A0A087Y3J6_POEFO Loading...

Heart- and neural crest derivatives-expressed protein 1

AlphaFold DB , UniProt , Accession A0A087Y3J6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 194 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
1M45.2Very low46.1Very low243 Ų243156.7 Ų156.7100%1.19781%0.813SS**  099.70-69.6143.8148.100106.9
2N36.6Very low45.8Very low146 Ų146158.8 Ų158.878%0.78182%0.815SS**  trans-88.9130.9178.4-69.4-19.1000108.6I4N2-I4 HydrophobicContact CB-CD1 3.9Å
3L51.6Low45.8Very low179 Ų179158.8 Ų158.894%0.93781%0.809SS**  trans-114.490.8161.1-85.3150.5000107.4
4I46.5Very low45.9Very low149 Ų149159.9 Ų159.976%0.76481%0.809SS**  trans-62.1122.8161.2-91.767.1000106.9N2N2-I4 HydrophobicContact CB-CD1 3.9Å
5G45.9Very low46.4Very low68 Ų68157.2 Ų157.270%0.70180%0.797SS**  trans-134.583.4166.100000107.2
6G49.1Very low46.8Very low64 Ų64156.1 Ų156.166%0.6679%0.79SS**  trans-74.3132-179.400000111.4
7Y44.1Very low46.8Very low217 Ų217157.5 Ų157.585%0.85179%0.792SS**  trans-12598.1154-73.1-82.6000107.7H9Y7-H9 PolarHBondContact O-N 3.49Å
8Q50.8Low46.5Very low161 Ų161157.9 Ų157.975%0.75279%0.791SS**  trans-65.4119155.8-81.5-89.227.400107.1
9H41Very low46.6Very low177 Ų177154.8 Ų154.882%0.81978%0.783SS**  trans-125.7113.7159.1-110.8-102.7000108.3Y7Y7-H9 PolarHBondContact O-N 3.49Å
10H47.8Very low46.3Very low152 Ų152155.5 Ų155.570%0.70478%0.781SS**  trans-60.8141.4-175.5-75-100.9000112.5H12H10-H12 PolarHBondContact O-N 3.43Å
11H48.5Very low46.4Very low168 Ų168153.9 Ų153.978%0.77878%0.782SS**  trans-56.9126.3160.7-74.8-97.8000110.7
12H43Very low46.6Very low181 Ų181150.8 Ų150.884%0.83876%0.762SS**  trans-127.6105.9149.2-90.590.9000107.9H10 H14H10-H12 PolarHBondContact O-N 3.43Å; H12-H14 PolarHBondContact O-N 3.19Å
13H45.8Very low47.2Very low159 Ų159148.6 Ų148.674%0.73675%0.754SS**  trans-66105.6163.2-84.5-106.1000108.1
14H46.1Very low47.1Very low175 Ų175147.9 Ų147.981%0.8175%0.745SS**  trans-99.591.4163.7-162.974.2000108.2H12H12-H14 PolarHBondContact O-N 3.19Å
15L54.6Low46.9Very low119 Ų119151.9 Ų151.962%0.62375%0.751SS**  trans-72.6135166.6-121.181.8000108.5
16M52.9Low46.6Very low140 Ų140154.3 Ų154.369%0.6976%0.756SS**  trans79.691160.9-48.4-60.5171.100117.9
17H45.3Very low46.5Very low179 Ų179159.3 Ų159.383%0.82976%0.761SS**  178.493.7117.3-108.2-128.3000109.6P19H17-P19 VanDerWaalsContact O-CD 3.29Å; H17-P19 WeakPolarHBondContact O-CD 3.29Å
18E42.1Very low46.7Very low165 Ų165157.3 Ų157.377%0.77176%0.76SS**  trans-76.5112157.1-103.6-75.8134.800106.8F20E18-F20 PolarHBondContact O-N 3.09Å; E18-F20 VanDerWaalsContact O-N 3.09Å
19P49.3Very low46.5Very low99 Ų99156.4 Ų156.464%0.64376%0.76SS**  trans-72.1106.6169.129.7-28.6000107.2H17H17-P19 VanDerWaalsContact O-CD 3.29Å; H17-P19 WeakPolarHBondContact O-CD 3.29Å
20F39.8Very low46.9Very low168 Ų168151.1 Ų151.174%0.73775%0.747SS**  trans-35.7124.3166.8-84.2-95.9000110.9E18 F22E18-F20 PolarHBondContact O-N 3.09Å; E18-F20 VanDerWaalsContact O-N 3.09Å; F20-F22 HydrophobicContact CB-CB 4.35Å; F20-F22 PolarHBondContact O-N 2.73Å
21P49.4Very low47Very low123 Ų123150.6 Ų150.680%0.79976%0.757SS**THydrogen-bonded Turntrans-70.39.2173.328.3-33.2000112.9
22F48.5Very low47.2Very low178 Ų178149.8 Ų149.878%0.78175%0.748SS**THydrogen-bonded Turntrans-84.5-15.7-172.4-169.8-108.5000114.6F20F20-F22 HydrophobicContact CB-CB 4.35Å; F20-F22 PolarHBondContact O-N 2.73Å
23V49.6Very low47.2Very low100 Ų100147.9 Ų147.961%0.60674%0.738SS**SBendtrans-114.50.5-168.7-166.40000114.2
24Q48Very low47.2Very low163 Ų163146.7 Ų146.776%0.76273%0.733SS**SBendtrans-93.1-2.5-175.3-144.2149.3-36.400114.9
25R42.9Very low47.5Very low234 Ų234142 Ų14288%0.88372%0.72SS**SBendtrans-95.3-10.9178.1-154.368.9176.8-164.40.5114.4
26C40.8Very low47.5Very low118 Ų118147 Ų14780%0.79773%0.73SS**SBendtrans-89.7-1.8178.9-76.70000114.4
27H46.7Very low47.8Very low169 Ų169145.7 Ų145.778%0.78273%0.73SS**SBendtrans-10612.9-169.2-120.694.9000116.1
28Q47.4Very low48.1Very low175 Ų175140.1 Ų140.182%0.81871%0.708SS**SBendtrans-119.8-1.6-179.4-80.4-168.878.700116.4
29D46.7Very low48.3Very low143 Ų143139.5 Ų139.577%0.76571%0.711SS**SBendtrans-119.259.9179.6-77.3-46.4000112.5
30A49.4Very low48.3Very low65 Ų65141.4 Ų141.454%0.53771%0.71SS.*  trans-158.4105.6157.700000113.1F33A30-F33 HydrophobicContact CB-CB 4.23Å
31P49.7Very low48.7Very low141 Ų141136 Ų13692%0.91670%0.703SS**SBend-118.425.6120.336.6-34.7000111.7
32Y52.2Low48.7Very low152 Ų152138.9 Ų138.960%0.59671%0.705SS**  trans-103.8-9177.9103.1-95.7000113.7Q34 S35Y32-Q34 PolarHBondContact O-N 3.23Å; Y32-S35 PolarHBondContact O-N 3.33Å; Y32-S35 VanDerWaalsContact O-N 3.14Å
33F43.6Very low48.7Very low141 Ų141134.7 Ų134.762%0.61869%0.694SS**THydrogen-bonded Turntrans-65.8-5.9-173-138.9-91.2000114.5A30A30-F33 HydrophobicContact CB-CB 4.23Å
34Q45.6Very low48.5Very low134 Ų134134 Ų13463%0.62669%0.692SS**THydrogen-bonded Turntrans-94.5-0.5177.1-71-77-0.800114.4Y32 V38Y32-Q34 PolarHBondContact O-N 3.23Å; Q34-V38 WeakPolarHBondContact O-CB 3.27Å; Q34-V38 VanDerWaalsContact OE1-CG2 3.3Å
35S53.5Low48.7Very low77 Ų77130.5 Ų130.554%0.53869%0.691SS.*THydrogen-bonded Turntrans-89.6-10.9-171.4-1770000115.5Y32Y32-S35 PolarHBondContact O-N 3.33Å; Y32-S35 VanDerWaalsContact O-N 3.14Å
36W53.8Low49Very low222 Ų222126 Ų12684%0.84168%0.684SS**THydrogen-bonded Turntrans-105.5-14.2-179.590.3-35.7000114.9
37V59.1Low49.3Very low114 Ų114128.4 Ų128.469%0.69168%0.681SS**THydrogen-bonded Turntrans-105.1-24.9176.3-167.10000111.7
38V53Low49.5Very low61 Ų61128.6 Ų128.637%0.3768%0.683SS.*SBendtrans-105.4116-177.3-176.20000109.9Q34 H40Q34-V38 WeakPolarHBondContact O-CB 3.27Å; Q34-V38 VanDerWaalsContact OE1-CG2 3.3Å; V38-H40 PolarHBondContact O-N 3.13Å
39N45.3Very low49.5Very low153 Ų153128 Ų12882%0.81868%0.683SS**  trans-62.7109.7168-143.2-12.9000107.3G41N39-G41 PolarHBondContact O-N 2.91Å
40H49.7Very low49.4Very low138 Ų138129.7 Ų129.764%0.63969%0.687SS**THydrogen-bonded Turntrans-71.939.1176.2-76.2-78.6000112.5V38V38-H40 PolarHBondContact O-N 3.13Å
41G46.9Very low49.2Very low56 Ų56130.8 Ų130.858%0.57770%0.696SS**THydrogen-bonded Turntrans-87.6-22177.900000113.8N39N39-G41 PolarHBondContact O-N 2.91Å
42E50Low49Very low182 Ų182130.3 Ų130.385%0.8569%0.693SS**  trans-148.479.6-169.6-63.9-89.1136.800109.1
43V47.9Very low48.3Very low91 Ų91132 Ų13255%0.55270%0.699SS**  trans-126.8111.3160.3-172.80000107.1
44P47.2Very low48.4Very low85 Ų85131.1 Ų131.155%0.55271%0.706SS**  trans-53.8146172.9-23.533000110.7D46P44-D46 PolarHBondContact O-N 3.28Å
45A52.2Low48.4Very low89 Ų89129.6 Ų129.674%0.73671%0.707SS**G310 helixtrans-62.96-173.300000115.3
46D47.6Very low47.7Very low139 Ų139130.2 Ų130.274%0.74371%0.712SS**G310 helixtrans-89.7-10-169.8-45.5-36.8000113P44P44-D46 PolarHBondContact O-N 3.28Å
47F47.6Very low47.1Very low170 Ų170124.9 Ų124.975%0.74672%0.715SS**G310 helixtrans-97.525.6177.7-75.1-81.7000113.9I49F47-I49 VanDerWaalsContact C-N 3.33Å; F47-I49 PolarHBondContact O-N 3.07Å
48Q50.5Low46.1Very low173 Ų173127.3 Ų127.381%0.80872%0.718SS**  trans-71.591.9166.9-142.2-168.6-44.300108.6Q50Q48-Q50 PolarHBondContact O-N 3.41Å
49I48.5Very low45.4Very low162 Ų162132.5 Ų132.583%0.83174%0.743SS**  trans-55.4110.1173.7-62.3-178.4000107.9F47 A51F47-I49 VanDerWaalsContact C-N 3.33Å; F47-I49 PolarHBondContact O-N 3.07Å; I49-A51 PolarHBondContact O-N 3.46Å
50Q43.4Very low44.6Very low178 Ų178129 Ų12983%0.83274%0.744SS**PPolyproline II helixtrans-60.3132174.7-74.4176.92.400109.6Q48Q48-Q50 PolarHBondContact O-N 3.41Å
