A0A096LY12_POEFO Loading...

Nuclear factor, interleukin 3 regulated

AlphaFold DB , UniProt , Accession A0A096LY12, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 335 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
1N40.7Very low42Very low207 Ų207153.1 Ų153.1100%1.10782%0.818SS**  0118.30-162.36.7000107.1
2M43Very low41.8Very low177 Ų177153.3 Ų153.387%0.87282%0.819SS**  trans-106.6128.8-174.4-70.1-173.971.100110.6
3Q44.8Very low41.7Very low177 Ų177155.9 Ų155.983%0.82782%0.823SS**  trans-144.597.4162.3-66.7-174.4-37.700106.5
4S46Very low41.7Very low116 Ų116152.6 Ų152.681%0.81182%0.819SS**  94.797.485.2-70.20000111.5
5V43Very low42.2Very low145 Ų145155.8 Ų155.888%0.87982%0.817SS**  trans-66135.1169.5171.30000109.2
6K46.2Very low42.4Very low163 Ų163150.5 Ų150.571%0.70980%0.797SS**  trans-99.4133.8169.7-163176.7-178.1-97.60109.8D8K6-D8 IonicContact NZ-OD1 2.91Å; K6-D8 PolarHBondContact NZ-OD1 3.49Å; K6-D8 IonicContact NZ-OD2 2.83Å; K6-D8 PolarHBondContact NZ-OD2 3.48Å
7Q44.8Very low42.9Very low163 Ų163144.7 Ų144.776%0.76278%0.782SS**  trans-121.6116-173-179.8-177.213.300107.7
8D34.4Very low43.2Very low121 Ų121142.1 Ų142.165%0.64777%0.767SS**  trans-131.884.5173.8-59.2-61.1000105.2K6K6-D8 IonicContact NZ-OD1 2.91Å; K6-D8 PolarHBondContact NZ-OD1 3.49Å; K6-D8 IonicContact NZ-OD2 2.83Å; K6-D8 PolarHBondContact NZ-OD2 3.48Å
9I43Very low43.5Very low136 Ų136139.7 Ų139.770%0.69775%0.754SS**  63.7101.390.9-61.9175.6000112.8
10D35.7Very low43.9Very low162 Ų162136.2 Ų136.287%0.86675%0.745SS**  trans-60.3135.9172.2-57.2-76.1000111.9
11S40.4Very low44.3Very low117 Ų117135.4 Ų135.482%0.81874%0.739SS**  trans-112.5101.8171.3-65.40000109.3E13S11-E13 PolarHBondContact O-N 3.46Å
12N39.3Very low44.9Very low155 Ų155130.4 Ų130.483%0.82972%0.716SS**  trans-75.2107-178.6-162.320.5000109.6S14N12-S14 PolarHBondContact O-N 3.15Å; N12-S14 VanDerWaalsContact O-N 3.16Å
13E40.8Very low45.4Very low188 Ų188127.7 Ų127.788%0.87970%0.704SS**  trans-79.299.6-174.4-162.4165.5-148.700110.5S11 Y15S11-E13 PolarHBondContact O-N 3.46Å; E13-Y15 PolarHBondContact O-N 3.45Å
14S41.4Very low45.7Very low109 Ų109122.1 Ų122.176%0.76269%0.689SS**  trans-67.7115.2-177.8-69.40000112.2N12 S16N12-S14 PolarHBondContact O-N 3.15Å; N12-S14 VanDerWaalsContact O-N 3.16Å; S14-S16 PolarHBondContact O-N 3.27Å
15Y49Very low46.3Very low201 Ų201122.3 Ų122.379%0.78869%0.685SS**  trans-63.7107.7176-168.9-106.4000111.3E13E13-Y15 PolarHBondContact O-N 3.45Å
16S45.2Very low46.6Very low71 Ų71119.2 Ų119.250%0.49767%0.674SS.*  trans-78.3136.7179.4-162.80000111.6S14 D18S14-S16 PolarHBondContact O-N 3.27Å; S16-D18 WeakPolarHBondContact CB-OD2 3.43Å; S16-D18 PolarHBondContact O-N 3Å; S16-D18 PolarHBondContact OG-OD2 3.08Å
17G51.8Low46.8Very low52 Ų52118.5 Ų118.554%0.53668%0.677SS.*THydrogen-bonded Turntrans-70.46.2-175.800000116.1
18D48.2Very low46.9Very low98 Ų98118.9 Ų118.952%0.52468%0.679SS.*Hα-helixtrans-69.8-33.5-175.3-58.5-61000112.8S16 A20 L21 V22S16-D18 WeakPolarHBondContact CB-OD2 3.43Å; S16-D18 PolarHBondContact O-N 3Å; S16-D18 PolarHBondContact OG-OD2 3.08Å; D18-A20 PolarHBondContact O-N 3.24Å; D18-L21 PolarHBondContact O-N 2.6Å; D18-L21 VanDerWaalsContact O-N 3.08Å; D18-V22 PolarHBondContact O-N 3.16Å
19D48.6Very low47.4Very low97 Ų97124.6 Ų124.652%0.51969%0.691SS.*Hα-helixtrans-61.7-31.4-178.8-76.6-19.5000112.6V22 L23D19-V22 PolarHBondContact O-N 3.07Å; D19-L23 PolarHBondContact O-N 3.36Å
20A51.6Low47.2Very low68 Ų68122.8 Ų122.856%0.56269%0.691SS**Hα-helixtrans-67.7-34.6176.700000112.5D18 A24D18-A20 PolarHBondContact O-N 3.24Å; A20-A24 PolarHBondContact O-N 3.32Å; A20-A24 VanDerWaalsContact O-N 3.15Å
21L52.9Low47.4Very low120 Ų120121.4 Ų121.463%0.62868%0.683SS**Hα-helixtrans-75-36178.7-64.9175.4000111.7D18 L23 A24 V25D18-L21 PolarHBondContact O-N 2.6Å; D18-L21 VanDerWaalsContact O-N 3.08Å; L21-L23 VanDerWaalsContact C-N 3.32Å; L21-L23 PolarHBondContact O-N 3.44Å; L21-A24 PolarHBondContact O-N 3.31Å; L21-V25 WeakPolarHBondContact O-CG2 3.4Å; L21-V25 PolarHBondContact O-N 3.24Å
22V53.3Low47.4Very low102 Ų102126.7 Ų126.762%0.61869%0.685SS**Hα-helixtrans-62.2-40.7174.8177.10000111.1D18 D19 A26D18-V22 PolarHBondContact O-N 3.16Å; D19-V22 PolarHBondContact O-N 3.07Å; V22-A26 PolarHBondContact O-N 3.15Å
23L53.4Low47.7Very low121 Ų121126.6 Ų126.663%0.63469%0.685SS**Hα-helixtrans-65.6-39.8173.7-82.7160.1000112.8D19 L21 A26D19-L23 PolarHBondContact O-N 3.36Å; L21-L23 VanDerWaalsContact C-N 3.32Å; L21-L23 PolarHBondContact O-N 3.44Å; L23-A26 PolarHBondContact O-N 3.47Å
24A51Low47.9Very low60 Ų60125.5 Ų125.550%0.49668%0.684SS.*Hα-helixtrans-64.4-39.6177.800000112.8A20 L21 A26 L27A20-A24 PolarHBondContact O-N 3.32Å; A20-A24 VanDerWaalsContact O-N 3.15Å; L21-A24 PolarHBondContact O-N 3.31Å; A24-A26 VanDerWaalsContact C-N 3.32Å; A24-A26 PolarHBondContact O-N 3.06Å; A24-L27 PolarHBondContact O-N 3.25Å
25V58.2Low47.9Very low120 Ų120125.4 Ų125.473%0.72768%0.679SS**Hα-helixtrans-65.9-33.5176.8172.40000111.9L21 L27L21-V25 WeakPolarHBondContact O-CG2 3.4Å; L21-V25 PolarHBondContact O-N 3.24Å; V25-L27 VanDerWaalsContact C-N 3.29Å; V25-L27 PolarHBondContact O-N 3.5Å
26A49.1Very low47.4Very low80 Ų80121.9 Ų121.966%0.66168%0.68SS**Hα-helixtrans-68.1-24.4-17900000114.2V22 L23 A24V22-A26 PolarHBondContact O-N 3.15Å; L23-A26 PolarHBondContact O-N 3.47Å; A24-A26 VanDerWaalsContact C-N 3.32Å; A24-A26 PolarHBondContact O-N 3.06Å
27L50.8Low47.4Very low148 Ų148126 Ų12678%0.77569%0.692SS**Hα-helixtrans-92.3-14.9-173.6-66.9174.8000114.4A24 V25 R29A24-L27 PolarHBondContact O-N 3.25Å; V25-L27 VanDerWaalsContact C-N 3.29Å; V25-L27 PolarHBondContact O-N 3.5Å; L27-R29 PolarHBondContact O-N 3.24Å
28H46.7Very low47.2Very low170 Ų170133.8 Ų133.879%0.78771%0.71SS**  trans-90.764.9-171.7-141.4-132000114S30H28-S30 PolarHBondContact O-N 3.25Å
29R44.9Very low47.1Very low241 Ų241136.9 Ų136.991%0.90973%0.725SS**  trans-92.786.4174.6-172.3179.8179.6135.7-0.1112.3L27L27-R29 PolarHBondContact O-N 3.24Å
30S38.8Very low47Very low98 Ų98136.6 Ų136.669%0.68573%0.731SS**  trans-159.7134.2155.6-111.70000116.4H28H28-S30 PolarHBondContact O-N 3.25Å
31N40.3Very low46.4Very low133 Ų133138.9 Ų138.971%0.71174%0.743SS**  trans40.7106.4152.1-72.4-43.8000120.6
32R39.5Very low46.1Very low228 Ų228140.8 Ų140.886%0.8675%0.746SS**  trans-142.6122.4136.1-41.4-78.2174.1-175.90.3108.1
33N45.4Very low45.8Very low153 Ų153141.2 Ų141.282%0.81875%0.751SS**  trans-81.2120.4168.8-69.3-60.8000108.8
34L46.3Very low45.3Very low166 Ų166143.9 Ų143.987%0.86976%0.758SS**  trans-143.4142165.3-75.8-178.7000113.1
35V40.3Very low45.4Very low107 Ų107150.2 Ų150.265%0.64877%0.774SS**  trans-56142.7-168.9176.90000114.7H37V35-H37 PolarHBondContact O-N 3.07Å; V35-H37 VanDerWaalsContact O-N 3.15Å
36P40.1Very low45.1Very low126 Ų126150.1 Ų150.182%0.81877%0.774SS**  trans-77.897.5175.832.1-34.9000112.1
37H43.3Very low45.5Very low159 Ų159155.6 Ų155.674%0.73678%0.783SS**  trans-77.6129.2166.5-78.6-87.9000111.1V35 I39V35-H37 PolarHBondContact O-N 3.07Å; V35-H37 VanDerWaalsContact O-N 3.15Å; H37-I39 PolarHBondContact O-N 3.19Å
38K49Very low45.8Very low214 Ų214153.1 Ų153.193%0.9378%0.778SS**  trans-58.9120.9179.1-72-177174.4-177.60110.9
39I46.8Very low46.4Very low164 Ų164151.5 Ų151.584%0.84178%0.78SS**  trans-110.2130.5164.6-50.5-178.9000108.7H37H37-I39 PolarHBondContact O-N 3.19Å
40S45.8Very low47.1Very low91 Ų91144.7 Ų144.764%0.63677%0.768SS**  trans-56.1132.5-171.1-173.70000113.8F42S40-F42 PolarHBondContact O-N 3.24Å
41S39.4Very low48.4Very low116 Ų116151 Ų15181%0.81178%0.777SS**  trans-8081.7178.758.60000112.2
42F44.9Very low50Low159 Ų159155.8 Ų155.870%0.69779%0.786SS**  trans-78.3125.3162.8-80.9-79.4000110.2S40 F44S40-F42 PolarHBondContact O-N 3.24Å; F42-F44 VanDerWaalsContact C-N 3.3Å; F42-F44 HydrophobicContact CB-CD2 4.47Å; F42-F44 HydrophobicContact CB-CE2 4.24Å; F42-F44 PolarHBondContact O-N 3.16Å
43P47.6Very low51.6Low111 Ų111153.8 Ų153.872%0.72178%0.783SS**  trans-81.274.3-171.233.5-36.4000111.4K45P43-K45 PolarHBondContact O-N 3.18Å
44F43.3Very low53.5Low177 Ų177158.2 Ų158.278%0.77679%0.788SS**  trans-61.3106.4164.4-75.1-78.3000108.7F42 T46F42-F44 VanDerWaalsContact C-N 3.3Å; F42-F44 HydrophobicContact CB-CD2 4.47Å; F42-F44 HydrophobicContact CB-CE2 4.24Å; F42-F44 PolarHBondContact O-N 3.16Å; F44-T46 PolarHBondContact O-N 3.02Å
45K53.4Low55.3Low193 Ų193158.7 Ų158.784%0.83979%0.786SS**  trans-67.274.5177.5-67.5-177.8-179.5177.60110.3P43 K47P43-K45 PolarHBondContact O-N 3.18Å; K45-K47 PolarHBondContact O-N 2.86Å
46T50.7Low57.3Low119 Ų119160.7 Ų160.773%0.7379%0.786SS**  trans-60103.5163.251.50000106.6F44 S48F44-T46 PolarHBondContact O-N 3.02Å; T46-S48 PolarHBondContact O-N 3.29Å
47K57.7Low59.4Low195 Ų195158.2 Ų158.285%0.84877%0.765SS**  trans-6975.1169.9-64.9-178.4-176.3178.30107.4K45 T49K45-K47 PolarHBondContact O-N 2.86Å; K47-T49 PolarHBondContact O-N 3.44Å; K47-T49 VanDerWaalsContact O-N 3.12Å
48S57.1Low61.7Low95 Ų95153.5 Ų153.566%0.66475%0.749SS**  trans-53.2120167.256.90000106.1T46 C50T46-S48 PolarHBondContact O-N 3.29Å; S48-C50 PolarHBondContact O-N 3.3Å
49T61Low63.4Low136 Ų136148.9 Ų148.983%0.83473%0.731SS**  trans-75.368.8174.255.10000107.5K47 R51K47-T49 PolarHBondContact O-N 3.44Å; K47-T49 VanDerWaalsContact O-N 3.12Å; T49-R51 PolarHBondContact O-N 3.46Å
50C58.8Low65.5Low98 Ų98148.8 Ų148.866%0.66273%0.727SS**PPolyproline II helixtrans-53.5116.5171.1-174.90000106.2S48 R52S48-C50 PolarHBondContact O-N 3.3Å; C50-R52 PolarHBondContact O-N 3.06Å
51R65.1Low67.5Low230 Ų230151.1 Ų151.187%0.86873%0.725SS**PPolyproline II helixtrans-55.9121175.8-60.8-177.4-175.3-166.72.3105.7T49 K53T49-R51 PolarHBondContact O-N 3.46Å; R51-K53 PolarHBondContact O-N 3.41Å
