A0A096M1D6_POEFO Loading...

Protein CUSTOS

AlphaFold DB (A0A3B3VKM6), UniProt , Accession A0A096M1D6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 240 aa.

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(Predicted Aligned Error values between residue pairs)
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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
1M38.4Very low48.8Very low243 Ų243172.2 Ų172.2100%1.19788%0.881SS**  0990-69-64.217100107.6
2A39.6Very low49.4Very low106 Ų106169.9 Ų169.988%0.87687%0.872SS**  trans-122.4113.1-178.500000108.8
3S44.1Very low49.9Very low131 Ų131166.1 Ų166.192%0.91687%0.869SS**  trans-85.1118.7-178.8-57.20000110.1
4R50Low50.3Low230 Ų230163.2 Ų163.287%0.86887%0.87SS**  trans-87.2111.1175.5-177.3178.9179-153.80.1108.9E6R4-E6 PolarHBondContact O-N 3.1Å
5A56.8Low50.7Low97 Ų97159.7 Ų159.780%0.80286%0.864SS**  trans-72.2118.3171.100000109.8R7A5-R7 PolarHBondContact O-N 3.14Å
6E51.3Low51Low172 Ų172156.4 Ų156.480%0.80486%0.856SS**  trans-73.1118.6170.5-67.2-161126.300110R4 R8R4-E6 PolarHBondContact O-N 3.1Å; E6-R8 PolarHBondContact O-N 3Å
7R51.6Low51.5Low237 Ų237152 Ų15289%0.89483%0.832SS**  trans-80.9105.6173.2-152.8-177.3-64156.5-1.5107.3A5 V9A5-R7 PolarHBondContact O-N 3.14Å; R7-V9 PolarHBondContact O-N 2.81Å
8R52.2Low51.9Low234 Ų234149.2 Ų149.288%0.88382%0.816SS**  trans-65.1121.4172.4-67.4-159.7173.6-136.6-1109.2E6 S10E6-R8 PolarHBondContact O-N 3Å; R8-S10 PolarHBondContact O-N 3.1Å
9V49.2Very low52.6Low126 Ų126147.9 Ų147.976%0.76480%0.803SS**  trans-86.3104.1170.6-179.60000106.8R7 K11R7-V9 PolarHBondContact O-N 2.81Å; V9-K11 PolarHBondContact O-N 3.36Å
10S48.9Very low53.1Low114 Ų114147.1 Ų147.180%0.79779%0.794SS**  trans-69.6106.6168.3-600000108.7R8R8-S10 PolarHBondContact O-N 3.1Å
11K54.9Low53.5Low204 Ų204144.3 Ų144.389%0.88778%0.778SS**  trans-91.691.4161.2-91.2173.7170.7168.30107V9V9-K11 PolarHBondContact O-N 3.36Å
12D56.3Low54.8Low145 Ų145137.5 Ų137.578%0.77574%0.742SS**  trans-130.7100.7166.1-169.2-119.7000107.9
13S55.9Low56Low120 Ų120140.2 Ų140.284%0.83973%0.734SS**  trans-17867.4162.6-78.70000107.6S15S13-S15 PolarHBondContact O-N 2.81Å
14S54.4Low56.9Low126 Ų126137.8 Ų137.888%0.88172%0.716SS**  trans-92.885.6162.6-155.90000106.5S16S14-S16 PolarHBondContact O-N 3.01Å
15S56.3Low57.6Low111 Ų111135.2 Ų135.278%0.77671%0.706SS**  trans-66.4127.5-177.1-171.50000110.9S13 D17S13-S15 PolarHBondContact O-N 2.81Å; S15-D17 PolarHBondContact O-N 2.74Å
16S56Low57.8Low106 Ų106139.2 Ų139.274%0.74171%0.708SS**  trans-74.275.5-179.1172.90000111.7S14S14-S16 PolarHBondContact O-N 3.01Å
17D58.8Low58.4Low82 Ų82134.7 Ų134.744%0.43970%0.701SS.*  trans-95.5-6.3-178.1-171.755.4000114S15 E19 E20 L21S15-D17 PolarHBondContact O-N 2.74Å; D17-E19 VanDerWaalsContact C-N 3.31Å; D17-E19 PolarHBondContact O-N 3.49Å; D17-E20 PolarHBondContact O-N 2.91Å; D17-L21 WeakPolarHBondContact O-CG 3.16Å; D17-L21 PolarHBondContact O-N 3.28Å; D17-L21 WeakPolarHBondContact OD2-CD1 3.15Å
18D60.4Low59Low102 Ų102127.9 Ų127.955%0.54569%0.685SS.*Hα-helixtrans-69.9-27.1-170.1-152.7-99.6000113.3K22D18-K22 VanDerWaalsContact O-CG 3.31Å; D18-K22 WeakPolarHBondContact O-CG 3.41Å; D18-K22 PolarHBondContact O-N 3.11Å; D18-K22 WeakPolarHBondContact OD1-CE 3.26Å; D18-K22 IonicContact OD1-NZ 2.86Å; D18-K22 PolarHBondContact OD1-NZ 3.2Å
19E64.9Low59.2Low124 Ų124128.1 Ų128.158%0.57969%0.686SS**Hα-helixtrans-82.5-32.4-179.2-66.2-65.2114.700113D17 K22 K23D17-E19 VanDerWaalsContact C-N 3.31Å; D17-E19 PolarHBondContact O-N 3.49Å; E19-K22 PolarHBondContact O-N 2.87Å; E19-K22 IonicContact OE1-NZ 2.78Å; E19-K22 PolarHBondContact OE1-NZ 3.11Å; E19-K23 PolarHBondContact O-N 3.31Å
20E62Low59.8Low132 Ų132130.2 Ų130.262%0.61769%0.688SS**Hα-helixtrans-70.5-40.6175.1-83.4176.9153.400111.1D17 K22 K23 C24D17-E20 PolarHBondContact O-N 2.91Å; E20-K22 VanDerWaalsContact C-N 3.27Å; E20-K22 PolarHBondContact O-N 3.33Å; E20-K23 PolarHBondContact O-N 2.7Å; E20-K23 VanDerWaalsContact O-N 3.15Å; E20-C24 PolarHBondContact O-N 3.23Å; E20-C24 VanDerWaalsContact O-N 3.08Å; E20-C24 PolarHBondContact O-SG 3.26Å; E20-C24 VanDerWaalsContact O-SG 3.39Å
21L60.6Low60.1Low89 Ų89129.6 Ų129.647%0.46668%0.683SS.*Hα-helixtrans-61.6-32.4173.4-68.1175.3000112.9D17 C24 R25D17-L21 WeakPolarHBondContact O-CG 3.16Å; D17-L21 PolarHBondContact O-N 3.28Å; D17-L21 WeakPolarHBondContact OD2-CD1 3.15Å; L21-C24 PolarHBondContact O-N 3.15Å; L21-R25 PolarHBondContact O-N 3.26Å
22K66.1Low59.9Low99 Ų99127 Ų12743%0.4367%0.674SS.*Hα-helixtrans-68.6-39174.4-75168.7-167154.40112.2D18 E19 E20 C24 R25D18-K22 VanDerWaalsContact O-CG 3.31Å; D18-K22 WeakPolarHBondContact O-CG 3.41Å; D18-K22 PolarHBondContact O-N 3.11Å; D18-K22 WeakPolarHBondContact OD1-CE 3.26Å; D18-K22 IonicContact OD1-NZ 2.86Å; D18-K22 PolarHBondContact OD1-NZ 3.2Å; E19-K22 PolarHBondContact O-N 2.87Å; E19-K22 IonicContact OE1-NZ 2.78Å; E19-K22 PolarHBondContact OE1-NZ 3.11Å; E20-K22 VanDerWaalsContact C-N 3.27Å; E20-K22 PolarHBondContact O-N 3.33Å; K22-C24 VanDerWaalsContact C-N 3.29Å; K22-C24 PolarHBondContact O-N 3.41Å; K22-R25 WeakPolarHBondContact O-CB 3.34Å; K22-R25 PolarHBondContact O-N 2.73Å
23K65.2Low59.9Low163 Ų163125.5 Ų125.571%0.70967%0.67SS**Hα-helixtrans-67.4-32.1175.9-166.4148.468.1-171.20112E19 E20 R25E19-K23 PolarHBondContact O-N 3.31Å; E20-K23 PolarHBondContact O-N 2.7Å; E20-K23 VanDerWaalsContact O-N 3.15Å; K23-R25 VanDerWaalsContact C-N 3.27Å; K23-R25 PolarHBondContact O-N 3.16Å
24C62.8Low59.5Low80 Ų80127.3 Ų127.354%0.54166%0.664SS.*Hα-helixtrans-72.4-14.2174.7-65.20000114.2E20 L21 K22E20-C24 PolarHBondContact O-N 3.23Å; E20-C24 VanDerWaalsContact O-N 3.08Å; E20-C24 PolarHBondContact O-SG 3.26Å; E20-C24 VanDerWaalsContact O-SG 3.39Å; L21-C24 PolarHBondContact O-N 3.15Å; K22-C24 VanDerWaalsContact C-N 3.29Å; K22-C24 PolarHBondContact O-N 3.41Å
25R64.3Low59.3Low176 Ų176130.3 Ų130.366%0.66466%0.661SS**Hα-helixtrans-71.8-28.9175.3-71.8178.3-161.3-106.51.8113.1L21 K22 K23 A27 V28L21-R25 PolarHBondContact O-N 3.26Å; K22-R25 WeakPolarHBondContact O-CB 3.34Å; K22-R25 PolarHBondContact O-N 2.73Å; K23-R25 VanDerWaalsContact C-N 3.27Å; K23-R25 PolarHBondContact O-N 3.16Å; R25-A27 PolarHBondContact O-N 3.26Å; R25-V28 PolarHBondContact O-N 3.08Å; R25-V28 VanDerWaalsContact O-N 3.13Å
26E61.8Low58.9Low181 Ų181129.5 Ų129.585%0.84666%0.661SS**THydrogen-bonded Turntrans-64.8-27179.5-169.6176.2-178.800112.3
27A63.6Low58.6Low78 Ų78130.8 Ų130.865%0.64566%0.664SS**THydrogen-bonded Turntrans-91.8-2.6177.600000114R25 W29R25-A27 PolarHBondContact O-N 3.26Å; A27-W29 PolarHBondContact O-N 3.09Å
28V64.2Low58.1Low93 Ų93135.2 Ų135.256%0.56469%0.688SS**  trans-86.5111.7176.41730000108.7R25 E30R25-V28 PolarHBondContact O-N 3.08Å; R25-V28 VanDerWaalsContact O-N 3.13Å; V28-E30 VanDerWaalsContact C-N 3.31Å; V28-E30 HydrophobicContact CG1-CG 4.47Å; V28-E30 PolarHBondContact O-N 2.9Å
29W57Low57.4Low239 Ų239133.5 Ų133.591%0.90569%0.694SS**  trans-69.693.7168.3-68.954.1000107.2A27 S31A27-W29 PolarHBondContact O-N 3.09Å; W29-S31 PolarHBondContact O-N 2.88Å