51A46.1Very low44.2Very low89 Ų89126.5 Ų126.574%0.73675%0.747SS**PPolyproline II helixtrans-58.7140.5166.700000109.4I49 Y53I49-A51 PolarHBondContact O-N 3.46Å; A51-Y53 PolarHBondContact O-N 3Å
52P44.9Very low43.7Very low130 Ų130133.4 Ų133.484%0.84476%0.764SS**PPolyproline II helixtrans-62122.9-175.222-31000111.2T54P52-T54 PolarHBondContact O-N 3.36Å
53Y37.2Very low42.7Very low189 Ų189128.2 Ų128.274%0.74176%0.759SS**PPolyproline II helixtrans-55117173.3175.8-97.8000110.4A51 P55A51-Y53 PolarHBondContact O-N 3Å; Y53-P55 HydrophobicContact CD1-CB 4.42Å; Y53-P55 HydrophobicContact CE1-CB 4.01Å
54T47.4Very low42Very low122 Ų122129.1 Ų129.175%0.74878%0.776SS**PPolyproline II helixtrans-77.9122.1164.649.80000108.3P52P52-T54 PolarHBondContact O-N 3.36Å
55P45.6Very low41.6Very low101 Ų101129.8 Ų129.866%0.65679%0.788SS**PPolyproline II helixtrans-80.6131.8179.730.5-30000111.9Y53Y53-P55 HydrophobicContact CD1-CB 4.42Å; Y53-P55 HydrophobicContact CE1-CB 4.01Å
56S38Very low41.2Very low91 Ų91134.8 Ų134.864%0.63680%0.796SS**  trans28.6118.1151.1-56.80000120.8
57A40.4Very low40.8Very low109 Ų109135.5 Ų135.590%0.90180%0.8SS**  trans-140125.4138.300000108.8
58E39Very low40.2Very low165 Ų165130.3 Ų130.377%0.77179%0.794SS**  trans-81.9165.7-167.2-55.4-104.3135.400113.5
59L37.5Very low39.4Very low170 Ų170133.1 Ų133.189%0.8980%0.798SS**  trans83.9117.9157.5-91.579.7000121
60G30.1Very low38.9Very low81 Ų81131.8 Ų131.884%0.83579%0.791SS**  trans152.696.6147.100000115.3
61A40.4Very low38.8Very low85 Ų85131.3 Ų131.370%0.70279%0.789SS**  trans-78-176.1174.300000113.1
62H35.7Very low38.4Very low201 Ų201130.4 Ų130.493%0.93179%0.788SS**  trans88124.3-177.4-43-70.3000113.4
63G29Very low38.5Very low72 Ų72131.7 Ų131.774%0.74279%0.788SS**  cis150.9147.38.900000108
64A33.5Very low39Very low111 Ų111131.4 Ų131.492%0.91779%0.793SS**  trans76.5134.4159.500000120.7
65A39.5Very low38.8Very low98 Ų98130.5 Ų130.581%0.8179%0.789SS**  trans-70.6151.7-179.400000113.2
66H44.1Very low38.9Very low195 Ų195129.2 Ų129.290%0.90379%0.794SS**  trans-136.1133.3145-138.8-85.4000110.2
67D37.6Very low39.7Very low153 Ų153133.1 Ų133.182%0.81880%0.804SS**  trans-78154.6-173174.740.6000113
68G34.9Very low40.4Very low61 Ų61131.1 Ų131.163%0.62979%0.794SS**  trans86118.1152.300000118
69R34Very low41.2Very low233 Ų233133.4 Ų133.488%0.87980%0.802SS**  165.4113.8109.8-174.3161178.7-177.3-1.1114.4
70L39.2Very low42.1Very low133 Ų133136.4 Ų136.470%0.69680%0.801SS**  trans54115.8143-79.5158.5000121.3
71E40.3Very low43.4Very low168 Ų168143.5 Ų143.579%0.78580%0.803SS**  trans18.7117.8130.5-71.9-160.8117.600118.6
72G38.7Very low44.1Very low70 Ų70142.1 Ų142.172%0.72279%0.792SS**  trans-158.469.3157.300000109.4Q74G72-Q74 PolarHBondContact O-N 3.35Å
73L46.6Very low45.2Very low158 Ų158137 Ų13783%0.82778%0.778SS**  trans-59.193.1161.4-79.896.8000108.2
74Q47.2Very low46.8Very low182 Ų182135.8 Ų135.885%0.8577%0.766SS**  trans-93.9118.4158.6-76.7-168.449.600108.2G72 G76G72-Q74 PolarHBondContact O-N 3.35Å; Q74-G76 PolarHBondContact O-N 3.4Å
75P44.1Very low48.8Very low103 Ų103135 Ų13567%0.66975%0.752SS**  trans-67108.6175.427.3-30.1000108.1M77P75-M77 HydrophobicContact CB-SD 4.16Å; P75-M77 PolarHBondContact O-N 2.91Å
76G47.5Very low50.7Low74 Ų74137.1 Ų137.176%0.76374%0.743SS**  trans-66.574.9170.500000110.9Q74Q74-G76 PolarHBondContact O-N 3.4Å
77M55.5Low52.7Low173 Ų173134.8 Ų134.885%0.85273%0.73SS**  trans-133.7107.1179.8-66.9167.985.400108.9P75P75-M77 HydrophobicContact CB-SD 4.16Å; P75-M77 PolarHBondContact O-N 2.91Å
78G54Low55.2Low67 Ų67132 Ų13269%0.69171%0.712SS**SBendtrans158-1916200000119.2R80G78-R80 PolarHBondContact O-N 3.18Å
79K55.8Low58.1Low213 Ų213137.2 Ų137.293%0.92671%0.713SS**SBendtrans-89.811.3-174.9-92.1139.2173.9172.90116
80R57.6Low61Low234 Ų234134.9 Ų134.988%0.88370%0.704SS**SBendtrans-97.518.9-178-55.9-167.8-148.8-1707.4115.5G78G78-R80 PolarHBondContact O-N 3.18Å
81R56.7Low63.7Low230 Ų230135.2 Ų135.287%0.86870%0.696SS**SBendtrans-126.85.2-177.6-68.6-163.1-82.4-168.6-4.3116.6
82A55Low66.4Low56 Ų56129.9 Ų129.946%0.46368%0.675SS.*SBendtrans-98.5-2.6178.400000114.5K86A82-K86 WeakPolarHBondContact O-CD 3.28Å; A82-K86 WeakPolarHBondContact O-CG 3.25Å
83S58Low69.2Low92 Ų92130.5 Ų130.564%0.64366%0.659SS**Hα-helixtrans-74.6-37.9-178.4-1760000112.6K86 K87S83-K86 PolarHBondContact O-N 3.43Å; S83-K87 WeakPolarHBondContact O-CB 3.48Å; S83-K87 PolarHBondContact O-N 3.5Å; S83-K87 VanDerWaalsContact O-N 3.08Å
84G64.3Low71.6Confident48 Ų48126.9 Ų126.950%0.49565%0.647SS.*Hα-helixtrans-59.6-57.3-177.100000114.4K86 K87 E88G84-K86 VanDerWaalsContact C-N 3.27Å; G84-K86 PolarHBondContact O-N 2.75Å; G84-K87 PolarHBondContact O-N 3.24Å; G84-E88 PolarHBondContact O-N 3.22Å; G84-E88 VanDerWaalsContact O-N 3.17Å
85P74.7Confident74Confident95 Ų95121 Ų12162%0.61762%0.621SS**Hα-helixtrans-62.9-32-177.9-24.334.5000113.7R89P85-R89 WeakPolarHBondContact O-CB 3.38Å; P85-R89 PolarHBondContact O-N 3.17Å
86K79.4Confident76.6Confident142 Ų142119.6 Ų119.662%0.61761%0.607SS**Hα-helixtrans-71.5-37.7177.6-68.3179.7180-179.90111.7A82 S83 G84 R90A82-K86 WeakPolarHBondContact O-CD 3.28Å; A82-K86 WeakPolarHBondContact O-CG 3.25Å; S83-K86 PolarHBondContact O-N 3.43Å; G84-K86 VanDerWaalsContact C-N 3.27Å; G84-K86 PolarHBondContact O-N 2.75Å; K86-R90 WeakPolarHBondContact O-CG 3.1Å; K86-R90 PolarHBondContact O-N 3.35Å
87K85.1Confident78.9Confident146 Ų146119.7 Ų119.764%0.63559%0.593SS**Hα-helixtrans-67-46.9178-174.3178.1177.5-179.20111.7S83 G84 R89 R90 R91S83-K87 WeakPolarHBondContact O-CB 3.48Å; S83-K87 PolarHBondContact O-N 3.5Å; S83-K87 VanDerWaalsContact O-N 3.08Å; G84-K87 PolarHBondContact O-N 3.24Å; K87-R89 VanDerWaalsContact C-N 3.3Å; K87-R89 PolarHBondContact O-N 3.41Å; K87-R90 PolarHBondContact O-N 3.48Å; K87-R91 PolarHBondContact O-N 3.18Å
88E91.6Very high80.9Confident93 Ų93114 Ų11444%0.43557%0.573SS.*Hα-helixtrans-66.5-35-178.8-173.155.1-151.700112.4G84 R91 T92G84-E88 PolarHBondContact O-N 3.22Å; G84-E88 VanDerWaalsContact O-N 3.17Å; E88-R91 PolarHBondContact O-N 2.94Å; E88-R91 IonicContact OE1-CZ 3.56Å; E88-R91 IonicContact OE1-NH1 3.93Å; E88-R91 PolarHBondContact OE1-NH1 3.38Å; E88-R91 IonicContact OE2-NH1 2.78Å; E88-T92 WeakPolarHBondContact O-CB 3.12Å; E88-T92 PolarHBondContact O-N 2.96Å; E88-T92 PolarHBondContact O-OG1 3.12Å
89R95.4Very high83Confident172 Ų172112.3 Ų112.365%0.64955%0.547SS*.Hα-helixtrans-59.9-50.6171.9179.8173177141.12.4111.6P85 K87 R91 T92 E93P85-R89 WeakPolarHBondContact O-CB 3.38Å; P85-R89 PolarHBondContact O-N 3.17Å; K87-R89 VanDerWaalsContact C-N 3.3Å; K87-R89 PolarHBondContact O-N 3.41Å; R89-R91 VanDerWaalsContact C-N 3.32Å; R89-R91 PolarHBondContact O-N 3.47Å; R89-T92 PolarHBondContact O-N 3.4Å; R89-T92 VanDerWaalsContact O-N 3.14Å; R89-E93 HydrophobicContact CG-CG 4.38Å; R89-E93 VanDerWaalsContact CG-OE1 3.28Å; R89-E93 WeakPolarHBondContact CG-OE1 3.48Å; R89-E93 IonicContact CZ-OE1 3.85Å; R89-E93 IonicContact NE-OE1 2.73Å; R89-E93 PolarHBondContact NE-OE1 3.29Å; R89-E93 IonicContact NH2-OE1 3.87Å; R89-E93 WeakPolarHBondContact O-CG 3.46Å; R89-E93 PolarHBondContact O-N 3.49Å
90R94Very high84.9Confident183 Ų183104.2 Ų104.269%0.69152%0.52SS*.Hα-helixtrans-59.4-41.7177.6-73.3177.2179.5-88.32.9112.3K86 K87 T92 E93 S94K86-R90 WeakPolarHBondContact O-CG 3.1Å; K86-R90 PolarHBondContact O-N 3.35Å; K87-R90 PolarHBondContact O-N 3.48Å; R90-T92 VanDerWaalsContact C-N 3.35Å; R90-T92 PolarHBondContact O-N 2.95Å; R90-E93 PolarHBondContact O-N 3.34Å; R90-S94 PolarHBondContact O-N 3.21Å
