A0A087YF56_POEFO Loading...

Rho GTPase-activating protein 15

AlphaFold DB , UniProt , Accession A0A087YF56, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 487 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
1M42.1Very low37Very low242 Ų242154 Ų154100%1.19283%0.825SS**  089.30-57.8174.8-179.800107.1
2A35.1Very low36.7Very low94 Ų94152.4 Ų152.478%0.77783%0.825SS**  cis7498.71900000116
3S34Very low36.6Very low119 Ų119147.7 Ų147.783%0.83282%0.819SS**  trans177.3147.8132.3-79.10000112.6
4T40.1Very low36.3Very low110 Ų110151.4 Ų151.468%0.67582%0.823SS**  cis-166.3157.9-25.9-57.60000110.5
5R39.3Very low36Very low227 Ų227154.3 Ų154.386%0.85783%0.828SS**  trans97.9124.2169.3-62.4-176.7176.9167.2-0.1115.1
6I40.2Very low36Very low147 Ų147152.8 Ų152.875%0.75483%0.826SS**  cis72.3128.89.6-31.3167.8000113.3
7T39.1Very low36.2Very low121 Ų121151.1 Ų151.174%0.74282%0.824SS**  cis-130.3151.323.350.80000112.2
8N34Very low35.9Very low142 Ų142151 Ų15176%0.75982%0.822SS**  52.7136.865.3-87.4-3.5000114.8
9L36.1Very low35.7Very low151 Ų151150.2 Ų150.279%0.79182%0.815SS**  cis-142.5-178.411.8-89.1132.7000109
10Q34.3Very low35.4Very low187 Ų187151 Ų15187%0.87481%0.814SS**  cis-172.416645.3-151.7164.517.300112.9
11N32.6Very low35.1Very low154 Ų154149.8 Ų149.882%0.82481%0.811SS**  trans-101170-171.6-115-27.1000114.5
12V33Very low35.1Very low135 Ų135144.4 Ų144.482%0.81879%0.794SS**  trans148.6140.6130.4166.40000114
13A35.3Very low34.7Very low91 Ų91147.7 Ų147.775%0.75279%0.794SS**  trans-110.2164.717900000113.9
14K33Very low34.5Very low200 Ų200149.6 Ų149.687%0.8779%0.79SS**  trans-157.5132.5163.6-93.2167-178.4178.10107.3
15Q31.4Very low33.9Very low195 Ų195150 Ų15091%0.91180%0.797SS**  cis88.614442.3-90.4-167.5-1.200117.2
16V36.2Very low33.4Very low130 Ų130143.5 Ų143.579%0.78879%0.791SS**  trans-91.6169.6-162.2-1690000112.1
17P39.7Very low33Very low123 Ų123141.5 Ų141.580%0.79980%0.797SS**  trans-143.5168.7130.435.2-19.1000116.5
18L30.5Very low32.6Very low150 Ų150139.5 Ų139.579%0.78579%0.793SS**  trans-139.1159.6179.2-141.384.6000110.2
19I33Very low32.4Very low135 Ų135142.5 Ų142.569%0.69280%0.802SS**  trans93.6110.6153.5-66.3168.7000122.1
20Q29Very low32.1Very low167 Ų167139.1 Ų139.178%0.7880%0.804SS**  trans69.3121.5133.1-72176.9-10.100127.6
21T30.2Very low32.1Very low125 Ų125135.1 Ų135.177%0.76780%0.803SS**  trans41.2143.5131.552.10000123.1
22P40.6Very low31.9Very low129 Ų129135 Ų13584%0.83881%0.807SS**  -151.5-158.867.943.9-21.9000119
23Q27.9Very low31.9Very low163 Ų163137.7 Ų137.776%0.76281%0.811SS**  trans-86.6163.4-151.3-72.4169.5-51.600120.2
24Q28.6Very low31.7Very low160 Ų160141.7 Ų141.775%0.74882%0.816SS**  trans88.3141.3132.1-90.7175.216.200124.8
25S28.3Very low31.4Very low119 Ų119143.9 Ų143.983%0.83282%0.819SS**  trans73.1156.4157.677.20000119.6
26A29.6Very low31.7Very low89 Ų89141.4 Ų141.474%0.73681%0.81SS**  cis-170.7148.6-37.600000109.3
27A30.4Very low31.5Very low105 Ų105145.2 Ų145.287%0.86882%0.816SS**  trans61.9162.6161.700000117.9
28A31.3Very low30.9Very low79 Ų79144.2 Ų144.265%0.65381%0.813SS**  cis-167.3155.8-28.500000110.4
29Q30.2Very low30.9Very low205 Ų205142.3 Ų142.396%0.95881%0.812SS**  trans61.9146.4153.1-68.4171.57.300121.5
30G28.5Very low30.8Very low81 Ų81145.1 Ų145.184%0.83582%0.822SS**  trans147.892.816400000114.6
31A34.1Very low31Very low102 Ų102142.4 Ų142.484%0.84382%0.822SS**  trans-94.2152.5179.100000113
32V30Very low31.5Very low151 Ų151142.3 Ų142.392%0.91582%0.823SS**  trans-139.2140.2160.4-176.50000110.4
33Q32.4Very low31.1Very low192 Ų192139.9 Ų139.990%0.89782%0.821SS**  trans-88.8165.7-172.8-85.5175.8-33.600115.5
34M31.2Very low31.3Very low175 Ų175138.4 Ų138.486%0.86282%0.818SS**  trans-63.5156.9178.9-63.7-91.1-7200115
35R27.5Very low31.5Very low246 Ų246141 Ų14193%0.92882%0.821SS**  trans-130140.8155.3-157.6171.5-160.2159.37.4111.4
36I37.4Very low31.8Very low143 Ų143142.1 Ų142.173%0.73382%0.818SS**  trans-100143.7-164.9-62.9157.9000111.7
37K30.3Very low32.1Very low210 Ų210143 Ų14391%0.91382%0.818SS**  trans-161.1160.6135.3-112175.2-176.6-175.40112.7
38S28.9Very low32.4Very low103 Ų103145.6 Ų145.672%0.7281%0.812SS**  trans-144.2141.7-149.454.80000114.2
39S29.8Very low32.8Very low110 Ų110147.6 Ų147.677%0.76982%0.822SS**  trans176.4147.6146.649.10000107.7
40Q31.3Very low33.1Very low193 Ų193146.8 Ų146.890%0.90282%0.815SS**  cis-165.4158.6-11.3-107.4175-7.700104.7
41S32.4Very low33.4Very low111 Ų111148.4 Ų148.478%0.77681%0.813SS**  trans-100-166.5-169.659.20000111.5
42P41.8Very low33.7Very low123 Ų123151.4 Ų151.480%0.79981%0.812SS**  cis-139.4175.73.340.5-20.3000117.9
43G31.8Very low34Very low77 Ų77150.8 Ų150.879%0.79481%0.808SS**  trans168.965.7173.300000115.5
44D30.6Very low34.3Very low132 Ų132148.6 Ų148.671%0.70680%0.802SS**  trans-70.2165.4176-77.2-39.2000113.4
45R33.9Very low34.4Very low214 Ų214149.4 Ų149.481%0.80880%0.804SS**  cis-164.7149.8-20.9-109.4171.4-159.3-152.31.7110.9
46L34.8Very low34.5Very low144 Ų144145.1 Ų145.175%0.75480%0.799SS**  trans-4.1132.3143.7-62.9160.1000117
47S36.4Very low34.2Very low106 Ų106143.4 Ų143.474%0.74180%0.8SS**  54.196.257.7-168.60000115.4
48Q35.6Very low34.3Very low160 Ų160141 Ų14175%0.74880%0.797SS**  trans-146.5130.7153.7-70.6-161.46.900111.4
49S39.4Very low34.7Very low122 Ų122143.6 Ų143.685%0.85380%0.802SS**  trans-100.9137.7163.1-52.50000108.9
50K37.4Very low35.2Very low188 Ų188143.7 Ų143.782%0.81780%0.8SS**  trans-136.4143.7168.9-86-171.9175.51790112.1
51S34.6Very low35.3Very low114 Ų114141.7 Ų141.780%0.79779%0.791SS**  trans-80.1160-179.4-166.80000111.7
52M39.7Very low35.3Very low166 Ų166144.4 Ų144.482%0.81879%0.788SS**  trans-129.3121.3170.5-101.7176.361.100110.5
53V37.6Very low35.2Very low138 Ų138143.3 Ų143.384%0.83678%0.781SS**  trans-110.3139.6164.7172.80000106.7
54L37.9Very low35Very low146 Ų146147.5 Ų147.576%0.76478%0.784SS**  trans-95.4147.9179.6-68.1167.8000111.3
55Q32.4Very low34.9Very low192 Ų192145.6 Ų145.690%0.89778%0.782SS**  trans-151.8153.3154.5-110.6174.811.500110
56D31.2Very low34.8Very low155 Ų155145.3 Ų145.383%0.82978%0.781SS**  trans-93.1-175.8-161.1-66.9-70.1000115.8
57S29.8Very low34.7Very low107 Ų107146.5 Ų146.575%0.74878%0.782SS**  trans88.1131.4171.1-56.80000116
58D31.9Very low34.6Very low159 Ų159152.8 Ų152.885%0.8579%0.789SS**  cis-140.7162.416.4-95.2-47000116
59L39.3Very low34.4Very low159 Ų159156.4 Ų156.483%0.83280%0.796SS**  trans-90.8170.5-177.7-72159.1000113.1
60P38.8Very low34Very low112 Ų112157.9 Ų157.973%0.72780%0.795SS**  -156.71388637.5-15.8000119.6
61Q33.7Very low33.7Very low151 Ų151156.8 Ų156.871%0.70679%0.792SS**  57.5150.1130-64.4-166.38.700121.4
62K33.1Very low33.8Very low168 Ų168156 Ų15673%0.7379%0.787SS**  cis-174.1-169.117.1-122170.2-178.8146.90107.5
63P38.6Very low33.6Very low99 Ų99157.4 Ų157.464%0.64379%0.792SS**  cis-132.6-168.6-31.430.3-7.6000114.2
64L29.2Very low33.4Very low165 Ų165160.1 Ų160.186%0.86479%0.794SS**  trans85.2144.9162.5-50.8176.6000118.3
65S28.5Very low32.9Very low93 Ų93156.6 Ų156.665%0.6579%0.794SS**  cis-164.7144.2-27.9-170.60000111.3
66R31.7Very low32.8Very low208 Ų208153.7 Ų153.779%0.78579%0.789SS**  trans5.1138.6155.9-57171.2169-177.1-3.6118.9
67H32.4Very low32.6Very low169 Ų169152.4 Ų152.478%0.78279%0.786SS**  -170.8152.775.7-102.4-73.9000116.9
68R34.1Very low32.7Very low238 Ų238154.9 Ų154.990%0.89879%0.79SS**  trans-52.9151.7162.8-78.9170.6161.8171.2-5.9114.3
69R30.8Very low32.5Very low235 Ų235151.9 Ų151.989%0.88778%0.782SS**  -166.4143.7109.7-130.2178.1175.6126.7-3115
70N31.8Very low32.1Very low154 Ų154151.1 Ų151.182%0.82478%0.784SS**  trans-91.3160159.4-94.7-8.2000110.1
71Q31.6Very low31.6Very low165 Ų165149.5 Ų149.577%0.77178%0.779SS**  trans132.7104.6154.5-80.2175.8-23.500110.3
72S36.6Very low31.6Very low98 Ų98149.2 Ų149.269%0.68579%0.788SS**  76.8124.57474.60000113.9
73Q35.6Very low31.4Very low195 Ų195145.6 Ų145.691%0.91179%0.79SS**  trans-161.6142.7136.7-110.1165.342.900111.3
74H31.9Very low31.2Very low194 Ų194151 Ų15190%0.89880%0.804SS**  trans-77.4154.7169.8-82.2-102.5000110.4
75G28.7Very low31.2Very low73 Ų73152.1 Ų152.175%0.75380%0.804SS**  trans-169.782.6170.900000111.8
76V30.7Very low31.5Very low131 Ų131153.6 Ų153.679%0.79481%0.811SS**  trans-75.2122.5168.7173.90000108.1
77V26.9Very low32Very low127 Ų127147.4 Ų147.477%0.7779%0.793SS**  trans-129.4106.6163-177.30000108.5
78L31.6Very low32.7Very low159 Ų159141.9 Ų141.983%0.83277%0.772SS**  trans-73.3121.4158.3-90.6153.1000107.6
79S26.2Very low33.2Very low96 Ų96136.9 Ų136.967%0.67176%0.763SS**  trans-133112.4162.3-173.40000108.7A81S79-A81 PolarHBondContact O-N 3.44Å
80V31.9Very low34.6Very low144 Ų144127 Ų12787%0.87373%0.727SS**  trans-84.7103.7167174.70000106.5
81A27.4Very low35.9Very low77 Ų77128.3 Ų128.364%0.63673%0.726SS**  trans-142.8116.2169.500000109.7S79 A83S79-A81 PolarHBondContact O-N 3.44Å; A81-A83 PolarHBondContact O-N 2.89Å
82T34.3Very low38Very low146 Ų146121.2 Ų121.290%0.89670%0.696SS**  trans-65.8118.9171.145.40000110.5
83A29.4Very low40.3Very low92 Ų92119 Ų11976%0.7668%0.676SS**  trans-141.1130.1165.500000109.4A81A81-A83 PolarHBondContact O-N 2.89Å
84F34.4Very low42.6Very low213 Ų213114.9 Ų114.993%0.93466%0.656SS**PPolyproline II helixtrans-71.1124.2173.3-79.4-116.9000109.2
85E28.4Very low45.2Very low187 Ų187105.8 Ų105.887%0.87461%0.614SS**PPolyproline II helixtrans-88.1137.3158.9-82.6-153145.200110.3
86P36.1Very low48.1Very low124 Ų124103.8 Ų103.881%0.80559%0.586SS**PPolyproline II helixtrans-76.9145.9-179.530.7-33.9000113.3V88P86-V88 PolarHBondContact O-N 2.76Å
87L42.2Very low50.8Low78 Ų7897.6 Ų97.641%0.40855%0.549SS..SBendtrans-40.2110.8172.9-17466.4000115.3D89 T120L87-D89 PolarHBondContact O-N 3.38Å; L87-T120 HydrophobicContact CB-CG2 4.5Å; L87-T120 HydrophobicContact CD2-CG2 4.04Å
88V45.3Very low53.8Low54 Ų5491.6 Ų91.633%0.32751%0.512SS..  trans3185.4151.3-168.10000116.5P86 L90P86-V88 PolarHBondContact O-N 2.76Å; V88-L90 HydrophobicContact CG1-CD1 4.31Å; V88-L90 HydrophobicContact CG1-CG 4.22Å
89D45.8Very low56.4Low133 Ų13386.5 Ų86.571%0.71148%0.483SS*.  trans-96.298164.7-167.321.4000110.1L87 K91L87-D89 PolarHBondContact O-N 3.38Å; D89-K91 PolarHBondContact O-N 3.02Å
90L58.8Low59.3Low26 Ų2683.1 Ų83.114%0.13646%0.457CS..EExtended strand (participates in β ladder)trans-84.2100.8179.6-98.2169000110.1V88 G92 L118 W186 A189V88-L90 HydrophobicContact CG1-CD1 4.31Å; V88-L90 HydrophobicContact CG1-CG 4.22Å; L90-G92 PolarHBondContact O-N 2.8Å; L90-G92 VanDerWaalsContact O-N 3.15Å; L90-L118 HydrophobicContact CB-CB 4.4Å; L90-L118 HydrophobicContact CD1-CD2 4.21Å; L90-W186 HydrophobicContact CB-CH2 4.4Å; L90-A189 HydrophobicContact CD1-CB 3.33Å
91K59.8Low61.8Low183 Ų18376.4 Ų76.480%0.79642%0.417SS*.EExtended strand (participates in β ladder)trans-43122169.3-71.9-176.2173.9177.80109.8D89D89-K91 PolarHBondContact O-N 3.02Å
92G76.4Confident64.4Low15 Ų1575.7 Ų75.716%0.15540%0.402CS..EExtended strand (participates in β ladder)trans-58.2153-165.100000114.7L90 W115 T116L90-G92 PolarHBondContact O-N 2.8Å; L90-G92 VanDerWaalsContact O-N 3.15Å; G92-W115 WeakPolarHBondContact O-CH2 3.42Å; G92-W115 VanDerWaalsContact O-CZ2 3.25Å; G92-W115 WeakPolarHBondContact O-CZ2 3.4Å; G92-W115 WeakPolarHBondContact O-CZ3 3.3Å; G92-T116 WeakPolarHBondContact CA-O 3.41Å
93E83.9Confident66.3Low53 Ų5373.8 Ų73.825%0.24839%0.387CS..EExtended strand (participates in β ladder)trans-135.3155.6176.4-64.7176.8-170.100109.5L95 T116 T182 K185 W186E93-L95 PolarHBondContact O-N 2.77Å; E93-T116 PolarHBondContact N-O 3.2Å; E93-T116 VanDerWaalsContact N-O 3.16Å; E93-T116 PolarHBondContact O-N 2.72Å; E93-T182 VanDerWaalsContact OE2-CG2 3.28Å; E93-T182 WeakPolarHBondContact OE2-CG2 3.34Å; E93-K185 IonicContact OE1-NZ 2.82Å; E93-K185 PolarHBondContact OE1-NZ 2.98Å; E93-W186 HydrophobicContact CB-CZ2 3.8Å; E93-W186 HydrophobicContact CG-CZ2 4.05Å; E93-W186 PolarHBondContact OE2-NE1 2.8Å
94H84.3Confident68.1Low108 Ų10872 Ų7250%0.538%0.377SS..EExtended strand (participates in β ladder)trans-78.5119.7174.7-72.199.2000110.2W115H94-W115 AromaticContact CE1-CE3 3.42Å; H94-W115 VanDerWaalsContact CE1-CE3 3.42Å; H94-W115 AromaticContact CE1-CZ3 3.75Å; H94-W115 AromaticContact CG-CE3 3.96Å; H94-W115 AromaticContact ND1-CE3 3.54Å; H94-W115 AromaticContact ND1-CZ3 3.74Å; H94-W115 AromaticContact NE2-CE3 3.76Å
95L87.4Confident70.1Confident2 Ų269.3 Ų69.31%0.0137%0.365CS..EExtended strand (participates in β ladder)trans-121.4145.3175.2-58.7178.5000110.2E93 V97 M114 T116 I175 A177 T182 W186E93-L95 PolarHBondContact O-N 2.77Å; L95-V97 HydrophobicContact CB-CG2 4.45Å; L95-V97 PolarHBondContact O-N 3.29Å; L95-M114 PolarHBondContact N-O 3.14Å; L95-M114 PolarHBondContact O-N 3Å; L95-T116 HydrophobicContact CD1-CG2 3.95Å; L95-I175 HydrophobicContact CB-CG2 3.97Å; L95-I175 HydrophobicContact CD1-CG2 3.72Å; L95-I175 HydrophobicContact CG-CG2 4.38Å; L95-A177 HydrophobicContact CD2-CB 3.81Å; L95-T182 HydrophobicContact CD2-CG2 4.33Å; L95-W186 HydrophobicContact CD1-CB 4.46Å; L95-W186 HydrophobicContact CD1-CD2 3.74Å; L95-W186 HydrophobicContact CD1-CE3 4.07Å; L95-W186 HydrophobicContact CD1-CG 3.89Å
96N88.3Confident72.6Confident32 Ų3269.3 Ų69.317%0.17136%0.362CS..EExtended strand (participates in β ladder)trans-81.7114.8173.2-78.6-59.7000108.8W111 I175 Q176N96-W111 HydrophobicContact CB-CE3 4.11Å; N96-W111 WeakPolarHBondContact O-CZ3 3.33Å; N96-I175 CarbonylContact O-C 3.54Å; N96-Q176 HydrophobicContact CB-CB 4.11Å; N96-Q176 VanDerWaalsContact CB-OE1 3.31Å; N96-Q176 PolarHBondContact N-O 3.03Å; N96-Q176 PolarHBondContact ND2-OE1 2.78Å; N96-Q176 PolarHBondContact O-N 3.46Å
97V88.8Confident74.6Confident1 Ų168.5 Ų68.51%0.00635%0.348CS..EExtended strand (participates in β ladder)trans-115.2142.3-178.4-1730000110.9L95 T112 M114 L125 Y173 L174 I175L95-V97 HydrophobicContact CB-CG2 4.45Å; L95-V97 PolarHBondContact O-N 3.29Å; V97-T112 PolarHBondContact N-O 3.4Å; V97-T112 PolarHBondContact O-N 3Å; V97-M114 HydrophobicContact CB-CE 4.05Å; V97-M114 HydrophobicContact CB-CG 4.41Å; V97-M114 HydrophobicContact CB-SD 4.11Å; V97-M114 HydrophobicContact CG1-CE 4.43Å; V97-M114 HydrophobicContact CG2-CB 4.38Å; V97-L125 HydrophobicContact CG1-CD1 3.95Å; V97-L125 HydrophobicContact CG2-CD1 4.48Å; V97-L125 HydrophobicContact CG2-CD2 4.07Å; V97-Y173 HydrophobicContact CG1-CD1 4.22Å; V97-L174 CarbonylContact C-O 3.59Å; V97-L174 VanDerWaalsContact CA-O 3.32Å; V97-L174 WeakPolarHBondContact CA-O 3.27Å; V97-I175 HydrophobicContact CG1-CG1 4.35Å; V97-I175 HydrophobicContact CG2-CG1 4.2Å
98A88.3Confident76.1Confident0 Ų075.7 Ų75.70%037%0.369CS..EExtended strand (participates in β ladder)trans-138.3113.6172.500000111.1I100 K109 N110 W111 L174A98-I100 PolarHBondContact O-N 3.48Å; A98-K109 HydrophobicContact CB-CG 4.02Å; A98-N110 VanDerWaalsContact CA-O 3.31Å; A98-N110 WeakPolarHBondContact CA-O 3.33Å; A98-N110 WeakPolarHBondContact CB-O 3.35Å; A98-W111 HydrophobicContact CB-CD2 3.71Å; A98-W111 HydrophobicContact CB-CE3 3.61Å; A98-W111 HydrophobicContact CB-CG 4.26Å; A98-W111 HydrophobicContact CB-CH2 4.26Å; A98-W111 HydrophobicContact CB-CZ2 4.33Å; A98-W111 HydrophobicContact CB-CZ3 3.9Å; A98-L174 HydrophobicContact CB-CB 4.49Å; A98-L174 PolarHBondContact N-O 2.87Å; A98-L174 PolarHBondContact O-N 3.08Å
99K87.3Confident78Confident52 Ų5277.1 Ų77.123%0.22637%0.371CS..EExtended strand (participates in β ladder)trans-74.5119.5170.7-166.8171-175.6170.70109.3S101 D102 Y173K99-S101 WeakPolarHBondContact CE-O 3.37Å; K99-D102 WeakPolarHBondContact CE-OD1 3.46Å; K99-D102 IonicContact NZ-OD1 2.71Å; K99-D102 PolarHBondContact NZ-OD1 3.45Å; K99-Y173 HydrophobicContact CB-CD1 4.05Å; K99-Y173 HydrophobicContact CB-CE1 4.04Å; K99-Y173 HydrophobicContact CD-CD1 4.44Å; K99-Y173 HydrophobicContact CD-CE1 3.67Å; K99-Y173 HydrophobicContact CD-CE2 4.38Å; K99-Y173 VanDerWaalsContact CE-OH 3.3Å; K99-Y173 WeakPolarHBondContact CE-OH 3.22Å; K99-Y173 HydrophobicContact CG-CD1 4.11Å; K99-Y173 HydrophobicContact CG-CE1 3.84Å; K99-Y173 HydrophobicContact CG-CE2 4.46Å; K99-Y173 PolarHBondContact NZ-OH 3.3Å
100I86.8Confident79.8Confident25 Ų2576.2 Ų76.213%0.12837%0.367CS..EExtended strand (participates in β ladder)trans-109.9-17.1-176.461.5168.3000113.2A98 Q107 K109 E172 L174A98-I100 PolarHBondContact O-N 3.48Å; I100-Q107 PolarHBondContact O-N 2.94Å; I100-K109 HydrophobicContact CG2-CB 3.98Å; I100-K109 HydrophobicContact CG2-CD 4.16Å; I100-K109 HydrophobicContact CG2-CG 3.93Å; I100-E172 HydrophobicContact CD1-CB 4.04Å; I100-E172 HydrophobicContact CG1-CB 3.53Å; I100-E172 WeakPolarHBondContact CG1-O 3.41Å; I100-E172 PolarHBondContact N-O 3.38Å; I100-L174 HydrophobicContact CD1-CD1 4.14Å; I100-L174 HydrophobicContact CD1-CD2 4.04Å; I100-L174 HydrophobicContact CD1-CG 3.89Å; I100-L174 HydrophobicContact CG1-CG 4.34Å; I100-L174 HydrophobicContact CG2-CD1 3.86Å; I100-L174 HydrophobicContact CG2-CG 4.09Å
101S84.6Confident81.1Confident4 Ų477.8 Ų77.83%0.02837%0.371CS..EExtended strand (participates in β ladder)trans-141.5140.7171.5-168.70000109.9K99 G104 K105 G170 S171 E172K99-S101 WeakPolarHBondContact CE-O 3.37Å; S101-G104 WeakPolarHBondContact OG-CA 3.36Å; S101-K105 WeakPolarHBondContact CA-O 3.49Å; S101-G170 PolarHBondContact OG-O 3.46Å; S101-S171 WeakPolarHBondContact O-CA 3.38Å; S101-E172 WeakPolarHBondContact CB-OE2 3.19Å; S101-E172 PolarHBondContact N-O 2.91Å; S101-E172 PolarHBondContact O-N 3.04Å
102D82.4Confident82.3Confident61 Ų6171.2 Ų71.233%0.32635%0.346SS..EExtended strand (participates in β ladder)trans-126.7110.8174.8-167.524.5000108.8K99 G104 K105 Q107K99-D102 WeakPolarHBondContact CE-OD1 3.46Å; K99-D102 IonicContact NZ-OD1 2.71Å; K99-D102 PolarHBondContact NZ-OD1 3.45Å; D102-G104 VanDerWaalsContact C-N 3.29Å; D102-G104 PolarHBondContact O-N 3.47Å; D102-K105 PolarHBondContact N-O 3.25Å; D102-K105 WeakPolarHBondContact O-CB 3.13Å; D102-K105 PolarHBondContact O-N 3.03Å; D102-Q107 HydrophobicContact CB-CG 4.17Å
103N74.3Confident82.7Confident106 Ų10673.5 Ų73.557%0.56736%0.359SS*.THydrogen-bonded Turntrans45.950.2-171.9-61.1-23.4000112.9K105 S171N103-K105 VanDerWaalsContact C-N 3.25Å; N103-K105 PolarHBondContact O-N 2.85Å; N103-S171 PolarHBondContact N-OG 3Å; N103-S171 PolarHBondContact OD1-OG 3.46Å
104G66.8Low82.9Confident55 Ų5571.8 Ų71.857%0.56735%0.352SS*.THydrogen-bonded Turntrans76.3-5.8-178.300000116.1S101 D102 G170S101-G104 WeakPolarHBondContact OG-CA 3.36Å; D102-G104 VanDerWaalsContact C-N 3.29Å; D102-G104 PolarHBondContact O-N 3.47Å; G104-G170 PolarHBondContact N-O 2.74Å
105K76.9Confident82.9Confident157 Ų15770 Ų7068%0.68334%0.341SS*.EExtended strand (participates in β ladder)trans-88.6114.7175.8-63.6177-176.8171.20110.2S101 D102 N103 Q107S101-K105 WeakPolarHBondContact CA-O 3.49Å; D102-K105 PolarHBondContact N-O 3.25Å; D102-K105 WeakPolarHBondContact O-CB 3.13Å; D102-K105 PolarHBondContact O-N 3.03Å; N103-K105 VanDerWaalsContact C-N 3.25Å; N103-K105 PolarHBondContact O-N 2.85Å; K105-Q107 PolarHBondContact O-N 3.5Å
106K81.1Confident82.9Confident187 Ų18769.9 Ų69.981%0.81334%0.34SS*.EExtended strand (participates in β ladder)trans-60.5123.6178-65.7-173.4177.7-176.70111.5
107Q77.9Confident82.9Confident107 Ų10769.6 Ų69.650%0.534%0.339SS..PPolyproline II helixtrans-103.5158177-70.3-66-9.600111.1I100 D102 K105 K109I100-Q107 PolarHBondContact O-N 2.94Å; D102-Q107 HydrophobicContact CB-CG 4.17Å; K105-Q107 PolarHBondContact O-N 3.5Å; Q107-K109 PolarHBondContact O-N 3.47Å
108R74Confident82.7Confident228 Ų22869.5 Ų69.586%0.8634%0.339SS*.PPolyproline II helixtrans-68.9117.6173179.9180177-177.7-0.9108.9N110R108-N110 PolarHBondContact O-N 3.37Å
109K84.7Confident82.5Confident84 Ų8471.5 Ų71.537%0.36535%0.351SS..  trans-51.9111.6174.9-175.7168.167.7173.80110.6A98 I100 Q107 W111 K156 L174A98-K109 HydrophobicContact CB-CG 4.02Å; I100-K109 HydrophobicContact CG2-CB 3.98Å; I100-K109 HydrophobicContact CG2-CD 4.16Å; I100-K109 HydrophobicContact CG2-CG 3.93Å; Q107-K109 PolarHBondContact O-N 3.47Å; K109-W111 HydrophobicContact CD-CZ2 4.09Å; K109-K156 PolarHBondContact NZ-O 2.96Å; K109-L174 HydrophobicContact CD-CD1 3.85Å
110N82.7Confident81.8Confident115 Ų11572.2 Ų72.262%0.61536%0.36SS*.  trans-125.5125.8173.7-171.926.5000108.3A98 R108A98-N110 VanDerWaalsContact CA-O 3.31Å; A98-N110 WeakPolarHBondContact CA-O 3.33Å; A98-N110 WeakPolarHBondContact CB-O 3.35Å; R108-N110 PolarHBondContact O-N 3.37Å
111W85.7Confident81.4Confident58 Ų5874.2 Ų74.222%0.2237%0.371CS..  trans-88.9137.4178.7-69.1101.5000109.9N96 A98 K109 S157 K159 V162 L174 Q176N96-W111 HydrophobicContact CB-CE3 4.11Å; N96-W111 WeakPolarHBondContact O-CZ3 3.33Å; A98-W111 HydrophobicContact CB-CD2 3.71Å; A98-W111 HydrophobicContact CB-CE3 3.61Å; A98-W111 HydrophobicContact CB-CG 4.26Å; A98-W111 HydrophobicContact CB-CH2 4.26Å; A98-W111 HydrophobicContact CB-CZ2 4.33Å; A98-W111 HydrophobicContact CB-CZ3 3.9Å; K109-W111 HydrophobicContact CD-CZ2 4.09Å; W111-S157 WeakPolarHBondContact CZ2-OG 3.41Å; W111-K159 HydrophobicContact CD2-CD 4.38Å; W111-K159 HydrophobicContact CZ2-CD 4.35Å; W111-V162 HydrophobicContact CH2-CG1 4.15Å; W111-V162 HydrophobicContact CH2-CG2 4.5Å; W111-L174 HydrophobicContact CH2-CB 3.66Å; W111-L174 HydrophobicContact CH2-CD1 4.27Å; W111-L174 HydrophobicContact CZ2-CB 4.42Å; W111-L174 HydrophobicContact CZ2-CD1 4.25Å; W111-L174 HydrophobicContact CZ3-CB 4.17Å; W111-Q176 HydrophobicContact CH2-CB 4.21Å; W111-Q176 HydrophobicContact CZ3-CB 3.91Å
112T85.5Confident81.4Confident46 Ų4677 Ų7728%0.28238%0.383SS..EExtended strand (participates in β ladder)trans-140.4132.3174.2-590000107.8V97 M114V97-T112 PolarHBondContact N-O 3.4Å; V97-T112 PolarHBondContact O-N 3Å; T112-M114 HydrophobicContact CG2-CE 4.11Å; T112-M114 HydrophobicContact CG2-CG 4.15Å; T112-M114 PolarHBondContact O-N 2.82Å
113S86.1Confident81.6Confident62 Ų6274.1 Ų74.143%0.43437%0.368SS..EExtended strand (participates in β ladder)trans-69.7126.5169.7-173.30000108
114M86.4Confident82.1Confident17 Ų1770.4 Ų70.48%0.08435%0.348CS..EExtended strand (participates in β ladder)trans-131.2134.2-179.7-57.2-170.5-157.400109.2L95 V97 T112 T116 L125 Y126L95-M114 PolarHBondContact N-O 3.14Å; L95-M114 PolarHBondContact O-N 3Å; V97-M114 HydrophobicContact CB-CE 4.05Å; V97-M114 HydrophobicContact CB-CG 4.41Å; V97-M114 HydrophobicContact CB-SD 4.11Å; V97-M114 HydrophobicContact CG1-CE 4.43Å; V97-M114 HydrophobicContact CG2-CB 4.38Å; T112-M114 HydrophobicContact CG2-CE 4.11Å; T112-M114 HydrophobicContact CG2-CG 4.15Å; T112-M114 PolarHBondContact O-N 2.82Å; M114-T116 PolarHBondContact O-N 3.45Å; M114-T116 PolarHBondContact O-OG1 2.91Å; M114-L125 HydrophobicContact CB-CB 4.44Å; M114-L125 HydrophobicContact SD-CB 3.8Å; M114-L125 HydrophobicContact SD-CD1 4.14Å; M114-L125 HydrophobicContact SD-CG 4.46Å; M114-Y126 CarbonylContact C-O 3.47Å; M114-Y126 VanDerWaalsContact CA-O 3.24Å; M114-Y126 WeakPolarHBondContact CA-O 3.45Å; M114-Y126 WeakPolarHBondContact CB-O 3.43Å
115W85Confident83Confident71 Ų7167.9 Ų67.927%0.26932%0.322SS..EExtended strand (participates in β ladder)trans-66.7117.3166.5-179.6-99.3000107.9G92 H94 Y126G92-W115 WeakPolarHBondContact O-CH2 3.42Å; G92-W115 VanDerWaalsContact O-CZ2 3.25Å; G92-W115 WeakPolarHBondContact O-CZ2 3.4Å; G92-W115 WeakPolarHBondContact O-CZ3 3.3Å; H94-W115 AromaticContact CE1-CE3 3.42Å; H94-W115 VanDerWaalsContact CE1-CE3 3.42Å; H94-W115 AromaticContact CE1-CZ3 3.75Å; H94-W115 AromaticContact CG-CE3 3.96Å; H94-W115 AromaticContact ND1-CE3 3.54Å; H94-W115 AromaticContact ND1-CZ3 3.74Å; H94-W115 AromaticContact NE2-CE3 3.76Å; W115-Y126 AromaticContact CD1-CD2 3.91Å; W115-Y126 PolarHBondContact N-O 3.27Å; W115-Y126 PolarHBondContact O-N 3.45Å
116T87.7Confident83.2Confident0 Ų063.2 Ų63.20%030%0.3CS..EExtended strand (participates in β ladder)trans-109.7128.9-172.9-56.80000109.1G92 E93 L95 M114 L123 L124 L125 W186G92-T116 WeakPolarHBondContact CA-O 3.41Å; E93-T116 PolarHBondContact N-O 3.2Å; E93-T116 VanDerWaalsContact N-O 3.16Å; E93-T116 PolarHBondContact O-N 2.72Å; L95-T116 HydrophobicContact CD1-CG2 3.95Å; M114-T116 PolarHBondContact O-N 3.45Å; M114-T116 PolarHBondContact O-OG1 2.91Å; T116-L123 HydrophobicContact CG2-CD1 3.47Å; T116-L123 VanDerWaalsContact CG2-CD1 3.47Å; T116-L123 HydrophobicContact CG2-CD2 4.24Å; T116-L123 HydrophobicContact CG2-CG 3.86Å; T116-L124 WeakPolarHBondContact CA-O 3.5Å; T116-L125 HydrophobicContact CG2-CD2 3.72Å; T116-L125 WeakPolarHBondContact OG1-CD2 3.15Å; T116-W186 HydrophobicContact CG2-CE3 4.31Å; T116-W186 HydrophobicContact CG2-CH2 4.13Å; T116-W186 HydrophobicContact CG2-CZ3 3.75Å; T116-W186 VanDerWaalsContact O-CH2 3.23Å; T116-W186 WeakPolarHBondContact O-CH2 3.32Å
117V87.3Confident82.8Confident25 Ų2560.8 Ų60.815%0.15229%0.29CS..EExtended strand (participates in β ladder)trans-123.9130.5174.6-176.50000108L124 Y126V117-L124 HydrophobicContact CB-CB 4.42Å; V117-L124 PolarHBondContact N-O 3.02Å; V117-L124 PolarHBondContact O-N 2.65Å; V117-Y126 HydrophobicContact CB-CE2 4.4Å; V117-Y126 HydrophobicContact CG2-CD2 4.42Å; V117-Y126 HydrophobicContact CG2-CE2 4Å
118L85.6Confident82Confident0 Ų062 Ų620%030%0.3CS..EExtended strand (participates in β ladder)trans-98.6122.2173.9176.863.1000108.8L90 L123 L145 W186 A189 I190 T193L90-L118 HydrophobicContact CB-CB 4.4Å; L90-L118 HydrophobicContact CD1-CD2 4.21Å; L118-L123 HydrophobicContact CB-CD1 4.16Å; L118-L123 HydrophobicContact CD1-CD1 4.11Å; L118-L145 HydrophobicContact CD1-CD1 3.46Å; L118-L145 VanDerWaalsContact CD1-CD1 3.46Å; L118-W186 HydrophobicContact CB-CZ3 3.83Å; L118-A189 HydrophobicContact CD2-CB 3.71Å; L118-I190 HydrophobicContact CD1-CG1 4.12Å; L118-I190 HydrophobicContact CD2-CG1 4.11Å; L118-T193 HydrophobicContact CD1-CG2 4.19Å
119T83Confident80.7Confident41 Ų4156.5 Ų56.525%0.25228%0.282SS..  trans-100.2-168.9171.271.90000110.2D121 E122 L124T119-D121 VanDerWaalsContact C-N 3.26Å; T119-D121 PolarHBondContact O-N 2.96Å; T119-E122 PolarHBondContact N-O 3.36Å; T119-E122 PolarHBondContact OG1-N 3.34Å; T119-E122 VanDerWaalsContact OG1-N 3.15Å; T119-E122 PolarHBondContact OG1-O 2.72Å; T119-E122 VanDerWaalsContact OG1-O 3.04Å; T119-L124 HydrophobicContact CG2-CD1 3.64Å; T119-L124 HydrophobicContact CG2-CG 4.16Å
120T73.6Confident79Confident67 Ų6758.2 Ų58.241%0.41129%0.291SS..SBendtrans-64.3-25.8-179.458.30000114.2L87 T193L87-T120 HydrophobicContact CB-CG2 4.5Å; L87-T120 HydrophobicContact CD2-CG2 4.04Å; T120-T193 WeakPolarHBondContact O-CG2 3.45Å
121D77.4Confident77.1Confident67 Ų6759.2 Ų59.236%0.35829%0.292SS..SBendtrans-145.6-7.1-172.2-60.5-81.2000113.8T119 L145T119-D121 VanDerWaalsContact C-N 3.26Å; T119-D121 PolarHBondContact O-N 2.96Å; D121-L145 WeakPolarHBondContact O-CB 3.44Å; D121-L145 PolarHBondContact O-N 3.28Å
122E84.9Confident74.9Confident63 Ų6363.3 Ų63.329%0.29432%0.323SS..EExtended strand (participates in β ladder)trans-134.9150.5-173.4-56.1-172.2146.800112T119 L124 V142T119-E122 PolarHBondContact N-O 3.36Å; T119-E122 PolarHBondContact OG1-N 3.34Å; T119-E122 VanDerWaalsContact OG1-N 3.15Å; T119-E122 PolarHBondContact OG1-O 2.72Å; T119-E122 VanDerWaalsContact OG1-O 3.04Å; E122-L124 HydrophobicContact CB-CD2 4.45Å; E122-V142 HydrophobicContact CB-CG1 4.36Å; E122-V142 HydrophobicContact CG-CG1 4.43Å
123L86.6Confident72.6Confident1 Ų164.1 Ų64.11%0.00534%0.341CS..EExtended strand (participates in β ladder)trans-109.5113.6169.5-171.477.1000108.6T116 L118 L125 V143 L145 I165 I175 W186 I190T116-L123 HydrophobicContact CG2-CD1 3.47Å; T116-L123 VanDerWaalsContact CG2-CD1 3.47Å; T116-L123 HydrophobicContact CG2-CD2 4.24Å; T116-L123 HydrophobicContact CG2-CG 3.86Å; L118-L123 HydrophobicContact CB-CD1 4.16Å; L118-L123 HydrophobicContact CD1-CD1 4.11Å; L123-L125 HydrophobicContact CD2-CD2 4.36Å; L123-L125 HydrophobicContact CG-CD2 4.38Å; L123-V143 HydrophobicContact CB-CB 4.22Å; L123-V143 PolarHBondContact N-O 2.96Å; L123-V143 PolarHBondContact O-N 2.99Å; L123-L145 HydrophobicContact CB-CD1 4.29Å; L123-L145 HydrophobicContact CB-CD2 4.17Å; L123-L145 HydrophobicContact CB-CG 4.37Å; L123-I165 HydrophobicContact CD2-CD1 3.84Å; L123-I175 HydrophobicContact CD2-CD1 3.61Å; L123-W186 HydrophobicContact CD1-CZ3 4.17Å; L123-I190 HydrophobicContact CD1-CD1 3.94Å; L123-I190 HydrophobicContact CD1-CG1 4.22Å; L123-I190 HydrophobicContact CD2-CD1 4.15Å
124L85.4Confident70.5Confident28 Ų2868 Ų6815%0.14736%0.362CS..EExtended strand (participates in β ladder)trans-96.6120.7-175.1-58.3175.9000110T116 V117 T119 E122 Y126 V142T116-L124 WeakPolarHBondContact CA-O 3.5Å; V117-L124 HydrophobicContact CB-CB 4.42Å; V117-L124 PolarHBondContact N-O 3.02Å; V117-L124 PolarHBondContact O-N 2.65Å; T119-L124 HydrophobicContact CG2-CD1 3.64Å; T119-L124 HydrophobicContact CG2-CG 4.16Å; E122-L124 HydrophobicContact CB-CD2 4.45Å; L124-Y126 HydrophobicContact CB-CD2 4.48Å; L124-Y126 HydrophobicContact CB-CE2 3.64Å; L124-Y126 WeakPolarHBondContact CD1-OH 3.43Å; L124-V142 HydrophobicContact CD2-CB 4.33Å; L124-V142 HydrophobicContact CD2-CG1 3.91Å; L124-V142 HydrophobicContact CD2-CG2 3.84Å
