 PolarHBondContact O-N 2.77Å; T15-R18 PolarHBondContact O-N 3.4Å; T15-S19 WeakPolarHBondContact O-CB 3.49Å; T15-S19 PolarHBondContact O-N 3.32Å
16Y73.9Confident68.3Low146 Ų146121.4 Ų121.457%0.57360%0.6SS**Hα-helixtrans-67.7-44176.8-157.8-94.5000111.7H12 L13 R18 S19 F20H12-Y16 VanDerWaalsContact O-CB 3.29Å; H12-Y16 WeakPolarHBondContact O-CB 3.41Å; H12-Y16 PolarHBondContact O-N 3.36Å; L13-Y16 PolarHBondContact O-N 3.39Å; Y16-R18 VanDerWaalsContact C-N 3.34Å; Y16-R18 PolarHBondContact O-N 2.9Å; Y16-S19 PolarHBondContact O-N 3.45Å; Y16-F20 AromaticContact CD1-CD2 3.69Å; Y16-F20 HydrophobicContact CD1-CD2 3.69Å; Y16-F20 AromaticContact CD1-CE2 3.95Å; Y16-F20 HydrophobicContact CD1-CE2 3.95Å; Y16-F20 HydrophobicContact CD2-CD2 4.46Å; Y16-F20 HydrophobicContact CD2-CE2 4.19Å; Y16-F20 AromaticContact CE1-CD2 3.48Å; Y16-F20 HydrophobicContact CE1-CD2 3.48Å; Y16-F20 VanDerWaalsContact CE1-CD2 3.48Å; Y16-F20 AromaticContact CE1-CE2 3.35Å; Y16-F20 HydrophobicContact CE1-CE2 3.35Å; Y16-F20 HydrophobicContact CE1-CG 4.33Å; Y16-F20 HydrophobicContact CE1-CZ 4.09Å; Y16-F20 HydrophobicContact CE2-CD2 4.3Å; Y16-F20 AromaticContact CE2-CE2 3.64Å; Y16-F20 HydrophobicContact CE2-CE2 3.64Å; Y16-F20 HydrophobicContact CG-CD2 4.19Å; Y16-F20 HydrophobicContact CG-CE2 4.34Å; Y16-F20 AromaticContact CZ-CD2 3.82Å; Y16-F20 AromaticContact CZ-CE2 3.17Å; Y16-F20 AromaticContact CZ-CZ 3.81Å; Y16-F20 WeakPolarHBondContact O-CD2 3.36Å; Y16-F20 PolarHBondContact O-N 3.1Å; Y16-F20 WeakPolarHBondContact OH-CE2 3.24Å; Y16-F20 WeakPolarHBondContact OH-CZ 3.38Å
17V66.7Low67.7Low83 Ų83119.7 Ų119.750%0.50359%0.594SS.*Hα-helixtrans-65.1-37.8175.6174.80000111L13 S19 F20 C21L13-V17 WeakPolarHBondContact O-CB 3.27Å; L13-V17 VanDerWaalsContact O-CG2 3.27Å; L13-V17 WeakPolarHBondContact O-CG2 3.35Å; L13-V17 PolarHBondContact O-N 3.38Å; V17-S19 VanDerWaalsContact C-N 3.3Å; V17-S19 PolarHBondContact O-N 3.09Å; V17-F20 PolarHBondContact O-N 3.36Å; V17-C21 WeakPolarHBondContact O-CB 3.44Å; V17-C21 PolarHBondContact O-N 2.94Å
18R65.3Low67.3Low221 Ų221122.2 Ų122.283%0.83460%0.601SS**Hα-helixtrans-68.6-27175.3-163.9175.9174.795.8-1.6113L14 T15 Y16L14-R18 VanDerWaalsContact O-CB 3.22Å; L14-R18 WeakPolarHBondContact O-CB 3.32Å; L14-R18 PolarHBondContact O-N 2.92Å; T15-R18 PolarHBondContact O-N 3.4Å; Y16-R18 VanDerWaalsContact C-N 3.34Å; Y16-R18 PolarHBondContact O-N 2.9Å
19S66.1Low66.7Low97 Ų97124.9 Ų124.968%0.67861%0.609SS**Hα-helixtrans-81.7-32.4175.2-172.60000113.5T15 Y16 V17T15-S19 WeakPolarHBondContact O-CB 3.49Å; T15-S19 PolarHBondContact O-N 3.32Å; Y16-S19 PolarHBondContact O-N 3.45Å; V17-S19 VanDerWaalsContact C-N 3.3Å; V17-S19 PolarHBondContact O-N 3.09Å
20F62.1Low65.9Low143 Ų143123 Ų12363%0.62760%0.601SS**Hα-helixtrans-92-22.4-179.5-85.4-91.4000113.5Y16 V17 S22Y16-F20 AromaticContact CD1-CD2 3.69Å; Y16-F20 HydrophobicContact CD1-CD2 3.69Å; Y16-F20 AromaticContact CD1-CE2 3.95Å; Y16-F20 HydrophobicContact CD1-CE2 3.95Å; Y16-F20 HydrophobicContact CD2-CD2 4.46Å; Y16-F20 HydrophobicContact CD2-CE2 4.19Å; Y16-F20 AromaticContact CE1-CD2 3.48Å; Y16-F20 HydrophobicContact CE1-CD2 3.48Å; Y16-F20 VanDerWaalsContact CE1-CD2 3.48Å; Y16-F20 AromaticContact CE1-CE2 3.35Å; Y16-F20 HydrophobicContact CE1-CE2 3.35Å; Y16-F20 HydrophobicContact CE1-CG 4.33Å; Y16-F20 HydrophobicContact CE1-CZ 4.09Å; Y16-F20 HydrophobicContact CE2-CD2 4.3Å; Y16-F20 AromaticContact CE2-CE2 3.64Å; Y16-F20 HydrophobicContact CE2-CE2 3.64Å; Y16-F20 HydrophobicContact CG-CD2 4.19Å; Y16-F20 HydrophobicContact CG-CE2 4.34Å; Y16-F20 AromaticContact CZ-CD2 3.82Å; Y16-F20 AromaticContact CZ-CE2 3.17Å; Y16-F20 AromaticContact CZ-CZ 3.81Å; Y16-F20 WeakPolarHBondContact O-CD2 3.36Å; Y16-F20 PolarHBondContact O-N 3.1Å; Y16-F20 WeakPolarHBondContact OH-CE2 3.24Å; Y16-F20 WeakPolarHBondContact OH-CZ 3.38Å; V17-F20 PolarHBondContact O-N 3.36Å; F20-S22 PolarHBondContact O-N 3.37Å
21C54.8Low64.8Low60 Ų60123.3 Ų123.341%0.40561%0.609SS.*  trans-97.476.4179.2-141.60000110V17 V23V17-C21 WeakPolarHBondContact O-CB 3.44Å; V17-C21 PolarHBondContact O-N 2.94Å; C21-V23 PolarHBondContact O-N 3.16Å
22S56.4Low63.6Low63 Ų63126.3 Ų126.344%0.44163%0.628SS.*  trans-61.3112.6164.2-1740000107.4F20 R24 Y25F20-S22 PolarHBondContact O-N 3.37Å; S22-R24 PolarHBondContact O-N 3.44Å; S22-Y25 PolarHBondContact O-N 3.2Å
23V58.4Low62.7Low110 Ų110124 Ų12467%0.66764%0.641SS**THydrogen-bonded Turntrans-48.9-16.1-179.8-179.10000112.7C21 Y25 I26C21-V23 PolarHBondContact O-N 3.16Å; V23-Y25 VanDerWaalsContact C-N 3.27Å; V23-Y25 PolarHBondContact O-N 3.2Å; V23-I26 PolarHBondContact O-N 3.33Å
24R59.2Low61.5Low209 Ų209123.5 Ų123.579%0.78965%0.647SS**THydrogen-bonded Turntrans-61.6-21.7171.3-62.3-175.1-174.1151.42.8115.3S22S22-R24 PolarHBondContact O-N 3.44Å
25Y57.1Low60.3Low161 Ų161126 Ų12663%0.63166%0.66SS**THydrogen-bonded Turntrans-88.1-26178.1-102.8-91000113.9S22 V23 V27 K28S22-Y25 PolarHBondContact O-N 3.2Å; V23-Y25 VanDerWaalsContact C-N 3.27Å; V23-Y25 PolarHBondContact O-N 3.2Å; Y25-V27 VanDerWaalsContact C-N 3.32Å; Y25-V27 PolarHBondContact O-N 3.19Å; Y25-K28 PolarHBondContact O-N 3.11Å
26I59.8Low59.8Low95 Ų95125.5 Ų125.549%0.48767%0.665SS.*G310 helixtrans-73.2-28.7-179.5-58.3172.8000110.8V23 K28 F29V23-I26 PolarHBondContact O-N 3.33Å; I26-K28 PolarHBondContact O-N 3.28Å; I26-F29 PolarHBondContact O-N 3.38Å
27V60.8Low59.2Low96 Ų96123.9 Ų123.958%0.58267%0.673SS**G310 helixtrans-62.8-21.9176.6-179.60000113Y25 F29Y25-V27 VanDerWaalsContact C-N 3.32Å; Y25-V27 PolarHBondContact O-N 3.19Å; V27-F29 VanDerWaalsContact C-N 3.35Å
28K62.5Low58.6Low152 Ų152131.8 Ų131.866%0.66169%0.693SS**G310 helixtrans-80.7-10.9-180-70.2-176.7175.7176.90114.6Y25 I26Y25-K28 PolarHBondContact O-N 3.11Å; I26-K28 PolarHBondContact O-N 3.28Å
29F62.8Low58.1Low184 Ų184128.4 Ų128.481%0.80769%0.691SS**G310 helixtrans-106.52.7178.3-77.4-82.1000113.4I26 V27I26-F29 PolarHBondContact O-N 3.38Å; V27-F29 VanDerWaalsContact C-N 3.35Å
30L59.5Low57Low104 Ų104129.8 Ų129.855%0.54569%0.691SS.*SBendtrans-84127.7174.5-82.9134000109.9N32L30-N32 PolarHBondContact O-N 3.45Å
31P54Low56.5Low105 Ų105130 Ų13068%0.68270%0.697SS**  trans-62.5122.3175.524.1-30.2000109.3G33P31-G33 PolarHBondContact O-N 3.29Å
32N51Low55.9Low170 Ų170132.7 Ų132.791%0.90971%0.708SS**THydrogen-bonded Turntrans-58.3109177-63.83.9000109.1L30L30-N32 PolarHBondContact O-N 3.45Å
33G58.7Low55.3Low85 Ų85134.8 Ų134.888%0.87672%0.722SS**THydrogen-bonded Turntrans136.4-3.9172.700000117.3P31P31-G33 PolarHBondContact O-N 3.29Å
34S52.7Low54.5Low101 Ų101136.1 Ų136.171%0.70673%0.725SS**PPolyproline II helixtrans-89.2136.4175.7-170.50000112.1A36S34-A36 PolarHBondContact O-N 3.43Å
35L50.8Low53.4Low165 Ų165132.4 Ų132.486%0.86473%0.726SS**PPolyproline II helixtrans-53.2130.9171.1-80.8154.8000109.8
36A62.6Low52.5Low85 Ų85131.9 Ų131.970%0.70273%0.733SS**PPolyproline II helixtrans-53.6133.117900000110.7S34 R38S34-A36 PolarHBondContact O-N 3.43Å; A36-R38 PolarHBondContact O-N 3.23Å; A36-R38 VanDerWaalsContact O-N 3.17Å
37P63.2Low51.5Low112 Ų112135.4 Ų135.473%0.72775%0.752SS**PPolyproline II helixtrans-65.8121.3177.527.3-31.1000108.3L39P37-L39 PolarHBondContact O-N 2.82Å; P37-L39 VanDerWaalsContact O-N 3.11Å
38R52.7Low50.1Low249 Ų249135.5 Ų135.594%0.9476%0.757SS**  trans-71.5101.7167.4-72.8-170143.2173.7-5.7107.4A36 N40A36-R38 PolarHBondContact O-N 3.23Å; A36-R38 VanDerWaalsContact O-N 3.17Å; R38-N40 PolarHBondContact O-N 2.89Å
39L54.9Low49.2Very low150 Ų150137.5 Ų137.579%0.78577%0.765SS**  trans-71.2108168.1-68.8173.7000107.5P37 I41P37-L39 PolarHBondContact O-N 2.82Å; P37-L39 VanDerWaalsContact O-N 3.11Å; L39-I41 PolarHBondContact O-N 3.26Å
40N43.5Very low47.9Very low127 Ų127136.4 Ų136.468%0.67977%0.768SS**  trans-73.7109.6165.2-164.924.8000107R38 D42R38-N40 PolarHBondContact O-N 2.89Å; N40-D42 VanDerWaalsContact C-N 3.32Å; N40-D42 PolarHBondContact ND2-OD1 2.97Å; N40-D42 PolarHBondContact ND2-OD2 3.24Å; N40-D42 VanDerWaalsContact ND2-OD2 3.09Å; N40-D42 PolarHBondContact O-N 3.27Å
41I50.6Low46.7Very low147 Ų147137.1 Ų137.175%0.75478%0.782SS**  trans-90.581.1176.6-53.3171.1000105.9L39 S43L39-I41 PolarHBondContact O-N 3.26Å; I41-S43 PolarHBondContact O-N 2.97Å
42D43.6Very low46.2Very low117 Ų117139.9 Ų139.963%0.62679%0.786SS**  trans-70.1108.5164-70-38.7000107N40 N44N40-D42 VanDerWaalsContact C-N 3.32Å; N40-D42 PolarHBondContact ND2-OD1 2.97Å; N40-D42 PolarHBondContact ND2-OD2 3.24Å; N40-D42 VanDerWaalsContact ND2-OD2 3.09Å; N40-D42 PolarHBondContact O-N 3.27Å; D42-N44 PolarHBondContact O-N 3.35Å
43S43.8Very low45.8Very low107 Ų107140.7 Ų140.775%0.74878%0.777SS**  trans-7373.8177.356.90000109.8I41I41-S43 PolarHBondContact O-N 2.97Å
44N40.8Very low45.1Very low137 Ų137143.8 Ų143.873%0.73377%0.774SS**  trans-140.4138.6168.9-75.2-45.8000109D42D42-N44 PolarHBondContact O-N 3.35Å
45V37.1Very low44.7Very low132 Ų132147 Ų14780%0.878%0.783SS**  trans83.493.2167.4-1600000115.2
46L37.4Very low44.6Very low150 Ų150144.9 Ų144.979%0.78578%0.781SS**  172.962.9125-87.3174.8000109.8
47L38.6Very low43.6Very low169 Ų169148.9 Ų148.989%0.88579%0.79SS**  trans-115.489.6154.1-150.178.1000107.6K49L47-K49 PolarHBondContact O-N 2.96Å
48S31Very low42.7Very low97 Ų97149.8 Ų149.868%0.67880%0.798SS**  trans-65.3103.9171.9-400000109
49K43.2Very low42.1Very low194 Ų194144 Ų14484%0.84380%0.796SS**  trans-136.6114.4152.3-87-167173.8-179.80108L47 S51L47-K49 PolarHBondContact O-N 2.96Å; K49-S51 PolarHBondContact O-N 3.31Å
50N36.8Very low41.6Very low162 Ų162141 Ų14187%0.86679%0.792SS**  trans-52.7121.8174.2-54.4-17.5000109.1
51S33.3Very low41.8Very low119 Ų119139.8 Ų139.883%0.83279%0.794SS**  trans-104.1111.3158.970.30000107K49K49-S51 PolarHBondContact O-N 3.31Å
52E44Very low41.4Very low162 Ų162140.4 Ų140.476%0.75780%0.799SS**  trans-150.5112168.6-164.4145-165.900107.7
53Y41.8Very low41.4Very low187 Ų187139.5 Ų139.573%0.73380%0.802SS**  trans49.5115.6163.2-60.1-73.7000120.3
54D45.5Very low41.5Very low151 Ų151142.3 Ų142.381%0.80781%0.808SS**  16213098.6-88.1-37.5000111.3C56D54-C56 PolarHBondContact O-N 3.5Å
55D42.8Very low42Very low168 Ų168142.4 Ų142.490%0.89881%0.813SS**  trans-58.9122.3167.3-85-40.9000110.3
56C49.4Very low42.3Very low121 Ų121144.1 Ų144.182%0.81882%0.817SS**  trans-155.1109.6160-87.10000109.9D54 C58D54-C56 PolarHBondContact O-N 3.5Å; C56-C58 PolarHBondContact O-N 2.91Å
57D42.3Very low42.6Very low168 Ų168146.6 Ų146.690%0.89882%0.817SS**  trans-52.9124.9151.7-92.6-37.4000109.7
58C42.8Very low42.5Very low131 Ų131144.4 Ų144.489%0.88581%0.811SS**  trans-166.4109.7152-99.30000110.7C56C56-C58 PolarHBondContact O-N 2.91Å
59S41Very low43Very low128 Ų128143.6 Ų143.690%0.89581%0.806SS**  trans-49.3140.4162.2-56.50000113.4
60A43.8Very low42.9Very low86 Ų86139.1 Ų139.171%0.71180%0.799SS**  trans-177.7112.8134.200000110.8
61S48.2Very low43.1Very low103 Ų103141.2 Ų141.272%0.7280%0.796SS**  40.7126.7129.3-18.30000118.4
62D42.4Very low43.7Very low160 Ų160140.7 Ų140.786%0.85679%0.788SS**  -153.7140.458.4-86.7-33.3000113.7
63S44.1Very low43.5Very low98 Ų98140.2 Ų140.269%0.68579%0.791SS**  trans-70.1150.1-178.851.90000114.9
64N45.1Very low43.7Very low165 Ų165136.3 Ų136.388%0.88279%0.788SS**  trans-160.182141.3-87.8-32.2000109
65V51.3Low43.8Very low139 Ų139136 Ų13684%0.84279%0.785SS**  trans-135.1104.1164.2-173.70000107.1
66L43.1Very low44Very low168 Ų168135 Ų13588%0.8878%0.779SS**  trans-83.4111.6169-85.1163.2000108.2
67Y44.9Very low44.1Very low202 Ų202133.8 Ų133.879%0.79277%0.773SS**  trans-128.8116161.2-174.4-95000107
68T36.5Very low44.4Very low123 Ų123132.6 Ų132.676%0.75577%0.766SS**  trans-131.3115.1177.454.30000109.7
69S41.1Very low45Very low80 Ų80133.1 Ų133.156%0.55976%0.76SS**  trans-170.598.6144.463.90000107.2
70S40.9Very low45.8Very low100 Ų100133.5 Ų133.570%0.69975%0.752SS**  57.4102.791.271.60000114.6
71Y40.7Very low46.6Very low207 Ų207136.8 Ų136.881%0.81276%0.758SS**  174.6128.9111.4-115.7-108.4000113.3
72T46.6Very low47Very low107 Ų107135.7 Ų135.766%0.65675%0.75SS**  trans65.1107.4146.253.60000123.6
