A0A087Y1E7_POEFO Loading...

Tpd52 like 2b

AlphaFold DB , UniProt , Accession A0A087Y1E7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 203 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M43.1Very low53.2Low240 Ų240151.6 Ų151.6100%1.18284%0.84SS**  0880-78.9-76-175.800105.6
2D49.8Very low53.2Low164 Ų164147.3 Ų147.388%0.87783%0.828SS**PPolyproline II helixtrans-92.8128.6172.2-89.1-63.5000108.3
3P57Low53Low114 Ų114145.7 Ų145.774%0.7483%0.828SS**PPolyproline II helixtrans-85.5126.9169.231.2-27.6000110.5S5P3-S5 PolarHBondContact O-N 3.2Å
4A49.9Very low52.5Low95 Ų95147.2 Ų147.279%0.78583%0.833SS**PPolyproline II helixtrans-57.5126.2176.100000112.2
5S57.3Low52.6Low112 Ų112151.5 Ų151.578%0.78384%0.838SS**  trans-92.6114.2161.3-58.80000108.2P3P3-S5 PolarHBondContact O-N 3.2Å
6Q59.2Low51.8Low167 Ų167146.4 Ų146.478%0.7883%0.831SS**  trans-129.785.4166.6-79-171.7-21.200108.3I8Q6-I8 PolarHBondContact O-N 3.49Å
7D55Low51.2Low162 Ų162147.4 Ų147.487%0.86683%0.833SS**  trans-80.1103.8164.5-71.3-58.3000108.6
8I60.2Low50.5Low153 Ų153145.1 Ų145.179%0.78583%0.828SS**  trans-108.7102.1172.833.7172.5000110.5Q6Q6-I8 PolarHBondContact O-N 3.49Å
9N48.6Very low50.5Low143 Ų143147.2 Ų147.277%0.76583%0.833SS**  trans62.394.3132.8-158.9-14000118.2
10L56.6Low50.2Low170 Ų170146.2 Ų146.289%0.8983%0.825SS**  trans-98106.7161.3-66.5173.4000109.9
11N48.9Very low50.1Low148 Ų148144.9 Ų144.979%0.79182%0.823SS**  trans56.798.3139.5-162.952.6000117.7
12S52.4Low50.5Low99 Ų99138.6 Ų138.669%0.69280%0.802SS**  trans-56.8146.4168.4-71.10000113.4N14S12-N14 PolarHBondContact O-N 3.07Å
13P51.8Low50.4Low127 Ų127137.2 Ų137.283%0.82580%0.795SS**  trans-83.1116.1177.832.6-29.2000109.9
14N44.8Very low49.9Very low167 Ų167140 Ų14089%0.89380%0.803SS**  trans-113.793161.3-163.327.8000109.4S12S12-N14 PolarHBondContact O-N 3.07Å
15K55.1Low49.9Very low212 Ų212143.6 Ų143.692%0.92281%0.806SS**  trans-153.9107.3165.3-149.2177.1-170.8-179.20109.7
16G39.6Very low49.5Very low70 Ų70143 Ų14372%0.72281%0.808SS**  trans169.648.1175.300000113.1S18G16-S18 PolarHBondContact O-N 3.34Å; G16-S18 VanDerWaalsContact O-N 3.13Å
17N41.7Very low48.7Very low162 Ų162142.5 Ų142.587%0.86681%0.811SS**  trans-73102.5165.8-154.185.7000106.8M19N17-M19 PolarHBondContact O-N 3Å
18S39Very low48.5Very low106 Ų106141.6 Ų141.674%0.74181%0.806SS**  trans-53.3120175.745.20000110.5G16 D20G16-S18 PolarHBondContact O-N 3.34Å; G16-S18 VanDerWaalsContact O-N 3.13Å; S18-D20 PolarHBondContact O-N 3.25Å
19M48.8Very low47.5Very low185 Ų185143.5 Ų143.591%0.91181%0.811SS**  trans-77.8111.4167.3-141.486.6168.700107.2N17N17-M19 PolarHBondContact O-N 3Å
20D44.6Very low47.3Very low127 Ų127141 Ų14168%0.67981%0.811SS**  trans-147.9123.2155.2-168.515.9000107.3S18 S22S18-D20 PolarHBondContact O-N 3.25Å; D20-S22 PolarHBondContact OD1-N 3.47Å
21P49.7Very low46.5Very low120 Ų120142.6 Ų142.678%0.77981%0.814SS**  -141.2101.1119.432.3-15.1000111.3
22S49.9Very low45.8Very low107 Ų107139.1 Ų139.175%0.74881%0.812SS**  trans-86.385.8150.6-60.80000108.6D20D20-S22 PolarHBondContact OD1-N 3.47Å
23D49.4Very low45.5Very low136 Ų136139.5 Ų139.573%0.72782%0.822SS**  trans-162100.2152.6-125.2-10.5000109.9
24N44.6Very low45Very low171 Ų171137.8 Ų137.891%0.91482%0.818SS**  trans-156.284.1150.9-13017.2000108.6
25M50.8Low45Very low171 Ų171135 Ų13584%0.84282%0.818SS**  trans-61.9138.7166-72-101.1-177.100109.5
26A48.5Very low44.6Very low99 Ų99131.8 Ų131.882%0.81881%0.811SS**  trans-61.6143.1173.900000112.1
27D42.8Very low45.2Very low158 Ų158134.7 Ų134.785%0.84582%0.821SS**  trans-148.3127.5142.1-158.532.3000109.7
28D50Low45.7Very low143 Ų143130.8 Ų130.877%0.76581%0.811SS**  trans-64.5142.2-179.7-80.4-61.1000111.9
29Q38.9Very low46.5Very low192 Ų192134 Ų13490%0.89781%0.814SS**  trans-154.6103132.7-73.7-152.8-5.300112.5
30A45.7Very low47Very low92 Ų92130.9 Ų130.976%0.7681%0.807SS**  44.9127129.700000123
31E39.2Very low47.6Very low203 Ų203127.8 Ų127.895%0.94979%0.79SS**  trans79.6130.1142.3-96.5-158.7137.200121
32G34.8Very low48.4Very low74 Ų74125.8 Ų125.876%0.76378%0.777SS**  trans123.881.4148.800000115.6
33A45.9Very low49Very low107 Ų107127.5 Ų127.588%0.88479%0.786SS**  trans-2.7121.9155.600000118.9
34A40.8Very low49.6Very low91 Ų91124.8 Ų124.875%0.75279%0.79SS**  155.788.6127.700000109.6N36A34-N36 PolarHBondContact O-N 3.03Å
35A45Very low50.3Low108 Ų108119.7 Ų119.789%0.89376%0.762SS**  trans-72.382.3165.400000109.2
36N46.6Very low51.6Low146 Ų146115.4 Ų115.478%0.78175%0.746SS**  trans-102.2103.1152.6-88.2-9.1000106.4A34 A38A34-N36 PolarHBondContact O-N 3.03Å; N36-A38 PolarHBondContact O-N 3.23Å
37S52.7Low52.8Low131 Ų131115.5 Ų115.592%0.91673%0.729SS**  trans-69.172.5167.3510000109.5
38A52.7Low54.5Low80 Ų80115.6 Ų115.666%0.66173%0.725SS**PPolyproline II helixtrans-89.4118.8161.500000107N36N36-A38 PolarHBondContact O-N 3.23Å
39H55.3Low56Low174 Ų174113.2 Ų113.281%0.80671%0.709SS**PPolyproline II helixtrans-48.5126.7162.4-108.833.1000108.5L41H39-L41 PolarHBondContact O-N 3.23Å
40P59.4Low57.9Low118 Ų118104.5 Ų104.577%0.76667%0.669SS**PPolyproline II helixtrans-63.5130.1177.4-11.224.9000108.2
41L57.6Low59.7Low63 Ų63105.5 Ų105.533%0.3366%0.658SS.*PPolyproline II helixtrans-57.4140.1173.3-71137000109.5H39 E47 A50H39-L41 PolarHBondContact O-N 3.23Å; L41-E47 WeakPolarHBondContact CD1-OE2 3.47Å; L41-A50 HydrophobicContact CD2-CB 3.34Å
42P66.6Low62Low77 Ų77102.3 Ų102.350%0.564%0.644SS.*PPolyproline II helixtrans-58.4139.6174.723.3-31000110G44 L45P42-G44 PolarHBondContact O-N 2.73Å; P42-L45 HydrophobicContact CG-CB 4.41Å; P42-L45 HydrophobicContact CG-CD1 4.46Å; P42-L45 PolarHBondContact O-N 2.97Å
43P62.5Low64.7Low143 Ų143103.2 Ų103.293%0.92963%0.631SS**THydrogen-bonded Turntrans-60.5116.1-176.7-1828.8000110.7
44G62Low66.8Low79 Ų79104.3 Ų104.381%0.81461%0.612SS**THydrogen-bonded Turntrans114-4.1175.400000116.4P42P42-G44 PolarHBondContact O-N 2.73Å
45L59.4Low69.4Low65 Ų65106 Ų10634%0.3461%0.608SS.*  trans-93.7132.5170-11185.3000110.9P42 E49 A50 L53P42-L45 HydrophobicContact CG-CB 4.41Å; P42-L45 HydrophobicContact CG-CD1 4.46Å; P42-L45 PolarHBondContact O-N 2.97Å; L45-E49 HydrophobicContact CD2-CB 4.25Å; L45-E49 HydrophobicContact CG-CB 4.31Å; L45-A50 HydrophobicContact CD2-CB 4.06Å; L45-L53 HydrophobicContact CD2-CD1 3.68Å
46T77.3Confident71.8Confident80 Ų80106.3 Ų106.349%0.49159%0.591SS.*  trans-73153.3167.162.70000110.1E48 E49 A50T46-E48 PolarHBondContact O-N 2.9Å; T46-E49 PolarHBondContact N-OE2 3.31Å; T46-E49 PolarHBondContact O-N 2.92Å; T46-E49 VanDerWaalsContact OG1-CG 3.27Å; T46-E49 WeakPolarHBondContact OG1-CG 3.5Å; T46-E49 PolarHBondContact OG1-OE2 3.16Å; T46-A50 PolarHBondContact O-N 2.77Å; T46-A50 VanDerWaalsContact O-N 3.15Å
47E73.9Confident74.1Confident102 Ų102104.1 Ų104.148%0.47758%0.578SS.*Hα-helixtrans-56.3-37.4-179.2-170.469.5-128.400111.8L41 A50 E51L41-E47 WeakPolarHBondContact CD1-OE2 3.47Å; E47-A50 WeakPolarHBondContact O-CB 3.27Å; E47-A50 PolarHBondContact O-N 3.34Å; E47-E51 PolarHBondContact O-N 3.15Å
48E77.8Confident76.2Confident160 Ų160101.1 Ų101.175%0.74856%0.555SS**Hα-helixtrans-66.9-41.1-178.5-163.1163.6-174.800112.2T46 A50 E51 E52T46-E48 PolarHBondContact O-N 2.9Å; E48-A50 VanDerWaalsContact C-N 3.32Å; E48-A50 PolarHBondContact O-N 3.46Å; E48-E51 PolarHBondContact O-N 2.95Å; E48-E52 PolarHBondContact O-N 3.43Å
49E81.7Confident78.4Confident93 Ų93103.2 Ų103.244%0.43555%0.549SS..Hα-helixtrans-66.3-34.8173.6-68.9166.3139.100111.9L45 T46 E52 L53L45-E49 HydrophobicContact CD2-CB 4.25Å; L45-E49 HydrophobicContact CG-CB 4.31Å; T46-E49 PolarHBondContact N-OE2 3.31Å; T46-E49 PolarHBondContact O-N 2.92Å; T46-E49 VanDerWaalsContact OG1-CG 3.27Å; T46-E49 WeakPolarHBondContact OG1-CG 3.5Å; T46-E49 PolarHBondContact OG1-OE2 3.16Å; E49-E52 PolarHBondContact O-N 3.4Å; E49-L53 WeakPolarHBondContact O-CG 3.3Å; E49-L53 PolarHBondContact O-N 3.42Å
50A79.3Confident80.4Confident8 Ų897.9 Ų97.97%0.06653%0.528CS..Hα-helixtrans-69.9-34.7177.300000112.2L41 L45 T46 E47 E48 R54L41-A50 HydrophobicContact CD2-CB 3.34Å; L45-A50 HydrophobicContact CD2-CB 4.06Å; T46-A50 PolarHBondContact O-N 2.77Å; T46-A50 VanDerWaalsContact O-N 3.15Å; E47-A50 WeakPolarHBondContact O-CB 3.27Å; E47-A50 PolarHBondContact O-N 3.34Å; E48-A50 VanDerWaalsContact C-N 3.32Å; E48-A50 PolarHBondContact O-N 3.46Å; A50-R54 VanDerWaalsContact O-CG 3.32Å; A50-R54 WeakPolarHBondContact O-CG 3.11Å; A50-R54 PolarHBondContact O-N 3.26Å
51E83.4Confident82.2Confident113 Ų11397.5 Ų97.553%0.52852%0.516SS..Hα-helixtrans-68.9-42172.4-71.6-174.2176.300112E47 E48 L53 R54 L55E47-E51 PolarHBondContact O-N 3.15Å; E48-E51 PolarHBondContact O-N 2.95Å; E51-L53 PolarHBondContact O-N 3.5Å; E51-R54 PolarHBondContact O-N 3.25Å; E51-L55 PolarHBondContact O-N 3.03Å; E51-L55 VanDerWaalsContact O-N 3.07Å
52E86.8Confident84.2Confident136 Ų136100.4 Ų100.464%0.63653%0.528SS*.Hα-helixtrans-61-45176.4-171.4175.1-166.700111.8E48 E49 R54 L55 E56E48-E52 PolarHBondContact O-N 3.43Å; E49-E52 PolarHBondContact O-N 3.4Å; E52-R54 VanDerWaalsContact C-N 3.29Å; E52-R54 PolarHBondContact O-N 3.23Å; E52-L55 WeakPolarHBondContact O-CB 3.32Å; E52-L55 PolarHBondContact O-N 3Å; E52-L55 VanDerWaalsContact O-N 3.16Å; E52-E56 PolarHBondContact O-N 3.29Å
