A0A087Y3B5_POEFO Loading...

Solute carrier family 25 member 28

Mitochondrial iron transporter that mediates iron uptake. Probably required for heme synthesis of hemoproteins and Fe-S cluster assembly in non-erythroid cells.

AlphaFold DB , UniProt , Accession A0A087Y3B5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 394 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
1M31.6Very low29.7Very low219 Ų219163.5 Ų163.5100%1.07979%0.793SS**  081.10-69.3175.3145.600106.9
2E29.3Very low29.4Very low166 Ų166161.8 Ų161.878%0.77679%0.786SS**  73.3116.965.6-65.1166.4120.700112.4
3T32.2Very low29.1Very low131 Ų131158.5 Ų158.580%0.80478%0.781SS**  169.9116.7116.932.70000106.2
4D31.6Very low29.1Very low160 Ų160153.4 Ų153.486%0.85678%0.777SS**  81.2141.368.9-98.7-28.6000115.4
5G30.9Very low28.9Very low70 Ų70155.2 Ų155.272%0.72278%0.782SS**  trans122.977178.700000114.2
6F29.3Very low28.8Very low170 Ų170153.6 Ų153.675%0.74678%0.782SS**  cis96.1156.747.4-148.6-90.3000113.7
7V31.3Very low28.7Very low129 Ų129150.4 Ų150.478%0.78279%0.785SS**  trans80.1110.8-176.9-167.40000115.2
8R29.1Very low28.6Very low181 Ų181146.4 Ų146.468%0.68379%0.787SS**  cis95.31009.8-158.1-166.2-164.4-163.59.3118.1
9K28.7Very low28.5Very low207 Ų207142.8 Ų142.890%0.979%0.787SS**  trans176.1127142.3-102.1173.1179.4-178.70108.2
10R27.3Very low28.4Very low181 Ų181144 Ų14468%0.68379%0.792SS**  cis107.4109.56.1-158-167.6-155.5-160.28.6115.9
11R26.1Very low28.3Very low185 Ų185141.9 Ų141.970%0.69879%0.794SS**  trans68.2159.2156-84.7177.9171.4-171.9-3.1117.5
12M25.8Very low28.1Very low142 Ų142134.5 Ų134.570%0.777%0.774SS**  cis-150.8127.514.2-125.2138145.600109
13T25.9Very low27.9Very low119 Ų119133.1 Ų133.173%0.7378%0.777SS**  68.6144.398.465.40000119.3
14A28.1Very low27.4Very low88 Ų88131.6 Ų131.673%0.72778%0.777SS**  trans101.5134165.400000115.5
15E27Very low27Very low180 Ų180127.1 Ų127.184%0.84177%0.768SS**  cis-157.2165.4-11.5-124.5169.6168.900111.2
16T27.5Very low26.6Very low129 Ų129128.4 Ų128.479%0.79177%0.772SS**  trans-24.9160.5164.435.30000119
17A26.4Very low26.3Very low100 Ų100126.2 Ų126.283%0.82678%0.778SS**  cis-166.1168.1-3.200000107
18G26.8Very low25.9Very low79 Ų79124.7 Ų124.781%0.81478%0.779SS**  cis172.11750.500000108.5
19G26.2Very low25.5Very low77 Ų77120 Ų12079%0.79479%0.787SS**  trans125.683.8174.900000114.5
20D27.1Very low25.3Very low166 Ų166114.9 Ų114.989%0.88878%0.784SS**  trans-57168.5166.2-61.2-70.1000112.4
21A26.6Very low25.1Very low100 Ų100113.1 Ų113.183%0.82678%0.783SS**  cis-157.6165.423.300000113.7
22G26.6Very low25Very low64 Ų64111.1 Ų111.166%0.6679%0.791SS**  trans96.470.4159.700000115.3
23V24.7Very low24.9Very low138 Ų138113.7 Ų113.784%0.83679%0.793SS**  57.589.393.6-176.80000110.9
24A23.6Very low24.8Very low98 Ų98119.5 Ų119.581%0.8180%0.802SS**  57.4132.786.600000113.1
25G22.6Very low24.7Very low66 Ų66123.1 Ų123.168%0.6881%0.808SS**  cis-176.9134.93.600000105
26A22.8Very low24.7Very low97 Ų97117.9 Ų117.980%0.80280%0.802SS**  67.7126.381.300000113.8
27S22.3Very low25Very low125 Ų125115.8 Ų115.887%0.87481%0.807SS**  trans69.3154.8174.782.30000116.2
28A22.7Very low24.9Very low97 Ų97122.7 Ų122.780%0.80281%0.811SS**  cis-172.9172-26.700000107.8
29G20.8Very low24.8Very low82 Ų82128.9 Ų128.985%0.84582%0.816SS**  trans98.5142.5156.200000115.9
30A23.9Very low24.9Very low100 Ų100136.9 Ų136.983%0.82682%0.822SS**  trans-93.4163.217800000111.6
31E22.8Very low24.6Very low143 Ų143132.1 Ų132.167%0.66881%0.813SS**  trans-156.7133.4134.7-120.7-169.9-174.900111.2R33E31-R33 IonicContact OE1-NH1 3.57Å; E31-R33 IonicContact OE2-CZ 3.64Å; E31-R33 IonicContact OE2-NE 3.9Å; E31-R33 IonicContact OE2-NH1 2.8Å; E31-R33 PolarHBondContact OE2-NH1 2.93Å
32V24.6Very low24.7Very low144 Ų144134.4 Ų134.487%0.87382%0.816SS**  trans-97.4123.8163.3172.70000106.8
33R23.7Very low24.6Very low196 Ų196136.8 Ų136.874%0.7482%0.823SS**  trans-130.8126.9174.7-111.5175.8166.6143.3-7.7112.3E31E31-R33 IonicContact OE1-NH1 3.57Å; E31-R33 IonicContact OE2-CZ 3.64Å; E31-R33 IonicContact OE2-NE 3.9Å; E31-R33 IonicContact OE2-NH1 2.8Å; E31-R33 PolarHBondContact OE2-NH1 2.93Å
34W23.5Very low24.6Very low240 Ų240138.3 Ų138.391%0.90982%0.821SS**  trans-113115.7-175.9-170.396.4000108.3
35L25.8Very low24.6Very low164 Ų164139 Ų13986%0.85982%0.82SS**  trans-165.5137.4177.1-113153.1000111.9
36G27Very low24.6Very low70 Ų70144.3 Ų144.372%0.72283%0.831SS**  trans86.188165.100000115.6R38G36-R38 PolarHBondContact O-N 3.16Å
37G34Very low24.6Very low86 Ų86146.1 Ų146.189%0.88783%0.831SS**  trans-69.2110.3179.500000114.3
38R25.2Very low24.6Very low244 Ų244145.8 Ų145.892%0.92183%0.829SS**  trans-164.6123.1151.6-108.7172.1180-165.9-1108.9G36G36-R38 PolarHBondContact O-N 3.16Å
39F24.1Very low24.5Very low210 Ų210146.1 Ų146.192%0.92183%0.825SS**  trans-98.1127.2176.1-148.3-92.5000109.1
40W27.9Very low24.6Very low244 Ų244149.6 Ų149.692%0.92482%0.824SS**  trans-145.9138.3176.3-117.371000109.6
41G22.6Very low24.6Very low66 Ų66151.2 Ų151.268%0.6882%0.823SS**  trans81.9109.7150.700000117.8
42V27.8Very low25.2Very low148 Ų148149.6 Ų149.690%0.89783%0.826SS**  trans-50.4140.9162174.40000112.3
43S23.4Very low25.1Very low115 Ų115154.7 Ų154.780%0.80483%0.829SS**  trans-138.1134.5151.3-174.70000109.5
44E26.1Very low25.2Very low170 Ų170153.5 Ų153.579%0.79484%0.836SS**  trans-68.4150.3166.9-57.4174.5134.500109.9
45S22.6Very low25.1Very low112 Ų112145.8 Ų145.878%0.78383%0.83SS**  trans148.194.4146.3-710000112.7
46I23.6Very low24.9Very low178 Ų178141.6 Ų141.691%0.91383%0.827SS**  trans-134.988.7139-59.8-173.7000106.7
47V22.7Very low24.8Very low134 Ų134147 Ų14781%0.81283%0.833SS**  trans-125.1126.2169.1170.40000107.8
48S21.9Very low24.2Very low118 Ų118147.1 Ų147.183%0.82582%0.821SS**  trans63.5105.5160.7-157.40000119.6
49S21.4Very low24Very low104 Ų104144 Ų14473%0.72782%0.817SS**  trans-173.2129.3150.5142.20000107.7
50L22.4Very low23.8Very low156 Ų156140.3 Ų140.382%0.81781%0.806SS**  cis-161.5144.83-100.6160.2000110.2
51T23.5Very low23.5Very low133 Ų133137.2 Ų137.282%0.81680%0.802SS**  trans-148.7165.2155.2230000106.9
52P35.2Very low23.4Very low110 Ų110139.3 Ų139.371%0.71481%0.806SS**  cis-130.4-172.1-2.940-23.1000113.6
53R22.1Very low23.1Very low250 Ų250138.1 Ų138.194%0.94380%0.799SS**  trans-155.2139.8148.4-118.9177.4-177.8-179.50.8112.1
54I26.6Very low23Very low172 Ų172139.2 Ų139.288%0.88280%0.796SS**  trans-134.6151.8-174.4-71.4174000110.1
55G21.1Very low22.7Very low77 Ų77136.7 Ų136.779%0.79479%0.792SS**  trans127.5130.1164.100000112.5
56G21.9Very low22.5Very low77 Ų77137.7 Ų137.779%0.79479%0.793SS**  cis-158.7-166.2-3.900000109.5
57E23.8Very low22.4Very low182 Ų182134.9 Ų134.985%0.8579%0.787SS**  cis-161176.8-1.2-142.8-152.285.800112.7
58S21.7Very low22.3Very low90 Ų90138 Ų13863%0.62979%0.793SS**  trans6.6125.6166.452.40000124.7
59Q20.7Very low22.3Very low179 Ų179136.7 Ų136.784%0.83679%0.789SS**  -157.6139.4109.5-111.7-165.51.400115.2
60L21.7Very low22.2Very low131 Ų131140.1 Ų140.169%0.68679%0.794SS**  trans61.793.9159.6-92.271.5000123
61Q19.9Very low22.5Very low179 Ų179141.2 Ų141.284%0.83680%0.795SS**  61.796.5117.6-72.2177.9-43.900121.4
62S22.1Very low22.3Very low111 Ų111139.1 Ų139.178%0.77679%0.791SS**  trans-81.2-173.2145.8510000112.2
63V21.2Very low21.6Very low123 Ų123143.2 Ų143.275%0.74580%0.801SS**  trans91.8121177.5-174.80000112
64D19.9Very low21.7Very low137 Ų137135.1 Ų135.173%0.73380%0.795SS**  cis-157.3158.122.6-126.2-11000116.4
65V19.9Very low21.5Very low118 Ų118136 Ų13672%0.71580%0.796SS**  trans58.4115.5140.8170.40000122.2
66V19.6Very low21.5Very low133 Ų133140.7 Ų140.781%0.80680%0.802SS**  -174.9144.9104160.40000109.4
67C21.6Very low21.6Very low118 Ų118141.8 Ų141.880%0.79780%0.798SS**  trans-76.7136.9170.8-58.10000112.6
68E19.3Very low21.7Very low200 Ų200141.8 Ų141.894%0.93580%0.798SS**  trans-162.7151.2137-118.7168.8-178.200111.3
69A23.5Very low22Very low90 Ų90142.5 Ų142.574%0.74480%0.801SS**  trans-109.5122.4174.900000109