73D39.4Very low47.5Very low153 Ų153137.7 Ų137.782%0.81875%0.747SS**  34.4153.3116.5-71.3-12.1000121.2
74P47.1Very low47.6Very low104 Ų104139.3 Ų139.368%0.67575%0.748SS**  cis-144.4157.228.729.3-4.2000119.5
75I47.4Very low47.9Very low145 Ų145139.8 Ų139.874%0.74475%0.745SS**  trans51.2113.7131.2-48.7162.7000119.8
76N47Very low47.7Very low147 Ų147137.4 Ų137.479%0.78673%0.732SS**  173.1154.9110.7-106.6-33.3000115.4
77S49.9Very low47.5Very low96 Ų96135.2 Ų135.267%0.67172%0.721SS**  trans72.5100.2167.967.60000116.9
78N48.6Very low47.3Very low143 Ų143137.4 Ų137.477%0.76573%0.728SS**  92.511672.7-76.2-15000110.1
79D57.2Low47.3Very low142 Ų142138 Ų13876%0.75973%0.727SS**  158.7111.1127.4-73.6-18.4000111
80D57.6Low47.3Very low136 Ų136139.4 Ų139.473%0.72774%0.737SS**  trans54.3110.1135.3-58-27.9000121.9
81D59.1Low47.2Very low155 Ų155143 Ų14383%0.82974%0.742SS**  166.5111.499.9-89.4-35.1000114
82S56.8Low47.1Very low79 Ų79140.5 Ų140.555%0.55274%0.742SS**  trans41.1115.5132.3-166.10000121.8
83Y53.2Low46.8Very low202 Ų202141.5 Ų141.579%0.79275%0.748SS**  169.6120.3104.2-90.6-66.5000113.6
84N46.9Very low46.7Very low133 Ų133138.6 Ų138.671%0.71174%0.74SS**  trans59.9108.1143.4-62.7-26.7000121.1
85E50.3Low46.6Very low175 Ų175141.4 Ų141.482%0.81875%0.748SS**  101.1154.980-105.4-86.5122.200112.3
86P47.2Very low46.5Very low88 Ų88140 Ų14057%0.57175%0.748SS**  -131.9160-87.346.4-32.3000115.3
87N38.4Very low46.4Very low122 Ų122138.5 Ų138.565%0.65275%0.748SS**  40.5125.4128.4-1560.5000121.2
88R41.5Very low46.1Very low249 Ų249144.7 Ų144.794%0.9476%0.759SS**  trans-160.5115135.1-105.2163.5-162.2-143.74.7112.7
89N36.8Very low45.7Very low135 Ų135144.5 Ų144.572%0.72276%0.758SS**  trans-76.7151.8171-62.2-32.7000113
90S41.2Very low45.4Very low110 Ų110145.8 Ų145.877%0.76976%0.764SS**  trans171.4114.4140.636.90000109
91H38.1Very low44.6Very low176 Ų176146 Ų14682%0.81577%0.765SS**  77.6137.679.2-89.4-69.3000115.4
92L39.7Very low44.1Very low153 Ų153150.6 Ų150.680%0.80177%0.771SS**  trans87.6139.4166-52.2163.9000114.3
93T39.7Very low43.2Very low128 Ų128153.9 Ų153.979%0.78578%0.783SS**  cis-170.9162.39.550000109.7
94S38Very low42.9Very low93 Ų93150.7 Ų150.765%0.6578%0.784SS**  trans-70.4151.2-179.352.70000117.8
95L45.2Very low42.8Very low163 Ų163150.3 Ų150.385%0.85379%0.786SS**  150.1146.6119.2-80.6169.7000114.4
96P43.5Very low42.2Very low115 Ų115147.3 Ų147.375%0.74779%0.785SS**  trans-108.6172.9-177.240.7-31.2000114.8
97C45.7Very low42Very low116 Ų116148.8 Ų148.878%0.78480%0.797SS**  trans-140.9130.4178.9-850000114.7
98Y43.5Very low41.9Very low226 Ų226148 Ų14889%0.88680%0.802SS**  trans73.6127.7140.8-80.2-89000125
99N39.5Very low41.9Very low139 Ų139146.4 Ų146.474%0.74380%0.802SS**  trans-79.3165172.5-71.6-40000113.1
100D52.4Low41.8Very low169 Ų169144.7 Ų144.790%0.90480%0.8SS**  -164.4135.8123.2-103.9-23.8000113.9
101N40Very low41.7Very low139 Ų139147.7 Ų147.774%0.74381%0.806SS**  trans-88.2152.9179.3-68.7-34.2000111.7
102R48.5Very low41.6Very low252 Ų252148 Ų14895%0.95181%0.805SS**  trans-158.6130136-76.5-147.9176.4169.6-0.1113.1
103D38.3Very low41.4Very low149 Ų149147.4 Ų147.480%0.79780%0.803SS**  trans-77.5151.8178.1-55.8-69.9000114.1
104T46Very low41.1Very low134 Ų134145.6 Ų145.682%0.82280%0.795SS**  trans-160103141.823.70000112.4
105V44.9Very low41Very low125 Ų125148 Ų14876%0.75880%0.796SS**  trans37.6120.5137-97.50000123.7
106S38.9Very low40.8Very low112 Ų112148.5 Ų148.578%0.78379%0.791SS**  71.4109.9126.2-61.60000122.2
107S41.3Very low40.2Very low120 Ų120150.1 Ų150.184%0.83979%0.794SS**  -170.8124.7102.973.60000111.8
108S36.7Very low39.8Very low106 Ų106153.3 Ų153.374%0.74179%0.794SS**  trans-66147.3-179.7-24.70000113.6
109F41.4Very low39.6Very low215 Ų215150.6 Ų150.694%0.94379%0.787SS**  -165.4124.9120.8-89.1-66.3000110.1
110S35.6Very low39.4Very low98 Ų98151.2 Ų151.269%0.68579%0.791SS**  trans-77.8146.8-17750.60000113.8
111I39.6Very low38.7Very low174 Ų174154.2 Ų154.289%0.89279%0.791SS**  -148.5131.1123.4-61.6-165.3000108.4
112F34.4Very low38.8Very low182 Ų182156.8 Ų156.880%0.79880%0.798SS**  trans-101172-172-118.3-95.6000112.2
113N37.3Very low38.5Very low140 Ų140153.2 Ų153.275%0.74979%0.792SS**  trans105.796.5165.3-61.8-17.2000113.6
114S32.5Very low39Very low90 Ų90150.9 Ų150.963%0.62979%0.788SS**  54.8113.558.4-168.50000113.5
115H36.9Very low39.4Very low143 Ų143152 Ų15266%0.66279%0.789SS**  -178.6115.5120.5-97.9-71.9000113.4
116K40.7Very low40Very low174 Ų174151.6 Ų151.676%0.75779%0.787SS**  trans59.3119.2130-65.9-179.6-176.3173.90122.1
117N30.8Very low41.6Very low149 Ų149150.7 Ų150.780%0.79778%0.778SS**  trans-40.8150.5156.2-60.3-62.5000116
118F36.4Very low42.4Very low183 Ų183151.2 Ų151.280%0.80378%0.776SS**  trans-167.2127133.3-94.2-67000113.2
119K38.9Very low43.8Very low170 Ų170155.7 Ų155.774%0.73978%0.778SS**  trans63.5115.3140.5-78.4167.7179.4-179.20122.9
120N35.1Very low44.6Very low152 Ų152156.4 Ų156.481%0.81378%0.776SS**  30.6118123-73-25000119.3
121Y39Very low45.3Very low232 Ų232158.2 Ų158.291%0.9178%0.783SS**  trans-130.9126.7141-82.8-83.3000109.3
122Q42.3Very low45.7Very low192 Ų192152.6 Ų152.690%0.89777%0.768SS**  trans-66.8134.5166.6-84.9-160.7-1.300109.5
123E42.3Very low46.2Very low177 Ų177149.7 Ų149.783%0.82777%0.77SS**  trans-95.8109.2171.5-164.7160.1-159.800108.5N125E123-N125 PolarHBondContact O-N 3.02Å
124S49Very low46.6Very low100 Ų100152.9 Ų152.970%0.69978%0.777SS**  trans-80.6108.9174.654.40000109.8V126S124-V126 PolarHBondContact O-N 3.11Å
125N52.8Low47.2Very low157 Ų157153.3 Ų153.384%0.8478%0.78SS**  trans-71.2114.4170.2-78.6-47.2000110.4E123E123-N125 PolarHBondContact O-N 3.02Å
126V58.1Low47.2Very low118 Ų118154 Ų15472%0.71579%0.789SS**PPolyproline II helixtrans-96.3122170.4178.30000108.7S124 V128S124-V126 PolarHBondContact O-N 3.11Å; V126-V128 PolarHBondContact O-N 3.27Å
127P72.1Confident47.3Very low92 Ų92152.1 Ų152.160%0.59779%0.786SS**PPolyproline II helixtrans-72.8123.717527.4-31.1000110.9Y129P127-Y129 HydrophobicContact CB-CE2 4.18Å; P127-Y129 HydrophobicContact CG-CE2 4.29Å
128V58.6Low47.8Very low131 Ų131155.3 Ų155.379%0.79479%0.788SS**PPolyproline II helixtrans-92.6117171.6178.40000108.7V126V126-V128 PolarHBondContact O-N 3.27Å
129Y66.2Low47.9Very low200 Ų200152.6 Ų152.678%0.78479%0.786SS**PPolyproline II helixtrans-91.7127.1172.3-70.1-88.3000110.5P127P127-Y129 HydrophobicContact CB-CE2 4.18Å; P127-Y129 HydrophobicContact CG-CE2 4.29Å
130Y57.7Low48Very low230 Ų230150 Ų15090%0.90279%0.79SS**PPolyproline II helixtrans-80.4117.5171.2-124.3-94.9000109.2
131V51.1Low48.3Very low137 Ų137150.5 Ų150.583%0.8379%0.792SS**  trans-104108.8168-178.90000107.2
132G48.1Very low48.7Very low56 Ų56144.5 Ų144.558%0.57778%0.781SS**  trans-173.775.4-178.400000113.9
133S44.4Very low48.3Very low121 Ų121143.3 Ų143.385%0.84678%0.781SS**  trans-146.787.5155.9-74.20000108.2S135S133-S135 PolarHBondContact O-N 3.25Å
134F46.4Very low48.3Very low207 Ų207140.3 Ų140.391%0.90878%0.779SS**  trans-82.8112.1163.5-70.5-73.8000108
135S43.7Very low47.8Very low98 Ų98143.8 Ų143.869%0.68578%0.784SS**  trans-64.3128.5171.934.10000110.5S133 I137S133-S135 PolarHBondContact O-N 3.25Å; S135-I137 PolarHBondContact O-N 2.88Å; S135-I137 VanDerWaalsContact O-N 3.14Å
136N36.6Very low47.3Very low158 Ų158144.5 Ų144.585%0.84579%0.786SS**  trans-66.4102.8162.9-105.9-18.8000108.3
137I42.8Very low46.7Very low134 Ų134147.2 Ų147.269%0.68779%0.789SS**  trans-96.2100.3165-60.7-176.7000107.1S135 T139S135-I137 PolarHBondContact O-N 2.88Å; S135-I137 VanDerWaalsContact O-N 3.14Å; I137-T139 HydrophobicContact CG2-CG2 4.38Å; I137-T139 PolarHBondContact O-N 2.87Å
138Y41.7Very low44.9Very low217 Ų217147.4 Ų147.485%0.85179%0.792SS**  trans-69.3109.4158.3-101.5-92.2000107.4S140Y138-S140 PolarHBondContact O-N 3.32Å
139T39.2Very low44.1Very low125 Ų125149.5 Ų149.577%0.76780%0.797SS**  trans-72.1107.8168.949.80000109I137I137-T139 HydrophobicContact CG2-CG2 4.38Å; I137-T139 PolarHBondContact O-N 2.87Å
140S40Very low43Very low116 Ų116147.9 Ų147.981%0.81179%0.794SS**PPolyproline II helixtrans-74.4124.3163.751.80000109.5Y138Y138-S140 PolarHBondContact O-N 3.32Å
141L43Very low42.3Very low163 Ų163143.7 Ų143.785%0.85379%0.787SS**PPolyproline II helixtrans-70144.6175-157.569.3000110.3
142P45.7Very low41.9Very low105 Ų105143.9 Ų143.968%0.68278%0.782SS**PPolyproline II helixtrans-82.7134.9-179.132.1-31.8000111.6
143D35.1Very low41.3Very low168 Ų168147.6 Ų147.690%0.89879%0.794SS**PPolyproline II helixtrans-63.3135.2166.3-75.1-40.1000110.2
144S42.3Very low41.1Very low113 Ų113145 Ų14579%0.7979%0.786SS**  trans-140.8131.8166.6-70.40000110.3
145E38.6Very low40.9Very low173 Ų173141.6 Ų141.681%0.80878%0.777SS**  trans-51.6137.9-170-58.3172.114000115.1
146I42.2Very low40.8Very low172 Ų172142.7 Ų142.788%0.88278%0.775SS**  trans-126.2123.1150.8-62.2-178.9000109.2
147K44.4Very low41.1Very low176 Ų176143.1 Ų143.177%0.76578%0.778SS**  trans-74.7132.9-172.7-68.1167178.3174.80112.1
148S34.9Very low40.9Very low96 Ų96144.2 Ų144.267%0.67179%0.785SS**  trans38.2110.8130.1177.10000119.3
149I42.1Very low41.2Very low175 Ų175143.3 Ų143.390%0.89779%0.788SS**  trans-138119.8133.7-60.6-174.6000109.1
150K43.4Very low41Very low166 Ų166146.7 Ų146.772%0.72279%0.793SS**  trans-78.5170.8175.6-72.5174.6169.2174.60112
151N43.4Very low41.1Very low141 Ų141148.4 Ų148.475%0.75479%0.792SS**  trans106.1131.4150.4-61.7-20.3000114.1
152I41.8Very low41.2Very low141 Ų141147 Ų14772%0.72378%0.784SS**  cis-167.1121.613.4-91.6150.6000104.7
153T35.7Very low40.8Very low135 Ų135149 Ų14983%0.82879%0.786SS**  61.4126.9106.2-46.80000119.2
154G39.5Very low41.1Very low65 Ų65150.5 Ų150.567%0.6778%0.784SS**  trans103.5141.2143.800000115.3
155D42.7Very low40.9Very low136 Ų136149.6 Ų149.673%0.72778%0.778SS**  cis-168.3136.1-11.1-117-16000105.6
156N41.6Very low41.3Very low121 Ų121148.9 Ų148.965%0.64778%0.779SS**  trans27.6129.1138.4-32.6-36.1000119
157N44Very low41Very low167 Ų167150 Ų15089%0.89378%0.778SS**  -169.1127.4124-90.2-33.6000113.7
158N37.1Very low41Very low158 Ų158147.7 Ų147.785%0.84578%0.779SS**  trans-76.4130.9177.2-62.4-48.6000111.5
159Q47.6Very low41.1Very low197 Ų197151.7 Ų151.792%0.92179%0.787SS**  trans-141109.3150.6-68.4-162.432.800112.6
160K37Very low41.1Very low197 Ų197154 Ų15486%0.85779%0.786SS**  trans-59.7122.1166.1165.1-168.8-178-175.90112
161L41.5Very low41.2Very low151 Ų151150.4 Ų150.479%0.79178%0.781SS**  trans-149.5108.8152.3-74.9-178.7000114.5
162I43.6Very low40.9Very low134 Ų134150.8 Ų150.869%0.68778%0.783SS**  68.497.4124.3-55.9177.8000120.1
163M37.5Very low41.2Very low147 Ų147153.8 Ų153.872%0.72479%0.787SS**  trans-1.6123.1130.5-82.8-69.8-57.600118.7
164K43Very low41.4Very low200 Ų200158.4 Ų158.487%0.8779%0.789SS**  trans-142.7106.9145.5-75.9-173.4175.4171.50110.7
165S37.8Very low41.6Very low93 Ų93166.5 Ų166.565%0.6580%0.801SS**PPolyproline II helixtrans-89.8125.8169.745.80000109.8
166N46.8Very low41.4Very low158 Ų158171.4 Ų171.485%0.84581%0.81SS**PPolyproline II helixtrans-100.3118.7171.8-71.3-17.2000109.6
167K35.9Very low41.5Very low197 Ų197169.3 Ų169.386%0.85782%0.817SS**PPolyproline II helixtrans-95.5116.7-175.4-178.1177.8-176.2175.70109.1
168T44.9Very low41.9Very low126 Ų126170.6 Ų170.677%0.77381%0.814SS**  trans-141.893.7164.835.40000107.2
169Q36.8Very low42Very low180 Ų180170.9 Ų170.984%0.84182%0.816SS**  48.387.7101.6-77.7-129.413.800113.1
170Y41.9Very low42.2Very low225 Ų225171.3 Ų171.388%0.88282%0.815SS**  trans-139.2127.7150.1-99.1-82.7000109.9
171S44.6Very low42.8Very low89 Ų89173.9 Ų173.962%0.62282%0.819SS**  trans-75.1139.2-169.242.40000112.6Y173S171-Y173 PolarHBondContact O-N 3.05Å
172N38.7Very low42.7Very low149 Ų149170.1 Ų170.180%0.79782%0.816SS**  trans-73.4117.1172.3-74.8-64.5000110.8
173Y46.2Very low43.2Very low204 Ų204173.4 Ų173.480%0.883%0.826SS**  trans-104.297.5158.1-73.5-76.6000109.3S171S171-Y173 PolarHBondContact O-N 3.05Å
174R41.6Very low43.2Very low233 Ų233178.4 Ų178.488%0.87984%0.837SS**  trans-84.3111.5164.2-76-174-166.8174.34.5108.7
175Y42.6Very low43.5Very low234 Ų234176.9 Ų176.992%0.91884%0.837SS**  trans-87.8126.7159.6-104.9-89.7000110.3