53L92.3Very high85.7Confident94 Ų94101.5 Ų101.549%0.49253%0.527SS..Hα-helixtrans-62.6-33.9176.2-73.6174.2000112.9L45 E49 E51 L57L45-L53 HydrophobicContact CD2-CD1 3.68Å; E49-L53 WeakPolarHBondContact O-CG 3.3Å; E49-L53 PolarHBondContact O-N 3.42Å; E51-L53 PolarHBondContact O-N 3.5Å; L53-L57 WeakPolarHBondContact O-CB 3.42Å; L53-L57 PolarHBondContact O-N 2.89Å
54R89.8Confident87.4Confident129 Ų12998.1 Ų98.149%0.48750%0.5SS..Hα-helixtrans-68.1-39175.3-75.5177-176.2117.7-3.7111.6A50 E51 E52 T58A50-R54 VanDerWaalsContact O-CG 3.32Å; A50-R54 WeakPolarHBondContact O-CG 3.11Å; A50-R54 PolarHBondContact O-N 3.26Å; E51-R54 PolarHBondContact O-N 3.25Å; E52-R54 VanDerWaalsContact C-N 3.29Å; E52-R54 PolarHBondContact O-N 3.23Å; R54-T58 WeakPolarHBondContact O-CB 3.5Å; R54-T58 PolarHBondContact O-N 2.9Å; R54-T58 PolarHBondContact O-OG1 3.34Å
55L94.6Very high89.1Confident127 Ų12798.3 Ų98.367%0.66548%0.482SS*.Hα-helixtrans-66.1-45.9175.3-73168.3000111.4E51 E52 T58 K59E51-L55 PolarHBondContact O-N 3.03Å; E51-L55 VanDerWaalsContact O-N 3.07Å; E52-L55 WeakPolarHBondContact O-CB 3.32Å; E52-L55 PolarHBondContact O-N 3Å; E52-L55 VanDerWaalsContact O-N 3.16Å; L55-T58 PolarHBondContact O-N 2.89Å; L55-K59 PolarHBondContact O-N 3.24Å
56E95.8Very high91Very high115 Ų11598.9 Ų98.954%0.53749%0.489SS..Hα-helixtrans-62.6-44.1176.9-172.4175.8-170.100111.3E52 T58 K59 V60E52-E56 PolarHBondContact O-N 3.29Å; E56-T58 VanDerWaalsContact C-N 3.33Å; E56-T58 PolarHBondContact O-N 3.25Å; E56-K59 PolarHBondContact O-N 2.96Å; E56-V60 HydrophobicContact CG-CG2 4.39Å; E56-V60 WeakPolarHBondContact O-CG2 3.43Å; E56-V60 PolarHBondContact O-N 3.45Å
57L95.4Very high92Very high100 Ų100100.7 Ų100.752%0.52450%0.495SS..Hα-helixtrans-57.2-48175.3-17963.8000111.2L53 K59 V60 E61L53-L57 WeakPolarHBondContact O-CB 3.42Å; L53-L57 PolarHBondContact O-N 2.89Å; L57-K59 VanDerWaalsContact C-N 3.33Å; L57-K59 PolarHBondContact O-N 3.27Å; L57-V60 PolarHBondContact O-N 3.05Å; L57-E61 HydrophobicContact CD1-CG 4.45Å; L57-E61 WeakPolarHBondContact O-CB 3.47Å; L57-E61 VanDerWaalsContact O-CG 3.31Å; L57-E61 WeakPolarHBondContact O-CG 3.31Å; L57-E61 PolarHBondContact O-N 2.94Å
58T96.9Very high93.2Very high68 Ų68104.1 Ų104.142%0.41750%0.503SS..Hα-helixtrans-58.4-46178.2-56.80000111R54 L55 E56 E61 E62R54-T58 WeakPolarHBondContact O-CB 3.5Å; R54-T58 PolarHBondContact O-N 2.9Å; R54-T58 PolarHBondContact O-OG1 3.34Å; L55-T58 PolarHBondContact O-N 2.89Å; E56-T58 VanDerWaalsContact C-N 3.33Å; E56-T58 PolarHBondContact O-N 3.25Å; T58-E61 PolarHBondContact O-N 2.89Å; T58-E62 WeakPolarHBondContact O-CG 3.46Å; T58-E62 PolarHBondContact O-N 3.41Å
59K97.9Very high94.1Very high124 Ų124102.4 Ų102.454%0.53950%0.495SS..Hα-helixtrans-62.1-45177.6-177.1-174.3174.5-1680112.1L55 E56 L57 E61 E62 E63L55-K59 PolarHBondContact O-N 3.24Å; E56-K59 PolarHBondContact O-N 2.96Å; L57-K59 VanDerWaalsContact C-N 3.33Å; L57-K59 PolarHBondContact O-N 3.27Å; K59-E61 VanDerWaalsContact C-N 3.3Å; K59-E61 PolarHBondContact O-N 2.87Å; K59-E62 WeakPolarHBondContact O-CB 3.45Å; K59-E62 PolarHBondContact O-N 2.92Å; K59-E63 VanDerWaalsContact CE-OE1 3.3Å; K59-E63 WeakPolarHBondContact CE-OE1 3.35Å; K59-E63 WeakPolarHBondContact O-CG 3.2Å; K59-E63 PolarHBondContact O-N 3.3Å
60V98.3Very high95Very high61 Ų61101.5 Ų101.537%0.3750%0.496SS..Hα-helixtrans-63-39.1177.7170.20000110.8E56 L57 E62 E63 I64E56-V60 HydrophobicContact CG-CG2 4.39Å; E56-V60 WeakPolarHBondContact O-CG2 3.43Å; E56-V60 PolarHBondContact O-N 3.45Å; L57-V60 PolarHBondContact O-N 3.05Å; V60-E62 PolarHBondContact O-N 2.84Å; V60-E63 PolarHBondContact O-N 3.37Å; V60-I64 HydrophobicContact CG1-CD1 3.87Å; V60-I64 HydrophobicContact CG1-CG1 4.4Å; V60-I64 WeakPolarHBondContact O-CB 3.34Å; V60-I64 VanDerWaalsContact O-CG1 3.24Å; V60-I64 WeakPolarHBondContact O-CG1 3.28Å; V60-I64 PolarHBondContact O-N 3.1Å
61E97.7Very high95.9Very high110 Ų110106 Ų10651%0.51452%0.518SS..Hα-helixtrans-63-40175.3-73.5179.2156.600112.5L57 T58 K59 I64 N65L57-E61 HydrophobicContact CD1-CG 4.45Å; L57-E61 WeakPolarHBondContact O-CB 3.47Å; L57-E61 VanDerWaalsContact O-CG 3.31Å; L57-E61 WeakPolarHBondContact O-CG 3.31Å; L57-E61 PolarHBondContact O-N 2.94Å; T58-E61 PolarHBondContact O-N 2.89Å; K59-E61 VanDerWaalsContact C-N 3.3Å; K59-E61 PolarHBondContact O-N 2.87Å; E61-I64 PolarHBondContact O-N 3.02Å; E61-N65 WeakPolarHBondContact O-CB 3.44Å; E61-N65 PolarHBondContact O-N 3.17Å
62E98.1Very high96.6Very high124 Ų124102.4 Ų102.458%0.57951%0.506SS*.Hα-helixtrans-65.1-43.1173.9-71.5178171.800112.4T58 K59 V60 N65 T66T58-E62 WeakPolarHBondContact O-CG 3.46Å; T58-E62 PolarHBondContact O-N 3.41Å; K59-E62 WeakPolarHBondContact O-CB 3.45Å; K59-E62 PolarHBondContact O-N 2.92Å; V60-E62 PolarHBondContact O-N 2.84Å; E62-N65 PolarHBondContact O-N 2.82Å; E62-T66 WeakPolarHBondContact O-CB 3.42Å; E62-T66 PolarHBondContact O-N 2.98Å; E62-T66 PolarHBondContact O-OG1 3.05Å
63E98.3Very high97.1Very high101 Ų10198.4 Ų98.447%0.47250%0.496SS..Hα-helixtrans-62.2-44.3174.6-73.2-179.4-166.900111.1K59 V60 N65 T66 L67K59-E63 VanDerWaalsContact CE-OE1 3.3Å; K59-E63 WeakPolarHBondContact CE-OE1 3.35Å; K59-E63 WeakPolarHBondContact O-CG 3.2Å; K59-E63 PolarHBondContact O-N 3.3Å; V60-E63 PolarHBondContact O-N 3.37Å; E63-N65 VanDerWaalsContact C-N 3.31Å; E63-N65 PolarHBondContact O-N 3.41Å; E63-T66 PolarHBondContact O-N 3.39Å; E63-L67 WeakPolarHBondContact O-CB 3.5Å; E63-L67 VanDerWaalsContact O-CG 3.28Å; E63-L67 WeakPolarHBondContact O-CG 3.49Å; E63-L67 PolarHBondContact O-N 3.07Å
64I98.4Very high97.4Very high72 Ų72100.8 Ų100.837%0.36950%0.502SS..Hα-helixtrans-57.8-45.3174.3-72.7166.2000110.7V60 E61 L67 R68V60-I64 HydrophobicContact CG1-CD1 3.87Å; V60-I64 HydrophobicContact CG1-CG1 4.4Å; V60-I64 WeakPolarHBondContact O-CB 3.34Å; V60-I64 VanDerWaalsContact O-CG1 3.24Å; V60-I64 WeakPolarHBondContact O-CG1 3.28Å; V60-I64 PolarHBondContact O-N 3.1Å; E61-I64 PolarHBondContact O-N 3.02Å; I64-L67 PolarHBondContact O-N 3.47Å; I64-R68 WeakPolarHBondContact O-CG 3.4Å; I64-R68 PolarHBondContact O-N 3.14Å
65N98.4Very high97.7Very high82 Ų82100 Ų10044%0.43950%0.504SS..Hα-helixtrans-62.6-46.8178.9-166-31.1000111E61 E62 E63 L67 R68 Q69E61-N65 WeakPolarHBondContact O-CB 3.44Å; E61-N65 PolarHBondContact O-N 3.17Å; E62-N65 PolarHBondContact O-N 2.82Å; E63-N65 VanDerWaalsContact C-N 3.31Å; E63-N65 PolarHBondContact O-N 3.41Å; N65-L67 VanDerWaalsContact C-N 3.34Å; N65-L67 PolarHBondContact O-N 2.95Å; N65-R68 WeakPolarHBondContact O-CB 3.24Å; N65-R68 PolarHBondContact O-N 3.4Å; N65-Q69 WeakPolarHBondContact O-CG 3.47Å; N65-Q69 PolarHBondContact O-N 3.11Å; N65-Q69 PolarHBondContact OD1-NE2 2.89Å
66T98.4Very high97.8Very high78 Ų78101.4 Ų101.448%0.47950%0.501SS..Hα-helixtrans-58.6-45.9176.8-58.10000111.4E62 E63 R68 Q69 V70E62-T66 WeakPolarHBondContact O-CB 3.42Å; E62-T66 PolarHBondContact O-N 2.98Å; E62-T66 PolarHBondContact O-OG1 3.05Å; E63-T66 PolarHBondContact O-N 3.39Å; T66-R68 VanDerWaalsContact C-N 3.33Å; T66-R68 PolarHBondContact O-N 3.45Å; T66-Q69 WeakPolarHBondContact O-CB 3.34Å; T66-Q69 PolarHBondContact O-N 3.07Å; T66-Q69 VanDerWaalsContact O-N 3.14Å; T66-V70 WeakPolarHBondContact O-CG2 3.47Å; T66-V70 PolarHBondContact O-N 2.88Å
67L98.6Very high97.9Very high118 Ų118101.2 Ų101.262%0.61850%0.499SS*.Hα-helixtrans-61.9-39.4177.4-72174.1000112.2E63 I64 N65 Q69 V70 L71E63-L67 WeakPolarHBondContact O-CB 3.5Å; E63-L67 VanDerWaalsContact O-CG 3.28Å; E63-L67 WeakPolarHBondContact O-CG 3.49Å; E63-L67 PolarHBondContact O-N 3.07Å; I64-L67 PolarHBondContact O-N 3.47Å; N65-L67 VanDerWaalsContact C-N 3.34Å; N65-L67 PolarHBondContact O-N 2.95Å; L67-Q69 VanDerWaalsContact C-N 3.33Å; L67-Q69 PolarHBondContact O-N 3.5Å; L67-V70 PolarHBondContact O-N 3.28Å; L67-L71 VanDerWaalsContact O-CB 3.32Å; L67-L71 WeakPolarHBondContact O-CB 3.46Å; L67-L71 PolarHBondContact O-N 3.24Å
68R98.6Very high97.8Very high173 Ų17398.5 Ų98.565%0.65349%0.492SS*.Hα-helixtrans-61.2-41.6173.5-73.7171.8175.8165.81.3111.9I64 N65 T66 L71 S72I64-R68 WeakPolarHBondContact O-CG 3.4Å; I64-R68 PolarHBondContact O-N 3.14Å; N65-R68 WeakPolarHBondContact O-CB 3.24Å; N65-R68 PolarHBondContact O-N 3.4Å; T66-R68 VanDerWaalsContact C-N 3.33Å; T66-R68 PolarHBondContact O-N 3.45Å; R68-L71 PolarHBondContact O-N 3.33Å; R68-S72 WeakPolarHBondContact O-CB 3.49Å; R68-S72 PolarHBondContact O-N 2.83Å
69Q98.6Very high97.6Very high124 Ų12498.8 Ų98.858%0.57950%0.496SS*.Hα-helixtrans-64.8-45.5176.7-66.5174.924.500111.4N65 T66 L67 L71 S72 A73N65-Q69 WeakPolarHBondContact O-CG 3.47Å; N65-Q69 PolarHBondContact O-N 3.11Å; N65-Q69 PolarHBondContact OD1-NE2 2.89Å; T66-Q69 WeakPolarHBondContact O-CB 3.34Å; T66-Q69 PolarHBondContact O-N 3.07Å; T66-Q69 VanDerWaalsContact O-N 3.14Å; L67-Q69 VanDerWaalsContact C-N 3.33Å; L67-Q69 PolarHBondContact O-N 3.5Å; Q69-L71 VanDerWaalsContact C-N 3.35Å; Q69-L71 PolarHBondContact O-N 2.92Å; Q69-S72 PolarHBondContact O-N 3.35Å; Q69-A73 WeakPolarHBondContact O-CB 3.43Å; Q69-A73 PolarHBondContact O-N 2.98Å