125L85Confident68Low2 Ų275.9 Ų75.91%0.0140%0.396CS..EExtended strand (participates in β ladder)trans-111.8112.5-177.6-57.8176.8000111.1V97 M114 T116 L123 T140 D141 V143 Y173V97-L125 HydrophobicContact CG1-CD1 3.95Å; V97-L125 HydrophobicContact CG2-CD1 4.48Å; V97-L125 HydrophobicContact CG2-CD2 4.07Å; M114-L125 HydrophobicContact CB-CB 4.44Å; M114-L125 HydrophobicContact SD-CB 3.8Å; M114-L125 HydrophobicContact SD-CD1 4.14Å; M114-L125 HydrophobicContact SD-CG 4.46Å; T116-L125 HydrophobicContact CG2-CD2 3.72Å; T116-L125 WeakPolarHBondContact OG1-CD2 3.15Å; L123-L125 HydrophobicContact CD2-CD2 4.36Å; L123-L125 HydrophobicContact CG-CD2 4.38Å; L125-T140 WeakPolarHBondContact O-CA 3.48Å; L125-D141 HydrophobicContact CB-CB 4.22Å; L125-D141 WeakPolarHBondContact CB-O 3.47Å; L125-D141 HydrophobicContact CD1-CB 4.4Å; L125-D141 PolarHBondContact N-O 3.48Å; L125-D141 PolarHBondContact O-N 3.06Å; L125-D141 VanDerWaalsContact O-N 3.14Å; L125-V143 HydrophobicContact CD1-CG2 3.96Å; L125-Y173 HydrophobicContact CD1-CD1 4.42Å; L125-Y173 HydrophobicContact CD1-CE1 4.44Å
126Y80.6Confident66.1Low59 Ų5978.7 Ų78.723%0.23142%0.423CS..EExtended strand (participates in β ladder)trans-107139.4178.9-53.5-92.8000110.8M114 W115 V117 L124 T140M114-Y126 CarbonylContact C-O 3.47Å; M114-Y126 VanDerWaalsContact CA-O 3.24Å; M114-Y126 WeakPolarHBondContact CA-O 3.45Å; M114-Y126 WeakPolarHBondContact CB-O 3.43Å; W115-Y126 AromaticContact CD1-CD2 3.91Å; W115-Y126 PolarHBondContact N-O 3.27Å; W115-Y126 PolarHBondContact O-N 3.45Å; V117-Y126 HydrophobicContact CB-CE2 4.4Å; V117-Y126 HydrophobicContact CG2-CD2 4.42Å; V117-Y126 HydrophobicContact CG2-CE2 4Å; L124-Y126 HydrophobicContact CB-CD2 4.48Å; L124-Y126 HydrophobicContact CB-CE2 3.64Å; L124-Y126 WeakPolarHBondContact CD1-OH 3.43Å; Y126-T140 HydrophobicContact CD1-CG2 4.12Å; Y126-T140 HydrophobicContact CE1-CG2 3.92Å
127K72.8Confident63.8Low136 Ų13682.4 Ų82.459%0.59146%0.462SS*.SBendtrans-82.8-10.7179.4-67-169.7176.8-169.40114.8
128D61.3Low61.7Low133 Ų13384 Ų8471%0.71148%0.483SS*.SBendtrans-152.1159.8-178-151.6-14.1000110.6Q130D128-Q130 PolarHBondContact O-N 3.34Å
129K47.9Very low60Low111 Ų11192.6 Ų92.648%0.48352%0.52SS..  trans-78.7110.3-174.3-172.7-167.2-174.7-1680110.8E131K129-E131 HydrophobicContact CD-CG 4.2Å; K129-E131 WeakPolarHBondContact CE-OE1 3.45Å; K129-E131 HydrophobicContact CG-CG 4.48Å; K129-E131 IonicContact NZ-OE1 2.6Å; K129-E131 PolarHBondContact NZ-OE1 3Å; K129-E131 PolarHBondContact O-N 2.96Å
130Q48.8Very low58.8Low120 Ų12093.4 Ų93.456%0.56153%0.525SS*.  trans-80.1103.2165.5-77.1-172.646.300110.4D128D128-Q130 PolarHBondContact O-N 3.34Å
131E41.8Very low58.7Low137 Ų13792.8 Ų92.864%0.6452%0.52SS*.  trans-81.8116.4155-71.6-176170.800108.7K129K129-E131 HydrophobicContact CD-CG 4.2Å; K129-E131 WeakPolarHBondContact CE-OE1 3.45Å; K129-E131 HydrophobicContact CG-CG 4.48Å; K129-E131 IonicContact NZ-OE1 2.6Å; K129-E131 PolarHBondContact NZ-OE1 3Å; K129-E131 PolarHBondContact O-N 2.96Å
132T41.1Very low58.9Low143 Ų14392.9 Ų92.988%0.87752%0.522SS*.SBendtrans45.6103.4162.555.80000118.5
133G36.3Very low58.7Low64 Ų6490 Ų9066%0.6651%0.509SS*.  trans127.5136.215200000116.3K135G133-K135 PolarHBondContact O-N 2.92Å
134V43.2Very low58.5Low142 Ų14294.6 Ų94.686%0.86153%0.531SS*.  trans-63.1116.6-174.6178.10000113.2
135K33.6Very low58.3Low183 Ų18393.3 Ų93.380%0.79652%0.524SS*.  trans-169.4139.2136.4-106.7166.5-173179.10112.2G133G133-K135 PolarHBondContact O-N 2.92Å
136P44.1Very low57.8Low131 Ų13195.1 Ų95.185%0.85154%0.537SS*.  trans-88.2129.9-174.833.8-32.9000112.4
137G39Very low57.4Low78 Ų7894.4 Ų94.480%0.80455%0.547SS*.  trans-161.6-24.5176.600000115.4
138G43.8Very low57.9Low59 Ų5988.1 Ų88.161%0.60852%0.52SS*.SBendtrans-75.8141169.800000111.9T140G138-T140 PolarHBondContact O-N 3.33Å
139K49Very low59Low179 Ų17985.7 Ų85.778%0.77851%0.51SS*.  trans-67.396170.7-70.2-175.1178.7-176.90109.9
140T59.6Low61Low58 Ų5881.3 Ų81.336%0.35649%0.492SS..  trans-78.7125168.9-47.50000109L125 Y126 G138 V142L125-T140 WeakPolarHBondContact O-CA 3.48Å; Y126-T140 HydrophobicContact CD1-CG2 4.12Å; Y126-T140 HydrophobicContact CE1-CG2 3.92Å; G138-T140 PolarHBondContact O-N 3.33Å; T140-V142 HydrophobicContact CG2-CG2 3.99Å
141D71.3Confident62.9Low54 Ų5481.3 Ų81.329%0.28949%0.492SS..EExtended strand (participates in β ladder)trans-92114168.8-156.2-15.7000106.2L125 Y173L125-D141 HydrophobicContact CB-CB 4.22Å; L125-D141 WeakPolarHBondContact CB-O 3.47Å; L125-D141 HydrophobicContact CD1-CB 4.4Å; L125-D141 PolarHBondContact N-O 3.48Å; L125-D141 PolarHBondContact O-N 3.06Å; L125-D141 VanDerWaalsContact O-N 3.14Å; D141-Y173 PolarHBondContact OD1-OH 3.35Å
142V80Confident65.1Low69 Ų6979.6 Ų79.642%0.41848%0.479SS..EExtended strand (participates in β ladder)trans-100.1113.7-177178.90000107.7E122 L124 T140E122-V142 HydrophobicContact CB-CG1 4.36Å; E122-V142 HydrophobicContact CG-CG1 4.43Å; L124-V142 HydrophobicContact CD2-CB 4.33Å; L124-V142 HydrophobicContact CD2-CG1 3.91Å; L124-V142 HydrophobicContact CD2-CG2 3.84Å; T140-V142 HydrophobicContact CG2-CG2 3.99Å
143V81.9Confident67.2Low3 Ų372.8 Ų72.82%0.01844%0.438CS..EExtended strand (participates in β ladder)trans-104.2102.1-178.2-174.50000108.5L123 L125 L145 T167 Y173L123-V143 HydrophobicContact CB-CB 4.22Å; L123-V143 PolarHBondContact N-O 2.96Å; L123-V143 PolarHBondContact O-N 2.99Å; L125-V143 HydrophobicContact CD1-CG2 3.96Å; V143-L145 PolarHBondContact O-N 3.42Å; V143-T167 HydrophobicContact CG1-CG2 3.59Å; V143-Y173 HydrophobicContact CG1-CD2 4.17Å; V143-Y173 HydrophobicContact CG1-CE2 4.1Å; V143-Y173 HydrophobicContact CG2-CD1 4.13Å; V143-Y173 HydrophobicContact CG2-CD2 4.3Å; V143-Y173 HydrophobicContact CG2-CE1 3.69Å; V143-Y173 HydrophobicContact CG2-CE2 3.91Å; V143-Y173 HydrophobicContact CG2-CG 4.41Å
144Q81.6Confident69Low98 Ų9873.4 Ų73.446%0.45844%0.436SS..EExtended strand (participates in β ladder)trans-71.1126.9178.2-166.616356.500110.4C146Q144-C146 HydrophobicContact CG-CB 4.43Å
145L82Confident70.4Confident0 Ų073.3 Ų73.30%043%0.427CS..  trans-92.1-11.6-171.4-61.4176.8000113.4L118 D121 L123 V143 G147 A148 I165 I190 T193 V194L118-L145 HydrophobicContact CD1-CD1 3.46Å; L118-L145 VanDerWaalsContact CD1-CD1 3.46Å; D121-L145 WeakPolarHBondContact O-CB 3.44Å; D121-L145 PolarHBondContact O-N 3.28Å; L123-L145 HydrophobicContact CB-CD1 4.29Å; L123-L145 HydrophobicContact CB-CD2 4.17Å; L123-L145 HydrophobicContact CB-CG 4.37Å; V143-L145 PolarHBondContact O-N 3.42Å; L145-G147 PolarHBondContact O-N 3.05Å; L145-A148 VanDerWaalsContact O-CB 3.3Å; L145-A148 WeakPolarHBondContact O-CB 3.41Å; L145-A148 PolarHBondContact O-N 3.4Å; L145-I165 HydrophobicContact CD2-CG2 4.38Å; L145-I190 HydrophobicContact CD1-CG2 4.24Å; L145-I190 HydrophobicContact CD2-CG2 4.03Å; L145-T193 HydrophobicContact CD1-CG2 3.76Å; L145-V194 HydrophobicContact CB-CG2 4.04Å
146C74.8Confident72.1Confident41 Ų4168.6 Ų68.628%0.27741%0.406SS..THydrogen-bonded Turntrans-59.1106.5-177.5-50.80000112.3Q144 A148 N168Q144-C146 HydrophobicContact CG-CB 4.43Å; C146-A148 VanDerWaalsContact C-N 3.31Å; C146-N168 PolarHBondContact O-ND2 3.33Å
147G71.3Confident73.6Confident43 Ų4363 Ų6344%0.44337%0.37SS..THydrogen-bonded Turntrans70.920.6-175.500000114.7L145L145-G147 PolarHBondContact O-N 3.05Å
148A84.3Confident75.2Confident5 Ų565.3 Ų65.34%0.04137%0.374CS..  trans-71.7159.9168.200000111.3L145 C146 I165 T166 V194L145-A148 VanDerWaalsContact O-CB 3.3Å; L145-A148 WeakPolarHBondContact O-CB 3.41Å; L145-A148 PolarHBondContact O-N 3.4Å; C146-A148 VanDerWaalsContact C-N 3.31Å; A148-I165 HydrophobicContact CB-CG2 4.18Å; A148-T166 CarbonylContact C-O 3.43Å; A148-T166 WeakPolarHBondContact CA-O 3.48Å; A148-T166 WeakPolarHBondContact CB-O 3.44Å; A148-V194 HydrophobicContact CB-CG2 4.25Å; A148-V194 WeakPolarHBondContact O-CG1 3.49Å
149V84.4Confident77Confident81 Ų8165.7 Ų65.749%0.49136%0.359SS..EExtended strand (participates in β ladder)trans-118.5130.7174.6-1800000109.3E151 T166V149-E151 HydrophobicContact CG1-CG 4.24Å; V149-T166 PolarHBondContact N-O 2.63Å; V149-T166 PolarHBondContact O-N 2.99Å
150I89.7Confident78.5Confident19 Ų1965.4 Ų65.410%0.09736%0.358CS..EExtended strand (participates in β ladder)trans-116.3124.8179.9-169.4173.4000111.5F163 Q164 I165 H187 I190 R191I150-F163 HydrophobicContact CD1-CD2 3.78Å; I150-F163 HydrophobicContact CD1-CE2 4.02Å; I150-F163 HydrophobicContact CG1-CD2 4.08Å; I150-Q164 WeakPolarHBondContact CA-O 3.46Å; I150-I165 HydrophobicContact CD1-CG1 4.3Å; I150-I165 HydrophobicContact CG1-CG1 4.25Å; I150-H187 HydrophobicContact CD1-CB 4.42Å; I150-I190 HydrophobicContact CD1-CB 4Å; I150-I190 HydrophobicContact CD1-CG2 3.81Å; I150-R191 HydrophobicContact CG2-CB 3.89Å; I150-R191 HydrophobicContact CG2-CG 4.26Å
151E88.1Confident79.8Confident120 Ų12064.5 Ų64.556%0.56135%0.351SS*.EExtended strand (participates in β ladder)trans-138.6145.9-178.2-68.7-177.6162.200111.1V149 A153 F163 Q164V149-E151 HydrophobicContact CG1-CG 4.24Å; E151-A153 PolarHBondContact O-N 3.29Å; E151-F163 CarbonylContact O-C 3.36Å; E151-F163 WeakPolarHBondContact O-CA 3.14Å; E151-Q164 PolarHBondContact N-O 3.05Å; E151-Q164 PolarHBondContact O-N 3.05Å
152W88.5Confident80.7Confident101 Ų10162.1 Ų62.138%0.38334%0.338SS..EExtended strand (participates in β ladder)trans-68.5128168.8-71.4110.9000109.9F163 F180 A183 H187W152-F163 HydrophobicContact CD2-CB 4.4Å; W152-F163 HydrophobicContact CE3-CB 3.85Å; W152-F163 HydrophobicContact CE3-CD1 4.46Å; W152-F163 HydrophobicContact CH2-CD1 4.39Å; W152-F163 HydrophobicContact CZ3-CB 4.17Å; W152-F163 AromaticContact CZ3-CD1 3.91Å; W152-F163 HydrophobicContact CZ3-CD1 3.91Å; W152-F180 HydrophobicContact CH2-CE2 4.39Å; W152-A183 HydrophobicContact CH2-CB 3.97Å; W152-A183 HydrophobicContact CZ3-CB 4.16Å; W152-H187 AromaticContact CD1-CE1 3.81Å; W152-H187 AromaticContact CD1-NE2 3.81Å; W152-H187 AromaticContact CE2-CD2 4Å; W152-H187 AromaticContact CE2-CE1 3.58Å; W152-H187 AromaticContact CE2-CG 3.95Å; W152-H187 AromaticContact CE2-ND1 3.72Å; W152-H187 AromaticContact CE2-NE2 3.78Å; W152-H187 HydrophobicContact CH2-CB 4.12Å; W152-H187 HydrophobicContact CZ2-CB 4.02Å; W152-H187 AromaticContact CZ2-CE1 3.97Å; W152-H187 AromaticContact CZ2-CG 3.73Å; W152-H187 AromaticContact CZ2-ND1 3.61Å; W152-H187 AromaticContact NE1-CE1 3.19Å; W152-H187 PolarHBondContact NE1-CE1 3.47Å; W152-H187 AromaticContact NE1-ND1 3.72Å; W152-H187 AromaticContact NE1-NE2 3.57Å
153A83.6Confident81.2Confident1 Ų158.9 Ų58.91%0.00832%0.318CS..  trans-127.151-167.200000112.1E151 E155 K156 V162 Q164 L174E151-A153 PolarHBondContact O-N 3.29Å; A153-E155 PolarHBondContact O-N 3.23Å; A153-K156 HydrophobicContact CB-CB 4.45Å; A153-K156 HydrophobicContact CB-CD 4.31Å; A153-K156 PolarHBondContact O-N 3.11Å; A153-V162 PolarHBondContact N-O 2.92Å; A153-Q164 HydrophobicContact CB-CB 3.75Å; A153-L174 HydrophobicContact CB-CD2 4.19Å
154A74.8Confident81.6Confident76 Ų7659 Ų5963%0.62832%0.319SS*.G310 helixtrans-64.7-24.6-178.200000112.9
155E72.9Confident82.1Confident140 Ų14054.3 Ų54.365%0.65430%0.297SS*.G310 helixtrans-78.2-18.5177.473.7-60.8147.900113.8A153A153-E155 PolarHBondContact O-N 3.23Å
156K70.4Confident82.4Confident85 Ų8556.2 Ų56.237%0.3731%0.308SS..G310 helixtrans-91.2-4.7-179.3-64.4179.8-165.3-178.90113.4K109 A153 L174K109-K156 PolarHBondContact NZ-O 2.96Å; A153-K156 HydrophobicContact CB-CB 4.45Å; A153-K156 HydrophobicContact CB-CD 4.31Å; A153-K156 PolarHBondContact O-N 3.11Å; K156-L174 HydrophobicContact CB-CD1 4.44Å; K156-L174 HydrophobicContact CB-CD2 4.47Å
157S74.6Confident83Confident12 Ų1254.8 Ų54.88%0.08430%0.298CS..  trans-151.1145.9179.5-161.10000113.6W111 K159W111-S157 WeakPolarHBondContact CZ2-OG 3.41Å; S157-K159 PolarHBondContact O-N 2.9Å; S157-K159 PolarHBondContact OG-N 3.46Å
158S73.3Confident83.4Confident128 Ų12857.2 Ų57.290%0.89530%0.302SS*.SBendtrans-77.7-6.6170.553.30000113.8
159K80.2Confident83.1Confident66 Ų6660.9 Ų60.929%0.28732%0.323SS..SBendtrans-77.8144.7172.2-67.1-167.5166.6-1650110.1W111 S157 V162 Q176W111-K159 HydrophobicContact CD2-CD 4.38Å; W111-K159 HydrophobicContact CZ2-CD 4.35Å; S157-K159 PolarHBondContact O-N 2.9Å; S157-K159 PolarHBondContact OG-N 3.46Å; K159-V162 HydrophobicContact CB-CG2 3.83Å; K159-V162 VanDerWaalsContact O-CG2 3.25Å; K159-V162 WeakPolarHBondContact O-CG2 3.4Å; K159-Q176 HydrophobicContact CB-CG 4.13Å; K159-Q176 HydrophobicContact CD-CG 3.98Å; K159-Q176 VanDerWaalsContact CD-OE1 3.24Å
160K81.5Confident82.8Confident174 Ų17458.3 Ų58.376%0.75731%0.313SS*.SBendtrans-75.4162.3171.4-62.5-175.8178.9-176.60110.8V162 Q176K160-V162 PolarHBondContact O-N 2.8Å; K160-Q176 WeakPolarHBondContact O-CG 3.31Å
161N87Confident82.7Confident39 Ų3957.6 Ų57.621%0.20931%0.31CS..SBendtrans57.146.2173.6-40.6-33.3000113.8A177 D178 F180 A183N161-A177 WeakPolarHBondContact CB-O 3.44Å; N161-A177 PolarHBondContact ND2-O 3.42Å; N161-D178 PolarHBondContact ND2-O 3.46Å; N161-F180 PolarHBondContact ND2-N 2.6Å; N161-A183 HydrophobicContact CB-CB 3.74Å
162V89.3Confident82.7Confident4 Ų454.1 Ų54.12%0.02429%0.294CS..EExtended strand (participates in β ladder)trans-105.9127.9-178.1-176.20000110.7W111 A153 K159 K160 L174 I175 Q176W111-V162 HydrophobicContact CH2-CG1 4.15Å; W111-V162 HydrophobicContact CH2-CG2 4.5Å; A153-V162 PolarHBondContact N-O 2.92Å; K159-V162 HydrophobicContact CB-CG2 3.83Å; K159-V162 VanDerWaalsContact O-CG2 3.25Å; K159-V162 WeakPolarHBondContact O-CG2 3.4Å; K160-V162 PolarHBondContact O-N 2.8Å; V162-L174 HydrophobicContact CG1-CB 4.17Å; V162-L174 HydrophobicContact CG1-CD2 4.31Å; V162-I175 WeakPolarHBondContact CA-O 3.45Å; V162-Q176 HydrophobicContact CG2-CB 3.99Å; V162-Q176 HydrophobicContact CG2-CG 3.89Å
163F90.8Very high82.8Confident0 Ų049.8 Ų49.80%028%0.277CS..EExtended strand (participates in β ladder)trans-121.1153.116957.5-87000110.8I150 E151 W152 I165 L174 I175 A183 W186 H187 I190I150-F163 HydrophobicContact CD1-CD2 3.78Å; I150-F163 HydrophobicContact CD1-CE2 4.02Å; I150-F163 HydrophobicContact CG1-CD2 4.08Å; E151-F163 CarbonylContact O-C 3.36Å; E151-F163 WeakPolarHBondContact O-CA 3.14Å; W152-F163 HydrophobicContact CD2-CB 4.4Å; W152-F163 HydrophobicContact CE3-CB 3.85Å; W152-F163 HydrophobicContact CE3-CD1 4.46Å; W152-F163 HydrophobicContact CH2-CD1 4.39Å; W152-F163 HydrophobicContact CZ3-CB 4.17Å; W152-F163 AromaticContact CZ3-CD1 3.91Å; W152-F163 HydrophobicContact CZ3-CD1 3.91Å; F163-I165 HydrophobicContact CD2-CG1 4.38Å; F163-I165 HydrophobicContact CE2-CD1 4.39Å; F163-I165 HydrophobicContact CE2-CG1 4.44Å; F163-L174 WeakPolarHBondContact O-CA 3.49Å; F163-I175 HydrophobicContact CD2-CB 4.16Å; F163-I175 HydrophobicContact CE1-CB 4.15Å; F163-I175 HydrophobicContact CE1-CG2 3.96Å; F163-I175 HydrophobicContact CE2-CB 3.69Å; F163-I175 HydrophobicContact CE2-CD1 4.03Å; F163-I175 HydrophobicContact CE2-CG1 4.23Å; F163-I175 HydrophobicContact CE2-CG2 4.02Å; F163-I175 HydrophobicContact CZ-CB 3.69Å; F163-I175 HydrophobicContact CZ-CD1 4.41Å; F163-I175 HydrophobicContact CZ-CG2 3.51Å; F163-I175 PolarHBondContact N-O 2.97Å; F163-I175 PolarHBondContact O-N 3.23Å; F163-A183 HydrophobicContact CE1-CB 4.46Å; F163-W186 HydrophobicContact CZ-CB 4.13Å; F163-H187 HydrophobicContact CD1-CB 4.13Å; F163-H187 HydrophobicContact CD2-CB 4.49Å; F163-H187 HydrophobicContact CE1-CB 4.18Å; F163-H187 HydrophobicContact CG-CB 4.28Å; F163-H187 HydrophobicContact CZ-CB 4.37Å; F163-I190 HydrophobicContact CE2-CD1 4.06Å; F163-I190 HydrophobicContact CZ-CD1 4.37Å
164Q91.5Very high83.1Confident5 Ų549.8 Ų49.82%0.02328%0.277CS..EExtended strand (participates in β ladder)trans-104.8137.5176.1176.3167.6-33.100110I150 E151 A153 T166 E172 Y173 L174I150-Q164 WeakPolarHBondContact CA-O 3.46Å; E151-Q164 PolarHBondContact N-O 3.05Å; E151-Q164 PolarHBondContact O-N 3.05Å; A153-Q164 HydrophobicContact CB-CB 3.75Å; Q164-T166 PolarHBondContact NE2-OG1 3.36Å; Q164-E172 PolarHBondContact NE2-OE1 2.85Å; Q164-Y173 CarbonylContact C-O 3.59Å; Q164-Y173 VanDerWaalsContact CA-O 3.32Å; Q164-Y173 WeakPolarHBondContact CA-O 2.76Å; Q164-L174 HydrophobicContact CB-CD2 3.8Å; Q164-L174 HydrophobicContact CG-CD2 4.21Å
165I90.9Very high83.9Confident1 Ų146.2 Ų46.21%0.00525%0.248CC..EExtended strand (participates in β ladder)trans-109.6129.6162.8-56.2175.6000107.7L123 L145 A148 I150 F163 Y173 I175 I190L123-I165 HydrophobicContact CD2-CD1 3.84Å; L145-I165 HydrophobicContact CD2-CG2 4.38Å; A148-I165 HydrophobicContact CB-CG2 4.18Å; I150-I165 HydrophobicContact CD1-CG1 4.3Å; I150-I165 HydrophobicContact CG1-CG1 4.25Å; F163-I165 HydrophobicContact CD2-CG1 4.38Å; F163-I165 HydrophobicContact CE2-CD1 4.39Å; F163-I165 HydrophobicContact CE2-CG1 4.44Å; I165-Y173 PolarHBondContact N-O 3.21Å; I165-Y173 PolarHBondContact O-N 3.02Å; I165-I175 HydrophobicContact CD1-CD1 3.57Å; I165-I175 HydrophobicContact CD1-CG1 4.44Å; I165-I175 HydrophobicContact CG1-CD1 4.43Å; I165-I190 HydrophobicContact CD1-CD1 4.04Å; I165-I190 HydrophobicContact CD1-CG2 3.96Å
166T87.9Confident84.8Confident39 Ų3940.1 Ų40.124%0.23922%0.219CC..EExtended strand (participates in β ladder)trans-116.9113.6175.4-48.60000108.3A148 V149 Q164 S171 E172A148-T166 CarbonylContact C-O 3.43Å; A148-T166 WeakPolarHBondContact CA-O 3.48Å; A148-T166 WeakPolarHBondContact CB-O 3.44Å; V149-T166 PolarHBondContact N-O 2.63Å; V149-T166 PolarHBondContact O-N 2.99Å; Q164-T166 PolarHBondContact NE2-OG1 3.36Å; T166-S171 WeakPolarHBondContact CA-O 3.34Å; T166-E172 HydrophobicContact CG2-CG 4.14Å
167T87Confident85.7Confident11 Ų1136.2 Ų36.27%0.06720%0.203CC..  trans-75.7160.4-179.8610000111.8V143 T169 G170 S171 Y173V143-T167 HydrophobicContact CG1-CG2 3.59Å; T167-T169 PolarHBondContact O-N 3.22Å; T167-T169 PolarHBondContact OG1-OG1 3.46Å; T167-G170 PolarHBondContact O-N 2.86Å; T167-S171 PolarHBondContact N-O 3.47Å; T167-S171 WeakPolarHBondContact OG1-CB 3.42Å; T167-S171 PolarHBondContact OG1-N 3.01Å; T167-S171 VanDerWaalsContact OG1-N 3.08Å; T167-S171 PolarHBondContact OG1-O 3.03Å; T167-Y173 HydrophobicContact CG2-CE2 4.33Å
168N81.4Confident86.2Confident95 Ų9542.1 Ų42.151%0.50823%0.234SC..THydrogen-bonded Turntrans-55.6-27.6170.360.89.7000113.4C146 G170C146-N168 PolarHBondContact O-ND2 3.33Å; N168-G170 PolarHBondContact O-N 2.96Å
169T78.1Confident86.8Confident82 Ų8238.2 Ų38.250%0.50321%0.206SC..THydrogen-bonded Turntrans-75.6-3.5173.654.40000114.3T167 S171T167-T169 PolarHBondContact O-N 3.22Å; T167-T169 PolarHBondContact OG1-OG1 3.46Å; T169-S171 VanDerWaalsContact C-N 3.35Å
170G77.8Confident87.1Confident27 Ų2740.8 Ų40.828%0.27822%0.217SC..SBendtrans75.422.1-177.400000113.9S101 G104 T167 N168S101-G170 PolarHBondContact OG-O 3.46Å; G104-G170 PolarHBondContact N-O 2.74Å; T167-G170 PolarHBondContact O-N 2.86Å; N168-G170 PolarHBondContact O-N 2.96Å
171S86.2Confident87.4Confident4 Ų436.9 Ų36.93%0.02821%0.21CC..  trans-87.2137.2168.1-630000109.7S101 N103 T166 T167 T169S101-S171 WeakPolarHBondContact O-CA 3.38Å; N103-S171 PolarHBondContact N-OG 3Å; N103-S171 PolarHBondContact OD1-OG 3.46Å; T166-S171 WeakPolarHBondContact CA-O 3.34Å; T167-S171 PolarHBondContact N-O 3.47Å; T167-S171 WeakPolarHBondContact OG1-CB 3.42Å; T167-S171 PolarHBondContact OG1-N 3.01Å; T167-S171 VanDerWaalsContact OG1-N 3.08Å; T167-S171 PolarHBondContact OG1-O 3.03Å; T169-S171 VanDerWaalsContact C-N 3.35Å
172E89.8Confident87.4Confident47 Ų4737 Ų3722%0.2221%0.212CC..EExtended strand (participates in β ladder)trans-118.2124-175.7-68.5-177.3122.300109.3I100 S101 Q164 T166I100-E172 HydrophobicContact CD1-CB 4.04Å; I100-E172 HydrophobicContact CG1-CB 3.53Å; I100-E172 WeakPolarHBondContact CG1-O 3.41Å; I100-E172 PolarHBondContact N-O 3.38Å; S101-E172 WeakPolarHBondContact CB-OE2 3.19Å; S101-E172 PolarHBondContact N-O 2.91Å; S101-E172 PolarHBondContact O-N 3.04Å; Q164-E172 PolarHBondContact NE2-OE1 2.85Å; T166-E172 HydrophobicContact CG2-CG 4.14Å
173Y89.9Confident87.3Confident10 Ų1036.8 Ų36.84%0.03921%0.211CC..EExtended strand (participates in β ladder)trans-119.8130.6179.6-66-101.7000109.4V97 K99 L125 D141 V143 Q164 I165 T167V97-Y173 HydrophobicContact CG1-CD1 4.22Å; K99-Y173 HydrophobicContact CB-CD1 4.05Å; K99-Y173 HydrophobicContact CB-CE1 4.04Å; K99-Y173 HydrophobicContact CD-CD1 4.44Å; K99-Y173 HydrophobicContact CD-CE1 3.67Å; K99-Y173 HydrophobicContact CD-CE2 4.38Å; K99-Y173 VanDerWaalsContact CE-OH 3.3Å; K99-Y173 WeakPolarHBondContact CE-OH 3.22Å; K99-Y173 HydrophobicContact CG-CD1 4.11Å; K99-Y173 HydrophobicContact CG-CE1 3.84Å; K99-Y173 HydrophobicContact CG-CE2 4.46Å; K99-Y173 PolarHBondContact NZ-OH 3.3Å; L125-Y173 HydrophobicContact CD1-CD1 4.42Å; L125-Y173 HydrophobicContact CD1-CE1 4.44Å; D141-Y173 PolarHBondContact OD1-OH 3.35Å; V143-Y173 HydrophobicContact CG1-CD2 4.17Å; V143-Y173 HydrophobicContact CG1-CE2 4.1Å; V143-Y173 HydrophobicContact CG2-CD1 4.13Å; V143-Y173 HydrophobicContact CG2-CD2 4.3Å; V143-Y173 HydrophobicContact CG2-CE1 3.69Å; V143-Y173 HydrophobicContact CG2-CE2 3.91Å; V143-Y173 HydrophobicContact CG2-CG 4.41Å; Q164-Y173 CarbonylContact C-O 3.59Å; Q164-Y173 VanDerWaalsContact CA-O 3.32Å; Q164-Y173 WeakPolarHBondContact CA-O 2.76Å; I165-Y173 PolarHBondContact N-O 3.21Å; I165-Y173 PolarHBondContact O-N 3.02Å; T167-Y173 HydrophobicContact CG2-CE2 4.33Å
174L90.7Very high87.2Confident1 Ų138.7 Ų38.71%0.00522%0.224CC..EExtended strand (participates in β ladder)trans-98.8129.8168.2-60.8178.7000109.1V97 A98 I100 K109 W111 A153 K156 V162 F163 Q164V97-L174 CarbonylContact C-O 3.59Å; V97-L174 VanDerWaalsContact CA-O 3.32Å; V97-L174 WeakPolarHBondContact CA-O 3.27Å; A98-L174 HydrophobicContact CB-CB 4.49Å; A98-L174 PolarHBondContact N-O 2.87Å; A98-L174 PolarHBondContact O-N 3.08Å; I100-L174 HydrophobicContact CD1-CD1 4.14Å; I100-L174 HydrophobicContact CD1-CD2 4.04Å; I100-L174 HydrophobicContact CD1-CG 3.89Å; I100-L174 HydrophobicContact CG1-CG 4.34Å; I100-L174 HydrophobicContact CG2-CD1 3.86Å; I100-L174 HydrophobicContact CG2-CG 4.09Å; K109-L174 HydrophobicContact CD-CD1 3.85Å; W111-L174 HydrophobicContact CH2-CB 3.66Å; W111-L174 HydrophobicContact CH2-CD1 4.27Å; W111-L174 HydrophobicContact CZ2-CB 4.42Å; W111-L174 HydrophobicContact CZ2-CD1 4.25Å; W111-L174 HydrophobicContact CZ3-CB 4.17Å; A153-L174 HydrophobicContact CB-CD2 4.19Å; K156-L174 HydrophobicContact CB-CD1 4.44Å; K156-L174 HydrophobicContact CB-CD2 4.47Å; V162-L174 HydrophobicContact CG1-CB 4.17Å; V162-L174 HydrophobicContact CG1-CD2 4.31Å; F163-L174 WeakPolarHBondContact O-CA 3.49Å; Q164-L174 HydrophobicContact CB-CD2 3.8Å; Q164-L174 HydrophobicContact CG-CD2 4.21Å
175I90.8Very high87.1Confident1 Ų142.6 Ų42.61%0.00524%0.241CC..EExtended strand (participates in β ladder)trans-117.2138.8176.1-56.6-169.9000108.9L95 N96 V97 L123 V162 F163 I165L95-I175 HydrophobicContact CB-CG2 3.97Å; L95-I175 HydrophobicContact CD1-CG2 3.72Å; L95-I175 HydrophobicContact CG-CG2 4.38Å; N96-I175 CarbonylContact O-C 3.54Å; V97-I175 HydrophobicContact CG1-CG1 4.35Å; V97-I175 HydrophobicContact CG2-CG1 4.2Å; L123-I175 HydrophobicContact CD2-CD1 3.61Å; V162-I175 WeakPolarHBondContact CA-O 3.45Å; F163-I175 HydrophobicContact CD2-CB 4.16Å; F163-I175 HydrophobicContact CE1-CB 4.15Å; F163-I175 HydrophobicContact CE1-CG2 3.96Å; F163-I175 HydrophobicContact CE2-CB 3.69Å; F163-I175 HydrophobicContact CE2-CD1 4.03Å; F163-I175 HydrophobicContact CE2-CG1 4.23Å; F163-I175 HydrophobicContact CE2-CG2 4.02Å; F163-I175 HydrophobicContact CZ-CB 3.69Å; F163-I175 HydrophobicContact CZ-CD1 4.41Å; F163-I175 HydrophobicContact CZ-CG2 3.51Å; F163-I175 PolarHBondContact N-O 2.97Å; F163-I175 PolarHBondContact O-N 3.23Å; I165-I175 HydrophobicContact CD1-CD1 3.57Å; I165-I175 HydrophobicContact CD1-CG1 4.44Å; I165-I175 HydrophobicContact CG1-CD1 4.43Å
176Q92.5Very high87.1Confident11 Ų1142.6 Ų42.65%0.05124%0.241CC..EExtended strand (participates in β ladder)trans-136.8131.8-179.9-178-100.6-48.800110.9N96 W111 K159 K160 V162 D178N96-Q176 HydrophobicContact CB-CB 4.11Å; N96-Q176 VanDerWaalsContact CB-OE1 3.31Å; N96-Q176 PolarHBondContact N-O 3.03Å; N96-Q176 PolarHBondContact ND2-OE1 2.78Å; N96-Q176 PolarHBondContact O-N 3.46Å; W111-Q176 HydrophobicContact CH2-CB 4.21Å; W111-Q176 HydrophobicContact CZ3-CB 3.91Å; K159-Q176 HydrophobicContact CB-CG 4.13Å; K159-Q176 HydrophobicContact CD-CG 3.98Å; K159-Q176 VanDerWaalsContact CD-OE1 3.24Å; K160-Q176 WeakPolarHBondContact O-CG 3.31Å; V162-Q176 HydrophobicContact CG2-CB 3.99Å; V162-Q176 HydrophobicContact CG2-CG 3.89Å; Q176-D178 PolarHBondContact NE2-OD1 3.31Å
177A89Confident87.3Confident4 Ų440.9 Ų40.93%0.03323%0.23CC..  trans-112.9151.5167.600000110.6L95 N161 S179 T182 A183L95-A177 HydrophobicContact CD2-CB 3.81Å; N161-A177 WeakPolarHBondContact CB-O 3.44Å; N161-A177 PolarHBondContact ND2-O 3.42Å; A177-S179 VanDerWaalsContact C-N 3.3Å; A177-S179 PolarHBondContact O-N 2.74Å; A177-T182 HydrophobicContact CB-CG2 3.69Å; A177-A183 HydrophobicContact CB-CB 3.99Å
178D85.1Confident87.4Confident136 Ų13646.4 Ų46.473%0.72726%0.255SS*.SBendtrans-75.4-22.6-175.7-61.2-35.2000112.5N161 Q176N161-D178 PolarHBondContact ND2-O 3.46Å; Q176-D178 PolarHBondContact NE2-OD1 3.31Å
179S85.9Confident87.7Confident46 Ų4642.4 Ų42.432%0.32224%0.236SC..SBendtrans-108.7144.7172.2100.50000112A177 P181 T182 A183A177-S179 VanDerWaalsContact C-N 3.3Å; A177-S179 PolarHBondContact O-N 2.74Å; S179-P181 WeakPolarHBondContact OG-CD 3.41Å; S179-T182 VanDerWaalsContact OG-CB 3.24Å; S179-T182 WeakPolarHBondContact OG-CB 3.28Å; S179-T182 PolarHBondContact OG-N 3.3Å; S179-T182 PolarHBondContact OG-OG1 2.94Å; S179-A183 PolarHBondContact O-N 3.34Å
180F86.9Confident88.1Confident119 Ų11938.5 Ų38.552%0.52221%0.212SC..Hα-helixtrans-65.6-42.2173.3178.6-96.3000112.7W152 N161 T182 A183 S184W152-F180 HydrophobicContact CH2-CE2 4.39Å; N161-F180 PolarHBondContact ND2-N 2.6Å; F180-T182 VanDerWaalsContact C-N 3.32Å; F180-T182 PolarHBondContact O-N 3.31Å; F180-A183 PolarHBondContact O-N 3.34Å; F180-S184 WeakPolarHBondContact O-CB 3.24Å; F180-S184 PolarHBondContact O-N 2.9Å
181P87.7Confident88.6Confident93 Ų9342.2 Ų42.260%0.60422%0.217SC*.Hα-helixtrans-57-42174.1-27.536.2000113.3S179 S184 K185S179-P181 WeakPolarHBondContact OG-CD 3.41Å; P181-S184 PolarHBondContact O-N 2.96Å; P181-K185 VanDerWaalsContact O-CB 3.25Å; P181-K185 WeakPolarHBondContact O-CB 3.42Å; P181-K185 PolarHBondContact O-N 2.88Å
182T86.4Confident88.6Confident41 Ų4148 Ų4825%0.25224%0.242SC..Hα-helixtrans-63.2-49.2174.6-56.90000110.9E93 L95 A177 S179 F180 S184 K185 W186E93-T182 VanDerWaalsContact OE2-CG2 3.28Å; E93-T182 WeakPolarHBondContact OE2-CG2 3.34Å; L95-T182 HydrophobicContact CD2-CG2 4.33Å; A177-T182 HydrophobicContact CB-CG2 3.69Å; S179-T182 VanDerWaalsContact OG-CB 3.24Å; S179-T182 WeakPolarHBondContact OG-CB 3.28Å; S179-T182 PolarHBondContact OG-N 3.3Å; S179-T182 PolarHBondContact OG-OG1 2.94Å; F180-T182 VanDerWaalsContact C-N 3.32Å; F180-T182 PolarHBondContact O-N 3.31Å; T182-S184 VanDerWaalsContact C-N 3.33Å; T182-S184 PolarHBondContact O-N 3.45Å; T182-K185 PolarHBondContact O-N 2.89Å; T182-W186 VanDerWaalsContact O-CD1 3.28Å; T182-W186 PolarHBondContact O-N 3.21Å
183A87.9Confident88.4Confident0 Ų046 Ų460%023%0.233CC..Hα-helixtrans-59.6-43178.700000112.2W152 N161 F163 A177 S179 F180 W186 H187W152-A183 HydrophobicContact CH2-CB 3.97Å; W152-A183 HydrophobicContact CZ3-CB 4.16Å; N161-A183 HydrophobicContact CB-CB 3.74Å; F163-A183 HydrophobicContact CE1-CB 4.46Å; A177-A183 HydrophobicContact CB-CB 3.99Å; S179-A183 PolarHBondContact O-N 3.34Å; F180-A183 PolarHBondContact O-N 3.34Å; A183-W186 PolarHBondContact O-N 2.98Å; A183-H187 WeakPolarHBondContact O-CB 3.39Å; A183-H187 PolarHBondContact O-N 3.32Å
184S88.1Confident88.1Confident39 Ų3945.9 Ų45.927%0.27323%0.233SC..Hα-helixtrans-65.9-44.5179-164.90000111.8F180 P181 T182 W186 H187 E188F180-S184 WeakPolarHBondContact O-CB 3.24Å; F180-S184 PolarHBondContact O-N 2.9Å; P181-S184 PolarHBondContact O-N 2.96Å; T182-S184 VanDerWaalsContact C-N 3.33Å; T182-S184 PolarHBondContact O-N 3.45Å; S184-W186 PolarHBondContact O-N 2.93Å; S184-H187 PolarHBondContact O-N 3.04Å; S184-E188 VanDerWaalsContact O-CB 3.29Å; S184-E188 WeakPolarHBondContact O-CB 3.31Å; S184-E188 PolarHBondContact O-N 3.39Å
185K90Very high87.8Confident88 Ų8850.1 Ų50.138%0.38326%0.256SS..Hα-helixtrans-55-49.9174.7174.7-168.5170.5-167.20111.5E93 P181 T182 A189E93-K185 IonicContact OE1-NZ 2.82Å; E93-K185 PolarHBondContact OE1-NZ 2.98Å; P181-K185 VanDerWaalsContact O-CB 3.25Å; P181-K185 WeakPolarHBondContact O-CB 3.42Å; P181-K185 PolarHBondContact O-N 2.88Å; T182-K185 PolarHBondContact O-N 2.89Å; K185-A189 VanDerWaalsContact O-CB 3.3Å; K185-A189 WeakPolarHBondContact O-CB 3.39Å; K185-A189 PolarHBondContact O-N 3.08Å