30E61.4Low56.6Low171 Ų171136.1 Ų136.180%0.79971%0.713SS**  trans-59.399175.4-71.3-173.6171.200109.1V28 Q32V28-E30 VanDerWaalsContact C-N 3.31Å; V28-E30 HydrophobicContact CG1-CG 4.47Å; V28-E30 PolarHBondContact O-N 2.9Å; E30-Q32 PolarHBondContact O-N 2.8Å; E30-Q32 VanDerWaalsContact O-N 3.08Å
31S56.3Low55.8Low100 Ų100132.4 Ų132.470%0.69971%0.709SS**  trans-71.9102.8166.6-58.10000106.1W29 T33W29-S31 PolarHBondContact O-N 2.88Å; S31-T33 VanDerWaalsContact C-N 3.33Å; S31-T33 PolarHBondContact O-N 3.09Å
32Q50.5Low55.5Low150 Ų150134 Ų13470%0.70173%0.728SS**  trans-53.996.1178.6-170167.327.700109.9E30 F34E30-Q32 PolarHBondContact O-N 2.8Å; E30-Q32 VanDerWaalsContact O-N 3.08Å; Q32-F34 HydrophobicContact CB-CE2 4.45Å; Q32-F34 HydrophobicContact CB-CZ 4.42Å; Q32-F34 HydrophobicContact CG-CD1 4.3Å; Q32-F34 HydrophobicContact CG-CE1 3.87Å; Q32-F34 HydrophobicContact CG-CE2 4.09Å; Q32-F34 HydrophobicContact CG-CZ 3.74Å; Q32-F34 PolarHBondContact O-N 3.3Å
33T55.1Low54.8Low113 Ų113135.4 Ų135.469%0.69375%0.745SS**  trans-86.595.7169.340.60000106.3S31 K35S31-T33 VanDerWaalsContact C-N 3.33Å; S31-T33 PolarHBondContact O-N 3.09Å; T33-K35 PolarHBondContact O-N 3.38Å; T33-K35 VanDerWaalsContact O-N 3.16Å
34F48.4Very low54.3Low158 Ų158136.8 Ų136.869%0.69375%0.751SS**  trans-53.7122169.1-57.7-83.9000107.7Q32 A36Q32-F34 HydrophobicContact CB-CE2 4.45Å; Q32-F34 HydrophobicContact CB-CZ 4.42Å; Q32-F34 HydrophobicContact CG-CD1 4.3Å; Q32-F34 HydrophobicContact CG-CE1 3.87Å; Q32-F34 HydrophobicContact CG-CE2 4.09Å; Q32-F34 HydrophobicContact CG-CZ 3.74Å; Q32-F34 PolarHBondContact O-N 3.3Å; F34-A36 PolarHBondContact O-N 2.91Å
35K50.5Low54.1Low189 Ų189141.9 Ų141.982%0.82277%0.767SS**  trans-61.9110.7174.4-59.4-65.4-177.3-179.50107.1T33 T37T33-K35 PolarHBondContact O-N 3.38Å; T33-K35 VanDerWaalsContact O-N 3.16Å; K35-T37 PolarHBondContact O-N 2.78Å; K35-T37 VanDerWaalsContact O-N 3.11Å
36A46.2Very low53.8Low95 Ų95141.5 Ų141.579%0.78577%0.772SS**  trans-65.9108.1168.600000107.5F34F34-A36 PolarHBondContact O-N 2.91Å
37T51.2Low53.9Low132 Ų132136.4 Ų136.481%0.8176%0.757SS**  trans-65.1124154.738.80000107.2K35 G39K35-T37 PolarHBondContact O-N 2.78Å; K35-T37 VanDerWaalsContact O-N 3.11Å; T37-G39 PolarHBondContact O-N 3.43Å; T37-G39 VanDerWaalsContact O-N 3.08Å
38D48.2Very low53.9Low175 Ų175142.3 Ų142.394%0.93677%0.768SS**SBendtrans-46.1113.8175.2-69.1-61.6000110.8
39G44.5Very low54Low66 Ų66147.9 Ų147.968%0.6878%0.779SS**  trans-174.697.2-175.300000109.1T37 G41T37-G39 PolarHBondContact O-N 3.43Å; T37-G39 VanDerWaalsContact O-N 3.08Å; G39-G41 PolarHBondContact O-N 3.44Å
40D48.9Very low54.2Low180 Ų180142.3 Ų142.396%0.96377%0.771SS**  trans-38.1126.6168.2179.335.5000112
41G46Very low54.4Low53 Ų53138.8 Ų138.855%0.54676%0.761SS.*  trans160.293.3-17600000111.6G39 V43G39-G41 PolarHBondContact O-N 3.44Å; G41-V43 VanDerWaalsContact C-N 3.29Å; G41-V43 PolarHBondContact O-N 3.45Å
42S52.3Low54.6Low123 Ų123140 Ų14086%0.8676%0.763SS**  trans-59.286.5170.763.40000111.1
43V52.6Low55.3Low128 Ų128137.2 Ų137.278%0.77677%0.766SS**  trans-101.2101.4165.6-172.90000105.8G41 Q45G41-V43 VanDerWaalsContact C-N 3.29Å; G41-V43 PolarHBondContact O-N 3.45Å; V43-Q45 PolarHBondContact O-N 3.28Å
44K54.8Low55.8Low192 Ų192138.1 Ų138.184%0.83577%0.767SS**  trans-46.6113.5167.2-68.2178.4178.3-179.90106.6E46K44-E46 PolarHBondContact O-N 3.04Å
45Q57.6Low56.9Low188 Ų188136 Ų13688%0.87976%0.759SS**  trans-66.384.2172.3-174.3179.5-24.100106.6V43 S47V43-Q45 PolarHBondContact O-N 3.28Å; Q45-S47 PolarHBondContact O-N 3.26Å
46E57.9Low57.8Low168 Ų168135 Ų13579%0.78576%0.757SS**  trans-58.6112.7170.750.6-177.4170.300107K44 K48K44-E46 PolarHBondContact O-N 3.04Å; E46-K48 PolarHBondContact O-N 2.83Å
47S64.3Low58.9Low74 Ų74135.8 Ų135.852%0.51775%0.745SS.*  trans-59.1107.6177.7167.70000107.7Q45 R49Q45-S47 PolarHBondContact O-N 3.26Å; S47-R49 PolarHBondContact O-N 3.04Å; S47-R49 WeakPolarHBondContact OG-CB 3.39Å; S47-R49 WeakPolarHBondContact OG-CD 3.45Å; S47-R49 WeakPolarHBondContact OG-CG 3.01Å; S47-R49 PolarHBondContact OG-NE 3.42Å
48K63.4Low59.8Low201 Ų201135.8 Ų135.887%0.87474%0.74SS**  trans-63.816.8171.6-60.9-177.6179.8-178.80113.8E46 V50E46-K48 PolarHBondContact O-N 2.83Å; K48-V50 PolarHBondContact O-N 3.19Å
49R66.2Low60.9Low210 Ų210130.9 Ų130.979%0.79273%0.73SS**  trans-62.1112.4167.1-69.6-178.9-138-165.81.5105.5S47 V51S47-R49 PolarHBondContact O-N 3.04Å; S47-R49 WeakPolarHBondContact OG-CB 3.39Å; S47-R49 WeakPolarHBondContact OG-CD 3.45Å; S47-R49 WeakPolarHBondContact OG-CG 3.01Å; S47-R49 PolarHBondContact OG-NE 3.42Å; R49-V51 PolarHBondContact O-N 3.22Å; R49-V51 VanDerWaalsContact O-N 3.1Å
50V61.7Low62.1Low123 Ų123134 Ų13475%0.74573%0.731SS**  trans-46.5121.7163.3169.50000106.3K48 V52K48-V50 PolarHBondContact O-N 3.19Å; V50-V52 VanDerWaalsContact C-N 3.31Å; V50-V52 WeakPolarHBondContact O-CG2 3.21Å; V50-V52 PolarHBondContact O-N 3.39Å
51V65.3Low63.6Low96 Ų96131.9 Ų131.958%0.58272%0.715SS**  trans-64.199.6173.8173.90000105.8R49 A53 D54R49-V51 PolarHBondContact O-N 3.22Å; R49-V51 VanDerWaalsContact O-N 3.1Å; V51-A53 HydrophobicContact CG1-CB 3.9Å; V51-A53 PolarHBondContact O-N 3.4Å; V51-A53 VanDerWaalsContact O-N 3.09Å; V51-D54 PolarHBondContact O-N 3.32Å
52V61.8Low65.2Low125 Ų125136.4 Ų136.476%0.75873%0.726SS**G310 helixtrans-62.3-16.9-177.8-177.10000111.4V50 D54 H55V50-V52 VanDerWaalsContact C-N 3.31Å; V50-V52 WeakPolarHBondContact O-CG2 3.21Å; V50-V52 PolarHBondContact O-N 3.39Å; V52-D54 VanDerWaalsContact C-N 3.26Å; V52-D54 PolarHBondContact O-N 3.04Å; V52-H55 PolarHBondContact O-N 3.38Å
53A63.8Low66.7Low92 Ų92139.9 Ų139.976%0.7673%0.729SS**G310 helixtrans-69.5-17.1178.800000114.5V51V51-A53 HydrophobicContact CG1-CB 3.9Å; V51-A53 PolarHBondContact O-N 3.4Å; V51-A53 VanDerWaalsContact O-N 3.09Å
54D66.4Low68.5Low132 Ų132137.1 Ų137.171%0.70671%0.712SS**G310 helixtrans-99.515.3-179.4-75.2-11.8000113V51 V52 E56V51-D54 PolarHBondContact O-N 3.32Å; V52-D54 VanDerWaalsContact C-N 3.26Å; V52-D54 PolarHBondContact O-N 3.04Å; D54-E56 VanDerWaalsContact C-N 3.31Å; D54-E56 PolarHBondContact O-N 3.45Å
55H70.4Confident70.4Confident114 Ų114132.5 Ų132.553%0.52870%0.7SS.*  trans-78.684.6173.6-162.245000109.9V52 H57 D58V52-H55 PolarHBondContact O-N 3.38Å; H55-H57 PolarHBondContact CD2-O 3.25Å; H55-H57 PolarHBondContact CE1-O 2.98Å; H55-H57 PolarHBondContact NE2-O 3.13Å; H55-H57 PolarHBondContact O-N 2.94Å; H55-H57 VanDerWaalsContact O-N 3.07Å; H55-D58 VanDerWaalsContact CD2-CA 3.48Å; H55-D58 WeakPolarHBondContact CD2-CA 3.37Å; H55-D58 IonicContact CD2-OD1 3.85Å; H55-D58 PolarHBondContact CD2-OD1 2.93Å
56E70.1Confident72.2Confident168 Ų168130.9 Ų130.979%0.78569%0.693SS**SBendtrans-62.9-13.9-177.2-65.9-171.4145.300114D54D54-E56 VanDerWaalsContact C-N 3.31Å; D54-E56 PolarHBondContact O-N 3.45Å
57H68.7Low74.1Confident112 Ų112125.3 Ų125.352%0.51968%0.68SS.*  trans-145.1101.2178.5-61.6-69.8000109.4H55 G59 E61H55-H57 PolarHBondContact CD2-O 3.25Å; H55-H57 PolarHBondContact CE1-O 2.98Å; H55-H57 PolarHBondContact NE2-O 3.13Å; H55-H57 PolarHBondContact O-N 2.94Å; H55-H57 VanDerWaalsContact O-N 3.07Å; H57-G59 PolarHBondContact O-N 3.1Å; H57-E61 IonicContact CE1-OE1 2.74Å; H57-E61 IonicContact CG-OE1 3.8Å; H57-E61 IonicContact ND1-OE1 3.42Å; H57-E61 PolarHBondContact ND1-OE1 3.33Å