70Q19.3Very low22.9Very low177 Ų177137.2 Ų137.283%0.82778%0.778SS**  trans-156.1146157.7-158.18011.700110.1
71E27.1Very low23.6Very low178 Ų178135 Ų13583%0.83276%0.761SS**  trans-66.2134.2-171.4-55143.5127.300114.4
72A20.8Very low24.6Very low90 Ų90133 Ų13374%0.74475%0.752SS**  trans-164.4119.4146.400000113
73Q20.9Very low26Very low195 Ų195128.8 Ų128.891%0.91173%0.726SS**  trans49.2110.8143.6-61.9178.1-15.300120.8
74G24Very low27.4Very low80 Ų80124.1 Ų124.183%0.82570%0.697SS**  87.496.213000000118.3
75E21.1Very low28.7Very low192 Ų192119.3 Ų119.390%0.89767%0.673SS**  trans-141.5130.2152.2-110175.3171.700109.6S77E75-S77 PolarHBondContact O-N 3.18Å
76D22.3Very low29.9Very low174 Ų174121.5 Ų121.593%0.9368%0.676SS**  trans-73.6115.4-163.8-73.9-60.5000112.9E78D76-E78 PolarHBondContact O-N 2.98Å
77S22.9Very low31.4Very low100 Ų100118.7 Ų118.770%0.69967%0.674SS**  trans-79.7115.6165.7-58.90000109.5E75E75-S77 PolarHBondContact O-N 3.18Å
78E25.8Very low33.2Very low182 Ų182114.2 Ų114.285%0.8565%0.645SS**  trans-42.3121.2172.4-87.2-87.2123.900110.9D76 D80D76-E78 PolarHBondContact O-N 2.98Å; E78-D80 PolarHBondContact O-N 2.96Å
79P27.8Very low35.7Very low106 Ų106107.9 Ų107.969%0.68862%0.622SS**  trans-71.8115.9-171.426.1-33.3000111.7Y81P79-Y81 PolarHBondContact O-N 3.07Å
80D39.4Very low38Very low68 Ų68106 Ų10636%0.36460%0.602SS.*  trans-49.999.9176.2-171.44.6000110.8E78 E82 G83 K174E78-D80 PolarHBondContact O-N 2.96Å; D80-E82 PolarHBondContact O-N 3.25Å; D80-E82 VanDerWaalsContact O-N 3.15Å; D80-G83 PolarHBondContact O-N 2.7Å; D80-K174 IonicContact OD2-NZ 3.92Å; D80-K174 PolarHBondContact OD2-NZ 3.02Å
81Y36.3Very low40.6Very low83 Ų83101.2 Ų101.233%0.32559%0.588SS.*THydrogen-bonded Turntrans-60.2-29.4-167.5174-102.9000113.2P79 Y278 W367 Y370P79-Y81 PolarHBondContact O-N 3.07Å; Y81-Y278 HydrophobicContact CD2-CE2 4.1Å; Y81-Y278 AromaticContact CE2-CE2 3.83Å; Y81-Y278 HydrophobicContact CE2-CE2 3.83Å; Y81-W367 PolarHBondContact OH-NE1 3.08Å; Y81-Y370 PolarHBondContact O-OH 2.8Å
82E42.3Very low42.9Very low137 Ų13795 Ų9564%0.6456%0.562SS**THydrogen-bonded Turntrans-85.5-7.2-179.6-57.8-170.8159.900113.3D80D80-E82 PolarHBondContact O-N 3.25Å; D80-E82 VanDerWaalsContact O-N 3.15Å
83G50.4Low45.3Very low23 Ų2392.3 Ų92.324%0.23753%0.534CS..SBendtrans-92.8140.4-179.500000114.3D80 Y370D80-G83 PolarHBondContact O-N 2.7Å; G83-Y370 PolarHBondContact O-OH 2.95Å; G83-Y370 VanDerWaalsContact O-OH 3.07Å
84L51.8Low48Very low25 Ų2585.8 Ų85.813%0.13151%0.505CS..SBendtrans-60.8151.9152.3-73.3175.2000109.3Q86 H93 A96 Y370 L377L84-Q86 PolarHBondContact O-N 2.86Å; L84-H93 HydrophobicContact CD1-CB 4.3Å; L84-A96 HydrophobicContact CD1-CB 4.34Å; L84-Y370 HydrophobicContact CD2-CE2 4.38Å; L84-L377 HydrophobicContact CD1-CD1 4.15Å; L84-L377 HydrophobicContact CD2-CD1 3.79Å
85P45.6Very low50.7Low36 Ų3687.6 Ų87.623%0.23449%0.494CS..PPolyproline II helixtrans-53.7134.2-169.418.4-32.5000113.4G87 A88P85-G87 PolarHBondContact O-N 3.27Å; P85-A88 PolarHBondContact O-N 2.74Å; P85-A88 VanDerWaalsContact O-N 3.14Å
86Q45.8Very low53.2Low165 Ų16579 Ų7977%0.77146%0.456SS*.THydrogen-bonded Turntrans-55.7111.3-179.7-63.2-1775.400109.9L84L84-Q86 PolarHBondContact O-N 2.86Å
87G50.6Low55.6Low74 Ų7471 Ų7176%0.76342%0.415SS*.THydrogen-bonded Turntrans123.2-7.7-176.200000115.6P85P85-G87 PolarHBondContact O-N 3.27Å
88A60.2Low58.3Low23 Ų2366.8 Ų66.819%0.1939%0.386CS..  trans-70.9142.9166.800000111.3P85 H93P85-A88 PolarHBondContact O-N 2.74Å; P85-A88 VanDerWaalsContact O-N 3.14Å; A88-H93 WeakPolarHBondContact CB-NE2 3.48Å
89S71.6Confident60.9Low67 Ų6761.3 Ų61.347%0.46937%0.365SS..  trans-70.2145.4177.6179.60000110.7S91 T92 H93S89-S91 PolarHBondContact O-N 3.38Å; S89-S91 PolarHBondContact OG-N 3.45Å; S89-S91 PolarHBondContact OG-OG 3.45Å; S89-S91 VanDerWaalsContact OG-OG 3.11Å; S89-T92 WeakPolarHBondContact O-CA 3.22Å; S89-T92 WeakPolarHBondContact O-CB 3.16Å; S89-T92 PolarHBondContact O-N 3.06Å; S89-H93 PolarHBondContact O-CD2 2.71Å; S89-H93 PolarHBondContact O-N 3.45Å; S89-H93 VanDerWaalsContact O-N 3.13Å
90T71.6Confident63.2Low51 Ų5157.2 Ų57.231%0.31334%0.34SS..Hα-helixtrans-50.3-33.4173.3-57.10000112.4T92 H93 M94 E171T90-T92 VanDerWaalsContact C-N 3.34Å; T90-T92 PolarHBondContact O-N 3.46Å; T90-H93 PolarHBondContact O-N 3.03Å; T90-M94 HydrophobicContact CG2-CG 4.46Å; T90-M94 HydrophobicContact CG2-SD 4.15Å; T90-M94 WeakPolarHBondContact O-CB 3.28Å; T90-M94 VanDerWaalsContact O-CG 3.23Å; T90-M94 WeakPolarHBondContact O-CG 3.34Å; T90-M94 PolarHBondContact O-N 3.45Å; T90-E171 WeakPolarHBondContact CA-OE1 3.35Å; T90-E171 WeakPolarHBondContact CB-OE2 3.46Å; T90-E171 WeakPolarHBondContact CG2-OE2 3.45Å; T90-E171 PolarHBondContact OG1-OE2 2.92Å
91S73.8Confident65Low76 Ų7654 Ų5453%0.53132%0.324SS..Hα-helixtrans-65.4-34.5174.561.40000113.3S89 L95S89-S91 PolarHBondContact O-N 3.38Å; S89-S91 PolarHBondContact OG-N 3.45Å; S89-S91 PolarHBondContact OG-OG 3.45Å; S89-S91 VanDerWaalsContact OG-OG 3.11Å; S91-L95 WeakPolarHBondContact O-CB 3.31Å; S91-L95 PolarHBondContact O-N 3.48Å
92T74.9Confident67.2Low47 Ų4752.7 Ų52.729%0.28832%0.321SS..Hα-helixtrans-69-42.2174.1-49.70000111S89 T90 L95 A96 L377S89-T92 WeakPolarHBondContact O-CA 3.22Å; S89-T92 WeakPolarHBondContact O-CB 3.16Å; S89-T92 PolarHBondContact O-N 3.06Å; T90-T92 VanDerWaalsContact C-N 3.34Å; T90-T92 PolarHBondContact O-N 3.46Å; T92-L95 PolarHBondContact O-N 2.96Å; T92-A96 VanDerWaalsContact O-CB 3.25Å; T92-A96 WeakPolarHBondContact O-CB 3.25Å; T92-A96 PolarHBondContact O-N 3.4Å; T92-L377 HydrophobicContact CG2-CD1 4.42Å; T92-L377 HydrophobicContact CG2-CD2 3.53Å
93H71.9Confident69.1Low34 Ų3449.4 Ų49.416%0.15731%0.307CS..Hα-helixtrans-61.5-47.9174.3-73.4-130.1000111.1L84 A88 S89 T90 L95 G97 E171L84-H93 HydrophobicContact CD1-CB 4.3Å; A88-H93 WeakPolarHBondContact CB-NE2 3.48Å; S89-H93 PolarHBondContact O-CD2 2.71Å; S89-H93 PolarHBondContact O-N 3.45Å; S89-H93 VanDerWaalsContact O-N 3.13Å; T90-H93 PolarHBondContact O-N 3.03Å; H93-L95 PolarHBondContact O-N 2.85Å; H93-G97 PolarHBondContact O-N 2.94Å; H93-E171 VanDerWaalsContact CB-OE1 3.25Å; H93-E171 WeakPolarHBondContact CB-OE1 3.5Å; H93-E171 IonicContact CD2-OE1 3.44Å; H93-E171 IonicContact CG-OE1 3.48Å; H93-E171 VanDerWaalsContact CG-OE1 3.29Å; H93-E171 IonicContact ND1-OE1 2.71Å; H93-E171 PolarHBondContact ND1-OE1 3.34Å
94M76.9Confident70.6Confident59 Ų5950.3 Ų50.329%0.29131%0.305SS..Hα-helixtrans-59.6-44.5176.3-70.4171.465.700112.6T90 A98 A164 F167 A168T90-M94 HydrophobicContact CG2-CG 4.46Å; T90-M94 HydrophobicContact CG2-SD 4.15Å; T90-M94 WeakPolarHBondContact O-CB 3.28Å; T90-M94 VanDerWaalsContact O-CG 3.23Å; T90-M94 WeakPolarHBondContact O-CG 3.34Å; T90-M94 PolarHBondContact O-N 3.45Å; M94-A98 VanDerWaalsContact O-CB 3.26Å; M94-A98 WeakPolarHBondContact O-CB 3.44Å; M94-A98 PolarHBondContact O-N 3.24Å; M94-A164 HydrophobicContact CE-CB 4.26Å; M94-F167 HydrophobicContact CG-CB 4.39Å; M94-A168 HydrophobicContact CE-CB 3.82Å; M94-A168 HydrophobicContact CG-CB 4.06Å; M94-A168 HydrophobicContact SD-CB 3.7Å
95L80.6Confident72.1Confident117 Ų11750.8 Ų50.861%0.61331%0.307SS*.Hα-helixtrans-70.2-46.8-179-179.161.7000112.1S91 T92 H93 G97 A98 V99S91-L95 WeakPolarHBondContact O-CB 3.31Å; S91-L95 PolarHBondContact O-N 3.48Å; T92-L95 PolarHBondContact O-N 2.96Å; H93-L95 PolarHBondContact O-N 2.85Å; L95-G97 VanDerWaalsContact C-N 3.33Å; L95-G97 PolarHBondContact O-N 3.26Å; L95-A98 PolarHBondContact O-N 2.76Å; L95-V99 HydrophobicContact CD1-CG2 4.31Å; L95-V99 WeakPolarHBondContact O-CG2 3.41Å; L95-V99 PolarHBondContact O-N 3.08Å
96A74.1Confident74Confident11 Ų1151.2 Ų51.29%0.09131%0.31CS..Hα-helixtrans-59.9-45.9176.600000110.6L84 T92 A98 V99 A100 F373 L377L84-A96 HydrophobicContact CD1-CB 4.34Å; T92-A96 VanDerWaalsContact O-CB 3.25Å; T92-A96 WeakPolarHBondContact O-CB 3.25Å; T92-A96 PolarHBondContact O-N 3.4Å; A96-A98 PolarHBondContact O-N 3.29Å; A96-V99 PolarHBondContact O-N 3.03Å; A96-A100 WeakPolarHBondContact O-CB 3.32Å; A96-A100 PolarHBondContact O-N 3.01Å; A96-F373 HydrophobicContact CB-CD1 4.11Å; A96-F373 HydrophobicContact CB-CG 4.49Å; A96-L377 HydrophobicContact CB-CD1 4.5Å