70V98.8Very high97.3Very high75 Ų7596.1 Ų96.146%0.45549%0.486SS..Hα-helixtrans-61.5-43.7176.7171.60000111T66 L67 A73 K74T66-V70 WeakPolarHBondContact O-CG2 3.47Å; T66-V70 PolarHBondContact O-N 2.88Å; L67-V70 PolarHBondContact O-N 3.28Å; V70-A73 WeakPolarHBondContact O-CB 3.46Å; V70-A73 PolarHBondContact O-N 3.25Å; V70-K74 WeakPolarHBondContact O-CG 3.37Å; V70-K74 PolarHBondContact O-N 2.94Å
71L98.4Very high97.2Very high101 Ų10197 Ų9753%0.52949%0.488SS..Hα-helixtrans-61.4-48.7176.6-178.561.8000110.9L67 R68 Q69 A73 K74 E75L67-L71 VanDerWaalsContact O-CB 3.32Å; L67-L71 WeakPolarHBondContact O-CB 3.46Å; L67-L71 PolarHBondContact O-N 3.24Å; R68-L71 PolarHBondContact O-N 3.33Å; Q69-L71 VanDerWaalsContact C-N 3.35Å; Q69-L71 PolarHBondContact O-N 2.92Å; L71-A73 VanDerWaalsContact C-N 3.25Å; L71-A73 PolarHBondContact O-N 3.44Å; L71-K74 CarbonylContact O-C 3.58Å; L71-K74 WeakPolarHBondContact O-CA 3.45Å; L71-K74 WeakPolarHBondContact O-CB 3.37Å; L71-K74 PolarHBondContact O-N 3.48Å; L71-E75 HydrophobicContact CD1-CG 4.49Å; L71-E75 HydrophobicContact CG-CG 4.49Å; L71-E75 WeakPolarHBondContact O-CG 3.32Å; L71-E75 PolarHBondContact O-N 3.45Å
72S97.9Very high96.8Very high39 Ų3997.5 Ų97.527%0.27349%0.488SS..Hα-helixtrans-57.8-38.9175.5-178.20000112.1R68 Q69 E75 R76R68-S72 WeakPolarHBondContact O-CB 3.49Å; R68-S72 PolarHBondContact O-N 2.83Å; Q69-S72 PolarHBondContact O-N 3.35Å; S72-E75 PolarHBondContact O-N 3.14Å; S72-R76 VanDerWaalsContact C-NH1 3.27Å; S72-R76 PolarHBondContact O-N 2.66Å; S72-R76 PolarHBondContact O-NH1 3.43Å; S72-R76 PolarHBondContact OG-NH1 3.49Å; S72-R76 VanDerWaalsContact OG-NH1 3.11Å; S72-R76 PolarHBondContact OG-NH2 2.83Å; S72-R76 VanDerWaalsContact OG-NH2 3.1Å
73A98.2Very high96.4Very high52 Ų5298.6 Ų98.643%0.4349%0.487SS..Hα-helixtrans-64.6-43174.100000112.1Q69 V70 L71 R76 H77Q69-A73 WeakPolarHBondContact O-CB 3.43Å; Q69-A73 PolarHBondContact O-N 2.98Å; V70-A73 WeakPolarHBondContact O-CB 3.46Å; V70-A73 PolarHBondContact O-N 3.25Å; L71-A73 VanDerWaalsContact C-N 3.25Å; L71-A73 PolarHBondContact O-N 3.44Å; A73-R76 PolarHBondContact O-N 2.89Å; A73-H77 WeakPolarHBondContact O-CB 3.42Å; A73-H77 PolarHBondContact O-N 3.03Å
74K97.9Very high95.9Very high144 Ų144101.1 Ų101.163%0.62650%0.497SS*.Hα-helixtrans-63.2-41.7175-72.3-83.2-171.5-147.20112.1V70 L71 H77 A78V70-K74 WeakPolarHBondContact O-CG 3.37Å; V70-K74 PolarHBondContact O-N 2.94Å; L71-K74 CarbonylContact O-C 3.58Å; L71-K74 WeakPolarHBondContact O-CA 3.45Å; L71-K74 WeakPolarHBondContact O-CB 3.37Å; L71-K74 PolarHBondContact O-N 3.48Å; K74-H77 PolarHBondContact O-N 2.88Å; K74-A78 WeakPolarHBondContact O-CB 3.48Å; K74-A78 PolarHBondContact O-N 2.94Å
75E96.9Very high95.4Very high111 Ų111104 Ų10452%0.51951%0.512SS..Hα-helixtrans-62.7-43.7177-73174.8164.100112L71 S72 A78 S79L71-E75 HydrophobicContact CD1-CG 4.49Å; L71-E75 HydrophobicContact CG-CG 4.49Å; L71-E75 WeakPolarHBondContact O-CG 3.32Å; L71-E75 PolarHBondContact O-N 3.45Å; S72-E75 PolarHBondContact O-N 3.14Å; E75-A78 PolarHBondContact O-N 3.37Å; E75-S79 WeakPolarHBondContact O-CB 3.47Å; E75-S79 PolarHBondContact O-N 3.18Å; E75-S79 PolarHBondContact O-OG 2.95Å
76R96.3Very high94.6Very high157 Ų157102 Ų10259%0.59251%0.511SS*.Hα-helixtrans-60.9-46.2171.9-75.4-170.4-149.479.6-1.5111.5S72 A73 A78 S79 E80S72-R76 VanDerWaalsContact C-NH1 3.27Å; S72-R76 PolarHBondContact O-N 2.66Å; S72-R76 PolarHBondContact O-NH1 3.43Å; S72-R76 PolarHBondContact OG-NH1 3.49Å; S72-R76 VanDerWaalsContact OG-NH1 3.11Å; S72-R76 PolarHBondContact OG-NH2 2.83Å; S72-R76 VanDerWaalsContact OG-NH2 3.1Å; A73-R76 PolarHBondContact O-N 2.89Å; R76-A78 VanDerWaalsContact C-N 3.34Å; R76-A78 PolarHBondContact O-N 3.39Å; R76-S79 WeakPolarHBondContact O-CB 3.38Å; R76-S79 PolarHBondContact O-N 3.42Å; R76-E80 WeakPolarHBondContact O-CB 3.4Å; R76-E80 PolarHBondContact O-N 3.42Å
77H97.1Very high93.6Very high111 Ų111103.1 Ų103.151%0.51451%0.514SS..Hα-helixtrans-62.5-40.6179.2-176-110.3000112.4A73 K74 S79 E80 L81A73-H77 WeakPolarHBondContact O-CB 3.42Å; A73-H77 PolarHBondContact O-N 3.03Å; K74-H77 PolarHBondContact O-N 2.88Å; H77-S79 VanDerWaalsContact C-N 3.34Å; H77-E80 WeakPolarHBondContact O-CB 3.48Å; H77-E80 PolarHBondContact O-N 2.83Å; H77-L81 WeakPolarHBondContact O-CG 3.46Å; H77-L81 PolarHBondContact O-N 3.33Å
78A94.9Very high92.8Very high44 Ų4499.2 Ų99.236%0.36450%0.496SS..Hα-helixtrans-63.5-41174.300000111.6K74 E75 R76 E80 L81 K82K74-A78 WeakPolarHBondContact O-CB 3.48Å; K74-A78 PolarHBondContact O-N 2.94Å; E75-A78 PolarHBondContact O-N 3.37Å; R76-A78 VanDerWaalsContact C-N 3.34Å; R76-A78 PolarHBondContact O-N 3.39Å; A78-E80 VanDerWaalsContact C-N 3.34Å; A78-L81 PolarHBondContact O-N 3.14Å; A78-K82 WeakPolarHBondContact O-CG 3.43Å; A78-K82 PolarHBondContact O-N 3.04Å
79S92.2Very high91.6Very high73 Ų7395.9 Ų95.951%0.5150%0.497SS..Hα-helixtrans-63-41.2175.5-580000111.9E75 R76 H77 K82 R83E75-S79 WeakPolarHBondContact O-CB 3.47Å; E75-S79 PolarHBondContact O-N 3.18Å; E75-S79 PolarHBondContact O-OG 2.95Å; R76-S79 WeakPolarHBondContact O-CB 3.38Å; R76-S79 PolarHBondContact O-N 3.42Å; H77-S79 VanDerWaalsContact C-N 3.34Å; S79-K82 PolarHBondContact O-N 3.44Å; S79-R83 PolarHBondContact O-N 2.81Å
80E92.4Very high90.7Very high68 Ų6896 Ų9632%0.31850%0.501SS..Hα-helixtrans-63.3-42.5175.3-176.965.4-152.700111.7R76 H77 A78 R83 K84R76-E80 WeakPolarHBondContact O-CB 3.4Å; R76-E80 PolarHBondContact O-N 3.42Å; H77-E80 WeakPolarHBondContact O-CB 3.48Å; H77-E80 PolarHBondContact O-N 2.83Å; A78-E80 VanDerWaalsContact C-N 3.34Å; E80-R83 VanDerWaalsContact CD-NH2 3.27Å; E80-R83 WeakPolarHBondContact O-CB 3.35Å; E80-R83 PolarHBondContact O-N 3.38Å; E80-R83 IonicContact OE1-CZ 3.69Å; E80-R83 IonicContact OE1-NE 2.66Å; E80-R83 IonicContact OE1-NH2 2.66Å; E80-R83 PolarHBondContact OE1-NH2 2.85Å; E80-R83 IonicContact OE2-CZ 3.54Å; E80-R83 IonicContact OE2-NE 3.53Å; E80-R83 IonicContact OE2-NH2 3.14Å; E80-R83 PolarHBondContact OE2-NH2 3.21Å; E80-R83 VanDerWaalsContact OE2-NH2 3.14Å; E80-K84 WeakPolarHBondContact O-CG 3.47Å; E80-K84 PolarHBondContact O-N 3.07Å; E80-K84 WeakPolarHBondContact OE1-CE 3.42Å
81L94.4Very high89.6Confident80 Ų8095.8 Ų95.842%0.41950%0.497SS..Hα-helixtrans-63.8-46173.6-74.8172000112H77 A78 R83 K84 L85H77-L81 WeakPolarHBondContact O-CG 3.46Å; H77-L81 PolarHBondContact O-N 3.33Å; A78-L81 PolarHBondContact O-N 3.14Å; L81-R83 VanDerWaalsContact C-N 3.27Å; L81-R83 PolarHBondContact O-N 2.9Å; L81-K84 PolarHBondContact O-N 3.07Å; L81-K84 VanDerWaalsContact O-N 3.14Å; L81-L85 WeakPolarHBondContact O-CB 3.44Å; L81-L85 WeakPolarHBondContact O-CG 3.42Å; L81-L85 PolarHBondContact O-N 2.98Å
82K90.6Very high88.7Confident120 Ų12096.4 Ų96.452%0.52250%0.497SS..Hα-helixtrans-56-43.5174.6-76.3179.1179.9-178.60111.3A78 S79 L85 G86 L87A78-K82 WeakPolarHBondContact O-CG 3.43Å; A78-K82 PolarHBondContact O-N 3.04Å; S79-K82 PolarHBondContact O-N 3.44Å; K82-L85 CarbonylContact O-C 3.55Å; K82-L85 PolarHBondContact O-N 3.4Å; K82-G86 PolarHBondContact O-N 3.36Å; K82-G86 VanDerWaalsContact O-N 3.11Å; K82-L87 HydrophobicContact CB-CB 4.22Å; K82-L87 WeakPolarHBondContact O-CA 3.4Å; K82-L87 PolarHBondContact O-N 3.13Å
83R88.6Confident88.1Confident148 Ų14899 Ų9956%0.55851%0.508SS*.Hα-helixtrans-60.1-48174.7-175.4-178.673.6152.12.6112.1S79 E80 L81 L85 G86S79-R83 PolarHBondContact O-N 2.81Å; E80-R83 VanDerWaalsContact CD-NH2 3.27Å; E80-R83 WeakPolarHBondContact O-CB 3.35Å; E80-R83 PolarHBondContact O-N 3.38Å; E80-R83 IonicContact OE1-CZ 3.69Å; E80-R83 IonicContact OE1-NE 2.66Å; E80-R83 IonicContact OE1-NH2 2.66Å; E80-R83 PolarHBondContact OE1-NH2 2.85Å; E80-R83 IonicContact OE2-CZ 3.54Å; E80-R83 IonicContact OE2-NE 3.53Å; E80-R83 IonicContact OE2-NH2 3.14Å; E80-R83 PolarHBondContact OE2-NH2 3.21Å; E80-R83 VanDerWaalsContact OE2-NH2 3.14Å; L81-R83 VanDerWaalsContact C-N 3.27Å; L81-R83 PolarHBondContact O-N 2.9Å; R83-L85 VanDerWaalsContact C-N 3.27Å; R83-L85 PolarHBondContact O-N 2.9Å; R83-G86 PolarHBondContact O-N 3.34Å
84K88.5Confident87.4Confident154 Ų154103.3 Ų103.367%0.6752%0.517SS*.Hα-helixtrans-62.9-33.3178.1-74178.3179.3-178.60112.8E80 L81 G86E80-K84 WeakPolarHBondContact O-CG 3.47Å; E80-K84 PolarHBondContact O-N 3.07Å; E80-K84 WeakPolarHBondContact OE1-CE 3.42Å; L81-K84 PolarHBondContact O-N 3.07Å; L81-K84 VanDerWaalsContact O-N 3.14Å; K84-G86 VanDerWaalsContact C-N 3.28Å
85L87.1Confident86.8Confident131 Ų131102.2 Ų102.269%0.68651%0.514SS*.THydrogen-bonded Turntrans-82-1.3175-66172.8000113.4L81 K82 R83 L87L81-L85 WeakPolarHBondContact O-CB 3.44Å; L81-L85 WeakPolarHBondContact O-CG 3.42Å; L81-L85 PolarHBondContact O-N 2.98Å; K82-L85 CarbonylContact O-C 3.55Å; K82-L85 PolarHBondContact O-N 3.4Å; R83-L85 VanDerWaalsContact C-N 3.27Å; R83-L85 PolarHBondContact O-N 2.9Å; L85-L87 VanDerWaalsContact C-N 3.29Å; L85-L87 HydrophobicContact CB-CD1 4.44Å; L85-L87 HydrophobicContact CB-CG 4.39Å; L85-L87 PolarHBondContact O-N 3.03Å
86G81.3Confident86.3Confident41 Ų41101.5 Ų101.542%0.42351%0.514SS..THydrogen-bonded Turntrans79.93.1-179.800000115.3K82 R83 K84 S88K82-G86 PolarHBondContact O-N 3.36Å; K82-G86 VanDerWaalsContact O-N 3.11Å; R83-G86 PolarHBondContact O-N 3.34Å; K84-G86 VanDerWaalsContact C-N 3.28Å; G86-S88 PolarHBondContact O-N 2.84Å