58D71.6Confident75.6Confident132 Ų132127 Ų12771%0.70668%0.678SS**  trans-569.1175.7-78.5-23000115H55 N60H55-D58 VanDerWaalsContact CD2-CA 3.48Å; H55-D58 WeakPolarHBondContact CD2-CA 3.37Å; H55-D58 IonicContact CD2-OD1 3.85Å; H55-D58 PolarHBondContact CD2-OD1 2.93Å; D58-N60 PolarHBondContact O-N 2.7Å
59G71.6Confident77.2Confident71 Ų71124.4 Ų124.473%0.73266%0.663SS**SBendtrans64.6-2.7-177.700000113.8H57H57-G59 PolarHBondContact O-N 3.1Å
60N68.6Low78.7Confident131 Ų131120.9 Ų120.970%0.70165%0.653SS**  trans-97.79.4-171.7-152.967.5000113D58 L62D58-N60 PolarHBondContact O-N 2.7Å; N60-L62 PolarHBondContact O-N 3.41Å
61E80.2Confident80.4Confident136 Ų136120.2 Ų120.264%0.63664%0.642SS**  trans-75.589.3173.2-65.6-178.3-141.300109.9H57 Q63H57-E61 IonicContact CE1-OE1 2.74Å; H57-E61 IonicContact CG-OE1 3.8Å; H57-E61 IonicContact ND1-OE1 3.42Å; H57-E61 PolarHBondContact ND1-OE1 3.33Å; E61-Q63 PolarHBondContact O-N 3.43Å
62L79.8Confident82Confident149 Ų149118.3 Ų118.378%0.7863%0.63SS**  trans-66.7116.8171.6-64.3178.9000109.2N60 V64N60-L62 PolarHBondContact O-N 3.41Å; L62-V64 PolarHBondContact O-N 3.35Å
63Q83.8Confident83.7Confident196 Ų196115 Ų11592%0.91662%0.616SS**  trans-61.5113.4171.3-65.5-176.5-3.600109.4E61E61-Q63 PolarHBondContact O-N 3.43Å
64V91.6Very high85.3Confident70 Ų70116.7 Ų116.742%0.42460%0.603SS.*  trans-86.5133.8176.6-67.40000111.1L62 F68 R69L62-V64 PolarHBondContact O-N 3.35Å; V64-F68 HydrophobicContact CB-CD1 3.83Å; V64-F68 HydrophobicContact CB-CE1 4.49Å; V64-F68 HydrophobicContact CG1-CD1 3.6Å; V64-F68 HydrophobicContact CG1-CE1 3.79Å; V64-R69 HydrophobicContact CB-CG 4.27Å; V64-R69 HydrophobicContact CG2-CG 3.72Å
65T94.9Very high86.8Confident95 Ų95117 Ų11758%0.58360%0.598SS**  trans-72.6153.4172.565.20000110.5G67 F68 R69T65-G67 PolarHBondContact O-N 3.33Å; T65-F68 WeakPolarHBondContact O-CB 3.47Å; T65-F68 PolarHBondContact O-N 3.48Å; T65-F68 VanDerWaalsContact O-N 3.09Å; T65-F68 WeakPolarHBondContact OG1-CB 3.49Å; T65-F68 PolarHBondContact OG1-N 3.33Å; T65-F68 VanDerWaalsContact OG1-N 3.11Å; T65-R69 PolarHBondContact O-N 3.06Å
66Q95.1Very high88.1Confident154 Ų154116.1 Ų116.172%0.7260%0.596SS**Hα-helixtrans-58.2-34.2173.4-174.1173.213.200112R69 K70Q66-R69 PolarHBondContact O-N 3.45Å; Q66-K70 PolarHBondContact O-N 3.29Å
67G97.1Very high89.3Confident50 Ų50113.5 Ų113.552%0.51558%0.584SS.*Hα-helixtrans-62.5-43.5174.300000112.6T65 K70 H71T65-G67 PolarHBondContact O-N 3.33Å; G67-K70 PolarHBondContact O-N 3.34Å; G67-H71 WeakPolarHBondContact O-CB 3.44Å; G67-H71 PolarHBondContact O-N 2.68Å
68F96.5Very high90.7Very high109 Ų109112.6 Ų112.648%0.47858%0.583SS.*Hα-helixtrans-61.9-46.9175.3179.7-99.1000111.7V64 T65 K70 H71 V72V64-F68 HydrophobicContact CB-CD1 3.83Å; V64-F68 HydrophobicContact CB-CE1 4.49Å; V64-F68 HydrophobicContact CG1-CD1 3.6Å; V64-F68 HydrophobicContact CG1-CE1 3.79Å; T65-F68 WeakPolarHBondContact O-CB 3.47Å; T65-F68 PolarHBondContact O-N 3.48Å; T65-F68 VanDerWaalsContact O-N 3.09Å; T65-F68 WeakPolarHBondContact OG1-CB 3.49Å; T65-F68 PolarHBondContact OG1-N 3.33Å; T65-F68 VanDerWaalsContact OG1-N 3.11Å; F68-K70 VanDerWaalsContact C-N 3.32Å; F68-K70 PolarHBondContact O-N 2.89Å; F68-H71 WeakPolarHBondContact O-CB 3.24Å; F68-H71 PolarHBondContact O-N 2.82Å; F68-H71 VanDerWaalsContact O-N 3.12Å; F68-V72 HydrophobicContact CD1-CG2 4.21Å; F68-V72 HydrophobicContact CD2-CG2 4.49Å; F68-V72 HydrophobicContact CE1-CG2 3.81Å; F68-V72 HydrophobicContact CE2-CG2 4.1Å; F68-V72 HydrophobicContact CZ-CG2 3.76Å; F68-V72 WeakPolarHBondContact O-CG2 3.28Å; F68-V72 PolarHBondContact O-N 2.9Å
69R95.6Very high91.8Very high148 Ų148111.1 Ų111.156%0.55858%0.575SS**Hα-helixtrans-56.9-45.7176.5-67.4-169-69.2-142.6-0.3112V64 T65 Q66 V72 A73V64-R69 HydrophobicContact CB-CG 4.27Å; V64-R69 HydrophobicContact CG2-CG 3.72Å; T65-R69 PolarHBondContact O-N 3.06Å; Q66-R69 PolarHBondContact O-N 3.45Å; R69-V72 PolarHBondContact O-N 3.22Å; R69-A73 WeakPolarHBondContact O-CB 3.43Å; R69-A73 PolarHBondContact O-N 2.89Å
70K97.8Very high93Very high135 Ų135112.6 Ų112.659%0.58757%0.566SS**Hα-helixtrans-64.1-40.4176.6-177.8176.6179.8174.80112.3Q66 G67 F68 A73 R74Q66-K70 PolarHBondContact O-N 3.29Å; G67-K70 PolarHBondContact O-N 3.34Å; F68-K70 VanDerWaalsContact C-N 3.32Å; F68-K70 PolarHBondContact O-N 2.89Å; K70-A73 PolarHBondContact O-N 3.33Å; K70-R74 PolarHBondContact O-N 2.69Å
71H98.1Very high94.3Very high110 Ų110110.4 Ų110.451%0.50955%0.554SS.*Hα-helixtrans-62.8-46.6178.3176.769.7000111.3G67 F68 R74 K75G67-H71 WeakPolarHBondContact O-CB 3.44Å; G67-H71 PolarHBondContact O-N 2.68Å; F68-H71 WeakPolarHBondContact O-CB 3.24Å; F68-H71 PolarHBondContact O-N 2.82Å; F68-H71 VanDerWaalsContact O-N 3.12Å; H71-R74 PolarHBondContact O-N 2.99Å; H71-K75 WeakPolarHBondContact O-CB 3.49Å; H71-K75 PolarHBondContact O-N 2.66Å
72V97.8Very high94.8Very high55 Ų55107.3 Ų107.333%0.33355%0.547SS..Hα-helixtrans-61.4-45.1176.2174.40000110.8F68 R69 R74 K75 L76F68-V72 HydrophobicContact CD1-CG2 4.21Å; F68-V72 HydrophobicContact CD2-CG2 4.49Å; F68-V72 HydrophobicContact CE1-CG2 3.81Å; F68-V72 HydrophobicContact CE2-CG2 4.1Å; F68-V72 HydrophobicContact CZ-CG2 3.76Å; F68-V72 WeakPolarHBondContact O-CG2 3.28Å; F68-V72 PolarHBondContact O-N 2.9Å; R69-V72 PolarHBondContact O-N 3.22Å; V72-R74 PolarHBondContact O-N 3.35Å; V72-K75 PolarHBondContact O-N 3.21Å; V72-K75 VanDerWaalsContact O-N 3.14Å; V72-L76 HydrophobicContact CG1-CD1 3.95Å; V72-L76 HydrophobicContact CG1-CG 4.33Å; V72-L76 WeakPolarHBondContact O-CG 3.39Å; V72-L76 PolarHBondContact O-N 3.4Å
73A97.5Very high95.3Very high56 Ų56103 Ų10346%0.46353%0.529SS..Hα-helixtrans-56.4-48.4177.100000112R69 K70 K75 L76 E77R69-A73 WeakPolarHBondContact O-CB 3.43Å; R69-A73 PolarHBondContact O-N 2.89Å; K70-A73 PolarHBondContact O-N 3.33Å; A73-K75 VanDerWaalsContact C-N 3.35Å; A73-K75 PolarHBondContact O-N 3.11Å; A73-L76 PolarHBondContact O-N 3.22Å; A73-E77 WeakPolarHBondContact O-CB 3.27Å; A73-E77 PolarHBondContact O-N 2.94Å
74R97.3Very high95.5Very high128 Ų12897.6 Ų97.648%0.48351%0.505SS..Hα-helixtrans-62.7-40.9175.9-173.4-176.4-60.1167.6-4.1112.3K70 H71 V72 L76 E77 D78K70-R74 PolarHBondContact O-N 2.69Å; H71-R74 PolarHBondContact O-N 2.99Å; V72-R74 PolarHBondContact O-N 3.35Å; R74-L76 VanDerWaalsContact C-N 3.28Å; R74-L76 PolarHBondContact O-N 3.33Å; R74-E77 WeakPolarHBondContact O-CB 3.49Å; R74-E77 PolarHBondContact O-N 3.05Å; R74-D78 VanDerWaalsContact O-CG 3.23Å; R74-D78 PolarHBondContact O-N 3.32Å
75K97.9Very high95.1Very high139 Ų13997.9 Ų97.960%0.60451%0.511SS*.Hα-helixtrans-64.3-36.7-179.8-165.570.3177.6-178.60111.7H71 V72 A73 L79H71-K75 WeakPolarHBondContact O-CB 3.49Å; H71-K75 PolarHBondContact O-N 2.66Å; V72-K75 PolarHBondContact O-N 3.21Å; V72-K75 VanDerWaalsContact O-N 3.14Å; A73-K75 VanDerWaalsContact C-N 3.35Å; A73-K75 PolarHBondContact O-N 3.11Å; K75-L79 WeakPolarHBondContact O-CB 3.18Å; K75-L79 PolarHBondContact O-N 3.17Å