176R38.5Very low44Very low240 Ų240182 Ų18291%0.90685%0.847SS**  trans-100.6109-170.4-174.7-178.6-173-123.84.7108.2
177G43.4Very low43.5Very low77 Ų77183.4 Ų183.479%0.79485%0.849SS**  trans-121.477.5-174.900000114.2
178K53Low43.8Very low194 Ų194178.8 Ų178.884%0.84384%0.842SS**  trans21.9114.9154.9-56.7-167.2178.9179.80120.7
179N38.4Very low43.5Very low163 Ų163178.8 Ų178.887%0.87284%0.841SS**  trans-64.3135.9156.8-54-17.6000110.9
180K53.8Low44.1Very low207 Ų207179 Ų17990%0.984%0.84SS**  trans-126.7124.2155.8-81.7-169.5177.2-1790110.1
181R48.6Very low44.1Very low250 Ų250174.8 Ų174.894%0.94383%0.832SS**  trans-60.6158-177-80.9171.9163.2175.7-6.5112.5
182G40.5Very low43.9Very low72 Ų72178.1 Ų178.174%0.74284%0.844SS**  trans-67.7169.4-173.300000116.4
183K52.5Low43.9Very low203 Ų203174.8 Ų174.888%0.88384%0.844SS**  trans-139.3109.9148.1-73.3-163176.7-1760108.3
184R39Very low43.8Very low253 Ų253172.9 Ų172.996%0.95584%0.84SS**  trans-68.4125.8155.9-112.9172.6158.9178.6-6.6106.2
185L48.1Very low43.5Very low168 Ų168169 Ų16988%0.8884%0.835SS**  trans-130.7140.1161.3-143.183.6000109.2
186K48Very low43.5Very low199 Ų199166.2 Ų166.287%0.86583%0.825SS**  trans-65.2151.2-161.6-71.8170.7164.7-179.70114.9
187E37.1Very low43.7Very low189 Ų189161.9 Ų161.988%0.88382%0.815SS**  trans-43.9138.3153.5-83.8149.2133.400113.2
188S42.7Very low43.8Very low100 Ų100165.5 Ų165.570%0.69982%0.816SS**  trans-142.5109.7145.2178.40000107.4
189T38.5Very low43.6Very low125 Ų125162.5 Ų162.577%0.76781%0.809SS**  trans-56.9126.3165.235.90000110.3
190K48Very low43.7Very low184 Ų184162.4 Ų162.480%0.881%0.808SS**  trans-135.887.3157.8-74.3-170.4-178.9176.90109.9
191N42Very low43.1Very low137 Ų137158.7 Ų158.773%0.73380%0.803SS**  trans-24.9125.8139.543.2-22.4000113.5
192N41.9Very low43.1Very low160 Ų160151.7 Ų151.786%0.85679%0.792SS**  trans-161.5100.6144.8-92.3-24.4000108.2
193G36.6Very low43.2Very low78 Ų78155 Ų15580%0.80479%0.793SS**  trans-66.6131.4165.400000109.6
194K44.4Very low43.1Very low164 Ų164151.7 Ų151.771%0.71379%0.79SS**  trans-129.3100.1156.5-88.5-168.6174.8-1750108.5Y196K194-Y196 HydrophobicContact CB-CD2 4.27Å; K194-Y196 HydrophobicContact CB-CE2 3.98Å; K194-Y196 HydrophobicContact CD-CE2 3.99Å; K194-Y196 PolarHBondContact O-N 3.08Å
195L36.8Very low43.7Very low151 Ų151145.6 Ų145.679%0.79178%0.781SS**  trans-49.5117.5155.1-167.589000108.9
196Y42.3Very low43.6Very low177 Ų177144.7 Ų144.769%0.69478%0.777SS**  trans-126.8100.9157.4-78.2-78.3000107K194K194-Y196 HydrophobicContact CB-CD2 4.27Å; K194-Y196 HydrophobicContact CB-CE2 3.98Å; K194-Y196 HydrophobicContact CD-CE2 3.99Å; K194-Y196 PolarHBondContact O-N 3.08Å
197H42.2Very low43.9Very low149 Ų149140.8 Ų140.869%0.6978%0.775SS**  trans-60.3126.3151.3-89.7-84.3000107.2
198N45.4Very low44.9Very low153 Ų153134.5 Ų134.582%0.81875%0.752SS**  trans-132.1128156.1-93.9-16.5000108.4
199N49.1Very low45.6Very low130 Ų130135.5 Ų135.570%0.69575%0.75SS**  trans-71.6154-164.7-61.4-44.5000111.8T201N199-T201 PolarHBondContact O-N 3.45Å; N199-T201 VanDerWaalsContact O-N 3.14Å
200N39.3Very low46.3Very low162 Ų162137.2 Ų137.287%0.86675%0.749SS**  trans-32.2111.2156.7-59.2-34.8000111.8
201T42.4Very low46.7Very low128 Ų128135.4 Ų135.479%0.78574%0.743SS**  trans-108.796.3153.916.60000106.3N199 D203N199-T201 PolarHBondContact O-N 3.45Å; N199-T201 VanDerWaalsContact O-N 3.14Å; T201-D203 PolarHBondContact O-N 2.94Å
202S47.5Very low47.5Very low103 Ų103136.3 Ų136.372%0.7274%0.741SS**  trans-61.8101.5157.745.80000108.3
203D43Very low48.7Very low142 Ų142135.4 Ų135.476%0.75973%0.731SS**  trans-98.498.3161-102.6-19.4000107.8T201 T205T201-D203 PolarHBondContact O-N 2.94Å; D203-T205 PolarHBondContact O-N 3.49Å
204T50.8Low50.5Low134 Ų134135.2 Ų135.282%0.82272%0.717SS**  trans-69.2104.2161.349.20000107.6
205T52Low52.5Low124 Ų124130.2 Ų130.276%0.76170%0.703SS**  trans-106.3114.516355.80000108.9D203D203-T205 PolarHBondContact O-N 3.49Å
206D45.3Very low55Low149 Ų149127 Ų12780%0.79769%0.693SS**  trans-19.1120.2168.2-100-39000115.4
207S54.8Low57.3Low117 Ų117127.5 Ų127.582%0.81869%0.694SS**  trans-10028.2175.682.10000113
208S57Low59.7Low58 Ų58123.4 Ų123.441%0.40668%0.682SS.*  trans-86.8-20.6-170.856.70000115.4
209D57.4Low62.1Low121 Ų121120.9 Ų120.965%0.64767%0.668SS**SBendtrans-93.7-20.4-165.9-71.3-5.7000115H211D209-H211 VanDerWaalsContact C-N 3.3Å; D209-H211 PolarHBondContact O-N 2.96Å
210E54.9Low64.3Low160 Ų160120.9 Ų120.975%0.74866%0.659SS**Hα-helixtrans-74.5-17.3179.3-76-66.7137.400113.4
211H55.9Low67Low147 Ų147116.9 Ų116.968%0.68164%0.636SS**Hα-helixtrans-75.5-27.6-176.6-149-81.8000113.1D209 S215D209-H211 VanDerWaalsContact C-N 3.3Å; D209-H211 PolarHBondContact O-N 2.96Å; H211-S215 PolarHBondContact O-N 3.33Å
212F58.7Low69.6Low156 Ų156113.7 Ų113.768%0.68462%0.619SS**Hα-helixtrans-70.7-37.7-178.2-75.5-76.7000112.8S216F212-S216 PolarHBondContact O-N 3.4Å
213H66.6Low71.9Confident141 Ų141114 Ų11465%0.65361%0.609SS**Hα-helixtrans-73.7-33.1177.7-70.9-52.7000112.8S216 R217H213-S216 PolarHBondContact O-N 2.95Å; H213-R217 WeakPolarHBondContact O-CB 3.27Å; H213-R217 PolarHBondContact O-N 2.93Å
214S75.6Confident74.6Confident74 Ų74110.4 Ų110.452%0.51759%0.59SS.*Hα-helixtrans-63-45.8175.7-174.20000111.8S216 R217 S218S214-S216 PolarHBondContact O-N 2.89Å; S214-R217 PolarHBondContact O-N 3.38Å; S214-S218 WeakPolarHBondContact O-CB 3.42Å; S214-S218 PolarHBondContact O-N 3.04Å
215S84.9Confident76.8Confident59 Ų59109.2 Ų109.241%0.41358%0.575SS.*Hα-helixtrans-60.8-45.6176.5179.90000111.8H211 R217 S218 N219H211-S215 PolarHBondContact O-N 3.33Å; S215-R217 VanDerWaalsContact C-N 3.29Å; S215-R217 PolarHBondContact O-N 3.18Å; S215-S218 PolarHBondContact O-N 2.94Å; S215-N219 WeakPolarHBondContact O-CB 3.35Å; S215-N219 VanDerWaalsContact O-CG 3.27Å; S215-N219 PolarHBondContact O-N 3.36Å; S215-N219 PolarHBondContact O-ND2 2.98Å
216S89.1Confident79Confident82 Ų82106.4 Ų106.457%0.57356%0.564SS**Hα-helixtrans-64.8-34179-151.50000112.6F212 H213 S214 R220F212-S216 PolarHBondContact O-N 3.4Å; H213-S216 PolarHBondContact O-N 2.95Å; S214-S216 PolarHBondContact O-N 2.89Å; S216-R220 PolarHBondContact O-N 2.92Å
217R90.8Very high81.5Confident189 Ų189103.6 Ų103.671%0.71355%0.546SS*.Hα-helixtrans-71.7-42.7174.1-173.6178.9-178.8134.9-0.8111.9H213 S214 S215 R220 I221H213-R217 WeakPolarHBondContact O-CB 3.27Å; H213-R217 PolarHBondContact O-N 2.93Å; S214-R217 PolarHBondContact O-N 3.38Å; S215-R217 VanDerWaalsContact C-N 3.29Å; S215-R217 PolarHBondContact O-N 3.18Å; R217-R220 PolarHBondContact O-N 2.9Å; R217-I221 HydrophobicContact CG-CD1 4.15Å; R217-I221 VanDerWaalsContact O-CG1 3.32Å; R217-I221 WeakPolarHBondContact O-CG1 3.38Å; R217-I221 PolarHBondContact O-N 3.1Å
218S92.8Very high83.5Confident63 Ų63102.1 Ų102.144%0.44153%0.528SS..Hα-helixtrans-61-47.9176.4177.60000111.1S214 S215 R220 I221 S222S214-S218 WeakPolarHBondContact O-CB 3.42Å; S214-S218 PolarHBondContact O-N 3.04Å; S215-S218 PolarHBondContact O-N 2.94Å; S218-R220 VanDerWaalsContact C-N 3.27Å; S218-R220 PolarHBondContact O-N 3.09Å; S218-I221 WeakPolarHBondContact O-CA 3.44Å; S218-I221 WeakPolarHBondContact O-CB 3.41Å; S218-I221 PolarHBondContact O-N 2.77Å; S218-S222 PolarHBondContact O-N 3.38Å; S218-S222 PolarHBondContact O-OG 3.03Å
219N95.5Very high85.5Confident100 Ų100102.7 Ų102.754%0.53553%0.532SS..Hα-helixtrans-57-40.4174.9-71.9-29.3000112.3S215 S222 Q223S215-N219 WeakPolarHBondContact O-CB 3.35Å; S215-N219 VanDerWaalsContact O-CG 3.27Å; S215-N219 PolarHBondContact O-N 3.36Å; S215-N219 PolarHBondContact O-ND2 2.98Å; N219-S222 PolarHBondContact O-N 2.97Å; N219-Q223 WeakPolarHBondContact O-CB 3.38Å; N219-Q223 PolarHBondContact O-N 3.22Å
220R96.5Very high87.4Confident130 Ų130103 Ų10349%0.49152%0.524SS..Hα-helixtrans-67.1-37.8176.5-175.358.1176170.14112S216 R217 S218 L224S216-R220 PolarHBondContact O-N 2.92Å; R217-R220 PolarHBondContact O-N 2.9Å; S218-R220 VanDerWaalsContact C-N 3.27Å; S218-R220 PolarHBondContact O-N 3.09Å; R220-L224 HydrophobicContact CG-CD1 4.31Å; R220-L224 VanDerWaalsContact O-CG 3.24Å; R220-L224 WeakPolarHBondContact O-CG 3.31Å; R220-L224 PolarHBondContact O-N 3.32Å; R220-L224 VanDerWaalsContact O-N 3.11Å
221I95.5Very high89.5Confident78 Ų7898.9 Ų98.940%0.451%0.507SS..Hα-helixtrans-63.9-50.5175.1-68.2162.2000109.8R217 S218 Q223 L224 E225R217-I221 HydrophobicContact CG-CD1 4.15Å; R217-I221 VanDerWaalsContact O-CG1 3.32Å; R217-I221 WeakPolarHBondContact O-CG1 3.38Å; R217-I221 PolarHBondContact O-N 3.1Å; S218-I221 WeakPolarHBondContact O-CA 3.44Å; S218-I221 WeakPolarHBondContact O-CB 3.41Å; S218-I221 PolarHBondContact O-N 2.77Å; I221-Q223 VanDerWaalsContact C-N 3.3Å; I221-Q223 PolarHBondContact O-N 3.04Å; I221-L224 PolarHBondContact O-N 3.14Å; I221-E225 HydrophobicContact CG2-CG 4.31Å; I221-E225 WeakPolarHBondContact CG2-OE1 3.43Å; I221-E225 WeakPolarHBondContact O-CG 3.36Å; I221-E225 PolarHBondContact O-N 3.12Å
222S96.5Very high91.5Very high60 Ų60100.4 Ų100.442%0.4251%0.506SS..Hα-helixtrans-60.1-38.3178.5-54.90000112.8S218 N219 E225 A226S218-S222 PolarHBondContact O-N 3.38Å; S218-S222 PolarHBondContact O-OG 3.03Å; N219-S222 PolarHBondContact O-N 2.97Å; S222-E225 PolarHBondContact O-N 3.03Å; S222-A226 PolarHBondContact O-N 3.04Å
223Q97.7Very high93.4Very high109 Ų10996.7 Ų96.751%0.50950%0.5SS..Hα-helixtrans-61.9-43.3173.8-174.7-175.21700112N219 I221 A226 E227N219-Q223 WeakPolarHBondContact O-CB 3.38Å; N219-Q223 PolarHBondContact O-N 3.22Å; I221-Q223 VanDerWaalsContact C-N 3.3Å; I221-Q223 PolarHBondContact O-N 3.04Å; Q223-A226 PolarHBondContact O-N 3.07Å; Q223-E227 PolarHBondContact O-N 3.2Å; Q223-E227 VanDerWaalsContact O-N 3.08Å
224L98.4Very high94.9Very high68 Ų6894 Ų9436%0.35649%0.487SS..Hα-helixtrans-69.4-37178.6-69.9170.7000111.7R220 I221 A226 E227 I228R220-L224 HydrophobicContact CG-CD1 4.31Å; R220-L224 VanDerWaalsContact O-CG 3.24Å; R220-L224 WeakPolarHBondContact O-CG 3.31Å; R220-L224 PolarHBondContact O-N 3.32Å; R220-L224 VanDerWaalsContact O-N 3.11Å; I221-L224 PolarHBondContact O-N 3.14Å; L224-A226 VanDerWaalsContact C-N 3.35Å; L224-E227 PolarHBondContact O-N 3.02Å; L224-I228 WeakPolarHBondContact O-CB 3.45Å; L224-I228 VanDerWaalsContact O-CG1 3.27Å; L224-I228 WeakPolarHBondContact O-CG1 3.5Å; L224-I228 PolarHBondContact O-N 3.42Å
225E97.2Very high95.9Very high109 Ų10995.3 Ų95.351%0.50949%0.488SS..Hα-helixtrans-62.6-41.1174.3-72.1171.5170.200111.8I221 S222 S229I221-E225 HydrophobicContact CG2-CG 4.31Å; I221-E225 WeakPolarHBondContact CG2-OE1 3.43Å; I221-E225 WeakPolarHBondContact O-CG 3.36Å; I221-E225 PolarHBondContact O-N 3.12Å; S222-E225 PolarHBondContact O-N 3.03Å; E225-S229 WeakPolarHBondContact O-CB 3.48Å; E225-S229 PolarHBondContact O-N 3.11Å; E225-S229 PolarHBondContact O-OG 3.01Å
226A97.4Very high96.5Very high64 Ų6494.9 Ų94.953%0.52949%0.488SS..Hα-helixtrans-64.1-42.3174.200000112.1S222 Q223 L224 S229 R230S222-A226 PolarHBondContact O-N 3.04Å; Q223-A226 PolarHBondContact O-N 3.07Å; L224-A226 VanDerWaalsContact C-N 3.35Å; A226-S229 PolarHBondContact O-N 2.72Å; A226-R230 WeakPolarHBondContact O-CB 3.48Å; A226-R230 PolarHBondContact O-N 3.5Å
227E97.8Very high96.8Very high91 Ų9197.6 Ų97.643%0.42549%0.491SS..Hα-helixtrans-67-42.9177.5-170.9177.8-173.200112.3Q223 L224 S229 R230 L231Q223-E227 PolarHBondContact O-N 3.2Å; Q223-E227 VanDerWaalsContact O-N 3.08Å; L224-E227 PolarHBondContact O-N 3.02Å; E227-S229 VanDerWaalsContact C-N 3.31Å; E227-S229 PolarHBondContact O-N 3.46Å; E227-R230 WeakPolarHBondContact O-CB 3.42Å; E227-R230 PolarHBondContact O-N 3.35Å; E227-L231 WeakPolarHBondContact O-CG 3.37Å; E227-L231 PolarHBondContact O-N 3.09Å
228I98.3Very high97.1Very high85 Ų8594.4 Ų94.444%0.43649%0.488SS..Hα-helixtrans-61.5-41.5174.7-72.1168.5000110.5L224 L231 R232L224-I228 WeakPolarHBondContact O-CB 3.45Å; L224-I228 VanDerWaalsContact O-CG1 3.27Å; L224-I228 WeakPolarHBondContact O-CG1 3.5Å; L224-I228 PolarHBondContact O-N 3.42Å; I228-L231 PolarHBondContact O-N 2.99Å; I228-R232 HydrophobicContact CG2-CG 4.4Å; I228-R232 WeakPolarHBondContact O-CB 3.49Å; I228-R232 VanDerWaalsContact O-CG 3.31Å; I228-R232 WeakPolarHBondContact O-CG 3.26Å; I228-R232 PolarHBondContact O-N 3.18Å