87L79Confident85.9Confident101 Ų10198.9 Ų98.953%0.52951%0.511SS..  trans-82.742.9176.4-57.4174.3000111.5K82 L85K82-L87 HydrophobicContact CB-CB 4.22Å; K82-L87 WeakPolarHBondContact O-CA 3.4Å; K82-L87 PolarHBondContact O-N 3.13Å; L85-L87 VanDerWaalsContact C-N 3.29Å; L85-L87 HydrophobicContact CB-CD1 4.44Å; L85-L87 HydrophobicContact CB-CG 4.39Å; L85-L87 PolarHBondContact O-N 3.03Å
88S80.9Confident85.4Confident37 Ų3797.3 Ų97.326%0.25951%0.509SS..  trans-87.1132.5-176.9-167.70000109.9G86 L90 N91 E92G86-S88 PolarHBondContact O-N 2.84Å; S88-L90 PolarHBondContact O-N 3.11Å; S88-N91 WeakPolarHBondContact O-CB 3.19Å; S88-N91 PolarHBondContact O-N 2.78Å; S88-E92 PolarHBondContact O-N 3.47Å
89P74Confident85Confident103 Ų103102.5 Ų102.567%0.66952%0.523SS*.Hα-helixtrans-52.2-29.9178-2834.3000114L93P89-L93 PolarHBondContact O-N 3.43Å; P89-L93 VanDerWaalsContact O-N 3.09Å
90L78.6Confident84.9Confident125 Ų125102.3 Ų102.365%0.65452%0.522SS*.Hα-helixtrans-70-31.3176.8-173.162.1000112.8S88 K94S88-L90 PolarHBondContact O-N 3.11Å; L90-K94 VanDerWaalsContact O-CB 3.24Å; L90-K94 WeakPolarHBondContact O-CB 3.26Å; L90-K94 PolarHBondContact O-N 3.32Å
91N76.5Confident84.6Confident71 Ų71106.3 Ų106.338%0.3853%0.534SS..Hα-helixtrans-71.1-41.3178.1-167.763.6000110.8S88 K94 Q95S88-N91 WeakPolarHBondContact O-CB 3.19Å; S88-N91 PolarHBondContact O-N 2.78Å; N91-K94 PolarHBondContact O-N 2.69Å; N91-Q95 WeakPolarHBondContact O-CB 3.24Å; N91-Q95 VanDerWaalsContact O-CG 3.28Å; N91-Q95 WeakPolarHBondContact O-CG 3.34Å; N91-Q95 PolarHBondContact O-N 3.01Å
92E79.1Confident84.2Confident114 Ų114107.3 Ų107.353%0.53354%0.536SS..Hα-helixtrans-63.8-44.7173.7-68.2175.3-154.200111.8S88 Q95 N96S88-E92 PolarHBondContact O-N 3.47Å; E92-Q95 PolarHBondContact O-N 3.09Å; E92-N96 WeakPolarHBondContact O-CB 3.49Å; E92-N96 PolarHBondContact O-N 3.34Å; E92-N96 PolarHBondContact O-ND2 2.94Å
93L84.7Confident84Confident95 Ų95106.6 Ų106.650%0.49754%0.539SS..Hα-helixtrans-62-47.2176.1-179.163.9000111.7P89 Q95 N96 I97P89-L93 PolarHBondContact O-N 3.43Å; P89-L93 VanDerWaalsContact O-N 3.09Å; L93-Q95 VanDerWaalsContact C-N 3.3Å; L93-Q95 PolarHBondContact O-N 3.44Å; L93-N96 PolarHBondContact O-N 3.21Å; L93-I97 HydrophobicContact CD1-CD1 3.72Å; L93-I97 HydrophobicContact CD1-CG1 4.06Å; L93-I97 HydrophobicContact CD2-CD1 4.45Å; L93-I97 HydrophobicContact CG-CD1 3.78Å; L93-I97 HydrophobicContact CG-CG1 4.43Å; L93-I97 WeakPolarHBondContact O-CB 3.41Å; L93-I97 WeakPolarHBondContact O-CG1 3.48Å; L93-I97 PolarHBondContact O-N 3.2Å
94K84.3Confident83.8Confident142 Ų142103.1 Ų103.162%0.61753%0.533SS*.Hα-helixtrans-59.8-43.9178.1-177.6-178.9176.2-176.40110.9L90 N91 T98L90-K94 VanDerWaalsContact O-CB 3.24Å; L90-K94 WeakPolarHBondContact O-CB 3.26Å; L90-K94 PolarHBondContact O-N 3.32Å; N91-K94 PolarHBondContact O-N 2.69Å; K94-T98 VanDerWaalsContact O-CB 3.28Å; K94-T98 WeakPolarHBondContact O-CB 3.38Å; K94-T98 PolarHBondContact O-N 2.92Å; K94-T98 PolarHBondContact O-OG1 2.83Å
95Q84.7Confident83.2Confident121 Ų12199.1 Ų99.157%0.56552%0.517SS*.Hα-helixtrans-66.9-42.6178.1-74.6-170.2-9.600112.1N91 E92 L93 T98 K99N91-Q95 WeakPolarHBondContact O-CB 3.24Å; N91-Q95 VanDerWaalsContact O-CG 3.28Å; N91-Q95 WeakPolarHBondContact O-CG 3.34Å; N91-Q95 PolarHBondContact O-N 3.01Å; E92-Q95 PolarHBondContact O-N 3.09Å; L93-Q95 VanDerWaalsContact C-N 3.3Å; L93-Q95 PolarHBondContact O-N 3.44Å; Q95-T98 PolarHBondContact O-N 2.94Å; Q95-K99 WeakPolarHBondContact O-CB 3.46Å; Q95-K99 PolarHBondContact O-N 3.03Å
96N87.1Confident82.7Confident96 Ų9696.7 Ų96.751%0.51351%0.508SS..Hα-helixtrans-63.1-46.8176.4-81.5-40.1000112E92 L93 T98 K99 S100E92-N96 WeakPolarHBondContact O-CB 3.49Å; E92-N96 PolarHBondContact O-N 3.34Å; E92-N96 PolarHBondContact O-ND2 2.94Å; L93-N96 PolarHBondContact O-N 3.21Å; N96-T98 PolarHBondContact O-N 3.18Å; N96-K99 PolarHBondContact O-N 2.84Å; N96-S100 VanDerWaalsContact O-CB 3.27Å; N96-S100 WeakPolarHBondContact O-CB 3.41Å; N96-S100 PolarHBondContact O-N 3.44Å; N96-S100 PolarHBondContact O-OG 2.95Å
97I87.5Confident82.6Confident102 Ų10296.4 Ų96.452%0.52350%0.5SS..Hα-helixtrans-63.8-44.6177.8-66.4171.8000110.8L93 K99 S100 W101L93-I97 HydrophobicContact CD1-CD1 3.72Å; L93-I97 HydrophobicContact CD1-CG1 4.06Å; L93-I97 HydrophobicContact CD2-CD1 4.45Å; L93-I97 HydrophobicContact CG-CD1 3.78Å; L93-I97 HydrophobicContact CG-CG1 4.43Å; L93-I97 WeakPolarHBondContact O-CB 3.41Å; L93-I97 WeakPolarHBondContact O-CG1 3.48Å; L93-I97 PolarHBondContact O-N 3.2Å; I97-K99 VanDerWaalsContact C-N 3.34Å; I97-K99 PolarHBondContact O-N 2.71Å; I97-S100 PolarHBondContact O-N 2.76Å; I97-W101 WeakPolarHBondContact O-CB 3.28Å; I97-W101 PolarHBondContact O-N 3.46Å
98T87.1Confident82.2Confident77 Ų7798.9 Ų98.947%0.47251%0.508SS..Hα-helixtrans-62.2-44.3178.8-54.60000110.7K94 Q95 N96 Q102K94-T98 VanDerWaalsContact O-CB 3.28Å; K94-T98 WeakPolarHBondContact O-CB 3.38Å; K94-T98 PolarHBondContact O-N 2.92Å; K94-T98 PolarHBondContact O-OG1 2.83Å; Q95-T98 PolarHBondContact O-N 2.94Å; N96-T98 PolarHBondContact O-N 3.18Å; T98-Q102 VanDerWaalsContact O-CB 3.32Å; T98-Q102 WeakPolarHBondContact O-CB 3.05Å; T98-Q102 PolarHBondContact O-N 3.24Å
99K87.5Confident81.8Confident154 Ų154100.3 Ų100.367%0.6752%0.523SS*.Hα-helixtrans-65.8-48.8178.2-172-174.1177.981.80111.3Q95 N96 I97 W101 Q102 D103Q95-K99 WeakPolarHBondContact O-CB 3.46Å; Q95-K99 PolarHBondContact O-N 3.03Å; N96-K99 PolarHBondContact O-N 2.84Å; I97-K99 VanDerWaalsContact C-N 3.34Å; I97-K99 PolarHBondContact O-N 2.71Å; K99-W101 VanDerWaalsContact C-N 3.32Å; K99-W101 PolarHBondContact O-N 2.67Å; K99-Q102 PolarHBondContact O-N 3.31Å; K99-D103 WeakPolarHBondContact O-CB 3.28Å; K99-D103 PolarHBondContact O-N 3.2Å
100S88.3Confident81.5Confident68 Ų68101 Ų10148%0.47651%0.513SS..Hα-helixtrans-62.8-37.8178.2-65.60000112.3N96 I97 D103 V104N96-S100 VanDerWaalsContact O-CB 3.27Å; N96-S100 WeakPolarHBondContact O-CB 3.41Å; N96-S100 PolarHBondContact O-N 3.44Å; N96-S100 PolarHBondContact O-OG 2.95Å; I97-S100 PolarHBondContact O-N 2.76Å; S100-D103 PolarHBondContact O-N 3.14Å; S100-V104 WeakPolarHBondContact O-CB 3.28Å; S100-V104 VanDerWaalsContact O-CG2 3.26Å; S100-V104 WeakPolarHBondContact O-CG2 3.34Å; S100-V104 PolarHBondContact O-N 3.17Å
101W86.3Confident81.5Confident152 Ų15299.4 Ų99.458%0.57650%0.504SS*.Hα-helixtrans-64.2-48.8173.2175.5-100.4000111.6I97 K99 D103 V104 Q105I97-W101 WeakPolarHBondContact O-CB 3.28Å; I97-W101 PolarHBondContact O-N 3.46Å; K99-W101 VanDerWaalsContact C-N 3.32Å; K99-W101 PolarHBondContact O-N 2.67Å; W101-D103 VanDerWaalsContact C-N 3.27Å; W101-D103 PolarHBondContact O-N 2.85Å; W101-V104 PolarHBondContact O-N 3.47Å; W101-Q105 HydrophobicContact CZ2-CG 4.28Å; W101-Q105 VanDerWaalsContact NE1-NE2 3.15Å; W101-Q105 WeakPolarHBondContact O-CG 3.36Å; W101-Q105 PolarHBondContact O-N 2.88Å
102Q86.4Confident81.3Confident101 Ų10199 Ų9947%0.47251%0.507SS..Hα-helixtrans-59.5-42.5176.5-160.37249.600111T98 K99 Q105 T106T98-Q102 VanDerWaalsContact O-CB 3.32Å; T98-Q102 WeakPolarHBondContact O-CB 3.05Å; T98-Q102 PolarHBondContact O-N 3.24Å; K99-Q102 PolarHBondContact O-N 3.31Å; Q102-Q105 WeakPolarHBondContact O-CB 3.36Å; Q102-Q105 PolarHBondContact O-N 3.42Å; Q102-T106 WeakPolarHBondContact O-CG2 3.5Å; Q102-T106 PolarHBondContact O-N 2.94Å; Q102-T106 PolarHBondContact O-OG1 3.37Å
103D87.4Confident80.9Confident106 Ų10696 Ų9657%0.56750%0.502SS*.Hα-helixtrans-64.1-43.1-179.9-164.348.8000111.1K99 S100 W101 T106 S107K99-D103 WeakPolarHBondContact O-CB 3.28Å; K99-D103 PolarHBondContact O-N 3.2Å; S100-D103 PolarHBondContact O-N 3.14Å; W101-D103 VanDerWaalsContact C-N 3.27Å; W101-D103 PolarHBondContact O-N 2.85Å; D103-T106 CarbonylContact O-C 3.57Å; D103-T106 PolarHBondContact O-N 3.19Å; D103-T106 PolarHBondContact O-OG1 3.26Å; D103-S107 WeakPolarHBondContact O-CA 3.48Å; D103-S107 WeakPolarHBondContact O-CB 3.38Å; D103-S107 PolarHBondContact O-N 3.05Å
104V82.8Confident80Confident74 Ų7494 Ų9445%0.44850%0.496SS..Hα-helixtrans-60.5-48.9171.9168.40000110.6S100 W101 T106 S107 Y110S100-V104 WeakPolarHBondContact O-CB 3.28Å; S100-V104 VanDerWaalsContact O-CG2 3.26Å; S100-V104 WeakPolarHBondContact O-CG2 3.34Å; S100-V104 PolarHBondContact O-N 3.17Å; W101-V104 PolarHBondContact O-N 3.47Å; V104-T106 VanDerWaalsContact C-N 3.28Å; V104-T106 PolarHBondContact O-N 2.66Å; V104-S107 PolarHBondContact O-N 3.21Å; V104-S107 PolarHBondContact O-OG 3.26Å; V104-Y110 HydrophobicContact CG1-CD2 4.24Å; V104-Y110 WeakPolarHBondContact O-CB 3.32Å
105Q77.1Confident79.3Confident70 Ų7089.8 Ų89.833%0.32749%0.488SS..Hα-helixtrans-59.1-37.5178.7-73.8-173.2-39.600113.1W101 Q102W101-Q105 HydrophobicContact CZ2-CG 4.28Å; W101-Q105 VanDerWaalsContact NE1-NE2 3.15Å; W101-Q105 WeakPolarHBondContact O-CG 3.36Å; W101-Q105 PolarHBondContact O-N 2.88Å; Q102-Q105 WeakPolarHBondContact O-CB 3.36Å; Q102-Q105 PolarHBondContact O-N 3.42Å