186W90.5Very high87.1Confident0 Ų052.2 Ų52.20%027%0.271CS..Hα-helixtrans-68.1-43.5179-82.596.3000112.7L90 E93 L95 T116 L118 L123 F163 T182 A183 S184 A189 I190L90-W186 HydrophobicContact CB-CH2 4.4Å; E93-W186 HydrophobicContact CB-CZ2 3.8Å; E93-W186 HydrophobicContact CG-CZ2 4.05Å; E93-W186 PolarHBondContact OE2-NE1 2.8Å; L95-W186 HydrophobicContact CD1-CB 4.46Å; L95-W186 HydrophobicContact CD1-CD2 3.74Å; L95-W186 HydrophobicContact CD1-CE3 4.07Å; L95-W186 HydrophobicContact CD1-CG 3.89Å; T116-W186 HydrophobicContact CG2-CE3 4.31Å; T116-W186 HydrophobicContact CG2-CH2 4.13Å; T116-W186 HydrophobicContact CG2-CZ3 3.75Å; T116-W186 VanDerWaalsContact O-CH2 3.23Å; T116-W186 WeakPolarHBondContact O-CH2 3.32Å; L118-W186 HydrophobicContact CB-CZ3 3.83Å; L123-W186 HydrophobicContact CD1-CZ3 4.17Å; F163-W186 HydrophobicContact CZ-CB 4.13Å; T182-W186 VanDerWaalsContact O-CD1 3.28Å; T182-W186 PolarHBondContact O-N 3.21Å; A183-W186 PolarHBondContact O-N 2.98Å; S184-W186 PolarHBondContact O-N 2.93Å; W186-A189 PolarHBondContact O-N 2.76Å; W186-I190 HydrophobicContact CE3-CD1 4.23Å; W186-I190 WeakPolarHBondContact O-CB 3.35Å; W186-I190 WeakPolarHBondContact O-CD1 3.23Å; W186-I190 WeakPolarHBondContact O-CG1 3.36Å; W186-I190 PolarHBondContact O-N 3.42Å
187H91.1Very high85.7Confident4 Ų452.9 Ų52.92%0.01928%0.277CS..Hα-helixtrans-63.3-41.8178.4169.3-95.5000112.4I150 W152 F163 A183 S184 R191I150-H187 HydrophobicContact CD1-CB 4.42Å; W152-H187 AromaticContact CD1-CE1 3.81Å; W152-H187 AromaticContact CD1-NE2 3.81Å; W152-H187 AromaticContact CE2-CD2 4Å; W152-H187 AromaticContact CE2-CE1 3.58Å; W152-H187 AromaticContact CE2-CG 3.95Å; W152-H187 AromaticContact CE2-ND1 3.72Å; W152-H187 AromaticContact CE2-NE2 3.78Å; W152-H187 HydrophobicContact CH2-CB 4.12Å; W152-H187 HydrophobicContact CZ2-CB 4.02Å; W152-H187 AromaticContact CZ2-CE1 3.97Å; W152-H187 AromaticContact CZ2-CG 3.73Å; W152-H187 AromaticContact CZ2-ND1 3.61Å; W152-H187 AromaticContact NE1-CE1 3.19Å; W152-H187 PolarHBondContact NE1-CE1 3.47Å; W152-H187 AromaticContact NE1-ND1 3.72Å; W152-H187 AromaticContact NE1-NE2 3.57Å; F163-H187 HydrophobicContact CD1-CB 4.13Å; F163-H187 HydrophobicContact CD2-CB 4.49Å; F163-H187 HydrophobicContact CE1-CB 4.18Å; F163-H187 HydrophobicContact CG-CB 4.28Å; F163-H187 HydrophobicContact CZ-CB 4.37Å; A183-H187 WeakPolarHBondContact O-CB 3.39Å; A183-H187 PolarHBondContact O-N 3.32Å; S184-H187 PolarHBondContact O-N 3.04Å; H187-R191 PolarHBondContact CE1-NH2 3.47Å; H187-R191 VanDerWaalsContact O-CB 3.24Å; H187-R191 WeakPolarHBondContact O-CB 3.3Å; H187-R191 PolarHBondContact O-N 2.93Å
188E89.1Confident84.1Confident126 Ų12656.9 Ų56.959%0.58930%0.301SS*.Hα-helixtrans-68.5-42.5175.8-174.2175.9179.500112.2S184 R191 K192S184-E188 VanDerWaalsContact O-CB 3.29Å; S184-E188 WeakPolarHBondContact O-CB 3.31Å; S184-E188 PolarHBondContact O-N 3.39Å; E188-R191 PolarHBondContact O-N 2.9Å; E188-K192 WeakPolarHBondContact O-CB 3.27Å; E188-K192 PolarHBondContact O-N 2.81Å
189A87.4Confident82.5Confident12 Ų1260.8 Ų60.810%0.09931%0.305CS..Hα-helixtrans-63-48.717700000112L90 L118 K185 W186 R191 K192 T193L90-A189 HydrophobicContact CD1-CB 3.33Å; L118-A189 HydrophobicContact CD2-CB 3.71Å; K185-A189 VanDerWaalsContact O-CB 3.3Å; K185-A189 WeakPolarHBondContact O-CB 3.39Å; K185-A189 PolarHBondContact O-N 3.08Å; W186-A189 PolarHBondContact O-N 2.76Å; A189-R191 VanDerWaalsContact C-N 3.34Å; A189-R191 PolarHBondContact O-N 3.31Å; A189-K192 WeakPolarHBondContact O-CB 3.33Å; A189-K192 PolarHBondContact O-N 3.16Å; A189-K192 VanDerWaalsContact O-N 3.17Å; A189-T193 PolarHBondContact O-N 3.39Å; A189-T193 PolarHBondContact O-OG1 3.01Å; A189-T193 VanDerWaalsContact O-OG1 3.1Å
190I88Confident80.5Confident0 Ų066.1 Ų66.10%033%0.33CS..Hα-helixtrans-62.3-41.8177.5-66.2166.9000110.6L118 L123 L145 I150 F163 I165 W186 K192 T193 V194L118-I190 HydrophobicContact CD1-CG1 4.12Å; L118-I190 HydrophobicContact CD2-CG1 4.11Å; L123-I190 HydrophobicContact CD1-CD1 3.94Å; L123-I190 HydrophobicContact CD1-CG1 4.22Å; L123-I190 HydrophobicContact CD2-CD1 4.15Å; L145-I190 HydrophobicContact CD1-CG2 4.24Å; L145-I190 HydrophobicContact CD2-CG2 4.03Å; I150-I190 HydrophobicContact CD1-CB 4Å; I150-I190 HydrophobicContact CD1-CG2 3.81Å; F163-I190 HydrophobicContact CE2-CD1 4.06Å; F163-I190 HydrophobicContact CZ-CD1 4.37Å; I165-I190 HydrophobicContact CD1-CD1 4.04Å; I165-I190 HydrophobicContact CD1-CG2 3.96Å; W186-I190 HydrophobicContact CE3-CD1 4.23Å; W186-I190 WeakPolarHBondContact O-CB 3.35Å; W186-I190 WeakPolarHBondContact O-CD1 3.23Å; W186-I190 WeakPolarHBondContact O-CG1 3.36Å; W186-I190 PolarHBondContact O-N 3.42Å; I190-K192 PolarHBondContact O-N 2.68Å; I190-T193 WeakPolarHBondContact O-CB 3.1Å; I190-T193 PolarHBondContact O-N 3.44Å; I190-V194 HydrophobicContact CG2-CG2 4.45Å; I190-V194 VanDerWaalsContact O-CG2 3.32Å; I190-V194 WeakPolarHBondContact O-CG2 3.26Å; I190-V194 PolarHBondContact O-N 3.29Å
191R88.3Confident78.3Confident105 Ų10563.8 Ų63.840%0.39634%0.34SS..Hα-helixtrans-58-47.9173.4178.5-171.5-69.3164-16111.3I150 H187 E188 A189 T193 V194 D195I150-R191 HydrophobicContact CG2-CB 3.89Å; I150-R191 HydrophobicContact CG2-CG 4.26Å; H187-R191 PolarHBondContact CE1-NH2 3.47Å; H187-R191 VanDerWaalsContact O-CB 3.24Å; H187-R191 WeakPolarHBondContact O-CB 3.3Å; H187-R191 PolarHBondContact O-N 2.93Å; E188-R191 PolarHBondContact O-N 2.9Å; A189-R191 VanDerWaalsContact C-N 3.34Å; A189-R191 PolarHBondContact O-N 3.31Å; R191-T193 VanDerWaalsContact C-N 3.28Å; R191-T193 PolarHBondContact O-N 3.43Å; R191-V194 WeakPolarHBondContact O-CB 3.5Å; R191-V194 PolarHBondContact O-N 2.97Å; R191-D195 WeakPolarHBondContact CG-OD2 3.18Å; R191-D195 WeakPolarHBondContact O-CB 3.5Å; R191-D195 VanDerWaalsContact O-CG 3.29Å; R191-D195 PolarHBondContact O-N 2.93Å
192K85.8Confident75.7Confident126 Ų12671 Ų7155%0.54836%0.355SS..Hα-helixtrans-59.7-40.2179.5-173.4177.8178.8-178.20111.6E188 A189 I190 D195 S196E188-K192 WeakPolarHBondContact O-CB 3.27Å; E188-K192 PolarHBondContact O-N 2.81Å; A189-K192 WeakPolarHBondContact O-CB 3.33Å; A189-K192 PolarHBondContact O-N 3.16Å; A189-K192 VanDerWaalsContact O-N 3.17Å; I190-K192 PolarHBondContact O-N 2.68Å; K192-D195 PolarHBondContact O-N 3.37Å; K192-S196 PolarHBondContact O-N 3.15Å; K192-S196 PolarHBondContact O-OG 2.92Å
193T84.7Confident73.1Confident3 Ų372.2 Ų72.22%0.01838%0.376CS..Hα-helixtrans-63.8-46.4174.3-580000112.4L118 T120 L145 A189 I190 R191 S196 S197L118-T193 HydrophobicContact CD1-CG2 4.19Å; T120-T193 WeakPolarHBondContact O-CG2 3.45Å; L145-T193 HydrophobicContact CD1-CG2 3.76Å; A189-T193 PolarHBondContact O-N 3.39Å; A189-T193 PolarHBondContact O-OG1 3.01Å; A189-T193 VanDerWaalsContact O-OG1 3.1Å; I190-T193 WeakPolarHBondContact O-CB 3.1Å; I190-T193 PolarHBondContact O-N 3.44Å; R191-T193 VanDerWaalsContact C-N 3.28Å; R191-T193 PolarHBondContact O-N 3.43Å; T193-S196 WeakPolarHBondContact CA-OG 3.15Å; T193-S196 PolarHBondContact O-N 2.93Å; T193-S196 PolarHBondContact O-OG 3.48Å; T193-S197 PolarHBondContact O-N 2.99Å
194V85.2Confident70.4Confident9 Ų981.8 Ų81.86%0.05542%0.418CS..Hα-helixtrans-57.1-51.8173.3167.30000110.3L145 A148 I190 R191 S196 S197 T198L145-V194 HydrophobicContact CB-CG2 4.04Å; A148-V194 HydrophobicContact CB-CG2 4.25Å; A148-V194 WeakPolarHBondContact O-CG1 3.49Å; I190-V194 HydrophobicContact CG2-CG2 4.45Å; I190-V194 VanDerWaalsContact O-CG2 3.32Å; I190-V194 WeakPolarHBondContact O-CG2 3.26Å; I190-V194 PolarHBondContact O-N 3.29Å; R191-V194 WeakPolarHBondContact O-CB 3.5Å; R191-V194 PolarHBondContact O-N 2.97Å; V194-S196 PolarHBondContact O-N 3.29Å; V194-S197 PolarHBondContact O-N 2.95Å; V194-S197 VanDerWaalsContact O-N 3.14Å; V194-S197 PolarHBondContact O-OG 3.24Å; V194-T198 PolarHBondContact O-N 2.76Å
195D82.6Confident67.9Low89 Ų8985 Ų8548%0.47645%0.447SS..Hα-helixtrans-63.6-39.1-177.5-67.6-23.3000111.6R191 K192 T198R191-D195 WeakPolarHBondContact CG-OD2 3.18Å; R191-D195 WeakPolarHBondContact O-CB 3.5Å; R191-D195 VanDerWaalsContact O-CG 3.29Å; R191-D195 PolarHBondContact O-N 2.93Å; K192-D195 PolarHBondContact O-N 3.37Å; D195-T198 PolarHBondContact O-N 3.38Å; D195-T198 PolarHBondContact O-OG1 3.2Å
196S76.8Confident65.3Low46 Ų4688.6 Ų88.632%0.32247%0.469SS..Hα-helixtrans-63.5-39.9173.649.90000112.8K192 T193 V194 T198 R199K192-S196 PolarHBondContact O-N 3.15Å; K192-S196 PolarHBondContact O-OG 2.92Å; T193-S196 WeakPolarHBondContact CA-OG 3.15Å; T193-S196 PolarHBondContact O-N 2.93Å; T193-S196 PolarHBondContact O-OG 3.48Å; V194-S196 PolarHBondContact O-N 3.29Å; S196-T198 PolarHBondContact O-N 3.38Å; S196-T198 VanDerWaalsContact O-N 3.13Å; S196-R199 PolarHBondContact O-N 3.4Å
197S62.3Low62.4Low25 Ų2599.9 Ų99.918%0.17551%0.512CS..Hα-helixtrans-64.4-16.3179.277.30000114T193 V194T193-S197 PolarHBondContact O-N 2.99Å; V194-S197 PolarHBondContact O-N 2.95Å; V194-S197 VanDerWaalsContact O-N 3.14Å; V194-S197 PolarHBondContact O-OG 3.24Å
198T57.3Low59.5Low88 Ų88110.8 Ų110.854%0.5455%0.553SS.*THydrogen-bonded Turntrans-87.8-8.4179.965.90000114.6V194 D195 S196V194-T198 PolarHBondContact O-N 2.76Å; D195-T198 PolarHBondContact O-N 3.38Å; D195-T198 PolarHBondContact O-OG1 3.2Å; S196-T198 PolarHBondContact O-N 3.38Å; S196-T198 VanDerWaalsContact O-N 3.13Å
199R50.7Low56.6Low218 Ų218108.6 Ų108.682%0.82356%0.556SS**SBendtrans-84.3-20.4-177-68.7-175.472.7-178.62114.3S196 G201S196-R199 PolarHBondContact O-N 3.4Å; R199-G201 PolarHBondContact O-N 3.03Å
200D42.7Very low53.8Low157 Ų157115.9 Ų115.984%0.8459%0.594SS**SBendtrans-8491.8175.2-76-14.7000110.6R202D200-R202 PolarHBondContact O-N 3.28Å
201G40.8Very low51.1Low70 Ų70120.9 Ų120.972%0.72263%0.629SS**  trans-68.7113.2-166.200000115.5R199R199-G201 PolarHBondContact O-N 3.03Å
202R34.8Very low48.5Very low244 Ų244121.4 Ų121.492%0.92165%0.648SS**  trans-136.6107.2134.2-75.9-148.7-67.8-97.34.1109.5D200D200-R202 PolarHBondContact O-N 3.28Å
203G31.6Very low46Very low68 Ų68123.9 Ų123.970%0.70166%0.662SS**  trans-81.9153.3-169.100000114.8
204F31.4Very low43.3Very low200 Ų200132 Ų13288%0.87770%0.704SS**  trans-149109.5144.1-90.4-71.2000109.1L206F204-L206 PolarHBondContact O-N 3.17Å
205A35.5Very low40.6Very low108 Ų108139.3 Ų139.389%0.89374%0.742SS**  trans-7996.9172.800000109.6
206L34.2Very low38.2Very low162 Ų162140.7 Ų140.785%0.84876%0.759SS**  trans-88.5121.5179.9-85.5171.3000113.1F204F204-L206 PolarHBondContact O-N 3.17Å
207R31Very low35.9Very low238 Ų238149.8 Ų149.890%0.89879%0.786SS**  trans-51.1131.9171.1-76.6-98.3-178.3149.5-2.9111.5A209R207-A209 PolarHBondContact O-N 3.48Å
208R29Very low34.2Very low233 Ų233157 Ų15788%0.87982%0.817SS**  trans-69.4108.4164.9-166.6-174.6-63.2168-1.3109.1
209A28.9Very low32.7Very low79 Ų79158.5 Ų158.565%0.65383%0.83SS**  trans-76146.816600000110.1R207R207-A209 PolarHBondContact O-N 3.48Å
210N28Very low31.8Very low165 Ų165153.7 Ų153.788%0.88283%0.831SS**  trans73.568.9170.7-48.9-12.4000116.1
211S30.8Very low31.2Very low106 Ų106154 Ų15474%0.74183%0.831SS**  trans-123.5114.6149.2-174.30000108.8
212S33.8Very low31.2Very low115 Ų115156.7 Ų156.780%0.80484%0.836SS**  trans-98.891.1171.358.40000109.4
213E33.3Very low30.9Very low179 Ų179149 Ų14984%0.83683%0.832SS**  trans172.7115.3148.4-102.7175-152.800109.1
214L29.5Very low30.8Very low172 Ų172155.5 Ų155.590%0.90184%0.844SS**  trans-163.1155.4143.6-113.9162.1000112.1
215L27Very low30.7Very low164 Ų164149.1 Ų149.186%0.85984%0.835SS**  trans-79.9158.6-164.1-66.6153000113.1
216S32.4Very low30.4Very low117 Ų117149.6 Ų149.682%0.81883%0.831SS**  trans-75.8153.6-177.2-41.70000114.4
217R28.5Very low30.2Very low238 Ų238148.1 Ų148.190%0.89883%0.829SS**  trans-154.3107.4146.4-106.3177.7-155.2-126.92.7112.8
218H27.3Very low30Very low177 Ų177141.9 Ų141.982%0.81982%0.822SS**  trans46.8146.4143.3-73.3-87.3000124.9
219S26.6Very low30.6Very low118 Ų118136.3 Ų136.383%0.82582%0.816SS**  trans65.2133.6170.753.70000116.8
220S30.5Very low30.5Very low118 Ų118137.4 Ų137.483%0.82582%0.818SS**  cis-154.1161.41.542.10000112.1
221L30.8Very low30.6Very low163 Ų163136.6 Ų136.685%0.85381%0.811SS**  trans-64.8173.9172.7-76.6158.6000113.1
222P40.7Very low30.5Very low126 Ų126140.5 Ų140.582%0.81882%0.815SS**  cis-128171-7.731.5-12.1000114.9
223G27.6Very low30.4Very low82 Ų82143.6 Ų143.685%0.84582%0.816SS**  trans-175.6117.9170.700000115.1
224H29.4Very low30.1Very low206 Ų206146.8 Ų146.895%0.95482%0.821SS**  trans-75.3156.9-168.8-129.9-83.9000116.3
225G29.3Very low30.5Very low66 Ų66145.5 Ų145.568%0.6882%0.815SS**  trans106.495.2160.800000115.1
226S29.3Very low31Very low117 Ų117143.9 Ų143.982%0.81882%0.815SS**  82148.161.2-160.10000115.3
227V30.5Very low31Very low132 Ų132144.9 Ų144.980%0.882%0.815SS**  trans82.893.7170.6-1640000118.5
228S27.7Very low31.2Very low107 Ų107140.1 Ų140.175%0.74880%0.803SS**  trans-73.7162.9142.6-71.90000109.7
229P41.2Very low31.5Very low116 Ų116143.8 Ų143.875%0.75381%0.809SS**  cis-158.1170.44544.2-22000120.7
230S26.4Very low31.9Very low101 Ų101148.4 Ų148.471%0.70681%0.809SS**  trans52.1120.1139.7-150.60000122.2
231M29Very low32.2Very low148 Ų148148 Ų14873%0.72981%0.806SS**  165.6149.899.7-94.5-145.6-176.400116.2
232K29.7Very low32.7Very low188 Ų188147.7 Ų147.782%0.81780%0.804SS**  trans79.4128.1145.9-78.9165.8178.2165.80121.8
233Q31.6Very low32.4Very low180 Ų180149.4 Ų149.484%0.84181%0.806SS**  trans-64.5161.6172.8-59.5170.8-2700113.5
234R28Very low33.1Very low246 Ų246150.9 Ų150.993%0.92880%0.798SS**  trans-150.5123143.7-145.5169.1178.5176.5-2112
235N37.9Very low33.8Very low145 Ų145151 Ų15178%0.77580%0.796SS**  trans-69.9156.6168.2-70.9-26.4000110.8
236P37.3Very low34.1Very low131 Ų131152 Ų15285%0.85181%0.806SS**  trans-121.7151.714529.2-15.6000113.3
237V31.1Very low34.4Very low137 Ų137150 Ų15083%0.8380%0.804SS**  trans-94.8133.9-167.3170.30000111.7
238H32.8Very low34.9Very low138 Ų138149.4 Ų149.464%0.63981%0.806SS**  trans32.3112.2143.5-141.676.9000119R240H238-R240 PolarHBondContact NE2-NE 3.06Å
239R32.9Very low35.5Very low254 Ų254153.8 Ų153.896%0.95881%0.812SS**  trans-133.3122148.8-116.3178.2-178.81521.7110.5
240R36.7Very low35.7Very low215 Ų215154.9 Ų154.981%0.81181%0.811SS**  trans-75.2138-177.7-61.5170.5-179.5167.8-4.5110H238H238-R240 PolarHBondContact NE2-NE 3.06Å
241S36Very low36.5Very low110 Ų110160 Ų16077%0.76982%0.82SS**  trans-107.9131.4165.457.50000110.1
242I41.1Very low37.2Very low156 Ų156160.1 Ų160.180%0.882%0.819SS**  trans-72.6133.4-173.5-69.8157.1000110.9V244I242-V244 HydrophobicContact CG2-CG2 4.01Å
243N34.9Very low37.9Very low162 Ų162155.9 Ų155.987%0.86681%0.813SS**  trans-82.7113.6167.5-77.4-10.5000109.8
244V42.6Very low38.9Very low113 Ų113151.2 Ų151.269%0.68581%0.805SS**  trans-116.9109.5159.1175.70000107.3I242I242-V244 HydrophobicContact CG2-CG2 4.01Å
245F42.9Very low40.1Very low208 Ų208144 Ų14491%0.91279%0.792SS**  trans177.398.1143.7-89-57.1000107.5
246G35.7Very low40.7Very low87 Ų87141 Ų14190%0.89778%0.776SS**  trans-87.1131.1169.100000110.1
247G36.3Very low41.5Very low75 Ų75137.9 Ų137.977%0.77376%0.758SS**  trans-166.498.4178.500000111.4
248S41.4Very low42.8Very low120 Ų120134.5 Ų134.584%0.83974%0.744SS**  trans29100.3168.7-159.20000118.6
249K39.5Very low44.3Very low200 Ų200132.9 Ų132.987%0.8774%0.74SS**  trans-86.4103.1160.4-80.8-174.7177.1178.60110.4K251K249-K251 PolarHBondContact O-N 2.93Å
250L46.5Very low46Very low139 Ų139127 Ų12773%0.72872%0.721SS**  trans-64126.8148.1-82.1164000108H252L250-H252 PolarHBondContact O-N 3.43Å
251K42.4Very low48Very low208 Ų208121.2 Ų121.290%0.90471%0.706SS**  trans-76.886.9-175.1-71.1-175.9178.71790110.7K249K249-K251 PolarHBondContact O-N 2.93Å
252H44Very low50.4Low150 Ų150117.4 Ų117.469%0.69468%0.684SS**  trans-96.3141.4160.2-60.4-72.1000109.9L250L250-H252 PolarHBondContact O-N 3.43Å
253S44.8Very low52.7Low99 Ų99114 Ų11469%0.69267%0.671SS**  trans-53.4140.1-168.9-57.70000113.9S255 D256S253-S255 PolarHBondContact O-N 3.29Å; S253-D256 PolarHBondContact O-N 2.92Å; S253-D256 VanDerWaalsContact O-N 3.12Å
254A51.1Low55.4Low83 Ų83113 Ų11369%0.68666%0.659SS**THydrogen-bonded Turntrans-57.2-27.5-172.800000114.4D256 S257A254-D256 VanDerWaalsContact C-N 3.28Å; A254-D256 PolarHBondContact O-N 3.46Å; A254-S257 PolarHBondContact O-N 2.99Å; A254-S257 PolarHBondContact O-OG 3.41Å
255S53.3Low57.7Low93 Ų93112.1 Ų112.165%0.6565%0.65SS**Hα-helixtrans-51.8-44.9175.9-156.90000112.7S253 S257 A258S253-S255 PolarHBondContact O-N 3.29Å; S255-S257 PolarHBondContact O-N 3.24Å; S255-S257 VanDerWaalsContact O-N 3.15Å; S255-A258 PolarHBondContact O-N 3.05Å
256D51.3Low60.1Low82 Ų82111.5 Ų111.544%0.43964%0.642SS.*Hα-helixtrans-71.8-15.6-171.2-14744.6000112.7S253 A254 K260S253-D256 PolarHBondContact O-N 2.92Å; S253-D256 VanDerWaalsContact O-N 3.12Å; A254-D256 VanDerWaalsContact C-N 3.28Å; A254-D256 PolarHBondContact O-N 3.46Å; D256-K260 WeakPolarHBondContact O-CD 3.36Å; D256-K260 WeakPolarHBondContact O-CG 3.24Å; D256-K260 WeakPolarHBondContact OD2-CE 3.26Å; D256-K260 IonicContact OD2-NZ 2.73Å; D256-K260 PolarHBondContact OD2-NZ 3.31Å
257S54.7Low62.9Low67 Ų67111.9 Ų111.947%0.46962%0.623SS.*Hα-helixtrans-87.2-27.9-178.375.30000113.6A254 S255 N261A254-S257 PolarHBondContact O-N 2.99Å; A254-S257 PolarHBondContact O-OG 3.41Å; S255-S257 PolarHBondContact O-N 3.24Å; S255-S257 VanDerWaalsContact O-N 3.15Å; S257-N261 PolarHBondContact O-ND2 2.87Å
258A58.3Low65.6Low65 Ų65115 Ų11554%0.53762%0.615SS.*Hα-helixtrans-70.6-46.1174.900000110S255 K260 N261 G262S255-A258 PolarHBondContact O-N 3.05Å; A258-K260 PolarHBondContact O-N 3.08Å; A258-N261 PolarHBondContact O-N 3.43Å; A258-G262 PolarHBondContact O-N 3.01Å
259D63.1Low68.1Low104 Ų104116 Ų11656%0.55660%0.604SS**Hα-helixtrans-65.5-39.2180-78.9-42.3000113.1N261 G262 V263D259-N261 VanDerWaalsContact C-N 3.27Å; D259-N261 PolarHBondContact O-N 3.37Å; D259-G262 CarbonylContact O-C 3.59Å; D259-G262 PolarHBondContact O-N 2.73Å; D259-G262 VanDerWaalsContact O-N 3.11Å; D259-V263 WeakPolarHBondContact O-CB 3.31Å; D259-V263 WeakPolarHBondContact O-CG2 3.39Å; D259-V263 PolarHBondContact O-N 3.06Å
260K69.3Low70.8Confident131 Ų131112.1 Ų112.157%0.5759%0.588SS**Hα-helixtrans-59.3-38.1174.8-74.3169.7-168.3164.50112.3D256 A258 K264D256-K260 WeakPolarHBondContact O-CD 3.36Å; D256-K260 WeakPolarHBondContact O-CG 3.24Å; D256-K260 WeakPolarHBondContact OD2-CE 3.26Å; D256-K260 IonicContact OD2-NZ 2.73Å; D256-K260 PolarHBondContact OD2-NZ 3.31Å; A258-K260 PolarHBondContact O-N 3.08Å; K260-K264 VanDerWaalsContact O-CB 3.27Å; K260-K264 WeakPolarHBondContact O-CB 3.48Å; K260-K264 PolarHBondContact O-N 2.99Å; K260-K264 VanDerWaalsContact O-N 3.12Å
261N78.4Confident73Confident93 Ų93110.9 Ų110.950%0.49758%0.581SS.*Hα-helixtrans-75.2-35.9174.2-72.8-50.6000112.5S257 A258 D259 N265S257-N261 PolarHBondContact O-ND2 2.87Å; A258-N261 PolarHBondContact O-N 3.43Å; D259-N261 VanDerWaalsContact C-N 3.27Å; D259-N261 PolarHBondContact O-N 3.37Å; N261-N265 WeakPolarHBondContact O-CB 3.2Å; N261-N265 VanDerWaalsContact O-CG 3.25Å; N261-N265 PolarHBondContact O-N 3.42Å; N261-N265 PolarHBondContact O-ND2 3.19Å
262G85.8Confident75.4Confident30 Ų30107.2 Ų107.231%0.30957%0.569SS.*Hα-helixtrans-61.4-51.3173.200000112.7A258 D259 N265 R266A258-G262 PolarHBondContact O-N 3.01Å; D259-G262 CarbonylContact O-C 3.59Å; D259-G262 PolarHBondContact O-N 2.73Å; D259-G262 VanDerWaalsContact O-N 3.11Å; G262-N265 PolarHBondContact O-N 3.26Å; G262-R266 WeakPolarHBondContact O-CG 3.3Å; G262-R266 PolarHBondContact O-N 3.13Å
263V90.6Very high77.8Confident84 Ų84109.9 Ų109.951%0.50957%0.574SS.*Hα-helixtrans-59.6-46.7175.7172.50000110.9D259 N265 R266 L267D259-V263 WeakPolarHBondContact O-CB 3.31Å; D259-V263 WeakPolarHBondContact O-CG2 3.39Å; D259-V263 PolarHBondContact O-N 3.06Å; V263-N265 VanDerWaalsContact C-N 3.31Å; V263-N265 PolarHBondContact O-N 3.32Å; V263-R266 PolarHBondContact O-N 3.12Å; V263-L267 WeakPolarHBondContact O-CB 3.45Å; V263-L267 PolarHBondContact O-N 3.09Å
264K91.4Very high80Confident142 Ų142112.6 Ų112.662%0.61757%0.569SS**Hα-helixtrans-56.5-43.8175.1-179.1177.5179.3178.30112.3K260 K268K260-K264 VanDerWaalsContact O-CB 3.27Å; K260-K264 WeakPolarHBondContact O-CB 3.48Å; K260-K264 PolarHBondContact O-N 2.99Å; K260-K264 VanDerWaalsContact O-N 3.12Å; K264-K268 WeakPolarHBondContact O-CB 3.47Å; K264-K268 PolarHBondContact O-N 3.49Å
265N91.4Very high81.9Confident95 Ų95111.4 Ų111.451%0.50855%0.554SS.*Hα-helixtrans-71.5-37178.6-73.4-21.9000112.7N261 G262 V263 K269N261-N265 WeakPolarHBondContact O-CB 3.2Å; N261-N265 VanDerWaalsContact O-CG 3.25Å; N261-N265 PolarHBondContact O-N 3.42Å; N261-N265 PolarHBondContact O-ND2 3.19Å; G262-N265 PolarHBondContact O-N 3.26Å; V263-N265 VanDerWaalsContact C-N 3.31Å; V263-N265 PolarHBondContact O-N 3.32Å; N265-K269 WeakPolarHBondContact O-CG 3.34Å; N265-K269 PolarHBondContact O-N 3.06Å
266R93.1Very high83.7Confident194 Ų194109.9 Ų109.973%0.73254%0.543SS*.Hα-helixtrans-63.5-45.8172.4-73.6173.570.1-175.31.7111.2G262 V263 K269 F270G262-R266 WeakPolarHBondContact O-CG 3.3Å; G262-R266 PolarHBondContact O-N 3.13Å; V263-R266 PolarHBondContact O-N 3.12Å; R266-K269 PolarHBondContact O-N 2.96Å; R266-F270 WeakPolarHBondContact O-CB 3.4Å; R266-F270 PolarHBondContact O-N 3.48Å
267L93.9Very high85.3Confident95 Ų95110.9 Ų110.950%0.49755%0.546SS..Hα-helixtrans-66.1-40.7178.7-172.463.6000111.8V263 K269 F270 I271V263-L267 WeakPolarHBondContact O-CB 3.45Å; V263-L267 PolarHBondContact O-N 3.09Å; L267-K269 VanDerWaalsContact C-N 3.34Å; L267-K269 PolarHBondContact O-N 3.21Å; L267-F270 HydrophobicContact CD1-CD1 4.17Å; L267-F270 PolarHBondContact O-N 3.45Å; L267-I271 HydrophobicContact CD1-CD1 4.4Å; L267-I271 HydrophobicContact CD1-CG1 4.44Å; L267-I271 HydrophobicContact CG-CD1 4.03Å; L267-I271 HydrophobicContact CG-CG1 4.49Å; L267-I271 WeakPolarHBondContact O-CG1 3.01Å; L267-I271 PolarHBondContact O-N 3.18Å
268K93.4Very high86.8Confident140 Ų140114.7 Ų114.761%0.60955%0.554SS**Hα-helixtrans-59.7-43.7173-171.5178.5-178.1-177.10111.7K264 I272K264-K268 WeakPolarHBondContact O-CB 3.47Å; K264-K268 PolarHBondContact O-N 3.49Å; K268-I272 HydrophobicContact CG-CD1 4.13Å; K268-I272 WeakPolarHBondContact O-CD1 3.49Å; K268-I272 VanDerWaalsContact O-CG1 3.3Å; K268-I272 WeakPolarHBondContact O-CG1 3.42Å; K268-I272 PolarHBondContact O-N 3.28Å
269K94.5Very high88.2Confident141 Ų141113.7 Ų113.761%0.61354%0.542SS*.Hα-helixtrans-64.7-39.8173.8-73.3177.2-179.6-177.90112.1N265 R266 L267 R273N265-K269 WeakPolarHBondContact O-CG 3.34Å; N265-K269 PolarHBondContact O-N 3.06Å; R266-K269 PolarHBondContact O-N 2.96Å; L267-K269 VanDerWaalsContact C-N 3.34Å; L267-K269 PolarHBondContact O-N 3.21Å; K269-R273 VanDerWaalsContact O-CB 3.31Å; K269-R273 WeakPolarHBondContact O-CB 3.37Å; K269-R273 WeakPolarHBondContact O-CG 3.21Å; K269-R273 PolarHBondContact O-N 3.47Å
270F94.9Very high89.3Confident119 Ų119110.2 Ų110.252%0.52252%0.523SS..Hα-helixtrans-63.7-48.7177.8173.5-100.1000112R266 L267 I272 R273 R274R266-F270 WeakPolarHBondContact O-CB 3.4Å; R266-F270 PolarHBondContact O-N 3.48Å; L267-F270 HydrophobicContact CD1-CD1 4.17Å; L267-F270 PolarHBondContact O-N 3.45Å; F270-I272 VanDerWaalsContact C-N 3.31Å; F270-I272 PolarHBondContact O-N 2.86Å; F270-R273 CarbonylContact O-C 3.59Å; F270-R273 PolarHBondContact O-N 3.19Å; F270-R273 VanDerWaalsContact O-N 3.15Å; F270-R274 HydrophobicContact CZ-CG 4.34Å; F270-R274 WeakPolarHBondContact O-CA 3.44Å; F270-R274 WeakPolarHBondContact O-CB 3.36Å; F270-R274 PolarHBondContact O-N 3.22Å
271I94.1Very high89.9Confident113 Ų113107.7 Ų107.758%0.57951%0.513SS*.Hα-helixtrans-60.1-42.6179.9-68.2167.6000110.9L267L267-I271 HydrophobicContact CD1-CD1 4.4Å; L267-I271 HydrophobicContact CD1-CG1 4.44Å; L267-I271 HydrophobicContact CG-CD1 4.03Å; L267-I271 HydrophobicContact CG-CG1 4.49Å; L267-I271 WeakPolarHBondContact O-CG1 3.01Å; L267-I271 PolarHBondContact O-N 3.18Å
272I92.9Very high90.2Very high131 Ų131110.4 Ų110.467%0.67252%0.523SS*.Hα-helixtrans-68.6-33.3178.2-65.4167.8000112.1K268 F270K268-I272 HydrophobicContact CG-CD1 4.13Å; K268-I272 WeakPolarHBondContact O-CD1 3.49Å; K268-I272 VanDerWaalsContact O-CG1 3.3Å; K268-I272 WeakPolarHBondContact O-CG1 3.42Å; K268-I272 PolarHBondContact O-N 3.28Å; F270-I272 VanDerWaalsContact C-N 3.31Å; F270-I272 PolarHBondContact O-N 2.86Å
273R93Very high90.2Very high207 Ų207115.8 Ų115.878%0.78154%0.538SS*.THydrogen-bonded Turntrans-101.312.1-178.2-64.4-178.3173.1-169-4.8113.6K269 F270 P275K269-R273 VanDerWaalsContact O-CB 3.31Å; K269-R273 WeakPolarHBondContact O-CB 3.37Å; K269-R273 WeakPolarHBondContact O-CG 3.21Å; K269-R273 PolarHBondContact O-N 3.47Å; F270-R273 CarbonylContact O-C 3.59Å; F270-R273 PolarHBondContact O-N 3.19Å; F270-R273 VanDerWaalsContact O-N 3.15Å; R273-P275 WeakPolarHBondContact O-CD 3.28Å
274R92.1Very high89.6Confident156 Ų156114.1 Ų114.159%0.58954%0.538SS*.PPolyproline II helixtrans-66.6124.2-175.7-174.3-179.4174.5-175.2-1.7108.5F270F270-R274 HydrophobicContact CZ-CG 4.34Å; F270-R274 WeakPolarHBondContact O-CA 3.44Å; F270-R274 WeakPolarHBondContact O-CB 3.36Å; F270-R274 PolarHBondContact O-N 3.22Å
275P90.6Very high89.1Confident58 Ų58113.4 Ų113.438%0.37754%0.54SS..PPolyproline II helixtrans-57.1147174-23.934.2000111.3R273 T279 L280R273-P275 WeakPolarHBondContact O-CD 3.28Å; P275-T279 HydrophobicContact CB-CG2 4.39Å; P275-L280 HydrophobicContact CB-CD2 3.97Å; P275-L280 HydrophobicContact CB-CG 4.16Å; P275-L280 HydrophobicContact CG-CD2 4.31Å
276S90.5Very high88.4Confident61 Ų61111.4 Ų111.443%0.42753%0.529SS..PPolyproline II helixtrans-64.3156.9174.984.10000110.9K278 T279 L280S276-K278 VanDerWaalsContact C-N 3.26Å; S276-K278 PolarHBondContact O-N 2.86Å; S276-K278 PolarHBondContact OG-N 3.37Å; S276-T279 WeakPolarHBondContact O-CB 3.45Å; S276-T279 PolarHBondContact O-N 3.03Å; S276-T279 VanDerWaalsContact O-N 3.11Å; S276-T279 PolarHBondContact OG-N 3.11Å; S276-T279 VanDerWaalsContact OG-N 3.12Å; S276-T279 PolarHBondContact OG-OG1 3.26Å; S276-L280 PolarHBondContact O-N 3.06Å; S276-L280 VanDerWaalsContact O-N 3.12Å
277M85.9Confident87.4Confident102 Ų102110.6 Ų110.650%0.50253%0.531SS..Hα-helixtrans-55.9-42.1175.2-72.7-63.3-62.100111.9T279 L280 Q281 I286M277-T279 PolarHBondContact O-N 3.4Å; M277-L280 WeakPolarHBondContact O-CB 3.43Å; M277-L280 PolarHBondContact O-N 3.47Å; M277-Q281 PolarHBondContact O-N 2.61Å; M277-I286 HydrophobicContact CE-CD1 3.48Å; M277-I286 VanDerWaalsContact CE-CD1 3.48Å; M277-I286 HydrophobicContact SD-CD1 3.96Å
278K85.3Confident86.4Confident147 Ų147110 Ų11064%0.63953%0.528SS*.Hα-helixtrans-57.7-46.3175.1-64.4-170.1176-170.10111.7S276 L280 Q281 E282S276-K278 VanDerWaalsContact C-N 3.26Å; S276-K278 PolarHBondContact O-N 2.86Å; S276-K278 PolarHBondContact OG-N 3.37Å; K278-L280 PolarHBondContact O-N 2.85Å; K278-Q281 PolarHBondContact O-N 2.82Å; K278-Q281 VanDerWaalsContact O-N 3.08Å; K278-E282 WeakPolarHBondContact O-CB 3.46Å; K278-E282 VanDerWaalsContact O-CG 3.27Å; K278-E282 WeakPolarHBondContact O-CG 3.2Å; K278-E282 PolarHBondContact O-N 3.41Å
279T88.1Confident86.2Confident45 Ų45110.1 Ų110.128%0.27653%0.525SS..Hα-helixtrans-64.4-23.5177.6-45.10000113.4P275 S276 M277 E282 K283P275-T279 HydrophobicContact CB-CG2 4.39Å; S276-T279 WeakPolarHBondContact O-CB 3.45Å; S276-T279 PolarHBondContact O-N 3.03Å; S276-T279 VanDerWaalsContact O-N 3.11Å; S276-T279 PolarHBondContact OG-N 3.11Å; S276-T279 VanDerWaalsContact OG-N 3.12Å; S276-T279 PolarHBondContact OG-OG1 3.26Å; M277-T279 PolarHBondContact O-N 3.4Å; T279-E282 WeakPolarHBondContact CA-OE2 3.46Å; T279-K283 WeakPolarHBondContact O-CB 3.35Å; T279-K283 WeakPolarHBondContact O-CD 3.42Å; T279-K283 VanDerWaalsContact O-CG 3.23Å; T279-K283 WeakPolarHBondContact O-CG 3.45Å
280L87Confident86.2Confident31 Ų31103.6 Ų103.616%0.16250%0.497CS..Hα-helixtrans-83.7-33.2173.7-63.4174.2000111.9P275 S276 M277 K278 L285 I286P275-L280 HydrophobicContact CB-CD2 3.97Å; P275-L280 HydrophobicContact CB-CG 4.16Å; P275-L280 HydrophobicContact CG-CD2 4.31Å; S276-L280 PolarHBondContact O-N 3.06Å; S276-L280 VanDerWaalsContact O-N 3.12Å; M277-L280 WeakPolarHBondContact O-CB 3.43Å; M277-L280 PolarHBondContact O-N 3.47Å; K278-L280 PolarHBondContact O-N 2.85Å; L280-L285 HydrophobicContact CD2-CD1 3.95Å; L280-L285 WeakPolarHBondContact O-CB 3.46Å; L280-L285 PolarHBondContact O-N 3Å; L280-I286 HydrophobicContact CB-CD1 3.65Å; L280-I286 HydrophobicContact CB-CG1 3.91Å; L280-I286 HydrophobicContact CD1-CD1 3.87Å; L280-I286 HydrophobicContact CG-CD1 4.41Å; L280-I286 PolarHBondContact O-N 3.18Å
281Q81.8Confident86.2Confident78 Ų7898 Ų9836%0.36447%0.472SS..Hα-helixtrans-68.1-48.4171.1-70.8169.7-69.800111.6M277 K278 K283 G284 I286 D288M277-Q281 PolarHBondContact O-N 2.61Å; K278-Q281 PolarHBondContact O-N 2.82Å; K278-Q281 VanDerWaalsContact O-N 3.08Å; Q281-K283 PolarHBondContact O-N 2.95Å; Q281-K283 VanDerWaalsContact O-N 3.15Å; Q281-G284 WeakPolarHBondContact O-CA 3.11Å; Q281-G284 PolarHBondContact O-N 3.5Å; Q281-I286 WeakPolarHBondContact CA-O 3.36Å; Q281-I286 HydrophobicContact CG-CB 4.07Å; Q281-I286 HydrophobicContact CG-CG2 4.06Å; Q281-D288 PolarHBondContact NE2-OD1 3.26Å