229S98Very high97.2Very high70 Ų7095.3 Ų95.349%0.4949%0.487SS..Hα-helixtrans-63.9-41.4176.8-59.80000111.6E225 A226 E227 R232 S233E225-S229 WeakPolarHBondContact O-CB 3.48Å; E225-S229 PolarHBondContact O-N 3.11Å; E225-S229 PolarHBondContact O-OG 3.01Å; A226-S229 PolarHBondContact O-N 2.72Å; E227-S229 VanDerWaalsContact C-N 3.31Å; E227-S229 PolarHBondContact O-N 3.46Å; S229-R232 PolarHBondContact O-N 3.06Å; S229-S233 PolarHBondContact O-N 2.86Å
230R98.1Very high97.1Very high129 Ų12994 Ų9449%0.48749%0.486SS..Hα-helixtrans-59.6-47173.3-167.2-171.976.772.64.7111.8A226 E227 S233 Q234A226-R230 WeakPolarHBondContact O-CB 3.48Å; A226-R230 PolarHBondContact O-N 3.5Å; E227-R230 WeakPolarHBondContact O-CB 3.42Å; E227-R230 PolarHBondContact O-N 3.35Å; R230-S233 PolarHBondContact O-N 3.38Å; R230-Q234 WeakPolarHBondContact O-CG 3.24Å; R230-Q234 PolarHBondContact O-N 3.27Å
231L98.6Very high96.8Very high72 Ų7290.9 Ų90.938%0.37749%0.488SS..Hα-helixtrans-65.9-40.1178.8-69.8174.6000112.2E227 I228 S233 Q234 I235E227-L231 WeakPolarHBondContact O-CG 3.37Å; E227-L231 PolarHBondContact O-N 3.09Å; I228-L231 PolarHBondContact O-N 2.99Å; L231-S233 VanDerWaalsContact C-N 3.34Å; L231-S233 PolarHBondContact O-N 2.87Å; L231-Q234 PolarHBondContact O-N 3.44Å; L231-I235 WeakPolarHBondContact O-CG1 3.3Å; L231-I235 PolarHBondContact O-N 3.45Å
232R98.1Very high96.6Very high180 Ų18092.5 Ų92.568%0.67949%0.493SS*.Hα-helixtrans-60.9-42.6174.6-76.7176.8174.4-177.2-1.4111.7I228 S229 I235 A236I228-R232 HydrophobicContact CG2-CG 4.4Å; I228-R232 WeakPolarHBondContact O-CB 3.49Å; I228-R232 VanDerWaalsContact O-CG 3.31Å; I228-R232 WeakPolarHBondContact O-CG 3.26Å; I228-R232 PolarHBondContact O-N 3.18Å; S229-R232 PolarHBondContact O-N 3.06Å; R232-I235 PolarHBondContact O-N 2.95Å; R232-A236 WeakPolarHBondContact O-CB 3.46Å; R232-A236 PolarHBondContact O-N 3.04Å
233S97.6Very high95.9Very high78 Ų7896.7 Ų96.755%0.54551%0.506SS..Hα-helixtrans-62.6-41.6174.8176.90000112.2S229 R230 L231 A236 Q237S229-S233 PolarHBondContact O-N 2.86Å; R230-S233 PolarHBondContact O-N 3.38Å; L231-S233 VanDerWaalsContact C-N 3.34Å; L231-S233 PolarHBondContact O-N 2.87Å; S233-A236 PolarHBondContact O-N 3.4Å; S233-Q237 WeakPolarHBondContact O-CB 3.22Å; S233-Q237 PolarHBondContact O-N 3.21Å
234Q98.1Very high94.7Very high83 Ų8398.3 Ų98.339%0.38852%0.518SS..Hα-helixtrans-64.2-41.5175.9-71.6-173-52.600112.8R230 L231 Q237 L238R230-Q234 WeakPolarHBondContact O-CG 3.24Å; R230-Q234 PolarHBondContact O-N 3.27Å; L231-Q234 PolarHBondContact O-N 3.44Å; Q234-Q237 PolarHBondContact O-N 3.46Å; Q234-L238 PolarHBondContact O-N 3.27Å
235I97.4Very high92.9Very high102 Ų10297.7 Ų97.752%0.52353%0.528SS..Hα-helixtrans-64.9-45176.2-67.9166.5000110.2L231 R232 Q237 L238 I239L231-I235 WeakPolarHBondContact O-CG1 3.3Å; L231-I235 PolarHBondContact O-N 3.45Å; R232-I235 PolarHBondContact O-N 2.95Å; I235-Q237 VanDerWaalsContact C-N 3.3Å; I235-Q237 PolarHBondContact O-N 3.38Å; I235-L238 PolarHBondContact O-N 2.79Å; I235-I239 HydrophobicContact CG2-CD1 3.77Å; I235-I239 HydrophobicContact CG2-CG1 4.36Å; I235-I239 WeakPolarHBondContact O-CG1 3.32Å; I235-I239 PolarHBondContact O-N 3.16Å
236A97.2Very high90.8Very high50 Ų5099.5 Ų99.541%0.41354%0.536SS..Hα-helixtrans-58.4-43.1176.200000111.4R232 S233 L238 I239 S240R232-A236 WeakPolarHBondContact O-CB 3.46Å; R232-A236 PolarHBondContact O-N 3.04Å; S233-A236 PolarHBondContact O-N 3.4Å; A236-L238 PolarHBondContact O-N 3.28Å; A236-I239 PolarHBondContact O-N 3.07Å; A236-S240 WeakPolarHBondContact O-CB 3.28Å; A236-S240 PolarHBondContact O-N 2.93Å; A236-S240 PolarHBondContact O-OG 3.5Å; A236-S240 VanDerWaalsContact O-OG 3.09Å
237Q96.2Very high88.6Confident140 Ų140101.3 Ų101.365%0.65455%0.545SS*.Hα-helixtrans-62.2-40.4176-171.7177.515.100112.8S233 Q234 I235 A241S233-Q237 WeakPolarHBondContact O-CB 3.22Å; S233-Q237 PolarHBondContact O-N 3.21Å; Q234-Q237 PolarHBondContact O-N 3.46Å; I235-Q237 VanDerWaalsContact C-N 3.3Å; I235-Q237 PolarHBondContact O-N 3.38Å; Q237-A241 VanDerWaalsContact O-CB 3.27Å; Q237-A241 WeakPolarHBondContact O-CB 3.25Å; Q237-A241 PolarHBondContact O-N 3.43Å
238L96.2Very high86Confident121 Ų121101.7 Ų101.763%0.63456%0.558SS**Hα-helixtrans-65.5-42.7175.6-101.5150.3000112.2Q234 I235 A236 A241 Q242Q234-L238 PolarHBondContact O-N 3.27Å; I235-L238 PolarHBondContact O-N 2.79Å; A236-L238 PolarHBondContact O-N 3.28Å; L238-A241 PolarHBondContact O-N 2.86Å; L238-Q242 WeakPolarHBondContact O-CB 3.45Å; L238-Q242 PolarHBondContact O-N 3.34Å
239I95.8Very high83.4Confident83 Ų83103.8 Ų103.843%0.42657%0.574SS.*Hα-helixtrans-63.7-48.1176.5-67168.8000109.9I235 A236 A241 Q242 E243I235-I239 HydrophobicContact CG2-CD1 3.77Å; I235-I239 HydrophobicContact CG2-CG1 4.36Å; I235-I239 WeakPolarHBondContact O-CG1 3.32Å; I235-I239 PolarHBondContact O-N 3.16Å; A236-I239 PolarHBondContact O-N 3.07Å; I239-A241 VanDerWaalsContact C-N 3.3Å; I239-A241 PolarHBondContact O-N 3.28Å; I239-Q242 PolarHBondContact O-N 2.84Å; I239-Q242 VanDerWaalsContact O-N 3.1Å; I239-E243 HydrophobicContact CG2-CG 4.49Å; I239-E243 WeakPolarHBondContact O-CG 3.31Å; I239-E243 PolarHBondContact O-N 2.95Å
240S93.1Very high81.1Confident73 Ų73106 Ų10651%0.5159%0.589SS.*Hα-helixtrans-62.3-35.6176.8-60.10000112.8A236 L244A236-S240 WeakPolarHBondContact O-CB 3.28Å; A236-S240 PolarHBondContact O-N 2.93Å; A236-S240 PolarHBondContact O-OG 3.5Å; A236-S240 VanDerWaalsContact O-OG 3.09Å; S240-L244 PolarHBondContact O-N 2.79Å
241A90.8Very high78.4Confident64 Ų64107.8 Ų107.853%0.52961%0.608SS.*Hα-helixtrans-69.4-33.7174.600000112.5Q237 L238 I239 G245Q237-A241 VanDerWaalsContact O-CB 3.27Å; Q237-A241 WeakPolarHBondContact O-CB 3.25Å; Q237-A241 PolarHBondContact O-N 3.43Å; L238-A241 PolarHBondContact O-N 2.86Å; I239-A241 VanDerWaalsContact C-N 3.3Å; I239-A241 PolarHBondContact O-N 3.28Å; A241-G245 PolarHBondContact O-N 2.88Å; A241-G245 VanDerWaalsContact O-N 3.1Å
242Q90.3Very high76.2Confident112 Ų112112.2 Ų112.252%0.52363%0.631SS.*Hα-helixtrans-72.2-42.5175.9-171.3172.5-2.700111.5L238 I239 L244 G245 E246L238-Q242 WeakPolarHBondContact O-CB 3.45Å; L238-Q242 PolarHBondContact O-N 3.34Å; I239-Q242 PolarHBondContact O-N 2.84Å; I239-Q242 VanDerWaalsContact O-N 3.1Å; Q242-L244 VanDerWaalsContact C-N 3.26Å; Q242-L244 PolarHBondContact O-N 3.47Å; Q242-G245 PolarHBondContact O-N 3.45Å; Q242-G245 VanDerWaalsContact O-N 3.16Å; Q242-E246 HydrophobicContact CG-CG 4.15Å; Q242-E246 WeakPolarHBondContact CG-OE1 3.49Å; Q242-E246 PolarHBondContact NE2-OE1 3.45Å; Q242-E246 WeakPolarHBondContact O-CG 3.39Å; Q242-E246 PolarHBondContact O-N 3.44Å
243E81.5Confident73.6Confident148 Ų148107 Ų10769%0.69263%0.634SS**Hα-helixtrans-62.1-33.1176.2-72.4177.9178.900112.4I239I239-E243 HydrophobicContact CG2-CG 4.49Å; I239-E243 WeakPolarHBondContact O-CG 3.31Å; I239-E243 PolarHBondContact O-N 2.95Å
244L71.8Confident71.4Confident142 Ų142115.1 Ų115.174%0.74365%0.652SS**Hα-helixtrans-78.6-31.3175.6-164.663.7000112.7S240 Q242 S247S240-L244 PolarHBondContact O-N 2.79Å; Q242-L244 VanDerWaalsContact C-N 3.26Å; Q242-L244 PolarHBondContact O-N 3.47Å; L244-S247 PolarHBondContact O-OG 3.03Å
245G61Low68.9Low55 Ų55118.6 Ų118.657%0.56767%0.674SS**Hα-helixtrans-85.3-19.8-176.300000115.8A241 Q242 S247A241-G245 PolarHBondContact O-N 2.88Å; A241-G245 VanDerWaalsContact O-N 3.1Å; Q242-G245 PolarHBondContact O-N 3.45Å; Q242-G245 VanDerWaalsContact O-N 3.16Å; G245-S247 VanDerWaalsContact C-N 3.26Å; G245-S247 PolarHBondContact O-N 3.14Å
246E54.4Low66.7Low147 Ų147123.5 Ų123.569%0.68769%0.686SS**THydrogen-bonded Turntrans-85.311.3-179.7-71.2-170.2179.100114.2Q242Q242-E246 HydrophobicContact CG-CG 4.15Å; Q242-E246 WeakPolarHBondContact CG-OE1 3.49Å; Q242-E246 PolarHBondContact NE2-OE1 3.45Å; Q242-E246 WeakPolarHBondContact O-CG 3.39Å; Q242-E246 PolarHBondContact O-N 3.44Å
247S50.5Low64.6Low103 Ų103130.2 Ų130.272%0.7271%0.706SS**THydrogen-bonded Turntrans-91.96.9175.663.10000115.1L244 G245L244-S247 PolarHBondContact O-OG 3.03Å; G245-S247 VanDerWaalsContact C-N 3.26Å; G245-S247 PolarHBondContact O-N 3.14Å
248S42.7Very low62.4Low98 Ų98128.6 Ų128.669%0.68571%0.708SS**  trans-15477.8-176.7-163.90000114.6
249T45.2Very low60.1Low129 Ų129131.5 Ų131.579%0.79172%0.717SS**SBendtrans-156.6103.4149.353.20000111.3
250C48.9Very low57.9Low118 Ų118139 Ų13980%0.79774%0.74SS**  trans42.591.3145.961.30000119.5
251D40.4Very low56.1Low165 Ų165139.8 Ų139.888%0.88274%0.744SS**  trans-95100.8152.3-163.23.2000108.6
252L52.4Low54.2Low165 Ų165144 Ų14486%0.86476%0.757SS**  trans-138.4101.1173-94.8167.2000109.2
253G43.3Very low52.8Low71 Ų71142.8 Ų142.873%0.73277%0.767SS**  trans66.995.3133.100000118
254R53.2Low51.8Low248 Ų248143.1 Ų143.194%0.93677%0.773SS**  trans-122.786.3144.4-176.1158.1-94.8-178.5-6.2110
255D45.6Very low51.5Low157 Ų157139.7 Ų139.784%0.8477%0.772SS**  trans-43.9137.8156.8-84.9-39.1000111.6
256R50.9Low51.5Low205 Ų205146.2 Ų146.277%0.77479%0.788SS**  162.9106.1121.6-175.9178.2-63.2-133.3-2109.5
257F51.8Low51.7Low191 Ų191144 Ų14484%0.83879%0.788SS**  171.6118.9120.6-82.6-62.7000109.2
258P51.1Low51.7Low106 Ų106146 Ų14669%0.68879%0.791SS**  trans-100.1160.6-167.438.7-34.5000114.5
259H48.2Very low52.2Low181 Ų181147.8 Ų147.884%0.83880%0.798SS**  trans69.8113.4157.4-66.5-60.4000120
260R49.4Very low52.4Low240 Ų240145.3 Ų145.391%0.90679%0.791SS**  -152.5123.1117.5-151.9170.9179.9156.6-0.9111
261P54.9Low52.4Low91 Ų91147.6 Ų147.659%0.59179%0.793SS**  trans-83.9173.8170.136.2-29.5000109.9
262D50Low52.7Low151 Ų151144.2 Ų144.281%0.80779%0.788SS**  trans116.4136.1160.7-50.9-27.9000115.1
263A61.6Low52.7Low87 Ų87140.1 Ų140.172%0.71978%0.778SS**  trans94.386.8174.400000115.4
264D60.2Low53Low156 Ų156143.6 Ų143.683%0.83479%0.785SS**  86129.459.684.3-20.4000115.5
265G65.6Low52.7Low70 Ų70135.6 Ų135.672%0.72278%0.78SS**  trans87.2130.8165.500000116.5
266E60.9Low52.9Low192 Ų192133.6 Ų133.690%0.89778%0.779SS**  cis-170.1153.5-1.7-124.5168.4163.400107.1
267S58.4Low52.6Low99 Ų99130.1 Ų130.169%0.69278%0.782SS**  trans-51.6166.2176.6-220000113.4
268D51.7Low52Low145 Ų145126.3 Ų126.378%0.77578%0.779SS**  cis-176.2171.435.8-111.2-33.1000108.5
269T53Low51.4Low137 Ų137128.9 Ų128.984%0.8479%0.787SS**  trans95.7132.7168.370.80000116.8
270A48.6Very low51.4Low76 Ų76127.8 Ų127.863%0.62878%0.784SS**  cis-178.9130-28.300000105.9
271I49.6Very low51Low166 Ų166124.8 Ų124.885%0.85178%0.78SS**  trans81.2128.7138.3-55.8166.7000119.6
272A47Very low50.7Low95 Ų95127.6 Ų127.679%0.78579%0.785SS**  trans82.9137.6155.300000118.1
273A50.7Low50.2Low79 Ų79127 Ų12765%0.65378%0.782SS**  cis-172.8144.8-13.100000105.8
274T51.2Low49.5Very low143 Ų143131.6 Ų131.688%0.87779%0.788SS**  trans58.1113.614554.40000120.2
275G46.9Very low48.7Very low80 Ų80129.7 Ų129.783%0.82578%0.783SS**  trans172.783.6158.400000113.1
276S50Low47.8Very low116 Ų116134.9 Ų134.981%0.81179%0.785SS**  trans-62.6156.9178.3-720000113.5
277P43Very low47Very low131 Ų131134.4 Ų134.485%0.85178%0.78SS**  trans-80.1129.2174.533.3-29.7000109.6
278S40.9Very low46.2Very low111 Ų111136.2 Ų136.278%0.77678%0.782SS**  trans-121.4108.9169-1670000110.2
279L38.3Very low46Very low160 Ų160136.4 Ų136.484%0.83878%0.783SS**  trans-52.4125.6156.8-178.3141000109.1
280M48Very low45.5Very low158 Ų158137.1 Ų137.178%0.77878%0.782SS**  trans-141.3108.3168-153.8160.288.400108.1
281E39.8Very low45.3Very low177 Ų177141.5 Ų141.583%0.82779%0.794SS**  trans-56.8136.6158.5-71.7-174.3136.200108.9
282H49.3Very low44.9Very low151 Ų151139.2 Ų139.270%0.69979%0.793SS**  trans-155.3114151.1-108.9-71000111.1
283D40.3Very low44.8Very low137 Ų137143.5 Ų143.573%0.73380%0.797SS**  trans41.7112.8143.6-81.2-38.4000121.1
284E46Very low44.2Very low185 Ų185144.7 Ų144.786%0.86480%0.8SS**  trans-71.4119.7152.6-63.3-159.4147.400110.9
285T43.4Very low44.3Very low116 Ų116145.7 Ų145.771%0.71280%0.799SS**  trans-92.699.6167.641.20000110.1F287T285-F287 PolarHBondContact O-N 3.3Å