91R96.4Very high86.7Confident140 Ų14098.3 Ų98.353%0.52850%0.503SS..Hα-helixtrans-59-47174.4178.5-177.6167.4-87.2-5.7111.2K87 E88 R89 S94 I95K87-R91 PolarHBondContact O-N 3.18Å; E88-R91 PolarHBondContact O-N 2.94Å; E88-R91 IonicContact OE1-CZ 3.56Å; E88-R91 IonicContact OE1-NH1 3.93Å; E88-R91 PolarHBondContact OE1-NH1 3.38Å; E88-R91 IonicContact OE2-NH1 2.78Å; R89-R91 VanDerWaalsContact C-N 3.32Å; R89-R91 PolarHBondContact O-N 3.47Å; R91-S94 PolarHBondContact O-N 3Å; R91-I95 HydrophobicContact CG-CD1 4.18Å; R91-I95 WeakPolarHBondContact O-CG1 3.47Å; R91-I95 PolarHBondContact O-N 2.99Å
92T97.1Very high88.6Confident56 Ų5690 Ų9034%0.34448%0.475SS..Hα-helixtrans-65.8-40.2179.3-60.50000112E88 R89 R90 I95 N96E88-T92 WeakPolarHBondContact O-CB 3.12Å; E88-T92 PolarHBondContact O-N 2.96Å; E88-T92 PolarHBondContact O-OG1 3.12Å; R89-T92 PolarHBondContact O-N 3.4Å; R89-T92 VanDerWaalsContact O-N 3.14Å; R90-T92 VanDerWaalsContact C-N 3.35Å; R90-T92 PolarHBondContact O-N 2.95Å; T92-I95 PolarHBondContact O-N 2.87Å; T92-N96 WeakPolarHBondContact O-CB 3.36Å; T92-N96 PolarHBondContact O-N 2.88Å; T92-N96 PolarHBondContact O-ND2 3.01Å
93E97.3Very high90.5Very high83 Ų8390.6 Ų90.639%0.38847%0.465SS..Hα-helixtrans-59.2-49.1174.1-74.1166.8179.100110.6R89 R90 I95 N96 T97R89-E93 HydrophobicContact CG-CG 4.38Å; R89-E93 VanDerWaalsContact CG-OE1 3.28Å; R89-E93 WeakPolarHBondContact CG-OE1 3.48Å; R89-E93 IonicContact CZ-OE1 3.85Å; R89-E93 IonicContact NE-OE1 2.73Å; R89-E93 PolarHBondContact NE-OE1 3.29Å; R89-E93 IonicContact NH2-OE1 3.87Å; R89-E93 WeakPolarHBondContact O-CG 3.46Å; R89-E93 PolarHBondContact O-N 3.49Å; R90-E93 PolarHBondContact O-N 3.34Å; E93-I95 PolarHBondContact O-N 3.12Å; E93-N96 PolarHBondContact O-N 3.38Å; E93-N96 VanDerWaalsContact O-N 3.08Å; E93-T97 PolarHBondContact O-N 3.12Å; E93-T97 PolarHBondContact O-OG1 2.89Å; E93-T97 VanDerWaalsContact O-OG1 3.12Å
94S97.9Very high92.2Very high82 Ų8293.9 Ų93.957%0.57347%0.471SS*.Hα-helixtrans-56.8-44.6175.6171.10000112.7R90 R91 N96 T97 A98R90-S94 PolarHBondContact O-N 3.21Å; R91-S94 PolarHBondContact O-N 3Å; S94-N96 VanDerWaalsContact C-N 3.33Å; S94-N96 PolarHBondContact O-N 3.4Å; S94-T97 PolarHBondContact O-N 3.24Å; S94-A98 PolarHBondContact O-N 3.08Å
95I97.8Very high93.7Very high60 Ų6095.5 Ų95.531%0.30847%0.473SS..Hα-helixtrans-62.6-41176.1-67.9166000111.2R91 T92 E93 A98 F99R91-I95 HydrophobicContact CG-CD1 4.18Å; R91-I95 WeakPolarHBondContact O-CG1 3.47Å; R91-I95 PolarHBondContact O-N 2.99Å; T92-I95 PolarHBondContact O-N 2.87Å; E93-I95 PolarHBondContact O-N 3.12Å; I95-A98 PolarHBondContact O-N 3.34Å; I95-F99 HydrophobicContact CG2-CD2 4.03Å; I95-F99 HydrophobicContact CG2-CE2 4.38Å; I95-F99 WeakPolarHBondContact O-CB 3.31Å; I95-F99 PolarHBondContact O-N 3.02Å
96N97Very high94.6Very high72 Ų7291.3 Ų91.339%0.38545%0.446SS..Hα-helixtrans-69.1-36.3-179.2-70.8-27.4000111.9T92 E93 S94 F99 A100T92-N96 WeakPolarHBondContact O-CB 3.36Å; T92-N96 PolarHBondContact O-N 2.88Å; T92-N96 PolarHBondContact O-ND2 3.01Å; E93-N96 PolarHBondContact O-N 3.38Å; E93-N96 VanDerWaalsContact O-N 3.08Å; S94-N96 VanDerWaalsContact C-N 3.33Å; S94-N96 PolarHBondContact O-N 3.4Å; N96-F99 WeakPolarHBondContact O-CB 3.36Å; N96-F99 PolarHBondContact O-N 3.03Å; N96-A100 PolarHBondContact O-N 3.24Å
97T97.1Very high95.3Very high77 Ų7786.3 Ų86.347%0.47243%0.428SS..Hα-helixtrans-61.1-51.3172.4-57.40000110.9E93 S94 F99 A100 E101E93-T97 PolarHBondContact O-N 3.12Å; E93-T97 PolarHBondContact O-OG1 2.89Å; E93-T97 VanDerWaalsContact O-OG1 3.12Å; S94-T97 PolarHBondContact O-N 3.24Å; T97-F99 PolarHBondContact O-N 3.48Å; T97-A100 WeakPolarHBondContact O-CA 3.38Å; T97-A100 WeakPolarHBondContact O-CB 3.45Å; T97-A100 PolarHBondContact O-N 3.23Å; T97-E101 PolarHBondContact O-N 3.04Å
98A97.7Very high95.5Very high52 Ų5285.2 Ų85.243%0.4343%0.429SS..Hα-helixtrans-59-35.7176.400000112.5S94 I95 A100 L102S94-A98 PolarHBondContact O-N 3.08Å; I95-A98 PolarHBondContact O-N 3.34Å; A98-A100 VanDerWaalsContact C-N 3.34Å; A98-L102 WeakPolarHBondContact O-CB 3.46Å; A98-L102 PolarHBondContact O-N 3.41Å
99F97.4Very high95.3Very high33 Ų3382 Ų8215%0.14542%0.416CS..Hα-helixtrans-66.9-32.1172.9-106.9-80000113I95 N96 T97 R103 K117 T120 L121I95-F99 HydrophobicContact CG2-CD2 4.03Å; I95-F99 HydrophobicContact CG2-CE2 4.38Å; I95-F99 WeakPolarHBondContact O-CB 3.31Å; I95-F99 PolarHBondContact O-N 3.02Å; N96-F99 WeakPolarHBondContact O-CB 3.36Å; N96-F99 PolarHBondContact O-N 3.03Å; T97-F99 PolarHBondContact O-N 3.48Å; F99-R103 WeakPolarHBondContact O-CG 3.48Å; F99-R103 PolarHBondContact O-N 2.98Å; F99-R103 PolarHBondContact O-NH1 2.95Å; F99-K117 HydrophobicContact CD1-CB 4.47Å; F99-K117 HydrophobicContact CD1-CG 4.2Å; F99-K117 HydrophobicContact CE1-CB 3.71Å; F99-K117 HydrophobicContact CE1-CG 3.88Å; F99-K117 HydrophobicContact CE2-CD 4.27Å; F99-K117 HydrophobicContact CE2-CG 4.35Å; F99-K117 HydrophobicContact CZ-CB 3.79Å; F99-K117 HydrophobicContact CZ-CD 4.26Å; F99-K117 HydrophobicContact CZ-CG 3.95Å; F99-T120 HydrophobicContact CD1-CG2 4.08Å; F99-T120 HydrophobicContact CE1-CG2 4.29Å; F99-L121 HydrophobicContact CE1-CD2 4.29Å; F99-L121 HydrophobicContact CE1-CG 4.14Å; F99-L121 HydrophobicContact CZ-CD1 4.23Å; F99-L121 HydrophobicContact CZ-CD2 4.05Å; F99-L121 HydrophobicContact CZ-CG 4.03Å
100A94.6Very high94.8Very high43 Ų4377.2 Ų77.236%0.35541%0.406SS..Hα-helixtrans-69.2-48.8176.200000110.3N96 T97 A98 L102 R103 E104N96-A100 PolarHBondContact O-N 3.24Å; T97-A100 WeakPolarHBondContact O-CA 3.38Å; T97-A100 WeakPolarHBondContact O-CB 3.45Å; T97-A100 PolarHBondContact O-N 3.23Å; A98-A100 VanDerWaalsContact C-N 3.34Å; A100-L102 VanDerWaalsContact C-N 3.29Å; A100-L102 PolarHBondContact O-N 3.45Å; A100-R103 WeakPolarHBondContact O-CB 3.22Å; A100-R103 PolarHBondContact O-N 2.99Å; A100-E104 PolarHBondContact O-N 2.85Å
101E95.6Very high94Very high110 Ų11074.1 Ų74.151%0.51442%0.42SS..Hα-helixtrans-55.6-44.4174.4-66.3169.2-172.800111.3T97 R103 E104 C105T97-E101 PolarHBondContact O-N 3.04Å; E101-R103 PolarHBondContact O-N 3.31Å; E101-E104 WeakPolarHBondContact O-CB 3.33Å; E101-E104 PolarHBondContact O-N 3.46Å; E101-E104 VanDerWaalsContact O-N 3.12Å; E101-C105 PolarHBondContact O-N 3.17Å; E101-C105 PolarHBondContact O-SG 3.09Å; E101-C105 VanDerWaalsContact O-SG 3.41Å
102L96.8Very high93.3Very high55 Ų5573.9 Ų73.929%0.28843%0.429SS..Hα-helixtrans-60.3-32.1176.2-177.260.2000113.2A98 A100 C105 T120 L121 A124A98-L102 WeakPolarHBondContact O-CB 3.46Å; A98-L102 PolarHBondContact O-N 3.41Å; A100-L102 VanDerWaalsContact C-N 3.29Å; A100-L102 PolarHBondContact O-N 3.45Å; L102-C105 PolarHBondContact O-N 3.41Å; L102-T120 HydrophobicContact CB-CG2 4.27Å; L102-T120 HydrophobicContact CD2-CG2 3.79Å; L102-T120 HydrophobicContact CG-CG2 3.81Å; L102-L121 HydrophobicContact CD2-CD2 4.28Å; L102-A124 HydrophobicContact CD1-CB 3.85Å; L102-A124 HydrophobicContact CD2-CB 4.36Å; L102-A124 HydrophobicContact CG-CB 4.3Å
103R95.4Very high92.9Very high68 Ų6873.3 Ų73.326%0.25743%0.426SS..Hα-helixtrans-71.1-35.9177.4-71.6176.1-168.495.1-5.6111.8F99 A100 E101 C105 I106 L115 T120F99-R103 WeakPolarHBondContact O-CG 3.48Å; F99-R103 PolarHBondContact O-N 2.98Å; F99-R103 PolarHBondContact O-NH1 2.95Å; A100-R103 WeakPolarHBondContact O-CB 3.22Å; A100-R103 PolarHBondContact O-N 2.99Å; E101-R103 PolarHBondContact O-N 3.31Å; R103-C105 PolarHBondContact O-N 3.35Å; R103-I106 PolarHBondContact O-N 2.8Å; R103-I106 VanDerWaalsContact O-N 3.08Å; R103-L115 HydrophobicContact CG-CB 4.39Å; R103-L115 HydrophobicContact CG-CD1 4.4Å; R103-L115 PolarHBondContact NE-O 3.04Å; R103-L115 PolarHBondContact NH2-O 3.4Å; R103-L115 VanDerWaalsContact NH2-O 3.13Å; R103-T120 HydrophobicContact CG-CG2 3.65Å; R103-T120 PolarHBondContact NE-OG1 2.91Å