282E83.9Confident86.2Confident149 Ų14994.5 Ų94.570%0.69646%0.463SS*.Hα-helixtrans-55.3-32175.5-73.1161.1-169.900112.8K278 T279 G284K278-E282 WeakPolarHBondContact O-CB 3.46Å; K278-E282 VanDerWaalsContact O-CG 3.27Å; K278-E282 WeakPolarHBondContact O-CG 3.2Å; K278-E282 PolarHBondContact O-N 3.41Å; T279-E282 WeakPolarHBondContact CA-OE2 3.46Å; E282-G284 VanDerWaalsContact C-N 3.31Å
283K85.5Confident86.3Confident143 Ų14388.8 Ų88.862%0.62244%0.435SS*.THydrogen-bonded Turntrans-85.72.9176.6-72-179.1178.6-169.60114T279 Q281 L285T279-K283 WeakPolarHBondContact O-CB 3.35Å; T279-K283 WeakPolarHBondContact O-CD 3.42Å; T279-K283 VanDerWaalsContact O-CG 3.23Å; T279-K283 WeakPolarHBondContact O-CG 3.45Å; Q281-K283 PolarHBondContact O-N 2.95Å; Q281-K283 VanDerWaalsContact O-N 3.15Å; K283-L285 HydrophobicContact CB-CD1 4.13Å; K283-L285 HydrophobicContact CB-CG 4Å; K283-L285 PolarHBondContact O-N 2.97Å; K283-L285 VanDerWaalsContact O-N 3.14Å
284G79.1Confident86.4Confident50 Ų5083.7 Ų83.752%0.51542%0.42SS..THydrogen-bonded Turntrans66.28.4-176.100000114.8Q281 E282 I286Q281-G284 WeakPolarHBondContact O-CA 3.11Å; Q281-G284 PolarHBondContact O-N 3.5Å; E282-G284 VanDerWaalsContact C-N 3.31Å; G284-I286 VanDerWaalsContact C-N 3.32Å
285L79.2Confident86.6Confident126 Ų12676.8 Ų76.866%0.6640%0.395SS*.SBendtrans-76.7-24.1179.8-61.6175.7000111.9L280 K283L280-L285 HydrophobicContact CD2-CD1 3.95Å; L280-L285 WeakPolarHBondContact O-CB 3.46Å; L280-L285 PolarHBondContact O-N 3Å; K283-L285 HydrophobicContact CB-CD1 4.13Å; K283-L285 HydrophobicContact CB-CG 4Å; K283-L285 PolarHBondContact O-N 2.97Å; K283-L285 VanDerWaalsContact O-N 3.14Å
286I77.6Confident86.8Confident53 Ų5378.1 Ų78.127%0.27240%0.398SS..SBendtrans-123.2106.4170.9-61.2-178.6000106.5M277 L280 Q281 G284M277-I286 HydrophobicContact CE-CD1 3.48Å; M277-I286 VanDerWaalsContact CE-CD1 3.48Å; M277-I286 HydrophobicContact SD-CD1 3.96Å; L280-I286 HydrophobicContact CB-CD1 3.65Å; L280-I286 HydrophobicContact CB-CG1 3.91Å; L280-I286 HydrophobicContact CD1-CD1 3.87Å; L280-I286 HydrophobicContact CG-CD1 4.41Å; L280-I286 PolarHBondContact O-N 3.18Å; Q281-I286 WeakPolarHBondContact CA-O 3.36Å; Q281-I286 HydrophobicContact CG-CB 4.07Å; Q281-I286 HydrophobicContact CG-CG2 4.06Å; G284-I286 VanDerWaalsContact C-N 3.32Å
287K71.6Confident87Confident177 Ų17778.4 Ų78.477%0.7740%0.397SS*.  trans-76.8148171.1-64.5-175.3178-175.70110R289K287-R289 PolarHBondContact O-N 3.48Å
288D74.1Confident87.5Confident82 Ų8273.5 Ų73.544%0.43937%0.373SS..  trans-71.5121.6172.7-70.4-25.8000109.7Q281 R301Q281-D288 PolarHBondContact NE2-OD1 3.26Å; D288-R301 PolarHBondContact O-NH1 2.67Å
289R88.6Confident88Confident143 Ų14366.5 Ų66.554%0.5434%0.343SS..  trans-75.4-177.6-177.7-69.1176.7-172.6-157.1-0.2111.3K287 F291 C293 R301 D345K287-R289 PolarHBondContact O-N 3.48Å; R289-F291 WeakPolarHBondContact CB-O 3.31Å; R289-C293 WeakPolarHBondContact O-CB 3.48Å; R289-R301 PolarHBondContact O-NH1 2.94Å; R289-R301 PolarHBondContact O-NH2 3.45Å; R289-R301 VanDerWaalsContact O-NH2 3.1Å; R289-D345 HydrophobicContact CB-CB 4.34Å; R289-D345 WeakPolarHBondContact CD-OD2 3.16Å; R289-D345 HydrophobicContact CG-CB 4.34Å
290V94Very high88.3Confident5 Ų569.7 Ų69.73%0.0336%0.358CS..SBendtrans-90.2-51.6169.71750000108.9C293 L298 F309 V344 D345 E347 F370V290-C293 WeakPolarHBondContact O-CB 3.47Å; V290-C293 PolarHBondContact O-N 3.03Å; V290-L298 HydrophobicContact CG1-CD1 4.31Å; V290-L298 HydrophobicContact CG1-CD2 4Å; V290-L298 HydrophobicContact CG2-CD1 4.35Å; V290-F309 HydrophobicContact CG1-CB 4.44Å; V290-V344 HydrophobicContact CB-CG1 3.91Å; V290-V344 HydrophobicContact CG1-CG1 3.74Å; V290-V344 HydrophobicContact CG2-CG1 4.2Å; V290-V344 VanDerWaalsContact CG2-O 3.31Å; V290-V344 WeakPolarHBondContact CG2-O 3.23Å; V290-D345 PolarHBondContact N-OD1 3.15Å; V290-E347 HydrophobicContact CG2-CG 4.14Å; V290-F370 HydrophobicContact CG1-CD2 4.46Å; V290-F370 HydrophobicContact CG1-CE2 4.12Å
291F96.1Very high88.6Confident2 Ų272.5 Ų72.51%0.00937%0.367CS..THydrogen-bonded Turntrans-74.1133.2171.1-72.8-106.9000110.5R289 C293 F309 R341 V344 D345 M369 F370R289-F291 WeakPolarHBondContact CB-O 3.31Å; F291-C293 VanDerWaalsContact C-N 3.33Å; F291-F309 HydrophobicContact CE1-CE1 4.41Å; F291-F309 HydrophobicContact CE2-CD1 4.38Å; F291-F309 HydrophobicContact CE2-CE1 4.08Å; F291-F309 HydrophobicContact CE2-CZ 4.16Å; F291-F309 HydrophobicContact CZ-CD1 4.27Å; F291-F309 AromaticContact CZ-CE1 3.58Å; F291-F309 HydrophobicContact CZ-CE1 3.58Å; F291-F309 HydrophobicContact CZ-CE2 4.44Å; F291-F309 AromaticContact CZ-CZ 3.68Å; F291-F309 HydrophobicContact CZ-CZ 3.68Å; F291-R341 HydrophobicContact CB-CG 4.22Å; F291-R341 VanDerWaalsContact CB-NH2 3.3Å; F291-R341 HydrophobicContact CD1-CG 3.78Å; F291-R341 HydrophobicContact CD2-CG 3.72Å; F291-R341 HydrophobicContact CE1-CG 3.97Å; F291-R341 HydrophobicContact CE2-CB 4.29Å; F291-R341 HydrophobicContact CE2-CG 3.94Å; F291-R341 HydrophobicContact CG-CG 3.65Å; F291-R341 HydrophobicContact CZ-CB 4.29Å; F291-R341 HydrophobicContact CZ-CG 4.06Å; F291-V344 HydrophobicContact CD2-CG1 4.21Å; F291-V344 HydrophobicContact CE2-CB 3.98Å; F291-V344 HydrophobicContact CE2-CG1 3.78Å; F291-D345 WeakPolarHBondContact CB-OD1 3.39Å; F291-D345 PolarHBondContact N-OD1 3.25Å; F291-M369 HydrophobicContact CD1-CG 4.22Å; F291-M369 HydrophobicContact CE1-CB 4.14Å; F291-M369 HydrophobicContact CE1-CG 3.99Å; F291-M369 HydrophobicContact CE1-SD 4.44Å; F291-F370 HydrophobicContact CD1-CB 4.16Å; F291-F370 HydrophobicContact CE1-CB 3.72Å; F291-F370 HydrophobicContact CZ-CB 4.13Å
292G94.1Very high89.2Confident38 Ų3870.2 Ų70.239%0.39236%0.356SS..THydrogen-bonded Turntrans84.60.7-174.700000115E373 P375G292-E373 VanDerWaalsContact CA-O 3.31Å; G292-E373 WeakPolarHBondContact CA-O 3.26Å; G292-P375 VanDerWaalsContact O-CG 3.29Å; G292-P375 WeakPolarHBondContact O-CG 3.36Å
293C93.8Very high89.8Confident12 Ų1266.6 Ų66.68%0.08136%0.359CS..SBendtrans-82.9150.2174.1-162.30000111.3R289 V290 F291 L295 L298 L374 P375R289-C293 WeakPolarHBondContact O-CB 3.48Å; V290-C293 WeakPolarHBondContact O-CB 3.47Å; V290-C293 PolarHBondContact O-N 3.03Å; F291-C293 VanDerWaalsContact C-N 3.33Å; C293-L295 PolarHBondContact O-N 3.48Å; C293-L298 HydrophobicContact CB-CB 4.23Å; C293-L374 WeakPolarHBondContact O-CD2 3.49Å; C293-P375 WeakPolarHBondContact O-CD 3.33Å
294H95.1Very high90.3Very high99 Ų9961.9 Ų61.946%0.45834%0.342SS..  trans-65.2133.8167.8-81.6-86.3000109.9L296 T297 L298H294-L296 VanDerWaalsContact C-N 3.27Å; H294-L296 PolarHBondContact O-N 3.3Å; H294-T297 PolarHBondContact O-N 3.31Å; H294-T297 VanDerWaalsContact O-N 3.09Å; H294-L298 PolarHBondContact O-N 3.3Å
295L96.8Very high91.1Very high12 Ų1261.7 Ų61.76%0.06333%0.331CS..Hα-helixtrans-54-42.5-175.3-177.664.4000112.9C293 C299 P307 L374 L378 P413 N414C293-L295 PolarHBondContact O-N 3.48Å; L295-C299 WeakPolarHBondContact O-CB 3.36Å; L295-C299 PolarHBondContact O-N 2.8Å; L295-C299 PolarHBondContact O-SG 2.83Å; L295-P307 HydrophobicContact CD1-CG 3.42Å; L295-P307 VanDerWaalsContact CD1-CG 3.42Å; L295-L374 HydrophobicContact CB-CD2 4.45Å; L295-L378 HydrophobicContact CD2-CD1 3.72Å; L295-P413 HydrophobicContact CD2-CB 4.3Å; L295-P413 HydrophobicContact CG-CB 4.08Å; L295-N414 HydrophobicContact CD2-CB 4.4Å
296L95.6Very high92Very high86 Ų8656.4 Ų56.445%0.4530%0.303SS..Hα-helixtrans-60.6-54.4176177.261.1000111.3H294 L298 C299 D300 P413H294-L296 VanDerWaalsContact C-N 3.27Å; H294-L296 PolarHBondContact O-N 3.3Å; L296-L298 VanDerWaalsContact C-N 3.31Å; L296-L298 PolarHBondContact O-N 2.86Å; L296-C299 PolarHBondContact O-N 3.3Å; L296-C299 VanDerWaalsContact O-N 3.13Å; L296-D300 PolarHBondContact O-N 3.42Å; L296-P413 HydrophobicContact CD1-CG 3.83Å
297T94.3Very high93Very high66 Ų6653.9 Ų53.941%0.40529%0.29SS..Hα-helixtrans-59.3-38.4-179.4-50.80000112.9H294 R301H294-T297 PolarHBondContact O-N 3.31Å; H294-T297 VanDerWaalsContact O-N 3.09Å; T297-R301 WeakPolarHBondContact O-CB 3.33Å; T297-R301 PolarHBondContact O-N 3.38Å
298L95.6Very high94.2Very high0 Ų050.3 Ų50.30%028%0.275CS..Hα-helixtrans-66.2-45.2175.417960.8000111.7V290 C293 H294 L296 R301 E302 P307 F370V290-L298 HydrophobicContact CG1-CD1 4.31Å; V290-L298 HydrophobicContact CG1-CD2 4Å; V290-L298 HydrophobicContact CG2-CD1 4.35Å; C293-L298 HydrophobicContact CB-CB 4.23Å; H294-L298 PolarHBondContact O-N 3.3Å; L296-L298 VanDerWaalsContact C-N 3.31Å; L296-L298 PolarHBondContact O-N 2.86Å; L298-R301 PolarHBondContact O-N 2.99Å; L298-E302 HydrophobicContact CD1-CG 4.31Å; L298-E302 WeakPolarHBondContact O-CB 3.18Å; L298-E302 WeakPolarHBondContact O-CG 3.41Å; L298-E302 PolarHBondContact O-N 2.79Å; L298-P307 HydrophobicContact CD2-CB 3.9Å; L298-P307 HydrophobicContact CD2-CG 4Å; L298-F370 HydrophobicContact CD2-CE2 3.7Å; L298-F370 HydrophobicContact CD2-CZ 3.78Å
299C96.7Very high95.3Very high0 Ų046.8 Ų46.80%026%0.256CS..Hα-helixtrans-63.7-43.5177.5-70.40000111.8L295 L296 R301 E302 G303 T304 P413L295-C299 WeakPolarHBondContact O-CB 3.36Å; L295-C299 PolarHBondContact O-N 2.8Å; L295-C299 PolarHBondContact O-SG 2.83Å; L296-C299 PolarHBondContact O-N 3.3Å; L296-C299 VanDerWaalsContact O-N 3.13Å; C299-R301 VanDerWaalsContact C-N 3.34Å; C299-R301 PolarHBondContact O-N 3.08Å; C299-E302 PolarHBondContact O-N 3.03Å; C299-G303 PolarHBondContact O-N 3.05Å; C299-T304 CarbonylContact C-O 3.6Å; C299-T304 VanDerWaalsContact CB-O 3.32Å; C299-T304 WeakPolarHBondContact CB-O 3.27Å; C299-T304 PolarHBondContact O-N 3.27Å; C299-P413 HydrophobicContact CB-CB 4.22Å; C299-P413 HydrophobicContact CB-CG 4.16Å
300D94.9Very high95.7Very high111 Ų11140 Ų4059%0.59423%0.23SC*.Hα-helixtrans-61-41.4175.2-65.1-25.5000111.4L296L296-D300 PolarHBondContact O-N 3.42Å
301R93.1Very high95.9Very high90 Ų9044.1 Ų44.134%0.3425%0.245SC..Hα-helixtrans-64.8-39.6175.1-177.1171.784.6-142.26.3112.5D288 R289 T297 L298 C299 E347D288-R301 PolarHBondContact O-NH1 2.67Å; R289-R301 PolarHBondContact O-NH1 2.94Å; R289-R301 PolarHBondContact O-NH2 3.45Å; R289-R301 VanDerWaalsContact O-NH2 3.1Å; T297-R301 WeakPolarHBondContact O-CB 3.33Å; T297-R301 PolarHBondContact O-N 3.38Å; L298-R301 PolarHBondContact O-N 2.99Å; C299-R301 VanDerWaalsContact C-N 3.34Å; C299-R301 PolarHBondContact O-N 3.08Å; R301-E347 IonicContact CZ-OE1 2.66Å; R301-E347 IonicContact NE-OE1 3.38Å; R301-E347 PolarHBondContact NE-OE1 2.98Å; R301-E347 IonicContact NH2-OE1 3.49Å; R301-E347 PolarHBondContact NH2-OE1 2.9Å
302E94.1Very high96Very high30 Ų3046.7 Ų46.714%0.1426%0.258CS..Hα-helixtrans-80.3-15.4-178.4-76.5-173.8171.900114.4L298 C299 T304 P307 K308L298-E302 HydrophobicContact CD1-CG 4.31Å; L298-E302 WeakPolarHBondContact O-CB 3.18Å; L298-E302 WeakPolarHBondContact O-CG 3.41Å; L298-E302 PolarHBondContact O-N 2.79Å; C299-E302 PolarHBondContact O-N 3.03Å; E302-T304 HydrophobicContact CB-CG2 4.09Å; E302-T304 PolarHBondContact OE2-OG1 3.48Å; E302-P307 VanDerWaalsContact OE2-CA 3.28Å; E302-P307 WeakPolarHBondContact OE2-CA 3.35Å; E302-K308 HydrophobicContact CB-CD 4.43Å; E302-K308 HydrophobicContact CG-CD 4.12Å; E302-K308 PolarHBondContact O-NZ 2.85Å; E302-K308 PolarHBondContact OE1-N 3.08Å; E302-K308 WeakPolarHBondContact OE2-CG 3.27Å; E302-K308 PolarHBondContact OE2-N 3.1Å
303G95Very high96.1Very high74 Ų7444.9 Ų44.976%0.76324%0.24SC*.THydrogen-bonded Turntrans73.225.7-171.600000113.4C299C299-G303 PolarHBondContact O-N 3.05Å
304T96.4Very high96.4Very high43 Ų4344.5 Ų44.526%0.26424%0.237SC..SBendtrans-123.7173.3-173.263.20000111.1C299 E302 I306 K308C299-T304 CarbonylContact C-O 3.6Å; C299-T304 VanDerWaalsContact CB-O 3.32Å; C299-T304 WeakPolarHBondContact CB-O 3.27Å; C299-T304 PolarHBondContact O-N 3.27Å; E302-T304 HydrophobicContact CB-CG2 4.09Å; E302-T304 PolarHBondContact OE2-OG1 3.48Å; T304-I306 WeakPolarHBondContact CB-O 3.39Å; T304-I306 PolarHBondContact OG1-O 3.31Å; T304-I306 VanDerWaalsContact OG1-O 3.05Å; T304-K308 HydrophobicContact CG2-CG 4.48Å
305T97Very high96.5Very high46 Ų4644.6 Ų44.628%0.28224%0.237SC..SBendtrans-109.72.8163.758.70000112.7K412 P413 D416T305-K412 HydrophobicContact CG2-CD 3.88Å; T305-K412 HydrophobicContact CG2-CG 4.07Å; T305-P413 VanDerWaalsContact O-CA 3.31Å; T305-P413 WeakPolarHBondContact O-CA 3.39Å; T305-D416 WeakPolarHBondContact CB-OD2 3.24Å; T305-D416 PolarHBondContact OG1-OD2 2.84Å
306I97.9Very high96.5Very high16 Ų1644.4 Ų44.48%0.08224%0.238CC..SBendtrans-142.3125.9179.4-53.8179.4000106.6T304 K308 V310 D416 L420T304-I306 WeakPolarHBondContact CB-O 3.39Å; T304-I306 PolarHBondContact OG1-O 3.31Å; T304-I306 VanDerWaalsContact OG1-O 3.05Å; I306-K308 PolarHBondContact O-N 3.33Å; I306-V310 HydrophobicContact CG2-CB 4.49Å; I306-V310 HydrophobicContact CG2-CG1 4.35Å; I306-D416 HydrophobicContact CD1-CB 4.05Å; I306-D416 WeakPolarHBondContact CD1-O 3.47Å; I306-D416 HydrophobicContact CG1-CB 3.73Å; I306-L420 HydrophobicContact CD1-CB 3.95Å; I306-L420 HydrophobicContact CD1-CD2 4.01Å; I306-L420 HydrophobicContact CG2-CD2 3.83Å
307P97.6Very high96.6Very high0 Ų040.3 Ų40.30%022%0.216CC..  trans-54.8133.5179.3-26.735.1000112.3L295 L298 E302 F309 V310 R311 F370L295-P307 HydrophobicContact CD1-CG 3.42Å; L295-P307 VanDerWaalsContact CD1-CG 3.42Å; L298-P307 HydrophobicContact CD2-CB 3.9Å; L298-P307 HydrophobicContact CD2-CG 4Å; E302-P307 VanDerWaalsContact OE2-CA 3.28Å; E302-P307 WeakPolarHBondContact OE2-CA 3.35Å; P307-F309 VanDerWaalsContact C-N 3.25Å; P307-F309 PolarHBondContact O-N 3.41Å; P307-V310 HydrophobicContact CB-CB 4.3Å; P307-V310 HydrophobicContact CB-CG2 4Å; P307-V310 HydrophobicContact CG-CG2 4.23Å; P307-V310 WeakPolarHBondContact O-CB 3.34Å; P307-V310 PolarHBondContact O-N 3.32Å; P307-R311 PolarHBondContact O-N 3.05Å; P307-R311 VanDerWaalsContact O-N 3.17Å; P307-F370 HydrophobicContact CB-CZ 3.98Å; P307-F370 HydrophobicContact CG-CE1 4.18Å; P307-F370 HydrophobicContact CG-CZ 3.76Å
308K96.5Very high96.8Very high102 Ų10239.8 Ų39.844%0.44321%0.209SC..Hα-helixtrans-54.4-43.6179.1-72.8165.5-172.3170.20111.2E302 T304 I306 V310 R311 I312E302-K308 HydrophobicContact CB-CD 4.43Å; E302-K308 HydrophobicContact CG-CD 4.12Å; E302-K308 PolarHBondContact O-NZ 2.85Å; E302-K308 PolarHBondContact OE1-N 3.08Å; E302-K308 WeakPolarHBondContact OE2-CG 3.27Å; E302-K308 PolarHBondContact OE2-N 3.1Å; T304-K308 HydrophobicContact CG2-CG 4.48Å; I306-K308 PolarHBondContact O-N 3.33Å; K308-V310 VanDerWaalsContact C-N 3.35Å; K308-V310 PolarHBondContact O-N 2.94Å; K308-R311 WeakPolarHBondContact O-CB 3.46Å; K308-R311 PolarHBondContact O-N 3.47Å; K308-I312 HydrophobicContact CB-CD1 4.45Å; K308-I312 WeakPolarHBondContact O-CD1 3.2Å; K308-I312 VanDerWaalsContact O-CG1 3.27Å; K308-I312 WeakPolarHBondContact O-CG1 3.43Å; K308-I312 PolarHBondContact O-N 3.35Å
309F97.4Very high96.8Very high7 Ų746.4 Ų46.43%0.03124%0.238CC..Hα-helixtrans-56.6-44.3176177.1-107.7000113.1V290 F291 P307 R311 I312 C313 V344 L350 A366 F370V290-F309 HydrophobicContact CG1-CB 4.44Å; F291-F309 HydrophobicContact CE1-CE1 4.41Å; F291-F309 HydrophobicContact CE2-CD1 4.38Å; F291-F309 HydrophobicContact CE2-CE1 4.08Å; F291-F309 HydrophobicContact CE2-CZ 4.16Å; F291-F309 HydrophobicContact CZ-CD1 4.27Å; F291-F309 AromaticContact CZ-CE1 3.58Å; F291-F309 HydrophobicContact CZ-CE1 3.58Å; F291-F309 HydrophobicContact CZ-CE2 4.44Å; F291-F309 AromaticContact CZ-CZ 3.68Å; F291-F309 HydrophobicContact CZ-CZ 3.68Å; P307-F309 VanDerWaalsContact C-N 3.25Å; P307-F309 PolarHBondContact O-N 3.41Å; F309-R311 PolarHBondContact O-N 3.47Å; F309-I312 PolarHBondContact O-N 3.4Å; F309-C313 WeakPolarHBondContact CE2-SG 3.31Å; F309-C313 WeakPolarHBondContact CZ-SG 3.3Å; F309-C313 WeakPolarHBondContact O-CB 3.46Å; F309-C313 PolarHBondContact O-N 3.12Å; F309-C313 PolarHBondContact O-SG 3.43Å; F309-V344 HydrophobicContact CB-CG1 4.13Å; F309-V344 HydrophobicContact CD2-CB 4.3Å; F309-V344 HydrophobicContact CD2-CG1 3.72Å; F309-V344 HydrophobicContact CD2-CG2 3.61Å; F309-V344 HydrophobicContact CE2-CG1 4.35Å; F309-V344 HydrophobicContact CE2-CG2 3.71Å; F309-V344 HydrophobicContact CG-CG1 3.93Å; F309-L350 HydrophobicContact CD2-CD2 3.98Å; F309-L350 HydrophobicContact CE2-CD2 4.24Å; F309-A366 HydrophobicContact CZ-CB 3.89Å; F309-F370 HydrophobicContact CD1-CB 4.04Å; F309-F370 AromaticContact CD1-CD2 3.99Å; F309-F370 HydrophobicContact CD1-CD2 3.99Å; F309-F370 AromaticContact CD1-CG 4Å; F309-F370 HydrophobicContact CD1-CG 4Å; F309-F370 HydrophobicContact CE1-CB 3.74Å; F309-F370 HydrophobicContact CE1-CD2 4.49Å; F309-F370 HydrophobicContact CE1-CG 4.23Å
310V98.3Very high96.7Very high0 Ų049.9 Ų49.90%025%0.251CS..Hα-helixtrans-61.7-46.1178170.60000110.3I306 P307 K308 C313 L314 L367 F370 F371 T417I306-V310 HydrophobicContact CG2-CB 4.49Å; I306-V310 HydrophobicContact CG2-CG1 4.35Å; P307-V310 HydrophobicContact CB-CB 4.3Å; P307-V310 HydrophobicContact CB-CG2 4Å; P307-V310 HydrophobicContact CG-CG2 4.23Å; P307-V310 WeakPolarHBondContact O-CB 3.34Å; P307-V310 PolarHBondContact O-N 3.32Å; K308-V310 VanDerWaalsContact C-N 3.35Å; K308-V310 PolarHBondContact O-N 2.94Å; V310-C313 PolarHBondContact O-N 2.84Å; V310-L314 HydrophobicContact CG1-CD1 3.75Å; V310-L314 HydrophobicContact CG1-CG 4.39Å; V310-L314 WeakPolarHBondContact O-CG 3.34Å; V310-L314 PolarHBondContact O-N 3.21Å; V310-L367 HydrophobicContact CB-CD1 4.27Å; V310-L367 HydrophobicContact CG1-CD1 4.19Å; V310-L367 HydrophobicContact CG2-CD1 3.98Å; V310-F370 HydrophobicContact CG2-CD1 3.57Å; V310-F370 HydrophobicContact CG2-CE1 3.4Å; V310-F370 VanDerWaalsContact CG2-CE1 3.4Å; V310-F370 HydrophobicContact CG2-CG 4.45Å; V310-F370 HydrophobicContact CG2-CZ 4.16Å; V310-F371 HydrophobicContact CG1-CZ 4.1Å; V310-F371 HydrophobicContact CG2-CE1 4.49Å; V310-F371 HydrophobicContact CG2-CZ 4.07Å; V310-T417 HydrophobicContact CG1-CG2 4.36Å
311R97.7Very high96.8Very high92 Ų9244.7 Ų44.735%0.34722%0.223SC..Hα-helixtrans-58.1-53.8176.8180-177-53.4-73.6-4.2111.7P307 K308 F309 C313 L314 E315 L420P307-R311 PolarHBondContact O-N 3.05Å; P307-R311 VanDerWaalsContact O-N 3.17Å; K308-R311 WeakPolarHBondContact O-CB 3.46Å; K308-R311 PolarHBondContact O-N 3.47Å; F309-R311 PolarHBondContact O-N 3.47Å; R311-C313 VanDerWaalsContact C-N 3.33Å; R311-C313 PolarHBondContact O-N 3.18Å; R311-L314 PolarHBondContact O-N 2.85Å; R311-L314 VanDerWaalsContact O-N 3.15Å; R311-E315 WeakPolarHBondContact CD-OE1 3.33Å; R311-E315 VanDerWaalsContact CG-CD 3.5Å; R311-E315 HydrophobicContact CG-CG 4.39Å; R311-E315 WeakPolarHBondContact CG-OE1 3.48Å; R311-E315 WeakPolarHBondContact O-CB 3.26Å; R311-E315 WeakPolarHBondContact O-CG 3.43Å; R311-E315 PolarHBondContact O-N 3.44Å; R311-L420 HydrophobicContact CB-CD2 4.49Å
312I97.1Very high97Very high57 Ų5741.4 Ų41.429%0.29221%0.213SC..Hα-helixtrans-59.6-42.4-177.3-66.1161.9000111K308 F309 A316 L350 L352K308-I312 HydrophobicContact CB-CD1 4.45Å; K308-I312 WeakPolarHBondContact O-CD1 3.2Å; K308-I312 VanDerWaalsContact O-CG1 3.27Å; K308-I312 WeakPolarHBondContact O-CG1 3.43Å; K308-I312 PolarHBondContact O-N 3.35Å; F309-I312 PolarHBondContact O-N 3.4Å; I312-A316 WeakPolarHBondContact O-CB 3.13Å; I312-A316 PolarHBondContact O-N 2.87Å; I312-L350 HydrophobicContact CG2-CD2 4.01Å; I312-L352 HydrophobicContact CG2-CD1 3.71Å; I312-L352 HydrophobicContact CG2-CG 3.88Å
313C98.3Very high97.1Very high0 Ų043.8 Ų43.80%023%0.226CC..Hα-helixtrans-63.3-44.9174.9-75.80000113.3F309 V310 R311 A316 V317 I363 L367F309-C313 WeakPolarHBondContact CE2-SG 3.31Å; F309-C313 WeakPolarHBondContact CZ-SG 3.3Å; F309-C313 WeakPolarHBondContact O-CB 3.46Å; F309-C313 PolarHBondContact O-N 3.12Å; F309-C313 PolarHBondContact O-SG 3.43Å; V310-C313 PolarHBondContact O-N 2.84Å; R311-C313 VanDerWaalsContact C-N 3.33Å; R311-C313 PolarHBondContact O-N 3.18Å; C313-A316 PolarHBondContact O-N 3.35Å; C313-V317 VanDerWaalsContact O-CG2 3.26Å; C313-V317 WeakPolarHBondContact O-CG2 3.34Å; C313-V317 PolarHBondContact O-N 3.15Å; C313-I363 HydrophobicContact CB-CG2 3.87Å; C313-L367 HydrophobicContact CB-CB 4.13Å; C313-L367 HydrophobicContact CB-CD1 4.19Å; C313-L367 HydrophobicContact CB-CD2 4.14Å; C313-L367 HydrophobicContact CB-CG 4.38Å
314L98.3Very high97.2Very high3 Ų341.4 Ų41.42%0.01620%0.199CC..Hα-helixtrans-65.9-43.5-179.4-66.5171.8000110.9V310 R311 V317 E318 L367 L420 L421 H424V310-L314 HydrophobicContact CG1-CD1 3.75Å; V310-L314 HydrophobicContact CG1-CG 4.39Å; V310-L314 WeakPolarHBondContact O-CG 3.34Å; V310-L314 PolarHBondContact O-N 3.21Å; R311-L314 PolarHBondContact O-N 2.85Å; R311-L314 VanDerWaalsContact O-N 3.15Å; L314-V317 PolarHBondContact O-N 3.27Å; L314-E318 WeakPolarHBondContact O-CG 3.35Å; L314-E318 PolarHBondContact O-N 3.07Å; L314-L367 HydrophobicContact CD2-CD2 3.48Å; L314-L367 VanDerWaalsContact CD2-CD2 3.48Å; L314-L367 HydrophobicContact CG-CD2 3.98Å; L314-L420 HydrophobicContact CD1-CD2 3.79Å; L314-L420 HydrophobicContact CD1-CG 3.74Å; L314-L421 HydrophobicContact CD2-CD1 4Å; L314-H424 HydrophobicContact CD1-CB 4.49Å; L314-H424 HydrophobicContact CD2-CB 3.81Å; L314-H424 VanDerWaalsContact CD2-CD2 3.46Å; L314-H424 WeakPolarHBondContact CD2-CD2 3.46Å; L314-H424 VanDerWaalsContact CD2-CG 3.46Å; L314-H424 PolarHBondContact O-CE1 3.48Å
315E97.6Very high97.3Very high101 Ų10144.2 Ų44.247%0.47221%0.213SC..Hα-helixtrans-62.3-43.1176.8-72.7168.1-173.400111.8R311 V317 E318 K319R311-E315 WeakPolarHBondContact CD-OE1 3.33Å; R311-E315 VanDerWaalsContact CG-CD 3.5Å; R311-E315 HydrophobicContact CG-CG 4.39Å; R311-E315 WeakPolarHBondContact CG-OE1 3.48Å; R311-E315 WeakPolarHBondContact O-CB 3.26Å; R311-E315 WeakPolarHBondContact O-CG 3.43Å; R311-E315 PolarHBondContact O-N 3.44Å; E315-V317 PolarHBondContact O-N 3.25Å; E315-E318 PolarHBondContact O-N 2.86Å; E315-K319 WeakPolarHBondContact O-CB 3.09Å; E315-K319 PolarHBondContact O-N 3.33Å
316A97.4Very high97.3Very high9 Ų942 Ų427%0.07420%0.199CC..Hα-helixtrans-63.5-39.6174.900000112.9I312 C313 K319 R320 L352 I363I312-A316 WeakPolarHBondContact O-CB 3.13Å; I312-A316 PolarHBondContact O-N 2.87Å; C313-A316 PolarHBondContact O-N 3.35Å; A316-K319 PolarHBondContact O-N 3.23Å; A316-R320 WeakPolarHBondContact O-CG 3.46Å; A316-R320 PolarHBondContact O-N 3.39Å; A316-L352 HydrophobicContact CB-CB 3.89Å; A316-L352 HydrophobicContact CB-CD1 3.86Å; A316-I363 HydrophobicContact CB-CD1 4.03Å
317V98.1Very high97.3Very high0 Ų041.3 Ų41.30%020%0.196CC..Hα-helixtrans-69.3-35.5176175.70000111.4C313 L314 E315 G321 L322 I327 Y328 V360 I363 T364C313-V317 VanDerWaalsContact O-CG2 3.26Å; C313-V317 WeakPolarHBondContact O-CG2 3.34Å; C313-V317 PolarHBondContact O-N 3.15Å; L314-V317 PolarHBondContact O-N 3.27Å; E315-V317 PolarHBondContact O-N 3.25Å; V317-G321 CarbonylContact O-C 3.39Å; V317-G321 WeakPolarHBondContact O-CA 3.26Å; V317-G321 PolarHBondContact O-N 3.46Å; V317-L322 PolarHBondContact O-N 3.48Å; V317-I327 HydrophobicContact CG1-CD1 4.18Å; V317-I327 HydrophobicContact CG1-CG1 4.12Å; V317-Y328 HydrophobicContact CG1-CE2 4.09Å; V317-V360 HydrophobicContact CG2-CG2 3.99Å; V317-I363 HydrophobicContact CG2-CB 4.44Å; V317-I363 HydrophobicContact CG2-CG2 3.81Å; V317-T364 HydrophobicContact CG1-CG2 4.23Å; V317-T364 HydrophobicContact CG2-CG2 3.63Å
318E97.5Very high97.3Very high54 Ų5441.3 Ų41.325%0.25220%0.196SC..Hα-helixtrans-66.4-39.4173.4-71.2-177.1-164.200112.6L314 E315 L322 H424 K427L314-E318 WeakPolarHBondContact O-CG 3.35Å; L314-E318 PolarHBondContact O-N 3.07Å; E315-E318 PolarHBondContact O-N 2.86Å; E318-L322 HydrophobicContact CG-CD2 4.43Å; E318-L322 WeakPolarHBondContact O-CD1 3.25Å; E318-H424 WeakPolarHBondContact CG-ND1 3.43Å; E318-H424 IonicContact OE1-CG 2.94Å; E318-H424 IonicContact OE1-ND1 2.67Å; E318-H424 PolarHBondContact OE1-ND1 2.79Å; E318-K427 VanDerWaalsContact CD-CD 3.42Å; E318-K427 HydrophobicContact CG-CD 4.18Å; E318-K427 VanDerWaalsContact OE1-CD 3.28Å; E318-K427 WeakPolarHBondContact OE1-CD 3.12Å; E318-K427 IonicContact OE1-NZ 2.72Å; E318-K427 PolarHBondContact OE1-NZ 3.37Å; E318-K427 WeakPolarHBondContact OE2-CD 3.39Å; E318-K427 IonicContact OE2-NZ 2.8Å; E318-K427 PolarHBondContact OE2-NZ 2.98Å
319K96.1Very high97.4Very high140 Ų14042.2 Ų42.261%0.60920%0.196SC*.Hα-helixtrans-66.4-38.6-177.2-175.7179.3177.9-174.10113.5E315 A316 D353E315-K319 WeakPolarHBondContact O-CB 3.09Å; E315-K319 PolarHBondContact O-N 3.33Å; A316-K319 PolarHBondContact O-N 3.23Å; K319-D353 WeakPolarHBondContact CE-OD1 3.48Å; K319-D353 IonicContact NZ-OD1 2.8Å; K319-D353 PolarHBondContact NZ-OD1 3.42Å; K319-D353 IonicContact NZ-OD2 3.19Å; K319-D353 PolarHBondContact NZ-OD2 2.85Å
320R95.4Very high97.4Very high73 Ų7344.6 Ų44.628%0.27521%0.211SC..Hα-helixtrans-146.815-169.963.8177.1-178.689-12.7116.1A316 L352 W357 E358A316-R320 WeakPolarHBondContact O-CG 3.46Å; A316-R320 PolarHBondContact O-N 3.39Å; R320-L352 PolarHBondContact NH2-O 3.45Å; R320-W357 PolarHBondContact NH2-O 3.27Å; R320-E358 PolarHBondContact NH1-O 2.97Å
321G95.3Very high97.4Very high1 Ų149.4 Ų49.41%0.0125%0.245CC..  trans-127.1-8.4-172.500000116.4V317 D323 A324V317-G321 CarbonylContact O-C 3.39Å; V317-G321 WeakPolarHBondContact O-CA 3.26Å; V317-G321 PolarHBondContact O-N 3.46Å; G321-D323 VanDerWaalsContact C-N 3.27Å; G321-D323 PolarHBondContact O-N 3.31Å; G321-A324 PolarHBondContact O-N 3.15Å
322L97.6Very high97.4Very high22 Ų2245.5 Ų45.512%0.11523%0.233CC..THydrogen-bonded Turntrans-68-24.1-171.3-66.3179.2000113.9V317 E318 K427 V428 F431 N435V317-L322 PolarHBondContact O-N 3.48Å; E318-L322 HydrophobicContact CG-CD2 4.43Å; E318-L322 WeakPolarHBondContact O-CD1 3.25Å; L322-K427 HydrophobicContact CD2-CB 4.49Å; L322-V428 HydrophobicContact CD2-CG2 3.91Å; L322-F431 HydrophobicContact CB-CB 4.36Å; L322-F431 HydrophobicContact CB-CD1 3.98Å; L322-F431 HydrophobicContact CB-CD2 4.16Å; L322-F431 HydrophobicContact CB-CE1 4.29Å; L322-F431 HydrophobicContact CB-CE2 4.46Å; L322-F431 HydrophobicContact CB-CG 3.92Å; L322-F431 HydrophobicContact CD1-CD2 4.2Å; L322-F431 HydrophobicContact CD1-CE2 3.93Å; L322-F431 HydrophobicContact CD1-CZ 4.26Å; L322-F431 WeakPolarHBondContact O-CB 3.49Å; L322-N435 WeakPolarHBondContact O-CB 3.18Å; L322-N435 PolarHBondContact O-ND2 3.19Å
323D97Very high97.4Very high80 Ų8047.2 Ų47.243%0.42824%0.243SC..THydrogen-bonded Turntrans-103.21.1178.256.2-12000114.5G321 K434G321-D323 VanDerWaalsContact C-N 3.27Å; G321-D323 PolarHBondContact O-N 3.31Å; D323-K434 HydrophobicContact CB-CB 4.02Å; D323-K434 HydrophobicContact CB-CD 3.6Å; D323-K434 IonicContact OD2-NZ 3.47Å
324A97.4Very high97.3Very high23 Ų2352.4 Ų52.419%0.1927%0.27CS..SBendtrans-69.9129.2178.500000112.6G321 G326 I327 V360 N435G321-A324 PolarHBondContact O-N 3.15Å; A324-G326 PolarHBondContact O-N 3Å; A324-I327 HydrophobicContact CB-CD1 4.37Å; A324-I327 WeakPolarHBondContact O-CB 3.3Å; A324-I327 PolarHBondContact O-N 3.48Å; A324-I327 VanDerWaalsContact O-N 3.08Å; A324-V360 HydrophobicContact CB-CG1 3.78Å; A324-N435 VanDerWaalsContact O-CB 3.25Å; A324-N435 WeakPolarHBondContact O-CB 3.39Å
325D97.4Very high97.3Very high103 Ų10355.7 Ų55.755%0.55130%0.298SS*.THydrogen-bonded Turntrans-55.1121.7-177.7-79.47.9000112.9I327 H361D325-I327 VanDerWaalsContact C-N 3.29Å; D325-I327 PolarHBondContact O-N 2.94Å; D325-H361 PolarHBondContact O-CE1 3.38Å
326G97.3Very high97.3Very high0 Ų052.7 Ų52.70%029%0.287CS..THydrogen-bonded Turntrans61.533.5-179.600000113.7A324 Y328 R329 V330 N435A324-G326 PolarHBondContact O-N 3Å; G326-Y328 PolarHBondContact O-N 2.85Å; G326-R329 CarbonylContact O-C 3.57Å; G326-R329 WeakPolarHBondContact O-CA 3.23Å; G326-R329 WeakPolarHBondContact O-CB 3.3Å; G326-R329 PolarHBondContact O-N 3.34Å; G326-V330 PolarHBondContact O-N 3.09Å; G326-N435 WeakPolarHBondContact CA-O 3.43Å; G326-N435 PolarHBondContact N-O 3.48Å
327I98.3Very high97.3Very high0 Ų052.7 Ų52.70%029%0.285CS..THydrogen-bonded Turntrans-45.9137.9172.5-167.765000111.3V317 A324 D325 R329 V360 T364 V428 N435 M437V317-I327 HydrophobicContact CG1-CD1 4.18Å; V317-I327 HydrophobicContact CG1-CG1 4.12Å; A324-I327 HydrophobicContact CB-CD1 4.37Å; A324-I327 WeakPolarHBondContact O-CB 3.3Å; A324-I327 PolarHBondContact O-N 3.48Å; A324-I327 VanDerWaalsContact O-N 3.08Å; D325-I327 VanDerWaalsContact C-N 3.29Å; D325-I327 PolarHBondContact O-N 2.94Å; I327-R329 PolarHBondContact O-N 3.48Å; I327-V360 HydrophobicContact CD1-CB 4.43Å; I327-V360 HydrophobicContact CD1-CG1 3.76Å; I327-V360 HydrophobicContact CD1-CG2 3.85Å; I327-T364 HydrophobicContact CD1-CG2 3.53Å; I327-T364 HydrophobicContact CG1-CG2 4.07Å; I327-V428 HydrophobicContact CG2-CG1 3.57Å; I327-N435 HydrophobicContact CG2-CB 3.91Å; I327-M437 HydrophobicContact CG2-CG 4.01Å; I327-M437 WeakPolarHBondContact O-CE 3.35Å; I327-M437 WeakPolarHBondContact O-CG 3.4Å