97G72.8Confident75.9Confident6 Ų647.9 Ų47.96%0.06230%0.297CS..Hα-helixtrans-60.8-40175.200000114.1H93 L95 G101H93-G97 PolarHBondContact O-N 2.94Å; L95-G97 VanDerWaalsContact C-N 3.33Å; L95-G97 PolarHBondContact O-N 3.26Å; G97-G101 PolarHBondContact O-N 2.65Å
98A79.9Confident77.5Confident12 Ų1244.7 Ų44.710%0.09926%0.262CS..Hα-helixtrans-66.2-44.9176.600000112.7M94 L95 A96 I102 A164M94-A98 VanDerWaalsContact O-CB 3.26Å; M94-A98 WeakPolarHBondContact O-CB 3.44Å; M94-A98 PolarHBondContact O-N 3.24Å; L95-A98 PolarHBondContact O-N 2.76Å; A96-A98 PolarHBondContact O-N 3.29Å; A98-I102 WeakPolarHBondContact O-CD1 3.32Å; A98-I102 VanDerWaalsContact O-CG1 3.26Å; A98-I102 WeakPolarHBondContact O-CG1 3.43Å; A98-I102 PolarHBondContact O-N 2.8Å; A98-A164 HydrophobicContact CB-CB 4.41Å
99V81.6Confident78.8Confident67 Ų6743.6 Ų43.641%0.40625%0.253SS..Hα-helixtrans-69.8-38177.6-174.40000110.9L95 A96 I102 M103 F373L95-V99 HydrophobicContact CD1-CG2 4.31Å; L95-V99 WeakPolarHBondContact O-CG2 3.41Å; L95-V99 PolarHBondContact O-N 3.08Å; A96-V99 PolarHBondContact O-N 3.03Å; V99-I102 PolarHBondContact O-N 3.21Å; V99-M103 WeakPolarHBondContact O-CB 3.24Å; V99-M103 PolarHBondContact O-N 3.21Å; V99-F373 HydrophobicContact CB-CE1 4.32Å; V99-F373 HydrophobicContact CB-CZ 3.73Å; V99-F373 HydrophobicContact CG1-CE1 4.44Å; V99-F373 HydrophobicContact CG1-CZ 3.65Å
100A75.3Confident79.5Confident20 Ų2042.1 Ų42.117%0.16524%0.242CC..Hα-helixtrans-57.5-51.7172.900000112.1A96 I102 M103 E104 V369 F373A96-A100 WeakPolarHBondContact O-CB 3.32Å; A96-A100 PolarHBondContact O-N 3.01Å; A100-I102 PolarHBondContact O-N 3.16Å; A100-M103 PolarHBondContact O-N 3.24Å; A100-M103 VanDerWaalsContact O-N 3.14Å; A100-E104 PolarHBondContact O-N 3.45Å; A100-V369 HydrophobicContact CB-CG1 3.47Å; A100-V369 VanDerWaalsContact CB-CG1 3.47Å; A100-F373 HydrophobicContact CB-CD2 3.95Å; A100-F373 HydrophobicContact CB-CE2 3.83Å
101G76.2Confident80.2Confident2 Ų241.7 Ų41.72%0.02124%0.237CC..Hα-helixtrans-63.5-38179.100000114.2G97 H105 H163G97-G101 PolarHBondContact O-N 2.65Å; G101-H105 WeakPolarHBondContact O-CB 3.41Å; G101-H105 PolarHBondContact O-CD2 3.49Å; G101-H105 VanDerWaalsContact O-CD2 3.28Å; G101-H105 PolarHBondContact O-N 2.9Å; G101-H163 VanDerWaalsContact CA-CD2 3.47Å; G101-H163 WeakPolarHBondContact CA-CD2 3.48Å; G101-H163 WeakPolarHBondContact CA-NE2 3.48Å
102I83.8Confident80.7Confident54 Ų5439.5 Ų39.528%0.27722%0.219SC..Hα-helixtrans-61.8-46.5171.8-68.5162000110.2A98 V99 A100 H105 C106 A156 A159A98-I102 WeakPolarHBondContact O-CD1 3.32Å; A98-I102 VanDerWaalsContact O-CG1 3.26Å; A98-I102 WeakPolarHBondContact O-CG1 3.43Å; A98-I102 PolarHBondContact O-N 2.8Å; V99-I102 PolarHBondContact O-N 3.21Å; A100-I102 PolarHBondContact O-N 3.16Å; I102-H105 PolarHBondContact O-N 3.39Å; I102-C106 WeakPolarHBondContact O-CB 3.32Å; I102-C106 PolarHBondContact O-N 3.46Å; I102-C106 PolarHBondContact O-SG 2.93Å; I102-A156 HydrophobicContact CG2-CB 4.44Å; I102-A159 HydrophobicContact CG1-CB 3.9Å
103M82.2Confident81.3Confident68 Ų6837.3 Ų37.334%0.33521%0.206SC..Hα-helixtrans-65.1-43.3-178.9-173149.866.800112.2V99 A100 C106 L107 V369 F373V99-M103 WeakPolarHBondContact O-CB 3.24Å; V99-M103 PolarHBondContact O-N 3.21Å; A100-M103 PolarHBondContact O-N 3.24Å; A100-M103 VanDerWaalsContact O-N 3.14Å; M103-C106 PolarHBondContact O-N 3.19Å; M103-L107 HydrophobicContact CG-CD1 4Å; M103-L107 VanDerWaalsContact O-CG 3.31Å; M103-L107 WeakPolarHBondContact O-CG 3.4Å; M103-L107 PolarHBondContact O-N 3.06Å; M103-V369 HydrophobicContact CE-CB 4.49Å; M103-V369 HydrophobicContact CE-CG1 3.99Å; M103-V369 HydrophobicContact CE-CG2 4Å; M103-V369 HydrophobicContact CG-CG2 4.41Å; M103-F373 HydrophobicContact CE-CE2 4.09Å
104E80.7Confident82Confident43 Ų4335.7 Ų35.720%0.20120%0.199CC..Hα-helixtrans-57.2-53.3174.1-178179.1143.300111.3A100 C106 L107 M108 I365 S366A100-E104 PolarHBondContact O-N 3.45Å; E104-C106 VanDerWaalsContact C-N 3.28Å; E104-C106 PolarHBondContact O-N 3.2Å; E104-L107 PolarHBondContact O-N 2.87Å; E104-M108 HydrophobicContact CG-CG 4.44Å; E104-M108 WeakPolarHBondContact O-CB 3.38Å; E104-M108 PolarHBondContact O-N 3.39Å; E104-I365 HydrophobicContact CB-CG2 4.42Å; E104-I365 HydrophobicContact CG-CG2 4.19Å; E104-S366 PolarHBondContact OE1-OG 3.17Å; E104-S366 WeakPolarHBondContact OE2-CB 3.35Å; E104-S366 PolarHBondContact OE2-OG 2.66Å
105H83.6Confident82.3Confident35 Ų3534.8 Ų34.816%0.16219%0.193CC..Hα-helixtrans-63.9-31.2179.9-78.2-44.6000113.6G101 I102 F109 T155 H163G101-H105 WeakPolarHBondContact O-CB 3.41Å; G101-H105 PolarHBondContact O-CD2 3.49Å; G101-H105 VanDerWaalsContact O-CD2 3.28Å; G101-H105 PolarHBondContact O-N 2.9Å; I102-H105 PolarHBondContact O-N 3.39Å; H105-F109 WeakPolarHBondContact O-CB 3.41Å; H105-F109 PolarHBondContact O-N 2.91Å; H105-F109 VanDerWaalsContact O-N 3.16Å; H105-T155 HydrophobicContact CB-CG2 3.88Å; H105-H163 AromaticContact CD2-CE1 3.78Å; H105-H163 AromaticContact NE2-CE1 3.54Å
106C86.7Confident82.5Confident45 Ų4529.6 Ų29.630%0.30417%0.166SC..Hα-helixtrans-67.4-44.8173.2-750000112.1I102 M103 E104 F109 L152I102-C106 WeakPolarHBondContact O-CB 3.32Å; I102-C106 PolarHBondContact O-N 3.46Å; I102-C106 PolarHBondContact O-SG 2.93Å; M103-C106 PolarHBondContact O-N 3.19Å; E104-C106 VanDerWaalsContact C-N 3.28Å; E104-C106 PolarHBondContact O-N 3.2Å; C106-F109 WeakPolarHBondContact O-CB 3.46Å; C106-F109 PolarHBondContact O-N 2.97Å; C106-L152 HydrophobicContact CB-CD1 4.33Å
107L84.4Confident83Confident95 Ų9529.4 Ų29.450%0.49716%0.163SC..Hα-helixtrans-70-40.3-179.8-68.8170.4000112.1M103 E104 F109 P110 I365M103-L107 HydrophobicContact CG-CD1 4Å; M103-L107 VanDerWaalsContact O-CG 3.31Å; M103-L107 WeakPolarHBondContact O-CG 3.4Å; M103-L107 PolarHBondContact O-N 3.06Å; E104-L107 PolarHBondContact O-N 2.87Å; L107-F109 VanDerWaalsContact C-N 3.3Å; L107-F109 PolarHBondContact O-N 2.89Å; L107-P110 WeakPolarHBondContact O-CD 3.26Å; L107-I365 HydrophobicContact CB-CD1 4.21Å; L107-I365 HydrophobicContact CB-CG2 4.35Å; L107-I365 HydrophobicContact CD1-CG2 3.84Å
108M83.8Confident83.3Confident7 Ų730.5 Ų30.53%0.03417%0.167CC..Hα-helixtrans-77.6-10.3177.9-70.8-67.6-76.600113.6E104 I111 D112 P361 I365E104-M108 HydrophobicContact CG-CG 4.44Å; E104-M108 WeakPolarHBondContact O-CB 3.38Å; E104-M108 PolarHBondContact O-N 3.39Å; M108-I111 HydrophobicContact CE-CG2 4.3Å; M108-I111 WeakPolarHBondContact O-CA 3.16Å; M108-I111 VanDerWaalsContact O-CB 3.31Å; M108-I111 WeakPolarHBondContact O-CB 3.4Å; M108-I111 PolarHBondContact O-N 3.48Å; M108-I111 HydrophobicContact SD-CD1 4Å; M108-D112 PolarHBondContact O-N 3.49Å; M108-P361 HydrophobicContact SD-CB 4.35Å; M108-I365 HydrophobicContact CG-CD1 4.06Å; M108-I365 HydrophobicContact SD-CD1 3.67Å
109F87.8Confident83.2Confident0 Ų030 Ų300%016%0.163CC..Hα-helixtrans-56.1-43.6-171.8-155.9-88.3000115.9H105 C106 L107 I111 D112 C113 P148 L149 G151 L152 T155 K214 Q218H105-F109 WeakPolarHBondContact O-CB 3.41Å; H105-F109 PolarHBondContact O-N 2.91Å; H105-F109 VanDerWaalsContact O-N 3.16Å; C106-F109 WeakPolarHBondContact O-CB 3.46Å; C106-F109 PolarHBondContact O-N 2.97Å; L107-F109 VanDerWaalsContact C-N 3.3Å; L107-F109 PolarHBondContact O-N 2.89Å; F109-I111 PolarHBondContact O-N 2.79Å; F109-D112 PolarHBondContact O-N 3.02Å; F109-C113 PolarHBondContact O-N 3.42Å; F109-C113 VanDerWaalsContact O-N 3.14Å; F109-P148 WeakPolarHBondContact CD1-O 3.29Å; F109-P148 WeakPolarHBondContact CE1-O 3.43Å; F109-L149 HydrophobicContact CB-CD2 4.45Å; F109-L149 HydrophobicContact CD1-CD2 4.28Å; F109-G151 VanDerWaalsContact CZ-C 3.42Å; F109-L152 HydrophobicContact CB-CD1 3.94Å; F109-L152 HydrophobicContact CD1-CB 4.25Å; F109-L152 HydrophobicContact CD1-CD1 4.46Å; F109-L152 HydrophobicContact CD2-CB 4.31Å; F109-L152 HydrophobicContact CD2-CD1 3.64Å; F109-L152 HydrophobicContact CE1-CB 4.19Å; F109-L152 HydrophobicContact CE2-CB 4.28Å; F109-L152 HydrophobicContact CE2-CD1 4.31Å; F109-L152 HydrophobicContact CG-CB 4.31Å; F109-L152 HydrophobicContact CG-CD1 3.74Å; F109-L152 HydrophobicContact CZ-CB 4.23Å; F109-T155 HydrophobicContact CD2-CG2 4.47Å; F109-T155 HydrophobicContact CE2-CG2 4.4Å; F109-T155 WeakPolarHBondContact CE2-OG1 3.48Å; F109-K214 HydrophobicContact CE2-CD 4.08Å; F109-K214 HydrophobicContact CE2-CG 3.89Å; F109-K214 HydrophobicContact CZ-CG 4.04Å; F109-Q218 HydrophobicContact CE1-CG 4.48Å; F109-Q218 HydrophobicContact CZ-CG 4.47Å; F109-Q218 VanDerWaalsContact CZ-NE2 3.27Å