52R74.5Confident70.1Confident235 Ų235147 Ų14789%0.88769%0.693SS**PPolyproline II helixtrans-46.5121.7177.8-83.6-173.7-77108.9-6.8107.5C50 R54C50-R52 PolarHBondContact O-N 3.06Å; R52-R54 PolarHBondContact O-N 3.4Å
53K73.6Confident72.5Confident186 Ų186144.3 Ų144.381%0.80969%0.686SS**PPolyproline II helixtrans-55.6134.8-178.7-78.1-161.1173.8-173.10107.7R51 E55R51-K53 PolarHBondContact O-N 3.41Å; K53-E55 VanDerWaalsContact C-N 3.29Å; K53-E55 PolarHBondContact O-N 2.89Å
54R85.2Confident74.8Confident245 Ų245144 Ų14493%0.92568%0.682SS**  trans-75.490.1-179.7-167.487170.4-131.1-0.6106.5R52 F56R52-R54 PolarHBondContact O-N 3.4Å; R54-F56 PolarHBondContact O-N 3Å
55E84.8Confident77.3Confident176 Ų176140.2 Ų140.282%0.82267%0.669SS**PPolyproline II helixtrans-60.5129.2170.8-73.3167.7-150.800108.5K53K53-E55 VanDerWaalsContact C-N 3.29Å; K53-E55 PolarHBondContact O-N 2.89Å
56F81.8Confident79.3Confident150 Ų150133 Ų13366%0.65864%0.636SS**PPolyproline II helixtrans-76.4139.1172.8-164.2-97000107.8R54 P58R54-F56 PolarHBondContact O-N 3Å; F56-P58 WeakPolarHBondContact O-CD 3.42Å
57I84.1Confident81.4Confident73 Ų73133.1 Ų133.137%0.37462%0.624SS.*PPolyproline II helixtrans-72.2121.5176.5-70.9169.1000107.1K61 K62 Y66I57-K61 HydrophobicContact CG2-CB 3.83Å; I57-K61 WeakPolarHBondContact CG2-O 3.49Å; I57-K62 HydrophobicContact CG2-CG 4.08Å; I57-Y66 HydrophobicContact CB-CE2 4.43Å; I57-Y66 HydrophobicContact CD1-CD2 3.65Å; I57-Y66 HydrophobicContact CD1-CE2 3.66Å
58P91.1Very high83.3Confident61 Ų61127.3 Ų127.340%0.39660%0.6SS.*PPolyproline II helixtrans-53.5150.5176.9-25.434.8000111.6F56 E60 K61F56-P58 WeakPolarHBondContact O-CD 3.42Å; P58-E60 WeakPolarHBondContact CB-OE2 3.37Å; P58-E60 PolarHBondContact O-N 2.91Å; P58-K61 PolarHBondContact O-N 3.19Å
59E85.2Confident85.2Confident116 Ų116131 Ų13154%0.54260%0.599SS.*G310 helixtrans-58.6-36.8-174.4-155.266.6-131.100111.4K61 K62E59-K61 PolarHBondContact O-N 3.24Å; E59-K62 PolarHBondContact O-N 3.5Å; E59-K62 VanDerWaalsContact O-N 3.14Å; E59-K62 VanDerWaalsContact OE1-CD 3.3Å; E59-K62 WeakPolarHBondContact OE1-CD 3.43Å; E59-K62 WeakPolarHBondContact OE1-CE 3.32Å; E59-K62 IonicContact OE1-NZ 3.54Å; E59-K62 PolarHBondContact OE1-NZ 3.29Å; E59-K62 WeakPolarHBondContact OE2-CE 3.5Å; E59-K62 IonicContact OE2-NZ 2.9Å; E59-K62 PolarHBondContact OE2-NZ 3.09Å
60E90.4Very high87Confident162 Ų162129.3 Ų129.376%0.75758%0.577SS**G310 helixtrans-66-8.7179.5-49.374.1-160.100113.3P58P58-E60 WeakPolarHBondContact CB-OE2 3.37Å; P58-E60 PolarHBondContact O-N 2.91Å
61K87.9Confident88.9Confident141 Ų141132.3 Ų132.361%0.61358%0.575SS**G310 helixtrans-118.914.7179.9-61.3-176.4-178.5178.60112.8I57 P58 E59 D63I57-K61 HydrophobicContact CG2-CB 3.83Å; I57-K61 WeakPolarHBondContact CG2-O 3.49Å; P58-K61 PolarHBondContact O-N 3.19Å; E59-K61 PolarHBondContact O-N 3.24Å; K61-D63 PolarHBondContact O-N 3.46Å
62K94.1Very high90.5Very high28 Ų28127.5 Ų127.512%0.12256%0.56CS.*  trans-92.968.3177.4-66-170.3-160.5160.40111.8I57 E59 Y66 W67I57-K62 HydrophobicContact CG2-CG 4.08Å; E59-K62 PolarHBondContact O-N 3.5Å; E59-K62 VanDerWaalsContact O-N 3.14Å; E59-K62 VanDerWaalsContact OE1-CD 3.3Å; E59-K62 WeakPolarHBondContact OE1-CD 3.43Å; E59-K62 WeakPolarHBondContact OE1-CE 3.32Å; E59-K62 IonicContact OE1-NZ 3.54Å; E59-K62 PolarHBondContact OE1-NZ 3.29Å; E59-K62 WeakPolarHBondContact OE2-CE 3.5Å; E59-K62 IonicContact OE2-NZ 2.9Å; E59-K62 PolarHBondContact OE2-NZ 3.09Å; K62-Y66 HydrophobicContact CB-CD1 3.75Å; K62-Y66 HydrophobicContact CB-CE1 4.21Å; K62-Y66 HydrophobicContact CB-CG 4.41Å; K62-Y66 HydrophobicContact CD-CD1 4.09Å; K62-Y66 HydrophobicContact CD-CE1 3.67Å; K62-Y66 HydrophobicContact CG-CD1 3.79Å; K62-Y66 HydrophobicContact CG-CE1 3.8Å; K62-Y66 HydrophobicContact CG-CG 4.42Å; K62-W67 HydrophobicContact CB-CZ2 4.24Å; K62-W67 HydrophobicContact CD-CH2 4.21Å; K62-W67 HydrophobicContact CD-CZ2 3.67Å; K62-W67 PolarHBondContact O-NE1 3.4Å
63D95.4Very high91.6Very high104 Ų104120.8 Ų120.856%0.55654%0.542SS*.  trans-64.8167.2178.1-42.6-32.9000112.3K61 I65 Y66 W67K61-D63 PolarHBondContact O-N 3.46Å; D63-I65 PolarHBondContact O-N 3.5Å; D63-I65 VanDerWaalsContact O-N 3.1Å; D63-Y66 WeakPolarHBondContact O-CA 3.25Å; D63-Y66 VanDerWaalsContact O-CB 3.32Å; D63-Y66 WeakPolarHBondContact O-CB 3.45Å; D63-Y66 PolarHBondContact O-N 2.94Å; D63-W67 PolarHBondContact O-N 3.42Å; D63-W67 VanDerWaalsContact O-N 3.15Å
64T95.9Very high92.8Very high105 Ų105115.9 Ų115.964%0.64452%0.524SS*.Hα-helixtrans-48.1-41.6174.6-48.40000112.8Y66 W67 E68T64-Y66 VanDerWaalsContact C-N 3.33Å; T64-Y66 PolarHBondContact O-N 3.18Å; T64-W67 PolarHBondContact O-N 2.9Å; T64-E68 PolarHBondContact O-N 3.36Å
65I95.4Very high93.4Very high96 Ų96108.6 Ų108.649%0.49250%0.501SS..Hα-helixtrans-65-35.3179-53.2177.8000111.6D63 R69D63-I65 PolarHBondContact O-N 3.5Å; D63-I65 VanDerWaalsContact O-N 3.1Å; I65-R69 VanDerWaalsContact O-CG 3.29Å; I65-R69 WeakPolarHBondContact O-CG 3.4Å; I65-R69 PolarHBondContact O-N 3.41Å; I65-R69 VanDerWaalsContact O-N 3.11Å
66Y95.4Very high94.1Very high41 Ų41102.7 Ų102.716%0.16148%0.482CS..Hα-helixtrans-64.5-47.6172.6167.8-92.3000110.6I57 K62 D63 T64 E68 R69 R70I57-Y66 HydrophobicContact CB-CE2 4.43Å; I57-Y66 HydrophobicContact CD1-CD2 3.65Å; I57-Y66 HydrophobicContact CD1-CE2 3.66Å; K62-Y66 HydrophobicContact CB-CD1 3.75Å; K62-Y66 HydrophobicContact CB-CE1 4.21Å; K62-Y66 HydrophobicContact CB-CG 4.41Å; K62-Y66 HydrophobicContact CD-CD1 4.09Å; K62-Y66 HydrophobicContact CD-CE1 3.67Å; K62-Y66 HydrophobicContact CG-CD1 3.79Å; K62-Y66 HydrophobicContact CG-CE1 3.8Å; K62-Y66 HydrophobicContact CG-CG 4.42Å; D63-Y66 WeakPolarHBondContact O-CA 3.25Å; D63-Y66 VanDerWaalsContact O-CB 3.32Å; D63-Y66 WeakPolarHBondContact O-CB 3.45Å; D63-Y66 PolarHBondContact O-N 2.94Å; T64-Y66 VanDerWaalsContact C-N 3.33Å; T64-Y66 PolarHBondContact O-N 3.18Å; Y66-E68 VanDerWaalsContact C-N 3.35Å; Y66-E68 PolarHBondContact O-N 3.16Å; Y66-R69 PolarHBondContact O-N 3.46Å; Y66-R70 HydrophobicContact CE1-CB 4.35Å; Y66-R70 WeakPolarHBondContact O-CB 2.96Å; Y66-R70 PolarHBondContact O-N 2.72Å
67W95.9Very high94.9Very high122 Ų12297.5 Ų97.546%0.46247%0.467SS..Hα-helixtrans-62.6-39.3-179.8-71.9111.1000112.9K62 D63 T64 R70 R71K62-W67 HydrophobicContact CB-CZ2 4.24Å; K62-W67 HydrophobicContact CD-CH2 4.21Å; K62-W67 HydrophobicContact CD-CZ2 3.67Å; K62-W67 PolarHBondContact O-NE1 3.4Å; D63-W67 PolarHBondContact O-N 3.42Å; D63-W67 VanDerWaalsContact O-N 3.15Å; T64-W67 PolarHBondContact O-N 2.9Å; W67-R70 PolarHBondContact O-N 3.23Å; W67-R71 WeakPolarHBondContact O-CB 3.33Å; W67-R71 PolarHBondContact O-N 2.82Å
68E97.6Very high95.6Very high73 Ų73101.7 Ų101.734%0.34148%0.482SS..Hα-helixtrans-60.7-49171.1-80-170.1-144.600113.1T64 Y66 R70 R71 K72T64-E68 PolarHBondContact O-N 3.36Å; Y66-E68 VanDerWaalsContact C-N 3.35Å; Y66-E68 PolarHBondContact O-N 3.16Å; E68-R70 VanDerWaalsContact C-N 3.26Å; E68-R70 PolarHBondContact O-N 3.19Å; E68-R71 PolarHBondContact O-N 3.21Å; E68-K72 WeakPolarHBondContact O-CB 3.26Å; E68-K72 WeakPolarHBondContact O-CG 3.1Å; E68-K72 PolarHBondContact O-N 3.09Å; E68-K72 IonicContact OE2-NZ 2.78Å; E68-K72 PolarHBondContact OE2-NZ 3.44Å
69R97.1Very high96Very high173 Ų173106.3 Ų106.365%0.65349%0.492SS*.Hα-helixtrans-60.7-39.3177-72.4172-176.8145.20.4110.9I65 Y66 N73I65-R69 VanDerWaalsContact O-CG 3.29Å; I65-R69 WeakPolarHBondContact O-CG 3.4Å; I65-R69 PolarHBondContact O-N 3.41Å; I65-R69 VanDerWaalsContact O-N 3.11Å; Y66-R69 PolarHBondContact O-N 3.46Å; R69-N73 VanDerWaalsContact O-CB 3.3Å; R69-N73 WeakPolarHBondContact O-CB 3.33Å; R69-N73 PolarHBondContact O-N 2.96Å
70R97.6Very high96.6Very high101 Ų101104 Ų10438%0.38149%0.489SS..Hα-helixtrans-64.1-44.3176.8-168.274-173.787.69.1111.4Y66 W67 E68 N73 N74Y66-R70 HydrophobicContact CE1-CB 4.35Å; Y66-R70 WeakPolarHBondContact O-CB 2.96Å; Y66-R70 PolarHBondContact O-N 2.72Å; W67-R70 PolarHBondContact O-N 3.23Å; E68-R70 VanDerWaalsContact C-N 3.26Å; E68-R70 PolarHBondContact O-N 3.19Å; R70-N73 PolarHBondContact O-N 2.72Å; R70-N74 PolarHBondContact NH1-OD1 3.18Å; R70-N74 PolarHBondContact O-N 2.9Å
71R98.5Very high97Very high161 Ų161105 Ų10561%0.60849%0.485SS*.Hα-helixtrans-61-54.2175-165.3-168.4-53.7157.34.4111.1W67 E68 N73 N74 E75W67-R71 WeakPolarHBondContact O-CB 3.33Å; W67-R71 PolarHBondContact O-N 2.82Å; E68-R71 PolarHBondContact O-N 3.21Å; R71-N73 VanDerWaalsContact C-N 3.31Å; R71-N73 PolarHBondContact O-N 2.97Å; R71-N74 PolarHBondContact O-N 3.44Å; R71-N74 VanDerWaalsContact O-N 3.13Å; R71-E75 PolarHBondContact O-N 2.93Å
72K98.6Very high97.5Very high129 Ų129102 Ų10256%0.56147%0.474SS*.Hα-helixtrans-56.2-41.6177.5-72.6164.3176.9159.50111.8E68 A76E68-K72 WeakPolarHBondContact O-CB 3.26Å; E68-K72 WeakPolarHBondContact O-CG 3.1Å; E68-K72 PolarHBondContact O-N 3.09Å; E68-K72 IonicContact OE2-NZ 2.78Å; E68-K72 PolarHBondContact OE2-NZ 3.44Å; K72-A76 WeakPolarHBondContact O-CB 3.5Å; K72-A76 PolarHBondContact O-N 3.31Å
73N98.4Very high97.7Very high93 Ų93108.6 Ų108.650%0.49750%0.502SS..Hα-helixtrans-69-39.4176.3179.8-113.1000113.4R69 R70 R71 A76 A77R69-N73 VanDerWaalsContact O-CB 3.3Å; R69-N73 WeakPolarHBondContact O-CB 3.33Å; R69-N73 PolarHBondContact O-N 2.96Å; R70-N73 PolarHBondContact O-N 2.72Å; R71-N73 VanDerWaalsContact C-N 3.31Å; R71-N73 PolarHBondContact O-N 2.97Å; N73-A76 PolarHBondContact O-N 3.47Å; N73-A77 WeakPolarHBondContact O-CB 3.22Å; N73-A77 PolarHBondContact O-N 3.25Å