106T75.8Confident78.6Confident80 Ų8087.6 Ų87.649%0.49148%0.483SS..Hα-helixtrans-92.2-7.1-179.657.50000113.6Q102 D103 V104Q102-T106 WeakPolarHBondContact O-CG2 3.5Å; Q102-T106 PolarHBondContact O-N 2.94Å; Q102-T106 PolarHBondContact O-OG1 3.37Å; D103-T106 CarbonylContact O-C 3.57Å; D103-T106 PolarHBondContact O-N 3.19Å; D103-T106 PolarHBondContact O-OG1 3.26Å; V104-T106 VanDerWaalsContact C-N 3.28Å; V104-T106 PolarHBondContact O-N 2.66Å
107S78.9Confident77.8Confident36 Ų3687.8 Ų87.825%0.25248%0.483SS..SBendtrans-64.4141.7-177.172.80000110.1D103 V104 A109 Y110 L111D103-S107 WeakPolarHBondContact O-CA 3.48Å; D103-S107 WeakPolarHBondContact O-CB 3.38Å; D103-S107 PolarHBondContact O-N 3.05Å; V104-S107 PolarHBondContact O-N 3.21Å; V104-S107 PolarHBondContact O-OG 3.26Å; S107-A109 PolarHBondContact O-N 2.97Å; S107-Y110 PolarHBondContact O-N 3.5Å; S107-Y110 VanDerWaalsContact O-N 3.07Å; S107-Y110 WeakPolarHBondContact OG-CB 3.18Å; S107-Y110 PolarHBondContact OG-N 3.45Å; S107-Y110 VanDerWaalsContact OG-N 3.09Å; S107-L111 PolarHBondContact O-N 3.47Å
108Q71.8Confident77Confident152 Ų15287.6 Ų87.671%0.7148%0.483SS*.Hα-helixtrans-59.4-29.4174.7-70.5-69.312.900111.6S112Q108-S112 WeakPolarHBondContact O-CB 3.3Å; Q108-S112 PolarHBondContact O-N 3.42Å; Q108-S112 PolarHBondContact O-OG 2.98Å
109A73.1Confident76.2Confident68 Ų6889.7 Ų89.756%0.56249%0.491SS*.Hα-helixtrans-66.5-43.2174.300000112.1S107 S112 A113S107-A109 PolarHBondContact O-N 2.97Å; A109-S112 WeakPolarHBondContact CA-OG 3.39Å; A109-S112 PolarHBondContact O-OG 3.3Å; A109-A113 WeakPolarHBondContact O-CB 3.21Å; A109-A113 PolarHBondContact O-N 2.76Å
110Y66.6Low75.3Confident117 Ų11786.8 Ų86.846%0.45948%0.482SS..Hα-helixtrans-71.5-42.5176.5-172.8-96.7000112.2V104 S107 A113 S114V104-Y110 HydrophobicContact CG1-CD2 4.24Å; V104-Y110 WeakPolarHBondContact O-CB 3.32Å; S107-Y110 PolarHBondContact O-N 3.5Å; S107-Y110 VanDerWaalsContact O-N 3.07Å; S107-Y110 WeakPolarHBondContact OG-CB 3.18Å; S107-Y110 PolarHBondContact OG-N 3.45Å; S107-Y110 VanDerWaalsContact OG-N 3.09Å; Y110-A113 PolarHBondContact O-N 3.46Å; Y110-S114 WeakPolarHBondContact O-CB 3.37Å; Y110-S114 PolarHBondContact O-N 2.84Å
111L78.4Confident74.4Confident91 Ų9185.5 Ų85.548%0.47647%0.471SS..Hα-helixtrans-65.2-41.6176.7-71.8168.2000111.9S107 S114 A115S107-L111 PolarHBondContact O-N 3.47Å; L111-S114 PolarHBondContact O-N 2.94Å; L111-A115 VanDerWaalsContact O-CB 3.27Å; L111-A115 WeakPolarHBondContact O-CB 3.19Å; L111-A115 PolarHBondContact O-N 3.37Å
112S72.4Confident73.7Confident64 Ų6484.4 Ų84.445%0.44847%0.473SS..Hα-helixtrans-71.6-37.7175.3620000112.5Q108 A109 A115 T116Q108-S112 WeakPolarHBondContact O-CB 3.3Å; Q108-S112 PolarHBondContact O-N 3.42Å; Q108-S112 PolarHBondContact O-OG 2.98Å; A109-S112 WeakPolarHBondContact CA-OG 3.39Å; A109-S112 PolarHBondContact O-OG 3.3Å; S112-A115 PolarHBondContact O-N 2.85Å; S112-T116 WeakPolarHBondContact O-CB 3.48Å; S112-T116 VanDerWaalsContact O-CG2 3.3Å; S112-T116 WeakPolarHBondContact O-CG2 3.29Å; S112-T116 PolarHBondContact O-N 2.79Å; S112-T116 PolarHBondContact O-OG1 2.9Å
113A70.9Confident73.1Confident51 Ų5181.4 Ų81.442%0.42146%0.462SS..Hα-helixtrans-66.4-39.1172.900000111.4A109 Y110 T116 L117A109-A113 WeakPolarHBondContact O-CB 3.21Å; A109-A113 PolarHBondContact O-N 2.76Å; Y110-A113 PolarHBondContact O-N 3.46Å; A113-T116 VanDerWaalsContact CA-OG1 3.3Å; A113-T116 WeakPolarHBondContact CA-OG1 3.26Å; A113-T116 PolarHBondContact O-OG1 3.43Å; A113-L117 WeakPolarHBondContact O-CB 3.4Å; A113-L117 PolarHBondContact O-N 3.39Å
114S65.8Low72.4Confident52 Ų5283 Ų8336%0.36447%0.467SS..Hα-helixtrans-67-41.8175-171.80000111.3Y110 L111 L117 D118Y110-S114 WeakPolarHBondContact O-CB 3.37Å; Y110-S114 PolarHBondContact O-N 2.84Å; L111-S114 PolarHBondContact O-N 2.94Å; S114-L117 PolarHBondContact O-N 2.95Å; S114-D118 WeakPolarHBondContact O-CB 3.26Å; S114-D118 PolarHBondContact O-N 2.91Å
115A70.3Confident72Confident54 Ų5482.7 Ų82.745%0.44647%0.472SS..Hα-helixtrans-66.2-42.4176.500000111.9L111 S112 L117 D118 D119L111-A115 VanDerWaalsContact O-CB 3.27Å; L111-A115 WeakPolarHBondContact O-CB 3.19Å; L111-A115 PolarHBondContact O-N 3.37Å; S112-A115 PolarHBondContact O-N 2.85Å; A115-L117 VanDerWaalsContact C-N 3.34Å; A115-D118 PolarHBondContact O-N 3.44Å; A115-D119 PolarHBondContact O-N 3.48Å
116T68.8Low71.8Confident75 Ų7584.2 Ų84.246%0.4648%0.475SS..Hα-helixtrans-69.2-32.7174.751.30000112.1S112 A113 D119 I120S112-T116 WeakPolarHBondContact O-CB 3.48Å; S112-T116 VanDerWaalsContact O-CG2 3.3Å; S112-T116 WeakPolarHBondContact O-CG2 3.29Å; S112-T116 PolarHBondContact O-N 2.79Å; S112-T116 PolarHBondContact O-OG1 2.9Å; A113-T116 VanDerWaalsContact CA-OG1 3.3Å; A113-T116 WeakPolarHBondContact CA-OG1 3.26Å; A113-T116 PolarHBondContact O-OG1 3.43Å; T116-D119 PolarHBondContact O-N 2.82Å; T116-I120 VanDerWaalsContact O-CB 3.28Å; T116-I120 WeakPolarHBondContact O-CB 3.48Å; T116-I120 WeakPolarHBondContact O-CD1 3.48Å; T116-I120 WeakPolarHBondContact O-CG1 3.27Å; T116-I120 PolarHBondContact O-N 2.76Å
117L70.3Confident72Confident100 Ų10085.3 Ų85.352%0.52447%0.473SS..Hα-helixtrans-68.3-38.9172.4-172.668.6000111.2A113 S114 A115 I120 T121A113-L117 WeakPolarHBondContact O-CB 3.4Å; A113-L117 PolarHBondContact O-N 3.39Å; S114-L117 PolarHBondContact O-N 2.95Å; A115-L117 VanDerWaalsContact C-N 3.34Å; L117-I120 PolarHBondContact O-N 3.32Å; L117-T121 HydrophobicContact CD1-CG2 4.36Å; L117-T121 HydrophobicContact CG-CG2 4.25Å; L117-T121 VanDerWaalsContact O-CB 3.3Å; L117-T121 WeakPolarHBondContact O-CB 3.46Å; L117-T121 WeakPolarHBondContact O-CG2 3.18Å; L117-T121 PolarHBondContact O-N 3.29Å; L117-T121 PolarHBondContact O-OG1 3.01Å
118D71.1Confident72.1Confident97 Ų9790.6 Ų90.652%0.51949%0.491SS..Hα-helixtrans-61.8-45.5171.8-106.919.8000110.7S114 A115 I120 T121 H122S114-D118 WeakPolarHBondContact O-CB 3.26Å; S114-D118 PolarHBondContact O-N 2.91Å; A115-D118 PolarHBondContact O-N 3.44Å; D118-I120 PolarHBondContact O-N 3.49Å; D118-T121 WeakPolarHBondContact CA-OG1 3.21Å; D118-T121 PolarHBondContact O-N 3.44Å; D118-T121 PolarHBondContact O-OG1 2.92Å; D118-H122 WeakPolarHBondContact O-CB 3.27Å; D118-H122 PolarHBondContact O-N 3.46Å; D118-H122 PolarHBondContact O-ND1 2.77Å
119D71.4Confident72.4Confident122 Ų12287.6 Ų87.665%0.65248%0.484SS*.Hα-helixtrans-62.6-42.2175.4-84.8-5.8000112.1A115 T116 S123A115-D119 PolarHBondContact O-N 3.48Å; T116-D119 PolarHBondContact O-N 2.82Å; D119-S123 WeakPolarHBondContact O-CB 3.44Å; D119-S123 PolarHBondContact O-N 2.89Å
120I66.8Low72.7Confident92 Ų9289 Ų8947%0.47248%0.479SS..Hα-helixtrans-68-44.4178.9-73.1161.3000110.4T116 L117 D118 H122 S123 Y126T116-I120 VanDerWaalsContact O-CB 3.28Å; T116-I120 WeakPolarHBondContact O-CB 3.48Å; T116-I120 WeakPolarHBondContact O-CD1 3.48Å; T116-I120 WeakPolarHBondContact O-CG1 3.27Å; T116-I120 PolarHBondContact O-N 2.76Å; L117-I120 PolarHBondContact O-N 3.32Å; D118-I120 PolarHBondContact O-N 3.49Å; I120-H122 VanDerWaalsContact C-N 3.28Å; I120-H122 PolarHBondContact O-N 3.4Å; I120-S123 VanDerWaalsContact O-CB 3.26Å; I120-S123 WeakPolarHBondContact O-CB 3.45Å; I120-S123 PolarHBondContact O-N 3.23Å; I120-S123 PolarHBondContact O-OG 2.95Å; I120-Y126 HydrophobicContact CG2-CD2 4.49Å; I120-Y126 WeakPolarHBondContact O-CB 3.29Å
121T70.9Confident73.3Confident41 Ų4189.9 Ų89.925%0.25249%0.487SS..Hα-helixtrans-64.8-32.3179.350.80000112.4L117 D118 Y126L117-T121 HydrophobicContact CD1-CG2 4.36Å; L117-T121 HydrophobicContact CG-CG2 4.25Å; L117-T121 VanDerWaalsContact O-CB 3.3Å; L117-T121 WeakPolarHBondContact O-CB 3.46Å; L117-T121 WeakPolarHBondContact O-CG2 3.18Å; L117-T121 PolarHBondContact O-N 3.29Å; L117-T121 PolarHBondContact O-OG1 3.01Å; D118-T121 WeakPolarHBondContact CA-OG1 3.21Å; D118-T121 PolarHBondContact O-N 3.44Å; D118-T121 PolarHBondContact O-OG1 2.92Å; T121-Y126 HydrophobicContact CG2-CE1 4.32Å; T121-Y126 VanDerWaalsContact O-CD1 3.3Å; T121-Y126 WeakPolarHBondContact O-CD1 3.21Å
122H70.2Confident73.2Confident130 Ų13089.6 Ų89.660%0.60249%0.489SS*.Hα-helixtrans-84.2-11.3173.2-68.379000113.3D118 I120D118-H122 WeakPolarHBondContact O-CB 3.27Å; D118-H122 PolarHBondContact O-N 3.46Å; D118-H122 PolarHBondContact O-ND1 2.77Å; I120-H122 VanDerWaalsContact C-N 3.28Å; I120-H122 PolarHBondContact O-N 3.4Å
123S74.7Confident73.7Confident37 Ų3792.4 Ų92.426%0.25950%0.498SS..SBendtrans-67.4145.3179.680.30000112.2D119 I120 A125 Y126 K127D119-S123 WeakPolarHBondContact O-CB 3.44Å; D119-S123 PolarHBondContact O-N 2.89Å; I120-S123 VanDerWaalsContact O-CB 3.26Å; I120-S123 WeakPolarHBondContact O-CB 3.45Å; I120-S123 PolarHBondContact O-N 3.23Å; I120-S123 PolarHBondContact O-OG 2.95Å; S123-A125 PolarHBondContact O-N 3.27Å; S123-Y126 PolarHBondContact O-N 2.94Å; S123-Y126 VanDerWaalsContact O-N 3.13Å; S123-Y126 PolarHBondContact OG-N 3.31Å; S123-K127 PolarHBondContact O-N 2.95Å
124E72.9Confident74.2Confident141 Ų14193.1 Ų93.166%0.65950%0.5SS*.Hα-helixtrans-58.6-28.2174.6-66.2-62.1128.500112.2K128E124-K128 WeakPolarHBondContact O-CB 3.38Å; E124-K128 PolarHBondContact O-N 3.35Å
125A73.8Confident74.8Confident67 Ų6795.4 Ų95.455%0.55451%0.505SS*.Hα-helixtrans-68.9-42.4176.400000112.3S123 T129S123-A125 PolarHBondContact O-N 3.27Å; A125-T129 VanDerWaalsContact O-CB 3.32Å; A125-T129 WeakPolarHBondContact O-CB 3.44Å; A125-T129 PolarHBondContact O-N 3.47Å; A125-T129 PolarHBondContact O-OG1 2.88Å