328Y98.4Very high97.3Very high0 Ų056.5 Ų56.50%030%0.303CS..THydrogen-bonded Turntrans61.9-26.7-166.5-63.7-78000117.7V317 G326 T364 L367 K368 H424 L425 V428 V445 F446V317-Y328 HydrophobicContact CG1-CE2 4.09Å; G326-Y328 PolarHBondContact O-N 2.85Å; Y328-T364 HydrophobicContact CD1-CG2 3.67Å; Y328-T364 HydrophobicContact CD2-CG2 4.19Å; Y328-T364 HydrophobicContact CE1-CG2 3.43Å; Y328-T364 VanDerWaalsContact CE1-CG2 3.43Å; Y328-T364 HydrophobicContact CE2-CG2 3.98Å; Y328-T364 HydrophobicContact CG-CG2 4.04Å; Y328-L367 HydrophobicContact CE1-CD2 4.15Å; Y328-K368 HydrophobicContact CD1-CD 4.49Å; Y328-K368 HydrophobicContact CD1-CG 4.42Å; Y328-K368 WeakPolarHBondContact O-CE 3.31Å; Y328-K368 PolarHBondContact O-NZ 3.33Å; Y328-H424 AromaticContact CE2-CD2 3.99Å; Y328-H424 AromaticContact CE2-NE2 3.43Å; Y328-H424 WeakPolarHBondContact CE2-NE2 3.49Å; Y328-H424 AromaticContact CZ-CD2 3.99Å; Y328-H424 AromaticContact CZ-NE2 3.52Å; Y328-H424 PolarHBondContact OH-CD2 3.14Å; Y328-H424 VanDerWaalsContact OH-CD2 3.29Å; Y328-H424 PolarHBondContact OH-NE2 2.82Å; Y328-L425 HydrophobicContact CD2-CD2 4.23Å; Y328-L425 HydrophobicContact CE2-CD2 4.12Å; Y328-V428 HydrophobicContact CD2-CG2 4.49Å; Y328-V428 HydrophobicContact CE2-CG2 4.01Å; Y328-V445 WeakPolarHBondContact O-CG1 3.46Å; Y328-F446 AromaticContact CD1-CE2 3.65Å; Y328-F446 HydrophobicContact CD1-CE2 3.65Å; Y328-F446 AromaticContact CD1-CZ 3.46Å; Y328-F446 HydrophobicContact CD1-CZ 3.46Å; Y328-F446 VanDerWaalsContact CD1-CZ 3.46Å; Y328-F446 HydrophobicContact CD2-CE2 4.38Å; Y328-F446 HydrophobicContact CE1-CE2 4.25Å; Y328-F446 AromaticContact CE1-CZ 3.69Å; Y328-F446 HydrophobicContact CE1-CZ 3.69Å; Y328-F446 AromaticContact CG-CE2 3.73Å; Y328-F446 HydrophobicContact CG-CE2 3.73Å; Y328-F446 HydrophobicContact CG-CZ 4.02Å
329R98.1Very high97.2Very high121 Ų12158.9 Ų58.946%0.45731%0.313SS..THydrogen-bonded Turntrans-78.7-46.5175.3-179.9179.268.6-138.9-0.3112.2G326 I327 L436 M437 V445G326-R329 CarbonylContact O-C 3.57Å; G326-R329 WeakPolarHBondContact O-CA 3.23Å; G326-R329 WeakPolarHBondContact O-CB 3.3Å; G326-R329 PolarHBondContact O-N 3.34Å; I327-R329 PolarHBondContact O-N 3.48Å; R329-L436 PolarHBondContact NH1-O 2.99Å; R329-M437 HydrophobicContact CB-CE 3.82Å; R329-M437 HydrophobicContact CB-SD 3.62Å; R329-M437 PolarHBondContact NH1-SD 2.88Å; R329-M437 VanDerWaalsContact NH1-SD 3.38Å; R329-V445 HydrophobicContact CB-CG2 4.39Å
330V98.1Very high97.2Very high58 Ų5852.2 Ų52.235%0.35228%0.284SS..SBendtrans-68.7146.4177.1175.90000110G326 H361G326-V330 PolarHBondContact O-N 3.09Å; V330-H361 HydrophobicContact CG1-CB 4.37Å
331S97.2Very high97.2Very high101 Ų10150.4 Ų50.471%0.70628%0.277SS*.  trans-102122.5178.6-680000110.2
332G97.3Very high97.1Very high10 Ų1056.2 Ų56.210%0.10330%0.302CS..  trans-72.6175170.100000112.5L334 H361G332-L334 PolarHBondContact O-N 2.78Å; G332-L334 VanDerWaalsContact O-N 3.14Å; G332-H361 VanDerWaalsContact CA-C 3.48Å; G332-H361 WeakPolarHBondContact CA-O 3.39Å; G332-H361 PolarHBondContact N-O 2.72Å
333N97.8Very high96.8Very high92 Ų9256.3 Ų56.349%0.49230%0.302SS..  trans-62.1116-179.6-175.2-28.7000111.7A335 T336 I337N333-A335 VanDerWaalsContact C-N 3.29Å; N333-A335 PolarHBondContact O-N 3.24Å; N333-A335 WeakPolarHBondContact OD1-CB 3.5Å; N333-A335 PolarHBondContact OD1-N 3.13Å; N333-T336 PolarHBondContact O-N 3.32Å; N333-T336 VanDerWaalsContact O-N 3.1Å; N333-I337 WeakPolarHBondContact O-CG1 3.3Å; N333-I337 PolarHBondContact O-N 3.41Å
334L96.8Very high96.7Very high109 Ų10953 Ų5357%0.57129%0.285SS*.Hα-helixtrans-59.8-34.2-177.2-177.160.7000113.4G332 I337 Q338 M369G332-L334 PolarHBondContact O-N 2.78Å; G332-L334 VanDerWaalsContact O-N 3.14Å; L334-I337 PolarHBondContact O-N 3.14Å; L334-Q338 HydrophobicContact CD1-CG 4.41Å; L334-Q338 VanDerWaalsContact O-CG 3.3Å; L334-Q338 WeakPolarHBondContact O-CG 3.27Å; L334-Q338 PolarHBondContact O-N 3.03Å; L334-M369 HydrophobicContact CD1-CE 3.8Å
335A97.3Very high96.5Very high72 Ų7252.8 Ų52.860%0.59528%0.28SS*.Hα-helixtrans-67.2-40.717700000111.2N333 Q338 K339N333-A335 VanDerWaalsContact C-N 3.29Å; N333-A335 PolarHBondContact O-N 3.24Å; N333-A335 WeakPolarHBondContact OD1-CB 3.5Å; N333-A335 PolarHBondContact OD1-N 3.13Å; A335-Q338 PolarHBondContact O-N 3.4Å; A335-K339 PolarHBondContact O-N 2.93Å
336T97.4Very high96.1Very high39 Ų3953.1 Ų53.124%0.23928%0.279CS..Hα-helixtrans-67.3-39175.1-44.30000111.4N333 Q338 K339 L340 W357 V362N333-T336 PolarHBondContact O-N 3.32Å; N333-T336 VanDerWaalsContact O-N 3.1Å; T336-Q338 VanDerWaalsContact C-N 3.35Å; T336-Q338 PolarHBondContact O-N 3.43Å; T336-K339 WeakPolarHBondContact O-CB 3.32Å; T336-K339 PolarHBondContact O-N 3.01Å; T336-L340 PolarHBondContact O-N 2.89Å; T336-W357 HydrophobicContact CG2-CE3 3.93Å; T336-W357 HydrophobicContact CG2-CZ3 3.77Å; T336-V362 HydrophobicContact CG2-CG1 3.92Å; T336-V362 HydrophobicContact CG2-CG2 3.91Å
337I97.9Very high95.4Very high8 Ų858.7 Ų58.74%0.04131%0.305CS..Hα-helixtrans-60.8-43.1172.7-65.3165.4000110.9N333 L334 L340 R341 V362 A366 M369N333-I337 WeakPolarHBondContact O-CG1 3.3Å; N333-I337 PolarHBondContact O-N 3.41Å; L334-I337 PolarHBondContact O-N 3.14Å; I337-L340 PolarHBondContact O-N 3.23Å; I337-R341 WeakPolarHBondContact O-CB 3.36Å; I337-R341 PolarHBondContact O-N 3.39Å; I337-V362 HydrophobicContact CG1-CB 4.23Å; I337-V362 HydrophobicContact CG1-CG1 3.86Å; I337-V362 HydrophobicContact CG1-CG2 4.45Å; I337-A366 HydrophobicContact CG2-CB 4.04Å; I337-M369 HydrophobicContact CG2-CE 3.47Å; I337-M369 VanDerWaalsContact CG2-CE 3.47Å; I337-M369 HydrophobicContact CG2-SD 3.76Å
338Q96.9Very high94.6Very high81 Ų8163.4 Ų63.438%0.37933%0.327SS..Hα-helixtrans-67.7-33.4176.7-71.5-65.5-25.500112.6L334 A335 T336 R341 F342L334-Q338 HydrophobicContact CD1-CG 4.41Å; L334-Q338 VanDerWaalsContact O-CG 3.3Å; L334-Q338 WeakPolarHBondContact O-CG 3.27Å; L334-Q338 PolarHBondContact O-N 3.03Å; A335-Q338 PolarHBondContact O-N 3.4Å; T336-Q338 VanDerWaalsContact C-N 3.35Å; T336-Q338 PolarHBondContact O-N 3.43Å; Q338-R341 VanDerWaalsContact OE1-CD 3.26Å; Q338-F342 PolarHBondContact O-N 2.8Å
339K95.4Very high94Very high104 Ų10472.9 Ų72.945%0.45237%0.371SS..Hα-helixtrans-63.4-46.4170.9-169.3-163.8177.3-158.70111.3A335 T336 F342 I343 W357A335-K339 PolarHBondContact O-N 2.93Å; T336-K339 WeakPolarHBondContact O-CB 3.32Å; T336-K339 PolarHBondContact O-N 3.01Å; K339-F342 PolarHBondContact O-N 2.81Å; K339-I343 HydrophobicContact CG-CD1 4.28Å; K339-I343 PolarHBondContact O-N 2.78Å; K339-I343 VanDerWaalsContact O-N 3.12Å; K339-W357 HydrophobicContact CB-CH2 4.37Å; K339-W357 HydrophobicContact CD-CH2 4.01Å; K339-W357 HydrophobicContact CD-CZ3 4.38Å; K339-W357 HydrophobicContact CG-CH2 4.18Å
340L96.5Very high93.6Very high0 Ų068.6 Ų68.60%036%0.357CS..Hα-helixtrans-60.7-47.3176.1177.653.6000111.1T336 I337 F342 I343 V344 L350 L352 W357 V362 A366T336-L340 PolarHBondContact O-N 2.89Å; I337-L340 PolarHBondContact O-N 3.23Å; L340-F342 VanDerWaalsContact C-N 3.27Å; L340-F342 PolarHBondContact O-N 2.75Å; L340-I343 PolarHBondContact O-N 3.29Å; L340-V344 HydrophobicContact CD1-CG2 4.03Å; L340-V344 VanDerWaalsContact O-CG2 3.31Å; L340-V344 WeakPolarHBondContact O-CG2 3.38Å; L340-V344 PolarHBondContact O-N 3.26Å; L340-L350 HydrophobicContact CD1-CD1 3.45Å; L340-L350 VanDerWaalsContact CD1-CD1 3.45Å; L340-L350 HydrophobicContact CD1-CD2 4.33Å; L340-L352 HydrophobicContact CD1-CD2 3.95Å; L340-L352 HydrophobicContact CD2-CD2 4.22Å; L340-W357 HydrophobicContact CB-CE3 4.2Å; L340-W357 HydrophobicContact CB-CH2 3.74Å; L340-W357 HydrophobicContact CB-CZ2 4.34Å; L340-W357 HydrophobicContact CB-CZ3 3.66Å; L340-W357 HydrophobicContact CD1-CD2 4.41Å; L340-W357 HydrophobicContact CD1-CH2 4.2Å; L340-W357 HydrophobicContact CD1-CZ2 3.93Å; L340-V362 HydrophobicContact CD2-CG1 4.19Å; L340-A366 HydrophobicContact CD2-CB 3.65Å; L340-A366 HydrophobicContact CG-CB 4.24Å
341R95.4Very high93.2Very high34 Ų3469.7 Ų69.713%0.12836%0.361CS..Hα-helixtrans-52.9-43.6174.1-171.9-162.1175.9-61.8-16.9112F291 I337 Q338 D345 M369 E373F291-R341 HydrophobicContact CB-CG 4.22Å; F291-R341 VanDerWaalsContact CB-NH2 3.3Å; F291-R341 HydrophobicContact CD1-CG 3.78Å; F291-R341 HydrophobicContact CD2-CG 3.72Å; F291-R341 HydrophobicContact CE1-CG 3.97Å; F291-R341 HydrophobicContact CE2-CB 4.29Å; F291-R341 HydrophobicContact CE2-CG 3.94Å; F291-R341 HydrophobicContact CG-CG 3.65Å; F291-R341 HydrophobicContact CZ-CB 4.29Å; F291-R341 HydrophobicContact CZ-CG 4.06Å; I337-R341 WeakPolarHBondContact O-CB 3.36Å; I337-R341 PolarHBondContact O-N 3.39Å; Q338-R341 VanDerWaalsContact OE1-CD 3.26Å; R341-D345 IonicContact CZ-OD2 2.64Å; R341-D345 IonicContact NH1-OD2 3.41Å; R341-D345 PolarHBondContact NH1-OD2 2.96Å; R341-D345 IonicContact NH2-OD2 2.75Å; R341-D345 PolarHBondContact NH2-OD2 3.41Å; R341-D345 WeakPolarHBondContact O-CB 3.41Å; R341-D345 PolarHBondContact O-N 3.07Å; R341-M369 HydrophobicContact CG-SD 4.37Å; R341-E373 IonicContact CZ-OE2 2.68Å; R341-E373 VanDerWaalsContact CZ-OE2 3.24Å; R341-E373 IonicContact NE-OE1 3.74Å; R341-E373 PolarHBondContact NE-OE1 3.45Å; R341-E373 IonicContact NE-OE2 2.99Å; R341-E373 PolarHBondContact NE-OE2 3.21Å; R341-E373 IonicContact NH2-OE2 2.61Å; R341-E373 PolarHBondContact NH2-OE2 3.1Å
342F93Very high93Very high124 Ų12465.2 Ų65.254%0.54433%0.329SS..Hα-helixtrans-65.3-47.5178.8179.6-94.4000112.6Q338 K339 L340 V344 D345 Q346Q338-F342 PolarHBondContact O-N 2.8Å; K339-F342 PolarHBondContact O-N 2.81Å; L340-F342 VanDerWaalsContact C-N 3.27Å; L340-F342 PolarHBondContact O-N 2.75Å; F342-V344 VanDerWaalsContact C-N 3.3Å; F342-V344 PolarHBondContact O-N 3.15Å; F342-D345 PolarHBondContact O-N 3.26Å; F342-Q346 HydrophobicContact CD1-CG 4.32Å; F342-Q346 HydrophobicContact CE1-CG 3.94Å; F342-Q346 HydrophobicContact CE2-CG 4.4Å; F342-Q346 HydrophobicContact CZ-CG 3.98Å; F342-Q346 VanDerWaalsContact O-CG 3.24Å; F342-Q346 WeakPolarHBondContact O-CG 3.35Å; F342-Q346 PolarHBondContact O-N 3.02Å; F342-Q346 VanDerWaalsContact O-N 3.15Å
343I92.9Very high92.6Very high24 Ų2468.5 Ų68.512%0.12335%0.345CS..Hα-helixtrans-60.5-42.3178.9-69.1164.9000110.7K339 L340 Q346 E348 L350 W357K339-I343 HydrophobicContact CG-CD1 4.28Å; K339-I343 PolarHBondContact O-N 2.78Å; K339-I343 VanDerWaalsContact O-N 3.12Å; L340-I343 PolarHBondContact O-N 3.29Å; I343-Q346 PolarHBondContact O-N 3.48Å; I343-E348 HydrophobicContact CG2-CB 4.04Å; I343-E348 PolarHBondContact O-N 3.22Å; I343-L350 HydrophobicContact CG2-CD1 4.47Å; I343-W357 HydrophobicContact CD1-CH2 3.83Å; I343-W357 HydrophobicContact CD1-CZ2 3.66Å
344V94.7Very high92.1Very high11 Ų1169 Ų697%0.06734%0.343CS..Hα-helixtrans-67.4-40.3177.4175.40000112.2V290 F291 F309 L340 F342 Q346 E347 L350V290-V344 HydrophobicContact CB-CG1 3.91Å; V290-V344 HydrophobicContact CG1-CG1 3.74Å; V290-V344 HydrophobicContact CG2-CG1 4.2Å; V290-V344 VanDerWaalsContact CG2-O 3.31Å; V290-V344 WeakPolarHBondContact CG2-O 3.23Å; F291-V344 HydrophobicContact CD2-CG1 4.21Å; F291-V344 HydrophobicContact CE2-CB 3.98Å; F291-V344 HydrophobicContact CE2-CG1 3.78Å; F309-V344 HydrophobicContact CB-CG1 4.13Å; F309-V344 HydrophobicContact CD2-CB 4.3Å; F309-V344 HydrophobicContact CD2-CG1 3.72Å; F309-V344 HydrophobicContact CD2-CG2 3.61Å; F309-V344 HydrophobicContact CE2-CG1 4.35Å; F309-V344 HydrophobicContact CE2-CG2 3.71Å; F309-V344 HydrophobicContact CG-CG1 3.93Å; L340-V344 HydrophobicContact CD1-CG2 4.03Å; L340-V344 VanDerWaalsContact O-CG2 3.31Å; L340-V344 WeakPolarHBondContact O-CG2 3.38Å; L340-V344 PolarHBondContact O-N 3.26Å; F342-V344 VanDerWaalsContact C-N 3.3Å; F342-V344 PolarHBondContact O-N 3.15Å; V344-Q346 PolarHBondContact O-N 3.36Å; V344-E347 PolarHBondContact O-N 2.97Å; V344-E347 VanDerWaalsContact O-N 3.07Å; V344-L350 HydrophobicContact CG2-CD1 4.26Å; V344-L350 HydrophobicContact CG2-CD2 3.89Å
345D92.8Very high91.7Very high17 Ų1770 Ų709%0.09135%0.35CS..Hα-helixtrans-65.3-19.8175.4-89-3.8000113.8R289 V290 F291 R341 F342 E347R289-D345 HydrophobicContact CB-CB 4.34Å; R289-D345 WeakPolarHBondContact CD-OD2 3.16Å; R289-D345 HydrophobicContact CG-CB 4.34Å; V290-D345 PolarHBondContact N-OD1 3.15Å; F291-D345 WeakPolarHBondContact CB-OD1 3.39Å; F291-D345 PolarHBondContact N-OD1 3.25Å; R341-D345 IonicContact CZ-OD2 2.64Å; R341-D345 IonicContact NH1-OD2 3.41Å; R341-D345 PolarHBondContact NH1-OD2 2.96Å; R341-D345 IonicContact NH2-OD2 2.75Å; R341-D345 PolarHBondContact NH2-OD2 3.41Å; R341-D345 WeakPolarHBondContact O-CB 3.41Å; R341-D345 PolarHBondContact O-N 3.07Å; F342-D345 PolarHBondContact O-N 3.26Å; D345-E347 VanDerWaalsContact C-N 3.34Å
346Q88.1Confident91.2Very high110 Ų11070 Ų7051%0.51434%0.337SS..THydrogen-bonded Turntrans-87.3-4.4175.5-67-76107.100112.9F342 I343 V344 E348F342-Q346 HydrophobicContact CD1-CG 4.32Å; F342-Q346 HydrophobicContact CE1-CG 3.94Å; F342-Q346 HydrophobicContact CE2-CG 4.4Å; F342-Q346 HydrophobicContact CZ-CG 3.98Å; F342-Q346 VanDerWaalsContact O-CG 3.24Å; F342-Q346 WeakPolarHBondContact O-CG 3.35Å; F342-Q346 PolarHBondContact O-N 3.02Å; F342-Q346 VanDerWaalsContact O-N 3.15Å; I343-Q346 PolarHBondContact O-N 3.48Å; V344-Q346 PolarHBondContact O-N 3.36Å; Q346-E348 HydrophobicContact CB-CG 3.97Å; Q346-E348 PolarHBondContact O-N 3.24Å
347E82.8Confident90.9Very high117 Ų11768.2 Ų68.255%0.54733%0.326SS..THydrogen-bonded Turntrans5531.3-174.6-57.4-171.7147.900113.4V290 R301 V344 D345V290-E347 HydrophobicContact CG2-CG 4.14Å; R301-E347 IonicContact CZ-OE1 2.66Å; R301-E347 IonicContact NE-OE1 3.38Å; R301-E347 PolarHBondContact NE-OE1 2.98Å; R301-E347 IonicContact NH2-OE1 3.49Å; R301-E347 PolarHBondContact NH2-OE1 2.9Å; V344-E347 PolarHBondContact O-N 2.97Å; V344-E347 VanDerWaalsContact O-N 3.07Å; D345-E347 VanDerWaalsContact C-N 3.34Å
348E82.9Confident90.6Very high100 Ų10075 Ų7547%0.46736%0.358SS..  trans-71.5155.8171.5-69.4172.1-162.200111I343 Q346 L350I343-E348 HydrophobicContact CG2-CB 4.04Å; I343-E348 PolarHBondContact O-N 3.22Å; Q346-E348 HydrophobicContact CB-CG 3.97Å; Q346-E348 PolarHBondContact O-N 3.24Å; E348-L350 PolarHBondContact O-N 3.21Å
349E84.4Confident90.6Very high198 Ų19874.2 Ų74.293%0.92536%0.356SS*.  trans-64.9118.5179-172.7170.6-163.500110.7
350L89.9Confident90.7Very high32 Ų3269.7 Ų69.717%0.16834%0.337CS..  trans-100.2103.9-172.9-177.571000112F309 I312 L340 I343 V344 E348 L352F309-L350 HydrophobicContact CD2-CD2 3.98Å; F309-L350 HydrophobicContact CE2-CD2 4.24Å; I312-L350 HydrophobicContact CG2-CD2 4.01Å; L340-L350 HydrophobicContact CD1-CD1 3.45Å; L340-L350 VanDerWaalsContact CD1-CD1 3.45Å; L340-L350 HydrophobicContact CD1-CD2 4.33Å; I343-L350 HydrophobicContact CG2-CD1 4.47Å; V344-L350 HydrophobicContact CG2-CD1 4.26Å; V344-L350 HydrophobicContact CG2-CD2 3.89Å; E348-L350 PolarHBondContact O-N 3.21Å; L350-L352 HydrophobicContact CD1-CD2 3.9Å; L350-L352 HydrophobicContact CD2-CD1 4.38Å; L350-L352 HydrophobicContact CD2-CD2 4Å; L350-L352 HydrophobicContact CD2-CG 3.98Å; L350-L352 HydrophobicContact CG-CD2 4.01Å; L350-L352 HydrophobicContact CG-CG 4.08Å
351D90.8Very high90.7Very high80 Ų8071.2 Ų71.243%0.42834%0.344SS..  trans-93.1118.9161.8178.517000110.8D353 H354 W357D351-D353 WeakPolarHBondContact OD1-CA 3.48Å; D351-D353 WeakPolarHBondContact OD1-CB 3.28Å; D351-D353 PolarHBondContact OD1-N 3.08Å; D351-H354 PolarHBondContact OD2-N 3.11Å; D351-W357 PolarHBondContact O-NE1 3.41Å; D351-W357 VanDerWaalsContact O-NE1 3.1Å
352L92.2Very high90.9Very high7 Ų769.8 Ų69.84%0.03734%0.339CS..SBendtrans-94.8-3.2174.7-71.2-170000114.3I312 A316 R320 L340 L350 W357 I363I312-L352 HydrophobicContact CG2-CD1 3.71Å; I312-L352 HydrophobicContact CG2-CG 3.88Å; A316-L352 HydrophobicContact CB-CB 3.89Å; A316-L352 HydrophobicContact CB-CD1 3.86Å; R320-L352 PolarHBondContact NH2-O 3.45Å; L340-L352 HydrophobicContact CD1-CD2 3.95Å; L340-L352 HydrophobicContact CD2-CD2 4.22Å; L350-L352 HydrophobicContact CD1-CD2 3.9Å; L350-L352 HydrophobicContact CD2-CD1 4.38Å; L350-L352 HydrophobicContact CD2-CD2 4Å; L350-L352 HydrophobicContact CD2-CG 3.98Å; L350-L352 HydrophobicContact CG-CD2 4.01Å; L350-L352 HydrophobicContact CG-CG 4.08Å; L352-W357 HydrophobicContact CD2-CB 4.43Å; L352-W357 HydrophobicContact CD2-CG 4.01Å; L352-I363 HydrophobicContact CB-CD1 4.12Å; L352-I363 HydrophobicContact CD1-CD1 4.03Å; L352-I363 HydrophobicContact CD1-CG1 4.21Å; L352-I363 HydrophobicContact CD1-CG2 3.97Å; L352-I363 HydrophobicContact CD2-CD1 4.37Å; L352-I363 HydrophobicContact CD2-CG1 4.31Å; L352-I363 HydrophobicContact CG-CD1 4.42Å
353D88.3Confident91.1Very high80 Ų8063.9 Ų63.943%0.42831%0.313SS..SBendtrans-83.6-22.8170.9-69.9-51.8000112.4K319 D351 N355K319-D353 WeakPolarHBondContact CE-OD1 3.48Å; K319-D353 IonicContact NZ-OD1 2.8Å; K319-D353 PolarHBondContact NZ-OD1 3.42Å; K319-D353 IonicContact NZ-OD2 3.19Å; K319-D353 PolarHBondContact NZ-OD2 2.85Å; D351-D353 WeakPolarHBondContact OD1-CA 3.48Å; D351-D353 WeakPolarHBondContact OD1-CB 3.28Å; D351-D353 PolarHBondContact OD1-N 3.08Å; D353-N355 PolarHBondContact O-N 3.37Å
354H88.6Confident91.4Very high101 Ų10162.7 Ų62.747%0.46831%0.307SS..SBendtrans-57.2133.8177.5-163.8-36.4000112.5D351 Q356 W357D351-H354 PolarHBondContact OD2-N 3.11Å; H354-Q356 HydrophobicContact CB-CG 4.18Å; H354-Q356 PolarHBondContact O-N 2.87Å; H354-W357 PolarHBondContact O-N 3.25Å
355N86.6Confident91.6Very high131 Ų13162.6 Ų62.670%0.70131%0.308SS*.G310 helixtrans-47.1-23.7-176.9-57.920.4000116.3D353 W357 E358D353-N355 PolarHBondContact O-N 3.37Å; N355-W357 PolarHBondContact O-N 2.77Å; N355-W357 VanDerWaalsContact O-N 3.15Å; N355-E358 WeakPolarHBondContact O-CB 3.43Å; N355-E358 PolarHBondContact O-N 3.14Å
356Q86.9Confident91.8Very high73 Ų7361.8 Ų61.834%0.34130%0.304SS..G310 helixtrans-62.4-16.5174.656.1169.8-11.600113.8H354H354-Q356 HydrophobicContact CB-CG 4.18Å; H354-Q356 PolarHBondContact O-N 2.87Å
357W92.6Very high92.3Very high1 Ų156.5 Ų56.50%0.00428%0.279CS..G310 helixtrans-116.819.1179.2-44.1122.9000113.2R320 T336 K339 L340 I343 D351 L352 H354 N355 D359 V362R320-W357 PolarHBondContact NH2-O 3.27Å; T336-W357 HydrophobicContact CG2-CE3 3.93Å; T336-W357 HydrophobicContact CG2-CZ3 3.77Å; K339-W357 HydrophobicContact CB-CH2 4.37Å; K339-W357 HydrophobicContact CD-CH2 4.01Å; K339-W357 HydrophobicContact CD-CZ3 4.38Å; K339-W357 HydrophobicContact CG-CH2 4.18Å; L340-W357 HydrophobicContact CB-CE3 4.2Å; L340-W357 HydrophobicContact CB-CH2 3.74Å; L340-W357 HydrophobicContact CB-CZ2 4.34Å; L340-W357 HydrophobicContact CB-CZ3 3.66Å; L340-W357 HydrophobicContact CD1-CD2 4.41Å; L340-W357 HydrophobicContact CD1-CH2 4.2Å; L340-W357 HydrophobicContact CD1-CZ2 3.93Å; I343-W357 HydrophobicContact CD1-CH2 3.83Å; I343-W357 HydrophobicContact CD1-CZ2 3.66Å; D351-W357 PolarHBondContact O-NE1 3.41Å; D351-W357 VanDerWaalsContact O-NE1 3.1Å; L352-W357 HydrophobicContact CD2-CB 4.43Å; L352-W357 HydrophobicContact CD2-CG 4.01Å; H354-W357 PolarHBondContact O-N 3.25Å; N355-W357 PolarHBondContact O-N 2.77Å; N355-W357 VanDerWaalsContact O-N 3.15Å; W357-D359 VanDerWaalsContact C-N 3.26Å; W357-D359 PolarHBondContact O-N 3.37Å; W357-V362 HydrophobicContact CE3-CG1 4.27Å
358E91.2Very high93.1Very high150 Ų15052 Ų5270%0.70126%0.258SS*.  trans-49.6-44.4-176.5-175.1176.4-17200112.5R320 N355 V360R320-E358 PolarHBondContact NH1-O 2.97Å; N355-E358 WeakPolarHBondContact O-CB 3.43Å; N355-E358 PolarHBondContact O-N 3.14Å; E358-V360 PolarHBondContact O-N 3.14Å; E358-V360 VanDerWaalsContact O-N 3.1Å
359D96.1Very high93.8Very high64 Ų6447.6 Ų47.634%0.34224%0.237SC..  trans-64.7107.3172.5176.518000112.3W357 H361 V362W357-D359 VanDerWaalsContact C-N 3.26Å; W357-D359 PolarHBondContact O-N 3.37Å; D359-H361 PolarHBondContact O-N 2.83Å; D359-H361 WeakPolarHBondContact OD1-CA 3.47Å; D359-H361 WeakPolarHBondContact OD1-CB 3.49Å; D359-H361 IonicContact OD1-CD2 3.24Å; D359-H361 PolarHBondContact OD1-CD2 3.15Å; D359-H361 IonicContact OD1-CG 2.89Å; D359-H361 PolarHBondContact OD1-N 2.86Å; D359-V362 HydrophobicContact CB-CG2 4.03Å; D359-V362 VanDerWaalsContact O-CB 3.29Å; D359-V362 WeakPolarHBondContact O-CB 3.45Å; D359-V362 PolarHBondContact O-N 3.05Å
360V97.4Very high94.5Very high10 Ų1038.1 Ų38.16%0.06119%0.193CC..Hα-helixtrans-63.9-20.5176.573.20000113.5V317 A324 I327 E358 V362 I363 T364V317-V360 HydrophobicContact CG2-CG2 3.99Å; A324-V360 HydrophobicContact CB-CG1 3.78Å; I327-V360 HydrophobicContact CD1-CB 4.43Å; I327-V360 HydrophobicContact CD1-CG1 3.76Å; I327-V360 HydrophobicContact CD1-CG2 3.85Å; E358-V360 PolarHBondContact O-N 3.14Å; E358-V360 VanDerWaalsContact O-N 3.1Å; V360-V362 PolarHBondContact O-N 2.95Å; V360-I363 PolarHBondContact O-N 2.87Å; V360-T364 PolarHBondContact O-N 2.81Å; V360-T364 PolarHBondContact O-OG1 3.05Å; V360-T364 VanDerWaalsContact O-OG1 3.11Å
361H98.2Very high94.9Very high32 Ų3236.6 Ų36.615%0.14819%0.185CC..Hα-helixtrans-71.2-19.9173.7-52.8-63.4000112.2D325 V330 G332 D359 T364 G365D325-H361 PolarHBondContact O-CE1 3.38Å; V330-H361 HydrophobicContact CG1-CB 4.37Å; G332-H361 VanDerWaalsContact CA-C 3.48Å; G332-H361 WeakPolarHBondContact CA-O 3.39Å; G332-H361 PolarHBondContact N-O 2.72Å; D359-H361 PolarHBondContact O-N 2.83Å; D359-H361 WeakPolarHBondContact OD1-CA 3.47Å; D359-H361 WeakPolarHBondContact OD1-CB 3.49Å; D359-H361 IonicContact OD1-CD2 3.24Å; D359-H361 PolarHBondContact OD1-CD2 3.15Å; D359-H361 IonicContact OD1-CG 2.89Å; D359-H361 PolarHBondContact OD1-N 2.86Å; H361-T364 WeakPolarHBondContact CA-OG1 3.37Å; H361-G365 WeakPolarHBondContact O-CA 3.38Å; H361-G365 PolarHBondContact O-N 3.08Å
362V98.2Very high95.2Very high3 Ų338.6 Ų38.62%0.01819%0.187CC..Hα-helixtrans-68-48.5166.1174.30000110.3T336 I337 L340 W357 D359 V360 G365 A366T336-V362 HydrophobicContact CG2-CG1 3.92Å; T336-V362 HydrophobicContact CG2-CG2 3.91Å; I337-V362 HydrophobicContact CG1-CB 4.23Å; I337-V362 HydrophobicContact CG1-CG1 3.86Å; I337-V362 HydrophobicContact CG1-CG2 4.45Å; L340-V362 HydrophobicContact CD2-CG1 4.19Å; W357-V362 HydrophobicContact CE3-CG1 4.27Å; D359-V362 HydrophobicContact CB-CG2 4.03Å; D359-V362 VanDerWaalsContact O-CB 3.29Å; D359-V362 WeakPolarHBondContact O-CB 3.45Å; D359-V362 PolarHBondContact O-N 3.05Å; V360-V362 PolarHBondContact O-N 2.95Å; V362-G365 PolarHBondContact O-N 2.97Å; V362-A366 WeakPolarHBondContact O-CB 3.5Å; V362-A366 PolarHBondContact O-N 2.91Å
363I98.3Very high95.4Very high0 Ų041 Ų410%020%0.197CC..Hα-helixtrans-63.4-51.1-178.3-63.2174.8000110.6C313 A316 V317 L352 V360 G365 A366 L367C313-I363 HydrophobicContact CB-CG2 3.87Å; A316-I363 HydrophobicContact CB-CD1 4.03Å; V317-I363 HydrophobicContact CG2-CB 4.44Å; V317-I363 HydrophobicContact CG2-CG2 3.81Å; L352-I363 HydrophobicContact CB-CD1 4.12Å; L352-I363 HydrophobicContact CD1-CD1 4.03Å; L352-I363 HydrophobicContact CD1-CG1 4.21Å; L352-I363 HydrophobicContact CD1-CG2 3.97Å; L352-I363 HydrophobicContact CD2-CD1 4.37Å; L352-I363 HydrophobicContact CD2-CG1 4.31Å; L352-I363 HydrophobicContact CG-CD1 4.42Å; V360-I363 PolarHBondContact O-N 2.87Å; I363-G365 VanDerWaalsContact C-N 3.27Å; I363-G365 PolarHBondContact O-N 3.19Å; I363-A366 PolarHBondContact O-N 2.86Å; I363-L367 PolarHBondContact O-N 3.15Å
364T98.5Very high95.8Very high0 Ų037.5 Ų37.50%018%0.179CC..Hα-helixtrans-64.5-32.1176.155.70000112.6V317 I327 Y328 V360 H361 K368V317-T364 HydrophobicContact CG1-CG2 4.23Å; V317-T364 HydrophobicContact CG2-CG2 3.63Å; I327-T364 HydrophobicContact CD1-CG2 3.53Å; I327-T364 HydrophobicContact CG1-CG2 4.07Å; Y328-T364 HydrophobicContact CD1-CG2 3.67Å; Y328-T364 HydrophobicContact CD2-CG2 4.19Å; Y328-T364 HydrophobicContact CE1-CG2 3.43Å; Y328-T364 VanDerWaalsContact CE1-CG2 3.43Å; Y328-T364 HydrophobicContact CE2-CG2 3.98Å; Y328-T364 HydrophobicContact CG-CG2 4.04Å; V360-T364 PolarHBondContact O-N 2.81Å; V360-T364 PolarHBondContact O-OG1 3.05Å; V360-T364 VanDerWaalsContact O-OG1 3.11Å; H361-T364 WeakPolarHBondContact CA-OG1 3.37Å; T364-K368 WeakPolarHBondContact O-CB 3.38Å; T364-K368 WeakPolarHBondContact O-CE 3.4Å; T364-K368 VanDerWaalsContact O-CG 3.28Å; T364-K368 WeakPolarHBondContact O-CG 3.43Å; T364-K368 PolarHBondContact O-N 3.37Å
365G98.4Very high96.1Very high8 Ų835.4 Ų35.48%0.08217%0.174CC..Hα-helixtrans-63-45.5171.800000113H361 V362 I363 M369H361-G365 WeakPolarHBondContact O-CA 3.38Å; H361-G365 PolarHBondContact O-N 3.08Å; V362-G365 PolarHBondContact O-N 2.97Å; I363-G365 VanDerWaalsContact C-N 3.27Å; I363-G365 PolarHBondContact O-N 3.19Å; G365-M369 WeakPolarHBondContact O-CB 3.41Å; G365-M369 PolarHBondContact O-N 3.24Å
366A98.4Very high96.5Very high0 Ų032.5 Ų32.50%016%0.157CC..Hα-helixtrans-68.2-40177.500000112.1F309 I337 L340 V362 I363 M369 F370F309-A366 HydrophobicContact CZ-CB 3.89Å; I337-A366 HydrophobicContact CG2-CB 4.04Å; L340-A366 HydrophobicContact CD2-CB 3.65Å; L340-A366 HydrophobicContact CG-CB 4.24Å; V362-A366 WeakPolarHBondContact O-CB 3.5Å; V362-A366 PolarHBondContact O-N 2.91Å; I363-A366 PolarHBondContact O-N 2.86Å; A366-M369 WeakPolarHBondContact O-CB 3.46Å; A366-M369 PolarHBondContact O-N 3.35Å; A366-M369 VanDerWaalsContact O-N 3.15Å; A366-F370 PolarHBondContact O-N 2.73Å
367L98.6Very high97Very high0 Ų029.1 Ų29.10%014%0.141CC..Hα-helixtrans-63.1-44.7174.5-177.359.4000112.2V310 C313 L314 Y328 I363 M369 F370 F371V310-L367 HydrophobicContact CB-CD1 4.27Å; V310-L367 HydrophobicContact CG1-CD1 4.19Å; V310-L367 HydrophobicContact CG2-CD1 3.98Å; C313-L367 HydrophobicContact CB-CB 4.13Å; C313-L367 HydrophobicContact CB-CD1 4.19Å; C313-L367 HydrophobicContact CB-CD2 4.14Å; C313-L367 HydrophobicContact CB-CG 4.38Å; L314-L367 HydrophobicContact CD2-CD2 3.48Å; L314-L367 VanDerWaalsContact CD2-CD2 3.48Å; L314-L367 HydrophobicContact CG-CD2 3.98Å; Y328-L367 HydrophobicContact CE1-CD2 4.15Å; I363-L367 PolarHBondContact O-N 3.15Å; L367-M369 VanDerWaalsContact C-N 3.27Å; L367-M369 PolarHBondContact O-N 2.87Å; L367-F370 PolarHBondContact O-N 3.28Å; L367-F371 HydrophobicContact CD1-CD2 4.23Å; L367-F371 HydrophobicContact CD1-CE2 3.61Å; L367-F371 HydrophobicContact CD1-CZ 4.32Å; L367-F371 HydrophobicContact CG-CD2 4.35Å; L367-F371 HydrophobicContact CG-CE2 3.93Å; L367-F371 VanDerWaalsContact O-CD2 3.26Å; L367-F371 WeakPolarHBondContact O-CD2 3.48Å; L367-F371 PolarHBondContact O-N 3.24Å
368K98.6Very high97.2Very high22 Ų2229.1 Ų29.110%0.09614%0.141CC..Hα-helixtrans-62.4-34.3172.2-72177.8-64178.10112.2Y328 T364 R372 V445 F446 T449Y328-K368 HydrophobicContact CD1-CD 4.49Å; Y328-K368 HydrophobicContact CD1-CG 4.42Å; Y328-K368 WeakPolarHBondContact O-CE 3.31Å; Y328-K368 PolarHBondContact O-NZ 3.33Å; T364-K368 WeakPolarHBondContact O-CB 3.38Å; T364-K368 WeakPolarHBondContact O-CE 3.4Å; T364-K368 VanDerWaalsContact O-CG 3.28Å; T364-K368 WeakPolarHBondContact O-CG 3.43Å; T364-K368 PolarHBondContact O-N 3.37Å; K368-R372 WeakPolarHBondContact O-CB 3.48Å; K368-R372 PolarHBondContact O-N 3.42Å; K368-R372 PolarHBondContact O-NH1 2.9Å; K368-V445 HydrophobicContact CD-CG1 3.66Å; K368-F446 HydrophobicContact CG-CZ 4.5Å; K368-T449 HydrophobicContact CB-CG2 4.21Å; K368-T449 HydrophobicContact CG-CG2 4.42Å
369M98.4Very high97.5Very high7 Ų722.1 Ų22.13%0.03411%0.108CC..Hα-helixtrans-68.6-40.6176.6-178.1177.2-71.300111.8F291 L334 I337 R341 G365 A366 L367 R372 E373F291-M369 HydrophobicContact CD1-CG 4.22Å; F291-M369 HydrophobicContact CE1-CB 4.14Å; F291-M369 HydrophobicContact CE1-CG 3.99Å; F291-M369 HydrophobicContact CE1-SD 4.44Å; L334-M369 HydrophobicContact CD1-CE 3.8Å; I337-M369 HydrophobicContact CG2-CE 3.47Å; I337-M369 VanDerWaalsContact CG2-CE 3.47Å; I337-M369 HydrophobicContact CG2-SD 3.76Å; R341-M369 HydrophobicContact CG-SD 4.37Å; G365-M369 WeakPolarHBondContact O-CB 3.41Å; G365-M369 PolarHBondContact O-N 3.24Å; A366-M369 WeakPolarHBondContact O-CB 3.46Å; A366-M369 PolarHBondContact O-N 3.35Å; A366-M369 VanDerWaalsContact O-N 3.15Å; L367-M369 VanDerWaalsContact C-N 3.27Å; L367-M369 PolarHBondContact O-N 2.87Å; M369-R372 PolarHBondContact O-N 3.21Å; M369-E373 HydrophobicContact CG-CG 4.27Å; M369-E373 WeakPolarHBondContact CG-OE1 3.37Å; M369-E373 WeakPolarHBondContact O-CB 3.45Å; M369-E373 WeakPolarHBondContact O-CG 3.42Å; M369-E373 PolarHBondContact O-N 3.33Å
370F98.6Very high97.5Very high0 Ų019.1 Ų19.10%09%0.092CC..Hα-helixtrans-56.9-53.6176.1172.1-94.1000111.3V290 F291 L298 P307 F309 V310 A366 L367 R372 E373 L374V290-F370 HydrophobicContact CG1-CD2 4.46Å; V290-F370 HydrophobicContact CG1-CE2 4.12Å; F291-F370 HydrophobicContact CD1-CB 4.16Å; F291-F370 HydrophobicContact CE1-CB 3.72Å; F291-F370 HydrophobicContact CZ-CB 4.13Å; L298-F370 HydrophobicContact CD2-CE2 3.7Å; L298-F370 HydrophobicContact CD2-CZ 3.78Å; P307-F370 HydrophobicContact CB-CZ 3.98Å; P307-F370 HydrophobicContact CG-CE1 4.18Å; P307-F370 HydrophobicContact CG-CZ 3.76Å; F309-F370 HydrophobicContact CD1-CB 4.04Å; F309-F370 AromaticContact CD1-CD2 3.99Å; F309-F370 HydrophobicContact CD1-CD2 3.99Å; F309-F370 AromaticContact CD1-CG 4Å; F309-F370 HydrophobicContact CD1-CG 4Å; F309-F370 HydrophobicContact CE1-CB 3.74Å; F309-F370 HydrophobicContact CE1-CD2 4.49Å; F309-F370 HydrophobicContact CE1-CG 4.23Å; V310-F370 HydrophobicContact CG2-CD1 3.57Å; V310-F370 HydrophobicContact CG2-CE1 3.4Å; V310-F370 VanDerWaalsContact CG2-CE1 3.4Å; V310-F370 HydrophobicContact CG2-CG 4.45Å; V310-F370 HydrophobicContact CG2-CZ 4.16Å; A366-F370 PolarHBondContact O-N 2.73Å; L367-F370 PolarHBondContact O-N 3.28Å; F370-R372 VanDerWaalsContact C-N 3.33Å; F370-R372 PolarHBondContact O-N 3.41Å; F370-E373 PolarHBondContact O-N 3.11Å; F370-L374 HydrophobicContact CE1-CD2 4.15Å; F370-L374 HydrophobicContact CE2-CD2 4.43Å; F370-L374 HydrophobicContact CZ-CD2 3.95Å; F370-L374 PolarHBondContact O-N 3.49Å