74N98.6Very high97.9Very high83 Ų83110.4 Ų110.444%0.44450%0.501SS..Hα-helixtrans-62.7-42.6174.5-79.8-17.1000111.6R70 R71 A77 K78R70-N74 PolarHBondContact NH1-OD1 3.18Å; R70-N74 PolarHBondContact O-N 2.9Å; R71-N74 PolarHBondContact O-N 3.44Å; R71-N74 VanDerWaalsContact O-N 3.13Å; N74-A77 PolarHBondContact O-N 3.45Å; N74-K78 PolarHBondContact O-N 3.18Å
75E98.7Very high98Very high93 Ų93113 Ų11344%0.43550%0.499SS..Hα-helixtrans-64.2-44.6174.5-67.9-159.7168.500112.7R71 A77 K78 R79R71-E75 PolarHBondContact O-N 2.93Å; E75-A77 VanDerWaalsContact C-N 3.26Å; E75-A77 PolarHBondContact O-N 3.05Å; E75-K78 PolarHBondContact O-N 3.16Å; E75-K78 VanDerWaalsContact O-N 3.12Å; E75-R79 PolarHBondContact O-N 3.07Å; E75-R79 IonicContact OE2-CZ 2.57Å; E75-R79 VanDerWaalsContact OE2-CZ 3.26Å; E75-R79 IonicContact OE2-NH1 3.26Å; E75-R79 PolarHBondContact OE2-NH1 3.41Å; E75-R79 IonicContact OE2-NH2 2.77Å; E75-R79 PolarHBondContact OE2-NH2 3.35Å
76A98.4Very high98.2Very high52 Ų52112.5 Ų112.543%0.4350%0.496SS..Hα-helixtrans-59.8-39.517700000111.2K72 N73 S80K72-A76 WeakPolarHBondContact O-CB 3.5Å; K72-A76 PolarHBondContact O-N 3.31Å; N73-A76 PolarHBondContact O-N 3.47Å; A76-S80 WeakPolarHBondContact O-CB 3.47Å; A76-S80 PolarHBondContact O-N 3.26Å
77A98.7Very high98.3Very high40 Ų40114.7 Ų114.733%0.33151%0.511SS..Hα-helixtrans-65.5-40.3173.200000112.5N73 N74 E75 S80 R81N73-A77 WeakPolarHBondContact O-CB 3.22Å; N73-A77 PolarHBondContact O-N 3.25Å; N74-A77 PolarHBondContact O-N 3.45Å; E75-A77 VanDerWaalsContact C-N 3.26Å; E75-A77 PolarHBondContact O-N 3.05Å; A77-S80 PolarHBondContact O-N 2.95Å; A77-R81 VanDerWaalsContact O-CG 3.3Å; A77-R81 WeakPolarHBondContact O-CG 3.4Å; A77-R81 PolarHBondContact O-N 3.3Å
78K98.7Very high98.5Very high161 Ų161112.8 Ų112.870%0.751%0.51SS*.Hα-helixtrans-62.2-52.9174.4-172.4179.5178.9-177.40111N74 E75 S80 R81 E82N74-K78 PolarHBondContact O-N 3.18Å; E75-K78 PolarHBondContact O-N 3.16Å; E75-K78 VanDerWaalsContact O-N 3.12Å; K78-S80 VanDerWaalsContact C-N 3.31Å; K78-S80 PolarHBondContact O-N 3.16Å; K78-R81 PolarHBondContact O-N 2.87Å; K78-E82 PolarHBondContact O-N 3.04Å
79R98.6Very high98.5Very high159 Ų159113.7 Ų113.760%0.652%0.515SS*.Hα-helixtrans-58.6-40.5176.6-67.8-172.4-171.1906.3112.1E75 E82 K83E75-R79 PolarHBondContact O-N 3.07Å; E75-R79 IonicContact OE2-CZ 2.57Å; E75-R79 VanDerWaalsContact OE2-CZ 3.26Å; E75-R79 IonicContact OE2-NH1 3.26Å; E75-R79 PolarHBondContact OE2-NH1 3.41Å; E75-R79 IonicContact OE2-NH2 2.77Å; E75-R79 PolarHBondContact OE2-NH2 3.35Å; R79-E82 PolarHBondContact O-N 2.73Å; R79-K83 VanDerWaalsContact O-CB 3.32Å; R79-K83 WeakPolarHBondContact O-CB 3.27Å; R79-K83 PolarHBondContact O-N 3.34Å
80S98.8Very high98.6Very high68 Ų68109.1 Ų109.148%0.47651%0.507SS..Hα-helixtrans-67.1-351781770000113.4A76 A77 K78 R84A76-S80 WeakPolarHBondContact O-CB 3.47Å; A76-S80 PolarHBondContact O-N 3.26Å; A77-S80 PolarHBondContact O-N 2.95Å; K78-S80 VanDerWaalsContact C-N 3.31Å; K78-S80 PolarHBondContact O-N 3.16Å; S80-R84 PolarHBondContact O-N 3.35Å
81R98.8Very high98.6Very high182 Ų182109.1 Ų109.169%0.68751%0.513SS*.Hα-helixtrans-70.2-45.3174.6-74.8172.2178.4-167-2.4110.8A77 K78 R84 R85A77-R81 VanDerWaalsContact O-CG 3.3Å; A77-R81 WeakPolarHBondContact O-CG 3.4Å; A77-R81 PolarHBondContact O-N 3.3Å; K78-R81 PolarHBondContact O-N 2.87Å; R81-R84 WeakPolarHBondContact O-CB 3.43Å; R81-R84 PolarHBondContact O-N 3.34Å; R81-R84 VanDerWaalsContact O-N 3.15Å; R81-R85 PolarHBondContact O-N 2.9Å
82E98.8Very high98.6Very high78 Ų78107.4 Ų107.436%0.36451%0.512SS..Hα-helixtrans-66.6-42-179.2-159.554.8-132.900111.8K78 R79 R84 R85 I86K78-E82 PolarHBondContact O-N 3.04Å; R79-E82 PolarHBondContact O-N 2.73Å; E82-R84 PolarHBondContact O-N 2.93Å; E82-R85 PolarHBondContact O-N 3.19Å; E82-R85 WeakPolarHBondContact OE1-CD 3.28Å; E82-R85 IonicContact OE2-NH1 2.72Å; E82-I86 HydrophobicContact CG-CD1 4.11Å; E82-I86 WeakPolarHBondContact O-CG1 3.17Å; E82-I86 PolarHBondContact O-N 3.14Å
83K98.7Very high98.6Very high166 Ų166105.9 Ų105.972%0.72251%0.511SS*.Hα-helixtrans-56.5-37.7171.9-179.3172.7179.9175.10112.3R79 N87R79-K83 VanDerWaalsContact O-CB 3.32Å; R79-K83 WeakPolarHBondContact O-CB 3.27Å; R79-K83 PolarHBondContact O-N 3.34Å; K83-N87 WeakPolarHBondContact O-CB 3.44Å; K83-N87 PolarHBondContact O-N 2.99Å; K83-N87 VanDerWaalsContact O-N 3.14Å
84R98.8Very high98.6Very high143 Ų143107.8 Ų107.854%0.5451%0.514SS..Hα-helixtrans-68.8-52.6175.8-166.8-169.9-64.1122.95.2110.8S80 R81 E82 I86 N87 D88S80-R84 PolarHBondContact O-N 3.35Å; R81-R84 WeakPolarHBondContact O-CB 3.43Å; R81-R84 PolarHBondContact O-N 3.34Å; R81-R84 VanDerWaalsContact O-N 3.15Å; E82-R84 PolarHBondContact O-N 2.93Å; R84-I86 VanDerWaalsContact C-N 3.28Å; R84-I86 PolarHBondContact O-N 3.31Å; R84-N87 CarbonylContact O-C 3.55Å; R84-N87 WeakPolarHBondContact O-CA 3.39Å; R84-N87 WeakPolarHBondContact O-CB 3.45Å; R84-N87 PolarHBondContact O-N 3.03Å; R84-D88 WeakPolarHBondContact CG-OD2 3.42Å; R84-D88 PolarHBondContact O-N 2.92Å
85R98.8Very high98.6Very high160 Ų160108.3 Ų108.360%0.60452%0.516SS*.Hα-helixtrans-51.1-47.1177.5170.2-179.6-87.2156.2-14.2112.3R81 E82 N87 D88 M89R81-R85 PolarHBondContact O-N 2.9Å; E82-R85 PolarHBondContact O-N 3.19Å; E82-R85 WeakPolarHBondContact OE1-CD 3.28Å; E82-R85 IonicContact OE2-NH1 2.72Å; R85-N87 VanDerWaalsContact C-N 3.33Å; R85-N87 PolarHBondContact O-N 3.39Å; R85-D88 PolarHBondContact O-N 3.38Å; R85-M89 WeakPolarHBondContact O-CB 3.45Å; R85-M89 PolarHBondContact O-N 2.77Å
86I98.6Very high98.5Very high84 Ų84109.1 Ų109.143%0.43152%0.522SS..Hα-helixtrans-63.7-40.1177.8-65.8167000110.8E82 R84 V90E82-I86 HydrophobicContact CG-CD1 4.11Å; E82-I86 WeakPolarHBondContact O-CG1 3.17Å; E82-I86 PolarHBondContact O-N 3.14Å; R84-I86 VanDerWaalsContact C-N 3.28Å; R84-I86 PolarHBondContact O-N 3.31Å; I86-V90 HydrophobicContact CG2-CG2 4.42Å; I86-V90 WeakPolarHBondContact O-CB 3.36Å; I86-V90 WeakPolarHBondContact O-CG2 3.1Å; I86-V90 PolarHBondContact O-N 2.86Å
87N98.6Very high98.5Very high87 Ų87108.7 Ų108.747%0.46552%0.518SS..Hα-helixtrans-66.9-43.3177.4-179.7-146.8000112.5K83 R84 R85 V90 L91K83-N87 WeakPolarHBondContact O-CB 3.44Å; K83-N87 PolarHBondContact O-N 2.99Å; K83-N87 VanDerWaalsContact O-N 3.14Å; R84-N87 CarbonylContact O-C 3.55Å; R84-N87 WeakPolarHBondContact O-CA 3.39Å; R84-N87 WeakPolarHBondContact O-CB 3.45Å; R84-N87 PolarHBondContact O-N 3.03Å; R85-N87 VanDerWaalsContact C-N 3.33Å; R85-N87 PolarHBondContact O-N 3.39Å; N87-V90 PolarHBondContact O-N 3.41Å; N87-L91 WeakPolarHBondContact O-CG 3.42Å; N87-L91 PolarHBondContact O-N 2.93Å
88D98.4Very high98.4Very high83 Ų83110.9 Ų110.944%0.44452%0.524SS..Hα-helixtrans-59.7-49.4176.5-56.2-25.8000109.8R84 R85 V90 L91 E92R84-D88 WeakPolarHBondContact CG-OD2 3.42Å; R84-D88 PolarHBondContact O-N 2.92Å; R85-D88 PolarHBondContact O-N 3.38Å; D88-V90 PolarHBondContact O-N 2.88Å; D88-L91 WeakPolarHBondContact O-CB 3.41Å; D88-L91 PolarHBondContact O-N 3.38Å; D88-L91 VanDerWaalsContact O-N 3.12Å; D88-E92 PolarHBondContact O-N 2.88Å
89M98.6Very high98.3Very high91 Ų91105.2 Ų105.245%0.44851%0.511SS..Hα-helixtrans-61.3-37.4176.2-176.9-177.370.700113.2R85 E92 N93R85-M89 WeakPolarHBondContact O-CB 3.45Å; R85-M89 PolarHBondContact O-N 2.77Å; M89-E92 PolarHBondContact O-N 2.99Å; M89-N93 WeakPolarHBondContact O-CB 3.38Å; M89-N93 VanDerWaalsContact O-CG 3.22Å; M89-N93 PolarHBondContact O-N 2.92Å; M89-N93 PolarHBondContact O-ND2 3.19Å
90V98.6Very high98.2Very high78 Ų78104.8 Ų104.847%0.47352%0.516SS..Hα-helixtrans-68.7-35.1175.1165.50000111.6I86 N87 D88 K94I86-V90 HydrophobicContact CG2-CG2 4.42Å; I86-V90 WeakPolarHBondContact O-CB 3.36Å; I86-V90 WeakPolarHBondContact O-CG2 3.1Å; I86-V90 PolarHBondContact O-N 2.86Å; N87-V90 PolarHBondContact O-N 3.41Å; D88-V90 PolarHBondContact O-N 2.88Å; V90-K94 WeakPolarHBondContact O-CB 3.26Å; V90-K94 PolarHBondContact O-N 3.12Å
91L98.6Very high98.2Very high100 Ų100107 Ų10752%0.52452%0.519SS..Hα-helixtrans-69.9-40.7174.9-70.4169.4000111.5N87 D88 K94 L95N87-L91 WeakPolarHBondContact O-CG 3.42Å; N87-L91 PolarHBondContact O-N 2.93Å; D88-L91 WeakPolarHBondContact O-CB 3.41Å; D88-L91 PolarHBondContact O-N 3.38Å; D88-L91 VanDerWaalsContact O-N 3.12Å; L91-K94 PolarHBondContact O-N 3.02Å; L91-L95 WeakPolarHBondContact O-CB 3.46Å; L91-L95 PolarHBondContact O-N 2.95Å
92E98.1Very high98.1Very high125 Ų125102 Ų10258%0.58451%0.506SS*.Hα-helixtrans-61.3-50.3173.9-175.4175.6-167.100111.7D88 M89 K94 L95 M96D88-E92 PolarHBondContact O-N 2.88Å; M89-E92 PolarHBondContact O-N 2.99Å; E92-K94 VanDerWaalsContact C-N 3.29Å; E92-K94 PolarHBondContact O-N 2.87Å; E92-L95 WeakPolarHBondContact O-CB 3.47Å; E92-L95 PolarHBondContact O-N 3.28Å; E92-L95 VanDerWaalsContact O-N 3.1Å; E92-M96 PolarHBondContact O-N 3.16Å
93N98.3Very high97.9Very high98 Ų98100.8 Ų100.852%0.52451%0.509SS..Hα-helixtrans-58.3-40.4174.8-73.2-18.3000112.2M89 M96 A97M89-N93 WeakPolarHBondContact O-CB 3.38Å; M89-N93 VanDerWaalsContact O-CG 3.22Å; M89-N93 PolarHBondContact O-N 2.92Å; M89-N93 PolarHBondContact O-ND2 3.19Å; N93-M96 PolarHBondContact O-N 2.96Å; N93-A97 WeakPolarHBondContact O-CB 3.43Å; N93-A97 PolarHBondContact O-N 2.75Å
94K98.4Very high97.8Very high132 Ų13295.8 Ų95.857%0.57450%0.495SS*.Hα-helixtrans-67.3-38.2176-179.5172.3178.2174.60112.2V90 L91 E92 L98V90-K94 WeakPolarHBondContact O-CB 3.26Å; V90-K94 PolarHBondContact O-N 3.12Å; L91-K94 PolarHBondContact O-N 3.02Å; E92-K94 VanDerWaalsContact C-N 3.29Å; E92-K94 PolarHBondContact O-N 2.87Å; K94-L98 HydrophobicContact CG-CD1 3.94Å; K94-L98 HydrophobicContact CG-CG 4.32Å; K94-L98 WeakPolarHBondContact O-CB 3.34Å; K94-L98 VanDerWaalsContact O-CG 3.29Å; K94-L98 WeakPolarHBondContact O-CG 3.44Å; K94-L98 PolarHBondContact O-N 2.9Å