126Y73.9Confident74.9Confident102 Ų10295.1 Ų95.140%0.450%0.503SS..Hα-helixtrans-69-45.8175-178.8-93.4000111.2I120 T121 S123 K128 T129 Q130I120-Y126 HydrophobicContact CG2-CD2 4.49Å; I120-Y126 WeakPolarHBondContact O-CB 3.29Å; T121-Y126 HydrophobicContact CG2-CE1 4.32Å; T121-Y126 VanDerWaalsContact O-CD1 3.3Å; T121-Y126 WeakPolarHBondContact O-CD1 3.21Å; S123-Y126 PolarHBondContact O-N 2.94Å; S123-Y126 VanDerWaalsContact O-N 3.13Å; S123-Y126 PolarHBondContact OG-N 3.31Å; Y126-K128 PolarHBondContact O-N 2.91Å; Y126-T129 CarbonylContact O-C 3.56Å; Y126-T129 PolarHBondContact O-N 2.9Å; Y126-T129 VanDerWaalsContact O-N 3.15Å; Y126-Q130 HydrophobicContact CE1-CB 4.4Å; Y126-Q130 VanDerWaalsContact O-CB 3.29Å; Y126-Q130 WeakPolarHBondContact O-CB 3.45Å; Y126-Q130 PolarHBondContact O-N 3.26Å
127K78.8Confident75.2Confident103 Ų10392.7 Ų92.745%0.44849%0.493SS..Hα-helixtrans-56.2-48.7174.9-79.4-177.4176.2170.40112.1S123 T129 Q130 E131S123-K127 PolarHBondContact O-N 2.95Å; K127-T129 VanDerWaalsContact C-N 3.29Å; K127-T129 PolarHBondContact O-N 3.19Å; K127-Q130 PolarHBondContact O-N 3.44Å; K127-E131 VanDerWaalsContact O-CB 3.24Å; K127-E131 WeakPolarHBondContact O-CB 3.44Å; K127-E131 PolarHBondContact O-N 3.12Å
128K80.8Confident75.7Confident146 Ų14695.1 Ų95.164%0.63550%0.502SS*.Hα-helixtrans-63.8-34.9178.4-168.7173.4-174.8-177.30112.3E124 Y126 T132E124-K128 WeakPolarHBondContact O-CB 3.38Å; E124-K128 PolarHBondContact O-N 3.35Å; Y126-K128 PolarHBondContact O-N 2.91Å; K128-T132 VanDerWaalsContact O-CB 3.27Å; K128-T132 WeakPolarHBondContact O-CB 3.36Å; K128-T132 PolarHBondContact O-N 2.75Å; K128-T132 PolarHBondContact O-OG1 3.18Å
129T78.6Confident75.9Confident89 Ų8996.8 Ų96.855%0.54650%0.504SS..Hα-helixtrans-73.1-40.7175-57.20000111.7A125 Y126 K127 E131 T132 L133A125-T129 VanDerWaalsContact O-CB 3.32Å; A125-T129 WeakPolarHBondContact O-CB 3.44Å; A125-T129 PolarHBondContact O-N 3.47Å; A125-T129 PolarHBondContact O-OG1 2.88Å; Y126-T129 CarbonylContact O-C 3.56Å; Y126-T129 PolarHBondContact O-N 2.9Å; Y126-T129 VanDerWaalsContact O-N 3.15Å; K127-T129 VanDerWaalsContact C-N 3.29Å; K127-T129 PolarHBondContact O-N 3.19Å; T129-E131 VanDerWaalsContact C-N 3.34Å; T129-T132 PolarHBondContact O-N 3.13Å; T129-L133 WeakPolarHBondContact O-CB 3.39Å; T129-L133 PolarHBondContact O-N 2.77Å
130Q79.6Confident75.8Confident99 Ų9995 Ų9546%0.46350%0.498SS..Hα-helixtrans-64.3-40.5175.2-179.7-177.9-0.300111Y126 K127 S134Y126-Q130 HydrophobicContact CE1-CB 4.4Å; Y126-Q130 VanDerWaalsContact O-CB 3.29Å; Y126-Q130 WeakPolarHBondContact O-CB 3.45Å; Y126-Q130 PolarHBondContact O-N 3.26Å; K127-Q130 PolarHBondContact O-N 3.44Å; Q130-S134 WeakPolarHBondContact O-CB 3.34Å; Q130-S134 PolarHBondContact O-N 3.32Å; Q130-S134 PolarHBondContact O-OG 2.85Å
131E79.1Confident76Confident135 Ų13594.2 Ų94.263%0.63150%0.5SS*.Hα-helixtrans-65.6-48.4174.7-171.4176.8-172.500110.3K127 T129 L133 S134 E135K127-E131 VanDerWaalsContact O-CB 3.24Å; K127-E131 WeakPolarHBondContact O-CB 3.44Å; K127-E131 PolarHBondContact O-N 3.12Å; T129-E131 VanDerWaalsContact C-N 3.34Å; E131-L133 PolarHBondContact O-N 2.97Å; E131-S134 PolarHBondContact O-N 3.35Å; E131-E135 VanDerWaalsContact O-CB 3.31Å; E131-E135 WeakPolarHBondContact O-CB 3.47Å; E131-E135 PolarHBondContact O-N 3.38Å
132T77.3Confident76Confident84 Ų8495 Ų9552%0.51551%0.511SS..Hα-helixtrans-62-41.9176.2-57.30000112K128 T129 E135 A136K128-T132 VanDerWaalsContact O-CB 3.27Å; K128-T132 WeakPolarHBondContact O-CB 3.36Å; K128-T132 PolarHBondContact O-N 2.75Å; K128-T132 PolarHBondContact O-OG1 3.18Å; T129-T132 PolarHBondContact O-N 3.13Å; T132-E135 PolarHBondContact O-N 2.73Å; T132-A136 WeakPolarHBondContact O-CB 3.46Å; T132-A136 PolarHBondContact O-N 2.99Å
133L81.6Confident75.7Confident123 Ų12391 Ų9164%0.64450%0.501SS*.Hα-helixtrans-70.8-36.8177.8-178.666.5000111.5T129 E131 G137T129-L133 WeakPolarHBondContact O-CB 3.39Å; T129-L133 PolarHBondContact O-N 2.77Å; E131-L133 PolarHBondContact O-N 2.97Å; L133-G137 WeakPolarHBondContact O-CA 3.11Å; L133-G137 PolarHBondContact O-N 2.74Å
134S82.6Confident75.4Confident66 Ų6694.8 Ų94.846%0.46252%0.518SS..Hα-helixtrans-67.5-41.4173.9-66.70000110.7Q130 E131 G137 Q138Q130-S134 WeakPolarHBondContact O-CB 3.34Å; Q130-S134 PolarHBondContact O-N 3.32Å; Q130-S134 PolarHBondContact O-OG 2.85Å; E131-S134 PolarHBondContact O-N 3.35Å; S134-G137 PolarHBondContact O-N 3.07Å; S134-Q138 WeakPolarHBondContact O-CB 3.16Å; S134-Q138 WeakPolarHBondContact O-CG 3.39Å; S134-Q138 PolarHBondContact O-N 3.19Å
135E77.3Confident75.2Confident101 Ų10193.6 Ų93.647%0.47252%0.516SS..Hα-helixtrans-68.5-46.8178.4-163.6-171.8159.300111.4E131 T132 G137 Q138 K139E131-E135 VanDerWaalsContact O-CB 3.31Å; E131-E135 WeakPolarHBondContact O-CB 3.47Å; E131-E135 PolarHBondContact O-N 3.38Å; T132-E135 PolarHBondContact O-N 2.73Å; E135-G137 VanDerWaalsContact C-N 3.31Å; E135-G137 PolarHBondContact O-N 3.46Å; E135-Q138 PolarHBondContact O-N 3.32Å; E135-K139 WeakPolarHBondContact O-CB 2.95Å; E135-K139 VanDerWaalsContact O-CG 3.27Å; E135-K139 WeakPolarHBondContact O-CG 3.03Å; E135-K139 PolarHBondContact O-N 2.74Å; E135-K139 WeakPolarHBondContact OE1-CE 3.27Å; E135-K139 IonicContact OE1-NZ 3.47Å; E135-K139 PolarHBondContact OE1-NZ 3.48Å
136A72.4Confident75.2Confident47 Ų4794.9 Ų94.939%0.38852%0.516SS..Hα-helixtrans-65.4-36173.300000111.8T132 K139 T140T132-A136 WeakPolarHBondContact O-CB 3.46Å; T132-A136 PolarHBondContact O-N 2.99Å; A136-K139 PolarHBondContact O-N 3.34Å; A136-T140 VanDerWaalsContact O-CB 3.26Å; A136-T140 WeakPolarHBondContact O-CB 3.5Å; A136-T140 PolarHBondContact O-N 2.75Å; A136-T140 PolarHBondContact O-OG1 3.49Å
137G75.9Confident74.5Confident25 Ų2595.1 Ų95.126%0.25852%0.524SS..Hα-helixtrans-69-38.117800000112.1L133 S134 E135 S141L133-G137 WeakPolarHBondContact O-CA 3.11Å; L133-G137 PolarHBondContact O-N 2.74Å; S134-G137 PolarHBondContact O-N 3.07Å; E135-G137 VanDerWaalsContact C-N 3.31Å; E135-G137 PolarHBondContact O-N 3.46Å; G137-S141 WeakPolarHBondContact O-CA 3.08Å; G137-S141 WeakPolarHBondContact O-CB 3.43Å; G137-S141 PolarHBondContact O-N 3.44Å; G137-S141 PolarHBondContact O-OG 3.18Å
138Q79.3Confident74.3Confident151 Ų15191.6 Ų91.671%0.70652%0.517SS*.Hα-helixtrans-69-42.7172-77.1-161.5-8.300111.6S134 E135 T140 S141 A142S134-Q138 WeakPolarHBondContact O-CB 3.16Å; S134-Q138 WeakPolarHBondContact O-CG 3.39Å; S134-Q138 PolarHBondContact O-N 3.19Å; E135-Q138 PolarHBondContact O-N 3.32Å; Q138-T140 VanDerWaalsContact C-N 3.31Å; Q138-T140 PolarHBondContact O-N 2.82Å; Q138-S141 PolarHBondContact O-N 2.88Å; Q138-A142 WeakPolarHBondContact O-CB 3.48Å; Q138-A142 PolarHBondContact O-N 2.84Å
139K76.8Confident74Confident132 Ų13288.5 Ų88.557%0.57451%0.511SS*.Hα-helixtrans-62.1-39.7175-70.4172-172.6170.50111.7E135 A136 A143E135-K139 WeakPolarHBondContact O-CB 2.95Å; E135-K139 VanDerWaalsContact O-CG 3.27Å; E135-K139 WeakPolarHBondContact O-CG 3.03Å; E135-K139 PolarHBondContact O-N 2.74Å; E135-K139 WeakPolarHBondContact OE1-CE 3.27Å; E135-K139 IonicContact OE1-NZ 3.47Å; E135-K139 PolarHBondContact OE1-NZ 3.48Å; A136-K139 PolarHBondContact O-N 3.34Å; K139-A143 PolarHBondContact O-N 2.67Å
140T69.3Low73.9Confident84 Ų8486.7 Ų86.752%0.51550%0.504SS..Hα-helixtrans-75-38176.2-54.80000112A136 Q138 A142 A143 L144A136-T140 VanDerWaalsContact O-CB 3.26Å; A136-T140 WeakPolarHBondContact O-CB 3.5Å; A136-T140 PolarHBondContact O-N 2.75Å; A136-T140 PolarHBondContact O-OG1 3.49Å; Q138-T140 VanDerWaalsContact C-N 3.31Å; Q138-T140 PolarHBondContact O-N 2.82Å; T140-A142 VanDerWaalsContact C-N 3.31Å; T140-A142 PolarHBondContact O-N 2.93Å; T140-A143 CarbonylContact O-C 3.51Å; T140-A143 WeakPolarHBondContact O-CA 3.38Å; T140-A143 WeakPolarHBondContact O-CB 3.26Å; T140-A143 PolarHBondContact O-N 3.09Å; T140-A143 VanDerWaalsContact O-N 3.11Å; T140-L144 WeakPolarHBondContact O-CB 3.34Å; T140-L144 PolarHBondContact O-N 3.07Å
141S70.9Confident73.7Confident75 Ų7587.4 Ų87.452%0.52451%0.51SS..Hα-helixtrans-64.1-37.9175.7-65.20000111.2G137 Q138 A143 L144 N145G137-S141 WeakPolarHBondContact O-CA 3.08Å; G137-S141 WeakPolarHBondContact O-CB 3.43Å; G137-S141 PolarHBondContact O-N 3.44Å; G137-S141 PolarHBondContact O-OG 3.18Å; Q138-S141 PolarHBondContact O-N 2.88Å; S141-A143 VanDerWaalsContact C-N 3.34Å; S141-L144 PolarHBondContact O-N 3.2Å; S141-N145 WeakPolarHBondContact O-CB 3.4Å; S141-N145 PolarHBondContact O-N 2.59Å
142A70.3Confident73.6Confident58 Ų5884.8 Ų84.848%0.47951%0.507SS..Hα-helixtrans-62.3-41.2171.200000111.7Q138 T140 T146Q138-A142 WeakPolarHBondContact O-CB 3.48Å; Q138-A142 PolarHBondContact O-N 2.84Å; T140-A142 VanDerWaalsContact C-N 3.31Å; T140-A142 PolarHBondContact O-N 2.93Å; A142-T146 WeakPolarHBondContact O-CB 3.18Å; A142-T146 PolarHBondContact O-N 2.85Å; A142-T146 VanDerWaalsContact O-N 3.07Å; A142-T146 PolarHBondContact O-OG1 3.21Å