110P88Confident83Confident35 Ų3527.1 Ų27.123%0.22715%0.145CC..Hα-helixtrans-64.7-32.3177.2-19.532.8000112.6L107 V114 L136 P148 L149L107-P110 WeakPolarHBondContact O-CD 3.26Å; P110-V114 PolarHBondContact O-N 2.92Å; P110-L136 HydrophobicContact CB-CD1 4.46Å; P110-P148 HydrophobicContact CB-CB 3.99Å; P110-L149 HydrophobicContact CG-CD2 3.9Å
111I84.8Confident82.3Confident43 Ų4327 Ų2722%0.22114%0.141CC..Hα-helixtrans-74.3-43.6-178.3-59.1-177.6000109.5M108 F109 C113 V114 K115 Y358M108-I111 HydrophobicContact CE-CG2 4.3Å; M108-I111 WeakPolarHBondContact O-CA 3.16Å; M108-I111 VanDerWaalsContact O-CB 3.31Å; M108-I111 WeakPolarHBondContact O-CB 3.4Å; M108-I111 PolarHBondContact O-N 3.48Å; M108-I111 HydrophobicContact SD-CD1 4Å; F109-I111 PolarHBondContact O-N 2.79Å; I111-C113 VanDerWaalsContact C-N 3.31Å; I111-C113 PolarHBondContact O-N 3.21Å; I111-V114 WeakPolarHBondContact O-CB 3.22Å; I111-V114 PolarHBondContact O-N 2.71Å; I111-V114 VanDerWaalsContact O-N 3.12Å; I111-K115 PolarHBondContact O-N 2.86Å; I111-Y358 HydrophobicContact CB-CE1 4.49Å; I111-Y358 HydrophobicContact CG2-CD1 3.13Å; I111-Y358 HydrophobicContact CG2-CD2 4.32Å; I111-Y358 HydrophobicContact CG2-CE1 3.13Å; I111-Y358 HydrophobicContact CG2-CE2 4.34Å; I111-Y358 HydrophobicContact CG2-CG 3.77Å; I111-Y358 PolarHBondContact O-OH 3.04Å
112D84.6Confident81.5Confident29 Ų2930.7 Ų30.716%0.15516%0.159CC..Hα-helixtrans-59.3-39.2172.6-74.8-28.9000112.9M108 F109 V114 K115 T116 K214M108-D112 PolarHBondContact O-N 3.49Å; F109-D112 PolarHBondContact O-N 3.02Å; D112-V114 VanDerWaalsContact C-N 3.25Å; D112-V114 PolarHBondContact O-N 3.49Å; D112-K115 WeakPolarHBondContact O-CA 3.29Å; D112-K115 VanDerWaalsContact O-CB 3.25Å; D112-K115 WeakPolarHBondContact O-CB 3.27Å; D112-K115 PolarHBondContact O-N 3.26Å; D112-T116 PolarHBondContact O-N 2.97Å; D112-T116 PolarHBondContact O-OG1 3.48Å; D112-K214 IonicContact OD2-NZ 3.98Å; D112-K214 PolarHBondContact OD2-NZ 2.93Å
113C87.3Confident80.3Confident1 Ų130.9 Ų30.91%0.00716%0.163CC..Hα-helixtrans-58.9-39.9175.9-173.30000111.7F109 I111 R117 P148 Q218F109-C113 PolarHBondContact O-N 3.42Å; F109-C113 VanDerWaalsContact O-N 3.14Å; I111-C113 VanDerWaalsContact C-N 3.31Å; I111-C113 PolarHBondContact O-N 3.21Å; C113-R117 WeakPolarHBondContact O-CB 3.38Å; C113-R117 WeakPolarHBondContact O-CG 3.34Å; C113-R117 PolarHBondContact O-N 3.23Å; C113-R117 VanDerWaalsContact O-N 3.13Å; C113-P148 HydrophobicContact CB-CB 4.2Å; C113-Q218 HydrophobicContact CB-CG 4.12Å
114V87.2Confident79.3Confident1 Ų129.2 Ų29.21%0.00616%0.155CC..Hα-helixtrans-67.3-42.2173.2-179.40000110.9P110 I111 D112 R117 M118 V132 A135 L136 I139 Y358P110-V114 PolarHBondContact O-N 2.92Å; I111-V114 WeakPolarHBondContact O-CB 3.22Å; I111-V114 PolarHBondContact O-N 2.71Å; I111-V114 VanDerWaalsContact O-N 3.12Å; D112-V114 VanDerWaalsContact C-N 3.25Å; D112-V114 PolarHBondContact O-N 3.49Å; V114-R117 PolarHBondContact O-N 2.94Å; V114-M118 HydrophobicContact CG1-CG 4.16Å; V114-M118 HydrophobicContact CG1-SD 3.81Å; V114-M118 WeakPolarHBondContact O-CB 3.42Å; V114-M118 WeakPolarHBondContact O-CG 3.47Å; V114-M118 PolarHBondContact O-N 2.91Å; V114-V132 HydrophobicContact CG1-CG1 4.4Å; V114-A135 HydrophobicContact CG1-CB 3.57Å; V114-L136 HydrophobicContact CG2-CB 3.88Å; V114-L136 HydrophobicContact CG2-CD1 4Å; V114-I139 HydrophobicContact CG2-CD1 4.03Å; V114-Y358 WeakPolarHBondContact CB-OH 3.2Å; V114-Y358 WeakPolarHBondContact CG1-OH 3.38Å
115K84.1Confident78.1Confident40 Ų4033.6 Ų33.617%0.17419%0.188CC..Hα-helixtrans-51.9-58.4174.6-164.2-163.6172.6-159.70111.1I111 D112 R117 M118 Q119 D302 Y358I111-K115 PolarHBondContact O-N 2.86Å; D112-K115 WeakPolarHBondContact O-CA 3.29Å; D112-K115 VanDerWaalsContact O-CB 3.25Å; D112-K115 WeakPolarHBondContact O-CB 3.27Å; D112-K115 PolarHBondContact O-N 3.26Å; K115-R117 VanDerWaalsContact C-N 3.3Å; K115-R117 PolarHBondContact O-N 3.46Å; K115-M118 PolarHBondContact O-N 3.33Å; K115-M118 VanDerWaalsContact O-N 3.16Å; K115-Q119 VanDerWaalsContact CE-OE1 3.25Å; K115-Q119 WeakPolarHBondContact O-CG 3.37Å; K115-Q119 PolarHBondContact O-N 2.85Å; K115-D302 WeakPolarHBondContact CE-OD2 3.43Å; K115-D302 IonicContact NZ-OD1 2.65Å; K115-D302 PolarHBondContact NZ-OD1 3.25Å; K115-D302 IonicContact NZ-OD2 3.43Å; K115-D302 PolarHBondContact NZ-OD2 3Å; K115-Y358 HydrophobicContact CB-CD2 4.05Å; K115-Y358 HydrophobicContact CB-CE2 3.44Å; K115-Y358 VanDerWaalsContact CB-CE2 3.44Å; K115-Y358 HydrophobicContact CD-CD2 4.42Å; K115-Y358 HydrophobicContact CG-CD2 4Å; K115-Y358 HydrophobicContact CG-CE2 3.72Å; K115-Y358 PolarHBondContact N-OH 3.47Å
116T84.1Confident76.6Confident7 Ų735.6 Ų35.64%0.04321%0.21CC..Hα-helixtrans-60.3-39.2-177.3-62.10000111.8D112 Q119 S120 Q215 M219 T306 T310D112-T116 PolarHBondContact O-N 2.97Å; D112-T116 PolarHBondContact O-OG1 3.48Å; T116-Q119 PolarHBondContact O-N 3.37Å; T116-S120 PolarHBondContact O-N 3.48Å; T116-Q215 HydrophobicContact CG2-CB 4.09Å; T116-Q215 HydrophobicContact CG2-CG 4.2Å; T116-M219 HydrophobicContact CG2-SD 4.08Å; T116-T306 HydrophobicContact CG2-CG2 4.44Å; T116-T310 HydrophobicContact CG2-CG2 4.47Å
117R83.5Confident75.1Confident7 Ų733.8 Ų33.83%0.02620%0.199CC..Hα-helixtrans-71.2-31177.4-75.2172.8165.4-123.53.2114.5C113 V114 K115 S120 Y129 I139 E143 Q218C113-R117 WeakPolarHBondContact O-CB 3.38Å; C113-R117 WeakPolarHBondContact O-CG 3.34Å; C113-R117 PolarHBondContact O-N 3.23Å; C113-R117 VanDerWaalsContact O-N 3.13Å; V114-R117 PolarHBondContact O-N 2.94Å; K115-R117 VanDerWaalsContact C-N 3.3Å; K115-R117 PolarHBondContact O-N 3.46Å; R117-S120 WeakPolarHBondContact O-CB 3.19Å; R117-Y129 HydrophobicContact CB-CE2 4.34Å; R117-I139 VanDerWaalsContact CD-CD1 3.49Å; R117-E143 IonicContact CZ-OE1 2.66Å; R117-E143 VanDerWaalsContact CZ-OE1 3.27Å; R117-E143 IonicContact CZ-OE2 2.67Å; R117-E143 IonicContact NH1-OE1 2.71Å; R117-E143 PolarHBondContact NH1-OE1 3.16Å; R117-E143 IonicContact NH2-OE1 3.19Å; R117-E143 PolarHBondContact NH2-OE1 3.25Å; R117-E143 IonicContact NH2-OE2 2.74Å; R117-E143 PolarHBondContact NH2-OE2 3.5Å; R117-Q218 PolarHBondContact NE-O 3.45Å; R117-Q218 PolarHBondContact NH2-O 3.14Å
118M80.1Confident74.1Confident29 Ų2939.7 Ų39.714%0.14321%0.214CC..Hα-helixtrans-79.5-21.8174.4-70.3-174.975.200113V114 K115 Y129 V132 A135 A354V114-M118 HydrophobicContact CG1-CG 4.16Å; V114-M118 HydrophobicContact CG1-SD 3.81Å; V114-M118 WeakPolarHBondContact O-CB 3.42Å; V114-M118 WeakPolarHBondContact O-CG 3.47Å; V114-M118 PolarHBondContact O-N 2.91Å; K115-M118 PolarHBondContact O-N 3.33Å; K115-M118 VanDerWaalsContact O-N 3.16Å; M118-Y129 HydrophobicContact CG-CD2 4.18Å; M118-Y129 HydrophobicContact CG-CG 4.49Å; M118-V132 HydrophobicContact SD-CG2 4.37Å; M118-A135 HydrophobicContact SD-CB 4.37Å; M118-A354 HydrophobicContact CE-CB 4.43Å; M118-A354 HydrophobicContact SD-CB 3.89Å
119Q78Confident73.5Confident3 Ų341.1 Ų41.11%0.01422%0.219CC..Hα-helixtrans-89.4-16.2175-70.5179.6-43.200113.5K115 T116 D302 T306K115-Q119 VanDerWaalsContact CE-OE1 3.25Å; K115-Q119 WeakPolarHBondContact O-CG 3.37Å; K115-Q119 PolarHBondContact O-N 2.85Å; T116-Q119 PolarHBondContact O-N 3.37Å; Q119-D302 PolarHBondContact NE2-OD2 3.44Å; Q119-T306 HydrophobicContact CB-CG2 4.03Å; Q119-T306 PolarHBondContact OE1-OG1 3.13Å