95L98.4Very high97.8Very high94 Ų9494.2 Ų94.249%0.49250%0.497SS..Hα-helixtrans-62.7-44.3175.9178.664.2000110.8L91 E92 G99 I137L91-L95 WeakPolarHBondContact O-CB 3.46Å; L91-L95 PolarHBondContact O-N 2.95Å; E92-L95 WeakPolarHBondContact O-CB 3.47Å; E92-L95 PolarHBondContact O-N 3.28Å; E92-L95 VanDerWaalsContact O-N 3.1Å; L95-G99 PolarHBondContact O-N 2.94Å; L95-I137 HydrophobicContact CD2-CD1 4.43Å
96M96.6Very high97.7Very high110 Ų11090.6 Ų90.654%0.54249%0.486SS..Hα-helixtrans-63-49.5176.6-70.1-59.9-64.700112.2E92 N93 L98 G99 E100 T136E92-M96 PolarHBondContact O-N 3.16Å; N93-M96 PolarHBondContact O-N 2.96Å; M96-L98 PolarHBondContact O-N 3.5Å; M96-G99 WeakPolarHBondContact O-CA 3.41Å; M96-G99 PolarHBondContact O-N 3.36Å; M96-E100 PolarHBondContact O-N 2.95Å; M96-T136 HydrophobicContact CE-CG2 4.34Å; M96-T136 HydrophobicContact SD-CG2 4.43Å
97A97.8Very high97.5Very high43 Ų4389 Ų8936%0.35549%0.485SS..Hα-helixtrans-60.3-45.1178.700000112.5N93 G99 E100 E101N93-A97 WeakPolarHBondContact O-CB 3.43Å; N93-A97 PolarHBondContact O-N 2.75Å; A97-G99 VanDerWaalsContact C-N 3.26Å; A97-G99 PolarHBondContact O-N 3.26Å; A97-E100 PolarHBondContact O-N 3.37Å; A97-E101 WeakPolarHBondContact O-CG 3.29Å; A97-E101 PolarHBondContact O-N 2.92Å
98L98.3Very high97.5Very high86 Ų8689.9 Ų89.945%0.4549%0.486SS..Hα-helixtrans-65.6-29.4174.5-71.2174.9000112.7K94 M96 N102K94-L98 HydrophobicContact CG-CD1 3.94Å; K94-L98 HydrophobicContact CG-CG 4.32Å; K94-L98 WeakPolarHBondContact O-CB 3.34Å; K94-L98 VanDerWaalsContact O-CG 3.29Å; K94-L98 WeakPolarHBondContact O-CG 3.44Å; K94-L98 PolarHBondContact O-N 2.9Å; M96-L98 PolarHBondContact O-N 3.5Å; L98-N102 WeakPolarHBondContact O-CB 3.32Å; L98-N102 PolarHBondContact O-N 3.46Å
99G96.6Very high97.4Very high43 Ų4390.3 Ų90.344%0.44349%0.488SS..Hα-helixtrans-66-46172.800000112.1L95 M96 A97 N102 A103L95-G99 PolarHBondContact O-N 2.94Å; M96-G99 WeakPolarHBondContact O-CA 3.41Å; M96-G99 PolarHBondContact O-N 3.36Å; A97-G99 VanDerWaalsContact C-N 3.26Å; A97-G99 PolarHBondContact O-N 3.26Å; G99-N102 PolarHBondContact O-N 3.33Å; G99-A103 WeakPolarHBondContact O-CB 3.22Å; G99-A103 PolarHBondContact O-N 3.06Å
100E96.3Very high97.3Very high150 Ų15086.6 Ų86.670%0.70147%0.47SS*.Hα-helixtrans-64.1-49.4176.3-174.7175.6-172.600111.9M96 A97 N102 A103 S104M96-E100 PolarHBondContact O-N 2.95Å; A97-E100 PolarHBondContact O-N 3.37Å; E100-N102 VanDerWaalsContact C-N 3.31Å; E100-N102 PolarHBondContact O-N 3.06Å; E100-A103 PolarHBondContact O-N 2.7Å; E100-A103 VanDerWaalsContact O-N 3.16Å; E100-S104 PolarHBondContact O-N 2.91Å
101E97.9Very high97.1Very high114 Ų11484.7 Ų84.753%0.53346%0.46SS..Hα-helixtrans-56.1-44.9175-73.9175.1-166.800111.6A97 A103 S104 L105A97-E101 WeakPolarHBondContact O-CG 3.29Å; A97-E101 PolarHBondContact O-N 2.92Å; E101-A103 PolarHBondContact O-N 3.37Å; E101-S104 PolarHBondContact O-N 2.96Å; E101-L105 WeakPolarHBondContact O-CB 3.3Å; E101-L105 VanDerWaalsContact O-CG 3.26Å; E101-L105 WeakPolarHBondContact O-CG 3.49Å; E101-L105 PolarHBondContact O-N 3.05Å
102N96.8Very high97.1Very high78 Ų7884 Ų8442%0.41746%0.456SS..Hα-helixtrans-66-38.1178.9-169-40.2000111.9L98 G99 E100 K106L98-N102 WeakPolarHBondContact O-CB 3.32Å; L98-N102 PolarHBondContact O-N 3.46Å; G99-N102 PolarHBondContact O-N 3.33Å; E100-N102 VanDerWaalsContact C-N 3.31Å; E100-N102 PolarHBondContact O-N 3.06Å; N102-K106 WeakPolarHBondContact O-CB 3.38Å; N102-K106 WeakPolarHBondContact O-CD 3.35Å; N102-K106 VanDerWaalsContact O-CG 3.28Å; N102-K106 WeakPolarHBondContact O-CG 3.41Å; N102-K106 PolarHBondContact O-N 3.04Å; N102-K106 VanDerWaalsContact OD1-CD 3.27Å; N102-K106 WeakPolarHBondContact OD1-CD 3.41Å; N102-K106 WeakPolarHBondContact OD1-CE 3.4Å; N102-K106 PolarHBondContact OD1-NZ 3.49Å
103A95.6Very high97Very high52 Ų5281.9 Ų81.943%0.4345%0.445SS..Hα-helixtrans-64.7-44.2173.400000112.1G99 E100 E101 K106 A107G99-A103 WeakPolarHBondContact O-CB 3.22Å; G99-A103 PolarHBondContact O-N 3.06Å; E100-A103 PolarHBondContact O-N 2.7Å; E100-A103 VanDerWaalsContact O-N 3.16Å; E101-A103 PolarHBondContact O-N 3.37Å; A103-K106 PolarHBondContact O-N 2.77Å; A103-A107 PolarHBondContact O-N 3.12Å
104S96.6Very high96.9Very high60 Ų6080.1 Ų80.142%0.4244%0.435SS..Hα-helixtrans-59.9-52.1174.7-167.60000111.4E100 E101 K106 A107 E108E100-S104 PolarHBondContact O-N 2.91Å; E101-S104 PolarHBondContact O-N 2.96Å; S104-K106 VanDerWaalsContact C-N 3.27Å; S104-K106 PolarHBondContact O-N 2.82Å; S104-A107 WeakPolarHBondContact O-CB 3.41Å; S104-A107 PolarHBondContact O-N 2.99Å; S104-E108 WeakPolarHBondContact O-CG 3.4Å; S104-E108 PolarHBondContact O-N 3.46Å; S104-E108 PolarHBondContact OG-OE1 3.45Å
105L98.1Very high96.7Very high111 Ų11181 Ų8158%0.58144%0.439SS*.Hα-helixtrans-59.7-36.5179.6-71171.4000112.4E101 L109E101-L105 WeakPolarHBondContact O-CB 3.3Å; E101-L105 VanDerWaalsContact O-CG 3.26Å; E101-L105 WeakPolarHBondContact O-CG 3.49Å; E101-L105 PolarHBondContact O-N 3.05Å; L105-L109 WeakPolarHBondContact O-CB 3.33Å; L105-L109 PolarHBondContact O-N 3.06Å
106K96.1Very high96.6Very high84 Ų8483.7 Ų83.737%0.36545%0.447SS..Hα-helixtrans-66.5-42.8173.2-79.7166.3171.2161.90112.1N102 A103 S104 L110 L131N102-K106 WeakPolarHBondContact O-CB 3.38Å; N102-K106 WeakPolarHBondContact O-CD 3.35Å; N102-K106 VanDerWaalsContact O-CG 3.28Å; N102-K106 WeakPolarHBondContact O-CG 3.41Å; N102-K106 PolarHBondContact O-N 3.04Å; N102-K106 VanDerWaalsContact OD1-CD 3.27Å; N102-K106 WeakPolarHBondContact OD1-CD 3.41Å; N102-K106 WeakPolarHBondContact OD1-CE 3.4Å; N102-K106 PolarHBondContact OD1-NZ 3.49Å; A103-K106 PolarHBondContact O-N 2.77Å; S104-K106 VanDerWaalsContact C-N 3.27Å; S104-K106 PolarHBondContact O-N 2.82Å; K106-L110 WeakPolarHBondContact O-CB 3.39Å; K106-L110 PolarHBondContact O-N 2.92Å; K106-L131 HydrophobicContact CB-CD1 4.06Å; K106-L131 HydrophobicContact CB-CD2 3.94Å; K106-L131 HydrophobicContact CD-CD2 3.67Å; K106-L131 HydrophobicContact CG-CD2 4.35Å
107A95.6Very high96.5Very high51 Ų5181.5 Ų81.542%0.42145%0.453SS..Hα-helixtrans-64.7-42.7176.500000112A103 S104 L110 S111A103-A107 PolarHBondContact O-N 3.12Å; S104-A107 WeakPolarHBondContact O-CB 3.41Å; S104-A107 PolarHBondContact O-N 2.99Å; A107-L110 PolarHBondContact O-N 3.4Å; A107-S111 WeakPolarHBondContact O-CB 3.36Å; A107-S111 PolarHBondContact O-N 3.35Å
108E97.1Very high96.3Very high105 Ų10585.8 Ų85.849%0.49147%0.469SS..Hα-helixtrans-62.9-50.3175-72.2172.2-122.400111.9S104 L110 S111 L112S104-E108 WeakPolarHBondContact O-CG 3.4Å; S104-E108 PolarHBondContact O-N 3.46Å; S104-E108 PolarHBondContact OG-OE1 3.45Å; E108-L110 VanDerWaalsContact C-N 3.27Å; E108-L110 PolarHBondContact O-N 3.1Å; E108-S111 WeakPolarHBondContact O-CB 3.19Å; E108-S111 PolarHBondContact O-N 3.03Å; E108-L112 WeakPolarHBondContact O-CG 3.35Å; E108-L112 PolarHBondContact O-N 3Å
109L97Very high96Very high92 Ų9283.4 Ų83.448%0.48246%0.458SS..Hα-helixtrans-56.8-43175.9177.766.7000111.3L105 L112 K113L105-L109 WeakPolarHBondContact O-CB 3.33Å; L105-L109 PolarHBondContact O-N 3.06Å; L109-L112 PolarHBondContact O-N 2.92Å; L109-K113 HydrophobicContact CG-CD 4.39Å; L109-K113 WeakPolarHBondContact O-CB 3.38Å; L109-K113 WeakPolarHBondContact O-CG 3.41Å; L109-K113 PolarHBondContact O-N 2.96Å
110L96.3Very high95.9Very high13 Ų1384.4 Ų84.47%0.06846%0.458CS..Hα-helixtrans-68.8-38.6179.9-176.663.2000111.6K106 A107 E108 K113 I114 Y124 E127 V128 L131K106-L110 WeakPolarHBondContact O-CB 3.39Å; K106-L110 PolarHBondContact O-N 2.92Å; A107-L110 PolarHBondContact O-N 3.4Å; E108-L110 VanDerWaalsContact C-N 3.27Å; E108-L110 PolarHBondContact O-N 3.1Å; L110-K113 PolarHBondContact O-N 2.87Å; L110-I114 PolarHBondContact O-N 3.32Å; L110-Y124 HydrophobicContact CD1-CD2 3.95Å; L110-Y124 HydrophobicContact CD2-CD2 3.74Å; L110-Y124 HydrophobicContact CD2-CE2 3.78Å; L110-Y124 HydrophobicContact CG-CD2 3.49Å; L110-Y124 VanDerWaalsContact CG-CD2 3.49Å; L110-Y124 HydrophobicContact CG-CE2 3.68Å; L110-E127 HydrophobicContact CD1-CB 4.08Å; L110-E127 HydrophobicContact CD1-CG 4.48Å; L110-E127 HydrophobicContact CD2-CB 3.69Å; L110-V128 HydrophobicContact CD2-CG2 3.72Å; L110-L131 HydrophobicContact CD2-CD1 4.23Å
111S95.3Very high95.7Very high38 Ų3881.6 Ų81.627%0.26646%0.455SS..Hα-helixtrans-59.9-45170.9-172.10000112A107 E108 I114 K115A107-S111 WeakPolarHBondContact O-CB 3.36Å; A107-S111 PolarHBondContact O-N 3.35Å; E108-S111 WeakPolarHBondContact O-CB 3.19Å; E108-S111 PolarHBondContact O-N 3.03Å; S111-I114 PolarHBondContact O-N 2.95Å; S111-K115 WeakPolarHBondContact O-CG 3.32Å; S111-K115 PolarHBondContact O-N 3.42Å; S111-K115 VanDerWaalsContact O-N 3.16Å
112L97.4Very high95.4Very high84 Ų8480.2 Ų80.244%0.4446%0.458SS..Hα-helixtrans-63.4-42.2175.6-68170.7000111.5E108 L109 I114 K115 F116E108-L112 WeakPolarHBondContact O-CG 3.35Å; E108-L112 PolarHBondContact O-N 3Å; L109-L112 PolarHBondContact O-N 2.92Å; L112-I114 VanDerWaalsContact C-N 3.32Å; L112-I114 PolarHBondContact O-N 3.37Å; L112-K115 PolarHBondContact O-N 2.82Å; L112-K115 VanDerWaalsContact O-N 3.07Å; L112-F116 HydrophobicContact CB-CD2 4.49Å; L112-F116 HydrophobicContact CD2-CE2 4.23Å; L112-F116 VanDerWaalsContact O-CD2 3.22Å; L112-F116 WeakPolarHBondContact O-CD2 3.3Å; L112-F116 PolarHBondContact O-N 3Å