143A64.8Low73.7Confident47 Ų4790 Ų9039%0.38852%0.517SS..Hα-helixtrans-68-39.2174.100000112.6K139 T140 S141 T146 L147K139-A143 PolarHBondContact O-N 2.67Å; T140-A143 CarbonylContact O-C 3.51Å; T140-A143 WeakPolarHBondContact O-CA 3.38Å; T140-A143 WeakPolarHBondContact O-CB 3.26Å; T140-A143 PolarHBondContact O-N 3.09Å; T140-A143 VanDerWaalsContact O-N 3.11Å; S141-A143 VanDerWaalsContact C-N 3.34Å; A143-T146 CarbonylContact O-C 3.57Å; A143-T146 WeakPolarHBondContact O-CB 3.17Å; A143-T146 PolarHBondContact O-N 2.89Å; A143-L147 WeakPolarHBondContact O-CG 3.13Å; A143-L147 PolarHBondContact O-N 3.33Å
144L68.1Low73.7Confident116 Ų11693.1 Ų93.161%0.60752%0.52SS*.Hα-helixtrans-66.2-40.1176.7-115.1168000111.7T140 S141 T146 L147 G148T140-L144 WeakPolarHBondContact O-CB 3.34Å; T140-L144 PolarHBondContact O-N 3.07Å; S141-L144 PolarHBondContact O-N 3.2Å; L144-T146 VanDerWaalsContact C-N 3.27Å; L144-T146 PolarHBondContact O-N 3.46Å; L144-L147 PolarHBondContact O-N 3.44Å; L144-G148 PolarHBondContact O-N 3.11Å
145N69.2Low73.7Confident116 Ų11694.7 Ų94.762%0.6252%0.523SS*.Hα-helixtrans-65.9-34.6173.7-158.228.6000111.2S141 T149S141-N145 WeakPolarHBondContact O-CB 3.4Å; S141-N145 PolarHBondContact O-N 2.59Å; N145-T149 WeakPolarHBondContact O-CB 3.29Å; N145-T149 WeakPolarHBondContact O-CG2 3.3Å; N145-T149 PolarHBondContact O-N 2.73Å; N145-T149 PolarHBondContact O-OG1 2.74Å
146T72.2Confident73.9Confident93 Ų9391.8 Ų91.857%0.57152%0.521SS*.Hα-helixtrans-68.3-39.6173.9-56.60000112.2A142 A143 L144 T149 A150A142-T146 WeakPolarHBondContact O-CB 3.18Å; A142-T146 PolarHBondContact O-N 2.85Å; A142-T146 VanDerWaalsContact O-N 3.07Å; A142-T146 PolarHBondContact O-OG1 3.21Å; A143-T146 CarbonylContact O-C 3.57Å; A143-T146 WeakPolarHBondContact O-CB 3.17Å; A143-T146 PolarHBondContact O-N 2.89Å; L144-T146 VanDerWaalsContact C-N 3.27Å; L144-T146 PolarHBondContact O-N 3.46Å; T146-T149 WeakPolarHBondContact CA-OG1 3.33Å; T146-T149 PolarHBondContact O-OG1 2.8Å; T146-A150 WeakPolarHBondContact O-CB 3.3Å; T146-A150 PolarHBondContact O-N 3.05Å; T146-A150 VanDerWaalsContact O-N 3.12Å
147L60.3Low74.3Confident108 Ų10894 Ų9457%0.56553%0.526SS*.Hα-helixtrans-74.6-36.7175.4-68174.7000112.1A143 L144 A150 I151A143-L147 WeakPolarHBondContact O-CG 3.13Å; A143-L147 PolarHBondContact O-N 3.33Å; L144-L147 PolarHBondContact O-N 3.44Å; L147-A150 PolarHBondContact O-N 3.43Å; L147-I151 VanDerWaalsContact O-CG1 3.29Å; L147-I151 WeakPolarHBondContact O-CG1 3.13Å; L147-I151 PolarHBondContact O-N 3.46Å
148G74.9Confident74.4Confident29 Ų2998.4 Ų98.430%0.29954%0.541SS..Hα-helixtrans-66.4-38.6176.400000112.5L144 S152L144-G148 PolarHBondContact O-N 3.11Å; G148-S152 VanDerWaalsContact O-CB 3.26Å; G148-S152 WeakPolarHBondContact O-CB 3.49Å; G148-S152 PolarHBondContact O-N 2.78Å; G148-S152 PolarHBondContact O-OG 3.4Å
149T73.4Confident74.2Confident81 Ų8199.6 Ų99.650%0.49754%0.539SS..Hα-helixtrans-68.2-39.4170.744.20000111.8N145 T146 S152 R153N145-T149 WeakPolarHBondContact O-CB 3.29Å; N145-T149 WeakPolarHBondContact O-CG2 3.3Å; N145-T149 PolarHBondContact O-N 2.73Å; N145-T149 PolarHBondContact O-OG1 2.74Å; T146-T149 WeakPolarHBondContact CA-OG1 3.33Å; T146-T149 PolarHBondContact O-OG1 2.8Å; T149-S152 PolarHBondContact O-N 2.69Å; T149-R153 WeakPolarHBondContact O-CB 3.3Å; T149-R153 PolarHBondContact O-N 2.79Å
150A75.9Confident74.3Confident50 Ų5098.4 Ų98.441%0.41354%0.539SS..Hα-helixtrans-63.2-43.4174.900000112.7T146 L147 R153 R154T146-A150 WeakPolarHBondContact O-CB 3.3Å; T146-A150 PolarHBondContact O-N 3.05Å; T146-A150 VanDerWaalsContact O-N 3.12Å; L147-A150 PolarHBondContact O-N 3.43Å; A150-R153 PolarHBondContact O-N 2.78Å; A150-R154 VanDerWaalsContact O-CG 3.27Å; A150-R154 WeakPolarHBondContact O-CG 3.18Å; A150-R154 PolarHBondContact O-N 2.8Å
151I76.4Confident74.9Confident115 Ų11595.7 Ų95.759%0.5952%0.524SS*.Hα-helixtrans-67.8-44.2176.8-67.2164000110.9L147 R153 R154 L155L147-I151 VanDerWaalsContact O-CG1 3.29Å; L147-I151 WeakPolarHBondContact O-CG1 3.13Å; L147-I151 PolarHBondContact O-N 3.46Å; I151-R153 VanDerWaalsContact C-N 3.25Å; I151-R153 PolarHBondContact O-N 3.28Å; I151-R154 PolarHBondContact O-N 2.77Å; I151-L155 WeakPolarHBondContact O-CB 3.3Å; I151-L155 PolarHBondContact O-N 3.41Å
152S76.4Confident75.2Confident80 Ų8097.1 Ų97.156%0.55953%0.531SS*.Hα-helixtrans-61.1-37.8177-61.50000111.6G148 T149 L155 G156G148-S152 VanDerWaalsContact O-CB 3.26Å; G148-S152 WeakPolarHBondContact O-CB 3.49Å; G148-S152 PolarHBondContact O-N 2.78Å; G148-S152 PolarHBondContact O-OG 3.4Å; T149-S152 PolarHBondContact O-N 2.69Å; S152-L155 PolarHBondContact O-N 3.49Å; S152-G156 PolarHBondContact O-N 3.36Å
153R80.8Confident75.5Confident194 Ų19499.9 Ų99.973%0.73254%0.542SS*.Hα-helixtrans-66.6-45.7175-155.4170.7-161.5160.83.7111.4T149 A150 I151 L155 G156 D157T149-R153 WeakPolarHBondContact O-CB 3.3Å; T149-R153 PolarHBondContact O-N 2.79Å; A150-R153 PolarHBondContact O-N 2.78Å; I151-R153 VanDerWaalsContact C-N 3.25Å; I151-R153 PolarHBondContact O-N 3.28Å; R153-L155 VanDerWaalsContact C-N 3.35Å; R153-L155 PolarHBondContact O-N 2.9Å; R153-G156 PolarHBondContact O-N 2.77Å; R153-D157 WeakPolarHBondContact O-CB 3.4Å; R153-D157 VanDerWaalsContact O-CG 3.23Å; R153-D157 PolarHBondContact O-N 3.43Å
154R81.1Confident76.1Confident187 Ų187101.4 Ų101.471%0.70654%0.54SS*.Hα-helixtrans-62.1-38.7174.8-71.2-65.7-171.5-154.13.2112.9A150 I151 M158A150-R154 VanDerWaalsContact O-CG 3.27Å; A150-R154 WeakPolarHBondContact O-CG 3.18Å; A150-R154 PolarHBondContact O-N 2.8Å; I151-R154 PolarHBondContact O-N 2.77Å; R154-M158 VanDerWaalsContact O-CB 3.29Å; R154-M158 WeakPolarHBondContact O-CB 3.27Å; R154-M158 PolarHBondContact O-N 3.33Å
155L81.6Confident76.7Confident99 Ų99100.3 Ų100.352%0.51853%0.53SS..Hα-helixtrans-70.2-40.1177.4-175.959.5000111.6I151 S152 R153 M158 R159I151-L155 WeakPolarHBondContact O-CB 3.3Å; I151-L155 PolarHBondContact O-N 3.41Å; S152-L155 PolarHBondContact O-N 3.49Å; R153-L155 VanDerWaalsContact C-N 3.35Å; R153-L155 PolarHBondContact O-N 2.9Å; L155-M158 HydrophobicContact CD1-CE 3.76Å; L155-M158 PolarHBondContact O-N 2.85Å; L155-R159 WeakPolarHBondContact O-CB 3.5Å; L155-R159 PolarHBondContact O-N 3.36Å
156G81.4Confident77.1Confident41 Ų4198.3 Ų98.342%0.42353%0.526SS..Hα-helixtrans-60.6-47.5172.200000112.2S152 R153 M158 R159 N160S152-G156 PolarHBondContact O-N 3.36Å; R153-G156 PolarHBondContact O-N 2.77Å; G156-M158 VanDerWaalsContact C-N 3.33Å; G156-M158 PolarHBondContact O-N 2.93Å; G156-R159 PolarHBondContact O-N 2.8Å; G156-N160 WeakPolarHBondContact O-CB 3.48Å; G156-N160 PolarHBondContact O-N 2.86Å
157D81.6Confident77.2Confident94 Ų94100.2 Ų100.250%0.50353%0.526SS..Hα-helixtrans-61.6-40.2176.4-69.7-18.3000111.8R153 N160 S161R153-D157 WeakPolarHBondContact O-CB 3.4Å; R153-D157 VanDerWaalsContact O-CG 3.23Å; R153-D157 PolarHBondContact O-N 3.43Å; D157-N160 CarbonylContact O-C 3.57Å; D157-N160 PolarHBondContact O-N 2.86Å; D157-S161 PolarHBondContact O-N 3.44Å
158M77.1Confident78Confident116 Ų116100.4 Ų100.457%0.57152%0.524SS*.Hα-helixtrans-68-38.2178.6-169.1174.173.500112.2R154 L155 G156 S161 F164R154-M158 VanDerWaalsContact O-CB 3.29Å; R154-M158 WeakPolarHBondContact O-CB 3.27Å; R154-M158 PolarHBondContact O-N 3.33Å; L155-M158 HydrophobicContact CD1-CE 3.76Å; L155-M158 PolarHBondContact O-N 2.85Å; G156-M158 VanDerWaalsContact C-N 3.33Å; G156-M158 PolarHBondContact O-N 2.93Å; M158-S161 WeakPolarHBondContact O-CB 3.16Å; M158-S161 PolarHBondContact O-N 3.03Å; M158-S161 PolarHBondContact O-OG 2.8Å; M158-F164 VanDerWaalsContact O-CB 3.3Å; M158-F164 WeakPolarHBondContact O-CB 3.31Å
159R75.9Confident77.9Confident177 Ų177103.9 Ų103.967%0.66854%0.536SS*.Hα-helixtrans-72.6-30.6177.5-157.2174.6-179.2158.1-0.3112.3L155 G156 S161 F164L155-R159 WeakPolarHBondContact O-CB 3.5Å; L155-R159 PolarHBondContact O-N 3.36Å; G156-R159 PolarHBondContact O-N 2.8Å; R159-S161 VanDerWaalsContact C-N 3.26Å; R159-F164 HydrophobicContact CG-CD1 3.98Å; R159-F164 HydrophobicContact CG-CE1 3.74Å; R159-F164 HydrophobicContact CG-CZ 4.38Å; R159-F164 WeakPolarHBondContact O-CD1 3.24Å
160N77.9Confident77.9Confident106 Ų106108 Ų10857%0.56755%0.547SS*.THydrogen-bonded Turntrans-85.61.7172.6-159.733.6000112.9G156 D157 K165G156-N160 WeakPolarHBondContact O-CB 3.48Å; G156-N160 PolarHBondContact O-N 2.86Å; D157-N160 CarbonylContact O-C 3.57Å; D157-N160 PolarHBondContact O-N 2.86Å; N160-K165 WeakPolarHBondContact OD1-CE 3.32Å; N160-K165 PolarHBondContact OD1-NZ 3.25Å
161S83.5Confident77.6Confident28 Ų28108.9 Ų108.920%0.19655%0.547CS..SBendtrans-70.9149.7-175.975.50000112.2D157 M158 R159 T163 F164 K165D157-S161 PolarHBondContact O-N 3.44Å; M158-S161 WeakPolarHBondContact O-CB 3.16Å; M158-S161 PolarHBondContact O-N 3.03Å; M158-S161 PolarHBondContact O-OG 2.8Å; R159-S161 VanDerWaalsContact C-N 3.26Å; S161-T163 PolarHBondContact O-N 2.83Å; S161-F164 PolarHBondContact O-N 2.82Å; S161-F164 PolarHBondContact OG-N 3.48Å; S161-K165 PolarHBondContact O-N 3.39Å
162P75.6Confident77Confident104 Ų104105.5 Ų105.568%0.67554%0.54SS*.Hα-helixtrans-56.7-34.1177.5-24.333.4000113S166P162-S166 VanDerWaalsContact O-CB 3.28Å; P162-S166 WeakPolarHBondContact O-CB 2.94Å; P162-S166 PolarHBondContact O-N 3.38Å; P162-S166 PolarHBondContact O-OG 3Å