120S76.4Confident72.7Confident5 Ų548.4 Ų48.44%0.03525%0.251CS..  trans-50.8135.2168.6-177.60000111.7T116 R117 Q122 M219 E312T116-S120 PolarHBondContact O-N 3.48Å; R117-S120 WeakPolarHBondContact O-CB 3.19Å; S120-Q122 VanDerWaalsContact C-N 3.31Å; S120-Q122 PolarHBondContact OG-N 2.81Å; S120-Q122 PolarHBondContact OG-O 2.84Å; S120-M219 VanDerWaalsContact OG-CE 3.27Å; S120-M219 WeakPolarHBondContact OG-CE 3.13Å; S120-E312 VanDerWaalsContact CA-OE1 3.27Å; S120-E312 WeakPolarHBondContact CA-OE1 3.38Å; S120-E312 PolarHBondContact OG-OE1 3.15Å
121L60.5Low72.3Confident17 Ų1751.4 Ų51.49%0.08927%0.265CS..SBendtrans-75.1-26.1173.2-62.2-176000111.4P123 L307 E312 T315 V339 L342 K350L121-P123 VanDerWaalsContact C-CD 3.42Å; L121-P123 WeakPolarHBondContact O-CD 3.35Å; L121-L307 HydrophobicContact CD1-CD1 3.89Å; L121-L307 HydrophobicContact CD1-CD2 4.04Å; L121-L307 HydrophobicContact CD1-CG 4.49Å; L121-L307 HydrophobicContact CG-CD1 4.49Å; L121-E312 WeakPolarHBondContact CA-OE2 3.12Å; L121-E312 WeakPolarHBondContact CB-OE2 3.46Å; L121-E312 PolarHBondContact N-OE1 3.31Å; L121-E312 PolarHBondContact N-OE2 2.85Å; L121-T315 HydrophobicContact CB-CG2 4.34Å; L121-V339 HydrophobicContact CD1-CG2 4.33Å; L121-L342 HydrophobicContact CD1-CD1 3.76Å; L121-K350 HydrophobicContact CD2-CD 4.15Å; L121-K350 PolarHBondContact O-NZ 3.17Å
122Q59.8Low72.1Confident81 Ų8150.5 Ų50.538%0.37926%0.262SS..SBendtrans-100.284165.1-64.9-171.5-10.300112.2S120 E312 H314 T315S120-Q122 VanDerWaalsContact C-N 3.31Å; S120-Q122 PolarHBondContact OG-N 2.81Å; S120-Q122 PolarHBondContact OG-O 2.84Å; Q122-E312 PolarHBondContact N-OE2 3.19Å; Q122-H314 VanDerWaalsContact NE2-CB 3.32Å; Q122-T315 HydrophobicContact CG-CG2 3.52Å
123P59.6Low72.1Confident58 Ų5854 Ų5438%0.37728%0.278SS..  trans-62.5151.4154.730.3-33.2000109L121L121-P123 VanDerWaalsContact C-CD 3.42Å; L121-P123 WeakPolarHBondContact O-CD 3.35Å
124D60Low72.1Confident32 Ų3255.8 Ų55.817%0.17129%0.288CS..  trans-51.2132.9170.2159.521.6000109.5A126 A127 F220D124-A126 PolarHBondContact O-N 3.07Å; D124-A126 PolarHBondContact OD1-N 3.24Å; D124-A126 VanDerWaalsContact OD1-N 3.08Å; D124-A127 HydrophobicContact CB-CB 3.63Å; D124-A127 WeakPolarHBondContact O-CA 3.33Å; D124-A127 PolarHBondContact O-N 3.26Å; D124-F220 HydrophobicContact CB-CD1 3.81Å; D124-F220 HydrophobicContact CB-CD2 4.16Å; D124-F220 HydrophobicContact CB-CE1 3.62Å; D124-F220 HydrophobicContact CB-CE2 4Å; D124-F220 HydrophobicContact CB-CG 4.05Å; D124-F220 HydrophobicContact CB-CZ 3.72Å
125P55.9Low71.9Confident135 Ų13555.8 Ų55.888%0.87729%0.288SS*.THydrogen-bonded Turntrans-50.3-29.4179.5-30.535.9000115.2
126A53.1Low72.1Confident77 Ų7756 Ų5664%0.63629%0.291SS*.THydrogen-bonded Turntrans-86.2-19.317400000113.6D124 R128D124-A126 PolarHBondContact O-N 3.07Å; D124-A126 PolarHBondContact OD1-N 3.24Å; D124-A126 VanDerWaalsContact OD1-N 3.08Å; A126-R128 PolarHBondContact O-N 2.99Å
127A54.8Low72.3Confident7 Ų763.9 Ų63.96%0.05832%0.32CS..  trans-9466.1-173.900000113.1D124 Y129D124-A127 HydrophobicContact CB-CB 3.63Å; D124-A127 WeakPolarHBondContact O-CA 3.33Å; D124-A127 PolarHBondContact O-N 3.26Å; A127-Y129 HydrophobicContact CB-CD1 4.11Å; A127-Y129 HydrophobicContact CB-CD2 4.34Å; A127-Y129 HydrophobicContact CB-CE1 3.69Å; A127-Y129 HydrophobicContact CB-CE2 3.9Å; A127-Y129 HydrophobicContact CB-CG 4.44Å; A127-Y129 PolarHBondContact O-N 3.4Å
128R64Low72.4Confident220 Ų22067 Ų6783%0.8333%0.332SS*.  trans-66.383.6150-94.2-171.3172.2-167.6-1.2109A126 K130 R138A126-R128 PolarHBondContact O-N 2.99Å; R128-K130 PolarHBondContact O-N 3.19Å; R128-R138 PolarHBondContact O-NH1 3.31Å; R128-R138 PolarHBondContact O-NH2 3.35Å
129Y69.9Low72.7Confident36 Ų3665.6 Ų65.614%0.14133%0.325CS..  trans-61.2112.2168.9-61.9-52.2000109R117 M118 A127 A135 R138 I139R117-Y129 HydrophobicContact CB-CE2 4.34Å; M118-Y129 HydrophobicContact CG-CD2 4.18Å; M118-Y129 HydrophobicContact CG-CG 4.49Å; A127-Y129 HydrophobicContact CB-CD1 4.11Å; A127-Y129 HydrophobicContact CB-CD2 4.34Å; A127-Y129 HydrophobicContact CB-CE1 3.69Å; A127-Y129 HydrophobicContact CB-CE2 3.9Å; A127-Y129 HydrophobicContact CB-CG 4.44Å; A127-Y129 PolarHBondContact O-N 3.4Å; Y129-A135 HydrophobicContact CD1-CB 3.3Å; Y129-A135 HydrophobicContact CD2-CB 4.45Å; Y129-A135 HydrophobicContact CE1-CB 3.78Å; Y129-A135 HydrophobicContact CG-CB 3.67Å; Y129-R138 HydrophobicContact CE1-CB 4.42Å; Y129-I139 HydrophobicContact CE1-CG1 4.45Å
130K72.2Confident73.3Confident154 Ų15468 Ų6867%0.6734%0.34SS*.  trans-82.8-36.6179.2-62.5-178.8-179.8-179.80111.6R128 D134R128-K130 PolarHBondContact O-N 3.19Å; K130-D134 PolarHBondContact N-OD2 3.01Å
131N78Confident73.9Confident97 Ų9771.9 Ų71.952%0.51937%0.372SS..SBendtrans-145.2158.7-173.3-50.965.4000109.1M133 D134 A135N131-M133 VanDerWaalsContact C-N 3.33Å; N131-M133 PolarHBondContact O-N 3.15Å; N131-D134 HydrophobicContact CB-CB 4.16Å; N131-D134 PolarHBondContact O-N 3.09Å; N131-A135 PolarHBondContact O-N 2.99Å
132V81.9Confident75.1Confident25 Ų2575.8 Ų75.815%0.15240%0.396CS..Hα-helixtrans-48.4-51.5170.5165.80000112.6V114 M118 D134 A135 L136 A354 I357 Y358V114-V132 HydrophobicContact CG1-CG1 4.4Å; M118-V132 HydrophobicContact SD-CG2 4.37Å; V132-D134 PolarHBondContact O-N 3.28Å; V132-A135 WeakPolarHBondContact O-CB 3.41Å; V132-A135 PolarHBondContact O-N 3.44Å; V132-L136 PolarHBondContact O-N 3.44Å; V132-A354 HydrophobicContact CG2-CB 3.84Å; V132-I357 HydrophobicContact CG2-CD1 4.46Å; V132-Y358 HydrophobicContact CB-CE1 4.28Å; V132-Y358 HydrophobicContact CG1-CE1 3.52Å; V132-Y358 HydrophobicContact CG2-CE1 3.73Å; V132-Y358 WeakPolarHBondContact CG2-OH 3.27Å
133M84.4Confident76.3Confident102 Ų10274.1 Ų74.150%0.50239%0.389SS..Hα-helixtrans-69.7-34.5-175.2-172.660.165.500112.4N131 R137N131-M133 VanDerWaalsContact C-N 3.33Å; N131-M133 PolarHBondContact O-N 3.15Å; M133-R137 WeakPolarHBondContact O-CB 3.33Å; M133-R137 VanDerWaalsContact O-CG 3.25Å; M133-R137 WeakPolarHBondContact O-CG 3.47Å; M133-R137 PolarHBondContact O-N 3.36Å
134D85.8Confident77.6Confident38 Ų3872.9 Ų72.920%0.20339%0.386CS..Hα-helixtrans-64.5-43.7171.8170.344.8000110.4K130 N131 V132 R137 R138K130-D134 PolarHBondContact N-OD2 3.01Å; N131-D134 HydrophobicContact CB-CB 4.16Å; N131-D134 PolarHBondContact O-N 3.09Å; V132-D134 PolarHBondContact O-N 3.28Å; D134-R137 PolarHBondContact O-N 3.44Å; D134-R138 WeakPolarHBondContact O-CB 3.39Å; D134-R138 VanDerWaalsContact O-CG 3.32Å; D134-R138 WeakPolarHBondContact O-CG 3.45Å; D134-R138 PolarHBondContact O-N 2.69Å; D134-R138 IonicContact OD1-CZ 3.72Å; D134-R138 IonicContact OD1-NE 3.83Å; D134-R138 PolarHBondContact OD1-NE 3.14Å; D134-R138 IonicContact OD1-NH2 3.73Å; D134-R138 PolarHBondContact OD1-NH2 3.47Å; D134-R138 IonicContact OD2-CZ 2.68Å; D134-R138 IonicContact OD2-NE 3.35Å; D134-R138 PolarHBondContact OD2-NE 3.44Å; D134-R138 IonicContact OD2-NH2 3.94Å; D134-R138 PolarHBondContact OD2-NH2 3.41Å
135A84.6Confident79Confident1 Ų175.9 Ų75.91%0.00841%0.406CS..Hα-helixtrans-61.2-48.2174.900000113V114 M118 Y129 N131 V132 R137 R138 I139V114-A135 HydrophobicContact CG1-CB 3.57Å; M118-A135 HydrophobicContact SD-CB 4.37Å; Y129-A135 HydrophobicContact CD1-CB 3.3Å; Y129-A135 HydrophobicContact CD2-CB 4.45Å; Y129-A135 HydrophobicContact CE1-CB 3.78Å; Y129-A135 HydrophobicContact CG-CB 3.67Å; N131-A135 PolarHBondContact O-N 2.99Å; V132-A135 WeakPolarHBondContact O-CB 3.41Å; V132-A135 PolarHBondContact O-N 3.44Å; A135-R137 PolarHBondContact O-N 3.31Å; A135-R138 PolarHBondContact O-N 3.46Å; A135-I139 WeakPolarHBondContact O-CD1 3.09Å; A135-I139 WeakPolarHBondContact O-CG1 3.44Å; A135-I139 PolarHBondContact O-N 2.94Å
136L87.5Confident80.5Confident44 Ų4479 Ų7923%0.2340%0.4CS..Hα-helixtrans-58.7-48.1177.4-174.758.5000111.7P110 V114 V132 R138 I139 V140 P148P110-L136 HydrophobicContact CB-CD1 4.46Å; V114-L136 HydrophobicContact CG2-CB 3.88Å; V114-L136 HydrophobicContact CG2-CD1 4Å; V132-L136 PolarHBondContact O-N 3.44Å; L136-R138 PolarHBondContact O-N 2.89Å; L136-I139 PolarHBondContact O-N 3.34Å; L136-V140 HydrophobicContact CD1-CG2 4.43Å; L136-V140 WeakPolarHBondContact O-CG2 3.47Å; L136-V140 PolarHBondContact O-N 2.9Å; L136-P148 HydrophobicContact CD1-CB 4.49Å; L136-P148 HydrophobicContact CD1-CG 4.09Å