113K96.3Very high95.2Very high81 Ų8178.1 Ų78.135%0.35245%0.451SS..Hα-helixtrans-58-39.2177-79.5174.7175.9-174.80113.1L109 L110 G117 L118 V119L109-K113 HydrophobicContact CG-CD 4.39Å; L109-K113 WeakPolarHBondContact O-CB 3.38Å; L109-K113 WeakPolarHBondContact O-CG 3.41Å; L109-K113 PolarHBondContact O-N 2.96Å; L110-K113 PolarHBondContact O-N 2.87Å; K113-G117 PolarHBondContact O-N 3.3Å; K113-L118 HydrophobicContact CB-CB 4.42Å; K113-L118 HydrophobicContact CG-CB 4.48Å; K113-L118 PolarHBondContact O-N 2.92Å; K113-V119 HydrophobicContact CB-CB 4.17Å; K113-V119 HydrophobicContact CB-CG2 3.79Å; K113-V119 HydrophobicContact CD-CG2 3.88Å; K113-V119 HydrophobicContact CG-CG2 4.24Å; K113-V119 PolarHBondContact O-N 3.49Å
114I95.8Very high95.1Very high62 Ų6279.1 Ų79.132%0.31844%0.444SS..Hα-helixtrans-64.5-50171.1-54.4159.8000110.6L110 S111 L112 F116 G117 Y124L110-I114 PolarHBondContact O-N 3.32Å; S111-I114 PolarHBondContact O-N 2.95Å; L112-I114 VanDerWaalsContact C-N 3.32Å; L112-I114 PolarHBondContact O-N 3.37Å; I114-F116 PolarHBondContact O-N 3.15Å; I114-F116 VanDerWaalsContact O-N 3.16Å; I114-G117 PolarHBondContact O-N 2.96Å; I114-Y124 HydrophobicContact CD1-CD1 3.8Å; I114-Y124 HydrophobicContact CD1-CD2 3.12Å; I114-Y124 HydrophobicContact CD1-CE1 3.88Å; I114-Y124 HydrophobicContact CD1-CE2 3.23Å; I114-Y124 HydrophobicContact CD1-CG 3.41Å; I114-Y124 VanDerWaalsContact CD1-CG 3.41Å; I114-Y124 HydrophobicContact CG1-CD2 3.52Å; I114-Y124 HydrophobicContact CG1-CE2 4.1Å; I114-Y124 HydrophobicContact CG1-CG 3.77Å
115K94.6Very high94.8Very high151 Ų15179.6 Ų79.666%0.65745%0.445SS*.Hα-helixtrans-58.3-31.7-173.5-73.1168.8-179.1172.50112.6S111 L112S111-K115 WeakPolarHBondContact O-CG 3.32Å; S111-K115 PolarHBondContact O-N 3.42Å; S111-K115 VanDerWaalsContact O-N 3.16Å; L112-K115 PolarHBondContact O-N 2.82Å; L112-K115 VanDerWaalsContact O-N 3.07Å
116F96.8Very high94.5Very high150 Ų15080.1 Ų80.166%0.65844%0.444SS*.THydrogen-bonded Turntrans-95.37.4175.3-65.5-66.7000114.5L112 I114 L118L112-F116 HydrophobicContact CB-CD2 4.49Å; L112-F116 HydrophobicContact CD2-CE2 4.23Å; L112-F116 VanDerWaalsContact O-CD2 3.22Å; L112-F116 WeakPolarHBondContact O-CD2 3.3Å; L112-F116 PolarHBondContact O-N 3Å; I114-F116 PolarHBondContact O-N 3.15Å; I114-F116 VanDerWaalsContact O-N 3.16Å; F116-L118 HydrophobicContact CB-CD1 4.28Å; F116-L118 HydrophobicContact CB-CG 4.09Å; F116-L118 PolarHBondContact O-N 3.24Å
117G93.8Very high94.2Very high64 Ų6480.5 Ų80.566%0.6645%0.448SS*.THydrogen-bonded Turntrans67.814.6178.500000115K113 I114 V119K113-G117 PolarHBondContact O-N 3.3Å; I114-G117 PolarHBondContact O-N 2.96Å; G117-V119 VanDerWaalsContact C-N 3.28Å; G117-V119 PolarHBondContact O-N 2.97Å
118L94.1Very high93.9Very high133 Ų13381 Ų8170%0.69645%0.445SS*.SBendtrans-75.9-16.7-178.7-61.9176.5000113K113 F116K113-L118 HydrophobicContact CB-CB 4.42Å; K113-L118 HydrophobicContact CG-CB 4.48Å; K113-L118 PolarHBondContact O-N 2.92Å; F116-L118 HydrophobicContact CB-CD1 4.28Å; F116-L118 HydrophobicContact CB-CG 4.09Å; F116-L118 PolarHBondContact O-N 3.24Å
119V93.3Very high93.6Very high35 Ų3582.5 Ų82.521%0.21245%0.452CS..SBendtrans-138.1137179.8174.40000109K113 G117 A123K113-V119 HydrophobicContact CB-CB 4.17Å; K113-V119 HydrophobicContact CB-CG2 3.79Å; K113-V119 HydrophobicContact CD-CG2 3.88Å; K113-V119 HydrophobicContact CG-CG2 4.24Å; K113-V119 PolarHBondContact O-N 3.49Å; G117-V119 VanDerWaalsContact C-N 3.28Å; G117-V119 PolarHBondContact O-N 2.97Å; V119-A123 HydrophobicContact CG1-CB 3.65Å
120S93.9Very high93.2Very high65 Ų6581.2 Ų81.246%0.45545%0.446SS..  trans-71155.4177.365.90000111.9S122 A123 Y124S120-S122 PolarHBondContact O-N 2.94Å; S120-S122 VanDerWaalsContact O-N 3.16Å; S120-S122 PolarHBondContact OG-OG 3.3Å; S120-A123 PolarHBondContact O-N 3.38Å; S120-A123 WeakPolarHBondContact OG-CB 3.12Å; S120-A123 PolarHBondContact OG-N 3.23Å; S120-Y124 PolarHBondContact O-N 3.36Å
121S92.1Very high92.6Very high91 Ų9183.2 Ų83.264%0.63646%0.456SS*.Hα-helixtrans-61.3-25.4179.1-172.90000113.6T125S121-T125 PolarHBondContact O-N 3.33Å; S121-T125 PolarHBondContact O-OG1 3.29Å
122S91.9Very high91.9Very high85 Ų8586.7 Ų86.759%0.59448%0.48SS*.Hα-helixtrans-77.4-40.4174.952.10000113.1S120 Y124 T125 Q126S120-S122 PolarHBondContact O-N 2.94Å; S120-S122 VanDerWaalsContact O-N 3.16Å; S120-S122 PolarHBondContact OG-OG 3.3Å; S122-Y124 VanDerWaalsContact C-N 3.3Å; S122-T125 PolarHBondContact O-N 2.92Å; S122-T125 PolarHBondContact O-OG1 3.2Å; S122-T125 VanDerWaalsContact O-OG1 3.06Å; S122-Q126 PolarHBondContact O-N 3.39Å
123A91.9Very high90.9Very high33 Ų3386.8 Ų86.827%0.27349%0.488SS..Hα-helixtrans-67.4-35.1174.100000111V119 S120 Q126 E127V119-A123 HydrophobicContact CG1-CB 3.65Å; S120-A123 PolarHBondContact O-N 3.38Å; S120-A123 WeakPolarHBondContact OG-CB 3.12Å; S120-A123 PolarHBondContact OG-N 3.23Å; A123-Q126 PolarHBondContact O-N 3.45Å; A123-E127 VanDerWaalsContact O-CG 3.32Å; A123-E127 WeakPolarHBondContact O-CG 3.35Å; A123-E127 PolarHBondContact O-N 2.92Å
124Y92.9Very high89.5Confident73 Ų7387.9 Ų87.929%0.28650%0.497SS..Hα-helixtrans-55.8-53.1172.6171.4-106.6000113.2L110 I114 S120 S122 Q126 E127 V128L110-Y124 HydrophobicContact CD1-CD2 3.95Å; L110-Y124 HydrophobicContact CD2-CD2 3.74Å; L110-Y124 HydrophobicContact CD2-CE2 3.78Å; L110-Y124 HydrophobicContact CG-CD2 3.49Å; L110-Y124 VanDerWaalsContact CG-CD2 3.49Å; L110-Y124 HydrophobicContact CG-CE2 3.68Å; I114-Y124 HydrophobicContact CD1-CD1 3.8Å; I114-Y124 HydrophobicContact CD1-CD2 3.12Å; I114-Y124 HydrophobicContact CD1-CE1 3.88Å; I114-Y124 HydrophobicContact CD1-CE2 3.23Å; I114-Y124 HydrophobicContact CD1-CG 3.41Å; I114-Y124 VanDerWaalsContact CD1-CG 3.41Å; I114-Y124 HydrophobicContact CG1-CD2 3.52Å; I114-Y124 HydrophobicContact CG1-CE2 4.1Å; I114-Y124 HydrophobicContact CG1-CG 3.77Å; S120-Y124 PolarHBondContact O-N 3.36Å; S122-Y124 VanDerWaalsContact C-N 3.3Å; Y124-Q126 VanDerWaalsContact C-N 3.29Å; Y124-Q126 PolarHBondContact O-N 2.99Å; Y124-E127 PolarHBondContact O-N 3Å; Y124-V128 HydrophobicContact CD1-CG2 4.43Å; Y124-V128 HydrophobicContact CD2-CG2 4.1Å; Y124-V128 HydrophobicContact CE1-CG2 3.93Å; Y124-V128 HydrophobicContact CE2-CG2 3.54Å; Y124-V128 VanDerWaalsContact CZ-CG2 3.47Å; Y124-V128 WeakPolarHBondContact O-CG2 3.3Å; Y124-V128 PolarHBondContact O-N 3.48Å
125T90.6Very high87.6Confident71 Ų7190.4 Ų90.444%0.43652%0.518SS..Hα-helixtrans-66.3-34.7-175.949.90000111.9S121 S122 Q129S121-T125 PolarHBondContact O-N 3.33Å; S121-T125 PolarHBondContact O-OG1 3.29Å; S122-T125 PolarHBondContact O-N 2.92Å; S122-T125 PolarHBondContact O-OG1 3.2Å; S122-T125 VanDerWaalsContact O-OG1 3.06Å; T125-Q129 WeakPolarHBondContact O-CG 3.34Å; T125-Q129 PolarHBondContact O-N 3.14Å; T125-Q129 VanDerWaalsContact O-N 3.09Å
126Q92.6Very high85.6Confident121 Ų12187.6 Ų87.657%0.56551%0.513SS*.Hα-helixtrans-62.3-46.2172.1-171.5172.325.100111.6S122 A123 Y124 V128 Q129 N130S122-Q126 PolarHBondContact O-N 3.39Å; A123-Q126 PolarHBondContact O-N 3.45Å; Y124-Q126 VanDerWaalsContact C-N 3.29Å; Y124-Q126 PolarHBondContact O-N 2.99Å; Q126-V128 PolarHBondContact O-N 3.26Å; Q126-Q129 WeakPolarHBondContact O-CB 3.42Å; Q126-Q129 PolarHBondContact O-N 2.71Å; Q126-N130 PolarHBondContact O-N 3.12Å; Q126-N130 PolarHBondContact O-ND2 3.19Å; Q126-N130 PolarHBondContact O-OD1 2.92Å
127E89.5Confident83.6Confident93 Ų9386.3 Ų86.344%0.43551%0.512SS..Hα-helixtrans-67.2-37.1179-66.8-73.4-151.600112.7L110 A123 Y124 Q129 N130 L131L110-E127 HydrophobicContact CD1-CB 4.08Å; L110-E127 HydrophobicContact CD1-CG 4.48Å; L110-E127 HydrophobicContact CD2-CB 3.69Å; A123-E127 VanDerWaalsContact O-CG 3.32Å; A123-E127 WeakPolarHBondContact O-CG 3.35Å; A123-E127 PolarHBondContact O-N 2.92Å; Y124-E127 PolarHBondContact O-N 3Å; E127-Q129 VanDerWaalsContact C-N 3.33Å; E127-Q129 PolarHBondContact O-N 3.37Å; E127-N130 WeakPolarHBondContact O-CB 3.32Å; E127-N130 PolarHBondContact O-N 2.87Å; E127-N130 PolarHBondContact OE2-ND2 3.36Å; E127-L131 VanDerWaalsContact O-CG 3.26Å; E127-L131 WeakPolarHBondContact O-CG 3.47Å; E127-L131 PolarHBondContact O-N 3.06Å
128V89.7Confident81.3Confident60 Ų6090 Ų9036%0.36452%0.517SS..Hα-helixtrans-61.8-40.8172.5173.90000111.6L110 Y124 Q126 L131 S132L110-V128 HydrophobicContact CD2-CG2 3.72Å; Y124-V128 HydrophobicContact CD1-CG2 4.43Å; Y124-V128 HydrophobicContact CD2-CG2 4.1Å; Y124-V128 HydrophobicContact CE1-CG2 3.93Å; Y124-V128 HydrophobicContact CE2-CG2 3.54Å; Y124-V128 VanDerWaalsContact CZ-CG2 3.47Å; Y124-V128 WeakPolarHBondContact O-CG2 3.3Å; Y124-V128 PolarHBondContact O-N 3.48Å; Q126-V128 PolarHBondContact O-N 3.26Å; V128-L131 PolarHBondContact O-N 2.57Å; V128-S132 PolarHBondContact O-N 3.38Å
129Q89.8Confident79Confident137 Ų13788.8 Ų88.864%0.6452%0.519SS*.Hα-helixtrans-64.1-43.1174.3-73.6176.5-1.800111.7T125 Q126 E127 L131 S132 S133T125-Q129 WeakPolarHBondContact O-CG 3.34Å; T125-Q129 PolarHBondContact O-N 3.14Å; T125-Q129 VanDerWaalsContact O-N 3.09Å; Q126-Q129 WeakPolarHBondContact O-CB 3.42Å; Q126-Q129 PolarHBondContact O-N 2.71Å; E127-Q129 VanDerWaalsContact C-N 3.33Å; E127-Q129 PolarHBondContact O-N 3.37Å; Q129-L131 PolarHBondContact O-N 2.77Å; Q129-S132 PolarHBondContact O-N 2.92Å; Q129-S133 WeakPolarHBondContact O-CB 3.29Å; Q129-S133 PolarHBondContact O-N 3.21Å; Q129-S133 VanDerWaalsContact O-N 3.09Å; Q129-S133 PolarHBondContact O-OG 2.99Å
130N88Confident76.8Confident65 Ų6594.5 Ų94.535%0.34854%0.543SS..Hα-helixtrans-55.7-52.4174.5-65.2-23.1000110.6Q126 E127 S132 S133 L134Q126-N130 PolarHBondContact O-N 3.12Å; Q126-N130 PolarHBondContact O-ND2 3.19Å; Q126-N130 PolarHBondContact O-OD1 2.92Å; E127-N130 WeakPolarHBondContact O-CB 3.32Å; E127-N130 PolarHBondContact O-N 2.87Å; E127-N130 PolarHBondContact OE2-ND2 3.36Å; N130-S132 VanDerWaalsContact C-N 3.29Å; N130-S132 PolarHBondContact O-N 2.89Å; N130-S133 WeakPolarHBondContact CA-OG 3.34Å; N130-S133 PolarHBondContact O-N 2.99Å; N130-S133 PolarHBondContact O-OG 2.99Å; N130-L134 VanDerWaalsContact O-CD1 3.25Å; N130-L134 WeakPolarHBondContact O-CD1 3.43Å; N130-L134 PolarHBondContact O-N 3.13Å