76L97.9Very high94.3Very high94 Ų9499.3 Ų99.349%0.49251%0.51SS..Hα-helixtrans-72.4-40174.5-68.3174.4000111.6V72 A73 R74 L79 L80V72-L76 HydrophobicContact CG1-CD1 3.95Å; V72-L76 HydrophobicContact CG1-CG 4.33Å; V72-L76 WeakPolarHBondContact O-CG 3.39Å; V72-L76 PolarHBondContact O-N 3.4Å; A73-L76 PolarHBondContact O-N 3.22Å; R74-L76 VanDerWaalsContact C-N 3.28Å; R74-L76 PolarHBondContact O-N 3.33Å; L76-L79 PolarHBondContact O-N 3.48Å; L76-L80 WeakPolarHBondContact O-CB 3.34Å; L76-L80 WeakPolarHBondContact O-CG 3.43Å; L76-L80 PolarHBondContact O-N 2.97Å
77E96.6Very high93Very high113 Ų11395.2 Ų95.253%0.52850%0.496SS..Hα-helixtrans-56.3-56.1172.5-179.4179.5-165.600111A73 R74 L79 L80 D81A73-E77 WeakPolarHBondContact O-CB 3.27Å; A73-E77 PolarHBondContact O-N 2.94Å; R74-E77 WeakPolarHBondContact O-CB 3.49Å; R74-E77 PolarHBondContact O-N 3.05Å; E77-L79 VanDerWaalsContact C-N 3.26Å; E77-L79 PolarHBondContact O-N 2.71Å; E77-L80 PolarHBondContact O-N 3.43Å; E77-L80 VanDerWaalsContact O-N 3.15Å; E77-D81 WeakPolarHBondContact O-CB 3.34Å; E77-D81 PolarHBondContact O-N 3.22Å
78D96.6Very high91.5Very high93 Ų9398.5 Ų98.550%0.49750%0.498SS..Hα-helixtrans-57.1-39.6179-63.8-26000112.1R74 S82R74-D78 VanDerWaalsContact O-CG 3.23Å; R74-D78 PolarHBondContact O-N 3.32Å; D78-S82 WeakPolarHBondContact O-CB 3.46Å; D78-S82 PolarHBondContact O-N 3.39Å; D78-S82 VanDerWaalsContact O-N 3.09Å
79L96.8Very high89.7Confident102 Ų10298.5 Ų98.553%0.53450%0.499SS..Hα-helixtrans-67.9-46.5178.6177.663.5000111.5K75 L76 E77 S82 C83K75-L79 WeakPolarHBondContact O-CB 3.18Å; K75-L79 PolarHBondContact O-N 3.17Å; L76-L79 PolarHBondContact O-N 3.48Å; E77-L79 VanDerWaalsContact C-N 3.26Å; E77-L79 PolarHBondContact O-N 2.71Å; L79-S82 WeakPolarHBondContact O-CB 3.07Å; L79-S82 PolarHBondContact O-N 2.79Å; L79-C83 PolarHBondContact O-N 2.82Å; L79-C83 PolarHBondContact O-SG 2.89Å; L79-C83 VanDerWaalsContact O-SG 3.32Å
80L96.4Very high88Confident102 Ų10295.8 Ų95.853%0.53450%0.495SS..Hα-helixtrans-66.6-40.5179.5-70.9171.7000111.1L76 E77 S82 C83 I84L76-L80 WeakPolarHBondContact O-CB 3.34Å; L76-L80 WeakPolarHBondContact O-CG 3.43Å; L76-L80 PolarHBondContact O-N 2.97Å; E77-L80 PolarHBondContact O-N 3.43Å; E77-L80 VanDerWaalsContact O-N 3.15Å; L80-S82 VanDerWaalsContact C-N 3.28Å; L80-S82 PolarHBondContact O-N 2.89Å; L80-C83 PolarHBondContact O-N 3.49Å; L80-I84 WeakPolarHBondContact O-CB 3.37Å; L80-I84 VanDerWaalsContact O-CG1 3.25Å; L80-I84 WeakPolarHBondContact O-CG1 3.18Å; L80-I84 PolarHBondContact O-N 3.31Å
81D94.6Very high86.2Confident85 Ų8594 Ų9446%0.45549%0.492SS..Hα-helixtrans-61.2-38.6174.9-76.9-11.7000111.4E77 S85E77-D81 WeakPolarHBondContact O-CB 3.34Å; E77-D81 PolarHBondContact O-N 3.22Å; D81-S85 WeakPolarHBondContact O-CB 3.36Å; D81-S85 PolarHBondContact O-N 3.47Å; D81-S85 PolarHBondContact O-OG 3.38Å
82S92.2Very high84.3Confident70 Ų7092.8 Ų92.849%0.4950%0.496SS..Hα-helixtrans-62.4-48.2172.5-173.80000111.7D78 L79 L80 S85 E86D78-S82 WeakPolarHBondContact O-CB 3.46Å; D78-S82 PolarHBondContact O-N 3.39Å; D78-S82 VanDerWaalsContact O-N 3.09Å; L79-S82 WeakPolarHBondContact O-CB 3.07Å; L79-S82 PolarHBondContact O-N 2.79Å; L80-S82 VanDerWaalsContact C-N 3.28Å; L80-S82 PolarHBondContact O-N 2.89Å; S82-S85 PolarHBondContact O-N 3.29Å; S82-E86 WeakPolarHBondContact O-CB 3.34Å; S82-E86 PolarHBondContact O-N 2.83Å
83C88.7Confident82.2Confident60 Ų6096.8 Ų96.841%0.40551%0.509SS..Hα-helixtrans-63.5-42.6179.4-66.40000111.9L79 L80 E86 T87L79-C83 PolarHBondContact O-N 2.82Å; L79-C83 PolarHBondContact O-SG 2.89Å; L79-C83 VanDerWaalsContact O-SG 3.32Å; L80-C83 PolarHBondContact O-N 3.49Å; C83-E86 PolarHBondContact O-N 2.98Å; C83-T87 WeakPolarHBondContact O-CG2 3.25Å; C83-T87 PolarHBondContact O-N 3.45Å; C83-T87 PolarHBondContact O-OG1 2.88Å
84I89.6Confident80Confident82 Ų8298 Ų9842%0.42151%0.513SS..Hα-helixtrans-66.6-45.2179-67.3165.2000110.2L80 E86 T87 Q88L80-I84 WeakPolarHBondContact O-CB 3.37Å; L80-I84 VanDerWaalsContact O-CG1 3.25Å; L80-I84 WeakPolarHBondContact O-CG1 3.18Å; L80-I84 PolarHBondContact O-N 3.31Å; I84-E86 VanDerWaalsContact C-N 3.29Å; I84-E86 PolarHBondContact O-N 3.03Å; I84-T87 WeakPolarHBondContact CA-OG1 3.43Å; I84-T87 PolarHBondContact O-N 3.49Å; I84-T87 PolarHBondContact O-OG1 2.83Å; I84-Q88 HydrophobicContact CG2-CG 4.36Å; I84-Q88 VanDerWaalsContact CG2-NE2 3.3Å; I84-Q88 WeakPolarHBondContact O-CG 3.4Å; I84-Q88 PolarHBondContact O-N 3.17Å
85S83.4Confident77.8Confident76 Ų7699.5 Ų99.553%0.53153%0.529SS..Hα-helixtrans-62.1-37.4178.2-59.40000112.2D81 S82 H89D81-S85 WeakPolarHBondContact O-CB 3.36Å; D81-S85 PolarHBondContact O-N 3.47Å; D81-S85 PolarHBondContact O-OG 3.38Å; S82-S85 PolarHBondContact O-N 3.29Å; S85-H89 PolarHBondContact O-N 2.78Å
86E76.4Confident75.4Confident124 Ų124101.5 Ų101.558%0.57954%0.541SS*.Hα-helixtrans-65.6-47.1173.6-174.1173.718000111.5S82 C83 I84 Q88 H89 I90S82-E86 WeakPolarHBondContact O-CB 3.34Å; S82-E86 PolarHBondContact O-N 2.83Å; C83-E86 PolarHBondContact O-N 2.98Å; I84-E86 VanDerWaalsContact C-N 3.29Å; I84-E86 PolarHBondContact O-N 3.03Å; E86-Q88 PolarHBondContact O-N 3.4Å; E86-H89 PolarHBondContact O-N 3.45Å; E86-I90 HydrophobicContact CG-CD1 4.14Å; E86-I90 WeakPolarHBondContact O-CD1 3.2Å; E86-I90 WeakPolarHBondContact O-CG1 3.5Å; E86-I90 PolarHBondContact O-N 3.2Å
87T67.7Low73.2Confident69 Ų69101 Ų10142%0.42355%0.546SS..Hα-helixtrans-62.8-41.5177.453.10000113.1C83 I84 H89 I90 D91C83-T87 WeakPolarHBondContact O-CG2 3.25Å; C83-T87 PolarHBondContact O-N 3.45Å; C83-T87 PolarHBondContact O-OG1 2.88Å; I84-T87 WeakPolarHBondContact CA-OG1 3.43Å; I84-T87 PolarHBondContact O-N 3.49Å; I84-T87 PolarHBondContact O-OG1 2.83Å; T87-H89 VanDerWaalsContact C-N 3.31Å; T87-H89 PolarHBondContact O-N 3.13Å; T87-I90 PolarHBondContact O-N 3.15Å; T87-I90 VanDerWaalsContact O-N 3.11Å; T87-D91 PolarHBondContact O-N 3.46Å
88Q66.5Low70.8Confident119 Ų119105.2 Ų105.256%0.55656%0.562SS**Hα-helixtrans-62.5-36.3178-73.8-17536.900112.8I84 E86 I90 S92I84-Q88 HydrophobicContact CG2-CG 4.36Å; I84-Q88 VanDerWaalsContact CG2-NE2 3.3Å; I84-Q88 WeakPolarHBondContact O-CG 3.4Å; I84-Q88 PolarHBondContact O-N 3.17Å; E86-Q88 PolarHBondContact O-N 3.4Å; Q88-I90 VanDerWaalsContact C-N 3.33Å; Q88-S92 VanDerWaalsContact O-CB 3.27Å; Q88-S92 WeakPolarHBondContact O-CB 3.02Å; Q88-S92 PolarHBondContact O-N 3.32Å; Q88-S92 PolarHBondContact O-OG 3.4Å
89H59.5Low68.4Low108 Ų108107.2 Ų107.250%0.558%0.582SS.*Hα-helixtrans-71.3-29.7176.9178-104.2000112.5S85 E86 T87 K93S85-H89 PolarHBondContact O-N 2.78Å; E86-H89 PolarHBondContact O-N 3.45Å; T87-H89 VanDerWaalsContact C-N 3.31Å; T87-H89 PolarHBondContact O-N 3.13Å; H89-K93 PolarHBondContact CE1-NZ 3.33Å; H89-K93 WeakPolarHBondContact NE2-CE 3.34Å; H89-K93 PolarHBondContact NE2-NZ 3.37Å; H89-K93 WeakPolarHBondContact O-CG 2.94Å; H89-K93 PolarHBondContact O-N 3.02Å
90I59.9Low66Low92 Ų92109.6 Ų109.647%0.47260%0.595SS.*Hα-helixtrans-73.1-47.9174-63.7162.6000110.2E86 T87 Q88 S92 K93 C94E86-I90 HydrophobicContact CG-CD1 4.14Å; E86-I90 WeakPolarHBondContact O-CD1 3.2Å; E86-I90 WeakPolarHBondContact O-CG1 3.5Å; E86-I90 PolarHBondContact O-N 3.2Å; T87-I90 PolarHBondContact O-N 3.15Å; T87-I90 VanDerWaalsContact O-N 3.11Å; Q88-I90 VanDerWaalsContact C-N 3.33Å; I90-S92 VanDerWaalsContact C-N 3.32Å; I90-S92 PolarHBondContact O-N 3.4Å; I90-K93 PolarHBondContact O-N 3.38Å; I90-C94 VanDerWaalsContact O-CB 3.28Å; I90-C94 WeakPolarHBondContact O-CB 3.47Å; I90-C94 PolarHBondContact O-N 3.46Å