286K47.6Very low43.9Very low178 Ų178146.8 Ų146.877%0.77479%0.791SS**  trans-72.8112161.4-99.5176.6177.9171.20109.5N288K286-N288 PolarHBondContact O-N 3.45Å
287F43.4Very low43.4Very low182 Ų182146.9 Ų146.980%0.79879%0.792SS**  trans-75.897.4164.2-78.3-85.4000109.9T285T285-F287 PolarHBondContact O-N 3.3Å
288N42.2Very low43.3Very low137 Ų137144.9 Ų144.973%0.73379%0.786SS**  trans-91.3115164.2-79.2-16.5000108.9K286K286-N288 PolarHBondContact O-N 3.45Å
289N47.4Very low43.5Very low149 Ų149144.2 Ų144.280%0.79778%0.781SS**  trans-104.7101.1161.7-74.4-35.7000107.8
290N42.4Very low43.5Very low152 Ų152144.5 Ų144.581%0.81378%0.783SS**  trans-139.195.4162.3-86.7-30.7000107.5S292N290-S292 PolarHBondContact O-N 2.7Å
291L44.9Very low43.4Very low168 Ų168144.7 Ų144.788%0.8879%0.786SS**  trans-78.9109168.4-168.875.8000107.3
292S40.1Very low43.5Very low119 Ų119141.2 Ų141.283%0.83278%0.781SS**  trans-80121.2169.2-67.80000109N290N290-S292 PolarHBondContact O-N 2.7Å
293E44.5Very low43.3Very low185 Ų185140.7 Ų140.786%0.86479%0.789SS**  trans-120.5131.8162.7-164162.2-16700108.6
294S39.1Very low43.6Very low104 Ų104139.6 Ų139.673%0.72779%0.792SS**  trans-102.5124.3-163.1141.80000110.6
295I53.7Low43.9Very low164 Ų164138.8 Ų138.884%0.84179%0.792SS**  trans-150.1129.5152.4-52.9-178.9000109.8
296P37.8Very low44.4Very low103 Ų103141.1 Ų141.167%0.66980%0.799SS**  trans-103.9165178.538-30.5000114.3
297S40.5Very low44.6Very low118 Ų118139.6 Ų139.683%0.82580%0.798SS**  trans94.6117.6157.9-43.10000117.6
298A40.2Very low45.8Very low88 Ų88136.1 Ų136.173%0.72779%0.794SS**  160.3109.8117.300000112.8
299S44.3Very low47.3Very low97 Ų97135 Ų13568%0.67879%0.794SS**  trans54.9115.8132.441.80000123.5
300L39.7Very low48.6Very low167 Ų167133.3 Ų133.387%0.87479%0.791SS**  82149.5119.1-64.5167000121.1
301I45.2Very low50.1Low162 Ų162131.6 Ų131.683%0.83179%0.788SS**  trans109.9108.6150.1-41.4175.4000115.9
302S42.8Very low51.5Low104 Ų104129.1 Ų129.173%0.72778%0.782SS**  trans-60.8143.8173.5-28.70000113.7
303T43.5Very low53.3Low140 Ų140129 Ų12986%0.85978%0.778SS**  trans-161.7119135.724.90000110
304S48.1Very low54.7Low114 Ų114125.5 Ų125.580%0.79777%0.772SS**  trans-66.8121.7172.7-28.10000109.9
305L52Low56.2Low167 Ų167126.3 Ų126.387%0.87478%0.775SS**  trans-133.6126.4156.1-73.3178.8000109.3
306I53.6Low56.8Low166 Ų166124.9 Ų124.985%0.85177%0.773SS**PPolyproline II helixtrans-62.6133.7-173.9-68.6153.3000110.3
307L50.6Low57.5Low146 Ų146127.6 Ų127.676%0.76478%0.78SS**PPolyproline II helixtrans-59.1137.9171.3-94.780.2000111
308P69Low58Low109 Ų109127.4 Ų127.471%0.70878%0.779SS**PPolyproline II helixtrans-73.8135.1150.430.5-29.1000109.2
309P73.3Confident58.5Low112 Ų112128.1 Ų128.173%0.72778%0.779SS**PPolyproline II helixtrans-64.6148.2174.726.1-32.9000111.3
310P75.4Confident58.9Low115 Ų115129.8 Ų129.875%0.74779%0.787SS**PPolyproline II helixtrans-61.2141.3175.225.2-32.9000110.9
311P74.2Confident58.8Low116 Ų116126.2 Ų126.275%0.75378%0.782SS**PPolyproline II helixtrans-64.3141.7179.725-32.6000111.4
312P75.1Confident58.9Low116 Ų116126.3 Ų126.375%0.75378%0.783SS**PPolyproline II helixtrans-63.9140.9176.724.9-32.3000111.2
313P76.7Confident59.1Low115 Ų115130.3 Ų130.375%0.74779%0.79SS**PPolyproline II helixtrans-63.2144.4175.324.6-31.9000111.2
314P75Confident58.8Low113 Ų113127.8 Ų127.873%0.73479%0.792SS**PPolyproline II helixtrans-61.6141.7-179.623.8-32.6000111.6V316P314-V316 PolarHBondContact O-N 3.2Å
315P69.9Low58.3Low120 Ų120125.8 Ų125.878%0.77979%0.79SS**PPolyproline II helixtrans-61121.1175.123.8-31.3000110I317P315-I317 PolarHBondContact O-N 3.06Å; P315-I317 VanDerWaalsContact O-N 3.11Å
316V65.4Low57.8Low134 Ų134122.7 Ų122.781%0.81279%0.788SS**  trans-57.8112.3169.5-83.70000109.2P314 S318P314-V316 PolarHBondContact O-N 3.2Å; V316-S318 PolarHBondContact O-N 2.68Å
317I54.1Low57.5Low160 Ų160122.1 Ų122.182%0.82179%0.787SS**  trans-61.9108.1172.4-60172.6000106.8P315 S319P315-I317 PolarHBondContact O-N 3.06Å; P315-I317 VanDerWaalsContact O-N 3.11Å; I317-S319 PolarHBondContact O-N 3.22Å; I317-S319 VanDerWaalsContact O-N 3.09Å
318S49.3Very low57.2Low114 Ų114118.4 Ų118.480%0.79778%0.784SS**  trans-61.8107.1177.2-64.10000109.1V316V316-S318 PolarHBondContact O-N 2.68Å
319S52.5Low56.7Low103 Ų103119.6 Ų119.672%0.7280%0.795SS**PPolyproline II helixtrans-78142.4162.3-62.60000108.6I317 A321I317-S319 PolarHBondContact O-N 3.22Å; I317-S319 VanDerWaalsContact O-N 3.09Å; S319-A321 PolarHBondContact O-N 3.45Å
320P50.9Low55.9Low132 Ų132118.9 Ų118.986%0.85779%0.792SS**PPolyproline II helixtrans-64.1130.1-163.424.6-33.1000112.3
321A37.6Very low55.5Low92 Ų92116.8 Ų116.876%0.7678%0.775SS**PPolyproline II helixtrans-59.6132.8177.200000112.7S319S319-A321 PolarHBondContact O-N 3.45Å
322L48.3Very low56.1Low165 Ų165120.4 Ų120.486%0.86477%0.774SS**  trans-127.393.1146.6-75.6174.7000107.7
323Q45.8Very low56.7Low187 Ų187122.7 Ų122.787%0.87477%0.767SS**  trans28.6122.7148.4-66.517532.300120.4
324G38.1Very low57.2Low87 Ų87123 Ų12390%0.89776%0.759SS**  trans88.2119.5149.600000113.8
325G38.1Very low57.8Low73 Ų73124.7 Ų124.775%0.75376%0.757SS**  cis144.5110.918.500000105.9
326A41.6Very low58.6Low101 Ų101123 Ų12384%0.83574%0.741SS**  trans33.284160.300000118.9
327N47.2Very low59.8Low155 Ų155120.6 Ų120.683%0.82972%0.721SS**  -178.4122.7128.1-114.2-20.4000110
328G44.5Very low61.4Low68 Ų68115.8 Ų115.870%0.70171%0.705SS**  trans-65.9152.2170.100000111.1
329S58.4Low63.1Low133 Ų133119.4 Ų119.493%0.9370%0.701SS**SBendtrans96.72.9161.3-157.30000120.2
330S55.8Low64.6Low97 Ų97120.4 Ų120.468%0.67870%0.698SS**  trans-125.9116.7178.449.90000115.7
331N66.9Low66.1Low71 Ų71122.5 Ų122.538%0.3869%0.689SS.*  trans77.662.8146.3-83.8-37.1000121R333 E334 Q335N331-R333 PolarHBondContact O-N 3.21Å; N331-R333 VanDerWaalsContact O-N 3.07Å; N331-E334 HydrophobicContact CB-CB 3.81Å; N331-E334 HydrophobicContact CB-CG 3.62Å; N331-E334 PolarHBondContact ND2-OE1 3.4Å; N331-E334 PolarHBondContact O-N 3Å; N331-Q335 PolarHBondContact O-N 2.87Å; N331-Q335 VanDerWaalsContact O-N 3.12Å
332W87.9Confident67.7Low193 Ų193120.9 Ų120.973%0.73167%0.672SS**Hα-helixtrans-49.7-28.8152.673.2-87.2000112.5Q335 L336W332-Q335 PolarHBondContact O-N 3.37Å; W332-L336 HydrophobicContact CE3-CD1 3.48Å; W332-L336 VanDerWaalsContact CE3-CD1 3.48Å; W332-L336 HydrophobicContact CE3-CG 4.42Å; W332-L336 HydrophobicContact CH2-CD1 4.41Å; W332-L336 HydrophobicContact CZ3-CD1 3.25Å; W332-L336 PolarHBondContact O-N 3.28Å
333R85.9Confident68.4Low163 Ų163121.5 Ų121.562%0.61567%0.667SS**Hα-helixtrans-67.7-39.8176.5-166.2176.4-179172-0.8113N331 L336 Q337N331-R333 PolarHBondContact O-N 3.21Å; N331-R333 VanDerWaalsContact O-N 3.07Å; R333-L336 PolarHBondContact O-N 3.37Å; R333-Q337 WeakPolarHBondContact O-CG 3.32Å; R333-Q337 PolarHBondContact O-N 3.44Å
334E87.5Confident69.1Low123 Ų123121.3 Ų121.358%0.57566%0.664SS**Hα-helixtrans-70.2-39.3173.4-70.4173.3-161.500110.6N331 L336 Q337 A338N331-E334 HydrophobicContact CB-CB 3.81Å; N331-E334 HydrophobicContact CB-CG 3.62Å; N331-E334 PolarHBondContact ND2-OE1 3.4Å; N331-E334 PolarHBondContact O-N 3Å; E334-L336 VanDerWaalsContact C-N 3.29Å; E334-L336 PolarHBondContact O-N 3.4Å; E334-Q337 PolarHBondContact O-N 3.36Å; E334-Q337 VanDerWaalsContact O-N 3.16Å; E334-A338 WeakPolarHBondContact O-CB 3.36Å; E334-A338 PolarHBondContact O-N 2.89Å
335Q88.2Confident70.2Confident147 Ų147122.7 Ų122.769%0.68765%0.65SS**Hα-helixtrans-61.3-38.6175.6-160.8174.367.900111.7N331 W332 R339N331-Q335 PolarHBondContact O-N 2.87Å; N331-Q335 VanDerWaalsContact O-N 3.12Å; W332-Q335 PolarHBondContact O-N 3.37Å; Q335-R339 WeakPolarHBondContact O-CB 3.34Å; Q335-R339 PolarHBondContact O-N 3.48Å
336L87.3Confident70.8Confident84 Ų84126 Ų12644%0.4465%0.651SS.*Hα-helixtrans-64.5-46.5171.2-99.1172.7000112.8W332 R333 E334 A338 R339 L340W332-L336 HydrophobicContact CE3-CD1 3.48Å; W332-L336 VanDerWaalsContact CE3-CD1 3.48Å; W332-L336 HydrophobicContact CE3-CG 4.42Å; W332-L336 HydrophobicContact CH2-CD1 4.41Å; W332-L336 HydrophobicContact CZ3-CD1 3.25Å; W332-L336 PolarHBondContact O-N 3.28Å; R333-L336 PolarHBondContact O-N 3.37Å; E334-L336 VanDerWaalsContact C-N 3.29Å; E334-L336 PolarHBondContact O-N 3.4Å; L336-A338 VanDerWaalsContact C-N 3.35Å; L336-A338 PolarHBondContact O-N 2.99Å; L336-R339 PolarHBondContact O-N 2.91Å; L336-L340 WeakPolarHBondContact O-CG 3.31Å; L336-L340 PolarHBondContact O-N 2.98Å
337Q89.8Confident70.9Confident85 Ų85127 Ų12740%0.39765%0.65SS.*Hα-helixtrans-62.6-41.8177.6-76.2-176.339.900111.8R333 E334 R339 L340 R341R333-Q337 WeakPolarHBondContact O-CG 3.32Å; R333-Q337 PolarHBondContact O-N 3.44Å; E334-Q337 PolarHBondContact O-N 3.36Å; E334-Q337 VanDerWaalsContact O-N 3.16Å; Q337-R339 VanDerWaalsContact C-N 3.31Å; Q337-R339 PolarHBondContact O-N 3.04Å; Q337-L340 PolarHBondContact O-N 2.85Å; Q337-R341 WeakPolarHBondContact O-CB 3.32Å; Q337-R341 VanDerWaalsContact O-CG 3.31Å; Q337-R341 WeakPolarHBondContact O-CG 3.37Å; Q337-R341 PolarHBondContact O-N 3.3Å
338A87.2Confident70.8Confident58 Ų58125.1 Ų125.148%0.47964%0.644SS.*Hα-helixtrans-60.8-41.1174.500000111.3E334 L336 R341 S342E334-A338 WeakPolarHBondContact O-CB 3.36Å; E334-A338 PolarHBondContact O-N 2.89Å; L336-A338 VanDerWaalsContact C-N 3.35Å; L336-A338 PolarHBondContact O-N 2.99Å; A338-R341 PolarHBondContact O-N 2.89Å; A338-S342 WeakPolarHBondContact O-CB 3.45Å; A338-S342 PolarHBondContact O-N 3.3Å; A338-S342 PolarHBondContact O-OG 3.46Å
339R84.8Confident70.9Confident190 Ų190128 Ų12872%0.71764%0.644SS**Hα-helixtrans-68.4-35.5177.4-155.3169.3-177.4171.1-0112.9Q335 L336 Q337 S342 K343Q335-R339 WeakPolarHBondContact O-CB 3.34Å; Q335-R339 PolarHBondContact O-N 3.48Å; L336-R339 PolarHBondContact O-N 2.91Å; Q337-R339 VanDerWaalsContact C-N 3.31Å; Q337-R339 PolarHBondContact O-N 3.04Å; R339-S342 VanDerWaalsContact CA-OG 3.32Å; R339-S342 WeakPolarHBondContact CA-OG 3.4Å; R339-S342 PolarHBondContact O-OG 3.14Å; R339-K343 WeakPolarHBondContact O-CB 3.34Å; R339-K343 PolarHBondContact O-N 3.2Å
340L84.6Confident70.3Confident125 Ų125130.3 Ų130.365%0.65464%0.637SS**Hα-helixtrans-68.9-40.6173.1-71.1171000111.8L336 Q337L336-L340 WeakPolarHBondContact O-CG 3.31Å; L336-L340 PolarHBondContact O-N 2.98Å; Q337-L340 PolarHBondContact O-N 2.85Å
341R82.7Confident69.7Low176 Ų176132.3 Ų132.366%0.66465%0.646SS**Hα-helixtrans-69.7-41.9177.6-71.9176177.6-174.10.9112.4Q337 A338 K343 K344Q337-R341 WeakPolarHBondContact O-CB 3.32Å; Q337-R341 VanDerWaalsContact O-CG 3.31Å; Q337-R341 WeakPolarHBondContact O-CG 3.37Å; Q337-R341 PolarHBondContact O-N 3.3Å; A338-R341 PolarHBondContact O-N 2.89Å; R341-K343 PolarHBondContact O-N 3.27Å; R341-K344 PolarHBondContact O-N 3.43Å
342S70.1Confident68.4Low58 Ų58133.9 Ų133.941%0.40666%0.662SS.*Hα-helixtrans-69.2-30.3178.446.70000113.3A338 R339 K344 N345A338-S342 WeakPolarHBondContact O-CB 3.45Å; A338-S342 PolarHBondContact O-N 3.3Å; A338-S342 PolarHBondContact O-OG 3.46Å; R339-S342 VanDerWaalsContact CA-OG 3.32Å; R339-S342 WeakPolarHBondContact CA-OG 3.4Å; R339-S342 PolarHBondContact O-OG 3.14Å; S342-K344 PolarHBondContact O-N 3.43Å; S342-N345 PolarHBondContact O-N 3.18Å
343K64.2Low66.2Low178 Ų178130.7 Ų130.777%0.77466%0.664SS**THydrogen-bonded Turntrans-68.5-17.7176-170.2150.8173.6171.70114R339 R341R339-K343 WeakPolarHBondContact O-CB 3.34Å; R339-K343 PolarHBondContact O-N 3.2Å; R341-K343 PolarHBondContact O-N 3.27Å
344K60.5Low63.9Low183 Ų183129.2 Ų129.280%0.79668%0.675SS**THydrogen-bonded Turntrans-82.6-13.9175.7-169165.9172.11770113.4R341 S342R341-K344 PolarHBondContact O-N 3.43Å; S342-K344 PolarHBondContact O-N 3.43Å
345N60.4Low61.7Low115 Ų115130.1 Ų130.162%0.61568%0.683SS**SBendtrans-112.60.8-169.6-55.8-6.5000113.9S342S342-N345 PolarHBondContact O-N 3.18Å
346N52Low59.2Low144 Ų144132 Ų13277%0.7769%0.689SS**  trans-101.242.9-178.2-81.2-26.4000113.4
347C44Very low56.6Low120 Ų120132.7 Ų132.781%0.81170%0.701SS**  trans-137.948.6173.9-164.70000111
348T44.3Very low54.1Low116 Ų116136.2 Ų136.271%0.71272%0.722SS**  trans-155.787.9173.5510000110.7