104E94.3Very high92.4Very high162 Ų16279.2 Ų79.276%0.75745%0.45SS*.Hα-helixtrans-64.4-27.7178.1-64.1176.9172.700111.6A100 E101 I106A100-E104 PolarHBondContact O-N 2.85Å; E101-E104 WeakPolarHBondContact O-CB 3.33Å; E101-E104 PolarHBondContact O-N 3.46Å; E101-E104 VanDerWaalsContact O-N 3.12Å; E104-I106 VanDerWaalsContact C-N 3.3Å; E104-I106 PolarHBondContact O-N 2.95Å
105C94.9Very high92Very high81 Ų8175.7 Ų75.755%0.54743%0.425SS..THydrogen-bonded Turntrans-76.4-10.1174.6-56.10000114.4E101 L102 R103 P107 Y127E101-C105 PolarHBondContact O-N 3.17Å; E101-C105 PolarHBondContact O-SG 3.09Å; E101-C105 VanDerWaalsContact O-SG 3.41Å; L102-C105 PolarHBondContact O-N 3.41Å; R103-C105 PolarHBondContact O-N 3.35Å; C105-P107 WeakPolarHBondContact O-CD 3.44Å; C105-Y127 WeakPolarHBondContact O-CE1 3.37Å
106I94.8Very high91.9Very high8 Ų875 Ų754%0.04143%0.425CS..SBendtrans-88.8114.7-178.1-58.9168.2000109.3R103 E104 V109 L115 T120 L123 F145R103-I106 PolarHBondContact O-N 2.8Å; R103-I106 VanDerWaalsContact O-N 3.08Å; E104-I106 VanDerWaalsContact C-N 3.3Å; E104-I106 PolarHBondContact O-N 2.95Å; I106-V109 HydrophobicContact CB-CG2 4.23Å; I106-V109 HydrophobicContact CG2-CG2 3.53Å; I106-L115 HydrophobicContact CD1-CD1 3.81Å; I106-T120 HydrophobicContact CD1-CG2 3.91Å; I106-L123 HydrophobicContact CD1-CB 3.84Å; I106-L123 HydrophobicContact CD1-CD1 4.5Å; I106-L123 HydrophobicContact CG1-CB 4.41Å; I106-L123 HydrophobicContact CG2-CB 3.95Å; I106-L123 HydrophobicContact CG2-CD1 4.27Å; I106-F145 HydrophobicContact CG2-CE1 4.33Å
107P93.6Very high91.8Very high37 Ų3776.5 Ų76.524%0.2443%0.428CS..THydrogen-bonded Turntrans-74.9159.6-177.828.1-30.7000112.2C105 V109 Y127 F145C105-P107 WeakPolarHBondContact O-CD 3.44Å; P107-V109 PolarHBondContact O-N 3.01Å; P107-Y127 HydrophobicContact CG-CD1 4.49Å; P107-Y127 HydrophobicContact CG-CD2 3.79Å; P107-Y127 HydrophobicContact CG-CE1 4.22Å; P107-Y127 HydrophobicContact CG-CE2 3.5Å; P107-Y127 HydrophobicContact CG-CG 4.3Å; P107-F145 HydrophobicContact CG-CB 4.28Å; P107-F145 HydrophobicContact CG-CD1 3.61Å; P107-F145 HydrophobicContact CG-CE1 4.25Å; P107-F145 HydrophobicContact CG-CG 4.18Å
108N88.9Confident91.7Very high123 Ų12376.9 Ų76.966%0.65843%0.427SS*.THydrogen-bonded Turntrans59.623.4177.5-58.3-40.8000114.3F145N108-F145 PolarHBondContact ND2-O 3.41Å
109V87.3Confident91.5Very high26 Ų2675 Ų7516%0.15841%0.409CS..SBendtrans-109.9120.6168.7-178.70000107.4I106 P107 A111 T113 L115 L123 A147 I149I106-V109 HydrophobicContact CB-CG2 4.23Å; I106-V109 HydrophobicContact CG2-CG2 3.53Å; P107-V109 PolarHBondContact O-N 3.01Å; V109-A111 PolarHBondContact O-N 3.34Å; V109-T113 HydrophobicContact CG1-CG2 4.07Å; V109-L115 HydrophobicContact CG1-CD1 3.91Å; V109-L115 HydrophobicContact CG1-CD2 4.4Å; V109-L115 HydrophobicContact CG1-CG 4.08Å; V109-L115 HydrophobicContact CG2-CD1 4.23Å; V109-L123 HydrophobicContact CG2-CD1 4.49Å; V109-A147 HydrophobicContact CG2-CB 3.75Å; V109-I149 HydrophobicContact CG1-CD1 4.12Å; V109-I149 HydrophobicContact CG2-CD1 4.13Å
110P85.3Confident91.4Very high70 Ų7073.4 Ų73.446%0.45540%0.402SS..  trans-57.1139.7174.3-23.633000111.3D112 T113P110-D112 WeakPolarHBondContact CB-OD1 3.34Å; P110-D112 PolarHBondContact O-N 2.94Å; P110-D112 VanDerWaalsContact O-N 3.12Å; P110-T113 WeakPolarHBondContact CB-OG1 3.37Å; P110-T113 WeakPolarHBondContact CD-OG1 3.37Å; P110-T113 WeakPolarHBondContact O-CB 3.41Å; P110-T113 PolarHBondContact O-N 3.21Å; P110-T113 PolarHBondContact O-OG1 3.45Å
111A77.4Confident91.5Very high118 Ų11875.3 Ų75.398%0.97541%0.406SS*.THydrogen-bonded Turntrans-60.9-24.7-174.200000113.8V109V109-A111 PolarHBondContact O-N 3.34Å
112D81.8Confident91.5Very high135 Ų13574.7 Ų74.772%0.72240%0.399SS*.THydrogen-bonded Turntrans-83.8-9.217663.5-38.8000113.5P110 K114P110-D112 WeakPolarHBondContact CB-OD1 3.34Å; P110-D112 PolarHBondContact O-N 2.94Å; P110-D112 VanDerWaalsContact O-N 3.12Å; D112-K114 PolarHBondContact O-N 3.25Å
113T87.6Confident91.4Very high45 Ų4572.7 Ų72.728%0.27639%0.388SS..  trans-73.9114.5-179.4-630000111.4V109 P110 L115 I149V109-T113 HydrophobicContact CG1-CG2 4.07Å; P110-T113 WeakPolarHBondContact CB-OG1 3.37Å; P110-T113 WeakPolarHBondContact CD-OG1 3.37Å; P110-T113 WeakPolarHBondContact O-CB 3.41Å; P110-T113 PolarHBondContact O-N 3.21Å; P110-T113 PolarHBondContact O-OG1 3.45Å; T113-L115 HydrophobicContact CG2-CD2 4.25Å; T113-L115 PolarHBondContact O-N 2.98Å; T113-I149 HydrophobicContact CG2-CD1 4.06Å
114K86.8Confident91.5Very high207 Ų20770.1 Ų70.190%0.938%0.381SS*.  trans-7792175.7-66-170.7178179.20111.6D112D112-K114 PolarHBondContact O-N 3.25Å
115L90.4Very high91.6Very high8 Ų867 Ų674%0.04237%0.373CS..  trans-73.6129.2169.3-64.8177.8000111.6R103 I106 V109 T113 K119 T120 L123 I149R103-L115 HydrophobicContact CG-CB 4.39Å; R103-L115 HydrophobicContact CG-CD1 4.4Å; R103-L115 PolarHBondContact NE-O 3.04Å; R103-L115 PolarHBondContact NH2-O 3.4Å; R103-L115 VanDerWaalsContact NH2-O 3.13Å; I106-L115 HydrophobicContact CD1-CD1 3.81Å; V109-L115 HydrophobicContact CG1-CD1 3.91Å; V109-L115 HydrophobicContact CG1-CD2 4.4Å; V109-L115 HydrophobicContact CG1-CG 4.08Å; V109-L115 HydrophobicContact CG2-CD1 4.23Å; T113-L115 HydrophobicContact CG2-CD2 4.25Å; T113-L115 PolarHBondContact O-N 2.98Å; L115-K119 HydrophobicContact CB-CB 4.48Å; L115-K119 HydrophobicContact CD2-CB 4.35Å; L115-T120 WeakPolarHBondContact CB-OG1 3.5Å; L115-L123 HydrophobicContact CD1-CD1 3.81Å; L115-L123 HydrophobicContact CD2-CD1 3.94Å; L115-I149 HydrophobicContact CD2-CD1 4.19Å; L115-I149 HydrophobicContact CD2-CG2 4.42Å
116S94.4Very high91.7Very high45 Ų4566.2 Ų66.232%0.31537%0.369SS..  trans-63.8160.2169.670.90000111.4I118 K119 T120S116-I118 VanDerWaalsContact C-N 3.3Å; S116-I118 PolarHBondContact O-N 3.38Å; S116-I118 WeakPolarHBondContact OG-CG2 3.43Å; S116-K119 PolarHBondContact O-N 3.05Å; S116-K119 WeakPolarHBondContact OG-CB 3.34Å; S116-K119 VanDerWaalsContact OG-CG 3.22Å; S116-K119 WeakPolarHBondContact OG-CG 3.48Å; S116-K119 PolarHBondContact OG-N 3.36Å; S116-T120 PolarHBondContact O-N 3.38Å; S116-T120 PolarHBondContact O-OG1 3.23Å
117K94.8Very high91.8Very high103 Ų10368.9 Ų68.945%0.44838%0.379SS..Hα-helixtrans-55.7-46.2179.9-67.8-173.9177.6-174.60111.5F99 K119 T120 L121F99-K117 HydrophobicContact CD1-CB 4.47Å; F99-K117 HydrophobicContact CD1-CG 4.2Å; F99-K117 HydrophobicContact CE1-CB 3.71Å; F99-K117 HydrophobicContact CE1-CG 3.88Å; F99-K117 HydrophobicContact CE2-CD 4.27Å; F99-K117 HydrophobicContact CE2-CG 4.35Å; F99-K117 HydrophobicContact CZ-CB 3.79Å; F99-K117 HydrophobicContact CZ-CD 4.26Å; F99-K117 HydrophobicContact CZ-CG 3.95Å; K117-K119 PolarHBondContact O-N 2.71Å; K117-T120 PolarHBondContact O-N 2.95Å; K117-L121 WeakPolarHBondContact O-CG 3.34Å; K117-L121 PolarHBondContact O-N 3.34Å; K117-L121 VanDerWaalsContact O-N 3.08Å
118I95.6Very high92Very high86 Ų8671.9 Ų71.944%0.44139%0.392SS..Hα-helixtrans-64.8-39.2179.2-171.958.1000112.5S116 R122S116-I118 VanDerWaalsContact C-N 3.3Å; S116-I118 PolarHBondContact O-N 3.38Å; S116-I118 WeakPolarHBondContact OG-CG2 3.43Å; I118-R122 VanDerWaalsContact CG1-NE 3.33Å; I118-R122 VanDerWaalsContact O-CD 3.28Å; I118-R122 WeakPolarHBondContact O-CD 3.37Å; I118-R122 VanDerWaalsContact O-CG 3.26Å; I118-R122 WeakPolarHBondContact O-CG 3.43Å; I118-R122 PolarHBondContact O-N 2.96Å; I118-R122 VanDerWaalsContact O-N 3.15Å