91D58.7Low64Low98 Ų98112.3 Ų112.352%0.52461%0.61SS.*Hα-helixtrans-65-37-179.2-66.3-24.1000111.8T87 C94 L95T87-D91 PolarHBondContact O-N 3.46Å; D91-C94 PolarHBondContact O-N 3.08Å; D91-L95 WeakPolarHBondContact O-CG 3.2Å; D91-L95 PolarHBondContact O-N 3.3Å
92S57.7Low62.3Low83 Ų83110.8 Ų110.858%0.5862%0.615SS**Hα-helixtrans-68.4-33.4176.6-56.50000113Q88 I90Q88-S92 VanDerWaalsContact O-CB 3.27Å; Q88-S92 WeakPolarHBondContact O-CB 3.02Å; Q88-S92 PolarHBondContact O-N 3.32Å; Q88-S92 PolarHBondContact O-OG 3.4Å; I90-S92 VanDerWaalsContact C-N 3.32Å; I90-S92 PolarHBondContact O-N 3.4Å
93K54.9Low60.6Low140 Ų140115.5 Ų115.561%0.60963%0.629SS**Hα-helixtrans-81.5-22.9174.6-76.7179.7176.71800113.1H89 I90H89-K93 PolarHBondContact CE1-NZ 3.33Å; H89-K93 WeakPolarHBondContact NE2-CE 3.34Å; H89-K93 PolarHBondContact NE2-NZ 3.37Å; H89-K93 WeakPolarHBondContact O-CG 2.94Å; H89-K93 PolarHBondContact O-N 3.02Å; I90-K93 PolarHBondContact O-N 3.38Å
94C50.2Low58.9Low82 Ų82118.1 Ų118.155%0.55464%0.639SS**Hα-helixtrans-78.6-25.5-179.8-169.80000112.9I90 D91I90-C94 VanDerWaalsContact O-CB 3.28Å; I90-C94 WeakPolarHBondContact O-CB 3.47Å; I90-C94 PolarHBondContact O-N 3.46Å; D91-C94 PolarHBondContact O-N 3.08Å
95L52.7Low57.4Low158 Ų158123 Ų12383%0.82766%0.66SS**THydrogen-bonded Turntrans-80.8-10.8-179.5-68.4176000114.4D91D91-L95 WeakPolarHBondContact O-CG 3.2Å; D91-L95 PolarHBondContact O-N 3.3Å
96E46.8Very low56.6Low181 Ų181121.6 Ų121.685%0.84666%0.658SS**THydrogen-bonded Turntrans-102.714.4179.4-149.5178.9162.500113.7
97S51.1Low55.3Low85 Ų85125.1 Ų125.159%0.59467%0.671SS**SBendtrans-10397.5165.2700000109.2C99S97-C99 PolarHBondContact O-N 3.09Å
98K46.6Very low55.2Low201 Ų201129.2 Ų129.287%0.87468%0.679SS**  trans-46.2129.1165.8-86.9-156173-177.70109.6D100K98-D100 VanDerWaalsContact C-N 3.28Å; K98-D100 PolarHBondContact O-N 2.69Å
99C45.7Very low55Low134 Ų134129.9 Ų129.991%0.90569%0.685SS**  trans-61.195.1160.6-62.30000107.6S97 D101S97-C99 PolarHBondContact O-N 3.09Å; C99-D101 PolarHBondContact O-N 3.15Å
100D47.2Very low54.6Low153 Ų153132.9 Ų132.982%0.81870%0.697SS**  trans-79.9107.5162.7-167.756.8000106.5K98 G102K98-D100 VanDerWaalsContact C-N 3.28Å; K98-D100 PolarHBondContact O-N 2.69Å; D100-G102 PolarHBondContact O-N 3.27Å; D100-G102 VanDerWaalsContact O-N 3.14Å
101D54.9Low54.2Low159 Ų159132.4 Ų132.485%0.8570%0.702SS**  trans-70.298.2173.8179.743.2000108.1C99C99-D101 PolarHBondContact O-N 3.15Å
102G57.3Low54.1Low53 Ų53133.9 Ų133.955%0.54672%0.715SS.*  trans-158.280-174.300000111.4D100 D104D100-G102 PolarHBondContact O-N 3.27Å; D100-G102 VanDerWaalsContact O-N 3.14Å; G102-D104 PolarHBondContact O-N 2.95Å
103Q56.3Low54.1Low168 Ų168134.2 Ų134.279%0.78572%0.718SS**  trans11.5100.9150-60.4-71.7-5.200115.7
104D55Low54Low115 Ų115133.9 Ų133.962%0.61573%0.727SS**  trans-144.597.4149.8-161.312.4000110.2G102 G106 R108G102-D104 PolarHBondContact O-N 2.95Å; D104-G106 PolarHBondContact O-N 3.04Å; D104-G106 VanDerWaalsContact O-N 3.1Å; D104-R108 VanDerWaalsContact OD2-CD 3.26Å; D104-R108 WeakPolarHBondContact OD2-CD 3.47Å
105E57.5Low54Low185 Ų185135.6 Ų135.686%0.86474%0.737SS**  trans-70.290.1167-71.5175.2155.900109.1
106G65.9Low54Low47 Ų47131.6 Ų131.649%0.48573%0.734SS.*SBendtrans171.4135.6169.900000114.1D104 R108D104-G106 PolarHBondContact O-N 3.04Å; D104-G106 VanDerWaalsContact O-N 3.1Å; G106-R108 VanDerWaalsContact C-N 3.31Å; G106-R108 PolarHBondContact O-N 3.24Å
107F49.7Very low53.8Low197 Ų197130.7 Ų130.786%0.86473%0.729SS**  trans-60.794.1167.8-63.2-91.7000109.3L109F107-L109 HydrophobicContact CB-CD1 3.67Å; F107-L109 PolarHBondContact O-N 3.09Å
108R64.9Low54Low156 Ų156135.7 Ų135.759%0.58974%0.744SS**  trans-71.275.2170.7-67.8175.266.7-118.3-2.7109.2D104 G106 F110 S111D104-R108 VanDerWaalsContact OD2-CD 3.26Å; D104-R108 WeakPolarHBondContact OD2-CD 3.47Å; G106-R108 VanDerWaalsContact C-N 3.31Å; G106-R108 PolarHBondContact O-N 3.24Å; R108-F110 PolarHBondContact O-N 2.89Å; R108-F110 VanDerWaalsContact O-N 3.11Å; R108-S111 PolarHBondContact NH1-OG 2.75Å; R108-S111 PolarHBondContact NH2-OG 3.08Å
109L63.2Low54Low132 Ų132132 Ų13269%0.69173%0.733SS**  trans-68-3-178.1-98.9123.8000114.4F107F107-L109 HydrophobicContact CB-CD1 3.67Å; F107-L109 PolarHBondContact O-N 3.09Å
110F50.3Low54.4Low171 Ų171130 Ų13075%0.7573%0.726SS**  trans-146.483.3176.4-58.6-77.8000110.6R108 T112R108-F110 PolarHBondContact O-N 2.89Å; R108-F110 VanDerWaalsContact O-N 3.11Å; F110-T112 PolarHBondContact O-N 2.91Å
111S50.9Low55Low82 Ų82132.3 Ų132.357%0.57373%0.729SS**  trans-73.367.2162.5-71.30000110.1R108R108-S111 PolarHBondContact NH1-OG 2.75Å; R108-S111 PolarHBondContact NH2-OG 3.08Å
112T56.9Low55Low130 Ų130130.1 Ų130.180%0.79872%0.724SS**  trans-92.378.6152.954.80000107F110F110-T112 PolarHBondContact O-N 2.91Å
113S57.3Low55.2Low90 Ų90132.9 Ų132.963%0.62974%0.735SS**  trans-148.788.1167-1680000109
114V52.9Low55.2Low133 Ų133129.9 Ų129.981%0.80673%0.732SS**  trans-99.8115.2157.3178.70000105.8G116V114-G116 PolarHBondContact O-N 3.27Å
115P50.8Low55.3Low117 Ų117130 Ų13076%0.7674%0.739SS**  trans-70.4118.6172.8-16.430.8000110
116G52.6Low55.5Low74 Ų74125.9 Ų125.976%0.76374%0.737SS**  trans83.786.9162.800000115.7V114V114-G116 PolarHBondContact O-N 3.27Å
117Q43.1Very low55.4Low162 Ų162134.7 Ų134.776%0.75776%0.755SS**  trans-159.7112.2139.7-155.2169.3-2.800109.3D119Q117-D119 WeakPolarHBondContact CG-OD2 3.48Å; Q117-D119 PolarHBondContact NE2-OD2 3.32Å; Q117-D119 PolarHBondContact O-N 2.92Å
118E54.4Low56.2Low191 Ų191136.8 Ų136.889%0.89376%0.757SS**  trans-75.2103.9162-62.2-160.5-171.200107.2
119D46.2Very low56.4Low122 Ų122140.4 Ų140.465%0.65277%0.771SS**  trans-149.3119163.9-84-48.2000110.6Q117Q117-D119 WeakPolarHBondContact CG-OD2 3.48Å; Q117-D119 PolarHBondContact NE2-OD2 3.32Å; Q117-D119 PolarHBondContact O-N 2.92Å
120A55.5Low56.4Low92 Ų92138.8 Ų138.876%0.7677%0.769SS**  trans25113.4160.100000118.8P122A120-P122 WeakPolarHBondContact O-CD 3.37Å; A120-P122 VanDerWaalsContact O-N 3.09Å
121K58.8Low57.1Low203 Ų203136 Ų13688%0.88377%0.767SS**  trans-37.1109.7162.8-179.2174-174.6171.10112.5
122P55Low57.2Low113 Ų113137.6 Ų137.673%0.73478%0.776SS**PPolyproline II helixtrans-74.4131.4165.529.1-29.5000108.9A120 S124A120-P122 WeakPolarHBondContact O-CD 3.37Å; A120-P122 VanDerWaalsContact O-N 3.09Å; P122-S124 PolarHBondContact O-N 3.41Å
123S61Low56.9Low111 Ų111137.2 Ų137.278%0.77678%0.779SS**PPolyproline II helixtrans-55.3128.3172.2-174.90000110
124S56.3Low56.6Low104 Ų104138.1 Ų138.173%0.72779%0.785SS**PPolyproline II helixtrans-65.1127-177.735.90000111.3P122 A126P122-S124 PolarHBondContact O-N 3.41Å; S124-A126 PolarHBondContact O-N 3.23Å
125P58.9Low56.7Low119 Ų119137 Ų13777%0.77378%0.783SS**PPolyproline II helixtrans-67.3133.6170.726.8-30.5000109R127P125-R127 PolarHBondContact O-N 2.91Å