137R87.8Confident82.2Confident174 Ų17477.2 Ų77.266%0.65738%0.377SS*.Hα-helixtrans-58.8-45.2177.4-73.6173.2-170.5161.52.4111.9M133 D134 A135 V140 A141M133-R137 WeakPolarHBondContact O-CB 3.33Å; M133-R137 VanDerWaalsContact O-CG 3.25Å; M133-R137 WeakPolarHBondContact O-CG 3.47Å; M133-R137 PolarHBondContact O-N 3.36Å; D134-R137 PolarHBondContact O-N 3.44Å; A135-R137 PolarHBondContact O-N 3.31Å; R137-V140 PolarHBondContact O-N 3.19Å; R137-A141 VanDerWaalsContact O-CB 3.28Å; R137-A141 WeakPolarHBondContact O-CB 3.38Å; R137-A141 PolarHBondContact O-N 3.49Å
138R86.6Confident83.7Confident72 Ų7277.1 Ų77.127%0.27238%0.375SS..Hα-helixtrans-63.4-46.3178-71.8-173.2-155.2-172.220.5111.9R128 Y129 D134 A135 L136 V140 A141 T142R128-R138 PolarHBondContact O-NH1 3.31Å; R128-R138 PolarHBondContact O-NH2 3.35Å; Y129-R138 HydrophobicContact CE1-CB 4.42Å; D134-R138 WeakPolarHBondContact O-CB 3.39Å; D134-R138 VanDerWaalsContact O-CG 3.32Å; D134-R138 WeakPolarHBondContact O-CG 3.45Å; D134-R138 PolarHBondContact O-N 2.69Å; D134-R138 IonicContact OD1-CZ 3.72Å; D134-R138 IonicContact OD1-NE 3.83Å; D134-R138 PolarHBondContact OD1-NE 3.14Å; D134-R138 IonicContact OD1-NH2 3.73Å; D134-R138 PolarHBondContact OD1-NH2 3.47Å; D134-R138 IonicContact OD2-CZ 2.68Å; D134-R138 IonicContact OD2-NE 3.35Å; D134-R138 PolarHBondContact OD2-NE 3.44Å; D134-R138 IonicContact OD2-NH2 3.94Å; D134-R138 PolarHBondContact OD2-NH2 3.41Å; A135-R138 PolarHBondContact O-N 3.46Å; L136-R138 PolarHBondContact O-N 2.89Å; R138-V140 VanDerWaalsContact C-N 3.32Å; R138-V140 PolarHBondContact O-N 3.16Å; R138-A141 PolarHBondContact O-N 3.34Å; R138-A141 VanDerWaalsContact O-N 3.16Å; R138-T142 WeakPolarHBondContact O-CG2 3.21Å; R138-T142 PolarHBondContact O-N 2.68Å; R138-T142 PolarHBondContact O-OG1 2.89Å
139I86.9Confident85Confident0 Ų069.3 Ų69.30%035%0.35CS..Hα-helixtrans-58.6-44.8178.5-64.9160.6000110.9V114 R117 Y129 A135 L136 E143 R147 P148V114-I139 HydrophobicContact CG2-CD1 4.03Å; R117-I139 VanDerWaalsContact CD-CD1 3.49Å; Y129-I139 HydrophobicContact CE1-CG1 4.45Å; A135-I139 WeakPolarHBondContact O-CD1 3.09Å; A135-I139 WeakPolarHBondContact O-CG1 3.44Å; A135-I139 PolarHBondContact O-N 2.94Å; L136-I139 PolarHBondContact O-N 3.34Å; I139-E143 WeakPolarHBondContact O-CB 3.44Å; I139-E143 PolarHBondContact O-N 3.41Å; I139-R147 HydrophobicContact CG2-CB 4.3Å; I139-R147 HydrophobicContact CG2-CG 4.35Å; I139-P148 HydrophobicContact CG2-CG 4.08Å
140V89.9Confident85.8Confident54 Ų5471.3 Ų71.333%0.32736%0.357SS..Hα-helixtrans-65.2-39.9177.2169.10000111.6L136 R137 R138 G144 V145 P148L136-V140 HydrophobicContact CD1-CG2 4.43Å; L136-V140 WeakPolarHBondContact O-CG2 3.47Å; L136-V140 PolarHBondContact O-N 2.9Å; R137-V140 PolarHBondContact O-N 3.19Å; R138-V140 VanDerWaalsContact C-N 3.32Å; R138-V140 PolarHBondContact O-N 3.16Å; V140-G144 CarbonylContact O-C 3.58Å; V140-G144 WeakPolarHBondContact O-CA 3.41Å; V140-G144 PolarHBondContact O-N 2.95Å; V140-G144 VanDerWaalsContact O-N 3.07Å; V140-V145 HydrophobicContact CG1-CB 4.21Å; V140-V145 HydrophobicContact CG1-CG2 4.47Å; V140-P148 HydrophobicContact CG2-CG 4.13Å
141A88.1Confident86.5Confident86 Ų8664.3 Ų64.371%0.71133%0.329SS*.Hα-helixtrans-73.8-34.4-179.400000114.1R137 R138R137-A141 VanDerWaalsContact O-CB 3.28Å; R137-A141 WeakPolarHBondContact O-CB 3.38Å; R137-A141 PolarHBondContact O-N 3.49Å; R138-A141 PolarHBondContact O-N 3.34Å; R138-A141 VanDerWaalsContact O-N 3.16Å
142T85.9Confident87Confident99 Ų9961.5 Ų61.561%0.60731%0.313SS*.Hα-helixtrans-95.8-29.3-176.2610000114R138R138-T142 WeakPolarHBondContact O-CG2 3.21Å; R138-T142 PolarHBondContact O-N 2.68Å; R138-T142 PolarHBondContact O-OG1 2.89Å
143E85Confident87.4Confident46 Ų4665.8 Ų65.822%0.21534%0.336CS..Hα-helixtrans-123-1.9-175.5-65.8176.1-104.100113.8R117 I139 R147 F220R117-E143 IonicContact CZ-OE1 2.66Å; R117-E143 VanDerWaalsContact CZ-OE1 3.27Å; R117-E143 IonicContact CZ-OE2 2.67Å; R117-E143 IonicContact NH1-OE1 2.71Å; R117-E143 PolarHBondContact NH1-OE1 3.16Å; R117-E143 IonicContact NH2-OE1 3.19Å; R117-E143 PolarHBondContact NH2-OE1 3.25Å; R117-E143 IonicContact NH2-OE2 2.74Å; R117-E143 PolarHBondContact NH2-OE2 3.5Å; I139-E143 WeakPolarHBondContact O-CB 3.44Å; I139-E143 PolarHBondContact O-N 3.41Å; E143-R147 HydrophobicContact CB-CB 3.89Å; E143-R147 HydrophobicContact CB-CG 3.54Å; E143-R147 HydrophobicContact CG-CG 4.44Å; E143-R147 IonicContact OE2-CZ 3.57Å; E143-R147 IonicContact OE2-NE 2.7Å; E143-R147 PolarHBondContact OE2-NE 2.88Å; E143-R147 IonicContact OE2-NH2 3.56Å; E143-R147 PolarHBondContact OE2-NH2 2.92Å; E143-F220 WeakPolarHBondContact OE1-CD2 3.42Å
144G87.4Confident87.7Confident31 Ų3161.5 Ų61.532%0.3232%0.316SS..  trans94.9156.2174.100000115V140 W146 R147V140-G144 CarbonylContact O-C 3.58Å; V140-G144 WeakPolarHBondContact O-CA 3.41Å; V140-G144 PolarHBondContact O-N 2.95Å; V140-G144 VanDerWaalsContact O-N 3.07Å; G144-W146 VanDerWaalsContact C-N 3.25Å; G144-W146 PolarHBondContact O-N 2.74Å; G144-R147 VanDerWaalsContact O-CB 3.22Å; G144-R147 WeakPolarHBondContact O-CB 3.5Å; G144-R147 PolarHBondContact O-N 2.67Å
145V89.5Confident87.7Confident96 Ų9659.7 Ų59.758%0.58231%0.306SS*.THydrogen-bonded Turntrans-58.7-30.3-174.867.70000114.4V140 R147 P148V140-V145 HydrophobicContact CG1-CB 4.21Å; V140-V145 HydrophobicContact CG1-CG2 4.47Å; V145-R147 VanDerWaalsContact C-N 3.33Å; V145-P148 WeakPolarHBondContact O-CD 3.22Å
146W87.9Confident87.9Confident201 Ų20161 Ų6176%0.76132%0.317SS*.THydrogen-bonded Turntrans-81.3-10.2178.3-61.6106.8000113.8G144 L149G144-W146 VanDerWaalsContact C-N 3.25Å; G144-W146 PolarHBondContact O-N 2.74Å; W146-L149 HydrophobicContact CE3-CD1 3.86Å; W146-L149 HydrophobicContact CZ3-CD1 3.98Å; W146-L149 PolarHBondContact O-N 3.28Å
147R87.4Confident88Confident39 Ų3965.2 Ų65.215%0.14734%0.338CS..G310 helixtrans-62.7-43.1-174.9-16373.4158.8124.92.7113.9I139 E143 G144 V145 L149 R150I139-R147 HydrophobicContact CG2-CB 4.3Å; I139-R147 HydrophobicContact CG2-CG 4.35Å; E143-R147 HydrophobicContact CB-CB 3.89Å; E143-R147 HydrophobicContact CB-CG 3.54Å; E143-R147 HydrophobicContact CG-CG 4.44Å; E143-R147 IonicContact OE2-CZ 3.57Å; E143-R147 IonicContact OE2-NE 2.7Å; E143-R147 PolarHBondContact OE2-NE 2.88Å; E143-R147 IonicContact OE2-NH2 3.56Å; E143-R147 PolarHBondContact OE2-NH2 2.92Å; G144-R147 VanDerWaalsContact O-CB 3.22Å; G144-R147 WeakPolarHBondContact O-CB 3.5Å; G144-R147 PolarHBondContact O-N 2.67Å; V145-R147 VanDerWaalsContact C-N 3.33Å; R147-L149 PolarHBondContact O-N 3.47Å; R147-R150 WeakPolarHBondContact O-CB 3.48Å; R147-R150 PolarHBondContact O-N 3.43Å
148P87.8Confident87.9Confident4 Ų457.6 Ų57.63%0.02632%0.315CS..G310 helixtrans-61.4-26.1178.7-23.435.7000113.5F109 P110 C113 L136 I139 V140 V145 R150F109-P148 WeakPolarHBondContact CD1-O 3.29Å; F109-P148 WeakPolarHBondContact CE1-O 3.43Å; P110-P148 HydrophobicContact CB-CB 3.99Å; C113-P148 HydrophobicContact CB-CB 4.2Å; L136-P148 HydrophobicContact CD1-CB 4.49Å; L136-P148 HydrophobicContact CD1-CG 4.09Å; I139-P148 HydrophobicContact CG2-CG 4.08Å; V140-P148 HydrophobicContact CG2-CG 4.13Å; V145-P148 WeakPolarHBondContact O-CD 3.22Å; P148-R150 VanDerWaalsContact C-N 3.34Å
149L89.7Confident87.8Confident56 Ų5654.2 Ų54.229%0.29330%0.302SS..G310 helixtrans-84.3-0.8-178.4-61.4176.8000114.2F109 P110 W146 R147 G151 L152F109-L149 HydrophobicContact CB-CD2 4.45Å; F109-L149 HydrophobicContact CD1-CD2 4.28Å; P110-L149 HydrophobicContact CG-CD2 3.9Å; W146-L149 HydrophobicContact CE3-CD1 3.86Å; W146-L149 HydrophobicContact CZ3-CD1 3.98Å; W146-L149 PolarHBondContact O-N 3.28Å; R147-L149 PolarHBondContact O-N 3.47Å; L149-G151 PolarHBondContact O-N 3.14Å; L149-L152 HydrophobicContact CD2-CD2 4.48Å; L149-L152 VanDerWaalsContact O-CB 3.24Å; L149-L152 WeakPolarHBondContact O-CB 3.43Å; L149-L152 PolarHBondContact O-N 3.34Å; L149-L152 VanDerWaalsContact O-N 3.16Å