131L85.3Confident74.5Confident56 Ų5699.3 Ų99.329%0.29356%0.558SS.*Hα-helixtrans-58.6-37.9179.4-66.1175000113K106 L110 E127 V128 Q129 S133K106-L131 HydrophobicContact CB-CD1 4.06Å; K106-L131 HydrophobicContact CB-CD2 3.94Å; K106-L131 HydrophobicContact CD-CD2 3.67Å; K106-L131 HydrophobicContact CG-CD2 4.35Å; L110-L131 HydrophobicContact CD2-CD1 4.23Å; E127-L131 VanDerWaalsContact O-CG 3.26Å; E127-L131 WeakPolarHBondContact O-CG 3.47Å; E127-L131 PolarHBondContact O-N 3.06Å; V128-L131 PolarHBondContact O-N 2.57Å; Q129-L131 PolarHBondContact O-N 2.77Å; L131-S133 VanDerWaalsContact C-N 3.27Å; L131-S133 PolarHBondContact O-N 3.49Å
132S80Confident71.7Confident110 Ų110103.9 Ų103.977%0.76957%0.57SS**Hα-helixtrans-72.9-16.7175.9-173.80000114.1V128 Q129 N130V128-S132 PolarHBondContact O-N 3.38Å; Q129-S132 PolarHBondContact O-N 2.92Å; N130-S132 VanDerWaalsContact C-N 3.29Å; N130-S132 PolarHBondContact O-N 2.89Å
133S75.6Confident69.3Low87 Ų87107.6 Ų107.661%0.60858%0.582SS**Hα-helixtrans-105.3-4.1-175.870.50000114.3Q129 N130 L131Q129-S133 WeakPolarHBondContact O-CB 3.29Å; Q129-S133 PolarHBondContact O-N 3.21Å; Q129-S133 VanDerWaalsContact O-N 3.09Å; Q129-S133 PolarHBondContact O-OG 2.99Å; N130-S133 WeakPolarHBondContact CA-OG 3.34Å; N130-S133 PolarHBondContact O-N 2.99Å; N130-S133 PolarHBondContact O-OG 2.99Å; L131-S133 VanDerWaalsContact C-N 3.27Å; L131-S133 PolarHBondContact O-N 3.49Å
134L67Low66.5Low104 Ų104113.8 Ų113.855%0.54561%0.609SS.*SBendtrans-59.1126.8177.7-107.375.5000109.4N130 T136N130-L134 VanDerWaalsContact O-CD1 3.25Å; N130-L134 WeakPolarHBondContact O-CD1 3.43Å; N130-L134 PolarHBondContact O-N 3.13Å; L134-T136 PolarHBondContact O-N 3.39Å; L134-T136 VanDerWaalsContact O-N 3.14Å
135P55.6Low63.6Low114 Ų114115.3 Ų115.374%0.7463%0.63SS**PPolyproline II helixtrans-67.2118.6-178.426.4-33.1000109.7I137P135-I137 PolarHBondContact O-N 3.32Å
136T54.3Low61Low92 Ų92117.5 Ų117.556%0.56465%0.646SS**PPolyproline II helixtrans-50.8130.4159.7-52.60000107.9M96 L134 N138M96-T136 HydrophobicContact CE-CG2 4.34Å; M96-T136 HydrophobicContact SD-CG2 4.43Å; L134-T136 PolarHBondContact O-N 3.39Å; L134-T136 VanDerWaalsContact O-N 3.14Å; T136-N138 PolarHBondContact O-N 2.85Å
137I53.1Low58Low123 Ų123117.8 Ų117.863%0.63166%0.656SS**  trans-77.171-171.2-43.9171.7000109.4L95 P135 S139L95-I137 HydrophobicContact CD2-CD1 4.43Å; P135-I137 PolarHBondContact O-N 3.32Å; I137-S139 VanDerWaalsContact C-N 3.26Å; I137-S139 PolarHBondContact O-N 3.3Å
138N46Very low55.4Low142 Ų142117.3 Ų117.376%0.75967%0.668SS**  trans-71.680.7174.5-83.16.9000109.7T136 H140T136-N138 PolarHBondContact O-N 2.85Å; N138-H140 VanDerWaalsContact C-N 3.3Å; N138-H140 PolarHBondContact O-N 3.01Å
139S46.5Very low52.8Low107 Ų107121.8 Ų121.875%0.74870%0.695SS**  trans-9447.7173.760.60000112.8I137I137-S139 VanDerWaalsContact C-N 3.26Å; I137-S139 PolarHBondContact O-N 3.3Å
140H47.1Very low50.2Low156 Ų156124.1 Ų124.172%0.72271%0.706SS**SBendtrans-157.1155.2151.7-143.6-89.7000108.6N138N138-H140 VanDerWaalsContact C-N 3.3Å; N138-H140 PolarHBondContact O-N 3.01Å
141E45.2Very low47.6Very low165 Ų165126 Ų12677%0.77172%0.724SS**  trans7561.2-172.3-51.4-51.9116.600116.5
142E32.7Very low45.1Very low188 Ų188129.5 Ų129.588%0.87974%0.743SS**  trans-121.194.8145.5-171.4-177.1-176.300109.8
143L41.9Very low42.8Very low162 Ų162133 Ų13385%0.84874%0.744SS**  trans174.880.3143.8-98156.1000111.4
144I33.4Very low40.7Very low164 Ų164138 Ų13884%0.84176%0.758SS**  trans-160.7119.5130.3-86.6135.1000106.3
145S30.9Very low39.1Very low104 Ų104143.5 Ų143.573%0.72777%0.772SS**  trans-105.7128.3170.3-178.90000109.2
146P37.7Very low37.8Very low118 Ų118145.5 Ų145.577%0.76678%0.776SS**  trans-107.996.8159.633.2-23000109.8
147T29.7Very low36.9Very low126 Ų126148.8 Ų148.877%0.77379%0.789SS**  trans-68.6142.5164.6-70.70000110.2
148A34Very low35.9Very low84 Ų84148.8 Ų148.869%0.69480%0.795SS**  trans68.382.4165.900000118.4
149V34.2Very low35.2Very low153 Ų153149.7 Ų149.793%0.92779%0.794SS**  -134.3103.2124.5-113.60000108.8
150Q36.4Very low34.6Very low186 Ų186151.2 Ų151.287%0.86980%0.799SS**  trans-78.8155.2168.3-73.6-179-7.700110
151S33.1Very low34.1Very low104 Ų104151.2 Ų151.273%0.72780%0.799SS**  trans64.793.6156.9179.40000117
152L33.2Very low33.8Very low131 Ų131149.8 Ų149.869%0.68680%0.796SS**  -160.3140.4110.4-128.555.1000113.1
153F31.1Very low33.8Very low183 Ų183146.3 Ų146.380%0.80379%0.792SS**  trans62.790164.5-51.7-53.4000119.9
154Q31.6Very low33.7Very low192 Ų192148 Ų14890%0.89779%0.793SS**  trans-107.9119.1142.8-170.9169.420.300108.7
155R33.6Very low34Very low220 Ų220146.2 Ų146.283%0.8380%0.795SS**  trans132.9118.5-179.1-82164.1-168.4175.14.2106.7
156D28.3Very low34.4Very low156 Ų156147 Ų14783%0.83480%0.799SS**  cis-154.5-179.938.5-96.6-34.5000114.3
157L34.4Very low34.6Very low160 Ų160146.4 Ų146.484%0.83880%0.804SS**  trans-70170.2-178.4-167.866.9000113.9
158V32.4Very low35Very low124 Ų124146.2 Ų146.275%0.75281%0.807SS**  trans97.1116.7158.5-1540000118.8
159H32.6Very low35.2Very low161 Ų161146.8 Ų146.875%0.74581%0.812SS**  trans-47.7121.3163.4169.3-66.3000115.9
160V32.3Very low35.7Very low139 Ų139147.6 Ų147.684%0.84281%0.81SS**  trans-142138.91521760000110
161E36.5Very low36Very low156 Ų156147.2 Ų147.273%0.72981%0.805SS**  trans-89.7168-176.9-164.6179.7172.400112.4
162L39.3Very low36.4Very low135 Ų135150.6 Ų150.671%0.70781%0.809SS**  trans75.299.3153.9-155.779.6000118.9
163S33Very low36.7Very low114 Ų114152.4 Ų152.480%0.79782%0.818SS**  -174.8138.6108.6-85.50000116.1
164K40.6Very low37.4Very low199 Ų199149.1 Ų149.187%0.86582%0.816SS**  trans-54.5145.5177.9-55.5151.1-177.1174.40113.8
165S39.8Very low37.4Very low126 Ų126147.8 Ų147.888%0.88181%0.814SS**  trans-150.6150.4132.8-162.40000110.8
166C37.9Very low38Very low120 Ų120144.4 Ų144.481%0.81181%0.809SS**  trans-116.8143.7-161.448.50000113.1
167A41.7Very low38.8Very low105 Ų105142.6 Ų142.687%0.86881%0.806SS**  trans-146.4122.1162.800000109.5
168S39.8Very low38.7Very low122 Ų122142 Ų14285%0.85380%0.799SS**  trans-84.2151.4-172.4-53.10000112.8
169A37.3Very low38.9Very low96 Ų96142.8 Ų142.879%0.79380%0.804SS**  157.583120.900000114.3
170I43.8Very low38.6Very low171 Ų171144.5 Ų144.588%0.87780%0.804SS**  trans-133.8121.4149.7-57.3-178.1000107.6
171K43.9Very low38.7Very low177 Ų177142.7 Ų142.777%0.7780%0.804SS**  trans-89.3144.9178.1-63.5179.2178.6177.70109.9
172H41.8Very low38.5Very low176 Ų176140.2 Ų140.282%0.81581%0.81SS**  trans7185.1171.7-47-72000116.7
173L38.5Very low38.3Very low168 Ų168139.5 Ų139.588%0.8882%0.817SS**  trans-132123.2148.7-150.873.2000107.7L175L173-L175 PolarHBondContact O-N 3.4Å
174P46.2Very low38.6Very low115 Ų115143.3 Ų143.375%0.74782%0.822SS**  trans-78.1113.9-17729.7-32.1000110.5
175L31.9Very low38.2Very low164 Ų164138.1 Ų138.186%0.85982%0.816SS**PPolyproline II helixtrans-75.4124.9170.3-165.274.7000108.9L173L173-L175 PolarHBondContact O-N 3.4Å
176M46Very low37.9Very low148 Ų148137.5 Ų137.573%0.72981%0.812SS**PPolyproline II helixtrans-78.6140.9166.8-74.1-70.3102.100109.5
177P45.4Very low37.8Very low118 Ų118140.7 Ų140.777%0.76681%0.812SS**PPolyproline II helixtrans-67.8140.8-178.627.3-33.6000111.9
178E32Very low37.5Very low147 Ų147140.1 Ų140.169%0.68780%0.798SS**PPolyproline II helixtrans-93.8118.7-170.6-176.1169.9-141.800110.5W180E178-W180 PolarHBondContact OE1-NE1 2.83Å
179T35.7Very low37.3Very low141 Ų141139.3 Ų139.387%0.86579%0.788SS**  trans-135.682.2168.858.70000110.5
180W27.1Very low37Very low197 Ų197143.5 Ų143.575%0.74678%0.784SS**  trans-100.5103.8160.640.5-94.6000109.3E178E178-W180 PolarHBondContact OE1-NE1 2.83Å
181A34.3Very low36.3Very low102 Ų102144.7 Ų144.784%0.84378%0.783SS**  trans-94118.3160.200000107.4
182A33.3Very low35.7Very low103 Ų103143 Ų14385%0.85179%0.788SS**  trans-75.1126.9177.600000110.5
183S35.1Very low35.4Very low121 Ų121138.8 Ų138.885%0.84678%0.783SS**  trans-147.4138156.9-164.20000110.6
184Q38Very low35Very low193 Ų193137.7 Ų137.790%0.90278%0.778SS**  trans-86.3125.8-179.9-56.9167.320.900109.2
185A33.1Very low34.2Very low90 Ų90141.8 Ų141.874%0.74479%0.785SS**  trans-165.9114.2154.900000112.6
186S34Very low34.2Very low114 Ų114142.6 Ų142.680%0.79778%0.781SS**  41.6113.7128.9-49.70000120.7T188S186-T188 PolarHBondContact O-N 2.93Å
187F34Very low33.3Very low186 Ų186144.3 Ų144.382%0.81679%0.788SS**  trans-48.2123.5156.2172.7-88.8000113.3V189F187-V189 HydrophobicContact CE1-CG2 4.25Å; F187-V189 HydrophobicContact CE2-CG2 3.93Å; F187-V189 HydrophobicContact CZ-CG2 3.69Å
188T37Very low32.4Very low94 Ų94146.2 Ų146.258%0.57779%0.786SS**  trans-144.5139.1153.851.10000111.5S186 Y190S186-T188 PolarHBondContact O-N 2.93Å; T188-Y190 WeakPolarHBondContact CB-OH 3.4Å; T188-Y190 HydrophobicContact CG2-CE2 4.48Å; T188-Y190 WeakPolarHBondContact CG2-OH 3.45Å; T188-Y190 WeakPolarHBondContact OG1-CE2 3.44Å
189V35.9Very low32.9Very low104 Ų104145 Ų14563%0.6379%0.791SS**  trans-109.9122.8-177.4170.60000110F187F187-V189 HydrophobicContact CE1-CG2 4.25Å; F187-V189 HydrophobicContact CE2-CG2 3.93Å; F187-V189 HydrophobicContact CZ-CG2 3.69Å
190Y30.5Very low32.7Very low185 Ų185146.3 Ų146.373%0.72579%0.787SS**  trans-145.2111.6164.3-36.7-79000105.8T188T188-Y190 WeakPolarHBondContact CB-OH 3.4Å; T188-Y190 HydrophobicContact CG2-CE2 4.48Å; T188-Y190 WeakPolarHBondContact CG2-OH 3.45Å; T188-Y190 WeakPolarHBondContact OG1-CE2 3.44Å