126A60.9Low57.3Low98 Ų98137.3 Ų137.381%0.8178%0.779SS**PPolyproline II helixtrans-54.3116.3178.700000110.3S124 R128S124-A126 PolarHBondContact O-N 3.23Å; A126-R128 PolarHBondContact O-N 3.26Å
127R62.8Low57.7Low232 Ų232137.9 Ų137.988%0.87577%0.771SS**  trans-53.3104.7170.9-84.6173.871.4-145.96.7108.4P125 R129P125-R127 PolarHBondContact O-N 2.91Å; R127-R129 PolarHBondContact O-N 3.38Å
128R66.8Low59.2Low240 Ų240134.4 Ų134.491%0.90676%0.757SS**PPolyproline II helixtrans-60.5127.6158.5-77.2-171.5147.2-179.8-6.3106.7A126A126-R128 PolarHBondContact O-N 3.26Å
129R69.1Low60.2Low232 Ų232129 Ų12988%0.87574%0.741SS**PPolyproline II helixtrans-53.4137.6173.6-68.7-179.9176.4133.7-1.2107.7R127R127-R129 PolarHBondContact O-N 3.38Å
130P64.7Low62.2Low99 Ų99127.9 Ų127.964%0.64373%0.732SS**PPolyproline II helixtrans-53144165.522.3-29.4000108.2
131P63.3Low63.7Low111 Ų111128 Ų12872%0.72172%0.718SS**PPolyproline II helixtrans-52.1144.4169.424.5-32.2000108.2S133P131-S133 PolarHBondContact O-N 3.2Å; P131-S133 VanDerWaalsContact O-N 3.09Å
132P54Low65Low117 Ų117123.2 Ų123.276%0.7670%0.698SS**PPolyproline II helixtrans-51127176.323.1-32.3000107.6S134P132-S134 VanDerWaalsContact C-N 3.33Å; P132-S134 PolarHBondContact O-N 2.88Å
133S50.1Low66.6Low121 Ų121121.7 Ų121.785%0.84669%0.687SS**  trans-53102.8175.7-159.60000106.8P131 S135P131-S133 PolarHBondContact O-N 3.2Å; P131-S133 VanDerWaalsContact O-N 3.09Å; S133-S135 PolarHBondContact O-N 2.74Å
134S52.3Low68.1Low110 Ų110123.4 Ų123.477%0.76968%0.677SS**  trans-65.996.2169.138.40000105.2P132 D136P132-S134 VanDerWaalsContact C-N 3.33Å; P132-S134 PolarHBondContact O-N 2.88Å; S134-D136 PolarHBondContact O-N 3.4Å
135S54.9Low69.7Low110 Ų110124.3 Ų124.377%0.76967%0.673SS**  trans-65.883.7162-172.10000105.7S133 S137S133-S135 PolarHBondContact O-N 2.74Å; S135-S137 PolarHBondContact O-N 3.08Å; S135-S137 VanDerWaalsContact O-N 3.09Å
136D62.9Low71.1Confident123 Ų123125.1 Ų125.166%0.65866%0.664SS**  trans-67.6105.3167.4-150.6-8.9000105.3S134 D138S134-D136 PolarHBondContact O-N 3.4Å; D136-D138 PolarHBondContact O-N 2.79Å; D136-D138 VanDerWaalsContact O-N 3.08Å
137S61.3Low72.4Confident86 Ų86128.4 Ų128.460%0.60166%0.662SS**  trans-78.795.6179.8-170.80000105.9S135 S139S135-S137 PolarHBondContact O-N 3.08Å; S135-S137 VanDerWaalsContact O-N 3.09Å; S137-S139 PolarHBondContact O-N 3.04Å
138D74Confident73.7Confident88 Ų88121 Ų12147%0.47165%0.651SS.*THydrogen-bonded Turntrans-56.17.6179.5-68.6-17.9000114.7D136 E140 M141 E142D136-D138 PolarHBondContact O-N 2.79Å; D136-D138 VanDerWaalsContact O-N 3.08Å; D138-E140 PolarHBondContact O-N 2.73Å; D138-M141 HydrophobicContact CB-CG 3.62Å; D138-M141 HydrophobicContact CB-SD 3.63Å; D138-M141 WeakPolarHBondContact O-CG 3.41Å; D138-M141 PolarHBondContact O-N 3.11Å; D138-M141 VanDerWaalsContact O-N 3.16Å; D138-E142 WeakPolarHBondContact O-CB 3.31Å; D138-E142 PolarHBondContact O-N 2.82Å
139S76.2Confident74.8Confident78 Ų78113 Ų11355%0.54564%0.637SS.*Hα-helixtrans-54.9-36.3175.2-173.10000112.8S137 T143S137-S139 PolarHBondContact O-N 3.04Å; S139-T143 WeakPolarHBondContact O-CG2 3.49Å; S139-T143 PolarHBondContact O-N 3.35Å; S139-T143 VanDerWaalsContact O-N 3.15Å; S139-T143 PolarHBondContact O-OG1 2.96Å
140E87.8Confident75.8Confident99 Ų99106.7 Ų106.746%0.46362%0.623SS.*Hα-helixtrans-63.7-50.7173.9167.8-157.815600112D138 E142 T143 R144D138-E140 PolarHBondContact O-N 2.73Å; E140-E142 VanDerWaalsContact C-N 3.35Å; E140-T143 PolarHBondContact O-N 3.25Å; E140-T143 PolarHBondContact O-OG1 3.31Å; E140-R144 PolarHBondContact O-N 3.02Å; E140-R144 VanDerWaalsContact O-N 3.1Å; E140-R144 IonicContact OE1-CZ 2.89Å; E140-R144 IonicContact OE1-NE 3.92Å; E140-R144 IonicContact OE1-NH1 2.66Å; E140-R144 PolarHBondContact OE1-NH1 3.07Å; E140-R144 IonicContact OE1-NH2 2.68Å; E140-R144 PolarHBondContact OE1-NH2 3.49Å
141M85.9Confident77Confident95 Ų95105 Ų10547%0.46861%0.614SS.*Hα-helixtrans-69.9-34.9-177.253.2-168.7-81.100111.8D138 T143 R144 L145D138-M141 HydrophobicContact CB-CG 3.62Å; D138-M141 HydrophobicContact CB-SD 3.63Å; D138-M141 WeakPolarHBondContact O-CG 3.41Å; D138-M141 PolarHBondContact O-N 3.11Å; D138-M141 VanDerWaalsContact O-N 3.16Å; M141-T143 VanDerWaalsContact C-N 3.3Å; M141-T143 PolarHBondContact O-N 3.16Å; M141-R144 PolarHBondContact O-N 3.1Å; M141-L145 WeakPolarHBondContact O-CB 3.41Å; M141-L145 VanDerWaalsContact O-CG 3.24Å; M141-L145 WeakPolarHBondContact O-CG 3.47Å; M141-L145 PolarHBondContact O-N 3.42Å
142E87.1Confident78Confident102 Ų102105.4 Ų105.448%0.47761%0.609SS.*Hα-helixtrans-57-42.1170.5-179.587.7-161.500111.6D138 E140 K146D138-E142 WeakPolarHBondContact O-CB 3.31Å; D138-E142 PolarHBondContact O-N 2.82Å; E140-E142 VanDerWaalsContact C-N 3.35Å; E142-K146 WeakPolarHBondContact O-CG 3.42Å; E142-K146 PolarHBondContact O-N 3.45Å; E142-K146 VanDerWaalsContact O-N 3.13Å; E142-K146 WeakPolarHBondContact OE1-CE 3.43Å; E142-K146 IonicContact OE1-NZ 2.74Å; E142-K146 PolarHBondContact OE1-NZ 3.02Å
143T89.3Confident79.6Confident81 Ų81101.1 Ų101.150%0.49758%0.581SS.*Hα-helixtrans-69.7-41.4178.453.10000112.3S139 E140 M141 L145 K146 E147S139-T143 WeakPolarHBondContact O-CG2 3.49Å; S139-T143 PolarHBondContact O-N 3.35Å; S139-T143 VanDerWaalsContact O-N 3.15Å; S139-T143 PolarHBondContact O-OG1 2.96Å; E140-T143 PolarHBondContact O-N 3.25Å; E140-T143 PolarHBondContact O-OG1 3.31Å; M141-T143 VanDerWaalsContact C-N 3.3Å; M141-T143 PolarHBondContact O-N 3.16Å; T143-L145 VanDerWaalsContact C-N 3.34Å; T143-L145 PolarHBondContact O-N 2.9Å; T143-K146 PolarHBondContact O-N 2.86Å; T143-E147 PolarHBondContact O-N 3.42Å
144R90.9Very high81.4Confident147 Ų147100.6 Ų100.656%0.55557%0.569SS**Hα-helixtrans-61.4-40.7174.8-70.5-179.6179.7150.911.6112.9E140 M141 K146 E147 A148E140-R144 PolarHBondContact O-N 3.02Å; E140-R144 VanDerWaalsContact O-N 3.1Å; E140-R144 IonicContact OE1-CZ 2.89Å; E140-R144 IonicContact OE1-NE 3.92Å; E140-R144 IonicContact OE1-NH1 2.66Å; E140-R144 PolarHBondContact OE1-NH1 3.07Å; E140-R144 IonicContact OE1-NH2 2.68Å; E140-R144 PolarHBondContact OE1-NH2 3.49Å; M141-R144 PolarHBondContact O-N 3.1Å; R144-K146 VanDerWaalsContact C-N 3.33Å; R144-E147 PolarHBondContact O-N 2.99Å; R144-A148 WeakPolarHBondContact O-CB 3.48Å; R144-A148 PolarHBondContact O-N 3.14Å
145L90.4Very high83.1Confident123 Ų123101.1 Ų101.164%0.64456%0.563SS**Hα-helixtrans-65.6-37.6177.4-71.2166000111.7M141 T143 A149M141-L145 WeakPolarHBondContact O-CB 3.41Å; M141-L145 VanDerWaalsContact O-CG 3.24Å; M141-L145 WeakPolarHBondContact O-CG 3.47Å; M141-L145 PolarHBondContact O-N 3.42Å; T143-L145 VanDerWaalsContact C-N 3.34Å; T143-L145 PolarHBondContact O-N 2.9Å; L145-A149 PolarHBondContact O-N 3.41Å
146K87.9Confident84.7Confident136 Ų13699 Ų9959%0.59154%0.542SS*.Hα-helixtrans-70.5-36.1175.2-74.8175.9-179.4160.30112.8E142 T143 R144 A149E142-K146 WeakPolarHBondContact O-CG 3.42Å; E142-K146 PolarHBondContact O-N 3.45Å; E142-K146 VanDerWaalsContact O-N 3.13Å; E142-K146 WeakPolarHBondContact OE1-CE 3.43Å; E142-K146 IonicContact OE1-NZ 2.74Å; E142-K146 PolarHBondContact OE1-NZ 3.02Å; T143-K146 PolarHBondContact O-N 2.86Å; R144-K146 VanDerWaalsContact C-N 3.33Å; K146-A149 WeakPolarHBondContact O-CB 3.4Å; K146-A149 PolarHBondContact O-N 3.46Å