119K93Very high92.2Very high12 Ų1268.2 Ų68.25%0.05238%0.378CS..Hα-helixtrans-65.4-45.5176.7-78.6-80.5-172.51630111.7L115 S116 K117 L121 R122 L123 I149 F152L115-K119 HydrophobicContact CB-CB 4.48Å; L115-K119 HydrophobicContact CD2-CB 4.35Å; S116-K119 PolarHBondContact O-N 3.05Å; S116-K119 WeakPolarHBondContact OG-CB 3.34Å; S116-K119 VanDerWaalsContact OG-CG 3.22Å; S116-K119 WeakPolarHBondContact OG-CG 3.48Å; S116-K119 PolarHBondContact OG-N 3.36Å; K117-K119 PolarHBondContact O-N 2.71Å; K119-L121 PolarHBondContact O-N 3.08Å; K119-R122 PolarHBondContact O-N 2.99Å; K119-L123 WeakPolarHBondContact O-CB 3.22Å; K119-L123 WeakPolarHBondContact O-CG 3.48Å; K119-L123 PolarHBondContact O-N 3.08Å; K119-I149 PolarHBondContact NZ-O 3.08Å; K119-F152 VanDerWaalsContact NZ-CB 3.3Å
120T95.6Very high92.6Very high0 Ų069.6 Ų69.60%038%0.381CS..Hα-helixtrans-57.2-50.2178.5-51.60000110.3F99 L102 R103 I106 L115 S116 K117 R122 L123 A124F99-T120 HydrophobicContact CD1-CG2 4.08Å; F99-T120 HydrophobicContact CE1-CG2 4.29Å; L102-T120 HydrophobicContact CB-CG2 4.27Å; L102-T120 HydrophobicContact CD2-CG2 3.79Å; L102-T120 HydrophobicContact CG-CG2 3.81Å; R103-T120 HydrophobicContact CG-CG2 3.65Å; R103-T120 PolarHBondContact NE-OG1 2.91Å; I106-T120 HydrophobicContact CD1-CG2 3.91Å; L115-T120 WeakPolarHBondContact CB-OG1 3.5Å; S116-T120 PolarHBondContact O-N 3.38Å; S116-T120 PolarHBondContact O-OG1 3.23Å; K117-T120 PolarHBondContact O-N 2.95Å; T120-R122 PolarHBondContact O-N 3.36Å; T120-L123 PolarHBondContact O-N 3.44Å; T120-A124 WeakPolarHBondContact O-CB 3.4Å; T120-A124 PolarHBondContact O-N 3.07Å
121L97.3Very high93Very high83 Ų8369.5 Ų69.544%0.43538%0.376SS..Hα-helixtrans-59.6-45.4179.3-67.7175.1000112.3F99 L102 K117 K119 A124 T125F99-L121 HydrophobicContact CE1-CD2 4.29Å; F99-L121 HydrophobicContact CE1-CG 4.14Å; F99-L121 HydrophobicContact CZ-CD1 4.23Å; F99-L121 HydrophobicContact CZ-CD2 4.05Å; F99-L121 HydrophobicContact CZ-CG 4.03Å; L102-L121 HydrophobicContact CD2-CD2 4.28Å; K117-L121 WeakPolarHBondContact O-CG 3.34Å; K117-L121 PolarHBondContact O-N 3.34Å; K117-L121 VanDerWaalsContact O-N 3.08Å; K119-L121 PolarHBondContact O-N 3.08Å; L121-A124 PolarHBondContact O-N 3.38Å; L121-T125 PolarHBondContact O-N 3.3Å; L121-T125 PolarHBondContact O-OG1 3.17Å; L121-T125 VanDerWaalsContact O-OG1 3.05Å
122R95.2Very high93.9Very high97 Ų9769.8 Ų69.837%0.36636%0.359SS..Hα-helixtrans-64.9-46.3-179.6-71.7162.3178.1-11813.5112.7I118 K119 T120 A124 T125 S126 D156I118-R122 VanDerWaalsContact CG1-NE 3.33Å; I118-R122 VanDerWaalsContact O-CD 3.28Å; I118-R122 WeakPolarHBondContact O-CD 3.37Å; I118-R122 VanDerWaalsContact O-CG 3.26Å; I118-R122 WeakPolarHBondContact O-CG 3.43Å; I118-R122 PolarHBondContact O-N 2.96Å; I118-R122 VanDerWaalsContact O-N 3.15Å; K119-R122 PolarHBondContact O-N 2.99Å; T120-R122 PolarHBondContact O-N 3.36Å; R122-A124 VanDerWaalsContact C-N 3.34Å; R122-T125 PolarHBondContact O-N 2.91Å; R122-S126 PolarHBondContact O-N 3.05Å; R122-S126 PolarHBondContact O-OG 3.13Å; R122-D156 IonicContact NH2-OD1 3.61Å
123L95.8Very high94.3Very high13 Ų1368.3 Ų68.37%0.06835%0.351CS..Hα-helixtrans-64.1-40.8179-72.9173.4000111.2I106 V109 L115 K119 T120 S126 Y127 A147I106-L123 HydrophobicContact CD1-CB 3.84Å; I106-L123 HydrophobicContact CD1-CD1 4.5Å; I106-L123 HydrophobicContact CG1-CB 4.41Å; I106-L123 HydrophobicContact CG2-CB 3.95Å; I106-L123 HydrophobicContact CG2-CD1 4.27Å; V109-L123 HydrophobicContact CG2-CD1 4.49Å; L115-L123 HydrophobicContact CD1-CD1 3.81Å; L115-L123 HydrophobicContact CD2-CD1 3.94Å; K119-L123 WeakPolarHBondContact O-CB 3.22Å; K119-L123 WeakPolarHBondContact O-CG 3.48Å; K119-L123 PolarHBondContact O-N 3.08Å; T120-L123 PolarHBondContact O-N 3.44Å; L123-S126 PolarHBondContact O-N 3.48Å; L123-Y127 WeakPolarHBondContact O-CB 3.28Å; L123-Y127 PolarHBondContact O-N 3.34Å; L123-A147 HydrophobicContact CD2-CB 4.14Å
124A97.2Very high94.5Very high13 Ų1368.3 Ų68.311%0.10735%0.351CS..Hα-helixtrans-61.1-46.2174.600000112L102 T120 L121 R122 S126 Y127 I128L102-A124 HydrophobicContact CD1-CB 3.85Å; L102-A124 HydrophobicContact CD2-CB 4.36Å; L102-A124 HydrophobicContact CG-CB 4.3Å; T120-A124 WeakPolarHBondContact O-CB 3.4Å; T120-A124 PolarHBondContact O-N 3.07Å; L121-A124 PolarHBondContact O-N 3.38Å; R122-A124 VanDerWaalsContact C-N 3.34Å; A124-S126 PolarHBondContact O-N 3.46Å; A124-Y127 PolarHBondContact O-N 3.15Å; A124-I128 WeakPolarHBondContact O-CG1 3.36Å; A124-I128 PolarHBondContact O-N 3.18Å
125T97Very high94.8Very high96 Ų9665.3 Ų65.359%0.58934%0.344SS*.Hα-helixtrans-59.5-45.8175.4-57.20000111.8L121 R122 Y127 I128 A129L121-T125 PolarHBondContact O-N 3.3Å; L121-T125 PolarHBondContact O-OG1 3.17Å; L121-T125 VanDerWaalsContact O-OG1 3.05Å; R122-T125 PolarHBondContact O-N 2.91Å; T125-Y127 VanDerWaalsContact C-N 3.28Å; T125-Y127 PolarHBondContact O-N 3.37Å; T125-I128 PolarHBondContact O-N 3.5Å; T125-A129 PolarHBondContact O-N 3.41Å; T125-A129 VanDerWaalsContact O-N 3.09Å
126S96Very high94.7Very high65 Ų6568.7 Ų68.746%0.45537%0.373SS..Hα-helixtrans-63-35.6176.5-64.30000112.4R122 L123 A124 Y130R122-S126 PolarHBondContact O-N 3.05Å; R122-S126 PolarHBondContact O-OG 3.13Å; L123-S126 PolarHBondContact O-N 3.48Å; A124-S126 PolarHBondContact O-N 3.46Å; S126-Y130 WeakPolarHBondContact O-CB 3.4Å; S126-Y130 PolarHBondContact O-N 2.99Å
127Y97.1Very high94.3Very high65 Ų6571.5 Ų71.526%0.25538%0.38SS..Hα-helixtrans-70.6-41179-176.1-133.6000111.9C105 P107 L123 A124 T125 A129 Y130 L131 F145C105-Y127 WeakPolarHBondContact O-CE1 3.37Å; P107-Y127 HydrophobicContact CG-CD1 4.49Å; P107-Y127 HydrophobicContact CG-CD2 3.79Å; P107-Y127 HydrophobicContact CG-CE1 4.22Å; P107-Y127 HydrophobicContact CG-CE2 3.5Å; P107-Y127 HydrophobicContact CG-CG 4.3Å; L123-Y127 WeakPolarHBondContact O-CB 3.28Å; L123-Y127 PolarHBondContact O-N 3.34Å; A124-Y127 PolarHBondContact O-N 3.15Å; T125-Y127 VanDerWaalsContact C-N 3.28Å; T125-Y127 PolarHBondContact O-N 3.37Å; Y127-A129 PolarHBondContact O-N 3.39Å; Y127-Y130 AromaticContact CD2-CD1 3.97Å; Y127-Y130 HydrophobicContact CD2-CD1 3.97Å; Y127-Y130 AromaticContact CE2-CD1 3.96Å; Y127-Y130 HydrophobicContact CE2-CD1 3.96Å; Y127-Y130 HydrophobicContact CE2-CE1 4.37Å; Y127-Y130 WeakPolarHBondContact O-CB 3.26Å; Y127-Y130 PolarHBondContact O-N 3.32Å; Y127-L131 HydrophobicContact CD1-CD1 4.23Å; Y127-L131 HydrophobicContact CD2-CD1 4.5Å; Y127-L131 HydrophobicContact CD2-CG 4.2Å; Y127-L131 HydrophobicContact CE1-CD1 3.81Å; Y127-L131 HydrophobicContact CE1-CG 4.45Å; Y127-L131 HydrophobicContact CE2-CD1 4.08Å; Y127-L131 HydrophobicContact CE2-CD2 3.81Å; Y127-L131 HydrophobicContact CE2-CG 3.81Å; Y127-L131 WeakPolarHBondContact O-CG 3.36Å; Y127-L131 PolarHBondContact O-N 3.38Å; Y127-F145 VanDerWaalsContact CA-CE2 3.46Å; Y127-F145 HydrophobicContact CD2-CB 4.17Å; Y127-F145 HydrophobicContact CD2-CD1 4.22Å; Y127-F145 AromaticContact CD2-CD2 3.83Å; Y127-F145 HydrophobicContact CD2-CD2 3.83Å; Y127-F145 HydrophobicContact CD2-CE2 4.24Å; Y127-F145 AromaticContact CD2-CG 3.8Å; Y127-F145 HydrophobicContact CD2-CG 3.8Å; Y127-F145 HydrophobicContact CE2-CB 4.4Å; Y127-F145 HydrophobicContact CE2-CG 4.46Å
128I96.8Very high93.2Very high100 Ų10074.7 Ų74.751%0.51340%0.402SS..Hα-helixtrans-58.1-49.4172.7-66.9165.7000110.3A124 T125 Y130 L131 M132A124-I128 WeakPolarHBondContact O-CG1 3.36Å; A124-I128 PolarHBondContact O-N 3.18Å; T125-I128 PolarHBondContact O-N 3.5Å; I128-Y130 VanDerWaalsContact C-N 3.32Å; I128-Y130 PolarHBondContact O-N 2.93Å; I128-L131 PolarHBondContact O-N 3.22Å; I128-M132 HydrophobicContact CG2-CG 4.44Å; I128-M132 HydrophobicContact CG2-SD 4.03Å; I128-M132 VanDerWaalsContact O-CG 3.31Å; I128-M132 WeakPolarHBondContact O-CG 2.75Å; I128-M132 PolarHBondContact O-N 3.14Å