150R88.1Confident87.7Confident78 Ų7854.6 Ų54.629%0.29431%0.306SS..THydrogen-bonded Turntrans-69.4119-179.4-167.5-173.6-168.4105.7-15.8111.1R147 P148 M217 Y224 R225R147-R150 WeakPolarHBondContact O-CB 3.48Å; R147-R150 PolarHBondContact O-N 3.43Å; P148-R150 VanDerWaalsContact C-N 3.34Å; R150-M217 HydrophobicContact CG-CB 4.48Å; R150-M217 HydrophobicContact CG-CE 3.7Å; R150-Y224 PolarHBondContact NH2-O 2.84Å; R150-R225 PolarHBondContact NH2-O 2.82Å
151G86.3Confident87.6Confident7 Ų756 Ų567%0.07232%0.316CS..THydrogen-bonded Turntrans104.6-7-175.900000114F109 L149 N153 A154 T155F109-G151 VanDerWaalsContact CZ-C 3.42Å; L149-G151 PolarHBondContact O-N 3.14Å; G151-N153 VanDerWaalsContact C-N 3.26Å; G151-N153 PolarHBondContact O-N 2.99Å; G151-A154 WeakPolarHBondContact O-CB 3.47Å; G151-A154 PolarHBondContact O-N 3.12Å; G151-T155 PolarHBondContact O-N 2.93Å
152L89.5Confident87.4Confident38 Ų3852 Ų5220%0.19928%0.283CS..Hα-helixtrans-49.5-45.3-178.6177.161.9000112.8C106 F109 L149 A154 T155 A156C106-L152 HydrophobicContact CB-CD1 4.33Å; F109-L152 HydrophobicContact CB-CD1 3.94Å; F109-L152 HydrophobicContact CD1-CB 4.25Å; F109-L152 HydrophobicContact CD1-CD1 4.46Å; F109-L152 HydrophobicContact CD2-CB 4.31Å; F109-L152 HydrophobicContact CD2-CD1 3.64Å; F109-L152 HydrophobicContact CE1-CB 4.19Å; F109-L152 HydrophobicContact CE2-CB 4.28Å; F109-L152 HydrophobicContact CE2-CD1 4.31Å; F109-L152 HydrophobicContact CG-CB 4.31Å; F109-L152 HydrophobicContact CG-CD1 3.74Å; F109-L152 HydrophobicContact CZ-CB 4.23Å; L149-L152 HydrophobicContact CD2-CD2 4.48Å; L149-L152 VanDerWaalsContact O-CB 3.24Å; L149-L152 WeakPolarHBondContact O-CB 3.43Å; L149-L152 PolarHBondContact O-N 3.34Å; L149-L152 VanDerWaalsContact O-N 3.16Å; L152-A154 VanDerWaalsContact C-N 3.27Å; L152-A154 PolarHBondContact O-N 3.46Å; L152-T155 PolarHBondContact O-N 3.44Å; L152-T155 VanDerWaalsContact O-N 3.07Å; L152-A156 PolarHBondContact O-N 3.45Å
153N90.3Very high87.2Confident116 Ų11648.5 Ų48.562%0.6226%0.26SS*.Hα-helixtrans-59.2-35.4-178.9-57.214.5000112.8G151 I157G151-N153 VanDerWaalsContact C-N 3.26Å; G151-N153 PolarHBondContact O-N 2.99Å; N153-I157 WeakPolarHBondContact O-CB 3.49Å; N153-I157 WeakPolarHBondContact O-CD1 3.23Å; N153-I157 WeakPolarHBondContact O-CG1 3.46Å; N153-I157 PolarHBondContact O-N 3.33Å; N153-I157 VanDerWaalsContact O-N 3.14Å
154A89.1Confident87.1Confident11 Ų1147.4 Ų47.49%0.09126%0.258CS..Hα-helixtrans-67.2-43.1176.700000111.1G151 L152 G158 A210 V213 V227G151-A154 WeakPolarHBondContact O-CB 3.47Å; G151-A154 PolarHBondContact O-N 3.12Å; L152-A154 VanDerWaalsContact C-N 3.27Å; L152-A154 PolarHBondContact O-N 3.46Å; A154-G158 PolarHBondContact O-N 3.39Å; A154-A210 WeakPolarHBondContact O-CB 3.31Å; A154-V213 HydrophobicContact CB-CB 4.4Å; A154-V213 HydrophobicContact CB-CG1 4.03Å; A154-V227 HydrophobicContact CB-CG1 3.79Å; A154-V227 HydrophobicContact CB-CG2 3.92Å
155T87.4Confident87Confident0 Ų049.3 Ų49.30%026%0.261CS..Hα-helixtrans-69-42.4178.9-55.80000111.9H105 F109 G151 L152 I157 G158 A159 M207 K214H105-T155 HydrophobicContact CB-CG2 3.88Å; F109-T155 HydrophobicContact CD2-CG2 4.47Å; F109-T155 HydrophobicContact CE2-CG2 4.4Å; F109-T155 WeakPolarHBondContact CE2-OG1 3.48Å; G151-T155 PolarHBondContact O-N 2.93Å; L152-T155 PolarHBondContact O-N 3.44Å; L152-T155 VanDerWaalsContact O-N 3.07Å; T155-I157 PolarHBondContact O-N 2.87Å; T155-G158 PolarHBondContact O-N 3Å; T155-A159 WeakPolarHBondContact O-CB 3.48Å; T155-A159 PolarHBondContact O-N 2.89Å; T155-M207 HydrophobicContact CG2-CE 3.69Å; T155-K214 HydrophobicContact CG2-CD 4.38Å; T155-K214 WeakPolarHBondContact OG1-CD 3.36Å
156A88Confident86.8Confident28 Ų2847.5 Ų47.523%0.23124%0.244CC..Hα-helixtrans-62.6-41.3176.800000112.3I102 L152I102-A156 HydrophobicContact CG2-CB 4.44Å; L152-A156 PolarHBondContact O-N 3.45Å
157I89.1Confident86.4Confident133 Ų13340.8 Ų40.868%0.68222%0.22SC*.Hα-helixtrans-68.8-39.4176.8-67.8167.9000111.5N153 T155 P161N153-I157 WeakPolarHBondContact O-CB 3.49Å; N153-I157 WeakPolarHBondContact O-CD1 3.23Å; N153-I157 WeakPolarHBondContact O-CG1 3.46Å; N153-I157 PolarHBondContact O-N 3.33Å; N153-I157 VanDerWaalsContact O-N 3.14Å; T155-I157 PolarHBondContact O-N 2.87Å; I157-P161 WeakPolarHBondContact O-CD 3.46Å
158G86.6Confident86.1Confident15 Ų1540.3 Ų40.316%0.15523%0.225CC..Hα-helixtrans-72.5-35.6177.500000114.1A154 T155 G160 A162 M207A154-G158 PolarHBondContact O-N 3.39Å; T155-G158 PolarHBondContact O-N 3Å; G158-G160 PolarHBondContact O-N 2.96Å; G158-A162 WeakPolarHBondContact O-CB 3.2Å; G158-A162 PolarHBondContact O-N 3.32Å; G158-M207 VanDerWaalsContact C-SD 3.57Å
159A83.5Confident85.8Confident0 Ų040.8 Ų40.80%023%0.228CC..Hα-helixtrans-61.6-45.9-174.200000113.1I102 T155 A162 H163 M207I102-A159 HydrophobicContact CG1-CB 3.9Å; T155-A159 WeakPolarHBondContact O-CB 3.48Å; T155-A159 PolarHBondContact O-N 2.89Å; A159-A162 PolarHBondContact O-N 3.19Å; A159-H163 WeakPolarHBondContact O-CB 3.38Å; A159-H163 PolarHBondContact O-N 3.06Å; A159-H163 PolarHBondContact O-ND1 3.31Å; A159-M207 HydrophobicContact CB-CE 4.09Å
160G84.6Confident85.4Confident9 Ų940.1 Ų40.19%0.09322%0.222CC..Hα-helixtrans-56.6-58-176.200000113.3G158 A162 H163 A164G158-G160 PolarHBondContact O-N 2.96Å; G160-A162 VanDerWaalsContact C-N 3.34Å; G160-A162 PolarHBondContact O-N 3.16Å; G160-H163 PolarHBondContact O-N 2.66Å; G160-A164 WeakPolarHBondContact O-CB 3.47Å; G160-A164 PolarHBondContact O-N 2.92Å
161P87.7Confident84.9Confident84 Ų8437.5 Ų37.555%0.54521%0.213SC..Hα-helixtrans-60.7-38.5176.4-25.335.4000113.6I157 A164 L165I157-P161 WeakPolarHBondContact O-CD 3.46Å; P161-A164 PolarHBondContact O-N 3.16Å; P161-L165 WeakPolarHBondContact O-CB 3.31Å; P161-L165 PolarHBondContact O-N 3.46Å
162A85.4Confident84.7Confident0 Ų044.3 Ų44.30%024%0.241CC..Hα-helixtrans-64.6-44.8179.400000112.1G158 A159 G160 L165 Y166 H203 A206 M207G158-A162 WeakPolarHBondContact O-CB 3.2Å; G158-A162 PolarHBondContact O-N 3.32Å; A159-A162 PolarHBondContact O-N 3.19Å; G160-A162 VanDerWaalsContact C-N 3.34Å; G160-A162 PolarHBondContact O-N 3.16Å; A162-L165 PolarHBondContact O-N 3.33Å; A162-Y166 PolarHBondContact O-N 3.01Å; A162-H203 VanDerWaalsContact C-CD2 3.48Å; A162-H203 PolarHBondContact O-CD2 3.23Å; A162-A206 HydrophobicContact CB-CB 3.97Å; A162-M207 HydrophobicContact CB-CB 3.88Å; A162-M207 HydrophobicContact CB-SD 4.42Å
163H82Confident84.3Confident27 Ų2744.8 Ų44.813%0.12524%0.243CC..Hα-helixtrans-69.9-40.5177-74.774.4000111.9G101 H105 A159 G160 L165 Y166 F167 H203G101-H163 VanDerWaalsContact CA-CD2 3.47Å; G101-H163 WeakPolarHBondContact CA-CD2 3.48Å; G101-H163 WeakPolarHBondContact CA-NE2 3.48Å; H105-H163 AromaticContact CD2-CE1 3.78Å; H105-H163 AromaticContact NE2-CE1 3.54Å; A159-H163 WeakPolarHBondContact O-CB 3.38Å; A159-H163 PolarHBondContact O-N 3.06Å; A159-H163 PolarHBondContact O-ND1 3.31Å; G160-H163 PolarHBondContact O-N 2.66Å; H163-L165 VanDerWaalsContact C-N 3.26Å; H163-L165 PolarHBondContact O-N 2.91Å; H163-Y166 WeakPolarHBondContact O-CB 3.43Å; H163-Y166 PolarHBondContact O-N 3.05Å; H163-Y166 VanDerWaalsContact O-N 3.14Å; H163-F167 VanDerWaalsContact O-CD2 3.26Å; H163-F167 WeakPolarHBondContact O-CD2 3.25Å; H163-F167 PolarHBondContact O-N 3.46Å; H163-H203 AromaticContact CE1-NE2 3.34Å; H163-H203 PolarHBondContact CE1-NE2 3.4Å; H163-H203 VanDerWaalsContact CE1-NE2 3.34Å; H163-H203 AromaticContact ND1-NE2 3.54Å; H163-H203 AromaticContact NE2-NE2 3.96Å
164A82.3Confident83.5Confident22 Ų2241.4 Ų41.418%0.18222%0.223CC..Hα-helixtrans-57.7-41.117300000111.6M94 A98 G160 P161 A168M94-A164 HydrophobicContact CE-CB 4.26Å; A98-A164 HydrophobicContact CB-CB 4.41Å; G160-A164 WeakPolarHBondContact O-CB 3.47Å; G160-A164 PolarHBondContact O-N 2.92Å; P161-A164 PolarHBondContact O-N 3.16Å; A164-A168 VanDerWaalsContact O-CB 3.23Å; A164-A168 WeakPolarHBondContact O-CB 3.45Å; A164-A168 PolarHBondContact O-N 3.14Å