349D45.4Very low52Low130 Ų130140.5 Ų140.570%0.69574%0.736SS**  trans-145.598150.4-87.4-40.1000106.7
350K46.6Very low50.4Low180 Ų180137 Ų13778%0.78374%0.741SS**  72.9105.194.7-73.7175.9-162140.30112.9
351T42.8Very low48.9Very low140 Ų140137.3 Ų137.386%0.85974%0.742SS**  -158.6127.9117.6-65.60000108.7
352S39.4Very low47.4Very low104 Ų104131.9 Ų131.973%0.72773%0.731SS**  trans-75.9132.9-179.547.60000113
353T42.4Very low46.8Very low125 Ų125136.5 Ų136.577%0.76775%0.746SS**  trans-165.4133.3143.844.30000109.9I355T353-I355 PolarHBondContact O-N 3.34Å
354P37.8Very low46.6Very low132 Ų132132 Ų13286%0.85773%0.731SS**  trans-96.392.4-175.335.3-27.9000111
355I41.7Very low46.7Very low143 Ų143127.6 Ų127.673%0.73372%0.721SS**  trans-141.5107.5172.7-55.1180000110.7T353T353-I355 PolarHBondContact O-N 3.34Å
356K35.6Very low47Very low186 Ų186126.1 Ų126.181%0.80973%0.725SS**  trans33.8122.1142-59.9175.4-179.7176.70118.3
357S33.4Very low48.3Very low99 Ų99122.8 Ų122.869%0.69271%0.706SS**  trans53100.8149.358.60000116.7
358N35.6Very low50.4Low159 Ų159122.8 Ų122.885%0.8570%0.696SS**  178.3134.2118.6-82-28.5000110.2S360N358-S360 PolarHBondContact O-N 3.29Å
359L44.6Very low52.5Low147 Ų147119.8 Ų119.877%0.7768%0.68SS**  trans-47.8107.1179.3-128.868.5000110.8I361L359-I361 PolarHBondContact O-N 3.46Å
360S50.4Low54.2Low116 Ų116117.7 Ų117.781%0.81167%0.666SS**  trans-73.595.7172.7490000109N358 S362N358-S360 PolarHBondContact O-N 3.29Å; S360-S362 VanDerWaalsContact C-N 3.28Å; S360-S362 PolarHBondContact O-N 3.18Å
361I53.9Low56Low132 Ų132111.9 Ų111.968%0.67765%0.645SS**  trans-66.991174.9-62.3161.6000107.5L359 Q363L359-I361 PolarHBondContact O-N 3.46Å; I361-Q363 PolarHBondContact O-N 3.11Å
362S50.3Low58.2Low62 Ų62109.7 Ų109.743%0.43463%0.628SS.*  trans-58.1110.5169172.80000108.6S360 N364 R383S360-S362 VanDerWaalsContact C-N 3.28Å; S360-S362 PolarHBondContact O-N 3.18Å; S362-N364 PolarHBondContact O-N 3.27Å; S362-R383 PolarHBondContact O-NH1 3.3Å
363Q57Low60.5Low155 Ų155110.3 Ų110.372%0.72462%0.618SS**  trans-71.216.9177.6-67-173.7-3400113I361 P365I361-Q363 PolarHBondContact O-N 3.11Å; Q363-P365 VanDerWaalsContact O-CD 3.31Å; Q363-P365 WeakPolarHBondContact O-CD 3.26Å
364N61.4Low62.5Low84 Ų84106.5 Ų106.545%0.44959%0.591SS.*  trans-92.5112.5173.2-128.7-30.3000109.6S362 A366 R383S362-N364 PolarHBondContact O-N 3.27Å; N364-A366 PolarHBondContact O-N 3.33Å; N364-A366 VanDerWaalsContact O-N 3.09Å; N364-R383 PolarHBondContact O-NH1 3.49Å
365P61.2Low64.8Low91 Ų91104.8 Ų104.859%0.59157%0.574SS**THydrogen-bonded Turntrans-68.5-6.5-17625.4-33.4000113.9Q363Q363-P365 VanDerWaalsContact O-CD 3.31Å; Q363-P365 WeakPolarHBondContact O-CD 3.26Å
366A67.7Low67Low84 Ų84105.9 Ų105.969%0.69458%0.576SS**THydrogen-bonded Turntrans-125.213.4-165.300000116.1N364 M368N364-A366 PolarHBondContact O-N 3.33Å; N364-A366 VanDerWaalsContact O-N 3.09Å; A366-M368 PolarHBondContact O-N 3.21Å
367D80Confident69.1Low73 Ų73101.3 Ų101.339%0.3957%0.568SS.*  trans-83.497.8178.6-1710.9000111.8S369 Q370D367-S369 VanDerWaalsContact CG-OG 3.23Å; D367-S369 PolarHBondContact O-N 3.37Å; D367-S369 VanDerWaalsContact OD1-CB 3.3Å; D367-S369 WeakPolarHBondContact OD1-CB 3.15Å; D367-S369 PolarHBondContact OD1-N 3.06Å; D367-S369 PolarHBondContact OD1-OG 3.29Å; D367-S369 PolarHBondContact OD2-OG 3.36Å; D367-Q370 PolarHBondContact O-N 3.36Å
368M86.5Confident71.3Confident121 Ų121100.1 Ų100.160%0.59657%0.571SS**Hα-helixtrans-65.1-22.6176.9-78.4-60.8-59.100113.4A366 Q370 V371 L372A366-M368 PolarHBondContact O-N 3.21Å; M368-Q370 VanDerWaalsContact C-N 3.29Å; M368-Q370 PolarHBondContact O-N 3.45Å; M368-V371 PolarHBondContact O-N 3.34Å; M368-V371 HydrophobicContact SD-CG2 4.48Å; M368-L372 WeakPolarHBondContact O-CG 3.49Å; M368-L372 PolarHBondContact O-N 3.28Å
369S88.3Confident73.4Confident53 Ų5395.7 Ų95.737%0.37155%0.553SS.*Hα-helixtrans-65.7-36.6-179.174.40000111.6D367 L372 K373D367-S369 VanDerWaalsContact CG-OG 3.23Å; D367-S369 PolarHBondContact O-N 3.37Å; D367-S369 VanDerWaalsContact OD1-CB 3.3Å; D367-S369 WeakPolarHBondContact OD1-CB 3.15Å; D367-S369 PolarHBondContact OD1-N 3.06Å; D367-S369 PolarHBondContact OD1-OG 3.29Å; D367-S369 PolarHBondContact OD2-OG 3.36Å; S369-L372 PolarHBondContact O-N 3.28Å; S369-K373 WeakPolarHBondContact O-CG 3.43Å; S369-K373 PolarHBondContact O-N 3.1Å
370Q82.3Confident75.1Confident86 Ų8694.2 Ų94.240%0.40254%0.544SS..Hα-helixtrans-68-41.4175.7-177.758.923.600111.4D367 M368 L372 K373 E374D367-Q370 PolarHBondContact O-N 3.36Å; M368-Q370 VanDerWaalsContact C-N 3.29Å; M368-Q370 PolarHBondContact O-N 3.45Å; Q370-L372 VanDerWaalsContact C-N 3.32Å; Q370-L372 PolarHBondContact O-N 2.97Å; Q370-K373 PolarHBondContact O-N 3.44Å; Q370-E374 WeakPolarHBondContact CG-OE1 3.4Å; Q370-E374 PolarHBondContact NE2-OE1 3.06Å; Q370-E374 WeakPolarHBondContact O-CG 3.41Å; Q370-E374 PolarHBondContact O-N 3.43Å
371V84.6Confident76.5Confident57 Ų5795.6 Ų95.635%0.34554%0.536SS..Hα-helixtrans-60.1-44.7176179.40000110.6M368 K373 E374 L375M368-V371 PolarHBondContact O-N 3.34Å; M368-V371 HydrophobicContact SD-CG2 4.48Å; V371-K373 PolarHBondContact O-N 2.75Å; V371-E374 PolarHBondContact O-N 3.03Å; V371-L375 HydrophobicContact CG1-CD1 4.16Å; V371-L375 VanDerWaalsContact O-CG 3.3Å; V371-L375 WeakPolarHBondContact O-CG 3.39Å; V371-L375 PolarHBondContact O-N 3.44Å
372L88Confident77.8Confident95 Ų9597.2 Ų97.250%0.49754%0.544SS..Hα-helixtrans-63.8-40.2177.4-67.7172.7000112.1M368 S369 Q370 L375 Q376M368-L372 WeakPolarHBondContact O-CG 3.49Å; M368-L372 PolarHBondContact O-N 3.28Å; S369-L372 PolarHBondContact O-N 3.28Å; Q370-L372 VanDerWaalsContact C-N 3.32Å; Q370-L372 PolarHBondContact O-N 2.97Å; L372-L375 PolarHBondContact O-N 3.34Å; L372-Q376 WeakPolarHBondContact O-CG 3.23Å; L372-Q376 PolarHBondContact O-N 2.97Å
373K87Confident79.2Confident117 Ų11799.8 Ų99.851%0.50955%0.545SS..Hα-helixtrans-62.9-41174.5-73171.8-177.5178.50112.2S369 Q370 V371 Q376 S377S369-K373 WeakPolarHBondContact O-CG 3.43Å; S369-K373 PolarHBondContact O-N 3.1Å; Q370-K373 PolarHBondContact O-N 3.44Å; V371-K373 PolarHBondContact O-N 2.75Å; K373-Q376 PolarHBondContact O-N 3.31Å; K373-S377 VanDerWaalsContact O-CB 3.29Å; K373-S377 WeakPolarHBondContact O-CB 3.47Å; K373-S377 PolarHBondContact O-N 2.98Å; K373-S377 PolarHBondContact O-OG 3.31Å
374E85.1Confident80.4Confident44 Ų4498.3 Ų98.321%0.20655%0.552CS.*Hα-helixtrans-67.5-38.3178-73.5172.4-163.100112.1Q370 V371 S377 G378Q370-E374 WeakPolarHBondContact CG-OE1 3.4Å; Q370-E374 PolarHBondContact NE2-OE1 3.06Å; Q370-E374 WeakPolarHBondContact O-CG 3.41Å; Q370-E374 PolarHBondContact O-N 3.43Å; V371-E374 PolarHBondContact O-N 3.03Å; E374-S377 PolarHBondContact O-N 3.45Å; E374-G378 PolarHBondContact O-N 3.01Å
375L86.7Confident81.3Confident97 Ų9798.4 Ų98.451%0.50855%0.551SS.*Hα-helixtrans-64.2-39.5173.2-70.5172.2000112V371 L372 I380V371-L375 HydrophobicContact CG1-CD1 4.16Å; V371-L375 VanDerWaalsContact O-CG 3.3Å; V371-L375 WeakPolarHBondContact O-CG 3.39Å; V371-L375 PolarHBondContact O-N 3.44Å; L372-L375 PolarHBondContact O-N 3.34Å; L375-I380 HydrophobicContact CD2-CD1 3.51Å; L375-I380 HydrophobicContact CD2-CG1 3.85Å
376Q86.5Confident82.4Confident166 Ų16698.4 Ų98.478%0.77655%0.551SS**Hα-helixtrans-74-31.5177.2-72.7175.1-27.200113.2L372 K373 G378L372-Q376 WeakPolarHBondContact O-CG 3.23Å; L372-Q376 PolarHBondContact O-N 2.97Å; K373-Q376 PolarHBondContact O-N 3.31Å; Q376-G378 VanDerWaalsContact C-N 3.28Å; Q376-G378 PolarHBondContact O-N 3.18Å
377S81.3Confident83.2Confident90 Ų90102.5 Ų102.563%0.62955%0.549SS*.THydrogen-bonded Turntrans-85.14.5-176.4-51.80000113.8K373 E374 S379K373-S377 VanDerWaalsContact O-CB 3.29Å; K373-S377 WeakPolarHBondContact O-CB 3.47Å; K373-S377 PolarHBondContact O-N 2.98Å; K373-S377 PolarHBondContact O-OG 3.31Å; E374-S377 PolarHBondContact O-N 3.45Å; S377-S379 PolarHBondContact O-N 3.32Å; S377-S379 VanDerWaalsContact O-N 3.14Å
378G79.6Confident83.5Confident74 Ų74101.1 Ų101.176%0.76355%0.545SS*.THydrogen-bonded Turntrans75.5-6.2173.500000116.2E374 Q376E374-G378 PolarHBondContact O-N 3.01Å; Q376-G378 VanDerWaalsContact C-N 3.28Å; Q376-G378 PolarHBondContact O-N 3.18Å
379S79.2Confident83.3Confident66 Ų66102.6 Ų102.646%0.46256%0.564SS.*  trans-120.398.6176.678.10000111.4S377 K381S377-S379 PolarHBondContact O-N 3.32Å; S377-S379 VanDerWaalsContact O-N 3.14Å; S379-K381 PolarHBondContact O-N 2.89Å
380I79.9Confident83.4Confident115 Ų115103.3 Ų103.359%0.5958%0.58SS**  trans-82.9103.1170.5-56.1164.4000107.2L375L375-I380 HydrophobicContact CD2-CD1 3.51Å; L375-I380 HydrophobicContact CD2-CG1 3.85Å
381K79.4Confident83.6Confident146 Ų146101.3 Ų101.364%0.63558%0.582SS**PPolyproline II helixtrans-99.7118.1171.7-73-174.8179.2178.40109.1S379 R383S379-K381 PolarHBondContact O-N 2.89Å; K381-R383 PolarHBondContact O-N 3.09Å
382L82.4Confident83.7Confident165 Ų165102.8 Ų102.886%0.86459%0.591SS**PPolyproline II helixtrans-63.2128171.7-62.1-178.8000109.3
383R79.2Confident83.4Confident116 Ų116101.2 Ų101.244%0.43859%0.586SS.*PPolyproline II helixtrans-70.4134.1173.5-67.2-174.5-69.5161.6-3.6109.6S362 N364 K381 I385S362-R383 PolarHBondContact O-NH1 3.3Å; N364-R383 PolarHBondContact O-NH1 3.49Å; K381-R383 PolarHBondContact O-N 3.09Å; R383-I385 PolarHBondContact O-N 3.24Å
384S81.3Confident83Confident125 Ų125100.1 Ų100.187%0.87459%0.585SS**PPolyproline II helixtrans-71.3120.3167.6-172.80000108.8
385I80.5Confident82.6Confident85 Ų85107 Ų10744%0.43661%0.614SS.*  trans-108.7131.2176.3-59.7175.2000106.9R383 R387 P393R383-I385 PolarHBondContact O-N 3.24Å; I385-R387 PolarHBondContact O-N 3.35Å; I385-P393 HydrophobicContact CG2-CB 4.01Å
386P84.9Confident81.8Confident92 Ų92108.6 Ų108.660%0.59762%0.619SS**  trans-58.2129.9175.625.3-34.6000109.9I394P386-I394 HydrophobicContact CB-CD1 4.25Å; P386-I394 PolarHBondContact O-N 3.18Å
387R85.1Confident80.7Confident169 Ų169110.7 Ų110.764%0.63863%0.626SS**BIsolated β-bridgetrans-116.4143.8-179.4-69.6173.9-176.2-176.9-0109.1I385 T392I385-R387 PolarHBondContact O-N 3.35Å; R387-T392 WeakPolarHBondContact CA-O 3.46Å
388S85.2Confident79.7Confident45 Ų45113.4 Ų113.432%0.31562%0.622SS.*  trans-65.7159.4164.857.20000109.6G390 G391 T392S388-G390 PolarHBondContact O-N 3.25Å; S388-G391 PolarHBondContact O-N 3.17Å; S388-T392 PolarHBondContact N-O 3.15Å; S388-T392 PolarHBondContact OG-O 3.27Å; S388-T392 VanDerWaalsContact OG-O 3.07Å
389P83.8Confident78.7Confident152 Ų152114.3 Ų114.399%0.98762%0.617SS**THydrogen-bonded Turntrans-51.6-25.8179.5-28.835.5000114.5G391P389-G391 VanDerWaalsContact C-N 3.28Å; P389-G391 PolarHBondContact O-N 3.21Å
390G89Confident78Confident68 Ų68115.9 Ų115.970%0.70163%0.626SS**THydrogen-bonded Turntrans-82.916.9174.400000115.7S388 T392S388-G390 PolarHBondContact O-N 3.25Å; G390-T392 PolarHBondContact O-N 3.05Å; G390-T392 VanDerWaalsContact O-N 3.13Å
391G87.7Confident77.2Confident44 Ų44117.3 Ų117.345%0.45464%0.64SS.*SBendtrans74.9-0.7175.100000115.7S388 P389S388-G391 PolarHBondContact O-N 3.17Å; P389-G391 VanDerWaalsContact C-N 3.28Å; P389-G391 PolarHBondContact O-N 3.21Å
392T86.2Confident76.5Confident87 Ų87113.2 Ų113.253%0.53463%0.625SS.*  trans-83.3126.7179.4-56.20000110.1R387 S388 G390 I394R387-T392 WeakPolarHBondContact CA-O 3.46Å; S388-T392 PolarHBondContact N-O 3.15Å; S388-T392 PolarHBondContact OG-O 3.27Å; S388-T392 VanDerWaalsContact OG-O 3.07Å; G390-T392 PolarHBondContact O-N 3.05Å; G390-T392 VanDerWaalsContact O-N 3.13Å; T392-I394 PolarHBondContact O-N 3.24Å
393P82.3Confident75.8Confident62 Ų62108.5 Ų108.540%0.40361%0.605SS.*BIsolated β-bridgetrans-54.1129.5173.4-24.333.4000111I385 K395I385-P393 HydrophobicContact CG2-CB 4.01Å; P393-K395 PolarHBondContact O-N 3.09Å
394I78.7Confident75.8Confident94 Ų94105.4 Ų105.448%0.48261%0.61SS.*  trans-68.7110.1-179.8-59.9177.9000107.9P386 T392 Q396P386-I394 HydrophobicContact CB-CD1 4.25Å; P386-I394 PolarHBondContact O-N 3.18Å; T392-I394 PolarHBondContact O-N 3.24Å; I394-Q396 PolarHBondContact O-N 2.99Å