163T76.9Confident76.2Confident116 Ų116106.8 Ų106.871%0.71254%0.541SS*.Hα-helixtrans-72.3-42-178.6-45.10000112.2S161 F167S161-T163 PolarHBondContact O-N 2.83Å; T163-F167 PolarHBondContact O-N 3.15Å; T163-F167 VanDerWaalsContact O-N 3.17Å
164F78.1Confident75Confident79 Ų79103.6 Ų103.635%0.34654%0.538SS..Hα-helixtrans-70.5-42.2176.5-172.3-93.7000111.4M158 R159 S161 S166 F167 E168M158-F164 VanDerWaalsContact O-CB 3.3Å; M158-F164 WeakPolarHBondContact O-CB 3.31Å; R159-F164 HydrophobicContact CG-CD1 3.98Å; R159-F164 HydrophobicContact CG-CE1 3.74Å; R159-F164 HydrophobicContact CG-CZ 4.38Å; R159-F164 WeakPolarHBondContact O-CD1 3.24Å; S161-F164 PolarHBondContact O-N 2.82Å; S161-F164 PolarHBondContact OG-N 3.48Å; F164-S166 PolarHBondContact O-N 2.72Å; F164-F167 WeakPolarHBondContact O-CB 3.27Å; F164-F167 PolarHBondContact O-N 3.43Å; F164-F167 VanDerWaalsContact O-N 3.14Å; F164-E168 PolarHBondContact O-N 2.74Å
165K80.1Confident73.6Confident93 Ų93103.6 Ų103.640%0.40454%0.543SS..Hα-helixtrans-59.7-44.1173.3-71.4-171.6179.5-178.60112.1N160 S161 F167 E168 D169N160-K165 WeakPolarHBondContact OD1-CE 3.32Å; N160-K165 PolarHBondContact OD1-NZ 3.25Å; S161-K165 PolarHBondContact O-N 3.39Å; K165-F167 PolarHBondContact O-N 2.92Å; K165-E168 PolarHBondContact O-N 2.8Å; K165-D169 WeakPolarHBondContact O-CB 3.46Å; K165-D169 VanDerWaalsContact O-CG 3.24Å; K165-D169 PolarHBondContact O-N 3.42Å
166S78.2Confident72.1Confident75 Ų75106.3 Ų106.352%0.52455%0.552SS.*Hα-helixtrans-61.3-31.8176.3-62.40000112.9P162 F164 K170P162-S166 VanDerWaalsContact O-CB 3.28Å; P162-S166 WeakPolarHBondContact O-CB 2.94Å; P162-S166 PolarHBondContact O-N 3.38Å; P162-S166 PolarHBondContact O-OG 3Å; F164-S166 PolarHBondContact O-N 2.72Å; S166-K170 WeakPolarHBondContact O-CB 3.14Å; S166-K170 PolarHBondContact O-N 3.04Å
167F74.7Confident70.7Confident132 Ų132112.7 Ų112.758%0.57957%0.569SS**Hα-helixtrans-75.3-44.3174.4-178.8-97.7000112T163 F164 K165 D169 K170 V171T163-F167 PolarHBondContact O-N 3.15Å; T163-F167 VanDerWaalsContact O-N 3.17Å; F164-F167 WeakPolarHBondContact O-CB 3.27Å; F164-F167 PolarHBondContact O-N 3.43Å; F164-F167 VanDerWaalsContact O-N 3.14Å; K165-F167 PolarHBondContact O-N 2.92Å; F167-D169 VanDerWaalsContact C-N 3.33Å; F167-D169 PolarHBondContact O-N 2.9Å; F167-K170 PolarHBondContact O-N 3.23Å; F167-V171 HydrophobicContact CD1-CG2 4.29Å; F167-V171 HydrophobicContact CD2-CG2 4.47Å; F167-V171 HydrophobicContact CE1-CG2 3.88Å; F167-V171 HydrophobicContact CE2-CG2 4.08Å; F167-V171 HydrophobicContact CZ-CG2 3.76Å; F167-V171 WeakPolarHBondContact O-CG2 3.26Å; F167-V171 PolarHBondContact O-N 2.65Å
168E77.2Confident69.1Low112 Ų112114.6 Ų114.652%0.52358%0.583SS.*Hα-helixtrans-58-43.8172.8-177.9173.5-168.300111.4F164 K165 K170 V171 G172F164-E168 PolarHBondContact O-N 2.74Å; K165-E168 PolarHBondContact O-N 2.8Å; E168-K170 VanDerWaalsContact C-N 3.33Å; E168-K170 PolarHBondContact O-N 3.13Å; E168-V171 PolarHBondContact O-N 3.03Å; E168-G172 WeakPolarHBondContact O-CA 3.4Å; E168-G172 PolarHBondContact O-N 2.72Å
169D73.1Confident67.9Low102 Ų102114.8 Ų114.855%0.54559%0.591SS.*Hα-helixtrans-64.6-37.6176.7-70.6-30.2000111.7K165 F167 N173K165-D169 WeakPolarHBondContact O-CB 3.46Å; K165-D169 VanDerWaalsContact O-CG 3.24Å; K165-D169 PolarHBondContact O-N 3.42Å; F167-D169 VanDerWaalsContact C-N 3.33Å; F167-D169 PolarHBondContact O-N 2.9Å; D169-N173 VanDerWaalsContact O-CB 3.26Å; D169-N173 WeakPolarHBondContact O-CB 3.28Å; D169-N173 PolarHBondContact O-N 2.95Å; D169-N173 PolarHBondContact O-ND2 3.39Å
170K72.6Confident66Low169 Ų169109 Ų10974%0.73559%0.586SS**Hα-helixtrans-68.6-40.3176.1-109.6-174.5176.6-1570112.8S166 F167 E168S166-K170 WeakPolarHBondContact O-CB 3.14Å; S166-K170 PolarHBondContact O-N 3.04Å; F167-K170 PolarHBondContact O-N 3.23Å; E168-K170 VanDerWaalsContact C-N 3.33Å; E168-K170 PolarHBondContact O-N 3.13Å
171V69.6Low64.8Low68 Ų68110.5 Ų110.541%0.41260%0.602SS.*Hα-helixtrans-82.4-34-178.9175.40000111.6F167 E168 L174F167-V171 HydrophobicContact CD1-CG2 4.29Å; F167-V171 HydrophobicContact CD2-CG2 4.47Å; F167-V171 HydrophobicContact CE1-CG2 3.88Å; F167-V171 HydrophobicContact CE2-CG2 4.08Å; F167-V171 HydrophobicContact CZ-CG2 3.76Å; F167-V171 WeakPolarHBondContact O-CG2 3.26Å; F167-V171 PolarHBondContact O-N 2.65Å; E168-V171 PolarHBondContact O-N 3.03Å; V171-L174 WeakPolarHBondContact O-CB 3.35Å; V171-L174 PolarHBondContact O-N 3.01Å
172G62.8Low62.8Low43 Ų43121.1 Ų121.144%0.44364%0.638SS.*Hα-helixtrans-63.1-42.4172.200000111.6E168 L174 K175 H176E168-G172 WeakPolarHBondContact O-CA 3.4Å; E168-G172 PolarHBondContact O-N 2.72Å; G172-L174 PolarHBondContact O-N 2.8Å; G172-K175 PolarHBondContact O-N 3.45Å; G172-K175 VanDerWaalsContact O-N 3.13Å; G172-H176 PolarHBondContact O-N 3.43Å
173N61.1Low61Low108 Ų108119.6 Ų119.658%0.57864%0.641SS**Hα-helixtrans-64-19.3171.3-84.8-53.1000113.8D169 H176 K177D169-N173 VanDerWaalsContact O-CB 3.26Å; D169-N173 WeakPolarHBondContact O-CB 3.28Å; D169-N173 PolarHBondContact O-N 2.95Å; D169-N173 PolarHBondContact O-ND2 3.39Å; N173-H176 PolarHBondContact O-N 2.66Å; N173-K177 WeakPolarHBondContact O-CB 3.11Å; N173-K177 PolarHBondContact O-N 2.68Å
174L54.6Low59.3Low127 Ų127122.4 Ų122.467%0.66565%0.652SS**Hα-helixtrans-73.6-31.7174.7-15471.1000111.9V171 G172 H176 K177V171-L174 WeakPolarHBondContact O-CB 3.35Å; V171-L174 PolarHBondContact O-N 3.01Å; G172-L174 PolarHBondContact O-N 2.8Å; L174-H176 VanDerWaalsContact C-N 3.31Å; L174-K177 PolarHBondContact O-N 3.18Å
175K52.1Low57.3Low186 Ų186121.7 Ų121.781%0.80967%0.667SS**Hα-helixtrans-70.8-27.1172.5-64.1-157.4-179.2-1590112.7G172 K177G172-K175 PolarHBondContact O-N 3.45Å; G172-K175 VanDerWaalsContact O-N 3.13Å; K175-K177 VanDerWaalsContact C-N 3.34Å
176H50.5Low55.2Low156 Ų156124.7 Ų124.772%0.72269%0.687SS**THydrogen-bonded Turntrans-87-1.7178.1-140.1-67.7000113.9G172 N173 L174G172-H176 PolarHBondContact O-N 3.43Å; N173-H176 PolarHBondContact O-N 2.66Å; L174-H176 VanDerWaalsContact C-N 3.31Å
177K50.8Low53.7Low175 Ų175125.8 Ų125.876%0.76170%0.7SS**THydrogen-bonded Turntrans-111.916.3-176.2-153.2163.4171.9176.60114.4N173 L174 K175N173-K177 WeakPolarHBondContact O-CB 3.11Å; N173-K177 PolarHBondContact O-N 2.68Å; L174-K177 PolarHBondContact O-N 3.18Å; K175-K177 VanDerWaalsContact C-N 3.34Å
178V49.1Very low51.9Low134 Ų134125.8 Ų125.881%0.81271%0.711SS**SBendtrans-105.732.8157.3-178.90000110.3
179V50.8Low50Low120 Ų120125.4 Ų125.473%0.72772%0.721SS**SBendtrans-120.691.9155.5171.60000105.4
180G37.7Very low48.2Very low56 Ų56126.1 Ų126.158%0.57773%0.734SS**  trans-66.1153.4174.100000111.5R182G180-R182 PolarHBondContact O-N 3.46Å
181P51.4Low47.1Very low137 Ų137123.4 Ų123.489%0.8973%0.734SS**  trans-70.9124.1-170.130.4-33.3000110.5
182R42.9Very low45.6Very low251 Ų251125.6 Ų125.695%0.94775%0.747SS**  trans-106.9115.2171.9-143.3168.9160.7143.1-5.5108.1G180G180-R182 PolarHBondContact O-N 3.46Å
183G37.3Very low44.3Very low73 Ų73130.2 Ų130.275%0.75376%0.762SS**  trans-68.2142.9-172.100000114.7
184N41.8Very low43.4Very low175 Ų175130.9 Ų130.994%0.93677%0.77SS**  trans39120.4133.3-130.957.9000120.3
185G35.2Very low42.7Very low64 Ų64130.9 Ų130.966%0.6678%0.775SS**  trans170.679.3164.300000113.6
186D35.4Very low42.4Very low156 Ų156126.9 Ų126.983%0.83477%0.768SS**  trans53.3113.6150.4-61.3-48.1000122.8
187A47Very low42.1Very low97 Ų97125.2 Ų125.280%0.80277%0.769SS**  trans24117.4137.400000119.2
188V38Very low42Very low133 Ų133123.8 Ų123.881%0.80677%0.765SS**  -170.8127.7114.264.90000110.9
189S36.1Very low41.5Very low104 Ų104124.5 Ų124.573%0.72776%0.759SS**  trans61.5109.3156.749.90000121.8
190S36.3Very low41.8Very low116 Ų116126.4 Ų126.481%0.81177%0.765SS**  trans-98.8154.9134.6-67.90000108.3
191P48.3Very low43.1Very low113 Ų113128.3 Ų128.373%0.73477%0.768SS**  -128.5141.973.816.76000113
192T38.6Very low43.9Very low114 Ų114127.5 Ų127.570%0.69976%0.762SS**  37.8118.896.735.90000113.5
193D35.5Very low44.6Very low139 Ų139128.9 Ų128.974%0.74378%0.776SS**  169.415681.8-107-43.3000105.4
194T41.1Very low45Very low123 Ų123131.7 Ų131.776%0.75578%0.777SS**  cis-170.6137.132.324.70000108.4
195T40.2Very low45.1Very low126 Ų126129.4 Ų129.477%0.77377%0.769SS**  trans-58.1160.8153.8-43.80000109.1
196P46.6Very low45.7Very low103 Ų103133.1 Ų133.167%0.66978%0.775SS**  cis-157.1172.446.443.4-19.2000120.4
197T44.7Very low46.3Very low120 Ų120131.7 Ų131.774%0.73677%0.771SS**  trans30.4138.2146.155.70000119.4
198H47.7Very low46.3Very low146 Ų146133.9 Ų133.968%0.67677%0.769SS**  -178.3136.582.7-144.2-17.1000111.8
199E39Very low46.8Very low148 Ų148133.9 Ų133.969%0.69277%0.767SS**  trans44.1138.7138.673.4-163.2157.300124.3
200N57.9Low47.6Very low160 Ų160136.1 Ų136.186%0.85677%0.77SS**  trans-136.5122.5162.7-144.8-3.1000107.4
201P64.3Low48.4Very low97 Ų97137.6 Ų137.663%0.6377%0.767SS**  trans-92.9155.9174.834.3-30.7000112.1
202P67.6Low48.4Very low119 Ų119139.7 Ų139.777%0.77377%0.769SS**  trans-88.614517234.8-30.4000111.8
203F58.3Low49.3Very low281 Ų281142 Ų142100%1.23278%0.776SS**  trans-122.50150.1-78-74.9000108.3

Retrieved 203 of 203 residues in 486.2 ms (Link to these results)