371F98.5Very high97.3Very high0 Ų020.6 Ų20.60%010%0.098CC..Hα-helixtrans-61.1-39.1179.3-71.6-62.6000113.3V310 L367 L374 L378 T417 L421 T449 L450 W452V310-F371 HydrophobicContact CG1-CZ 4.1Å; V310-F371 HydrophobicContact CG2-CE1 4.49Å; V310-F371 HydrophobicContact CG2-CZ 4.07Å; L367-F371 HydrophobicContact CD1-CD2 4.23Å; L367-F371 HydrophobicContact CD1-CE2 3.61Å; L367-F371 HydrophobicContact CD1-CZ 4.32Å; L367-F371 HydrophobicContact CG-CD2 4.35Å; L367-F371 HydrophobicContact CG-CE2 3.93Å; L367-F371 VanDerWaalsContact O-CD2 3.26Å; L367-F371 WeakPolarHBondContact O-CD2 3.48Å; L367-F371 PolarHBondContact O-N 3.24Å; F371-L374 HydrophobicContact CD1-CD1 4.14Å; F371-L374 PolarHBondContact O-N 3.12Å; F371-L378 HydrophobicContact CD1-CB 4.33Å; F371-L378 HydrophobicContact CD1-CD2 4.27Å; F371-L378 HydrophobicContact CE1-CD1 4.4Å; F371-L378 HydrophobicContact CE1-CD2 3.88Å; F371-T417 HydrophobicContact CE1-CG2 3.76Å; F371-T417 HydrophobicContact CZ-CG2 4.02Å; F371-L421 HydrophobicContact CE2-CD1 4.25Å; F371-L421 HydrophobicContact CE2-CD2 3.93Å; F371-L421 HydrophobicContact CZ-CD2 3.93Å; F371-T449 HydrophobicContact CB-CG2 3.88Å; F371-L450 HydrophobicContact CB-CD2 4.04Å; F371-L450 HydrophobicContact CD1-CD2 4Å; F371-L450 HydrophobicContact CD2-CD2 4.09Å; F371-L450 HydrophobicContact CG-CD2 3.78Å; F371-W452 VanDerWaalsContact O-CH2 3.3Å; F371-W452 WeakPolarHBondContact O-CH2 3.4Å
372R97.3Very high97.1Very high122 Ų12227 Ų2746%0.4612%0.121SC..Hα-helixtrans-74.3-25.1179.2-172.8-179.864.1-100.2-4.3113.7K368 M369 F370K368-R372 WeakPolarHBondContact O-CB 3.48Å; K368-R372 PolarHBondContact O-N 3.42Å; K368-R372 PolarHBondContact O-NH1 2.9Å; M369-R372 PolarHBondContact O-N 3.21Å; F370-R372 VanDerWaalsContact C-N 3.33Å; F370-R372 PolarHBondContact O-N 3.41Å
373E96.2Very high96.9Very high56 Ų5627.3 Ų27.326%0.26212%0.122SC..Hα-helixtrans-87.5-5176.2-74.2-174.6-156.800113G292 R341 M369 F370G292-E373 VanDerWaalsContact CA-O 3.31Å; G292-E373 WeakPolarHBondContact CA-O 3.26Å; R341-E373 IonicContact CZ-OE2 2.68Å; R341-E373 VanDerWaalsContact CZ-OE2 3.24Å; R341-E373 IonicContact NE-OE1 3.74Å; R341-E373 PolarHBondContact NE-OE1 3.45Å; R341-E373 IonicContact NE-OE2 2.99Å; R341-E373 PolarHBondContact NE-OE2 3.21Å; R341-E373 IonicContact NH2-OE2 2.61Å; R341-E373 PolarHBondContact NH2-OE2 3.1Å; M369-E373 HydrophobicContact CG-CG 4.27Å; M369-E373 WeakPolarHBondContact CG-OE1 3.37Å; M369-E373 WeakPolarHBondContact O-CB 3.45Å; M369-E373 WeakPolarHBondContact O-CG 3.42Å; M369-E373 PolarHBondContact O-N 3.33Å; F370-E373 PolarHBondContact O-N 3.11Å
374L96.4Very high96.6Very high7 Ų728.5 Ų28.54%0.03713%0.127CC..SBendtrans-58.9138.5172.9-65.4176.2000110.7C293 L295 F370 F371 E376 W452C293-L374 WeakPolarHBondContact O-CD2 3.49Å; L295-L374 HydrophobicContact CB-CD2 4.45Å; F370-L374 HydrophobicContact CE1-CD2 4.15Å; F370-L374 HydrophobicContact CE2-CD2 4.43Å; F370-L374 HydrophobicContact CZ-CD2 3.95Å; F370-L374 PolarHBondContact O-N 3.49Å; F371-L374 HydrophobicContact CD1-CD1 4.14Å; F371-L374 PolarHBondContact O-N 3.12Å; L374-E376 VanDerWaalsContact CB-O 3.23Å; L374-E376 WeakPolarHBondContact CB-O 3.39Å; L374-E376 PolarHBondContact O-N 3.06Å; L374-W452 HydrophobicContact CB-CH2 4.45Å; L374-W452 WeakPolarHBondContact O-CZ2 3.35Å
375P94.5Very high96.2Very high58 Ų5833.2 Ų33.238%0.37715%0.149SC..SBendtrans-63-25.9175.9-24.934.8000114.3G292 C293G292-P375 VanDerWaalsContact O-CG 3.29Å; G292-P375 WeakPolarHBondContact O-CG 3.36Å; C293-P375 WeakPolarHBondContact O-CD 3.33Å
376E94.9Very high96.1Very high70 Ų7036.8 Ų36.833%0.32716%0.164SC..SBendtrans-130.8138171.7-175.1177.1-15700108.4L374 P380 F381L374-E376 VanDerWaalsContact CB-O 3.23Å; L374-E376 WeakPolarHBondContact CB-O 3.39Å; L374-E376 PolarHBondContact O-N 3.06Å; E376-P380 HydrophobicContact CG-CB 4.45Å; E376-P380 WeakPolarHBondContact OE1-CA 3.2Å; E376-P380 WeakPolarHBondContact OE1-CB 3.47Å; E376-F381 HydrophobicContact CB-CE2 4.29Å; E376-F381 HydrophobicContact CG-CD2 3.77Å; E376-F381 HydrophobicContact CG-CE2 3.92Å; E376-F381 HydrophobicContact CG-CG 4.41Å; E376-F381 PolarHBondContact OE1-N 2.78Å
377P97.1Very high95.9Very high2 Ų236.9 Ų36.91%0.01316%0.164CC..  trans-58.9157.5-179.89.4-16.8000113.4F379 F381 L450 W452P377-F379 WeakPolarHBondContact CB-O 3.49Å; P377-F379 WeakPolarHBondContact CG-O 3.28Å; P377-F379 CarbonylContact O-C 3.47Å; P377-F379 PolarHBondContact O-N 3.14Å; P377-F381 HydrophobicContact CG-CD1 3.7Å; P377-F381 HydrophobicContact CG-CE1 3.47Å; P377-F381 VanDerWaalsContact CG-CE1 3.47Å; P377-F381 HydrophobicContact CG-CG 4.42Å; P377-F381 HydrophobicContact CG-CZ 4.02Å; P377-L450 VanDerWaalsContact CB-O 3.23Å; P377-L450 WeakPolarHBondContact CB-O 2.94Å; P377-W452 VanDerWaalsContact CA-CH2 3.45Å; P377-W452 HydrophobicContact CB-CD2 3.99Å; P377-W452 HydrophobicContact CB-CE3 3.81Å; P377-W452 HydrophobicContact CB-CH2 3.75Å; P377-W452 HydrophobicContact CB-CZ2 3.92Å; P377-W452 HydrophobicContact CB-CZ3 3.68Å; P377-W452 VanDerWaalsContact CD-CZ2 3.47Å; P377-W452 HydrophobicContact CG-CD2 3.96Å; P377-W452 HydrophobicContact CG-CE3 4.3Å; P377-W452 HydrophobicContact CG-CG 4.44Å; P377-W452 HydrophobicContact CG-CH2 4.36Å; P377-W452 HydrophobicContact CG-CZ2 4.01Å; P377-W452 HydrophobicContact CG-CZ3 4.49Å
378L98Very high95.7Very high1 Ų137 Ų371%0.00517%0.165CC..SBendtrans-55.4-37175.8-177.962.7000111.1L295 F371 P380 N414 T417 M418 L421 L450L295-L378 HydrophobicContact CD2-CD1 3.72Å; F371-L378 HydrophobicContact CD1-CB 4.33Å; F371-L378 HydrophobicContact CD1-CD2 4.27Å; F371-L378 HydrophobicContact CE1-CD1 4.4Å; F371-L378 HydrophobicContact CE1-CD2 3.88Å; L378-P380 WeakPolarHBondContact O-CD 3.46Å; L378-N414 HydrophobicContact CD1-CB 4.42Å; L378-N414 PolarHBondContact O-ND2 3.49Å; L378-T417 HydrophobicContact CD1-CG2 3.87Å; L378-T417 HydrophobicContact CD2-CG2 4.44Å; L378-M418 HydrophobicContact CD1-CG 4.22Å; L378-M418 HydrophobicContact CD2-CG 3.62Å; L378-M418 HydrophobicContact CG-CE 3.97Å; L378-M418 HydrophobicContact CG-CG 3.73Å; L378-M418 WeakPolarHBondContact O-CE 3.4Å; L378-L421 HydrophobicContact CD2-CD2 4.13Å; L378-L450 HydrophobicContact CB-CD2 4.21Å; L378-L450 HydrophobicContact CD2-CD2 3.88Å; L378-L450 PolarHBondContact N-O 3.39Å
379F96.8Very high95.5Very high2 Ų239.4 Ų39.41%0.00918%0.179CC..SBendtrans-86.1105162.7-69.3-99.4000109P377 F387 M418 F422 L450 M451 I470 I474P377-F379 WeakPolarHBondContact CB-O 3.49Å; P377-F379 WeakPolarHBondContact CG-O 3.28Å; P377-F379 CarbonylContact O-C 3.47Å; P377-F379 PolarHBondContact O-N 3.14Å; F379-F387 AromaticContact CD1-CD2 3.84Å; F379-F387 HydrophobicContact CD1-CD2 3.84Å; F379-F387 HydrophobicContact CD1-CE1 4.42Å; F379-F387 AromaticContact CD1-CE2 3.63Å; F379-F387 HydrophobicContact CD1-CE2 3.63Å; F379-F387 HydrophobicContact CD1-CG 4.34Å; F379-F387 AromaticContact CD1-CZ 3.95Å; F379-F387 HydrophobicContact CD1-CZ 3.95Å; F379-F387 HydrophobicContact CE1-CD1 4.45Å; F379-F387 HydrophobicContact CE1-CD2 4.45Å; F379-F387 HydrophobicContact CE1-CE1 4.16Å; F379-F387 HydrophobicContact CE1-CE2 4.17Å; F379-F387 HydrophobicContact CE1-CZ 4.02Å; F379-M418 HydrophobicContact CB-CE 4.14Å; F379-M418 HydrophobicContact CD1-CE 3.51Å; F379-M418 HydrophobicContact CD1-SD 4.4Å; F379-M418 HydrophobicContact CD2-CE 3.56Å; F379-M418 HydrophobicContact CE1-CE 3.64Å; F379-M418 HydrophobicContact CE1-SD 3.95Å; F379-M418 HydrophobicContact CE2-CE 3.7Å; F379-M418 HydrophobicContact CE2-SD 4.21Å; F379-M418 HydrophobicContact CG-CE 3.45Å; F379-M418 VanDerWaalsContact CG-CE 3.45Å; F379-M418 HydrophobicContact CZ-CE 3.73Å; F379-M418 HydrophobicContact CZ-SD 3.83Å; F379-F422 HydrophobicContact CE2-CE2 4.31Å; F379-F422 HydrophobicContact CE2-CZ 4.47Å; F379-F422 HydrophobicContact CZ-CE2 4.05Å; F379-F422 HydrophobicContact CZ-CZ 4.18Å; F379-L450 HydrophobicContact CD2-CB 3.79Å; F379-L450 WeakPolarHBondContact CD2-O 3.38Å; F379-L450 HydrophobicContact CE2-CB 3.9Å; F379-L450 HydrophobicContact CE2-CD1 4.12Å; F379-L450 PolarHBondContact N-O 2.93Å; F379-M451 HydrophobicContact CB-CG 3.49Å; F379-M451 VanDerWaalsContact CB-CG 3.49Å; F379-M451 HydrophobicContact CB-SD 4.33Å; F379-M451 HydrophobicContact CD1-CG 4.48Å; F379-M451 HydrophobicContact CD1-SD 4.32Å; F379-M451 HydrophobicContact CD2-CE 4.32Å; F379-M451 HydrophobicContact CD2-CG 3.78Å; F379-M451 HydrophobicContact CD2-SD 4.3Å; F379-M451 HydrophobicContact CE2-CE 4.36Å; F379-M451 HydrophobicContact CG-CG 3.67Å; F379-M451 HydrophobicContact CG-SD 4.06Å; F379-I470 HydrophobicContact CE1-CG2 4.15Å; F379-I474 HydrophobicContact CE1-CD1 3.52Å; F379-I474 HydrophobicContact CZ-CD1 3.57Å
380P95.8Very high95.4Very high2 Ų239.4 Ų39.41%0.01318%0.18CC..  trans-62.7146.2-172.4-18.831.3000111.8E376 L378 R382 F383 L410E376-P380 HydrophobicContact CG-CB 4.45Å; E376-P380 WeakPolarHBondContact OE1-CA 3.2Å; E376-P380 WeakPolarHBondContact OE1-CB 3.47Å; L378-P380 WeakPolarHBondContact O-CD 3.46Å; P380-R382 VanDerWaalsContact C-N 3.26Å; P380-R382 HydrophobicContact CB-CG 4.4Å; P380-R382 PolarHBondContact O-N 3.15Å; P380-R382 VanDerWaalsContact O-N 3.11Å; P380-F383 HydrophobicContact CB-CD2 4.01Å; P380-F383 HydrophobicContact CG-CD2 3.98Å; P380-F383 HydrophobicContact CG-CE2 4.42Å; P380-F383 PolarHBondContact O-N 3.19Å; P380-L410 HydrophobicContact CG-CD2 4.09Å
381F93.9Very high95.2Very high41 Ų4140 Ų4018%0.1818%0.183CC..Hα-helixtrans-54.5-42-169.2-64.6-59.8000112.5E376 P377 F383 F384 W452 E454E376-F381 HydrophobicContact CB-CE2 4.29Å; E376-F381 HydrophobicContact CG-CD2 3.77Å; E376-F381 HydrophobicContact CG-CE2 3.92Å; E376-F381 HydrophobicContact CG-CG 4.41Å; E376-F381 PolarHBondContact OE1-N 2.78Å; P377-F381 HydrophobicContact CG-CD1 3.7Å; P377-F381 HydrophobicContact CG-CE1 3.47Å; P377-F381 VanDerWaalsContact CG-CE1 3.47Å; P377-F381 HydrophobicContact CG-CG 4.42Å; P377-F381 HydrophobicContact CG-CZ 4.02Å; F381-F383 PolarHBondContact O-N 2.85Å; F381-F383 VanDerWaalsContact O-N 3.08Å; F381-F384 WeakPolarHBondContact O-CB 3.47Å; F381-F384 PolarHBondContact O-N 3.37Å; F381-W452 WeakPolarHBondContact CD1-O 3.09Å; F381-W452 AromaticContact CE1-CD1 3.64Å; F381-W452 HydrophobicContact CE1-CG 4.45Å; F381-W452 AromaticContact CE1-NE1 3.6Å; F381-W452 WeakPolarHBondContact CE1-O 3.49Å; F381-W452 AromaticContact CZ-CD1 3.98Å; F381-W452 AromaticContact CZ-NE1 3.51Å; F381-E454 HydrophobicContact CB-CB 4.15Å; F381-E454 HydrophobicContact CD1-CB 3.69Å; F381-E454 HydrophobicContact CD1-CG 4.42Å; F381-E454 HydrophobicContact CD2-CB 4.08Å; F381-E454 HydrophobicContact CD2-CG 3.92Å; F381-E454 HydrophobicContact CE1-CB 3.98Å; F381-E454 HydrophobicContact CE2-CB 4.36Å; F381-E454 HydrophobicContact CE2-CG 4.1Å; F381-E454 HydrophobicContact CG-CB 3.74Å; F381-E454 HydrophobicContact CG-CG 4.09Å; F381-E454 HydrophobicContact CZ-CB 4.3Å; F381-E454 HydrophobicContact CZ-CG 4.4Å
382R93.3Very high95Very high165 Ų16544.6 Ų44.662%0.62320%0.203SC*.Hα-helixtrans-58.3-20.1177.668.5-178.8-175.7164.23.3115.4P380 Q386P380-R382 VanDerWaalsContact C-N 3.26Å; P380-R382 HydrophobicContact CB-CG 4.4Å; P380-R382 PolarHBondContact O-N 3.15Å; P380-R382 VanDerWaalsContact O-N 3.11Å; R382-Q386 PolarHBondContact O-NE2 2.89Å
383F94.1Very high95Very high11 Ų1141.2 Ų41.25%0.04819%0.194CC..Hα-helixtrans-99.2-14.1177.6-69.3-77.8000113.4P380 F381 Q385 Q386 F387 L406 Q409 L410P380-F383 HydrophobicContact CB-CD2 4.01Å; P380-F383 HydrophobicContact CG-CD2 3.98Å; P380-F383 HydrophobicContact CG-CE2 4.42Å; P380-F383 PolarHBondContact O-N 3.19Å; F381-F383 PolarHBondContact O-N 2.85Å; F381-F383 VanDerWaalsContact O-N 3.08Å; F383-Q385 PolarHBondContact O-N 2.98Å; F383-Q386 WeakPolarHBondContact O-CA 3.39Å; F383-Q386 WeakPolarHBondContact O-CB 3.23Å; F383-Q386 PolarHBondContact O-N 3.03Å; F383-F387 HydrophobicContact CB-CD2 3.88Å; F383-F387 HydrophobicContact CB-CE2 3.74Å; F383-F387 HydrophobicContact CG-CE2 4.5Å; F383-F387 VanDerWaalsContact O-CD2 3.31Å; F383-F387 WeakPolarHBondContact O-CD2 3.44Å; F383-F387 PolarHBondContact O-N 3.2Å; F383-L406 HydrophobicContact CD1-CD2 4.27Å; F383-Q409 HydrophobicContact CE1-CB 3.99Å; F383-Q409 HydrophobicContact CZ-CB 4.11Å; F383-Q409 WeakPolarHBondContact CZ-O 3.46Å; F383-L410 HydrophobicContact CB-CD2 4.48Å; F383-L410 HydrophobicContact CD1-CD2 4.43Å; F383-L410 HydrophobicContact CD2-CD2 3.45Å; F383-L410 VanDerWaalsContact CD2-CD2 3.45Å; F383-L410 HydrophobicContact CE2-CD2 3.59Å; F383-L410 HydrophobicContact CG-CD2 3.9Å; F383-L410 HydrophobicContact CZ-CD2 4.16Å
384F91.6Very high94.9Very high24 Ų2448.4 Ų48.411%0.10523%0.225CC..Hα-helixtrans-53.6-52.3-173.7178.2-106.7000112.3F381 Q386 F387 V388 M451 N463 Q467F381-F384 WeakPolarHBondContact O-CB 3.47Å; F381-F384 PolarHBondContact O-N 3.37Å; F384-Q386 VanDerWaalsContact C-N 3.26Å; F384-Q386 PolarHBondContact O-N 3.49Å; F384-F387 PolarHBondContact O-N 3.44Å; F384-V388 HydrophobicContact CD1-CG2 4.28Å; F384-V388 HydrophobicContact CD2-CG2 4.48Å; F384-V388 HydrophobicContact CE1-CG2 3.86Å; F384-V388 HydrophobicContact CE2-CG2 4.06Å; F384-V388 HydrophobicContact CZ-CG2 3.73Å; F384-V388 WeakPolarHBondContact O-CG2 3.49Å; F384-V388 PolarHBondContact O-N 3.47Å; F384-M451 HydrophobicContact CD2-CB 4.34Å; F384-M451 HydrophobicContact CD2-CG 4.23Å; F384-M451 HydrophobicContact CD2-SD 4.07Å; F384-M451 HydrophobicContact CE2-CB 4.32Å; F384-M451 HydrophobicContact CE2-SD 4.09Å; F384-N463 HydrophobicContact CZ-CB 4.29Å; F384-Q467 HydrophobicContact CE2-CG 3.72Å; F384-Q467 HydrophobicContact CZ-CG 4.15Å
385Q91.4Very high94.9Very high99 Ų9952.7 Ų52.746%0.46324%0.244SC..Hα-helixtrans-60.6-35.8178.2-174.556.945.300112.4F383 V388 D389F383-Q385 PolarHBondContact O-N 2.98Å; Q385-V388 WeakPolarHBondContact O-CB 3.49Å; Q385-V388 PolarHBondContact O-N 3.19Å; Q385-D389 VanDerWaalsContact NE2-CG 3.26Å; Q385-D389 PolarHBondContact NE2-OD1 3.3Å; Q385-D389 VanDerWaalsContact NE2-OD1 3.16Å; Q385-D389 PolarHBondContact NE2-OD2 2.98Å; Q385-D389 PolarHBondContact O-N 3.36Å
386Q95.1Very high94.8Very high84 Ų8453.5 Ų53.539%0.39325%0.248SC..Hα-helixtrans-68.5-39.2179.3-55179.15900111.5R382 F383 F384 D389 A390 L406R382-Q386 PolarHBondContact O-NE2 2.89Å; F383-Q386 WeakPolarHBondContact O-CA 3.39Å; F383-Q386 WeakPolarHBondContact O-CB 3.23Å; F383-Q386 PolarHBondContact O-N 3.03Å; F384-Q386 VanDerWaalsContact C-N 3.26Å; F384-Q386 PolarHBondContact O-N 3.49Å; Q386-D389 PolarHBondContact O-N 3.17Å; Q386-A390 WeakPolarHBondContact O-CB 3.31Å; Q386-A390 PolarHBondContact O-N 3.42Å; Q386-L406 HydrophobicContact CB-CD1 3.96Å; Q386-L406 HydrophobicContact CB-CD2 3.7Å; Q386-L406 HydrophobicContact CG-CD2 4.49Å; Q386-L406 WeakPolarHBondContact O-CD1 3.14Å
387F95.8Very high94.8Very high1 Ų157.3 Ų57.30%0.00426%0.264CS..Hα-helixtrans-67.1-39.4172.1-78-72.4000112.2F379 F383 F384 D389 A390 V391 V403 L406 I407 L410 I470 I474F379-F387 AromaticContact CD1-CD2 3.84Å; F379-F387 HydrophobicContact CD1-CD2 3.84Å; F379-F387 HydrophobicContact CD1-CE1 4.42Å; F379-F387 AromaticContact CD1-CE2 3.63Å; F379-F387 HydrophobicContact CD1-CE2 3.63Å; F379-F387 HydrophobicContact CD1-CG 4.34Å; F379-F387 AromaticContact CD1-CZ 3.95Å; F379-F387 HydrophobicContact CD1-CZ 3.95Å; F379-F387 HydrophobicContact CE1-CD1 4.45Å; F379-F387 HydrophobicContact CE1-CD2 4.45Å; F379-F387 HydrophobicContact CE1-CE1 4.16Å; F379-F387 HydrophobicContact CE1-CE2 4.17Å; F379-F387 HydrophobicContact CE1-CZ 4.02Å; F383-F387 HydrophobicContact CB-CD2 3.88Å; F383-F387 HydrophobicContact CB-CE2 3.74Å; F383-F387 HydrophobicContact CG-CE2 4.5Å; F383-F387 VanDerWaalsContact O-CD2 3.31Å; F383-F387 WeakPolarHBondContact O-CD2 3.44Å; F383-F387 PolarHBondContact O-N 3.2Å; F384-F387 PolarHBondContact O-N 3.44Å; F387-D389 VanDerWaalsContact C-N 3.32Å; F387-D389 PolarHBondContact O-N 3.41Å; F387-A390 PolarHBondContact O-N 2.9Å; F387-V391 PolarHBondContact O-N 2.65Å; F387-V403 HydrophobicContact CD1-CG1 4.43Å; F387-V403 HydrophobicContact CE1-CG1 4.19Å; F387-L406 HydrophobicContact CD1-CB 4.31Å; F387-L406 HydrophobicContact CD1-CD1 3.88Å; F387-L406 HydrophobicContact CE1-CB 3.7Å; F387-L406 HydrophobicContact CE1-CD1 4.13Å; F387-L406 HydrophobicContact CE2-CB 4.25Å; F387-L406 HydrophobicContact CG-CD1 4.1Å; F387-L406 HydrophobicContact CZ-CB 3.66Å; F387-I407 HydrophobicContact CE1-CD1 4.37Å; F387-I407 HydrophobicContact CE1-CG1 3.9Å; F387-I407 HydrophobicContact CZ-CG1 3.87Å; F387-L410 HydrophobicContact CE2-CD2 4.44Å; F387-I470 HydrophobicContact CB-CD1 3.8Å; F387-I470 HydrophobicContact CB-CG1 4.25Å; F387-I470 HydrophobicContact CB-CG2 4.3Å; F387-I470 HydrophobicContact CD1-CG2 4.42Å; F387-I474 HydrophobicContact CE1-CD1 4.44Å
388V93.4Very high94.8Very high2 Ų262.2 Ų62.21%0.01229%0.287CS..Hα-helixtrans-59.9-41.8173.7168.60000111.2F384 Q385 K392 Y466 I470F384-V388 HydrophobicContact CD1-CG2 4.28Å; F384-V388 HydrophobicContact CD2-CG2 4.48Å; F384-V388 HydrophobicContact CE1-CG2 3.86Å; F384-V388 HydrophobicContact CE2-CG2 4.06Å; F384-V388 HydrophobicContact CZ-CG2 3.73Å; F384-V388 WeakPolarHBondContact O-CG2 3.49Å; F384-V388 PolarHBondContact O-N 3.47Å; Q385-V388 WeakPolarHBondContact O-CB 3.49Å; Q385-V388 PolarHBondContact O-N 3.19Å; V388-K392 VanDerWaalsContact O-CG 3.3Å; V388-K392 WeakPolarHBondContact O-CG 3.29Å; V388-K392 PolarHBondContact O-N 2.91Å; V388-Y466 HydrophobicContact CG1-CD1 4.44Å; V388-Y466 HydrophobicContact CG1-CD2 3.7Å; V388-Y466 HydrophobicContact CG1-CE2 3.95Å; V388-Y466 HydrophobicContact CG1-CG 3.97Å; V388-Y466 HydrophobicContact CG2-CD2 4.43Å; V388-Y466 HydrophobicContact CG2-CG 4.33Å; V388-I470 HydrophobicContact CG2-CD1 4Å
389D94.4Very high94.7Very high74 Ų7464 Ų6440%0.39629%0.294SS..Hα-helixtrans-77.2-33179.1-66.5-33.9000112.7Q385 Q386 F387 K392Q385-D389 VanDerWaalsContact NE2-CG 3.26Å; Q385-D389 PolarHBondContact NE2-OD1 3.3Å; Q385-D389 VanDerWaalsContact NE2-OD1 3.16Å; Q385-D389 PolarHBondContact NE2-OD2 2.98Å; Q385-D389 PolarHBondContact O-N 3.36Å; Q386-D389 PolarHBondContact O-N 3.17Å; F387-D389 VanDerWaalsContact C-N 3.32Å; F387-D389 PolarHBondContact O-N 3.41Å; D389-K392 PolarHBondContact O-N 3.1Å; D389-K392 IonicContact OD1-NZ 2.6Å; D389-K392 PolarHBondContact OD1-NZ 3.49Å
390A96.4Very high94.7Very high7 Ų763.9 Ų63.96%0.05829%0.294CS..Hα-helixtrans-62.5-45.5170.800000111.9Q386 F387 K392 I393 A402 V403 L406Q386-A390 WeakPolarHBondContact O-CB 3.31Å; Q386-A390 PolarHBondContact O-N 3.42Å; F387-A390 PolarHBondContact O-N 2.9Å; A390-K392 PolarHBondContact O-N 3.19Å; A390-I393 VanDerWaalsContact O-CB 3.31Å; A390-I393 WeakPolarHBondContact O-CB 3.46Å; A390-I393 VanDerWaalsContact O-CG1 3.27Å; A390-I393 WeakPolarHBondContact O-CG1 3.39Å; A390-I393 PolarHBondContact O-N 3.01Å; A390-I393 VanDerWaalsContact O-N 3.11Å; A390-A402 HydrophobicContact CB-CB 4.04Å; A390-V403 HydrophobicContact CB-CG2 3.81Å; A390-L406 HydrophobicContact CB-CD1 3.95Å
391V94.9Very high94.8Very high11 Ų1170.1 Ų70.17%0.06732%0.323CS..Hα-helixtrans-69-19.7-177.187.40000113.3F387 I393 K399 Y466 Q469 I470 F473F387-V391 PolarHBondContact O-N 2.65Å; V391-I393 VanDerWaalsContact C-N 3.32Å; V391-K399 HydrophobicContact CG2-CD 4.33Å; V391-K399 WeakPolarHBondContact O-CE 3.43Å; V391-K399 PolarHBondContact O-NZ 3.28Å; V391-Y466 HydrophobicContact CG1-CD1 3.99Å; V391-Q469 HydrophobicContact CG2-CB 4.38Å; V391-I470 HydrophobicContact CB-CG1 4.11Å; V391-I470 HydrophobicContact CG1-CG1 4.02Å; V391-I470 HydrophobicContact CG2-CG1 4.46Å; V391-F473 HydrophobicContact CG2-CB 4.21Å
392K94.7Very high94.9Very high97 Ų9769.5 Ų69.542%0.42233%0.326SS..THydrogen-bonded Turntrans-73.3-16.3172.9-70.7168.3-164.11650114.2V388 D389 A390 K394 Y466V388-K392 VanDerWaalsContact O-CG 3.3Å; V388-K392 WeakPolarHBondContact O-CG 3.29Å; V388-K392 PolarHBondContact O-N 2.91Å; D389-K392 PolarHBondContact O-N 3.1Å; D389-K392 IonicContact OD1-NZ 2.6Å; D389-K392 PolarHBondContact OD1-NZ 3.49Å; A390-K392 PolarHBondContact O-N 3.19Å; K392-K394 PolarHBondContact O-N 3.31Å; K392-Y466 WeakPolarHBondContact CE-OH 3.33Å; K392-Y466 HydrophobicContact CG-CE1 4.13Å
393I96.4Very high95.1Very high51 Ų5161.8 Ų61.826%0.26230%0.297SS..  trans-57.2135.4178.2-64.6170.5000109.3A390 V391 Q398 K399 A402A390-I393 VanDerWaalsContact O-CB 3.31Å; A390-I393 WeakPolarHBondContact O-CB 3.46Å; A390-I393 VanDerWaalsContact O-CG1 3.27Å; A390-I393 WeakPolarHBondContact O-CG1 3.39Å; A390-I393 PolarHBondContact O-N 3.01Å; A390-I393 VanDerWaalsContact O-N 3.11Å; V391-I393 VanDerWaalsContact C-N 3.32Å; I393-Q398 HydrophobicContact CG2-CB 3.87Å; I393-K399 HydrophobicContact CB-CB 4.15Å; I393-K399 HydrophobicContact CG2-CB 4.26Å; I393-K399 WeakPolarHBondContact O-CE 3.49Å; I393-K399 PolarHBondContact O-NZ 3.25Å; I393-A402 HydrophobicContact CD1-CB 3.77Å
394K94.3Very high95.3Very high208 Ų20863.3 Ų63.390%0.90430%0.303SS*.SBendtrans-79-38.4-177.7-71.3-176178.11800113.1K392K392-K394 PolarHBondContact O-N 3.31Å
395E95.9Very high95.5Very high96 Ų9668.8 Ų68.845%0.44933%0.327SS..SBendtrans-80.9121.2-179.3-170.1-174.3154.900111.2K397 Q398 K399E395-K397 PolarHBondContact O-N 3Å; E395-Q398 HydrophobicContact CB-CB 4.29Å; E395-Q398 HydrophobicContact CB-CG 4.2Å; E395-Q398 HydrophobicContact CG-CG 4.33Å; E395-Q398 PolarHBondContact O-N 3.19Å; E395-Q398 PolarHBondContact OE2-NE2 2.91Å; E395-K399 WeakPolarHBondContact O-CB 3.39Å; E395-K399 PolarHBondContact O-N 2.82Å
396T93.7Very high95.8Very high76 Ų7664.9 Ų64.947%0.46631%0.309SS..Hα-helixtrans-57.2-45.1-177.1-46.60000112.5Q398 K399 T400 F473T396-Q398 PolarHBondContact O-N 3.15Å; T396-K399 CarbonylContact O-C 3.56Å; T396-K399 WeakPolarHBondContact O-CB 3.48Å; T396-K399 PolarHBondContact O-N 2.82Å; T396-K399 VanDerWaalsContact O-N 3.14Å; T396-T400 PolarHBondContact O-N 3.1Å; T396-T400 PolarHBondContact O-OG1 3.25Å; T396-F473 HydrophobicContact CG2-CE2 4.3Å
397K94.6Very high95.9Very high150 Ų15060.9 Ų60.965%0.65229%0.29SS*.Hα-helixtrans-61.1-46.6-179.1-68-176.3177.1-178.80112.5E395 K399 T400 Q401E395-K397 PolarHBondContact O-N 3Å; K397-K399 VanDerWaalsContact C-N 3.32Å; K397-K399 PolarHBondContact O-N 3.21Å; K397-T400 PolarHBondContact O-N 3.19Å; K397-Q401 WeakPolarHBondContact O-CG 3.43Å; K397-Q401 PolarHBondContact O-N 3.26Å
398Q96.3Very high95.9Very high105 Ų10565.8 Ų65.849%0.49131%0.313SS..Hα-helixtrans-63.1-39.4175.4-64.1-171.423.700111.6I393 E395 T396 Q401 A402I393-Q398 HydrophobicContact CG2-CB 3.87Å; E395-Q398 HydrophobicContact CB-CB 4.29Å; E395-Q398 HydrophobicContact CB-CG 4.2Å; E395-Q398 HydrophobicContact CG-CG 4.33Å; E395-Q398 PolarHBondContact O-N 3.19Å; E395-Q398 PolarHBondContact OE2-NE2 2.91Å; T396-Q398 PolarHBondContact O-N 3.15Å; Q398-Q401 PolarHBondContact O-N 2.99Å; Q398-A402 WeakPolarHBondContact O-CB 3.3Å; Q398-A402 PolarHBondContact O-N 2.94Å
399K96.7Very high96.1Very high37 Ų3770.2 Ų70.216%0.16133%0.334CS..Hα-helixtrans-61.1-48.6174.6-173.8-177.4-57.7-165.60111.9V391 I393 E395 T396 K397 Q401 A402 V403 F473V391-K399 HydrophobicContact CG2-CD 4.33Å; V391-K399 WeakPolarHBondContact O-CE 3.43Å; V391-K399 PolarHBondContact O-NZ 3.28Å; I393-K399 HydrophobicContact CB-CB 4.15Å; I393-K399 HydrophobicContact CG2-CB 4.26Å; I393-K399 WeakPolarHBondContact O-CE 3.49Å; I393-K399 PolarHBondContact O-NZ 3.25Å; E395-K399 WeakPolarHBondContact O-CB 3.39Å; E395-K399 PolarHBondContact O-N 2.82Å; T396-K399 CarbonylContact O-C 3.56Å; T396-K399 WeakPolarHBondContact O-CB 3.48Å; T396-K399 PolarHBondContact O-N 2.82Å; T396-K399 VanDerWaalsContact O-N 3.14Å; K397-K399 VanDerWaalsContact C-N 3.32Å; K397-K399 PolarHBondContact O-N 3.21Å; K399-Q401 VanDerWaalsContact C-N 3.35Å; K399-Q401 PolarHBondContact O-N 2.86Å; K399-A402 PolarHBondContact O-N 3.32Å; K399-V403 HydrophobicContact CG-CG2 4.45Å; K399-V403 WeakPolarHBondContact O-CB 3.43Å; K399-V403 WeakPolarHBondContact O-CG2 3.07Å; K399-V403 PolarHBondContact O-N 2.83Å; K399-F473 HydrophobicContact CB-CE1 4.48Å; K399-F473 HydrophobicContact CB-CZ 3.99Å; K399-F473 HydrophobicContact CD-CD1 4.08Å; K399-F473 HydrophobicContact CD-CD2 3.7Å; K399-F473 HydrophobicContact CD-CE1 3.89Å; K399-F473 HydrophobicContact CD-CE2 3.49Å; K399-F473 VanDerWaalsContact CD-CE2 3.49Å; K399-F473 HydrophobicContact CD-CG 3.99Å; K399-F473 HydrophobicContact CD-CZ 3.58Å; K399-F473 HydrophobicContact CG-CD1 4.19Å; K399-F473 HydrophobicContact CG-CD2 4.49Å; K399-F473 HydrophobicContact CG-CE1 3.62Å; K399-F473 HydrophobicContact CG-CE2 3.97Å; K399-F473 HydrophobicContact CG-CZ 3.49Å; K399-F473 VanDerWaalsContact CG-CZ 3.49Å
400T96.9Very high96.2Very high1 Ų167.3 Ų67.31%0.00632%0.318CS..Hα-helixtrans-59.6-46.2178.4-510000110.6T396 K397 V403 K404 F473 E477 E480 I481T396-T400 PolarHBondContact O-N 3.1Å; T396-T400 PolarHBondContact O-OG1 3.25Å; K397-T400 PolarHBondContact O-N 3.19Å; T400-V403 PolarHBondContact O-N 3.12Å; T400-K404 WeakPolarHBondContact O-CB 3.43Å; T400-K404 PolarHBondContact O-N 3.31Å; T400-F473 WeakPolarHBondContact OG1-CZ 3.18Å; T400-E477 HydrophobicContact CG2-CB 4.07Å; T400-E477 HydrophobicContact CG2-CG 4.5Å; T400-E480 HydrophobicContact CG2-CB 3.97Å; T400-E480 VanDerWaalsContact CG2-CD 3.5Å; T400-E480 HydrophobicContact CG2-CG 3.83Å; T400-I481 HydrophobicContact CG2-CG1 3.93Å
401Q96.6Very high96.2Very high132 Ų13269 Ų6962%0.61733%0.329SS*.Hα-helixtrans-63.3-41.7176.7-71.3-176.3-3.500113.1K397 Q398 K399 K405K397-Q401 WeakPolarHBondContact O-CG 3.43Å; K397-Q401 PolarHBondContact O-N 3.26Å; Q398-Q401 PolarHBondContact O-N 2.99Å; K399-Q401 VanDerWaalsContact C-N 3.35Å; K399-Q401 PolarHBondContact O-N 2.86Å; Q401-K405 WeakPolarHBondContact O-CB 3.49Å; Q401-K405 PolarHBondContact O-N 3.49Å
402A97.5Very high96.3Very high29 Ų2975 Ų7524%0.2435%0.354CS..Hα-helixtrans-63.9-49.2177.400000111.9A390 I393 Q398 K399 K405 L406A390-A402 HydrophobicContact CB-CB 4.04Å; I393-A402 HydrophobicContact CD1-CB 3.77Å; Q398-A402 WeakPolarHBondContact O-CB 3.3Å; Q398-A402 PolarHBondContact O-N 2.94Å; K399-A402 PolarHBondContact O-N 3.32Å; A402-K405 PolarHBondContact O-N 2.89Å; A402-L406 WeakPolarHBondContact O-CG 3.3Å; A402-L406 PolarHBondContact O-N 3.46Å
403V97.4Very high96.5Very high3 Ų370.8 Ų70.82%0.01834%0.336CS..Hα-helixtrans-64.2-42178171.60000111.3F387 A390 K399 T400 K405 L406 I407 F473 I474 I481F387-V403 HydrophobicContact CD1-CG1 4.43Å; F387-V403 HydrophobicContact CE1-CG1 4.19Å; A390-V403 HydrophobicContact CB-CG2 3.81Å; K399-V403 HydrophobicContact CG-CG2 4.45Å; K399-V403 WeakPolarHBondContact O-CB 3.43Å; K399-V403 WeakPolarHBondContact O-CG2 3.07Å; K399-V403 PolarHBondContact O-N 2.83Å; T400-V403 PolarHBondContact O-N 3.12Å; V403-K405 PolarHBondContact O-N 3.41Å; V403-L406 PolarHBondContact O-N 3.23Å; V403-I407 HydrophobicContact CG1-CD1 3.95Å; V403-I407 PolarHBondContact O-N 2.78Å; V403-F473 HydrophobicContact CB-CD1 4.4Å; V403-F473 HydrophobicContact CB-CE1 3.99Å; V403-F473 HydrophobicContact CG1-CD1 4.33Å; V403-F473 HydrophobicContact CG1-CE1 4.27Å; V403-F473 HydrophobicContact CG2-CD1 3.95Å; V403-F473 HydrophobicContact CG2-CE1 3.77Å; V403-I474 HydrophobicContact CG1-CD1 4.13Å; V403-I474 HydrophobicContact CG1-CG1 3.62Å; V403-I481 HydrophobicContact CG1-CD1 3.86Å
404K96.9Very high96.6Very high42 Ų4268.9 Ų68.918%0.18333%0.327CS..Hα-helixtrans-58.3-46.8173.8-178168.4-169.4166.50111.7T400 L406 I407 H408 E480 I481 D483T400-K404 WeakPolarHBondContact O-CB 3.43Å; T400-K404 PolarHBondContact O-N 3.31Å; K404-L406 VanDerWaalsContact C-N 3.35Å; K404-L406 PolarHBondContact O-N 3.48Å; K404-I407 PolarHBondContact O-N 3.01Å; K404-H408 PolarHBondContact O-N 2.66Å; K404-H408 PolarHBondContact O-ND1 3.39Å; K404-E480 WeakPolarHBondContact CD-O 3.38Å; K404-E480 WeakPolarHBondContact CE-O 3.24Å; K404-E480 PolarHBondContact NZ-O 2.73Å; K404-I481 WeakPolarHBondContact CE-O 3.35Å; K404-I481 WeakPolarHBondContact CG-O 3.42Å; K404-D483 WeakPolarHBondContact CE-OD2 3.41Å; K404-D483 IonicContact NZ-OD1 3.87Å; K404-D483 PolarHBondContact NZ-OD1 3.25Å; K404-D483 IonicContact NZ-OD2 3.16Å; K404-D483 PolarHBondContact NZ-OD2 3.04Å
405K97Very high96.8Very high140 Ų14060.8 Ų60.861%0.60929%0.292SS*.Hα-helixtrans-59.9-42.4177.4-176.6-179.8178.5-177.60112Q401 A402 V403 H408 Q409Q401-K405 WeakPolarHBondContact O-CB 3.49Å; Q401-K405 PolarHBondContact O-N 3.49Å; A402-K405 PolarHBondContact O-N 2.89Å; V403-K405 PolarHBondContact O-N 3.41Å; K405-H408 PolarHBondContact O-N 2.75Å; K405-Q409 WeakPolarHBondContact O-CG 3.24Å; K405-Q409 PolarHBondContact O-N 3.12Å