395K75.9Confident76Confident188 Ų188104 Ų10482%0.81760%0.6SS**  trans-74.4110.7171-65.1-174.5178.4-173.50107.8P393 K397P393-K395 PolarHBondContact O-N 3.09Å; K395-K397 PolarHBondContact O-N 3.18Å; K395-K397 VanDerWaalsContact O-N 3.15Å
396Q69.3Low76.5Confident131 Ų131103.2 Ų103.261%0.61260%0.597SS**  trans-58.3120.1166.1-70.2-177.9-31.100107.7I394 R398I394-Q396 PolarHBondContact O-N 2.99Å; Q396-R398 PolarHBondContact O-N 3.05Å
397K63.5Low76.9Confident210 Ų210103 Ų10391%0.91360%0.595SS**  trans-67.177.6175.1-71.9-176.1175.1-178.90109.1K395 S399K395-K397 PolarHBondContact O-N 3.18Å; K395-K397 VanDerWaalsContact O-N 3.15Å; K397-S399 PolarHBondContact O-N 3.33Å; K397-S399 VanDerWaalsContact O-N 3.1Å
398R60.3Low77.2Confident147 Ų14799 Ų9956%0.55559%0.592SS**  trans-75.988.7157.3-66.7-175-172.1159.84.5105Q396 P400Q396-R398 PolarHBondContact O-N 3.05Å; R398-P400 WeakPolarHBondContact O-CD 3.39Å
399S59.9Low77.4Confident94 Ų9497.2 Ų97.266%0.65758%0.58SS**  trans-54.2124.2159.651.80000105.5K397 T401K397-S399 PolarHBondContact O-N 3.33Å; K397-S399 VanDerWaalsContact O-N 3.1Å; S399-T401 PolarHBondContact O-N 3.21Å; S399-T401 VanDerWaalsContact O-N 3.11Å
400P62.6Low77.8Confident98 Ų9894 Ų9464%0.63655%0.554SS**  trans-51.1128.5169.4-19.430.2000106.3R398 I402R398-P400 WeakPolarHBondContact O-CD 3.39Å; P400-I402 HydrophobicContact CB-CG1 4.16Å; P400-I402 WeakPolarHBondContact O-CG1 3.31Å; P400-I402 PolarHBondContact O-N 3Å
401T63.1Low78Confident145 Ų14595.5 Ų95.589%0.8955%0.545SS*.  trans-65.685.2169.6-46.10000105.7S399 S403S399-T401 PolarHBondContact O-N 3.21Å; S399-T401 VanDerWaalsContact O-N 3.11Å; T401-S403 PolarHBondContact O-N 3.35Å
402I65.2Low78.3Confident61 Ų6194.9 Ų94.931%0.31354%0.535SS..  trans-67.2105.3-176.9-78.2172.9000105.4P400 G404 A409 R413P400-I402 HydrophobicContact CB-CG1 4.16Å; P400-I402 WeakPolarHBondContact O-CG1 3.31Å; P400-I402 PolarHBondContact O-N 3Å; I402-G404 PolarHBondContact O-N 3.48Å; I402-A409 HydrophobicContact CB-CB 4.26Å; I402-A409 HydrophobicContact CG2-CB 3.21Å; I402-A409 VanDerWaalsContact CG2-O 3.26Å; I402-A409 WeakPolarHBondContact CG2-O 3.38Å; I402-R413 HydrophobicContact CD1-CG 4.48Å; I402-R413 HydrophobicContact CG2-CG 4.07Å
403S68.7Low78.5Confident65 Ų6596.1 Ų96.146%0.45553%0.53SS..  trans-56.3132178.7-173.80000109.3T401 S405 D406 A409T401-S403 PolarHBondContact O-N 3.35Å; S403-S405 PolarHBondContact O-N 3.26Å; S403-S405 PolarHBondContact OG-OG 3.33Å; S403-S405 VanDerWaalsContact OG-OG 3.06Å; S403-D406 PolarHBondContact O-N 2.65Å; S403-A409 VanDerWaalsContact O-CB 3.24Å; S403-A409 WeakPolarHBondContact O-CB 3.3Å
404G79.5Confident79Confident52 Ų5296 Ų9654%0.53653%0.534SS..THydrogen-bonded Turntrans-56.9-21.4179.700000114.2I402 R413I402-G404 PolarHBondContact O-N 3.48Å; G404-R413 PolarHBondContact O-NH2 3.04Å
405S85.7Confident79.8Confident96 Ų9695.6 Ų95.667%0.67153%0.532SS*.THydrogen-bonded Turntrans-99.4-11.4-170.165.90000115.5S403S403-S405 PolarHBondContact O-N 3.26Å; S403-S405 PolarHBondContact OG-OG 3.33Å; S403-S405 VanDerWaalsContact OG-OG 3.06Å
406D90.5Very high80.5Confident68 Ų6893.5 Ų93.536%0.36453%0.525SS..  trans-86.5125.5-177.7162.432.2000110S403 C408 A409 I410S403-D406 PolarHBondContact O-N 2.65Å; D406-C408 PolarHBondContact O-N 3.11Å; D406-C408 WeakPolarHBondContact OD1-CB 3.22Å; D406-C408 PolarHBondContact OD1-N 3.49Å; D406-A409 HydrophobicContact CB-CB 3.72Å; D406-A409 WeakPolarHBondContact O-CA 3.47Å; D406-A409 WeakPolarHBondContact O-CB 3.44Å; D406-A409 PolarHBondContact O-N 2.74Å; D406-A409 VanDerWaalsContact O-N 3.07Å; D406-A409 PolarHBondContact OD2-N 2.94Å; D406-I410 WeakPolarHBondContact O-CG1 3.41Å; D406-I410 PolarHBondContact O-N 3.49Å
407P93.2Very high81.5Confident86 Ų8691.1 Ų91.156%0.55852%0.523SS*.Hα-helixtrans-56.3-38.2178.622.8-34.6000112.2A409 I410 I411P407-A409 VanDerWaalsContact C-N 3.33Å; P407-A409 PolarHBondContact O-N 3.05Å; P407-I410 PolarHBondContact O-N 3.36Å; P407-I411 VanDerWaalsContact O-CG1 3.28Å; P407-I411 WeakPolarHBondContact O-CG1 3.4Å; P407-I411 PolarHBondContact O-N 3.02Å
408C91.2Very high83Confident86 Ų8688 Ų8858%0.58151%0.509SS*.Hα-helixtrans-63.7-42176.9-68.10000111.2D406 I411 A412D406-C408 PolarHBondContact O-N 3.11Å; D406-C408 WeakPolarHBondContact OD1-CB 3.22Å; D406-C408 PolarHBondContact OD1-N 3.49Å; C408-I411 PolarHBondContact O-N 2.99Å; C408-A412 VanDerWaalsContact O-CB 3.25Å; C408-A412 WeakPolarHBondContact O-CB 3.36Å; C408-A412 PolarHBondContact O-N 3.29Å
409A89.5Confident84.5Confident7 Ų785.5 Ų85.56%0.05850%0.503CS..Hα-helixtrans-62.5-38.7174.900000113.7I402 S403 D406 P407 R413I402-A409 HydrophobicContact CB-CB 4.26Å; I402-A409 HydrophobicContact CG2-CB 3.21Å; I402-A409 VanDerWaalsContact CG2-O 3.26Å; I402-A409 WeakPolarHBondContact CG2-O 3.38Å; S403-A409 VanDerWaalsContact O-CB 3.24Å; S403-A409 WeakPolarHBondContact O-CB 3.3Å; D406-A409 HydrophobicContact CB-CB 3.72Å; D406-A409 WeakPolarHBondContact O-CA 3.47Å; D406-A409 WeakPolarHBondContact O-CB 3.44Å; D406-A409 PolarHBondContact O-N 2.74Å; D406-A409 VanDerWaalsContact O-N 3.07Å; D406-A409 PolarHBondContact OD2-N 2.94Å; P407-A409 VanDerWaalsContact C-N 3.33Å; P407-A409 PolarHBondContact O-N 3.05Å; A409-R413 PolarHBondContact O-N 2.96Å; A409-R413 PolarHBondContact O-NE 2.89Å
410I92.4Very high85.8Confident86 Ų8683.8 Ų83.844%0.44149%0.491SS..Hα-helixtrans-68.1-48.6175.4-64.5164.7000110.2D406 P407 A412 R413 A414D406-I410 WeakPolarHBondContact O-CG1 3.41Å; D406-I410 PolarHBondContact O-N 3.49Å; P407-I410 PolarHBondContact O-N 3.36Å; I410-A412 VanDerWaalsContact C-N 3.34Å; I410-A412 PolarHBondContact O-N 3.48Å; I410-R413 PolarHBondContact O-N 2.84Å; I410-A414 WeakPolarHBondContact O-CB 3.45Å; I410-A414 PolarHBondContact O-N 3.35Å
411I93.7Very high86.9Confident99 Ų9985.7 Ų85.751%0.50849%0.491SS..Hα-helixtrans-60.1-45.3177.6-65.9164.5000110.3P407 C408 R413 A414 L415P407-I411 VanDerWaalsContact O-CG1 3.28Å; P407-I411 WeakPolarHBondContact O-CG1 3.4Å; P407-I411 PolarHBondContact O-N 3.02Å; C408-I411 PolarHBondContact O-N 2.99Å; I411-R413 PolarHBondContact O-N 2.93Å; I411-A414 PolarHBondContact O-N 2.96Å; I411-L415 HydrophobicContact CG2-CD1 3.95Å; I411-L415 HydrophobicContact CG2-CG 4.29Å; I411-L415 WeakPolarHBondContact O-CG 3.32Å; I411-L415 PolarHBondContact O-N 3.26Å
412A92.6Very high88Confident30 Ų3083.5 Ų83.525%0.24847%0.473CS..Hα-helixtrans-58.5-47176.300000111.4C408 I410 A414 L415 H416C408-A412 VanDerWaalsContact O-CB 3.25Å; C408-A412 WeakPolarHBondContact O-CB 3.36Å; C408-A412 PolarHBondContact O-N 3.29Å; I410-A412 VanDerWaalsContact C-N 3.34Å; I410-A412 PolarHBondContact O-N 3.48Å; A412-A414 VanDerWaalsContact C-N 3.35Å; A412-A414 PolarHBondContact O-N 3.07Å; A412-L415 PolarHBondContact O-N 2.93Å; A412-H416 WeakPolarHBondContact O-CB 3.35Å; A412-H416 PolarHBondContact O-CD2 3.42Å; A412-H416 PolarHBondContact O-N 3.44Å
413R91.5Very high88.6Confident113 Ų11388.6 Ų88.643%0.42649%0.489SS..Hα-helixtrans-59.2-43.9174.4-91.6-179.7-63.7164.22.9112.4I402 G404 A409 I410 I411 H416 S417I402-R413 HydrophobicContact CD1-CG 4.48Å; I402-R413 HydrophobicContact CG2-CG 4.07Å; G404-R413 PolarHBondContact O-NH2 3.04Å; A409-R413 PolarHBondContact O-N 2.96Å; A409-R413 PolarHBondContact O-NE 2.89Å; I410-R413 PolarHBondContact O-N 2.84Å; I411-R413 PolarHBondContact O-N 2.93Å; R413-H416 PolarHBondContact O-N 3.34Å; R413-S417 VanDerWaalsContact O-CB 3.3Å; R413-S417 WeakPolarHBondContact O-CB 3.45Å; R413-S417 PolarHBondContact O-N 3.13Å
414A93Very high89Confident59 Ų5988.3 Ų88.349%0.48849%0.487SS..Hα-helixtrans-62.3-43.8178.900000111.7I410 I411 A412 S417 K418I410-A414 WeakPolarHBondContact O-CB 3.45Å; I410-A414 PolarHBondContact O-N 3.35Å; I411-A414 PolarHBondContact O-N 2.96Å; A412-A414 VanDerWaalsContact C-N 3.35Å; A412-A414 PolarHBondContact O-N 3.07Å; A414-S417 PolarHBondContact O-N 3.04Å; A414-K418 VanDerWaalsContact O-CB 3.31Å; A414-K418 WeakPolarHBondContact O-CB 3.39Å; A414-K418 PolarHBondContact O-N 3.36Å
415L95.3Very high88.9Confident86 Ų8692.1 Ų92.145%0.4549%0.492SS..Hα-helixtrans-66.3-45.6176-66.4173.8000111.8I411 A412 S417 K418 F419I411-L415 HydrophobicContact CG2-CD1 3.95Å; I411-L415 HydrophobicContact CG2-CG 4.29Å; I411-L415 WeakPolarHBondContact O-CG 3.32Å; I411-L415 PolarHBondContact O-N 3.26Å; A412-L415 PolarHBondContact O-N 2.93Å; L415-S417 VanDerWaalsContact C-N 3.27Å; L415-S417 PolarHBondContact O-N 3.48Å; L415-K418 PolarHBondContact O-N 2.76Å; L415-F419 HydrophobicContact CB-CD2 4.4Å; L415-F419 HydrophobicContact CD2-CE2 3.96Å; L415-F419 WeakPolarHBondContact O-CB 3.07Å; L415-F419 WeakPolarHBondContact O-CD2 3.29Å; L415-F419 PolarHBondContact O-N 3.41Å
416H90.6Very high88.5Confident144 Ų14493.9 Ų93.967%0.66749%0.491SS*.Hα-helixtrans-57.9-41.7175.4-90.5-91.8000111.6A412 R413 S420A412-H416 WeakPolarHBondContact O-CB 3.35Å; A412-H416 PolarHBondContact O-CD2 3.42Å; A412-H416 PolarHBondContact O-N 3.44Å; R413-H416 PolarHBondContact O-N 3.34Å; H416-S420 WeakPolarHBondContact O-CB 3.27Å; H416-S420 PolarHBondContact O-N 3.23Å
417S90.6Very high87.5Confident81 Ų8194.8 Ų94.857%0.56650%0.496SS*.Hα-helixtrans-67.2-46.5176.4-173.20000111.9R413 A414 L415 F419 S420R413-S417 VanDerWaalsContact O-CB 3.3Å; R413-S417 WeakPolarHBondContact O-CB 3.45Å; R413-S417 PolarHBondContact O-N 3.13Å; A414-S417 PolarHBondContact O-N 3.04Å; L415-S417 VanDerWaalsContact C-N 3.27Å; L415-S417 PolarHBondContact O-N 3.48Å; S417-F419 VanDerWaalsContact C-N 3.26Å; S417-F419 PolarHBondContact O-N 3.46Å; S417-S420 PolarHBondContact O-N 3Å; S417-S420 PolarHBondContact O-OG 2.92Å
418K93.6Very high86Confident145 Ų14595.8 Ų95.863%0.6350%0.497SS*.Hα-helixtrans-60.2-35.3179.2-173.2175.5-171.3-66.70112.7A414 L415A414-K418 VanDerWaalsContact O-CB 3.31Å; A414-K418 WeakPolarHBondContact O-CB 3.39Å; A414-K418 PolarHBondContact O-N 3.36Å; L415-K418 PolarHBondContact O-N 2.76Å
419F92.9Very high84.5Confident94 Ų9496.5 Ų96.541%0.41250%0.503SS..Hα-helixtrans-105.42.4-174.9-61.1-58.6000114.5L415 S417 H421 L422 R423L415-F419 HydrophobicContact CB-CD2 4.4Å; L415-F419 HydrophobicContact CD2-CE2 3.96Å; L415-F419 WeakPolarHBondContact O-CB 3.07Å; L415-F419 WeakPolarHBondContact O-CD2 3.29Å; L415-F419 PolarHBondContact O-N 3.41Å; S417-F419 VanDerWaalsContact C-N 3.26Å; S417-F419 PolarHBondContact O-N 3.46Å; F419-H421 VanDerWaalsContact C-N 3.28Å; F419-H421 PolarHBondContact O-N 3.42Å; F419-L422 HydrophobicContact CD1-CD1 3.48Å; F419-L422 VanDerWaalsContact CD1-CD1 3.48Å; F419-L422 HydrophobicContact CD1-CG 4.14Å; F419-L422 HydrophobicContact CE1-CD1 3.95Å; F419-L422 PolarHBondContact O-N 3.43Å; F419-L422 VanDerWaalsContact O-N 3.14Å; F419-R423 PolarHBondContact O-N 3.31Å
420S87Confident82.8Confident59 Ų59102.3 Ų102.341%0.41354%0.538SS..Hα-helixtrans-56.5-44176.762.50000111.6H416 S417 R423 S424H416-S420 WeakPolarHBondContact O-CB 3.27Å; H416-S420 PolarHBondContact O-N 3.23Å; S417-S420 PolarHBondContact O-N 3Å; S417-S420 PolarHBondContact O-OG 2.92Å; S420-R423 PolarHBondContact O-N 3.06Å; S420-S424 PolarHBondContact O-N 3.19Å
421H85.6Confident80.6Confident138 Ų138102 Ų10264%0.63954%0.544SS*.Hα-helixtrans-66.5-36177.1-61.389.7000112.8F419 R423 S424 M425F419-H421 VanDerWaalsContact C-N 3.28Å; F419-H421 PolarHBondContact O-N 3.42Å; H421-R423 VanDerWaalsContact C-N 3.3Å; H421-R423 PolarHBondContact O-N 2.97Å; H421-S424 PolarHBondContact O-N 3Å; H421-M425 WeakPolarHBondContact O-CG 3.4Å; H421-M425 PolarHBondContact O-N 2.92Å
422L85.5Confident78.4Confident99 Ų99100.5 Ų100.552%0.51855%0.552SS.*Hα-helixtrans-67-34178.4-65.3-165.7000112F419 M425 M426F419-L422 HydrophobicContact CD1-CD1 3.48Å; F419-L422 VanDerWaalsContact CD1-CD1 3.48Å; F419-L422 HydrophobicContact CD1-CG 4.14Å; F419-L422 HydrophobicContact CE1-CD1 3.95Å; F419-L422 PolarHBondContact O-N 3.43Å; F419-L422 VanDerWaalsContact O-N 3.14Å; L422-M425 PolarHBondContact O-N 2.88Å; L422-M426 WeakPolarHBondContact O-CB 3.5Å; L422-M426 PolarHBondContact O-N 3.47Å