129A95.1Very high91.8Very high45 Ų4574 Ų7437%0.37240%0.404SS..Hα-helixtrans-58.3-43.817800000112.1T125 Y127 L131 M132 D133T125-A129 PolarHBondContact O-N 3.41Å; T125-A129 VanDerWaalsContact O-N 3.09Å; Y127-A129 PolarHBondContact O-N 3.39Å; A129-L131 PolarHBondContact O-N 3.19Å; A129-M132 WeakPolarHBondContact O-CB 3.28Å; A129-M132 PolarHBondContact O-N 2.78Å; A129-D133 PolarHBondContact O-N 3.07Å
130Y94.6Very high90.4Very high55 Ų5577.5 Ų77.522%0.21644%0.444CS..Hα-helixtrans-58.2-47.9174.6167.2-101.6000112.4S126 Y127 I128 M132 D133 V134 E143 F145S126-Y130 WeakPolarHBondContact O-CB 3.4Å; S126-Y130 PolarHBondContact O-N 2.99Å; Y127-Y130 AromaticContact CD2-CD1 3.97Å; Y127-Y130 HydrophobicContact CD2-CD1 3.97Å; Y127-Y130 AromaticContact CE2-CD1 3.96Å; Y127-Y130 HydrophobicContact CE2-CD1 3.96Å; Y127-Y130 HydrophobicContact CE2-CE1 4.37Å; Y127-Y130 WeakPolarHBondContact O-CB 3.26Å; Y127-Y130 PolarHBondContact O-N 3.32Å; I128-Y130 VanDerWaalsContact C-N 3.32Å; I128-Y130 PolarHBondContact O-N 2.93Å; Y130-M132 VanDerWaalsContact C-N 3.29Å; Y130-M132 PolarHBondContact O-N 2.85Å; Y130-D133 PolarHBondContact O-N 3.43Å; Y130-V134 HydrophobicContact CD1-CG2 4.22Å; Y130-V134 HydrophobicContact CD2-CG2 4.09Å; Y130-V134 HydrophobicContact CE1-CG2 3.77Å; Y130-V134 HydrophobicContact CE2-CG2 3.58Å; Y130-V134 HydrophobicContact CG-CG2 4.39Å; Y130-V134 VanDerWaalsContact CZ-CG2 3.42Å; Y130-V134 VanDerWaalsContact O-CG2 3.25Å; Y130-V134 WeakPolarHBondContact O-CG2 3.28Å; Y130-V134 PolarHBondContact O-N 2.98Å; Y130-E143 WeakPolarHBondContact CE2-O 3.41Å; Y130-E143 PolarHBondContact OH-O 3.4Å; Y130-F145 HydrophobicContact CD1-CB 3.81Å; Y130-F145 HydrophobicContact CD1-CD2 4.25Å; Y130-F145 HydrophobicContact CD1-CG 4.46Å; Y130-F145 HydrophobicContact CE1-CB 3.88Å; Y130-F145 HydrophobicContact CG-CB 4.15Å; Y130-F145 HydrophobicContact CG-CD2 4.05Å
131L94.6Very high88.8Confident68 Ų6885.3 Ų85.336%0.35648%0.481SS..Hα-helixtrans-62.8-37178.6-68.4176.7000112Y127 I128 A129 V134 L135Y127-L131 HydrophobicContact CD1-CD1 4.23Å; Y127-L131 HydrophobicContact CD2-CD1 4.5Å; Y127-L131 HydrophobicContact CD2-CG 4.2Å; Y127-L131 HydrophobicContact CE1-CD1 3.81Å; Y127-L131 HydrophobicContact CE1-CG 4.45Å; Y127-L131 HydrophobicContact CE2-CD1 4.08Å; Y127-L131 HydrophobicContact CE2-CD2 3.81Å; Y127-L131 HydrophobicContact CE2-CG 3.81Å; Y127-L131 WeakPolarHBondContact O-CG 3.36Å; Y127-L131 PolarHBondContact O-N 3.38Å; I128-L131 PolarHBondContact O-N 3.22Å; A129-L131 PolarHBondContact O-N 3.19Å; L131-V134 PolarHBondContact O-N 3.48Å; L131-L135 VanDerWaalsContact O-CG 3.27Å; L131-L135 WeakPolarHBondContact O-CG 3.25Å; L131-L135 PolarHBondContact O-N 3.49Å
132M94.8Very high87.5Confident124 Ų12483.3 Ų83.361%0.61147%0.472SS*.Hα-helixtrans-62.5-44174.4-67.2175.770.400111.7I128 A129 Y130 L135 A136I128-M132 HydrophobicContact CG2-CG 4.44Å; I128-M132 HydrophobicContact CG2-SD 4.03Å; I128-M132 VanDerWaalsContact O-CG 3.31Å; I128-M132 WeakPolarHBondContact O-CG 2.75Å; I128-M132 PolarHBondContact O-N 3.14Å; A129-M132 WeakPolarHBondContact O-CB 3.28Å; A129-M132 PolarHBondContact O-N 2.78Å; Y130-M132 VanDerWaalsContact C-N 3.29Å; Y130-M132 PolarHBondContact O-N 2.85Å; M132-L135 PolarHBondContact O-N 2.96Å; M132-A136 WeakPolarHBondContact O-CB 3.41Å; M132-A136 PolarHBondContact O-N 2.96Å; M132-A136 VanDerWaalsContact O-N 3.07Å
133D91.3Very high86.6Confident104 Ų10487.5 Ų87.556%0.55650%0.496SS*.Hα-helixtrans-65.1-39.7176.8-68.5-18000111.8A129 Y130 A136 K137A129-D133 PolarHBondContact O-N 3.07Å; Y130-D133 PolarHBondContact O-N 3.43Å; D133-A136 PolarHBondContact O-N 3.14Å; D133-K137 VanDerWaalsContact O-CG 3.28Å; D133-K137 WeakPolarHBondContact O-CG 3.2Å; D133-K137 PolarHBondContact O-N 3.08Å
134V92.1Very high86Confident45 Ų4589.6 Ų89.627%0.27352%0.52SS..Hα-helixtrans-61-45.1175.41720000111.1Y130 L131 A136 K137 T142Y130-V134 HydrophobicContact CD1-CG2 4.22Å; Y130-V134 HydrophobicContact CD2-CG2 4.09Å; Y130-V134 HydrophobicContact CE1-CG2 3.77Å; Y130-V134 HydrophobicContact CE2-CG2 3.58Å; Y130-V134 HydrophobicContact CG-CG2 4.39Å; Y130-V134 VanDerWaalsContact CZ-CG2 3.42Å; Y130-V134 VanDerWaalsContact O-CG2 3.25Å; Y130-V134 WeakPolarHBondContact O-CG2 3.28Å; Y130-V134 PolarHBondContact O-N 2.98Å; L131-V134 PolarHBondContact O-N 3.48Å; V134-A136 VanDerWaalsContact C-N 3.27Å; V134-A136 PolarHBondContact O-N 2.94Å; V134-K137 PolarHBondContact O-N 3.17Å; V134-T142 HydrophobicContact CB-CG2 4.45Å; V134-T142 HydrophobicContact CG2-CG2 3.95Å
135L91.4Very high85.7Confident145 Ų14590 Ų9076%0.75952%0.52SS*.Hα-helixtrans-68.8-25.7179.2-69.8171.9000113.1L131 M132L131-L135 VanDerWaalsContact O-CG 3.27Å; L131-L135 WeakPolarHBondContact O-CG 3.25Å; L131-L135 PolarHBondContact O-N 3.49Å; M132-L135 PolarHBondContact O-N 2.96Å
136A89.7Confident85.2Confident79 Ų7993.4 Ų93.465%0.65353%0.526SS*.Hα-helixtrans-82.8-18.2177.800000113.6M132 D133 V134M132-A136 WeakPolarHBondContact O-CB 3.41Å; M132-A136 PolarHBondContact O-N 2.96Å; M132-A136 VanDerWaalsContact O-N 3.07Å; D133-A136 PolarHBondContact O-N 3.14Å; V134-A136 VanDerWaalsContact C-N 3.27Å; V134-A136 PolarHBondContact O-N 2.94Å
137K85.8Confident84.8Confident103 Ų10391 Ų9145%0.44851%0.511SS..  trans-98.8110-179.1-67.1174.378.5-165.20109.6D133 V134 S139 E141 T142D133-K137 VanDerWaalsContact O-CG 3.28Å; D133-K137 WeakPolarHBondContact O-CG 3.2Å; D133-K137 PolarHBondContact O-N 3.08Å; V134-K137 PolarHBondContact O-N 3.17Å; K137-S139 PolarHBondContact O-N 3.48Å; K137-E141 PolarHBondContact NZ-O 3.27Å; K137-E141 VanDerWaalsContact NZ-O 3.13Å; K137-T142 HydrophobicContact CD-CG2 4.06Å
138D72.1Confident84Confident170 Ų17093 Ų9391%0.90952%0.522SS*.SBendtrans-68.7-13176.6-66.3-34.8000113.6
139S66.2Low83.1Confident71 Ų7191.1 Ų91.150%0.49751%0.513SS..SBendtrans-93.3118.6173.5580000110.2K137 E141K137-S139 PolarHBondContact O-N 3.48Å; S139-E141 PolarHBondContact O-N 3.17Å
140G64Low81.7Confident86 Ų8698.4 Ų98.489%0.88754%0.536SS*.SBendtrans-63.521.8-179.400000116.2
141E61.3Low80Confident165 Ų165102.7 Ų102.777%0.77156%0.556SS**  trans-101.781.4176.1-59.9-168.4-177.900109.4K137 S139K137-E141 PolarHBondContact NZ-O 3.27Å; K137-E141 VanDerWaalsContact NZ-O 3.13Å; S139-E141 PolarHBondContact O-N 3.17Å
142T70.3Confident78.2Confident40 Ų40102 Ų10225%0.24555%0.55CS..  trans-122.5122.6170.861.20000108.8V134 K137 G144V134-T142 HydrophobicContact CB-CG2 4.45Å; V134-T142 HydrophobicContact CG2-CG2 3.95Å; K137-T142 HydrophobicContact CD-CG2 4.06Å; T142-G144 PolarHBondContact O-N 3.27Å
143E75.7Confident76.4Confident186 Ų186102.4 Ų102.487%0.86955%0.55SS**PPolyproline II helixtrans-56.3132172.8-62.4-138.5148.300109.5Y130Y130-E143 WeakPolarHBondContact CE2-O 3.41Å; Y130-E143 PolarHBondContact OH-O 3.4Å
144G84Confident74.8Confident57 Ų57102.6 Ų102.659%0.58856%0.555SS**PPolyproline II helixtrans-58.6147-176.800000112.5T142 K146T142-G144 PolarHBondContact O-N 3.27Å; G144-K146 PolarHBondContact O-N 2.96Å