406L97.6Very high96.9Very high16 Ų1657.7 Ų57.78%0.08428%0.279CS..Hα-helixtrans-63.7-43.8176-68.3171.9000111.8F383 Q386 F387 A390 A402 V403 K404 H408 Q409 L410F383-L406 HydrophobicContact CD1-CD2 4.27Å; Q386-L406 HydrophobicContact CB-CD1 3.96Å; Q386-L406 HydrophobicContact CB-CD2 3.7Å; Q386-L406 HydrophobicContact CG-CD2 4.49Å; Q386-L406 WeakPolarHBondContact O-CD1 3.14Å; F387-L406 HydrophobicContact CD1-CB 4.31Å; F387-L406 HydrophobicContact CD1-CD1 3.88Å; F387-L406 HydrophobicContact CE1-CB 3.7Å; F387-L406 HydrophobicContact CE1-CD1 4.13Å; F387-L406 HydrophobicContact CE2-CB 4.25Å; F387-L406 HydrophobicContact CG-CD1 4.1Å; F387-L406 HydrophobicContact CZ-CB 3.66Å; A390-L406 HydrophobicContact CB-CD1 3.95Å; A402-L406 WeakPolarHBondContact O-CG 3.3Å; A402-L406 PolarHBondContact O-N 3.46Å; V403-L406 PolarHBondContact O-N 3.23Å; K404-L406 VanDerWaalsContact C-N 3.35Å; K404-L406 PolarHBondContact O-N 3.48Å; L406-H408 VanDerWaalsContact C-N 3.31Å; L406-H408 PolarHBondContact O-N 2.83Å; L406-Q409 WeakPolarHBondContact O-CB 3.29Å; L406-Q409 PolarHBondContact O-N 3.49Å; L406-L410 PolarHBondContact O-N 3.04Å
407I96.9Very high97.1Very high0 Ų054 Ų540%026%0.256CS..Hα-helixtrans-61.6-38.1177.2-76.8166.8000111.9F387 V403 K404 Q409 L410 M418 I474 I481 F482F387-I407 HydrophobicContact CE1-CD1 4.37Å; F387-I407 HydrophobicContact CE1-CG1 3.9Å; F387-I407 HydrophobicContact CZ-CG1 3.87Å; V403-I407 HydrophobicContact CG1-CD1 3.95Å; V403-I407 PolarHBondContact O-N 2.78Å; K404-I407 PolarHBondContact O-N 3.01Å; I407-Q409 PolarHBondContact O-N 3.19Å; I407-L410 HydrophobicContact CG1-CD1 4.37Å; I407-L410 WeakPolarHBondContact O-CB 3.5Å; I407-L410 WeakPolarHBondContact O-CG 3.32Å; I407-L410 PolarHBondContact O-N 3.36Å; I407-M418 HydrophobicContact CG1-SD 4.48Å; I407-I474 HydrophobicContact CD1-CD1 4.09Å; I407-I474 HydrophobicContact CD1-CG1 4.24Å; I407-I474 HydrophobicContact CD1-CG2 4.26Å; I407-I481 HydrophobicContact CD1-CG2 3.39Å; I407-F482 HydrophobicContact CD1-CE1 4.4Å; I407-F482 HydrophobicContact CD1-CZ 4.08Å; I407-F482 HydrophobicContact CG2-CD1 4.15Å; I407-F482 HydrophobicContact CG2-CE1 3.62Å; I407-F482 HydrophobicContact CG2-CZ 4.36Å
408H95.3Very high97.2Very high104 Ų10446.9 Ų46.948%0.48123%0.225SC..Hα-helixtrans-70.3-15.1175.2-75.165.5000114K404 K405 L406K404-H408 PolarHBondContact O-N 2.66Å; K404-H408 PolarHBondContact O-ND1 3.39Å; K405-H408 PolarHBondContact O-N 2.75Å; L406-H408 VanDerWaalsContact C-N 3.31Å; L406-H408 PolarHBondContact O-N 2.83Å
409Q97.1Very high97.3Very high95 Ų9545 Ų4544%0.44422%0.216SC..THydrogen-bonded Turntrans-93.4-4.7175.8-70.1175.2-6.600113.3F383 K405 L406 I407F383-Q409 HydrophobicContact CE1-CB 3.99Å; F383-Q409 HydrophobicContact CZ-CB 4.11Å; F383-Q409 WeakPolarHBondContact CZ-O 3.46Å; K405-Q409 WeakPolarHBondContact O-CG 3.24Å; K405-Q409 PolarHBondContact O-N 3.12Å; L406-Q409 WeakPolarHBondContact O-CB 3.29Å; L406-Q409 PolarHBondContact O-N 3.49Å; I407-Q409 PolarHBondContact O-N 3.19Å
410L96.9Very high97.4Very high13 Ų1345.4 Ų45.47%0.06822%0.219CC..SBendtrans-69.1154.1176.7-62-179.1000111.3P380 F383 F387 L406 I407 N414 H415 M418P380-L410 HydrophobicContact CG-CD2 4.09Å; F383-L410 HydrophobicContact CB-CD2 4.48Å; F383-L410 HydrophobicContact CD1-CD2 4.43Å; F383-L410 HydrophobicContact CD2-CD2 3.45Å; F383-L410 VanDerWaalsContact CD2-CD2 3.45Å; F383-L410 HydrophobicContact CE2-CD2 3.59Å; F383-L410 HydrophobicContact CG-CD2 3.9Å; F383-L410 HydrophobicContact CZ-CD2 4.16Å; F387-L410 HydrophobicContact CE2-CD2 4.44Å; L406-L410 PolarHBondContact O-N 3.04Å; I407-L410 HydrophobicContact CG1-CD1 4.37Å; I407-L410 WeakPolarHBondContact O-CB 3.5Å; I407-L410 WeakPolarHBondContact O-CG 3.32Å; I407-L410 PolarHBondContact O-N 3.36Å; L410-N414 HydrophobicContact CB-CB 4.19Å; L410-H415 HydrophobicContact CB-CB 4.45Å; L410-M418 HydrophobicContact CD1-CE 3.41Å; L410-M418 VanDerWaalsContact CD1-CE 3.41Å; L410-M418 HydrophobicContact CD1-SD 3.5Å; L410-M418 VanDerWaalsContact CD1-SD 3.5Å
411P97.6Very high97.4Very high43 Ų4345.4 Ų45.428%0.27922%0.219SC..  trans-55.3143.4167.5-19.831.6000110.4P413 N414 H415P411-P413 VanDerWaalsContact C-CD 3.5Å; P411-P413 VanDerWaalsContact C-N 3.31Å; P411-N414 WeakPolarHBondContact CB-OD1 3.2Å; P411-N414 WeakPolarHBondContact O-CB 3.16Å; P411-N414 PolarHBondContact O-N 2.98Å; P411-H415 PolarHBondContact O-N 2.94Å
412K97.2Very high97.5Very high136 Ų13639.1 Ų39.159%0.59119%0.189SC*.Hα-helixtrans-51.9-41.3-175.3-169.3177.6-176.1-171.60113.7T305 N414 H415 D416T305-K412 HydrophobicContact CG2-CD 3.88Å; T305-K412 HydrophobicContact CG2-CG 4.07Å; K412-N414 PolarHBondContact O-N 3.04Å; K412-H415 PolarHBondContact O-N 2.89Å; K412-D416 WeakPolarHBondContact CE-OD2 3.37Å; K412-D416 WeakPolarHBondContact CG-OD2 3.37Å; K412-D416 WeakPolarHBondContact O-CB 3.45Å; K412-D416 PolarHBondContact O-N 3.04Å
413P98.1Very high97.5Very high9 Ų939 Ų396%0.05819%0.187CC..Hα-helixtrans-60-42.1174.6-27.738000114.5L295 L296 C299 T305 P411 T417L295-P413 HydrophobicContact CD2-CB 4.3Å; L295-P413 HydrophobicContact CG-CB 4.08Å; L296-P413 HydrophobicContact CD1-CG 3.83Å; C299-P413 HydrophobicContact CB-CB 4.22Å; C299-P413 HydrophobicContact CB-CG 4.16Å; T305-P413 VanDerWaalsContact O-CA 3.31Å; T305-P413 WeakPolarHBondContact O-CA 3.39Å; P411-P413 VanDerWaalsContact C-CD 3.5Å; P411-P413 VanDerWaalsContact C-N 3.31Å; P413-T417 WeakPolarHBondContact O-CB 3.34Å; P413-T417 PolarHBondContact O-N 2.64Å; P413-T417 PolarHBondContact O-OG1 2.89Å
414N98.4Very high97.5Very high12 Ų1238.9 Ų38.96%0.06419%0.186CC..Hα-helixtrans-65.5-46.6176.5-61.173.1000110.9L295 L378 L410 P411 K412 M418L295-N414 HydrophobicContact CD2-CB 4.4Å; L378-N414 HydrophobicContact CD1-CB 4.42Å; L378-N414 PolarHBondContact O-ND2 3.49Å; L410-N414 HydrophobicContact CB-CB 4.19Å; P411-N414 WeakPolarHBondContact CB-OD1 3.2Å; P411-N414 WeakPolarHBondContact O-CB 3.16Å; P411-N414 PolarHBondContact O-N 2.98Å; K412-N414 PolarHBondContact O-N 3.04Å; N414-M418 WeakPolarHBondContact O-CB 3.45Å; N414-M418 VanDerWaalsContact O-CG 3.27Å; N414-M418 WeakPolarHBondContact O-CG 3.29Å; N414-M418 PolarHBondContact O-N 3.48Å
415H97.8Very high97.5Very high38 Ų3836.9 Ų36.918%0.17618%0.178CC..Hα-helixtrans-58.5-53.8177.9170.1-87.3000112.1L410 P411 K412 T417 M418 K419L410-H415 HydrophobicContact CB-CB 4.45Å; P411-H415 PolarHBondContact O-N 2.94Å; K412-H415 PolarHBondContact O-N 2.89Å; H415-T417 PolarHBondContact O-N 3.38Å; H415-M418 PolarHBondContact O-N 2.96Å; H415-K419 WeakPolarHBondContact O-CB 3.2Å; H415-K419 PolarHBondContact O-N 3.04Å
416D97.9Very high97.5Very high30 Ų3032.4 Ų32.416%0.1616%0.159CC..Hα-helixtrans-68.1-38-174.7-68.5-4.7000110.9T305 I306 K412 K419 L420T305-D416 WeakPolarHBondContact CB-OD2 3.24Å; T305-D416 PolarHBondContact OG1-OD2 2.84Å; I306-D416 HydrophobicContact CD1-CB 4.05Å; I306-D416 WeakPolarHBondContact CD1-O 3.47Å; I306-D416 HydrophobicContact CG1-CB 3.73Å; K412-D416 WeakPolarHBondContact CE-OD2 3.37Å; K412-D416 WeakPolarHBondContact CG-OD2 3.37Å; K412-D416 WeakPolarHBondContact O-CB 3.45Å; K412-D416 PolarHBondContact O-N 3.04Å; D416-K419 PolarHBondContact O-N 3.35Å; D416-L420 PolarHBondContact O-N 2.84Å
417T98.4Very high97.5Very high0 Ų036 Ų360%017%0.174CC..Hα-helixtrans-66.7-41.7174.5-59.50000111.9V310 F371 L378 P413 H415 L421V310-T417 HydrophobicContact CG1-CG2 4.36Å; F371-T417 HydrophobicContact CE1-CG2 3.76Å; F371-T417 HydrophobicContact CZ-CG2 4.02Å; L378-T417 HydrophobicContact CD1-CG2 3.87Å; L378-T417 HydrophobicContact CD2-CG2 4.44Å; P413-T417 WeakPolarHBondContact O-CB 3.34Å; P413-T417 PolarHBondContact O-N 2.64Å; P413-T417 PolarHBondContact O-OG1 2.89Å; H415-T417 PolarHBondContact O-N 3.38Å; T417-L421 WeakPolarHBondContact O-CB 3.44Å; T417-L421 PolarHBondContact O-N 2.91Å
418M98Very high97.5Very high0 Ų036 Ų360%017%0.174CC..Hα-helixtrans-60.4-48.2171.7-79.3-171.3-165.800111.3L378 F379 I407 L410 N414 H415 L420 L421 F422 F482L378-M418 HydrophobicContact CD1-CG 4.22Å; L378-M418 HydrophobicContact CD2-CG 3.62Å; L378-M418 HydrophobicContact CG-CE 3.97Å; L378-M418 HydrophobicContact CG-CG 3.73Å; L378-M418 WeakPolarHBondContact O-CE 3.4Å; F379-M418 HydrophobicContact CB-CE 4.14Å; F379-M418 HydrophobicContact CD1-CE 3.51Å; F379-M418 HydrophobicContact CD1-SD 4.4Å; F379-M418 HydrophobicContact CD2-CE 3.56Å; F379-M418 HydrophobicContact CE1-CE 3.64Å; F379-M418 HydrophobicContact CE1-SD 3.95Å; F379-M418 HydrophobicContact CE2-CE 3.7Å; F379-M418 HydrophobicContact CE2-SD 4.21Å; F379-M418 HydrophobicContact CG-CE 3.45Å; F379-M418 VanDerWaalsContact CG-CE 3.45Å; F379-M418 HydrophobicContact CZ-CE 3.73Å; F379-M418 HydrophobicContact CZ-SD 3.83Å; I407-M418 HydrophobicContact CG1-SD 4.48Å; L410-M418 HydrophobicContact CD1-CE 3.41Å; L410-M418 VanDerWaalsContact CD1-CE 3.41Å; L410-M418 HydrophobicContact CD1-SD 3.5Å; L410-M418 VanDerWaalsContact CD1-SD 3.5Å; N414-M418 WeakPolarHBondContact O-CB 3.45Å; N414-M418 VanDerWaalsContact O-CG 3.27Å; N414-M418 WeakPolarHBondContact O-CG 3.29Å; N414-M418 PolarHBondContact O-N 3.48Å; H415-M418 PolarHBondContact O-N 2.96Å; M418-L420 VanDerWaalsContact C-N 3.31Å; M418-L420 PolarHBondContact O-N 3.32Å; M418-L421 PolarHBondContact O-N 3.24Å; M418-F422 HydrophobicContact CB-CD2 4.3Å; M418-F422 WeakPolarHBondContact O-CD2 3.45Å; M418-F422 PolarHBondContact O-N 2.95Å; M418-F482 HydrophobicContact CB-CE1 4.06Å; M418-F482 HydrophobicContact CB-CZ 4Å
419K97.4Very high97.6Very high66 Ų6632 Ų3229%0.28716%0.156SC..Hα-helixtrans-57-45-179179.3162.5177.51600111.3H415 D416 S423 F482 L484H415-K419 WeakPolarHBondContact O-CB 3.2Å; H415-K419 PolarHBondContact O-N 3.04Å; D416-K419 PolarHBondContact O-N 3.35Å; K419-S423 VanDerWaalsContact O-CB 3.24Å; K419-S423 WeakPolarHBondContact O-CB 3.45Å; K419-S423 PolarHBondContact O-N 2.92Å; K419-S423 VanDerWaalsContact O-N 3.08Å; K419-S423 PolarHBondContact O-OG 3.4Å; K419-F482 HydrophobicContact CB-CD1 3.66Å; K419-F482 HydrophobicContact CB-CE1 4.01Å; K419-F482 HydrophobicContact CB-CG 4.27Å; K419-F482 HydrophobicContact CD-CB 4.12Å; K419-F482 HydrophobicContact CD-CD1 4.32Å; K419-F482 WeakPolarHBondContact CE-O 3.27Å; K419-F482 HydrophobicContact CG-CB 4.05Å; K419-F482 HydrophobicContact CG-CD1 4Å; K419-F482 HydrophobicContact CG-CG 4.18Å; K419-F482 PolarHBondContact NZ-O 3.31Å; K419-L484 HydrophobicContact CG-CD2 4.37Å
420L98Very high97.5Very high45 Ų4531.3 Ų31.324%0.23617%0.166CC..Hα-helixtrans-65.8-47.2176.7-172.367.8000112I306 R311 L314 D416 M418 S423 H424I306-L420 HydrophobicContact CD1-CB 3.95Å; I306-L420 HydrophobicContact CD1-CD2 4.01Å; I306-L420 HydrophobicContact CG2-CD2 3.83Å; R311-L420 HydrophobicContact CB-CD2 4.49Å; L314-L420 HydrophobicContact CD1-CD2 3.79Å; L314-L420 HydrophobicContact CD1-CG 3.74Å; D416-L420 PolarHBondContact O-N 2.84Å; M418-L420 VanDerWaalsContact C-N 3.31Å; M418-L420 PolarHBondContact O-N 3.32Å; L420-S423 PolarHBondContact O-N 3.15Å; L420-H424 PolarHBondContact O-N 3.15Å
421L98.4Very high97.6Very high0 Ų034.8 Ų34.80%018%0.181CC..Hα-helixtrans-61.6-49.3-179.4179.562.9000112.4L314 F371 L378 T417 M418 S423 H424 L425 F446 L450L314-L421 HydrophobicContact CD2-CD1 4Å; F371-L421 HydrophobicContact CE2-CD1 4.25Å; F371-L421 HydrophobicContact CE2-CD2 3.93Å; F371-L421 HydrophobicContact CZ-CD2 3.93Å; L378-L421 HydrophobicContact CD2-CD2 4.13Å; T417-L421 WeakPolarHBondContact O-CB 3.44Å; T417-L421 PolarHBondContact O-N 2.91Å; M418-L421 PolarHBondContact O-N 3.24Å; L421-S423 VanDerWaalsContact C-N 3.34Å; L421-S423 PolarHBondContact O-N 3.31Å; L421-H424 WeakPolarHBondContact O-CB 3.39Å; L421-H424 PolarHBondContact O-N 2.94Å; L421-L425 HydrophobicContact CD1-CD1 4.2Å; L421-L425 HydrophobicContact CD1-CG 4.31Å; L421-L425 HydrophobicContact CG-CD1 4.06Å; L421-L425 VanDerWaalsContact O-CG 3.31Å; L421-L425 WeakPolarHBondContact O-CG 3.25Å; L421-L425 PolarHBondContact O-N 2.83Å; L421-F446 HydrophobicContact CD1-CE1 4.03Å; L421-F446 HydrophobicContact CD1-CZ 4.34Å; L421-F446 HydrophobicContact CD2-CD1 4.31Å; L421-F446 HydrophobicContact CD2-CE1 4.2Å; L421-L450 HydrophobicContact CD2-CD1 3.75Å; L421-L450 HydrophobicContact CD2-CD2 3.79Å; L421-L450 HydrophobicContact CD2-CG 4.41Å
422F97.8Very high97.5Very high0 Ų035 Ų350%018%0.183CC..Hα-helixtrans-68.5-32.1179.4-79.7-80.3000112.4F379 M418 L425 Q426 L450 V471 I474 L475 F482F379-F422 HydrophobicContact CE2-CE2 4.31Å; F379-F422 HydrophobicContact CE2-CZ 4.47Å; F379-F422 HydrophobicContact CZ-CE2 4.05Å; F379-F422 HydrophobicContact CZ-CZ 4.18Å; M418-F422 HydrophobicContact CB-CD2 4.3Å; M418-F422 WeakPolarHBondContact O-CD2 3.45Å; M418-F422 PolarHBondContact O-N 2.95Å; F422-L425 PolarHBondContact O-N 3.15Å; F422-Q426 PolarHBondContact O-N 3.48Å; F422-L450 HydrophobicContact CE2-CD1 4.46Å; F422-L450 HydrophobicContact CZ-CD1 4.38Å; F422-V471 HydrophobicContact CE1-CG1 4.02Å; F422-V471 HydrophobicContact CZ-CG1 4.28Å; F422-I474 HydrophobicContact CD1-CB 4.38Å; F422-I474 HydrophobicContact CD1-CG2 3.73Å; F422-I474 HydrophobicContact CD2-CG2 3.88Å; F422-I474 HydrophobicContact CE1-CB 3.88Å; F422-I474 HydrophobicContact CE1-CG2 3.6Å; F422-I474 HydrophobicContact CE2-CG2 3.77Å; F422-I474 HydrophobicContact CG-CG2 3.87Å; F422-I474 HydrophobicContact CZ-CB 3.99Å; F422-I474 HydrophobicContact CZ-CG2 3.63Å; F422-L475 HydrophobicContact CD1-CB 4.11Å; F422-L475 HydrophobicContact CD1-CD1 4.07Å; F422-L475 HydrophobicContact CE1-CB 4.19Å; F422-F482 HydrophobicContact CB-CD2 4.36Å; F422-F482 HydrophobicContact CB-CE2 3.69Å; F422-F482 HydrophobicContact CB-CZ 4.34Å; F422-F482 HydrophobicContact CD2-CE2 4.02Å; F422-F482 AromaticContact CD2-CZ 3.96Å; F422-F482 HydrophobicContact CD2-CZ 3.96Å; F422-F482 AromaticContact CG-CE2 3.98Å; F422-F482 HydrophobicContact CG-CE2 3.98Å; F422-F482 HydrophobicContact CG-CZ 4.39Å
423S96.8Very high97.5Very high27 Ų2739.9 Ų39.919%0.18920%0.198CC..Hα-helixtrans-64.2-38.9171.3-59.80000112.2K419 L420 L421 K427 L484K419-S423 VanDerWaalsContact O-CB 3.24Å; K419-S423 WeakPolarHBondContact O-CB 3.45Å; K419-S423 PolarHBondContact O-N 2.92Å; K419-S423 VanDerWaalsContact O-N 3.08Å; K419-S423 PolarHBondContact O-OG 3.4Å; L420-S423 PolarHBondContact O-N 3.15Å; L421-S423 VanDerWaalsContact C-N 3.34Å; L421-S423 PolarHBondContact O-N 3.31Å; S423-K427 PolarHBondContact O-N 2.92Å; S423-L484 WeakPolarHBondContact OG-CD1 3.18Å; S423-L484 WeakPolarHBondContact OG-CD2 3.4Å
424H97.9Very high97.5Very high1 Ų145.1 Ų45.11%0.00522%0.22CC..Hα-helixtrans-66.1-48173.517384.4000111.9L314 E318 Y328 L420 L421 Q426 K427 V428L314-H424 HydrophobicContact CD1-CB 4.49Å; L314-H424 HydrophobicContact CD2-CB 3.81Å; L314-H424 VanDerWaalsContact CD2-CD2 3.46Å; L314-H424 WeakPolarHBondContact CD2-CD2 3.46Å; L314-H424 VanDerWaalsContact CD2-CG 3.46Å; L314-H424 PolarHBondContact O-CE1 3.48Å; E318-H424 WeakPolarHBondContact CG-ND1 3.43Å; E318-H424 IonicContact OE1-CG 2.94Å; E318-H424 IonicContact OE1-ND1 2.67Å; E318-H424 PolarHBondContact OE1-ND1 2.79Å; Y328-H424 AromaticContact CE2-CD2 3.99Å; Y328-H424 AromaticContact CE2-NE2 3.43Å; Y328-H424 WeakPolarHBondContact CE2-NE2 3.49Å; Y328-H424 AromaticContact CZ-CD2 3.99Å; Y328-H424 AromaticContact CZ-NE2 3.52Å; Y328-H424 PolarHBondContact OH-CD2 3.14Å; Y328-H424 VanDerWaalsContact OH-CD2 3.29Å; Y328-H424 PolarHBondContact OH-NE2 2.82Å; L420-H424 PolarHBondContact O-N 3.15Å; L421-H424 WeakPolarHBondContact O-CB 3.39Å; L421-H424 PolarHBondContact O-N 2.94Å; H424-Q426 PolarHBondContact O-N 3.1Å; H424-K427 WeakPolarHBondContact O-CA 3.43Å; H424-K427 WeakPolarHBondContact O-CB 3.33Å; H424-K427 PolarHBondContact O-N 2.95Å; H424-V428 PolarHBondContact O-N 3.27Å
425L97.9Very high97.5Very high0 Ų044.5 Ų44.50%022%0.217CC..Hα-helixtrans-62.5-28.9-179.7-66.7173.4000112.2Y328 L421 F422 V428 L429 I442 F446 L475Y328-L425 HydrophobicContact CD2-CD2 4.23Å; Y328-L425 HydrophobicContact CE2-CD2 4.12Å; L421-L425 HydrophobicContact CD1-CD1 4.2Å; L421-L425 HydrophobicContact CD1-CG 4.31Å; L421-L425 HydrophobicContact CG-CD1 4.06Å; L421-L425 VanDerWaalsContact O-CG 3.31Å; L421-L425 WeakPolarHBondContact O-CG 3.25Å; L421-L425 PolarHBondContact O-N 2.83Å; F422-L425 PolarHBondContact O-N 3.15Å; L425-V428 WeakPolarHBondContact O-CB 3.18Å; L425-V428 PolarHBondContact O-N 3.01Å; L425-L429 WeakPolarHBondContact O-CG 3.47Å; L425-L429 PolarHBondContact O-N 2.88Å; L425-I442 HydrophobicContact CD1-CG2 3.97Å; L425-I442 HydrophobicContact CD2-CD1 4.3Å; L425-I442 HydrophobicContact CD2-CG2 4.07Å; L425-I442 HydrophobicContact CG-CG2 4.41Å; L425-F446 HydrophobicContact CD1-CD2 4.13Å; L425-F446 HydrophobicContact CD1-CE2 4.17Å; L425-F446 HydrophobicContact CD1-CG 4.3Å; L425-F446 HydrophobicContact CD1-CZ 4.4Å; L425-F446 HydrophobicContact CD2-CD2 4.23Å; L425-F446 HydrophobicContact CD2-CE2 3.61Å; L425-F446 HydrophobicContact CD2-CZ 3.99Å; L425-L475 HydrophobicContact CB-CD1 3.64Å
426Q96.3Very high97.5Very high46 Ų4647.4 Ų47.422%0.21523%0.233CC..Hα-helixtrans-61.6-42168.1-85.9-67.2-51.700113.1F422 H424 L429 A430 L475 S478F422-Q426 PolarHBondContact O-N 3.48Å; H424-Q426 PolarHBondContact O-N 3.1Å; Q426-L429 PolarHBondContact O-N 2.84Å; Q426-A430 PolarHBondContact O-N 3.01Å; Q426-L475 HydrophobicContact CG-CD1 4.15Å; Q426-L475 PolarHBondContact NE2-O 3.3Å; Q426-S478 WeakPolarHBondContact CG-OG 3.31Å
427K96.5Very high97.5Very high90 Ų9046.2 Ų46.239%0.39123%0.227SC..Hα-helixtrans-65-40174.7-61.3167.5-173.2168.80111.2E318 L322 S423 H424 L429 A430 F431E318-K427 VanDerWaalsContact CD-CD 3.42Å; E318-K427 HydrophobicContact CG-CD 4.18Å; E318-K427 VanDerWaalsContact OE1-CD 3.28Å; E318-K427 WeakPolarHBondContact OE1-CD 3.12Å; E318-K427 IonicContact OE1-NZ 2.72Å; E318-K427 PolarHBondContact OE1-NZ 3.37Å; E318-K427 WeakPolarHBondContact OE2-CD 3.39Å; E318-K427 IonicContact OE2-NZ 2.8Å; E318-K427 PolarHBondContact OE2-NZ 2.98Å; L322-K427 HydrophobicContact CD2-CB 4.49Å; S423-K427 PolarHBondContact O-N 2.92Å; H424-K427 WeakPolarHBondContact O-CA 3.43Å; H424-K427 WeakPolarHBondContact O-CB 3.33Å; H424-K427 PolarHBondContact O-N 2.95Å; K427-L429 VanDerWaalsContact C-N 3.35Å; K427-L429 PolarHBondContact O-N 2.87Å; K427-A430 WeakPolarHBondContact O-CB 3.2Å; K427-A430 PolarHBondContact O-N 3.3Å; K427-F431 WeakPolarHBondContact O-CD2 3.39Å; K427-F431 PolarHBondContact O-N 3.43Å
428V97.8Very high97.4Very high0 Ų048.7 Ų48.70%024%0.244CC..Hα-helixtrans-58-46173.2175.80000111.2L322 I327 Y328 H424 L425 A430 F431 S432 N435 I442L322-V428 HydrophobicContact CD2-CG2 3.91Å; I327-V428 HydrophobicContact CG2-CG1 3.57Å; Y328-V428 HydrophobicContact CD2-CG2 4.49Å; Y328-V428 HydrophobicContact CE2-CG2 4.01Å; H424-V428 PolarHBondContact O-N 3.27Å; L425-V428 WeakPolarHBondContact O-CB 3.18Å; L425-V428 PolarHBondContact O-N 3.01Å; V428-A430 VanDerWaalsContact C-N 3.32Å; V428-A430 PolarHBondContact O-N 3.46Å; V428-F431 CarbonylContact O-C 3.5Å; V428-F431 PolarHBondContact O-N 3.46Å; V428-F431 VanDerWaalsContact O-N 3.08Å; V428-S432 PolarHBondContact O-N 2.77Å; V428-N435 PolarHBondContact O-ND2 2.75Å; V428-I442 HydrophobicContact CG1-CD1 4.32Å
429L96.8Very high97.4Very high22 Ų2250.4 Ų50.412%0.11526%0.255CS..Hα-helixtrans-67.4-28.6177.3-71-175.2000113.7L425 Q426 K427 F431 S432 T439 I442 L475L425-L429 WeakPolarHBondContact O-CG 3.47Å; L425-L429 PolarHBondContact O-N 2.88Å; Q426-L429 PolarHBondContact O-N 2.84Å; K427-L429 VanDerWaalsContact C-N 3.35Å; K427-L429 PolarHBondContact O-N 2.87Å; L429-F431 PolarHBondContact O-N 2.91Å; L429-S432 WeakPolarHBondContact O-CB 3.3Å; L429-S432 PolarHBondContact O-N 2.79Å; L429-S432 PolarHBondContact O-OG 3.08Å; L429-T439 HydrophobicContact CD1-CG2 4.4Å; L429-I442 HydrophobicContact CD2-CG1 4.01Å; L429-L475 HydrophobicContact CD1-CD1 4.26Å; L429-L475 HydrophobicContact CD1-CD2 3.56Å; L429-L475 HydrophobicContact CD1-CG 3.72Å; L429-L475 HydrophobicContact CG-CD2 4.34Å
430A96.6Very high97.4Very high80 Ų8052.3 Ų52.366%0.66127%0.265SS*.Hα-helixtrans-62.1-25.8171.500000112.4Q426 K427 V428Q426-A430 PolarHBondContact O-N 3.01Å; K427-A430 WeakPolarHBondContact O-CB 3.2Å; K427-A430 PolarHBondContact O-N 3.3Å; V428-A430 VanDerWaalsContact C-N 3.32Å; V428-A430 PolarHBondContact O-N 3.46Å
431F97.3Very high97.4Very high85 Ų8550.9 Ų50.937%0.37326%0.261SS..THydrogen-bonded Turntrans-96.610.1175.1-76.7-110.7000113.8L322 K427 V428 L429 R433 K434 N435L322-F431 HydrophobicContact CB-CB 4.36Å; L322-F431 HydrophobicContact CB-CD1 3.98Å; L322-F431 HydrophobicContact CB-CD2 4.16Å; L322-F431 HydrophobicContact CB-CE1 4.29Å; L322-F431 HydrophobicContact CB-CE2 4.46Å; L322-F431 HydrophobicContact CB-CG 3.92Å; L322-F431 HydrophobicContact CD1-CD2 4.2Å; L322-F431 HydrophobicContact CD1-CE2 3.93Å; L322-F431 HydrophobicContact CD1-CZ 4.26Å; L322-F431 WeakPolarHBondContact O-CB 3.49Å; K427-F431 WeakPolarHBondContact O-CD2 3.39Å; K427-F431 PolarHBondContact O-N 3.43Å; V428-F431 CarbonylContact O-C 3.5Å; V428-F431 PolarHBondContact O-N 3.46Å; V428-F431 VanDerWaalsContact O-N 3.08Å; L429-F431 PolarHBondContact O-N 2.91Å; F431-R433 PolarHBondContact O-N 3.27Å; F431-K434 PolarHBondContact O-N 2.91Å; F431-N435 WeakPolarHBondContact CB-ND2 3.37Å; F431-N435 PolarHBondContact O-N 2.88Å; F431-N435 VanDerWaalsContact O-N 3.08Å; F431-N435 PolarHBondContact O-ND2 2.87Å
432S96.8Very high97.3Very high47 Ų4750.9 Ų50.933%0.32926%0.261SS..Hα-helixtrans-46.8-33.5-178.948.80000115.6V428 L429 K434 N435 L436 M437V428-S432 PolarHBondContact O-N 2.77Å; L429-S432 WeakPolarHBondContact O-CB 3.3Å; L429-S432 PolarHBondContact O-N 2.79Å; L429-S432 PolarHBondContact O-OG 3.08Å; S432-K434 VanDerWaalsContact C-N 3.29Å; S432-K434 PolarHBondContact O-N 3.18Å; S432-N435 WeakPolarHBondContact CA-OD1 3.31Å; S432-L436 WeakPolarHBondContact O-CA 3.3Å; S432-L436 PolarHBondContact O-N 3.16Å; S432-L436 VanDerWaalsContact O-N 3.08Å; S432-M437 WeakPolarHBondContact CB-O 3.46Å
433R97.2Very high97.3Very high239 Ų23950.9 Ų50.990%0.90226%0.261SS*.Hα-helixtrans-67.2-24.6176.8-65.2-173.9-178.6-1741114.3F431F431-R433 PolarHBondContact O-N 3.27Å
434K97.3Very high97.3Very high119 Ų11954.5 Ų54.552%0.51728%0.277SS..Hα-helixtrans-95.8-60.2175-70.1-169.3174.5-170.20110.5D323 F431 S432 L436D323-K434 HydrophobicContact CB-CB 4.02Å; D323-K434 HydrophobicContact CB-CD 3.6Å; D323-K434 IonicContact OD2-NZ 3.47Å; F431-K434 PolarHBondContact O-N 2.91Å; S432-K434 VanDerWaalsContact C-N 3.29Å; S432-K434 PolarHBondContact O-N 3.18Å; K434-L436 WeakPolarHBondContact O-CG 3.42Å; K434-L436 PolarHBondContact O-N 2.73Å; K434-L436 VanDerWaalsContact O-N 3.15Å
435N97.9Very high97.3Very high0 Ų055.7 Ų55.70%028%0.284CS..Hα-helixtrans-75.1-1.6-172.765.737.6000115.1L322 A324 G326 I327 V428 F431 S432 M437L322-N435 WeakPolarHBondContact O-CB 3.18Å; L322-N435 PolarHBondContact O-ND2 3.19Å; A324-N435 VanDerWaalsContact O-CB 3.25Å; A324-N435 WeakPolarHBondContact O-CB 3.39Å; G326-N435 WeakPolarHBondContact CA-O 3.43Å; G326-N435 PolarHBondContact N-O 3.48Å; I327-N435 HydrophobicContact CG2-CB 3.91Å; V428-N435 PolarHBondContact O-ND2 2.75Å; F431-N435 WeakPolarHBondContact CB-ND2 3.37Å; F431-N435 PolarHBondContact O-N 2.88Å; F431-N435 VanDerWaalsContact O-N 3.08Å; F431-N435 PolarHBondContact O-ND2 2.87Å; S432-N435 WeakPolarHBondContact CA-OD1 3.31Å; N435-M437 PolarHBondContact O-N 2.95Å; N435-M437 VanDerWaalsContact O-N 3.14Å; N435-M437 WeakPolarHBondContact OD1-CB 3.42Å; N435-M437 PolarHBondContact OD1-N 2.86Å
436L97.8Very high97.4Very high99 Ų9955.7 Ų55.752%0.51828%0.284SS..  trans56.830.4176.4-45.6-179000114.1R329 S432 K434R329-L436 PolarHBondContact NH1-O 2.99Å; S432-L436 WeakPolarHBondContact O-CA 3.3Å; S432-L436 PolarHBondContact O-N 3.16Å; S432-L436 VanDerWaalsContact O-N 3.08Å; K434-L436 WeakPolarHBondContact O-CG 3.42Å; K434-L436 PolarHBondContact O-N 2.73Å; K434-L436 VanDerWaalsContact O-N 3.15Å
437M98.1Very high97.4Very high4 Ų453.5 Ų53.52%0.0227%0.274CS..  trans-104.2132.7174.6-67.6-59.7-70.400111.9I327 R329 S432 N435 I442I327-M437 HydrophobicContact CG2-CG 4.01Å; I327-M437 WeakPolarHBondContact O-CE 3.35Å; I327-M437 WeakPolarHBondContact O-CG 3.4Å; R329-M437 HydrophobicContact CB-CE 3.82Å; R329-M437 HydrophobicContact CB-SD 3.62Å; R329-M437 PolarHBondContact NH1-SD 2.88Å; R329-M437 VanDerWaalsContact NH1-SD 3.38Å; S432-M437 WeakPolarHBondContact CB-O 3.46Å; N435-M437 PolarHBondContact O-N 2.95Å; N435-M437 VanDerWaalsContact O-N 3.14Å; N435-M437 WeakPolarHBondContact OD1-CB 3.42Å; N435-M437 PolarHBondContact OD1-N 2.86Å; M437-I442 HydrophobicContact CB-CD1 4.35Å; M437-I442 HydrophobicContact CE-CD1 3.45Å; M437-I442 VanDerWaalsContact CE-CD1 3.45Å; M437-I442 HydrophobicContact CE-CG1 4Å
438S97.7Very high97.4Very high52 Ų5251.7 Ų51.736%0.36427%0.271SS..  trans-107.9166.417277.60000111.3Q440 G441 I442S438-Q440 VanDerWaalsContact C-N 3.27Å; S438-Q440 PolarHBondContact O-N 3.37Å; S438-Q440 PolarHBondContact OG-N 3.29Å; S438-Q440 PolarHBondContact OG-OE1 3.45Å; S438-G441 WeakPolarHBondContact O-CA 3.43Å; S438-G441 PolarHBondContact O-N 3.18Å; S438-G441 PolarHBondContact OG-N 3.41Å; S438-G441 VanDerWaalsContact OG-N 3.12Å; S438-I442 PolarHBondContact O-N 2.82Å
439T97.4Very high97.4Very high37 Ų3752.3 Ų52.323%0.22728%0.275CS..Hα-helixtrans-53.5-44.2173.5-45.40000111.7L429 I442 G443 E472 L475 I476L429-T439 HydrophobicContact CD1-CG2 4.4Å; T439-I442 PolarHBondContact O-N 2.77Å; T439-G443 PolarHBondContact O-N 2.85Å; T439-E472 HydrophobicContact CG2-CB 4.23Å; T439-E472 HydrophobicContact CG2-CG 4.26Å; T439-L475 HydrophobicContact CG2-CB 4.41Å; T439-L475 HydrophobicContact CG2-CD2 4.1Å; T439-L475 HydrophobicContact CG2-CG 4.38Å; T439-I476 HydrophobicContact CG2-CD1 4.18Å; T439-I476 HydrophobicContact CG2-CG1 3.85Å
440Q97.1Very high97.4Very high106 Ų10651.2 Ų51.250%0.49527%0.269SS..Hα-helixtrans-66.6-38.5176.5-50.692.6-12.500112S438 I442 G443 I444S438-Q440 VanDerWaalsContact C-N 3.27Å; S438-Q440 PolarHBondContact O-N 3.37Å; S438-Q440 PolarHBondContact OG-N 3.29Å; S438-Q440 PolarHBondContact OG-OE1 3.45Å; Q440-I442 VanDerWaalsContact C-N 3.32Å; Q440-I442 PolarHBondContact O-N 2.97Å; Q440-G443 PolarHBondContact O-N 2.86Å; Q440-I444 VanDerWaalsContact O-CG1 3.3Å; Q440-I444 WeakPolarHBondContact O-CG1 3.24Å; Q440-I444 PolarHBondContact O-N 3.21Å
441G97.3Very high97.3Very high15 Ų1547.5 Ų47.516%0.15524%0.238CC..Hα-helixtrans-61.2-40.2175.700000112.7S438 V445S438-G441 WeakPolarHBondContact O-CA 3.43Å; S438-G441 PolarHBondContact O-N 3.18Å; S438-G441 PolarHBondContact OG-N 3.41Å; S438-G441 VanDerWaalsContact OG-N 3.12Å; G441-V445 WeakPolarHBondContact O-CG2 3.32Å; G441-V445 PolarHBondContact O-N 2.82Å
442I98.1Very high96.9Very high0 Ų046.3 Ų46.30%023%0.231CC..Hα-helixtrans-69.2-41.6172.4-63.2-67.2000110.7L425 V428 L429 M437 S438 T439 Q440 I444 V445 F446 L475L425-I442 HydrophobicContact CD1-CG2 3.97Å; L425-I442 HydrophobicContact CD2-CD1 4.3Å; L425-I442 HydrophobicContact CD2-CG2 4.07Å; L425-I442 HydrophobicContact CG-CG2 4.41Å; V428-I442 HydrophobicContact CG1-CD1 4.32Å; L429-I442 HydrophobicContact CD2-CG1 4.01Å; M437-I442 HydrophobicContact CB-CD1 4.35Å; M437-I442 HydrophobicContact CE-CD1 3.45Å; M437-I442 VanDerWaalsContact CE-CD1 3.45Å; M437-I442 HydrophobicContact CE-CG1 4Å; S438-I442 PolarHBondContact O-N 2.82Å; T439-I442 PolarHBondContact O-N 2.77Å; Q440-I442 VanDerWaalsContact C-N 3.32Å; Q440-I442 PolarHBondContact O-N 2.97Å; I442-I444 PolarHBondContact O-N 2.86Å; I442-V445 PolarHBondContact O-N 3.45Å; I442-F446 HydrophobicContact CG2-CD2 3.89Å; I442-F446 WeakPolarHBondContact O-CB 3.48Å; I442-F446 PolarHBondContact O-N 3.43Å; I442-L475 HydrophobicContact CB-CD2 3.97Å; I442-L475 HydrophobicContact CG2-CD2 3.57Å
443G97.5Very high96Very high0 Ų046.2 Ų46.20%023%0.23CC..Hα-helixtrans-56-47.4175.800000113.5T439 Q440 V445 G447 N468T439-G443 PolarHBondContact O-N 2.85Å; Q440-G443 PolarHBondContact O-N 2.86Å; G443-V445 VanDerWaalsContact C-N 3.32Å; G443-V445 PolarHBondContact O-N 2.87Å; G443-G447 WeakPolarHBondContact O-CA 3.28Å; G443-G447 PolarHBondContact O-N 2.94Å; G443-N468 PolarHBondContact O-OD1 3.45Å
444I97Very high95.2Very high103 Ų10341.4 Ų41.453%0.52822%0.218SC..Hα-helixtrans-63.8-34.5177.8-68.1162.7000112.3Q440 I442 P448Q440-I444 VanDerWaalsContact O-CG1 3.3Å; Q440-I444 WeakPolarHBondContact O-CG1 3.24Å; Q440-I444 PolarHBondContact O-N 3.21Å; I442-I444 PolarHBondContact O-N 2.86Å; I444-P448 VanDerWaalsContact O-CD 3.3Å; I444-P448 WeakPolarHBondContact O-CD 3.23Å
445V98Very high94Very high25 Ų2542.1 Ų42.115%0.15223%0.226CC..Hα-helixtrans-77.1-47.4178.41720000111.3Y328 R329 K368 G441 I442 G443 T449Y328-V445 WeakPolarHBondContact O-CG1 3.46Å; R329-V445 HydrophobicContact CB-CG2 4.39Å; K368-V445 HydrophobicContact CD-CG1 3.66Å; G441-V445 WeakPolarHBondContact O-CG2 3.32Å; G441-V445 PolarHBondContact O-N 2.82Å; I442-V445 PolarHBondContact O-N 3.45Å; G443-V445 VanDerWaalsContact C-N 3.32Å; G443-V445 PolarHBondContact O-N 2.87Å; V445-T449 WeakPolarHBondContact O-CB 3.25Å; V445-T449 PolarHBondContact O-OG1 2.94Å