423R77.8Confident76.6Confident167 Ų167107.5 Ų107.563%0.6358%0.58SS**Hα-helixtrans-65.2-45.5174.9-170.966.465.7-161.90.1110.7F419 S420 H421 M425 M426 D427F419-R423 PolarHBondContact O-N 3.31Å; S420-R423 PolarHBondContact O-N 3.06Å; H421-R423 VanDerWaalsContact C-N 3.3Å; H421-R423 PolarHBondContact O-N 2.97Å; R423-M425 VanDerWaalsContact C-N 3.35Å; R423-M425 PolarHBondContact O-N 2.93Å; R423-M426 PolarHBondContact O-N 2.84Å; R423-D427 WeakPolarHBondContact CG-OD2 3.29Å; R423-D427 WeakPolarHBondContact O-CB 3.44Å; R423-D427 VanDerWaalsContact O-CG 3.24Å; R423-D427 PolarHBondContact O-N 3.24Å
424S77.4Confident74.6Confident60 Ų60110.6 Ų110.642%0.4260%0.599SS.*Hα-helixtrans-60.6-42175.7179.90000112.1S420 H421 M426 N428S420-S424 PolarHBondContact O-N 3.19Å; H421-S424 PolarHBondContact O-N 3Å; S424-M426 PolarHBondContact O-N 3.43Å; S424-N428 VanDerWaalsContact O-CB 3.23Å; S424-N428 WeakPolarHBondContact O-CB 3.3Å; S424-N428 PolarHBondContact O-N 3.47Å; S424-N428 PolarHBondContact O-ND2 3.46Å; S424-N428 PolarHBondContact O-OD1 2.88Å; S424-N428 PolarHBondContact OG-ND2 3.45Å
425M77.7Confident72.2Confident131 Ų131117 Ų11765%0.64562%0.616SS**Hα-helixtrans-66.6-35.3178.4-69.3-179.56900113.4H421 L422 R423 S429H421-M425 WeakPolarHBondContact O-CG 3.4Å; H421-M425 PolarHBondContact O-N 2.92Å; L422-M425 PolarHBondContact O-N 2.88Å; R423-M425 VanDerWaalsContact C-N 3.35Å; R423-M425 PolarHBondContact O-N 2.93Å; M425-S429 PolarHBondContact O-OG 3.45Å
426M76.2Confident69.7Low133 Ų133118.1 Ų118.166%0.65563%0.631SS**Hα-helixtrans-72-43.9177.8-170.475.6110.200111.6L422 R423 S424 N428 S429L422-M426 WeakPolarHBondContact O-CB 3.5Å; L422-M426 PolarHBondContact O-N 3.47Å; R423-M426 PolarHBondContact O-N 2.84Å; S424-M426 PolarHBondContact O-N 3.43Å; M426-N428 VanDerWaalsContact C-N 3.34Å; M426-S429 PolarHBondContact O-N 2.98Å
427D70.5Confident67.6Low87 Ų87119.1 Ų119.147%0.46564%0.636SS.*Hα-helixtrans-74.2-28.1-176.1-62.7-15.5000111.5R423 S429R423-D427 WeakPolarHBondContact CG-OD2 3.29Å; R423-D427 WeakPolarHBondContact O-CB 3.44Å; R423-D427 VanDerWaalsContact O-CG 3.24Å; R423-D427 PolarHBondContact O-N 3.24Å; D427-S429 VanDerWaalsContact C-N 3.3Å; D427-S429 PolarHBondContact O-N 3.29Å
428N61.9Low65.5Low108 Ų108119.7 Ų119.758%0.57864%0.64SS**THydrogen-bonded Turntrans-78.5-9.6176.5-61.34000113.4S424 M426 T430S424-N428 VanDerWaalsContact O-CB 3.23Å; S424-N428 WeakPolarHBondContact O-CB 3.3Å; S424-N428 PolarHBondContact O-N 3.47Å; S424-N428 PolarHBondContact O-ND2 3.46Å; S424-N428 PolarHBondContact O-OD1 2.88Å; S424-N428 PolarHBondContact OG-ND2 3.45Å; M426-N428 VanDerWaalsContact C-N 3.34Å; N428-T430 VanDerWaalsContact C-N 3.34Å
429S58.5Low62.9Low100 Ų100119.3 Ų119.370%0.69965%0.645SS**THydrogen-bonded Turntrans-83.5-5.6-179.1-700000114M425 M426 D427M425-S429 PolarHBondContact O-OG 3.45Å; M426-S429 PolarHBondContact O-N 2.98Å; D427-S429 VanDerWaalsContact C-N 3.3Å; D427-S429 PolarHBondContact O-N 3.29Å
430T55.4Low60.7Low129 Ų129122.2 Ų122.279%0.79166%0.664SS**SBendtrans-125.77.8-176.760.30000115.3N428N428-T430 VanDerWaalsContact C-N 3.34Å
431S46.4Very low58.5Low81 Ų81127.4 Ų127.457%0.56668%0.682SS**  trans-125.991.8171.150.20000109.3
432G47.4Very low56.5Low67 Ų67128 Ų12869%0.69169%0.689SS**  trans-69.3136.2156.300000107.4
433E53.6Low54.5Low176 Ų176130.3 Ų130.382%0.82270%0.702SS**  trans95.7146.5175.689.4-147.514400117.4
434E49.3Very low52.9Low179 Ų179127.7 Ų127.784%0.83671%0.709SS**  trans7366.1175.352.1-168.4176.300120.8S436E434-S436 PolarHBondContact O-N 2.97Å
435K43.1Very low51.2Low194 Ų194128 Ų12884%0.84372%0.722SS**  trans-17113.7132.6-169.8176.6-172.5176.90114.4
436S43.2Very low49.7Very low109 Ų109130.9 Ų130.976%0.76274%0.739SS**  trans-150.289.6155.8-79.40000110.4E434 S438E434-S436 PolarHBondContact O-N 2.97Å; S436-S438 PolarHBondContact O-N 3.42Å
437Q45.1Very low48.1Very low165 Ų165127.9 Ų127.977%0.77174%0.742SS**  trans-55.2115.6150-91.1170.4-94.200107.4
438S48.5Very low47.1Very low93 Ų93130.3 Ų130.365%0.6576%0.763SS**  trans-117.391.7154.546.60000107.2S436 N440S436-S438 PolarHBondContact O-N 3.42Å; S438-N440 PolarHBondContact O-N 3.38Å
439D38.2Very low46.1Very low136 Ų136127.9 Ų127.973%0.72776%0.763SS**  trans-62.8101.5156.2-81.3-48.2000107.4H441D439-H441 PolarHBondContact O-N 3.06Å
440N46.4Very low45.9Very low155 Ų155133 Ų13383%0.82977%0.767SS**  trans-93.980.6162.3-70.7-39.7000107.7S438S438-N440 PolarHBondContact O-N 3.38Å
441H40.2Very low45.7Very low168 Ų168134.4 Ų134.478%0.77877%0.765SS**  trans-90.199.6161.3169.6-79.4000107.6D439D439-H441 PolarHBondContact O-N 3.06Å
442L44.2Very low46Very low152 Ų152137 Ų13780%0.79677%0.772SS**  trans-169106.5153.2-73-167.5000105.6
443D43.6Very low46.6Very low146 Ų146141.4 Ų141.478%0.78178%0.778SS**  98.6139.884.9-172.729.1000111
444S44.7Very low46.6Very low112 Ų112144.6 Ų144.678%0.78378%0.783SS**  trans79.7106-171.7-39.40000114.3
445G40.4Very low46.9Very low67 Ų67141 Ų14169%0.69178%0.777SS**  cis130.2125.52400000107.7
446L46.8Very low47.8Very low192 Ų192137.1 Ų137.1100%1.00577%0.772SS**  trans74.6124.1172.5-41.5174.2000114.5
447G43.3Very low47.9Very low70 Ų70141.9 Ų141.972%0.72278%0.779SS**  cis-176.4176.611.800000108.5
448P48.7Very low48.2Very low138 Ų138143.9 Ų143.990%0.89678%0.78SS**  trans-103.3175.1-137.738.7-35000114.8
449G41.4Very low48.5Very low57 Ų57147.8 Ų147.859%0.58879%0.785SS**  trans107.988.1149.900000116.1
450R54.9Low48.9Very low208 Ų208147.6 Ų147.679%0.78579%0.791SS**  trans179.2105.2133.653.9-169.4178.4-83-3.2108.6D452R450-D452 PolarHBondContact O-N 2.87Å
451E49.9Very low49.1Very low157 Ų157146.7 Ų146.773%0.73479%0.786SS**  trans-58.193.816644.8-82.5177.900111.6I453E451-I453 HydrophobicContact CB-CG1 4.49Å; E451-I453 HydrophobicContact CG-CD1 4.48Å; E451-I453 PolarHBondContact O-N 3.37Å
452D52.8Low49.3Very low136 Ų136144.8 Ų144.873%0.72779%0.792SS**  trans-79.499.8163.3-74.1-29.7000109R450 W454R450-D452 PolarHBondContact O-N 2.87Å; D452-W454 PolarHBondContact O-N 3.31Å
453I59.9Low49.3Very low159 Ų159141.5 Ų141.582%0.81578%0.782SS**  trans-659.4-171.5-72.9148000115.1E451E451-I453 HydrophobicContact CB-CG1 4.49Å; E451-I453 HydrophobicContact CG-CD1 4.48Å; E451-I453 PolarHBondContact O-N 3.37Å
454W55.1Low49.6Very low243 Ų243140.7 Ų140.792%0.9279%0.785SS**  trans-105.925.3-169.9-136-56.1000116.9D452 P456D452-W454 PolarHBondContact O-N 3.31Å; W454-P456 WeakPolarHBondContact O-CD 3.33Å
455S53.9Low49.9Very low103 Ų103143.5 Ų143.572%0.7279%0.785SS**  trans-110.4107.6173.9-68.40000111.9K457S455-K457 PolarHBondContact O-N 3.48Å
456P62.1Low50.6Low114 Ų114144 Ų14474%0.7478%0.778SS**  trans-61.5110.2169-21.432.8000110.1W454 R458W454-P456 WeakPolarHBondContact O-CD 3.33Å; P456-R458 PolarHBondContact O-N 3.43Å
457K45.1Very low50.9Low209 Ų209141.9 Ų141.991%0.90977%0.767SS**  trans-56.7107.5170.3-79.2-162175.8-175.20109.5S455S455-K457 PolarHBondContact O-N 3.48Å
458R53Low51.7Low206 Ų206142.7 Ų142.778%0.77775%0.753SS**  trans-94.1114.6160.6-73.5-170.4-70.3162.3-1.7108.6P456P456-R458 PolarHBondContact O-N 3.43Å
459K53.3Low52.2Low176 Ų176145.8 Ų145.877%0.76575%0.753SS**  trans-60140.5168.5-70.5179.9175.8176.40109.3N461K459-N461 PolarHBondContact O-N 3.28Å; K459-N461 VanDerWaalsContact O-N 3.09Å
460P48.2Very low53.3Low132 Ų132144.4 Ų144.486%0.85774%0.739SS**  trans-80.391.117732.6-30.2000108.9
461N50Low53.8Low135 Ų135140.5 Ų140.572%0.72273%0.73SS**  trans-106.3117.5168.3-63.813.4000107.4K459 S463K459-N461 PolarHBondContact O-N 3.28Å; K459-N461 VanDerWaalsContact O-N 3.09Å; N461-S463 PolarHBondContact O-N 2.69Å; N461-S463 VanDerWaalsContact O-N 3.11Å
462S43.7Very low54.6Low128 Ų128139.2 Ų139.290%0.89572%0.723SS**  trans-51.3105.1176.952.40000112.6
463S44.3Very low55.5Low83 Ų83138.8 Ų138.858%0.5872%0.719SS**  trans-164.5128.8156.4-173.30000109.6N461 H465N461-S463 PolarHBondContact O-N 2.69Å; N461-S463 VanDerWaalsContact O-N 3.11Å; S463-H465 VanDerWaalsContact C-N 3.25Å; S463-H465 PolarHBondContact O-N 2.89Å
464P49.4Very low56.1Low130 Ų130137.5 Ų137.584%0.84471%0.714SS**  trans-83.571.1179.536.1-31.8000109.3
465H51.4Low56.8Low170 Ų170136.8 Ų136.879%0.78771%0.711SS**  trans-104.790.9159.9-83.9-81.6000107.7S463 L467S463-H465 VanDerWaalsContact C-N 3.25Å; S463-H465 PolarHBondContact O-N 2.89Å; H465-L467 PolarHBondContact O-N 3.35Å
466S54.4Low57.7Low77 Ų77138.1 Ų138.154%0.53872%0.717SS.*  trans-52126.3166.354.80000108.5I468S466-I468 VanDerWaalsContact C-N 3.32Å; S466-I468 PolarHBondContact O-N 2.97Å; S466-I468 VanDerWaalsContact OG-CD1 3.26Å; S466-I468 WeakPolarHBondContact OG-CD1 3.48Å
467L54.6Low58.1Low148 Ų148139 Ų13978%0.77572%0.72SS**  trans-5196.4170.1-71.3159.6000109H465H465-L467 PolarHBondContact O-N 3.35Å
468I58.9Low58.7Low87 Ų87136.4 Ų136.445%0.44672%0.716SS.*  trans-104.381.6-177.2-98.3157.8000106.6S466 Q471S466-I468 VanDerWaalsContact C-N 3.32Å; S466-I468 PolarHBondContact O-N 2.97Å; S466-I468 VanDerWaalsContact OG-CD1 3.26Å; S466-I468 WeakPolarHBondContact OG-CD1 3.48Å; I468-Q471 HydrophobicContact CG1-CB 3.94Å
469F59.8Low59.2Low204 Ų204138.2 Ų138.290%0.89572%0.723SS**SBendtrans-109.9122.4155.8-156.5-94.9000107.4Q471F469-Q471 PolarHBondContact O-N 3.4Å
470G65Low59.7Low27 Ų27140.3 Ų140.328%0.27873%0.726SS.*SBendtrans89.4-22.5179.500000117.2H472 I473G470-H472 VanDerWaalsContact C-N 3.34Å; G470-H472 PolarHBondContact O-N 3.24Å; G470-I473 PolarHBondContact O-N 3.18Å
471Q64.2Low60.8Low127 Ų127139.5 Ų139.559%0.59372%0.721SS**G310 helixtrans-71.6-24.8-179.9-98.1177.72.500114I468 F469 I473 L474I468-Q471 HydrophobicContact CG1-CB 3.94Å; F469-Q471 PolarHBondContact O-N 3.4Å; Q471-I473 VanDerWaalsContact C-N 3.28Å; Q471-I473 PolarHBondContact O-N 3.39Å; Q471-L474 PolarHBondContact O-N 3Å
472H66.6Low61.4Low129 Ų129140.7 Ų140.760%0.59773%0.727SS**G310 helixtrans-74.7-15.7174.859.3-96.5000113.3G470 L474G470-H472 VanDerWaalsContact C-N 3.34Å; G470-H472 PolarHBondContact O-N 3.24Å; H472-L474 VanDerWaalsContact C-N 3.29Å
473I72Confident62.3Low127 Ų127144.1 Ų144.165%0.65173%0.726SS**G310 helixtrans-76.3-23.6176.6-50.5177.7000110.5G470 Q471 R475G470-I473 PolarHBondContact O-N 3.18Å; Q471-I473 VanDerWaalsContact C-N 3.28Å; Q471-I473 PolarHBondContact O-N 3.39Å; I473-R475 PolarHBondContact O-N 3.49Å
474L72.9Confident63.1Low133 Ų133144.8 Ų144.870%0.69674%0.736SS**SBendtrans-90.295.5176.5-60.3177.9000109.5Q471 H472 P476Q471-L474 PolarHBondContact O-N 3Å; H472-L474 VanDerWaalsContact C-N 3.29Å; L474-P476 WeakPolarHBondContact O-CD 3.37Å
475R69.6Low63.1Low227 Ų227150 Ų15086%0.85776%0.757SS**  trans-54.4126.4168.4-79.3-179.1176.2158.3-0.3109.6I473 V477I473-R475 PolarHBondContact O-N 3.49Å; R475-V477 PolarHBondContact O-N 3.22Å
476P73.1Confident63.6Low131 Ų131149 Ų14985%0.85176%0.755SS**  trans-61.4112.3170.2-18.630.1000109.5L474 N478L474-P476 WeakPolarHBondContact O-CD 3.37Å; P476-N478 PolarHBondContact O-N 3.02Å
477V70.3Confident64.1Low132 Ų132152.7 Ų152.780%0.877%0.767SS**  trans-77.1111172.31750000108.2R475 R479R475-V477 PolarHBondContact O-N 3.22Å; V477-R479 PolarHBondContact O-N 3.33Å
478N57.4Low64.7Low155 Ų155153 Ų15383%0.82977%0.766SS**  trans20.382.8161.9-94.5-25.4000116.6P476P476-N478 PolarHBondContact O-N 3.02Å
479R65Low65Low244 Ų244156.9 Ų156.992%0.92179%0.785SS**  trans-84.7108.4152.2-66.1-171.7-175.8158.41.3107.2V477V477-R479 PolarHBondContact O-N 3.33Å
480R62.8Low65.3Low220 Ų220153.9 Ų153.983%0.8378%0.778SS**  trans-61.5131.6169.7-76.4-176.1178.6135.7-0.2108.2D482R480-D482 PolarHBondContact O-N 3.14Å
481P71.6Confident65.3Low115 Ų115162.4 Ų162.475%0.74781%0.812SS**  trans-72.5115.1164.728.1-28.9000107.9K483P481-K483 PolarHBondContact O-N 3.5Å
482D62.3Low65.4Low161 Ų161164.9 Ų164.986%0.86183%0.827SS**  trans-63.5104.6163.7-69.5-32.7000107.4R480 A484R480-D482 PolarHBondContact O-N 3.14Å; D482-A484 PolarHBondContact O-N 3.41Å
483K63.2Low65.3Low200 Ų200167.7 Ų167.787%0.8785%0.845SS**  trans-74.9103.3164.6-87.1-179.7174178.30107.1P481P481-K483 PolarHBondContact O-N 3.5Å
484A61.1Low64.8Low96 Ų96171.1 Ų171.179%0.79386%0.861SS**  trans-63.5127.2156.500000108.9D482D482-A484 PolarHBondContact O-N 3.41Å
485N48.2Very low64Low239 Ų239174.5 Ų174.5100%1.27888%0.876SS**  trans-151.50154.7-121.412.2000107.4

Retrieved 485 of 485 residues in 392.8 ms (Link to these results)