147E89.3Confident85.6Confident166 Ų16697 Ų9778%0.77654%0.536SS*.Hα-helixtrans-67-39.2175.7-174.9-177.4170.400112.1T143 R144 A149T143-E147 PolarHBondContact O-N 3.42Å; R144-E147 PolarHBondContact O-N 2.99Å; E147-A149 PolarHBondContact O-N 2.92Å
148A89.4Confident86.3Confident78 Ų7897.7 Ų97.765%0.64554%0.541SS*.THydrogen-bonded Turntrans-75.2-7.8178.700000113.9R144 V150R144-A148 WeakPolarHBondContact O-CB 3.48Å; R144-A148 PolarHBondContact O-N 3.14Å; A148-V150 PolarHBondContact O-N 3.02Å
149A90.2Very high86.2Confident72 Ų7298.8 Ų98.860%0.59556%0.555SS**  trans-73.8111-179.600000110.7L145 K146 E147L145-A149 PolarHBondContact O-N 3.41Å; K146-A149 WeakPolarHBondContact O-CB 3.4Å; K146-A149 PolarHBondContact O-N 3.46Å; E147-A149 PolarHBondContact O-N 2.92Å
150V90.8Very high85.6Confident98 Ų98100.8 Ų100.859%0.59456%0.558SS**  trans-89.7133.6171.3-69.90000110.2A148 L155A148-V150 PolarHBondContact O-N 3.02Å; V150-L155 HydrophobicContact CG2-CD1 4.24Å; V150-L155 HydrophobicContact CG2-CD2 4.11Å; V150-L155 HydrophobicContact CG2-CG 4.3Å
151S87.9Confident84.5Confident63 Ų63103 Ų10344%0.44156%0.562SS.*  trans-75.6149.7175.4171.30000109.9S153 D154S151-S153 WeakPolarHBondContact CB-OG 3.46Å; S151-S153 PolarHBondContact O-N 3.35Å; S151-S153 PolarHBondContact OG-N 3.46Å; S151-S153 PolarHBondContact OG-OG 2.9Å; S151-D154 PolarHBondContact N-OD2 2.99Å; S151-D154 WeakPolarHBondContact O-CB 3.42Å; S151-D154 PolarHBondContact O-N 2.97Å
152I85.9Confident83.5Confident120 Ų120103.1 Ų103.162%0.61557%0.572SS**Hα-helixtrans-55.7-28176.4-60.8169.6000110.9D154 L155 L156I152-D154 PolarHBondContact O-N 2.86Å; I152-L155 PolarHBondContact O-N 2.7Å; I152-L156 HydrophobicContact CG2-CD1 3.6Å; I152-L156 HydrophobicContact CG2-CG 3.97Å; I152-L156 PolarHBondContact O-N 3.18Å
153S87.4Confident82.1Confident27 Ų27104.3 Ų104.319%0.18959%0.592CS.*Hα-helixtrans-57.3-29.1172.352.50000115.3S151 R161S151-S153 WeakPolarHBondContact CB-OG 3.46Å; S151-S153 PolarHBondContact O-N 3.35Å; S151-S153 PolarHBondContact OG-N 3.46Å; S151-S153 PolarHBondContact OG-OG 2.9Å; S153-R161 PolarHBondContact O-NH1 3.11Å
154D87.8Confident80.4Confident111 Ų111105.2 Ų105.259%0.59460%0.602SS**Hα-helixtrans-91.7-19.4-173.1-49.5-21.8000110.2S151 I152S151-D154 PolarHBondContact N-OD2 2.99Å; S151-D154 WeakPolarHBondContact O-CB 3.42Å; S151-D154 PolarHBondContact O-N 2.97Å; I152-D154 PolarHBondContact O-N 2.86Å
155L88.3Confident78.7Confident120 Ų120104.3 Ų104.363%0.62862%0.618SS**Hα-helixtrans-91-31.7176.6-59.4178.4000112.6V150 I152V150-L155 HydrophobicContact CG2-CD1 4.24Å; V150-L155 HydrophobicContact CG2-CD2 4.11Å; V150-L155 HydrophobicContact CG2-CG 4.3Å; I152-L155 PolarHBondContact O-N 2.7Å
156L87.6Confident76.7Confident66 Ų66102.4 Ų102.435%0.34662%0.62SS.*SBendtrans-93.2134.4-177.8-65.5-178000111.6I152 S158 M160I152-L156 HydrophobicContact CG2-CD1 3.6Å; I152-L156 HydrophobicContact CG2-CG 3.97Å; I152-L156 PolarHBondContact O-N 3.18Å; L156-S158 PolarHBondContact O-N 3.07Å; L156-M160 HydrophobicContact CB-CB 4.4Å; L156-M160 HydrophobicContact CD2-CE 4.47Å
157P83Confident74.7Confident82 Ų82103.9 Ų103.953%0.53263%0.629SS.*  trans-52.8140.8168.7-22.932000110.1S159 M160P157-S159 PolarHBondContact O-N 3.07Å; P157-M160 HydrophobicContact CG-SD 4.38Å; P157-M160 PolarHBondContact O-N 3.43Å
158S74.4Confident72.5Confident100 Ų100102 Ų10270%0.69963%0.63SS**G310 helixtrans-51.7-28.4-177-156.60000113.5L156 M160 R161L156-S158 PolarHBondContact O-N 3.07Å; S158-M160 VanDerWaalsContact C-N 3.33Å; S158-M160 PolarHBondContact O-N 3.12Å; S158-R161 PolarHBondContact O-N 3.35Å
159S72.3Confident70.2Confident110 Ų110106.9 Ų106.977%0.76965%0.645SS**G310 helixtrans-64.7-28.8174.8-168.30000114.4P157P157-S159 PolarHBondContact O-N 3.07Å
160M63.4Low67.9Low121 Ų121106.7 Ų106.760%0.59665%0.65SS**G310 helixtrans-91.9-1.8178.5-66.4-178.769.600113.4L156 P157 S158 S162L156-M160 HydrophobicContact CB-CB 4.4Å; L156-M160 HydrophobicContact CD2-CE 4.47Å; P157-M160 HydrophobicContact CG-SD 4.38Å; P157-M160 PolarHBondContact O-N 3.43Å; S158-M160 VanDerWaalsContact C-N 3.33Å; S158-M160 PolarHBondContact O-N 3.12Å; M160-S162 PolarHBondContact O-N 3.09Å; M160-S162 VanDerWaalsContact O-N 3.11Å
161R65.1Low65.4Low144 Ų144107.6 Ų107.654%0.54366%0.661SS.*  trans-74.37.5177.2-68175.574.8160.5-2.5113.6S153 S158S153-R161 PolarHBondContact O-NH1 3.11Å; S158-R161 PolarHBondContact O-N 3.35Å
162S64.8Low63.2Low98 Ų98113 Ų11369%0.68568%0.679SS**SBendtrans-94.1117.6176.2-52.40000109.2M160M160-S162 PolarHBondContact O-N 3.09Å; M160-S162 VanDerWaalsContact O-N 3.11Å
163S58.9Low60.9Low127 Ų127113.2 Ų113.289%0.88869%0.691SS**SBendtrans91.855.2177.5-165.10000117.6
164S52.7Low58.3Low101 Ų101115.8 Ų115.871%0.70672%0.722SS**  trans-153.287.4138.969.70000110.3A166S164-A166 PolarHBondContact O-N 2.87Å
165S55.3Low56.2Low128 Ų128115 Ų11590%0.89573%0.731SS**  trans-71.684.4156.11770000107
166A48.1Very low53.8Low83 Ų83119.4 Ų119.469%0.68675%0.745SS**  trans-114.4102.5166.600000106.5S164S164-A166 PolarHBondContact O-N 2.87Å
167E47.3Very low51.7Low167 Ų167126.2 Ų126.278%0.7877%0.772SS**  trans-54.9141.2172.8-65.3-149.3110.900110.9L169E167-L169 PolarHBondContact O-N 3.03Å; E167-L169 VanDerWaalsContact O-N 3.1Å
168P42.7Very low49.5Very low125 Ų125131 Ų13181%0.81278%0.784SS**  trans-70.4105.1162.429.1-28.8000108.2G170P168-G170 PolarHBondContact O-N 3.37Å
169L40.7Very low47.7Very low182 Ų182134.6 Ų134.695%0.95379%0.787SS**  trans-62.1102.1164.5-85.3160.7000108.7E167E167-L169 PolarHBondContact O-N 3.03Å; E167-L169 VanDerWaalsContact O-N 3.1Å
170G41.8Very low45.8Very low67 Ų67135.6 Ų135.669%0.69179%0.788SS**  trans179.453.1177.300000113.4P168P168-G170 PolarHBondContact O-N 3.37Å
171S39Very low44.3Very low118 Ų118137.7 Ų137.783%0.82580%0.797SS**  trans179.1152.6147.338.30000111.7
172E40.5Very low42.6Very low175 Ų175136.9 Ų136.982%0.81880%0.799SS**  trans-69.1156.7-167.361.4-143.4106.400117.8
173S37.4Very low41Very low125 Ų125140.4 Ų140.487%0.87481%0.805SS**  trans92.4132.5154.982.30000120.6
174G33.5Very low39.7Very low81 Ų81142.9 Ų142.984%0.83580%0.802SS**  trans122.896.5149.800000117.6
175A42.8Very low38.8Very low95 Ų95147 Ų14779%0.78581%0.81SS**  trans-63.1145.2172.400000114.7
176K39.7Very low37.9Very low213 Ų213149.3 Ų149.393%0.92681%0.807SS**  -179.6142.4128.8-94.8157-170.9-177.90113.1
177K43.5Very low37Very low209 Ų209150.1 Ų150.191%0.90981%0.806SS**  trans-73.9155.7-174-60.6170173.2178.20113.5
178K36.8Very low36.3Very low182 Ų182147.2 Ų147.279%0.79180%0.799SS**  157134107.9-168.9174.2-173.4-176.70115.5
179K34.8Very low35.9Very low175 Ų175147.9 Ų147.976%0.76180%0.801SS**  trans62.9123.4156-86.2-172.4163.1-1630118.8
180V33.3Very low36Very low131 Ų131148.3 Ų148.379%0.79480%0.795SS**  cis81.8128.849.3179.90000114.6
181Q31.8Very low35.8Very low166 Ų166154.3 Ų154.378%0.77680%0.802SS**  trans107.6140.4169.2-79.3-172.5-52.200114.4
182E29Very low36Very low127 Ų127158.8 Ų158.859%0.59381%0.807SS**  cis174.9141.3-9.1172.4168.7-174.800105
183E31.4Very low35.8Very low172 Ų172156.9 Ų156.980%0.80481%0.807SS**  trans57.3142.9160.8-71.2178157.200118.1