191K29.3Very low32.9Very low196 Ų196144.7 Ų144.785%0.85279%0.788SS**  48.785.769.5-161.3173.9-176.2178.50113.1
192T30.9Very low32.7Very low142 Ų142145.9 Ų145.987%0.87178%0.78SS**  trans-83.7144.1160.629.50000110.7
193A34.9Very low32.3Very low87 Ų87145.7 Ų145.772%0.71977%0.773SS**  trans-129.8157.5166.100000108.3
194D31.3Very low31.9Very low145 Ų145144.6 Ų144.678%0.77576%0.761SS**  trans-62.7153.6-168.7-50-93.6000114.6
195F27.6Very low31.5Very low200 Ų200145.6 Ų145.688%0.87776%0.757SS**  -172.7153.5100-114-94.5000114.2
196K32.4Very low31.4Very low181 Ų181148.5 Ų148.579%0.78776%0.755SS**  trans-57.6154.1170.7-88.2171.9164.3-178.20113.5
197E27.6Very low31.1Very low185 Ų185148.9 Ų148.986%0.86475%0.753SS**  -175156.686.8-136.5160.1-155.800114
198E26.6Very low30.9Very low157 Ų157144.5 Ų144.573%0.73475%0.75SS**  trans-92158.2169-84.8-76.6155.700109.2
199P43.3Very low30.6Very low121 Ų121151.8 Ų151.879%0.78677%0.767SS**  -148.215998.637.1-20.1000116.7
200E31Very low30.4Very low169 Ų169152.6 Ų152.679%0.7978%0.777SS**  trans-68.1152.5168.2-62.3-147.1-165.600113.8
201E30.9Very low30.5Very low164 Ų164149.4 Ų149.477%0.76678%0.782SS**  176.8134.6111.4-100.3-169-165.900115.7
202N29.5Very low30.9Very low127 Ų127145 Ų14568%0.67978%0.777SS**  trans52130.6142.871.347.6000127.3
203S24.9Very low30.9Very low99 Ų99145.4 Ų145.469%0.69277%0.773SS**  trans84104.1132.7-148.30000125.2
204T27.5Very low31Very low97 Ų97146.7 Ų146.760%0.59578%0.777SS**  45.5110.5119.8-220000122.5
205W29.9Very low31.7Very low215 Ų215146.1 Ų146.181%0.81478%0.781SS**  168.1126106.8-85.5122.8000115.5
206Q31.3Very low32.5Very low151 Ų151147.2 Ų147.271%0.70678%0.78SS**  trans57.8122.3139-83.2-174.370.700126.6
207T27.6Very low32.3Very low122 Ų122145.7 Ų145.775%0.74878%0.78SS**  77.7104.5118.8-52.90000123.1
208A28.3Very low32.9Very low93 Ų93140.7 Ų140.777%0.76977%0.766SS**  170.2148.9129.800000108.7
209R31.4Very low33.4Very low248 Ų248140.2 Ų140.294%0.93677%0.768SS**  cis-160.21634.6-135.1168.5160.2175.9-7.5109.5
210S30.9Very low33.2Very low120 Ų120142.2 Ų142.284%0.83977%0.767SS**  trans-96.6156.8-164.4-35.80000118
211S34.5Very low33.4Very low118 Ų118140.1 Ų140.183%0.82576%0.761SS**  trans-162.9107.8135.656.80000109.6
212S36.7Very low33.8Very low105 Ų105137.2 Ų137.273%0.73476%0.759SS**  81.589.966.1-153.70000115.4
213N31.8Very low34.2Very low149 Ų149137.8 Ų137.880%0.79776%0.761SS**  162.6125.4118.4-83.55.8000113.4
214S35.9Very low34.7Very low115 Ų115139.2 Ų139.280%0.80477%0.77SS**  trans-101.9173.3156.7-55.70000109.9
215P46.1Very low35.4Very low133 Ų133143.5 Ų143.586%0.86478%0.78SS**  -141.5166108.136.2-22.6000116.3
216R43.5Very low36.3Very low223 Ų223138 Ų13884%0.84278%0.78SS**  trans-85.5156.4176.8-69.9161.8124.5-167.6-0.4113
217N29.7Very low37.1Very low149 Ų149136.8 Ų136.880%0.79779%0.789SS**  -166.7142.8113.249.16.4000108
218S39.4Very low38.2Very low80 Ų80137.5 Ų137.556%0.55979%0.788SS**  cis98.3137.629.2-69.40000113.7
219D37.3Very low39.2Very low146 Ų146136.3 Ų136.378%0.78178%0.784SS**  trans87.3138.5164.4-45.6-23.4000117.2
220E39.6Very low39.7Very low163 Ų163132.2 Ų132.276%0.76278%0.776SS**  cis-164.1159.8-9.5-116.8-64.590.100111.4
221N34.8Very low40.4Very low126 Ų126132.5 Ų132.567%0.67477%0.768SS**  trans58.5111.2146-166.636.9000122.9
222S40Very low41.4Very low102 Ų102134.6 Ų134.671%0.71377%0.765SS**  168.9118.797.648.10000117.3
223L37.2Very low41.9Very low139 Ų139137.7 Ų137.773%0.72877%0.768SS**  trans48114.2138.1-16065.8000121.9K225L223-K225 HydrophobicContact CD1-CG 4.26Å
224C36.3Very low42.1Very low130 Ų130138.2 Ų138.288%0.87877%0.765SS**  -158.5150.4111.3-1100000112.9
225K40.7Very low42.5Very low186 Ų186139.2 Ų139.281%0.80977%0.766SS**  trans-92.5138.2-164-64.5176.5178.8179.40114.2L223L223-K225 HydrophobicContact CD1-CG 4.26Å
226A48.5Very low42.7Very low100 Ų100137.2 Ų137.283%0.82675%0.753SS**  trans9.8140.713300000121.4
227S50.1Low42.6Very low125 Ų125136.3 Ų136.387%0.87476%0.755SS**  -147.8137.8126.7-1670000110.3
228D49.6Very low42.6Very low138 Ų138132.6 Ų132.674%0.73875%0.752SS**  trans-98.4167.6178.5-174.917.8000110.5
229G48.7Very low42.5Very low67 Ų67137 Ų13769%0.69177%0.769SS**  trans168.764.6-177.300000116.1
230E42.5Very low42.8Very low163 Ų163136.7 Ų136.776%0.76277%0.771SS**  trans-11.7151.1133.5-46-67.689.200114
231D46.3Very low43.1Very low126 Ų126134.2 Ų134.267%0.67477%0.77SS**  cis178.6172.13167.332.6000103.6
232E54.6Low43.1Very low161 Ų161133.6 Ų133.675%0.75278%0.775SS**  trans160.880.9149.2-91-79.4124.400108.4
233Q47.8Very low43.1Very low170 Ų170135.2 Ų135.279%0.79478%0.78SS**  trans-69.1128.9172.8178.6169.268.200111.8
234Q36.3Very low43Very low161 Ų161132.9 Ų132.975%0.75278%0.781SS**  trans-161.7113156.6-109144.399.900114.9
235V42.9Very low43.4Very low136 Ų136133.2 Ų133.282%0.82477%0.774SS**  trans-135.5128.6156.6174.20000107
236P52Low43.5Very low90 Ų90132.7 Ų132.758%0.58478%0.775SS**  trans-146.8126.4133.724.8-3.4000116.7
237K40.5Very low43.6Very low205 Ų205138.7 Ų138.789%0.89178%0.776SS**  trans73.9132.5132.6-55.8159.5-163.1166.10119.4
238G30.6Very low43.2Very low70 Ų70138 Ų13872%0.72277%0.771SS**  trans173.962.6167.500000119.5
239L35.7Very low43Very low174 Ų174137.1 Ų137.191%0.91177%0.77SS**  trans57.6127.9145.3-63.2160.6000122.3
240V44.1Very low42.9Very low138 Ų138141.5 Ų141.584%0.83678%0.776SS**  trans-113.8138.6151.1-146.80000106.8
241P45.4Very low42.7Very low112 Ų112139 Ų13973%0.72777%0.772SS**  -138.8-167.59242.2-26.8000110.9
242S35Very low42.5Very low112 Ų112138.1 Ų138.178%0.78378%0.776SS**  cis-155.1-174.710.5-153.70000113.7
243V39.5Very low42.3Very low137 Ų137136.2 Ų136.283%0.8378%0.775SS**  trans-58.3137.8174.9170.90000115.8
244A36.9Very low42.2Very low90 Ų90135.3 Ų135.374%0.74477%0.771SS**  trans-162127136.200000111.7
245D43.7Very low43.2Very low136 Ų136136.8 Ų136.873%0.72777%0.774SS**  trans-76.4133.2173.717522.6000111.1
246Q42.3Very low43.4Very low176 Ų176135.7 Ų135.782%0.82277%0.768SS**  trans-141.798.7162.9-69.9-1651700111.7S248Q246-S248 PolarHBondContact O-N 3.08Å; Q246-S248 VanDerWaalsContact O-N 3.08Å
247R51Low43.2Very low226 Ų226136.5 Ų136.585%0.85377%0.773SS**  trans-51.1108.9158.6-72.5175.4164.6-172-4.9110.9
248S42.3Very low43.3Very low110 Ų110133.6 Ų133.677%0.76977%0.767SS**  trans-99.5101.1164.151.90000110.3Q246 I250Q246-S248 PolarHBondContact O-N 3.08Å; Q246-S248 VanDerWaalsContact O-N 3.08Å; S248-I250 PolarHBondContact O-N 3.06Å
249V45.6Very low44.3Very low120 Ų120137.6 Ų137.673%0.72778%0.777SS**  trans-75.4111.1173.7176.30000108.4V251V249-V251 HydrophobicContact CG1-CG2 4.36Å; V249-V251 PolarHBondContact O-N 3.14Å
250I46.2Very low45.1Very low158 Ų158134.2 Ų134.281%0.8177%0.768SS**  trans-74.996.2174.8-57.6177.9000108.7S248 S252S248-I250 PolarHBondContact O-N 3.06Å; I250-S252 PolarHBondContact O-N 2.96Å; I250-S252 VanDerWaalsContact O-N 3.09Å
251V39.2Very low45.2Very low112 Ų112132.9 Ų132.968%0.67977%0.765SS**  trans-71.299.9170.1178.60000108.8V249 T253V249-V251 HydrophobicContact CG1-CG2 4.36Å; V249-V251 PolarHBondContact O-N 3.14Å; V251-T253 HydrophobicContact CG1-CG2 4.32Å; V251-T253 PolarHBondContact O-N 2.87Å; V251-T253 VanDerWaalsContact O-N 3.08Å
252S41.1Very low45.7Very low107 Ų107133.4 Ų133.475%0.74877%0.771SS**  trans-70.2100.9171.3-173.30000109.8I250 H254I250-S252 PolarHBondContact O-N 2.96Å; I250-S252 VanDerWaalsContact O-N 3.09Å; S252-H254 PolarHBondContact O-N 3.27Å
253T50.5Low47Very low121 Ų121132.1 Ų132.174%0.74277%0.768SS**  trans-77.290.6171.6450000109.6V251 K255V251-T253 HydrophobicContact CG1-CG2 4.32Å; V251-T253 PolarHBondContact O-N 2.87Å; V251-T253 VanDerWaalsContact O-N 3.08Å; T253-K255 PolarHBondContact O-N 3.36Å
254H45.1Very low48.1Very low151 Ų151131 Ų13170%0.69976%0.756SS**  trans-64.294177179.9-89.2000111.3S252 V256S252-H254 PolarHBondContact O-N 3.27Å; H254-V256 PolarHBondContact O-N 2.87Å
255K56.9Low49.7Very low191 Ų191130.7 Ų130.783%0.8375%0.747SS**  trans-75113.8164.8-80.9-159.3170.8-163.60109.7T253 P257T253-K255 PolarHBondContact O-N 3.36Å; K255-P257 WeakPolarHBondContact O-CD 3.46Å
256V48.1Very low50.4Low114 Ų114130.9 Ų130.969%0.69174%0.743SS**PPolyproline II helixtrans-64.5125169.5-176.70000108.9H254H254-V256 PolarHBondContact O-N 2.87Å
257P47.8Very low51.4Low106 Ų106132.1 Ų132.169%0.68875%0.746SS**PPolyproline II helixtrans-78.9139.8171.3-11.929.1000111.4K255K255-P257 WeakPolarHBondContact O-CD 3.46Å
258D43.2Very low51.9Low145 Ų145126.4 Ų126.478%0.77573%0.732SS**PPolyproline II helixtrans-62.2151179.7-75.2-58.5000114.1S260D258-S260 PolarHBondContact O-N 2.78Å
259V51.3Low53.4Low153 Ų153128.6 Ų128.693%0.92772%0.723SS**SBendtrans-75.664.6-178.5-171.10000111.4
260S51.4Low54.4Low104 Ų104130.3 Ų130.373%0.72773%0.726SS**  trans-171.964.6162.541.60000112.3D258D258-S260 PolarHBondContact O-N 2.78Å
261S46.8Very low55.3Low109 Ų109129.1 Ų129.176%0.76272%0.715SS**  trans-138.146172.5-80.30000114.1A263S261-A263 PolarHBondContact O-N 2.83Å
262S57Low56.4Low123 Ų123129.1 Ų129.186%0.8672%0.721SS**  trans-76.466.4157.4-170.10000110.2
263A61.8Low57.3Low86 Ų86134.7 Ų134.771%0.71173%0.725SS**  trans-108.378.8172.200000108.7S261S261-A263 PolarHBondContact O-N 2.83Å
264L61.9Low57.7Low113 Ų113135 Ų13559%0.59273%0.727SS**  trans-46.7132.6170-75.3171000109.2H266 L268L264-H266 PolarHBondContact O-N 3.15Å; L264-L268 HydrophobicContact CB-CB 4.29Å
265P70.9Confident58Low84 Ų84134.7 Ų134.755%0.54573%0.729SS.*  trans-53.9139.3-175.421.9-33.5000109.3K267 L268P265-K267 PolarHBondContact O-N 3.18Å; P265-L268 HydrophobicContact CG-CD1 3.97Å; P265-L268 HydrophobicContact CG-CG 4.27Å; P265-L268 PolarHBondContact O-N 3.21Å