145F90.6Very high73.3Confident21 Ų21108.1 Ų108.19%0.09257%0.571CS.*PPolyproline II helixtrans-55.6124.8178.4179.4-95.7000112.1I106 P107 N108 Y127 Y130 A147I106-F145 HydrophobicContact CG2-CE1 4.33Å; P107-F145 HydrophobicContact CG-CB 4.28Å; P107-F145 HydrophobicContact CG-CD1 3.61Å; P107-F145 HydrophobicContact CG-CE1 4.25Å; P107-F145 HydrophobicContact CG-CG 4.18Å; N108-F145 PolarHBondContact ND2-O 3.41Å; Y127-F145 VanDerWaalsContact CA-CE2 3.46Å; Y127-F145 HydrophobicContact CD2-CB 4.17Å; Y127-F145 HydrophobicContact CD2-CD1 4.22Å; Y127-F145 AromaticContact CD2-CD2 3.83Å; Y127-F145 HydrophobicContact CD2-CD2 3.83Å; Y127-F145 HydrophobicContact CD2-CE2 4.24Å; Y127-F145 AromaticContact CD2-CG 3.8Å; Y127-F145 HydrophobicContact CD2-CG 3.8Å; Y127-F145 HydrophobicContact CE2-CB 4.4Å; Y127-F145 HydrophobicContact CE2-CG 4.46Å; Y130-F145 HydrophobicContact CD1-CB 3.81Å; Y130-F145 HydrophobicContact CD1-CD2 4.25Å; Y130-F145 HydrophobicContact CD1-CG 4.46Å; Y130-F145 HydrophobicContact CE1-CB 3.88Å; Y130-F145 HydrophobicContact CG-CB 4.15Å; Y130-F145 HydrophobicContact CG-CD2 4.05Å; F145-A147 HydrophobicContact CE1-CB 3.99Å
146K85.9Confident71.8Confident167 Ų167103.9 Ų103.973%0.72655%0.549SS*.  trans-109.3108.3178.8-165.7178-173.5178.90111.2G144 E148G144-K146 PolarHBondContact O-N 2.96Å; K146-E148 PolarHBondContact O-N 3.17Å
147A86.9Confident70.3Confident16 Ų16104.7 Ų104.713%0.13254%0.542CS..  trans-70.998175.200000111V109 L123 F145 I149V109-A147 HydrophobicContact CG2-CB 3.75Å; L123-A147 HydrophobicContact CD2-CB 4.14Å; F145-A147 HydrophobicContact CE1-CB 3.99Å; A147-I149 HydrophobicContact CB-CG1 4.46Å; A147-I149 PolarHBondContact O-N 2.73Å
148E80.6Confident69Low107 Ų107106 Ų10650%0.555%0.548SS..  trans-76.290.3176.1-70.6-152.3156.600112.4K146K146-E148 PolarHBondContact O-N 3.17Å
149I78.5Confident68.4Low60 Ų60105.2 Ų105.231%0.30853%0.532SS..  trans-80.1-28.4-178.5-52.6-169.1000112.5V109 T113 L115 K119 A147V109-I149 HydrophobicContact CG1-CD1 4.12Å; V109-I149 HydrophobicContact CG2-CD1 4.13Å; T113-I149 HydrophobicContact CG2-CD1 4.06Å; L115-I149 HydrophobicContact CD2-CD1 4.19Å; L115-I149 HydrophobicContact CD2-CG2 4.42Å; K119-I149 PolarHBondContact NZ-O 3.08Å; A147-I149 HydrophobicContact CB-CG1 4.46Å; A147-I149 PolarHBondContact O-N 2.73Å
150K65.4Low68.1Low198 Ų198109.1 Ų109.186%0.86154%0.54SS*.SBendtrans-89.6-15.4-156.6-139.9165.9-177.4169.50117.6
151K59.3Low67.8Low144 Ų144113.2 Ų113.263%0.62653%0.529SS*.SBendtrans-109.3-20.1-164.5-64.8178.1-178.2168.60116.4
152F55.9Low67.6Low54 Ų54110.9 Ų110.924%0.23752%0.518CS..Hα-helixtrans-77-31-168.6-164-97.5000114.4K119 T154 D156K119-F152 VanDerWaalsContact NZ-CB 3.3Å; F152-T154 PolarHBondContact O-N 3.12Å; F152-D156 HydrophobicContact CE1-CB 4.04Å; F152-D156 WeakPolarHBondContact CE1-OD1 3.47Å; F152-D156 VanDerWaalsContact CE1-OD2 3.28Å; F152-D156 WeakPolarHBondContact CE1-OD2 3.43Å; F152-D156 WeakPolarHBondContact CE2-OD2 3.25Å; F152-D156 HydrophobicContact CZ-CB 4.3Å; F152-D156 VanDerWaalsContact CZ-OD1 3.25Å; F152-D156 WeakPolarHBondContact CZ-OD1 3.43Å; F152-D156 WeakPolarHBondContact CZ-OD2 3.45Å
153E56.6Low66.9Low133 Ų133115.9 Ų115.962%0.62154%0.543SS*.Hα-helixtrans-65.3-38-174.6-63.2-155.5147.400112.6R155 L157E153-R155 PolarHBondContact O-N 3.34Å; E153-L157 WeakPolarHBondContact O-CB 3.49Å; E153-L157 PolarHBondContact O-N 2.97Å; E153-L157 VanDerWaalsContact O-N 3.07Å
154T58.4Low66Low107 Ų107111.2 Ų111.266%0.65653%0.527SS*.Hα-helixtrans-67.8-35.8-174.5-30.20000113F152 K158F152-T154 PolarHBondContact O-N 3.12Å; T154-K158 VanDerWaalsContact O-CB 3.25Å; T154-K158 WeakPolarHBondContact O-CB 3.48Å; T154-K158 PolarHBondContact O-N 3.49Å; T154-K158 VanDerWaalsContact O-N 3.17Å
155R59.8Low64.4Low162 Ų162113.9 Ų113.961%0.61153%0.527SS*.Hα-helixtrans-75.1-42.1-178-103.8-175.455.2179-5.2112.8E153 K158 R159E153-R155 PolarHBondContact O-N 3.34Å; R155-K158 PolarHBondContact O-N 3.01Å; R155-R159 PolarHBondContact O-N 3.2Å
156D59.8Low62.5Low55 Ų55116.1 Ų116.129%0.29456%0.556SS.*Hα-helixtrans-77.8-33.8-178.8-80.4-126.3000111.9R122 F152 K158 R159 K160R122-D156 IonicContact NH2-OD1 3.61Å; F152-D156 HydrophobicContact CE1-CB 4.04Å; F152-D156 WeakPolarHBondContact CE1-OD1 3.47Å; F152-D156 VanDerWaalsContact CE1-OD2 3.28Å; F152-D156 WeakPolarHBondContact CE1-OD2 3.43Å; F152-D156 WeakPolarHBondContact CE2-OD2 3.25Å; F152-D156 HydrophobicContact CZ-CB 4.3Å; F152-D156 VanDerWaalsContact CZ-OD1 3.25Å; F152-D156 WeakPolarHBondContact CZ-OD1 3.43Å; F152-D156 WeakPolarHBondContact CZ-OD2 3.45Å; D156-K158 VanDerWaalsContact C-N 3.31Å; D156-R159 PolarHBondContact O-N 3.1Å; D156-K160 WeakPolarHBondContact O-CB 3.03Å; D156-K160 PolarHBondContact O-N 3.3Å
157L58.9Low60.9Low97 Ų97114.8 Ų114.851%0.50856%0.556SS.*Hα-helixtrans-66.6-35.9172.2-149.873.6000111.3E153 R161E153-L157 WeakPolarHBondContact O-CB 3.49Å; E153-L157 PolarHBondContact O-N 2.97Å; E153-L157 VanDerWaalsContact O-N 3.07Å; L157-R161 VanDerWaalsContact O-CG 3.28Å; L157-R161 WeakPolarHBondContact O-CG 3.28Å; L157-R161 PolarHBondContact O-N 2.64Å; L157-R161 VanDerWaalsContact O-N 3.08Å
158K57.9Low59Low131 Ų131120.9 Ų120.957%0.5758%0.582SS**Hα-helixtrans-68.7-46.1174.3-175.6146.1-178.5178.50112.3T154 R155 D156 K160 R161 E162T154-K158 VanDerWaalsContact O-CB 3.25Å; T154-K158 WeakPolarHBondContact O-CB 3.48Å; T154-K158 PolarHBondContact O-N 3.49Å; T154-K158 VanDerWaalsContact O-N 3.17Å; R155-K158 PolarHBondContact O-N 3.01Å; D156-K158 VanDerWaalsContact C-N 3.31Å; K158-K160 VanDerWaalsContact C-N 3.3Å; K158-K160 PolarHBondContact O-N 3.36Å; K158-R161 PolarHBondContact O-N 2.95Å; K158-R161 VanDerWaalsContact O-N 3.12Å; K158-E162 WeakPolarHBondContact CE-OE1 3.42Å; K158-E162 HydrophobicContact CG-CG 4.49Å; K158-E162 VanDerWaalsContact CG-OE1 3.32Å; K158-E162 WeakPolarHBondContact CG-OE1 3.32Å; K158-E162 WeakPolarHBondContact O-CG 3.41Å; K158-E162 PolarHBondContact O-N 3.26Å
159R59.8Low57.2Low153 Ų153124.2 Ų124.258%0.57760%0.598SS**Hα-helixtrans-61.4-36175.7-168.2-177.3-69.4-175.7-6.3112.6R155 D156 L163R155-R159 PolarHBondContact O-N 3.2Å; D156-R159 PolarHBondContact O-N 3.1Å; R159-L163 PolarHBondContact O-N 2.82Å
160K60Low55.6Low152 Ų152126 Ų12666%0.66161%0.612SS**Hα-helixtrans-69.9-36.6173.8-82.8-162.873.6177.30113.1D156 K158 T164D156-K160 WeakPolarHBondContact O-CB 3.03Å; D156-K160 PolarHBondContact O-N 3.3Å; K158-K160 VanDerWaalsContact C-N 3.3Å; K158-K160 PolarHBondContact O-N 3.36Å; K160-T164 PolarHBondContact O-N 2.9Å; K160-T164 PolarHBondContact O-OG1 3.07Å
161R57.6Low54.3Low172 Ų172125.4 Ų125.465%0.64961%0.609SS**Hα-helixtrans-66.6-44.8176.7-74.5170.1-173.4-173.60.8111.2L157 K158 L163 T164 D165L157-R161 VanDerWaalsContact O-CG 3.28Å; L157-R161 WeakPolarHBondContact O-CG 3.28Å; L157-R161 PolarHBondContact O-N 2.64Å; L157-R161 VanDerWaalsContact O-N 3.08Å; K158-R161 PolarHBondContact O-N 2.95Å; K158-R161 VanDerWaalsContact O-N 3.12Å; R161-L163 VanDerWaalsContact C-N 3.32Å; R161-L163 PolarHBondContact O-N 3.42Å; R161-T164 PolarHBondContact O-N 3.12Å; R161-T164 VanDerWaalsContact O-N 3.1Å; R161-D165 WeakPolarHBondContact O-CB 3.48Å; R161-D165 PolarHBondContact O-N 2.8Å
162E57.1Low53.2Low116 Ų116121.9 Ų121.954%0.54262%0.615SS.*Hα-helixtrans-61.8-36.8179.2-70.2170.1-178.400112.8K158 T164K158-E162 WeakPolarHBondContact CE-OE1 3.42Å; K158-E162 HydrophobicContact CG-CG 4.49Å; K158-E162 VanDerWaalsContact CG-OE1 3.32Å; K158-E162 WeakPolarHBondContact CG-OE1 3.32Å; K158-E162 WeakPolarHBondContact O-CG 3.41Å; K158-E162 PolarHBondContact O-N 3.26Å; E162-T164 VanDerWaalsContact C-N 3.34Å
163L56.8Low52.7Low146 Ų146123.4 Ų123.476%0.76465%0.645SS**Hα-helixtrans-76.4-21.6177.1-155.6123.1000113.5R159 R161R159-L163 PolarHBondContact O-N 2.82Å; R161-L163 VanDerWaalsContact C-N 3.32Å; R161-L163 PolarHBondContact O-N 3.42Å