184E31Very low35.8Very low179 Ų179159.8 Ų159.884%0.83680%0.804SS**  -160.2128.150.8-172.9179.2167.700109.3
185E35.1Very low35.9Very low186 Ų186167.6 Ų167.687%0.86981%0.809SS**  trans-71.2136.2166.2-67.5-174.5140.800109.9
186H34.9Very low35.7Very low178 Ų178172.3 Ų172.382%0.82481%0.811SS**  trans-138.7114.1147.1-162.5-88.5000111.2
187C30.3Very low35.4Very low99 Ų99170.1 Ų170.167%0.66980%0.802SS**  trans-99.2153.6179.8-163.90000110.7
188V33.1Very low34.9Very low106 Ų106169.5 Ų169.564%0.64280%0.802SS**  trans77.8114.7157.4-160.50000118.2
189V33.9Very low34.8Very low139 Ų139165.9 Ų165.984%0.84279%0.788SS**  -148.8114.7112.2-177.50000110.4
190K41.8Very low34.5Very low191 Ų191164.7 Ų164.783%0.8379%0.79SS**  trans-73.7133.7167.2-68.4170.6175.61680109.7
191K39.2Very low34.6Very low193 Ų193165.8 Ų165.884%0.83978%0.784SS**  trans-13498.8159.3-146.2171.7-175.6175.90110.8
192K42.8Very low34.8Very low213 Ų213165.8 Ų165.893%0.92678%0.784SS**  trans-68.8128.5162.8-77.3-177.5171-179.80108.1
193T36.2Very low34.9Very low135 Ų135166.1 Ų166.183%0.82879%0.79SS**  trans-118139.7165.5-45.40000110
194K36.4Very low35.1Very low185 Ų185162 Ų16280%0.80478%0.78SS**  trans-87.4138.3-153172.2177.6176.31780112
195R37Very low35.1Very low246 Ų246159.7 Ų159.793%0.92878%0.778SS**  trans-57134.7162.9-65.4176.9176.2174.6-2.9109.9
196K37.7Very low35Very low193 Ų193155.9 Ų155.984%0.83977%0.772SS**  trans-122.8115.3156.3-101.2-166.5171.1-166.80109.1
197K32.9Very low34.8Very low167 Ų167152.5 Ų152.573%0.72677%0.768SS**  trans-76.8133.6160.9176.3-173.7178.4-1650106.7E199K197-E199 WeakPolarHBondContact CE-OE2 3.47Å; K197-E199 IonicContact NZ-OE2 2.71Å; K197-E199 PolarHBondContact NZ-OE2 3.24Å
198E33.4Very low34.9Very low196 Ų196151.7 Ų151.792%0.91677%0.769SS**  trans-131126157.2-147.1161.9-136.500107.6
199E34.8Very low35.2Very low106 Ų106154 Ų15450%0.49577%0.772SS.*  trans-121.6123.9-173.6175.5-172.5166.200105.2K197 K201K197-E199 WeakPolarHBondContact CE-OE2 3.47Å; K197-E199 IonicContact NZ-OE2 2.71Å; K197-E199 PolarHBondContact NZ-OE2 3.24Å; E199-K201 HydrophobicContact CG-CG 4.15Å; E199-K201 WeakPolarHBondContact OE1-CE 3.36Å
200N28.1Very low35.3Very low151 Ų151156 Ų15681%0.80777%0.772SS**  trans-15389.2156.1-15720.8000105.9
201K35Very low35.4Very low153 Ų153155.4 Ų155.467%0.66577%0.772SS**  58.9135.183.2-75.4-155.4178.7-151.40115.6E199E199-K201 HydrophobicContact CG-CG 4.15Å; E199-K201 WeakPolarHBondContact OE1-CE 3.36Å
202Q36Very low35.1Very low166 Ų166149.8 Ų149.878%0.77677%0.769SS**  trans107.6126.3161.4-59.2-160.3-77.700112.5
203D31.2Very low34.8Very low135 Ų135147.6 Ų147.672%0.72277%0.767SS**  cis179.5158.8-1.1-105.4-28000102
204S36.1Very low34.6Very low85 Ų85144.5 Ų144.559%0.59476%0.762SS**  cis173.6133.213.8135.40000105.1
205V30.9Very low34.8Very low130 Ų130144.5 Ų144.579%0.78877%0.765SS**  trans72.7130138.5-172.70000115.5
206S32.5Very low34.8Very low106 Ų106140.8 Ų140.874%0.74176%0.758SS**  cis-178167.337.1260000104.9
207S31.2Very low34.7Very low107 Ų107140 Ų14075%0.74876%0.757SS**  cis-178.9147-7.3168.50000103.6
208A33.3Very low34.9Very low83 Ų83139.6 Ų139.669%0.68676%0.757SS**  trans52.2117.5149.300000120.8
209H39.7Very low34.9Very low154 Ų154135.7 Ų135.771%0.71375%0.752SS**  52.5101.9116.2-161.477.5000117.2
210H36.3Very low35.2Very low182 Ų182136 Ų13684%0.84376%0.761SS**  trans-155.1117.3138.3-98.6-67.9000110.2
211Q42.6Very low36Very low178 Ų178134.9 Ų134.983%0.83276%0.759SS**  trans-56.7136148.8-71.7174.9-48.600108.1
212G32.3Very low36.2Very low74 Ų74134.5 Ų134.576%0.76377%0.765SS**  trans-17796.9179.200000112
213N37.3Very low36.5Very low168 Ų168131.7 Ų131.790%0.89876%0.759SS**  trans-42.8139.1158.7-167.432.2000111.3
214G32.5Very low37.4Very low69 Ų69135.9 Ų135.971%0.71177%0.771SS**  trans178.589.3-17900000114.1
215E39.6Very low38.2Very low185 Ų185140.3 Ų140.386%0.86478%0.782SS**  trans-50.5129.4162.1-54.9160.9125.800110.5
216Q37.2Very low39.6Very low169 Ų169144 Ų14479%0.7979%0.787SS**  trans-157.5111.4147.1-156.6162.3-0.800112.8H218Q216-H218 PolarHBondContact NE2-NE2 3.31Å
217E36.1Very low40.9Very low177 Ų177148.9 Ų148.983%0.82780%0.795SS**  trans-53.3143.7160.9-52.8172.2122.400111.6
218H36.7Very low42.5Very low157 Ų157153.3 Ų153.373%0.72780%0.801SS**  trans-166.4105.4140.1-81.4-58.4000110.4Q216Q216-H218 PolarHBondContact NE2-NE2 3.31Å
219S34.7Very low43.9Very low115 Ų115158.9 Ų158.980%0.80481%0.81SS**  trans-150.8108.5139.473.70000109.7
220V41.1Very low44.8Very low112 Ų112161 Ų16168%0.67982%0.817SS**  trans-69.4120.2-175.3177.80000110.5
221V43.2Very low45.8Very low127 Ų127163.6 Ų163.677%0.7782%0.819SS**  trans-118.3112.6162.5179.80000108.8T223V221-T223 PolarHBondContact O-N 3.39Å
222N40.1Very low46.6Very low146 Ų146164.2 Ų164.278%0.78182%0.819SS**  trans-72.5114.5-178-62.6-49000111
223T42.1Very low47.6Very low107 Ų107172.4 Ų172.466%0.65683%0.827SS**  trans-119.1116.6164.359.30000110.5V221 Q225V221-T223 PolarHBondContact O-N 3.39Å; T223-Q225 PolarHBondContact O-N 3.28Å
224K49.7Very low48.3Very low222 Ų222171.3 Ų171.397%0.96582%0.821SS**  trans-68.3112.1174.8-68.9178.9176.5176.50109.7
225Q54.2Low48.8Very low178 Ų178174.6 Ų174.683%0.83283%0.828SS**  trans-101.7128.6174.3-67.2-170.6-2.600111.8T223T223-Q225 PolarHBondContact O-N 3.28Å
226K58.9Low49.6Very low208 Ų208174.3 Ų174.390%0.90483%0.827SS**  trans-78.1116.9176.8-177.1176.5177.7177.10110K228K226-K228 PolarHBondContact O-N 3.32Å
227K60.9Low50.3Low208 Ų208174.5 Ų174.590%0.90483%0.827SS**  trans-65.7114.4-177.2-172.7174-179173.60112.2
228K63.1Low51Low200 Ų200170 Ų17087%0.8782%0.821SS**PPolyproline II helixtrans-89.8121.4168.5-170.5175.1178.8177.70109.7K226 K230K226-K228 PolarHBondContact O-N 3.32Å; K228-K230 PolarHBondContact O-N 3.44Å
229K63.3Low51.6Low201 Ų201170.3 Ų170.387%0.87483%0.827SS**PPolyproline II helixtrans-70.5116.6-179.7-176.1176.5179.4176.70110.7
230K59.3Low51.8Low199 Ų199176.2 Ų176.287%0.86585%0.849SS**PPolyproline II helixtrans-88.5126.1172.5-169.6175.1179.21800109.7K228K228-K230 PolarHBondContact O-N 3.44Å
231R57.6Low52.3Low235 Ų235179.5 Ų179.589%0.88786%0.858SS**PPolyproline II helixtrans-71.6133.9169.7-78.4173.188.4-173.36.3109
232K58.2Low52.8Low191 Ų191182.2 Ų182.283%0.8386%0.863SS**PPolyproline II helixtrans-72.7133.5169.3-63.2-178176.1-174.90108.7
233R53.8Low53.5Low246 Ų246184.2 Ų184.293%0.92887%0.867SS**  trans-104.4127154.2-75.3-171.7-166.1137.90.6105.7
234N52Low54.1Low146 Ų146188.8 Ų188.878%0.78188%0.88SS**  trans-79.4141.9-178.7-64.9-14.5000109.3
235T43.5Very low54.4Low138 Ų138186.7 Ų186.785%0.84787%0.874SS**  trans-81.7120.1163.7-50.10000106.8
236E54.9Low54.4Low179 Ų179187.3 Ų187.384%0.83688%0.877SS**  trans-107.798.9163.3-178.2179.8166.900104
237E51.8Low54.1Low172 Ų172185.8 Ų185.880%0.80488%0.875SS**  73.911699.8-70.8-99.1125.800111.9
238A52.7Low53.6Low84 Ų84184.1 Ų184.169%0.69487%0.873SS**  trans-74.6166.5164.400000110.4
239L47.4Very low52.8Low162 Ų162182.8 Ų182.885%0.84887%0.873SS**  trans98.683.3168.2-60.1153.8000116.3
240N38.9Very low51.8Low240 Ų240181.1 Ų181.1100%1.28387%0.873SS**  -177.80106.3-102.8-18.5000111

Retrieved 240 of 240 residues in 151.3 ms (Link to these results)