266H57.3Low57.1Low140 Ų140134 Ų13465%0.64873%0.729SS**THydrogen-bonded Turntrans-51.4-17.6-164-165.796.7000116L264L264-H266 PolarHBondContact O-N 3.15Å
267K64.6Low57.3Low201 Ų201135.5 Ų135.587%0.87473%0.731SS**THydrogen-bonded Turntrans-69.1-25.3172.1-60.6-65.1-176.1174.20114.8P265P265-K267 PolarHBondContact O-N 3.18Å
268L61.4Low57.5Low107 Ų107139.5 Ų139.556%0.5674%0.738SS**SBendtrans-104.9-2.4-176.8-59.6-177.8000113.3L264 P265 I270L264-L268 HydrophobicContact CB-CB 4.29Å; P265-L268 HydrophobicContact CG-CD1 3.97Å; P265-L268 HydrophobicContact CG-CG 4.27Å; P265-L268 PolarHBondContact O-N 3.21Å; L268-I270 PolarHBondContact O-N 3.43Å
269R74.1Confident57.4Low156 Ų156140.9 Ų140.959%0.58974%0.742SS**  trans-73.598.6176-168.5172.385.4107.2-8.5110.1K271R269-K271 PolarHBondContact O-N 2.87Å
270I65.3Low57.1Low155 Ų155141.6 Ų141.680%0.79574%0.735SS**  trans-54.7121168.6-58.2177.6000107.8L268 S272L268-I270 PolarHBondContact O-N 3.43Å; I270-S272 PolarHBondContact O-N 3.11Å
271K66.8Low56.8Low133 Ų133142.2 Ų142.258%0.57874%0.737SS**  trans-92.585.3178.5-68.7-176.3-177.9177.90108.9R269 R273R269-K271 PolarHBondContact O-N 2.87Å; K271-R273 PolarHBondContact O-N 3.42Å
272S61.6Low56.3Low113 Ų113143.4 Ų143.479%0.7974%0.74SS**  trans-55.2129.4162.5450000109.2I270I270-S272 PolarHBondContact O-N 3.11Å
273R59.4Low55.3Low224 Ų224144.9 Ų144.985%0.84574%0.738SS**  trans-119.3107.8166.9-72.8-168.4-176.7-148.45.8107.1K271 I275K271-R273 PolarHBondContact O-N 3.42Å; R273-I275 PolarHBondContact O-N 3.1Å
274T59Low54.8Low128 Ų128146.2 Ų146.279%0.78574%0.739SS**  trans-62.9116.1167.5-54.20000108.4Q276T274-Q276 PolarHBondContact O-N 2.94Å
275I50.8Low53.7Low144 Ų144150 Ų15074%0.73875%0.754SS**  trans-80.8111.9169.1-61.1176000106R273 I277R273-I275 PolarHBondContact O-N 3.1Å; I275-I277 HydrophobicContact CG2-CG1 4.21Å; I275-I277 PolarHBondContact O-N 2.91Å
276Q39.5Very low52Low177 Ų177156.1 Ų156.183%0.82777%0.767SS**  trans-69.594.9170.8-69.3-88.128.200107.8T274 K278T274-Q276 PolarHBondContact O-N 2.94Å; Q276-K278 PolarHBondContact O-N 3.09Å
277I51.3Low50.9Low144 Ų144157.5 Ų157.574%0.73877%0.774SS**  trans-74.5109.3172.6-60.3178.1000107.2I275 M279I275-I277 HydrophobicContact CG2-CG1 4.21Å; I275-I277 PolarHBondContact O-N 2.91Å; I277-M279 PolarHBondContact O-N 3.03Å; I277-M279 VanDerWaalsContact O-N 3.16Å
278K51.5Low49.6Very low191 Ų191152 Ų15283%0.8376%0.761SS**  trans-75.699.2174.2-175.3-174178.3-166.90108.4Q276 E280Q276-K278 PolarHBondContact O-N 3.09Å; K278-E280 PolarHBondContact O-N 2.74Å
279M42.6Very low48.1Very low173 Ų173154.8 Ų154.885%0.85277%0.769SS**PPolyproline II helixtrans-66.7129.1166-69-174.9106.700109.2I277I277-M279 PolarHBondContact O-N 3.03Å; I277-M279 VanDerWaalsContact O-N 3.16Å
280E43.1Very low46Very low168 Ų168152 Ų15279%0.78578%0.779SS**PPolyproline II helixtrans-91.7149.7158.1-118.4-149.7144.900108.7K278K278-E280 PolarHBondContact O-N 2.74Å
281P45.8Very low44.7Very low117 Ų117152.8 Ų152.876%0.7678%0.777SS**PPolyproline II helixtrans-76.1132.1-17931.2-32.1000111.3
282T37.2Very low42.9Very low135 Ų135153.9 Ų153.983%0.82879%0.789SS**PPolyproline II helixtrans-69.5131.6175.5-42.60000111.2
283D35Very low41.5Very low153 Ų153153.6 Ų153.682%0.81879%0.787SS**PPolyproline II helixtrans-78.1127.7171.6-153.73.9000109.9E285D283-E285 PolarHBondContact O-N 3.33Å
284P51.5Low40.2Very low115 Ų115148.5 Ų148.575%0.74779%0.786SS**  trans-103.873.7-165.239-34.1000113.6
285E38.5Very low38.8Very low191 Ų191147.1 Ų147.189%0.89379%0.787SS**  trans-148.696.5172.9-123.1177.2-135.700113.4D283D283-E285 PolarHBondContact O-N 3.33Å
286Y35.7Very low38Very low213 Ų213146.1 Ų146.184%0.83579%0.793SS**  trans-169.9100140.3-159.7-107000111.6
287E35Very low37.7Very low170 Ų170144.9 Ų144.979%0.79479%0.79SS**  trans-75.2150.5154.6-77.1-15516000109.9
288S35.8Very low37Very low84 Ų84146.4 Ų146.459%0.58780%0.799SS**  167.3117.5122.2-178.30000114.8
289F29.8Very low36.1Very low167 Ų167145.5 Ų145.573%0.73280%0.798SS**  trans48.7115.6140.9-72.1-108.2000123.1
290A31Very low35.6Very low96 Ų96140.9 Ų140.979%0.79379%0.794SS**  172.1101.1113.900000109.2
291K37.9Very low34.9Very low172 Ų172138.6 Ų138.675%0.74879%0.792SS**  57.6123.473.6-94.2-178-179.1174.90116.6
292N29.3Very low34.1Very low156 Ų156138.1 Ų138.183%0.83479%0.79SS**  trans82134.4170.5-44.9-5.4000113.8
293S31.2Very low33.8Very low108 Ų108140.6 Ų140.676%0.75579%0.789SS**  cis-149.6141.926.1-1560000115
294S32Very low33.7Very low117 Ų117141.3 Ų141.382%0.81879%0.788SS**  trans35.2130.6146-52.40000123.5
295A30.7Very low32.6Very low99 Ų99141.7 Ų141.782%0.81879%0.788SS**  trans-84.3164165.400000113.3
296S32.8Very low32.3Very low122 Ų122139 Ų13985%0.85379%0.785SS**  trans-144.5110.8156.561.40000110.9
297I33.9Very low32.3Very low151 Ų151137.3 Ų137.377%0.77479%0.785SS**  trans-87.3146.7167.4-69.3173.6000108.2E299I297-E299 HydrophobicContact CG2-CG 4.37Å
298L37Very low32Very low176 Ų176137.6 Ų137.692%0.92179%0.791SS**  trans-143.6111.2159.7-114.8167000110.1
299E32.4Very low31.8Very low173 Ų173138.9 Ų138.981%0.80880%0.801SS**  trans-85.1151.5172.2-71.1-174.3124.500111.7I297I297-E299 HydrophobicContact CG2-CG 4.37Å
300G31.6Very low31.8Very low75 Ų75136.1 Ų136.177%0.77380%0.802SS**  64.8110.912900000120
301V28.4Very low31.9Very low121 Ų121135.4 Ų135.473%0.73380%0.796SS**  trans-132.1125.3144.7-174.30000109.7F303V301-F303 HydrophobicContact CG1-CD2 3.97Å; V301-F303 HydrophobicContact CG1-CE1 4.35Å; V301-F303 HydrophobicContact CG1-CE2 3.37Å; V301-F303 HydrophobicContact CG1-CZ 3.59Å
302C28.5Very low31.7Very low106 Ų106137.3 Ų137.372%0.71680%0.8SS**  trans-105.9144.4174.2173.40000109.2
303F32.7Very low32.1Very low188 Ų188137.1 Ų137.183%0.82580%0.796SS**  trans-132.8111169.5-71.2-70.8000111.8V301V301-F303 HydrophobicContact CG1-CD2 3.97Å; V301-F303 HydrophobicContact CG1-CE1 4.35Å; V301-F303 HydrophobicContact CG1-CE2 3.37Å; V301-F303 HydrophobicContact CG1-CZ 3.59Å
304Q31.5Very low32.5Very low168 Ų168139.4 Ų139.479%0.78580%0.795SS**  trans-113147.2146.8-61.2-179.426.200104.8
305T27.9Very low33Very low122 Ų122139 Ų13975%0.74879%0.789SS**  -179.2151.367.9-35.60000103.5
306T32.6Very low33.2Very low134 Ų134139.7 Ų139.782%0.82279%0.788SS**  -170.5159.97044.60000111.7
307Q35.5Very low33.4Very low179 Ų179141.8 Ų141.884%0.83678%0.784SS**  trans-86.2160178.4-58.6174.3-0.500112.7
308N30Very low33.3Very low175 Ų175140.2 Ų140.294%0.93679%0.785SS**  trans-158.1155.8144.2-100.4-25.4000111.1
309S30.2Very low33.7Very low112 Ų112137.2 Ų137.278%0.78378%0.777SS**  trans-114.1166.9-177.5-147.60000110.1
310S31.6Very low33.8Very low108 Ų108137.2 Ų137.276%0.75578%0.781SS**  cis-155.6-172.615.6-155.20000107.8
311A32.3Very low34.5Very low82 Ų82139.1 Ų139.168%0.67878%0.782SS**  cis-160.3167.81100000113.2
312Y32.6Very low35.5Very low212 Ų212139.4 Ų139.483%0.83178%0.784SS**  trans39.6100140.7-135.1-113.8000120
313M39.4Very low36.3Very low152 Ų152142.4 Ų142.475%0.74979%0.788SS**  trans-167115.9134.1-99.7-53.7102.100112.2
314Q38.8Very low36.7Very low156 Ų156140 Ų14073%0.72979%0.788SS**  trans-133.1155156.4-85.5-77.5-3100104.5
315P42.4Very low37.7Very low107 Ų107137.2 Ų137.270%0.69579%0.787SS**  cis-143.3171.928.741.6-23.5000117.2
316S36.2Very low38.6Very low115 Ų115137 Ų13780%0.80478%0.782SS**  trans-158.6143.8132.362.60000111.6
317H35.7Very low39.6Very low166 Ų166137.9 Ų137.977%0.76978%0.778SS**  trans-115.9144.3-174.5-89.5-92000111.8
318C31.9Very low40.5Very low118 Ų118138 Ų13880%0.79778%0.779SS**  trans68169.2151-65.50000118.3
319P45.6Very low41.6Very low113 Ų113132.8 Ų132.873%0.73477%0.767SS**  cis-123.1156.8-13.436-22.2000113.7
320L35.4Very low42.4Very low172 Ų172138.6 Ų138.690%0.90177%0.771SS**  trans-170.969.4142.4-107.2170.1000111.5
321S45.5Very low43.5Very low115 Ų115138.9 Ų138.980%0.80477%0.773SS**  trans-127.986.6164.261.50000108.6
322V49.3Very low44.5Very low127 Ų127147.1 Ų147.177%0.7779%0.787SS**  trans-107.6118171.81780000108
323Q44.5Very low45Very low170 Ų170141 Ų14179%0.79479%0.788SS**  trans-68.1136.1176.8-60.8163.2-71.900109.8
324V42.2Very low45.3Very low136 Ų136139.3 Ų139.382%0.82479%0.791SS**  trans-115.472.4159-1730000108.4N326V324-N326 PolarHBondContact O-N 3.46Å
325S51.2Low45.7Very low111 Ų111144.9 Ų144.978%0.77682%0.817SS**  trans-88.977166-60.50000109
326N47.2Very low45.8Very low117 Ų117146.8 Ų146.863%0.62682%0.823SS**  trans-151.499.3167.7-167.40.3000112.5V324 Q328V324-N326 PolarHBondContact O-N 3.46Å; N326-Q328 PolarHBondContact OD1-N 3.32Å
327M54.1Low46.4Very low153 Ų153148.5 Ų148.575%0.75482%0.824SS**  trans-125.739163.5-75.4-162.364.800111.6G329M327-G329 PolarHBondContact O-N 3.08Å
328Q54.4Low46.9Very low181 Ų181147.5 Ų147.585%0.84683%0.828SS**THydrogen-bonded Turntrans-88.580167.7-114.968.326.800109.5N326N326-Q328 PolarHBondContact OD1-N 3.32Å
329G53.2Low47.8Very low66 Ų66149.2 Ų149.268%0.6883%0.829SS**THydrogen-bonded Turntrans-168.6-7.7-178.900000118.7M327M327-G329 PolarHBondContact O-N 3.08Å
330W47.8Very low48Very low233 Ų233151.5 Ų151.588%0.88384%0.835SS**SBendtrans-107.139-170.5-74.867.9000113.8
331S55Low48.8Very low114 Ų114150.1 Ų150.180%0.79783%0.831SS**  trans-155.671.7176-720000112.9
332R52.1Low49.1Very low256 Ų256152.6 Ų152.697%0.96683%0.833SS**  trans-166110.5155.1-108.2167-169.8-92.2-1108.3
333G42.4Very low49Very low82 Ų82154.6 Ų154.685%0.84584%0.838SS**  trans16253.9-174.500000114.4
334S47.3Very low49.4Very low117 Ų117153.3 Ų153.382%0.81884%0.841SS**  trans-150.1105.2161.259.60000108
335E46.1Very low50.1Low274 Ų274154.9 Ų154.9100%1.2884%0.843SS**  trans-72.90154.6-69.8-179.2121.700109.8

Retrieved 335 of 335 residues in 1013.3 ms (Link to these results)