164T55.9Low52.1Low88 Ų88125.3 Ų125.354%0.5465%0.654SS.*Hα-helixtrans-88.5-32.8179.4-45.60000111.3K160 R161 E162 L167K160-T164 PolarHBondContact O-N 2.9Å; K160-T164 PolarHBondContact O-OG1 3.07Å; R161-T164 PolarHBondContact O-N 3.12Å; R161-T164 VanDerWaalsContact O-N 3.1Å; E162-T164 VanDerWaalsContact C-N 3.34Å; T164-L167 PolarHBondContact O-N 2.67Å
165D51.2Low51.9Low112 Ų112130 Ų13060%0.59967%0.665SS**Hα-helixtrans-68.4-36.4179.2-155.437.4000112R161 L167 Q168R161-D165 WeakPolarHBondContact O-CB 3.48Å; R161-D165 PolarHBondContact O-N 2.8Å; D165-L167 PolarHBondContact O-N 3.15Å; D165-L167 VanDerWaalsContact O-N 3.15Å; D165-Q168 PolarHBondContact O-N 3.41Å
166G49.5Very low51.6Low68 Ų68131.1 Ų131.170%0.70168%0.675SS**THydrogen-bonded Turntrans-67.4-11.4176.900000115.8
167L53.8Low51.6Low139 Ų139134.9 Ų134.973%0.72870%0.699SS**THydrogen-bonded Turntrans-102.2-11.7178.6-167.463000112.7T164 D165T164-L167 PolarHBondContact O-N 2.67Å; D165-L167 PolarHBondContact O-N 3.15Å; D165-L167 VanDerWaalsContact O-N 3.15Å
168Q45.7Very low51.6Low144 Ų144137.5 Ų137.567%0.67371%0.707SS**THydrogen-bonded Turntrans-89.7-16.2-173.7-165.9162.613.400113.8D165 T170D165-Q168 PolarHBondContact O-N 3.41Å; Q168-T170 PolarHBondContact O-N 3.26Å; Q168-T170 VanDerWaalsContact O-N 3.12Å
169E43.4Very low51.7Low177 Ų177132.7 Ų132.783%0.82769%0.694SS**THydrogen-bonded Turntrans-72.12.2-178.4-82.6-7411200115.1
170T43.8Very low52Low99 Ų99138 Ų13861%0.60771%0.714SS**THydrogen-bonded Turntrans-113.9-4.1-176.557.60000116.4Q168Q168-T170 PolarHBondContact O-N 3.26Å; Q168-T170 VanDerWaalsContact O-N 3.12Å
171F39.1Very low52.6Low184 Ų184133.8 Ų133.881%0.80770%0.701SS**SBendtrans-133.2109.4179.5-74.9-81.9000112.9
172G36.2Very low53.2Low71 Ų71127 Ų12773%0.73268%0.684SS**  trans-53.7157.7179.900000115E174G172-E174 PolarHBondContact O-N 2.85Å; G172-E174 VanDerWaalsContact O-N 3.17Å
173G46.1Very low53.9Low85 Ų85129.2 Ų129.288%0.87669%0.688SS**  trans-62.2109.4-171.800000114.1
174E43.2Very low54.9Low174 Ų174125.1 Ų125.181%0.81367%0.67SS**  trans-124.4126.7160.1-63.1-170.6119.300109.4G172 K176G172-E174 PolarHBondContact O-N 2.85Å; G172-E174 VanDerWaalsContact O-N 3.17Å; E174-K176 PolarHBondContact O-N 3Å
175K54.8Low55.4Low205 Ų205127.8 Ų127.889%0.89168%0.676SS**  trans-7291.1-170.5-44.7177.8-170.2172.80108.4V177K175-V177 PolarHBondContact O-N 2.8Å
176K53.6Low56.3Low186 Ų186129.3 Ų129.381%0.80968%0.68SS**  trans-64.9102.9-179.4-77.9166.1178.7166.70110.9E174 K178E174-K176 PolarHBondContact O-N 3Å; K176-K178 VanDerWaalsContact C-N 3.35Å; K176-K178 PolarHBondContact O-N 2.91Å
177V59.1Low57.4Low133 Ų133129.4 Ų129.481%0.80667%0.667SS**  trans-64.497.7162.8173.20000107.4K175 G179K175-V177 PolarHBondContact O-N 2.8Å; V177-G179 PolarHBondContact O-N 3.11Å; V177-G179 VanDerWaalsContact O-N 3.16Å
178K59.5Low58Low153 Ų153129.4 Ų129.467%0.66566%0.657SS**  trans-73.1104178.7-167.476.9144.9179.30108K176 G182K176-K178 VanDerWaalsContact C-N 3.35Å; K176-K178 PolarHBondContact O-N 2.91Å; K178-G182 VanDerWaalsContact CE-CA 3.43Å; K178-G182 WeakPolarHBondContact CE-O 3.17Å; K178-G182 PolarHBondContact NZ-O 2.95Å
179G60.2Low59.1Low30 Ų30125.6 Ų125.631%0.30965%0.651SS.*  trans-61.4169.2170.300000112.5V177 T181 G182V177-G179 PolarHBondContact O-N 3.11Å; V177-G179 VanDerWaalsContact O-N 3.16Å; G179-T181 PolarHBondContact O-N 3.4Å; G179-G182 PolarHBondContact O-N 3.16Å
180R66.1Low60.1Low263 Ų263124 Ų12499%0.99265%0.647SS**THydrogen-bonded Turntrans-48.4-25.8-172.7-76.6-174.5-83-133.7-1.9116.4
181T71.2Confident61Low65 Ų65127.1 Ų127.140%0.39966%0.655SS.*THydrogen-bonded Turntrans-103.5-1.5-172.354.20000114.2G179 W183 W188G179-T181 PolarHBondContact O-N 3.4Å; T181-W183 VanDerWaalsContact O-CD1 3.31Å; T181-W183 PolarHBondContact O-N 3.07Å; T181-W183 VanDerWaalsContact O-N 3.12Å; T181-W188 VanDerWaalsContact CB-CH2 3.48Å; T181-W188 HydrophobicContact CG2-CH2 3.2Å; T181-W188 HydrophobicContact CG2-CZ2 3.57Å; T181-W188 HydrophobicContact CG2-CZ3 4.29Å; T181-W188 WeakPolarHBondContact OG1-CH2 2.91Å; T181-W188 WeakPolarHBondContact OG1-CZ2 3.36Å
182G71.1Confident61.9Low28 Ų28125.5 Ų125.529%0.28965%0.653SS.*SBendtrans70.52.7178.200000114.9K178 G179K178-G182 VanDerWaalsContact CE-CA 3.43Å; K178-G182 WeakPolarHBondContact CE-O 3.17Å; K178-G182 PolarHBondContact NZ-O 2.95Å; G179-G182 PolarHBondContact O-N 3.16Å
183W72.4Confident62.8Low163 Ų163129.3 Ų129.362%0.61766%0.657SS**SBendtrans-94.3144.5172.6-72.892.6000110.9T181 Q185T181-W183 VanDerWaalsContact O-CD1 3.31Å; T181-W183 PolarHBondContact O-N 3.07Å; T181-W183 VanDerWaalsContact O-N 3.12Å; W183-Q185 PolarHBondContact O-N 2.92Å
184P76.6Confident63Low60 Ų60137.7 Ų137.739%0.3967%0.674SS.*  trans-61.1131.5173.6-18.531.1000110.2Q186 V187P184-Q186 HydrophobicContact CB-CG 4.04Å; P184-Q186 PolarHBondContact O-N 3.12Å; P184-Q186 VanDerWaalsContact O-N 3.11Å; P184-V187 HydrophobicContact CB-CG2 4.14Å; P184-V187 HydrophobicContact CG-CG2 4.26Å; P184-V187 WeakPolarHBondContact O-CB 3.1Å; P184-V187 PolarHBondContact O-N 3.36Å
185Q67.8Low64Low144 Ų144135.9 Ų135.967%0.67367%0.667SS**Hα-helixtrans-58.6-31.5-170.6-155.1146.5-4.400113.5W183 V187 W188 A189W183-Q185 PolarHBondContact O-N 2.92Å; Q185-V187 VanDerWaalsContact C-N 3.28Å; Q185-V187 PolarHBondContact O-N 3.44Å; Q185-W188 PolarHBondContact O-N 3.4Å; Q185-A189 PolarHBondContact O-N 3.32Å
186Q69.3Low64.4Low145 Ų145132.3 Ų132.368%0.67866%0.655SS**Hα-helixtrans-60.3-29.4173.658.8-174.4-34.700114.4P184 W188 A189P184-Q186 HydrophobicContact CB-CG 4.04Å; P184-Q186 PolarHBondContact O-N 3.12Å; P184-Q186 VanDerWaalsContact O-N 3.11Å; Q186-W188 VanDerWaalsContact C-N 3.32Å; Q186-W188 PolarHBondContact O-N 3.28Å; Q186-A189 PolarHBondContact O-N 3.34Å
187V71.9Confident65Low70 Ų70129.3 Ų129.342%0.42465%0.646SS.*Hα-helixtrans-70.1-31.4-179.3177.50000111.3P184 Q185P184-V187 HydrophobicContact CB-CG2 4.14Å; P184-V187 HydrophobicContact CG-CG2 4.26Å; P184-V187 WeakPolarHBondContact O-CB 3.1Å; P184-V187 PolarHBondContact O-N 3.36Å; Q185-V187 VanDerWaalsContact C-N 3.28Å; Q185-V187 PolarHBondContact O-N 3.44Å
188W67Low65.4Low138 Ų138129.1 Ų129.152%0.52364%0.637SS.*Hα-helixtrans-81.4-31.5176.3-75.5-17.4000113.8T181 Q185 Q186 L190 E191T181-W188 VanDerWaalsContact CB-CH2 3.48Å; T181-W188 HydrophobicContact CG2-CH2 3.2Å; T181-W188 HydrophobicContact CG2-CZ2 3.57Å; T181-W188 HydrophobicContact CG2-CZ3 4.29Å; T181-W188 WeakPolarHBondContact OG1-CH2 2.91Å; T181-W188 WeakPolarHBondContact OG1-CZ2 3.36Å; Q185-W188 PolarHBondContact O-N 3.4Å; Q186-W188 VanDerWaalsContact C-N 3.32Å; Q186-W188 PolarHBondContact O-N 3.28Å; W188-L190 PolarHBondContact O-N 3.47Å; W188-E191 PolarHBondContact O-N 3.17Å
189A69.2Low65.8Low65 Ų65127.6 Ų127.654%0.53764%0.635SS.*Hα-helixtrans-64.5-27.7-177.800000112.5Q185 Q186Q185-A189 PolarHBondContact O-N 3.32Å; Q186-A189 PolarHBondContact O-N 3.34Å
190L63.5Low66.1Low142 Ų142134.1 Ų134.174%0.74366%0.657SS**G310 helixtrans-77-20-177.6-65.4170.4000113.9W188 L192W188-L190 PolarHBondContact O-N 3.47Å; L190-L192 PolarHBondContact O-N 3.4Å
191E62.4Low66.1Low165 Ų165124.9 Ų124.977%0.77163%0.633SS**G310 helixtrans-78-9.5179.9-159.492.7-139.900112.6W188W188-E191 PolarHBondContact O-N 3.17Å
192L59.2Low65.7Low150 Ų150129.5 Ų129.579%0.78565%0.651SS**G310 helixtrans-100.97.2-175.7-66176.8000114.1L190L190-L192 PolarHBondContact O-N 3.4Å
193N55.4Low65.3Low152 Ų152137.9 Ų137.981%0.81368%0.681SS**  trans-122.346.4-172.4-131.771.9000113.5
194Q48.7Very low64.6Low261 Ų261135.6 Ų135.6100%1.2269%0.687SS**  trans-114.20163-89.2-173.490.300110.4

Retrieved 194 of 194 residues in 218.8 ms (Link to these results)