446F98.4Very high92.4Very high0 Ų047.8 Ų47.80%026%0.256CS..Hα-helixtrans-90-22.7-171.4-81.9-85000114.4Y328 K368 L421 L425 I442 T449 L450 V471Y328-F446 AromaticContact CD1-CE2 3.65Å; Y328-F446 HydrophobicContact CD1-CE2 3.65Å; Y328-F446 AromaticContact CD1-CZ 3.46Å; Y328-F446 HydrophobicContact CD1-CZ 3.46Å; Y328-F446 VanDerWaalsContact CD1-CZ 3.46Å; Y328-F446 HydrophobicContact CD2-CE2 4.38Å; Y328-F446 HydrophobicContact CE1-CE2 4.25Å; Y328-F446 AromaticContact CE1-CZ 3.69Å; Y328-F446 HydrophobicContact CE1-CZ 3.69Å; Y328-F446 AromaticContact CG-CE2 3.73Å; Y328-F446 HydrophobicContact CG-CE2 3.73Å; Y328-F446 HydrophobicContact CG-CZ 4.02Å; K368-F446 HydrophobicContact CG-CZ 4.5Å; L421-F446 HydrophobicContact CD1-CE1 4.03Å; L421-F446 HydrophobicContact CD1-CZ 4.34Å; L421-F446 HydrophobicContact CD2-CD1 4.31Å; L421-F446 HydrophobicContact CD2-CE1 4.2Å; L425-F446 HydrophobicContact CD1-CD2 4.13Å; L425-F446 HydrophobicContact CD1-CE2 4.17Å; L425-F446 HydrophobicContact CD1-CG 4.3Å; L425-F446 HydrophobicContact CD1-CZ 4.4Å; L425-F446 HydrophobicContact CD2-CD2 4.23Å; L425-F446 HydrophobicContact CD2-CE2 3.61Å; L425-F446 HydrophobicContact CD2-CZ 3.99Å; I442-F446 HydrophobicContact CG2-CD2 3.89Å; I442-F446 WeakPolarHBondContact O-CB 3.48Å; I442-F446 PolarHBondContact O-N 3.43Å; F446-T449 HydrophobicContact CD1-CG2 4.44Å; F446-T449 PolarHBondContact O-N 2.95Å; F446-T449 VanDerWaalsContact O-N 3.15Å; F446-L450 HydrophobicContact CB-CD1 4.05Å; F446-L450 HydrophobicContact CB-CG 4.28Å; F446-L450 HydrophobicContact CD1-CD1 3.94Å; F446-L450 HydrophobicContact CD1-CD2 4.13Å; F446-L450 HydrophobicContact CD1-CG 3.94Å; F446-L450 HydrophobicContact CG-CD1 4.43Å; F446-L450 WeakPolarHBondContact O-CB 3.46Å; F446-L450 VanDerWaalsContact O-CG 3.3Å; F446-L450 WeakPolarHBondContact O-CG 3.48Å; F446-L450 PolarHBondContact O-N 3.25Å; F446-V471 HydrophobicContact CB-CG1 3.97Å
447G97.3Very high90.5Very high0 Ų047.6 Ų47.60%027%0.27CS..Hα-helixtrans-48.5-64.9173.200000112.6G443 T449 L450 M451G443-G447 WeakPolarHBondContact O-CA 3.28Å; G443-G447 PolarHBondContact O-N 2.94Å; G447-T449 VanDerWaalsContact C-N 3.26Å; G447-T449 PolarHBondContact O-N 3.39Å; G447-L450 PolarHBondContact O-N 3.28Å; G447-M451 PolarHBondContact O-N 2.96Å; G447-M451 VanDerWaalsContact O-N 3.07Å
448P95.7Very high88.9Confident52 Ų5249.5 Ų49.534%0.33829%0.29SS..Hα-helixtrans-73.7-11.5177.630.5-36.6000114.2I444 M451I444-P448 VanDerWaalsContact O-CD 3.3Å; I444-P448 WeakPolarHBondContact O-CD 3.23Å; P448-M451 CarbonylContact C-O 3.56Å; P448-M451 WeakPolarHBondContact CA-O 3.45Å
449T97.4Very high87.7Confident13 Ų1352.2 Ų52.28%0.0830%0.3CS..Hα-helixtrans-85.5-28.6177.1-610000112.1K368 F371 V445 F446 G447K368-T449 HydrophobicContact CB-CG2 4.21Å; K368-T449 HydrophobicContact CG-CG2 4.42Å; F371-T449 HydrophobicContact CB-CG2 3.88Å; V445-T449 WeakPolarHBondContact O-CB 3.25Å; V445-T449 PolarHBondContact O-OG1 2.94Å; F446-T449 HydrophobicContact CD1-CG2 4.44Å; F446-T449 PolarHBondContact O-N 2.95Å; F446-T449 VanDerWaalsContact O-N 3.15Å; G447-T449 VanDerWaalsContact C-N 3.26Å; G447-T449 PolarHBondContact O-N 3.39Å
450L97.9Very high86.6Confident0 Ų055.2 Ų55.20%031%0.313CS..Hα-helixtrans-107.1-14.2-177-56.2-179.7000113.2F371 P377 L378 F379 L421 F422 F446 G447F371-L450 HydrophobicContact CB-CD2 4.04Å; F371-L450 HydrophobicContact CD1-CD2 4Å; F371-L450 HydrophobicContact CD2-CD2 4.09Å; F371-L450 HydrophobicContact CG-CD2 3.78Å; P377-L450 VanDerWaalsContact CB-O 3.23Å; P377-L450 WeakPolarHBondContact CB-O 2.94Å; L378-L450 HydrophobicContact CB-CD2 4.21Å; L378-L450 HydrophobicContact CD2-CD2 3.88Å; L378-L450 PolarHBondContact N-O 3.39Å; F379-L450 HydrophobicContact CD2-CB 3.79Å; F379-L450 WeakPolarHBondContact CD2-O 3.38Å; F379-L450 HydrophobicContact CE2-CB 3.9Å; F379-L450 HydrophobicContact CE2-CD1 4.12Å; F379-L450 PolarHBondContact N-O 2.93Å; L421-L450 HydrophobicContact CD2-CD1 3.75Å; L421-L450 HydrophobicContact CD2-CD2 3.79Å; L421-L450 HydrophobicContact CD2-CG 4.41Å; F422-L450 HydrophobicContact CE2-CD1 4.46Å; F422-L450 HydrophobicContact CZ-CD1 4.38Å; F446-L450 HydrophobicContact CB-CD1 4.05Å; F446-L450 HydrophobicContact CB-CG 4.28Å; F446-L450 HydrophobicContact CD1-CD1 3.94Å; F446-L450 HydrophobicContact CD1-CD2 4.13Å; F446-L450 HydrophobicContact CD1-CG 3.94Å; F446-L450 HydrophobicContact CG-CD1 4.43Å; F446-L450 WeakPolarHBondContact O-CB 3.46Å; F446-L450 VanDerWaalsContact O-CG 3.3Å; F446-L450 WeakPolarHBondContact O-CG 3.48Å; F446-L450 PolarHBondContact O-N 3.25Å; G447-L450 PolarHBondContact O-N 3.28Å
451M94.4Very high85.5Confident2 Ų253.2 Ų53.21%0.0131%0.314CS..  trans-140.5136.1178.8-74.1168.2-77.200110.8F379 F384 G447 P448 Q467 I470 V471F379-M451 HydrophobicContact CB-CG 3.49Å; F379-M451 VanDerWaalsContact CB-CG 3.49Å; F379-M451 HydrophobicContact CB-SD 4.33Å; F379-M451 HydrophobicContact CD1-CG 4.48Å; F379-M451 HydrophobicContact CD1-SD 4.32Å; F379-M451 HydrophobicContact CD2-CE 4.32Å; F379-M451 HydrophobicContact CD2-CG 3.78Å; F379-M451 HydrophobicContact CD2-SD 4.3Å; F379-M451 HydrophobicContact CE2-CE 4.36Å; F379-M451 HydrophobicContact CG-CG 3.67Å; F379-M451 HydrophobicContact CG-SD 4.06Å; F384-M451 HydrophobicContact CD2-CB 4.34Å; F384-M451 HydrophobicContact CD2-CG 4.23Å; F384-M451 HydrophobicContact CD2-SD 4.07Å; F384-M451 HydrophobicContact CE2-CB 4.32Å; F384-M451 HydrophobicContact CE2-SD 4.09Å; G447-M451 PolarHBondContact O-N 2.96Å; G447-M451 VanDerWaalsContact O-N 3.07Å; P448-M451 CarbonylContact C-O 3.56Å; P448-M451 WeakPolarHBondContact CA-O 3.45Å; M451-Q467 HydrophobicContact CB-CG 3.79Å; M451-Q467 HydrophobicContact CE-CB 4.14Å; M451-Q467 HydrophobicContact CE-CG 4.47Å; M451-Q467 VanDerWaalsContact CE-O 3.26Å; M451-Q467 WeakPolarHBondContact CE-O 3.34Å; M451-Q467 PolarHBondContact O-NE2 3.23Å; M451-Q467 HydrophobicContact SD-CG 4.34Å; M451-I470 HydrophobicContact CE-CB 4.07Å; M451-I470 HydrophobicContact CE-CG2 3.93Å; M451-I470 HydrophobicContact SD-CB 4.33Å; M451-I470 HydrophobicContact SD-CD1 4.02Å; M451-I470 HydrophobicContact SD-CG2 4.04Å; M451-V471 HydrophobicContact CE-CG2 3.6Å
452W89.8Confident84.6Confident59 Ų5955.4 Ų55.422%0.22333%0.325CS..  trans-146.7156.5165.154.990.9000108.9F371 L374 P377 F381F371-W452 VanDerWaalsContact O-CH2 3.3Å; F371-W452 WeakPolarHBondContact O-CH2 3.4Å; L374-W452 HydrophobicContact CB-CH2 4.45Å; L374-W452 WeakPolarHBondContact O-CZ2 3.35Å; P377-W452 VanDerWaalsContact CA-CH2 3.45Å; P377-W452 HydrophobicContact CB-CD2 3.99Å; P377-W452 HydrophobicContact CB-CE3 3.81Å; P377-W452 HydrophobicContact CB-CH2 3.75Å; P377-W452 HydrophobicContact CB-CZ2 3.92Å; P377-W452 HydrophobicContact CB-CZ3 3.68Å; P377-W452 VanDerWaalsContact CD-CZ2 3.47Å; P377-W452 HydrophobicContact CG-CD2 3.96Å; P377-W452 HydrophobicContact CG-CE3 4.3Å; P377-W452 HydrophobicContact CG-CG 4.44Å; P377-W452 HydrophobicContact CG-CH2 4.36Å; P377-W452 HydrophobicContact CG-CZ2 4.01Å; P377-W452 HydrophobicContact CG-CZ3 4.49Å; F381-W452 WeakPolarHBondContact CD1-O 3.09Å; F381-W452 AromaticContact CE1-CD1 3.64Å; F381-W452 HydrophobicContact CE1-CG 4.45Å; F381-W452 AromaticContact CE1-NE1 3.6Å; F381-W452 WeakPolarHBondContact CE1-O 3.49Å; F381-W452 AromaticContact CZ-CD1 3.98Å; F381-W452 AromaticContact CZ-NE1 3.51Å
453P77.6Confident83.8Confident46 Ų4657 Ų5730%0.29933%0.333SS..  trans-70.1144.5176.929.7-35000111.3
454E78.7Confident83.2Confident138 Ų13861.3 Ų61.365%0.64535%0.354SS*.SBendtrans-69.7-36.5172.4-169.1177.5179.700111.6F381F381-E454 HydrophobicContact CB-CB 4.15Å; F381-E454 HydrophobicContact CD1-CB 3.69Å; F381-E454 HydrophobicContact CD1-CG 4.42Å; F381-E454 HydrophobicContact CD2-CB 4.08Å; F381-E454 HydrophobicContact CD2-CG 3.92Å; F381-E454 HydrophobicContact CE1-CB 3.98Å; F381-E454 HydrophobicContact CE2-CB 4.36Å; F381-E454 HydrophobicContact CE2-CG 4.1Å; F381-E454 HydrophobicContact CG-CB 3.74Å; F381-E454 HydrophobicContact CG-CG 4.09Å; F381-E454 HydrophobicContact CZ-CB 4.3Å; F381-E454 HydrophobicContact CZ-CG 4.4Å
455L72.3Confident83Confident133 Ų13360 Ų6070%0.69635%0.351SS*.SBendtrans-135.4138.9178.5-66173.4000109.8A457L455-A457 PolarHBondContact O-N 3.3Å
456D64.8Low82.7Confident119 Ų11961.5 Ų61.564%0.63636%0.355SS*.SBendtrans-81.147.4-173.5-144.212000112.5M460D456-M460 WeakPolarHBondContact OD1-CE 3.44Å; D456-M460 WeakPolarHBondContact OD2-CE 3.38Å
457A58.3Low82.5Confident96 Ų9661.8 Ų61.879%0.79336%0.356SS*.  trans-100.40.3-16800000114.4L455L455-A457 PolarHBondContact O-N 3.3Å
458G63.6Low82.5Confident43 Ų4363.2 Ų63.244%0.44336%0.364SS..SBendtrans-114.2175-177.900000113.3M460G458-M460 PolarHBondContact O-N 2.82Å
459N73.7Confident82.5Confident109 Ų10964.7 Ų64.758%0.58337%0.366SS*.  trans-69.396.2167.8-175.6-19.8000108.9A461 V462 N463N459-A461 PolarHBondContact O-N 3.03Å; N459-A461 VanDerWaalsContact O-N 3.14Å; N459-A461 PolarHBondContact OD1-N 3.23Å; N459-V462 HydrophobicContact CB-CB 4.15Å; N459-V462 HydrophobicContact CB-CG2 4.05Å; N459-V462 WeakPolarHBondContact O-CB 3.44Å; N459-V462 PolarHBondContact O-N 2.94Å; N459-N463 PolarHBondContact O-N 2.86Å; N459-N463 VanDerWaalsContact O-N 3.09Å
460M73.3Confident82.4Confident101 Ų10164.2 Ų64.250%0.49836%0.363SS..Hα-helixtrans-49-41.1-175.1-175.4-174.4-74.800112.9D456 G458 V462 N463 M464D456-M460 WeakPolarHBondContact OD1-CE 3.44Å; D456-M460 WeakPolarHBondContact OD2-CE 3.38Å; G458-M460 PolarHBondContact O-N 2.82Å; M460-V462 PolarHBondContact O-N 3.24Å; M460-N463 PolarHBondContact O-N 3.46Å; M460-M464 WeakPolarHBondContact O-CG 3.42Å; M460-M464 PolarHBondContact O-N 3.06Å
461A74.8Confident82.4Confident63 Ų6364.2 Ų64.252%0.52136%0.363SS..Hα-helixtrans-64.1-40.4178.600000112.6N459 M464 V465N459-A461 PolarHBondContact O-N 3.03Å; N459-A461 VanDerWaalsContact O-N 3.14Å; N459-A461 PolarHBondContact OD1-N 3.23Å; A461-M464 PolarHBondContact O-N 2.71Å; A461-V465 WeakPolarHBondContact O-CG2 3.3Å; A461-V465 PolarHBondContact O-N 2.97Å
462V77.6Confident82.5Confident62 Ų6266.3 Ų66.338%0.37637%0.372SS..Hα-helixtrans-67.6-40.9177.3172.90000110.7N459 M460 V465 Y466N459-V462 HydrophobicContact CB-CB 4.15Å; N459-V462 HydrophobicContact CB-CG2 4.05Å; N459-V462 WeakPolarHBondContact O-CB 3.44Å; N459-V462 PolarHBondContact O-N 2.94Å; M460-V462 PolarHBondContact O-N 3.24Å; V462-V465 PolarHBondContact O-N 2.91Å; V462-Y466 HydrophobicContact CG1-CD2 3.84Å; V462-Y466 HydrophobicContact CG1-CE2 3.4Å; V462-Y466 VanDerWaalsContact O-CD2 3.27Å; V462-Y466 WeakPolarHBondContact O-CD2 3.25Å; V462-Y466 PolarHBondContact O-N 3.04Å; V462-Y466 VanDerWaalsContact O-N 3.15Å
463N81.9Confident82.9Confident32 Ų3264.5 Ų64.517%0.17137%0.366CS..Hα-helixtrans-63.8-41.8177-72.4-8.4000111.9F384 N459 M460 V465 Y466 Q467F384-N463 HydrophobicContact CZ-CB 4.29Å; N459-N463 PolarHBondContact O-N 2.86Å; N459-N463 VanDerWaalsContact O-N 3.09Å; M460-N463 PolarHBondContact O-N 3.46Å; N463-V465 PolarHBondContact O-N 2.88Å; N463-Y466 PolarHBondContact O-N 3.42Å; N463-Q467 VanDerWaalsContact O-CG 3.28Å; N463-Q467 WeakPolarHBondContact O-CG 3.43Å; N463-Q467 PolarHBondContact O-N 2.84Å
464M85.8Confident83.8Confident91 Ų9162.3 Ų62.345%0.44835%0.352SS..Hα-helixtrans-61.4-39.6174.9-73-178.272.700112.9M460 A461 Q467 N468M460-M464 WeakPolarHBondContact O-CG 3.42Å; M460-M464 PolarHBondContact O-N 3.06Å; A461-M464 PolarHBondContact O-N 2.71Å; M464-Q467 PolarHBondContact O-N 3.33Å; M464-N468 PolarHBondContact O-N 3.06Å; M464-N468 PolarHBondContact O-OD1 2.82Å
465V91.4Very high84.6Confident77 Ų7755.8 Ų55.847%0.46732%0.321SS..Hα-helixtrans-62-44.8175.6171.80000110.9A461 V462 N463 N468 Q469A461-V465 WeakPolarHBondContact O-CG2 3.3Å; A461-V465 PolarHBondContact O-N 2.97Å; V462-V465 PolarHBondContact O-N 2.91Å; N463-V465 PolarHBondContact O-N 2.88Å; V465-N468 PolarHBondContact O-N 2.95Å; V465-Q469 HydrophobicContact CG1-CG 4.46Å; V465-Q469 WeakPolarHBondContact O-CG 3.42Å; V465-Q469 PolarHBondContact O-N 3.27Å
466Y92.8Very high85.7Confident56 Ų5654.1 Ų54.122%0.2231%0.312CS..Hα-helixtrans-66.8-37.7177.7-69.8-54000113.2V388 V391 K392 V462 N463 N468 Q469 I470V388-Y466 HydrophobicContact CG1-CD1 4.44Å; V388-Y466 HydrophobicContact CG1-CD2 3.7Å; V388-Y466 HydrophobicContact CG1-CE2 3.95Å; V388-Y466 HydrophobicContact CG1-CG 3.97Å; V388-Y466 HydrophobicContact CG2-CD2 4.43Å; V388-Y466 HydrophobicContact CG2-CG 4.33Å; V391-Y466 HydrophobicContact CG1-CD1 3.99Å; K392-Y466 WeakPolarHBondContact CE-OH 3.33Å; K392-Y466 HydrophobicContact CG-CE1 4.13Å; V462-Y466 HydrophobicContact CG1-CD2 3.84Å; V462-Y466 HydrophobicContact CG1-CE2 3.4Å; V462-Y466 VanDerWaalsContact O-CD2 3.27Å; V462-Y466 WeakPolarHBondContact O-CD2 3.25Å; V462-Y466 PolarHBondContact O-N 3.04Å; V462-Y466 VanDerWaalsContact O-N 3.15Å; N463-Y466 PolarHBondContact O-N 3.42Å; Y466-N468 VanDerWaalsContact C-N 3.32Å; Y466-N468 PolarHBondContact O-N 3.14Å; Y466-Q469 PolarHBondContact O-N 2.89Å; Y466-I470 WeakPolarHBondContact O-CB 3.32Å; Y466-I470 WeakPolarHBondContact O-CD1 3.39Å; Y466-I470 WeakPolarHBondContact O-CG1 3.37Å; Y466-I470 PolarHBondContact O-N 3.24Å
467Q94.3Very high87.1Confident6 Ų650.8 Ų50.83%0.02829%0.293CS..Hα-helixtrans-55.1-47.9174.8-72.3167.1-6.800111.5F384 M451 N463 M464 I470 V471F384-Q467 HydrophobicContact CE2-CG 3.72Å; F384-Q467 HydrophobicContact CZ-CG 4.15Å; M451-Q467 HydrophobicContact CB-CG 3.79Å; M451-Q467 HydrophobicContact CE-CB 4.14Å; M451-Q467 HydrophobicContact CE-CG 4.47Å; M451-Q467 VanDerWaalsContact CE-O 3.26Å; M451-Q467 WeakPolarHBondContact CE-O 3.34Å; M451-Q467 PolarHBondContact O-NE2 3.23Å; M451-Q467 HydrophobicContact SD-CG 4.34Å; N463-Q467 VanDerWaalsContact O-CG 3.28Å; N463-Q467 WeakPolarHBondContact O-CG 3.43Å; N463-Q467 PolarHBondContact O-N 2.84Å; M464-Q467 PolarHBondContact O-N 3.33Å; Q467-I470 PolarHBondContact O-N 2.85Å; Q467-V471 PolarHBondContact O-N 3.46Å
468N95.8Very high88.8Confident30 Ų3046.2 Ų46.216%0.1626%0.255CS..Hα-helixtrans-64.5-47178.1-62.1-5.9000110.9G443 M464 V465 Y466 I470 V471 E472G443-N468 PolarHBondContact O-OD1 3.45Å; M464-N468 PolarHBondContact O-N 3.06Å; M464-N468 PolarHBondContact O-OD1 2.82Å; V465-N468 PolarHBondContact O-N 2.95Å; Y466-N468 VanDerWaalsContact C-N 3.32Å; Y466-N468 PolarHBondContact O-N 3.14Å; N468-I470 VanDerWaalsContact C-N 3.33Å; N468-I470 PolarHBondContact O-N 2.85Å; N468-V471 PolarHBondContact O-N 3.39Å; N468-E472 WeakPolarHBondContact O-CB 3.34Å; N468-E472 WeakPolarHBondContact O-CG 3.38Å; N468-E472 PolarHBondContact O-N 3.3Å
469Q95.7Very high90.1Very high82 Ų8252.6 Ų52.638%0.38327%0.266SS..Hα-helixtrans-60.8-37.4178.5-73.3177.7-3.900113.5V391 V465 Y466 F473V391-Q469 HydrophobicContact CG2-CB 4.38Å; V465-Q469 HydrophobicContact CG1-CG 4.46Å; V465-Q469 WeakPolarHBondContact O-CG 3.42Å; V465-Q469 PolarHBondContact O-N 3.27Å; Y466-Q469 PolarHBondContact O-N 2.89Å; Q469-F473 VanDerWaalsContact O-CB 3.24Å; Q469-F473 WeakPolarHBondContact O-CB 3.45Å; Q469-F473 PolarHBondContact O-N 3.23Å
470I96.9Very high91Very high4 Ų451.6 Ų51.62%0.02126%0.258CS..Hα-helixtrans-64.6-47.1176.2-70.9158.8000110F379 F387 V388 V391 M451 Y466 Q467 N468 F473 I474F379-I470 HydrophobicContact CE1-CG2 4.15Å; F387-I470 HydrophobicContact CB-CD1 3.8Å; F387-I470 HydrophobicContact CB-CG1 4.25Å; F387-I470 HydrophobicContact CB-CG2 4.3Å; F387-I470 HydrophobicContact CD1-CG2 4.42Å; V388-I470 HydrophobicContact CG2-CD1 4Å; V391-I470 HydrophobicContact CB-CG1 4.11Å; V391-I470 HydrophobicContact CG1-CG1 4.02Å; V391-I470 HydrophobicContact CG2-CG1 4.46Å; M451-I470 HydrophobicContact CE-CB 4.07Å; M451-I470 HydrophobicContact CE-CG2 3.93Å; M451-I470 HydrophobicContact SD-CB 4.33Å; M451-I470 HydrophobicContact SD-CD1 4.02Å; M451-I470 HydrophobicContact SD-CG2 4.04Å; Y466-I470 WeakPolarHBondContact O-CB 3.32Å; Y466-I470 WeakPolarHBondContact O-CD1 3.39Å; Y466-I470 WeakPolarHBondContact O-CG1 3.37Å; Y466-I470 PolarHBondContact O-N 3.24Å; Q467-I470 PolarHBondContact O-N 2.85Å; N468-I470 VanDerWaalsContact C-N 3.33Å; N468-I470 PolarHBondContact O-N 2.85Å; I470-F473 PolarHBondContact O-N 2.92Å; I470-I474 HydrophobicContact CG2-CD1 3.64Å; I470-I474 WeakPolarHBondContact O-CB 3.3Å; I470-I474 VanDerWaalsContact O-CG1 3.26Å; I470-I474 WeakPolarHBondContact O-CG1 3.4Å; I470-I474 PolarHBondContact O-N 3.31Å
471V97.8Very high92Very high0 Ų046.8 Ų46.80%023%0.234CC..Hα-helixtrans-64.6-45.2177.1174.40000111.4F422 F446 M451 Q467 N468 F473 I474 L475F422-V471 HydrophobicContact CE1-CG1 4.02Å; F422-V471 HydrophobicContact CZ-CG1 4.28Å; F446-V471 HydrophobicContact CB-CG1 3.97Å; M451-V471 HydrophobicContact CE-CG2 3.6Å; Q467-V471 PolarHBondContact O-N 3.46Å; N468-V471 PolarHBondContact O-N 3.39Å; V471-F473 VanDerWaalsContact C-N 3.35Å; V471-F473 PolarHBondContact O-N 2.6Å; V471-I474 PolarHBondContact O-N 2.96Å; V471-L475 WeakPolarHBondContact O-CB 3.45Å; V471-L475 PolarHBondContact O-N 3.29Å
472E96.9Very high92.8Very high45 Ų4544 Ų4421%0.2121%0.21CC..Hα-helixtrans-58.1-46.5176.6-74.3176.6-141.200111.7T439 N468 L475 I476T439-E472 HydrophobicContact CG2-CB 4.23Å; T439-E472 HydrophobicContact CG2-CG 4.26Å; N468-E472 WeakPolarHBondContact O-CB 3.34Å; N468-E472 WeakPolarHBondContact O-CG 3.38Å; N468-E472 PolarHBondContact O-N 3.3Å; E472-L475 PolarHBondContact O-N 3Å; E472-I476 WeakPolarHBondContact O-CD1 3.42Å; E472-I476 VanDerWaalsContact O-CG1 3.26Å; E472-I476 WeakPolarHBondContact O-CG1 3.44Å; E472-I476 PolarHBondContact O-N 3.12Å
473F97.1Very high93.3Very high22 Ų2243.4 Ų43.410%0.09621%0.205CC..Hα-helixtrans-66.3-47-179.8-179.4-102.8000112.6V391 T396 K399 T400 V403 Q469 I470 V471 L475 I476 E477 I481V391-F473 HydrophobicContact CG2-CB 4.21Å; T396-F473 HydrophobicContact CG2-CE2 4.3Å; K399-F473 HydrophobicContact CB-CE1 4.48Å; K399-F473 HydrophobicContact CB-CZ 3.99Å; K399-F473 HydrophobicContact CD-CD1 4.08Å; K399-F473 HydrophobicContact CD-CD2 3.7Å; K399-F473 HydrophobicContact CD-CE1 3.89Å; K399-F473 HydrophobicContact CD-CE2 3.49Å; K399-F473 VanDerWaalsContact CD-CE2 3.49Å; K399-F473 HydrophobicContact CD-CG 3.99Å; K399-F473 HydrophobicContact CD-CZ 3.58Å; K399-F473 HydrophobicContact CG-CD1 4.19Å; K399-F473 HydrophobicContact CG-CD2 4.49Å; K399-F473 HydrophobicContact CG-CE1 3.62Å; K399-F473 HydrophobicContact CG-CE2 3.97Å; K399-F473 HydrophobicContact CG-CZ 3.49Å; K399-F473 VanDerWaalsContact CG-CZ 3.49Å; T400-F473 WeakPolarHBondContact OG1-CZ 3.18Å; V403-F473 HydrophobicContact CB-CD1 4.4Å; V403-F473 HydrophobicContact CB-CE1 3.99Å; V403-F473 HydrophobicContact CG1-CD1 4.33Å; V403-F473 HydrophobicContact CG1-CE1 4.27Å; V403-F473 HydrophobicContact CG2-CD1 3.95Å; V403-F473 HydrophobicContact CG2-CE1 3.77Å; Q469-F473 VanDerWaalsContact O-CB 3.24Å; Q469-F473 WeakPolarHBondContact O-CB 3.45Å; Q469-F473 PolarHBondContact O-N 3.23Å; I470-F473 PolarHBondContact O-N 2.92Å; V471-F473 VanDerWaalsContact C-N 3.35Å; V471-F473 PolarHBondContact O-N 2.6Å; F473-L475 PolarHBondContact O-N 3.36Å; F473-I476 PolarHBondContact O-N 2.76Å; F473-E477 HydrophobicContact CD2-CG 4.13Å; F473-E477 HydrophobicContact CE1-CG 4.4Å; F473-E477 HydrophobicContact CE2-CB 4.46Å; F473-E477 HydrophobicContact CE2-CG 3.47Å; F473-E477 VanDerWaalsContact CE2-CG 3.47Å; F473-E477 HydrophobicContact CZ-CB 4.25Å; F473-E477 HydrophobicContact CZ-CG 3.64Å; F473-E477 PolarHBondContact O-N 3Å; F473-I481 HydrophobicContact CE1-CD1 4.23Å
474I97.2Very high93Very high0 Ų044.6 Ų44.60%021%0.211CC..Hα-helixtrans-62.6-33.9176.8-67165.9000110.8F379 F387 V403 I407 F422 I470 V471 S478 I481 F482F379-I474 HydrophobicContact CE1-CD1 3.52Å; F379-I474 HydrophobicContact CZ-CD1 3.57Å; F387-I474 HydrophobicContact CE1-CD1 4.44Å; V403-I474 HydrophobicContact CG1-CD1 4.13Å; V403-I474 HydrophobicContact CG1-CG1 3.62Å; I407-I474 HydrophobicContact CD1-CD1 4.09Å; I407-I474 HydrophobicContact CD1-CG1 4.24Å; I407-I474 HydrophobicContact CD1-CG2 4.26Å; F422-I474 HydrophobicContact CD1-CB 4.38Å; F422-I474 HydrophobicContact CD1-CG2 3.73Å; F422-I474 HydrophobicContact CD2-CG2 3.88Å; F422-I474 HydrophobicContact CE1-CB 3.88Å; F422-I474 HydrophobicContact CE1-CG2 3.6Å; F422-I474 HydrophobicContact CE2-CG2 3.77Å; F422-I474 HydrophobicContact CG-CG2 3.87Å; F422-I474 HydrophobicContact CZ-CB 3.99Å; F422-I474 HydrophobicContact CZ-CG2 3.63Å; I470-I474 HydrophobicContact CG2-CD1 3.64Å; I470-I474 WeakPolarHBondContact O-CB 3.3Å; I470-I474 VanDerWaalsContact O-CG1 3.26Å; I470-I474 WeakPolarHBondContact O-CG1 3.4Å; I470-I474 PolarHBondContact O-N 3.31Å; V471-I474 PolarHBondContact O-N 2.96Å; I474-S478 WeakPolarHBondContact O-CA 3.33Å; I474-S478 VanDerWaalsContact O-CB 3.23Å; I474-S478 WeakPolarHBondContact O-CB 3.38Å; I474-S478 PolarHBondContact O-N 2.86Å; I474-I481 HydrophobicContact CB-CD1 4.4Å; I474-I481 HydrophobicContact CG1-CD1 4.27Å; I474-I481 HydrophobicContact CG2-CD1 4.46Å; I474-F482 HydrophobicContact CG2-CE2 3.71Å; I474-F482 HydrophobicContact CG2-CZ 4.07Å
475L95.9Very high91.5Very high0 Ų043.9 Ų43.90%023%0.227CC..Hα-helixtrans-69.4-47.2176.9-171.855.2000111.2F422 L425 Q426 L429 T439 I442 V471 E472 F473 S478F422-L475 HydrophobicContact CD1-CB 4.11Å; F422-L475 HydrophobicContact CD1-CD1 4.07Å; F422-L475 HydrophobicContact CE1-CB 4.19Å; L425-L475 HydrophobicContact CB-CD1 3.64Å; Q426-L475 HydrophobicContact CG-CD1 4.15Å; Q426-L475 PolarHBondContact NE2-O 3.3Å; L429-L475 HydrophobicContact CD1-CD1 4.26Å; L429-L475 HydrophobicContact CD1-CD2 3.56Å; L429-L475 HydrophobicContact CD1-CG 3.72Å; L429-L475 HydrophobicContact CG-CD2 4.34Å; T439-L475 HydrophobicContact CG2-CB 4.41Å; T439-L475 HydrophobicContact CG2-CD2 4.1Å; T439-L475 HydrophobicContact CG2-CG 4.38Å; I442-L475 HydrophobicContact CB-CD2 3.97Å; I442-L475 HydrophobicContact CG2-CD2 3.57Å; V471-L475 WeakPolarHBondContact O-CB 3.45Å; V471-L475 PolarHBondContact O-N 3.29Å; E472-L475 PolarHBondContact O-N 3Å; F473-L475 PolarHBondContact O-N 3.36Å; L475-S478 VanDerWaalsContact O-CB 3.3Å; L475-S478 WeakPolarHBondContact O-CB 3.38Å; L475-S478 PolarHBondContact O-N 3.11Å; L475-S478 PolarHBondContact O-OG 3.29Å
476I94.9Very high89.2Confident98 Ų9850.3 Ų50.350%0.50324%0.243SC..Hα-helixtrans-59.4-54.5176.9-68.1162.6000111T439 E472 F473 S478T439-I476 HydrophobicContact CG2-CD1 4.18Å; T439-I476 HydrophobicContact CG2-CG1 3.85Å; E472-I476 WeakPolarHBondContact O-CD1 3.42Å; E472-I476 VanDerWaalsContact O-CG1 3.26Å; E472-I476 WeakPolarHBondContact O-CG1 3.44Å; E472-I476 PolarHBondContact O-N 3.12Å; F473-I476 PolarHBondContact O-N 2.76Å; I476-S478 VanDerWaalsContact C-N 3.26Å; I476-S478 PolarHBondContact O-N 3.22Å
477E94.6Very high86.3Confident50 Ų5060.2 Ų60.223%0.23429%0.294CS..THydrogen-bonded Turntrans-89.314.5-174.9-56.7-59.3166.200113.4T400 F473 R479 E480 I481T400-E477 HydrophobicContact CG2-CB 4.07Å; T400-E477 HydrophobicContact CG2-CG 4.5Å; F473-E477 HydrophobicContact CD2-CG 4.13Å; F473-E477 HydrophobicContact CE1-CG 4.4Å; F473-E477 HydrophobicContact CE2-CB 4.46Å; F473-E477 HydrophobicContact CE2-CG 3.47Å; F473-E477 VanDerWaalsContact CE2-CG 3.47Å; F473-E477 HydrophobicContact CZ-CB 4.25Å; F473-E477 HydrophobicContact CZ-CG 3.64Å; F473-E477 PolarHBondContact O-N 3Å; E477-R479 PolarHBondContact O-N 3.35Å; E477-E480 PolarHBondContact O-N 3.15Å; E477-I481 HydrophobicContact CB-CD1 3.76Å; E477-I481 HydrophobicContact CB-CG1 4.17Å; E477-I481 WeakPolarHBondContact O-CB 3.33Å; E477-I481 WeakPolarHBondContact O-CG1 3.38Å; E477-I481 PolarHBondContact O-N 3.12Å
478S93Very high85.9Confident0 Ų062.9 Ų62.90%031%0.307CS..Hα-helixtrans-50.7-35.9-175.850.20000114Q426 I474 L475 I476 F482Q426-S478 WeakPolarHBondContact CG-OG 3.31Å; I474-S478 WeakPolarHBondContact O-CA 3.33Å; I474-S478 VanDerWaalsContact O-CB 3.23Å; I474-S478 WeakPolarHBondContact O-CB 3.38Å; I474-S478 PolarHBondContact O-N 2.86Å; L475-S478 VanDerWaalsContact O-CB 3.3Å; L475-S478 WeakPolarHBondContact O-CB 3.38Å; L475-S478 PolarHBondContact O-N 3.11Å; L475-S478 PolarHBondContact O-OG 3.29Å; I476-S478 VanDerWaalsContact C-N 3.26Å; I476-S478 PolarHBondContact O-N 3.22Å; S478-F482 WeakPolarHBondContact O-CB 3.4Å; S478-F482 WeakPolarHBondContact O-CD2 3.15Å; S478-F482 PolarHBondContact O-N 3.49Å
479R90.6Very high85.4Confident177 Ų17764.6 Ų64.667%0.66832%0.315SS*.Hα-helixtrans-65-43.9178-63.5-175.1-175.2-169.30.2112.8E477 D483 L484E477-R479 PolarHBondContact O-N 3.35Å; R479-D483 CarbonylContact O-C 3.56Å; R479-D483 VanDerWaalsContact O-CA 3.3Å; R479-D483 WeakPolarHBondContact O-CA 3.34Å; R479-D483 PolarHBondContact O-N 3.01Å; R479-L484 PolarHBondContact O-N 3.23Å
480E92.8Very high84.8Confident88 Ų8863.7 Ų63.741%0.41131%0.311SS..Hα-helixtrans-77.3-38.6178.6-170.6179156.900111.3T400 K404 E477T400-E480 HydrophobicContact CG2-CB 3.97Å; T400-E480 VanDerWaalsContact CG2-CD 3.5Å; T400-E480 HydrophobicContact CG2-CG 3.83Å; K404-E480 WeakPolarHBondContact CD-O 3.38Å; K404-E480 WeakPolarHBondContact CE-O 3.24Å; K404-E480 PolarHBondContact NZ-O 2.73Å; E477-E480 PolarHBondContact O-N 3.15Å
481I94.3Very high84.1Confident0 Ų067.2 Ų67.20%033%0.328CS..Hα-helixtrans-65.3-47.6-178.5-72.4170.2000112.1T400 V403 K404 I407 F473 I474 E477T400-I481 HydrophobicContact CG2-CG1 3.93Å; V403-I481 HydrophobicContact CG1-CD1 3.86Å; K404-I481 WeakPolarHBondContact CE-O 3.35Å; K404-I481 WeakPolarHBondContact CG-O 3.42Å; I407-I481 HydrophobicContact CD1-CG2 3.39Å; F473-I481 HydrophobicContact CE1-CD1 4.23Å; I474-I481 HydrophobicContact CB-CD1 4.4Å; I474-I481 HydrophobicContact CG1-CD1 4.27Å; I474-I481 HydrophobicContact CG2-CD1 4.46Å; E477-I481 HydrophobicContact CB-CD1 3.76Å; E477-I481 HydrophobicContact CB-CG1 4.17Å; E477-I481 WeakPolarHBondContact O-CB 3.33Å; E477-I481 WeakPolarHBondContact O-CG1 3.38Å; E477-I481 PolarHBondContact O-N 3.12Å
482F92.2Very high83.2Confident3 Ų371.4 Ų71.41%0.01335%0.349CS..THydrogen-bonded Turntrans-101.57-175.6-63.2-73.6000114I407 M418 K419 F422 I474 S478 L484I407-F482 HydrophobicContact CD1-CE1 4.4Å; I407-F482 HydrophobicContact CD1-CZ 4.08Å; I407-F482 HydrophobicContact CG2-CD1 4.15Å; I407-F482 HydrophobicContact CG2-CE1 3.62Å; I407-F482 HydrophobicContact CG2-CZ 4.36Å; M418-F482 HydrophobicContact CB-CE1 4.06Å; M418-F482 HydrophobicContact CB-CZ 4Å; K419-F482 HydrophobicContact CB-CD1 3.66Å; K419-F482 HydrophobicContact CB-CE1 4.01Å; K419-F482 HydrophobicContact CB-CG 4.27Å; K419-F482 HydrophobicContact CD-CB 4.12Å; K419-F482 HydrophobicContact CD-CD1 4.32Å; K419-F482 WeakPolarHBondContact CE-O 3.27Å; K419-F482 HydrophobicContact CG-CB 4.05Å; K419-F482 HydrophobicContact CG-CD1 4Å; K419-F482 HydrophobicContact CG-CG 4.18Å; K419-F482 PolarHBondContact NZ-O 3.31Å; F422-F482 HydrophobicContact CB-CD2 4.36Å; F422-F482 HydrophobicContact CB-CE2 3.69Å; F422-F482 HydrophobicContact CB-CZ 4.34Å; F422-F482 HydrophobicContact CD2-CE2 4.02Å; F422-F482 AromaticContact CD2-CZ 3.96Å; F422-F482 HydrophobicContact CD2-CZ 3.96Å; F422-F482 AromaticContact CG-CE2 3.98Å; F422-F482 HydrophobicContact CG-CE2 3.98Å; F422-F482 HydrophobicContact CG-CZ 4.39Å; I474-F482 HydrophobicContact CG2-CE2 3.71Å; I474-F482 HydrophobicContact CG2-CZ 4.07Å; S478-F482 WeakPolarHBondContact O-CB 3.4Å; S478-F482 WeakPolarHBondContact O-CD2 3.15Å; S478-F482 PolarHBondContact O-N 3.49Å; F482-L484 VanDerWaalsContact C-N 3.31Å; F482-L484 HydrophobicContact CB-CD1 4.22Å; F482-L484 HydrophobicContact CB-CD2 4.26Å; F482-L484 HydrophobicContact CB-CG 3.89Å; F482-L484 PolarHBondContact O-N 2.73Å
483D87.1Confident82.3Confident51 Ų5173.1 Ų73.127%0.27336%0.358SS..THydrogen-bonded Turntrans52.942.3-175.3-65.3-65.7000113.6K404 R479 G485 R486K404-D483 WeakPolarHBondContact CE-OD2 3.41Å; K404-D483 IonicContact NZ-OD1 3.87Å; K404-D483 PolarHBondContact NZ-OD1 3.25Å; K404-D483 IonicContact NZ-OD2 3.16Å; K404-D483 PolarHBondContact NZ-OD2 3.04Å; R479-D483 CarbonylContact O-C 3.56Å; R479-D483 VanDerWaalsContact O-CA 3.3Å; R479-D483 WeakPolarHBondContact O-CA 3.34Å; R479-D483 PolarHBondContact O-N 3.01Å; D483-G485 PolarHBondContact O-N 2.99Å; D483-R486 PolarHBondContact O-N 3.47Å
484L75.8Confident81.3Confident56 Ų5676.8 Ų76.829%0.29338%0.377SS..THydrogen-bonded Turntrans-77.274.6177.6-53.9169000109.9K419 S423 R479 F482K419-L484 HydrophobicContact CG-CD2 4.37Å; S423-L484 WeakPolarHBondContact OG-CD1 3.18Å; S423-L484 WeakPolarHBondContact OG-CD2 3.4Å; R479-L484 PolarHBondContact O-N 3.23Å; F482-L484 VanDerWaalsContact C-N 3.31Å; F482-L484 HydrophobicContact CB-CD1 4.22Å; F482-L484 HydrophobicContact CB-CD2 4.26Å; F482-L484 HydrophobicContact CB-CG 3.89Å; F482-L484 PolarHBondContact O-N 2.73Å
485G55.1Low80.1Confident76 Ų7682.7 Ų82.778%0.78441%0.406SS*.THydrogen-bonded Turntrans162.41.9-176.700000115.3D483D483-G485 PolarHBondContact O-N 2.99Å
486R41.5Very low78.7Confident213 Ų21389.6 Ų89.680%0.80444%0.44SS*.  trans-110.679167.2-61.4-173-165.3-162.54.1110.1D483D483-R486 PolarHBondContact O-N 3.47Å
487M32.9Very low77.3Confident263 Ų26388.8 Ų88.8100%1.29643%0.434SS*.  trans-1360160.4-77.2-172.9174.600107.5

Retrieved 487 of 487 residues in 132 ms (Link to these results)