165L85.8Confident82.9Confident71 Ų7146 Ų4637%0.37224%0.241SC..Hα-helixtrans-67.5-39.2174.9-178.860.2000112.4P161 A162 H163 S169 L202 A206P161-L165 WeakPolarHBondContact O-CB 3.31Å; P161-L165 PolarHBondContact O-N 3.46Å; A162-L165 PolarHBondContact O-N 3.33Å; H163-L165 VanDerWaalsContact C-N 3.26Å; H163-L165 PolarHBondContact O-N 2.91Å; L165-S169 VanDerWaalsContact O-CB 3.3Å; L165-S169 WeakPolarHBondContact O-CB 3.41Å; L165-S169 PolarHBondContact O-N 3.01Å; L165-S169 PolarHBondContact O-OG 3.39Å; L165-L202 HydrophobicContact CD2-CB 4.09Å; L165-L202 WeakPolarHBondContact CD2-O 3.37Å; L165-L202 HydrophobicContact CG-CB 4.14Å; L165-A206 HydrophobicContact CD2-CB 4.15Å
166Y83.8Confident82.5Confident59 Ų5949.6 Ų49.623%0.23126%0.263CS..Hα-helixtrans-55.2-58.6173-179.7-94.5000111.1A162 H163 A168 S169 Y170 A199 H203A162-Y166 PolarHBondContact O-N 3.01Å; H163-Y166 WeakPolarHBondContact O-CB 3.43Å; H163-Y166 PolarHBondContact O-N 3.05Å; H163-Y166 VanDerWaalsContact O-N 3.14Å; Y166-A168 PolarHBondContact O-N 3.41Å; Y166-S169 PolarHBondContact O-N 3.19Å; Y166-S169 PolarHBondContact O-OG 2.86Å; Y166-S169 VanDerWaalsContact O-OG 3.07Å; Y166-Y170 VanDerWaalsContact O-CB 3.22Å; Y166-Y170 WeakPolarHBondContact O-CB 3.44Å; Y166-Y170 PolarHBondContact O-N 2.97Å; Y166-A199 HydrophobicContact CD2-CB 3.7Å; Y166-A199 HydrophobicContact CE2-CB 3.73Å; Y166-A199 HydrophobicContact CG-CB 4.37Å; Y166-H203 HydrophobicContact CD2-CB 4.17Å
167F79.5Confident81.8Confident59 Ų5950.3 Ų50.326%0.25926%0.263SS..Hα-helixtrans-65.5-39.6-176.3-74.5-76.4000112.5M94 H163 E171M94-F167 HydrophobicContact CG-CB 4.39Å; H163-F167 VanDerWaalsContact O-CD2 3.26Å; H163-F167 WeakPolarHBondContact O-CD2 3.25Å; H163-F167 PolarHBondContact O-N 3.46Å; F167-E171 WeakPolarHBondContact O-CB 3.34Å; F167-E171 PolarHBondContact O-N 3.34Å
168A82.4Confident80.8Confident30 Ų3046.9 Ų46.925%0.24825%0.25CS..Hα-helixtrans-62.5-43.6176.200000112.9M94 A164 Y166 K172M94-A168 HydrophobicContact CE-CB 3.82Å; M94-A168 HydrophobicContact CG-CB 4.06Å; M94-A168 HydrophobicContact SD-CB 3.7Å; A164-A168 VanDerWaalsContact O-CB 3.23Å; A164-A168 WeakPolarHBondContact O-CB 3.45Å; A164-A168 PolarHBondContact O-N 3.14Å; Y166-A168 PolarHBondContact O-N 3.41Å; A168-K172 WeakPolarHBondContact O-CB 3.42Å; A168-K172 PolarHBondContact O-N 3.45Å
169S81.8Confident80.1Confident14 Ų1452.4 Ų52.410%0.09828%0.276CS..Hα-helixtrans-73.3-43.817957.80000111.6L165 Y166 E171 K172 L173 A199L165-S169 VanDerWaalsContact O-CB 3.3Å; L165-S169 WeakPolarHBondContact O-CB 3.41Å; L165-S169 PolarHBondContact O-N 3.01Å; L165-S169 PolarHBondContact O-OG 3.39Å; Y166-S169 PolarHBondContact O-N 3.19Å; Y166-S169 PolarHBondContact O-OG 2.86Å; Y166-S169 VanDerWaalsContact O-OG 3.07Å; S169-E171 PolarHBondContact O-N 3.05Å; S169-K172 PolarHBondContact O-N 3.07Å; S169-L173 VanDerWaalsContact O-CB 3.31Å; S169-L173 WeakPolarHBondContact O-CB 3.27Å; S169-L173 WeakPolarHBondContact O-CD1 3.43Å; S169-L173 WeakPolarHBondContact O-CG 3.44Å; S169-L173 PolarHBondContact O-N 3.28Å; S169-A199 WeakPolarHBondContact OG-CA 3.46Å; S169-A199 WeakPolarHBondContact OG-CB 3.27Å
170Y79.8Confident79.4Confident41 Ų4157.2 Ų57.216%0.16131%0.306CS..Hα-helixtrans-56.9-49.3175.9179.9-98.6000112.1Y166 K172 L173 K174 A195Y166-Y170 VanDerWaalsContact O-CB 3.22Å; Y166-Y170 WeakPolarHBondContact O-CB 3.44Å; Y166-Y170 PolarHBondContact O-N 2.97Å; Y170-K172 PolarHBondContact O-N 3.47Å; Y170-L173 PolarHBondContact O-N 3.47Å; Y170-K174 HydrophobicContact CE1-CD 4.01Å; Y170-K174 WeakPolarHBondContact O-CB 3.41Å; Y170-K174 PolarHBondContact O-N 2.83Å; Y170-A195 HydrophobicContact CD2-CB 4.17Å; Y170-A195 HydrophobicContact CE2-CB 4.27Å
171E77.6Confident78.5Confident23 Ų2360 Ų6011%0.10732%0.318CS..Hα-helixtrans-59.5-45.8176.8-91.2-164.5-128.400112.4T90 H93 F167 S169 K175T90-E171 WeakPolarHBondContact CA-OE1 3.35Å; T90-E171 WeakPolarHBondContact CB-OE2 3.46Å; T90-E171 WeakPolarHBondContact CG2-OE2 3.45Å; T90-E171 PolarHBondContact OG1-OE2 2.92Å; H93-E171 VanDerWaalsContact CB-OE1 3.25Å; H93-E171 WeakPolarHBondContact CB-OE1 3.5Å; H93-E171 IonicContact CD2-OE1 3.44Å; H93-E171 IonicContact CG-OE1 3.48Å; H93-E171 VanDerWaalsContact CG-OE1 3.29Å; H93-E171 IonicContact ND1-OE1 2.71Å; H93-E171 PolarHBondContact ND1-OE1 3.34Å; F167-E171 WeakPolarHBondContact O-CB 3.34Å; F167-E171 PolarHBondContact O-N 3.34Å; S169-E171 PolarHBondContact O-N 3.05Å; E171-K175 WeakPolarHBondContact O-CB 3.46Å; E171-K175 WeakPolarHBondContact O-CD 3.26Å; E171-K175 VanDerWaalsContact O-CG 3.25Å; E171-K175 WeakPolarHBondContact O-CG 3.41Å; E171-K175 PolarHBondContact O-N 3.15Å; E171-K175 IonicContact OE2-NZ 2.73Å; E171-K175 PolarHBondContact OE2-NZ 2.58Å
172K82.1Confident77Confident151 Ų15164.2 Ų64.266%0.65733%0.33SS*.Hα-helixtrans-63.7-43.8-179.5-173175.2-178.9178.90111.2A168 S169 Y170 T176A168-K172 WeakPolarHBondContact O-CB 3.42Å; A168-K172 PolarHBondContact O-N 3.45Å; S169-K172 PolarHBondContact O-N 3.07Å; Y170-K172 PolarHBondContact O-N 3.47Å; K172-T176 WeakPolarHBondContact O-CB 3.37Å; K172-T176 PolarHBondContact O-N 3.47Å; K172-T176 PolarHBondContact O-OG1 2.85Å; K172-T176 VanDerWaalsContact O-OG1 3.08Å
173L81.3Confident75.4Confident47 Ų4770.5 Ų70.525%0.24637%0.371CS..Hα-helixtrans-68.6-44.4178.8-77.2155.3000112.1S169 Y170 K175 T176 L177 A195 V198S169-L173 VanDerWaalsContact O-CB 3.31Å; S169-L173 WeakPolarHBondContact O-CB 3.27Å; S169-L173 WeakPolarHBondContact O-CD1 3.43Å; S169-L173 WeakPolarHBondContact O-CG 3.44Å; S169-L173 PolarHBondContact O-N 3.28Å; Y170-L173 PolarHBondContact O-N 3.47Å; L173-K175 VanDerWaalsContact C-N 3.35Å; L173-K175 PolarHBondContact O-N 3.16Å; L173-T176 PolarHBondContact O-N 2.94Å; L173-L177 VanDerWaalsContact O-CB 3.26Å; L173-L177 WeakPolarHBondContact O-CB 3.43Å; L173-L177 WeakPolarHBondContact O-CG 3.49Å; L173-L177 PolarHBondContact O-N 3.11Å; L173-A195 HydrophobicContact CB-CB 3.59Å; L173-V198 HydrophobicContact CD1-CB 3.78Å; L173-V198 HydrophobicContact CD1-CG1 3.6Å
174K74.5Confident74.1Confident46 Ų4671.2 Ų71.220%0.239%0.386CS..Hα-helixtrans-58.4-46.6176-175.5174.3176.7177.40110.4D80 Y170 S178D80-K174 IonicContact OD2-NZ 3.92Å; D80-K174 PolarHBondContact OD2-NZ 3.02Å; Y170-K174 HydrophobicContact CE1-CD 4.01Å; Y170-K174 WeakPolarHBondContact O-CB 3.41Å; Y170-K174 PolarHBondContact O-N 2.83Å; K174-S178 WeakPolarHBondContact O-CB 3.02Å; K174-S178 PolarHBondContact O-N 3.18Å
175K75.9Confident72.5Confident107 Ų10775 Ų7547%0.46542%0.417SS..Hα-helixtrans-59-61.3175-71.1164.3-179.8164.70111.1E171 L173 L177 S178 D179E171-K175 WeakPolarHBondContact O-CB 3.46Å; E171-K175 WeakPolarHBondContact O-CD 3.26Å; E171-K175 VanDerWaalsContact O-CG 3.25Å; E171-K175 WeakPolarHBondContact O-CG 3.41Å; E171-K175 PolarHBondContact O-N 3.15Å; E171-K175 IonicContact OE2-NZ 2.73Å; E171-K175 PolarHBondContact OE2-NZ 2.58Å; L173-K175 VanDerWaalsContact C-N 3.35Å; L173-K175 PolarHBondContact O-N 3.16Å; K175-L177 VanDerWaalsContact C-N 3.34Å; K175-L177 PolarHBondContact O-N 2.93Å; K175-S178 PolarHBondContact O-N 3.21Å; K175-S178 VanDerWaalsContact O-N 3.07Å; K175-D179 PolarHBondContact O-N 3.06Å; K175-D179 VanDerWaalsContact O-OD2 3.13Å
176T79Confident70.9Confident75 Ų7578.6 Ų78.646%0.4644%0.436SS..Hα-helixtrans-58.7-38.8-177.3-58.90000113.9K172 L173 T180K172-T176 WeakPolarHBondContact O-CB 3.37Å; K172-T176 PolarHBondContact O-N 3.47Å; K172-T176 PolarHBondContact O-OG1 2.85Å; K172-T176 VanDerWaalsContact O-OG1 3.08Å; L173-T176 PolarHBondContact O-N 2.94Å; T176-T180 VanDerWaalsContact O-CB 3.3Å; T176-T180 WeakPolarHBondContact O-CB 3.15Å; T176-T180 PolarHBondContact O-N 2.88Å; T176-T180 VanDerWaalsContact O-N 3.09Å; T176-T180 PolarHBondContact O-OG1 3.36Å
177L72.7Confident69.7Low44 Ų4477 Ų7723%0.2343%0.434CS..Hα-helixtrans-71.9-35.6177.3-74.3162.7000112.4L173 K175 I181 N191 A194 A195L173-L177 VanDerWaalsContact O-CB 3.26Å; L173-L177 WeakPolarHBondContact O-CB 3.43Å; L173-L177 WeakPolarHBondContact O-CG 3.49Å; L173-L177 PolarHBondContact O-N 3.11Å; K175-L177 VanDerWaalsContact C-N 3.34Å; K175-L177 PolarHBondContact O-N 2.93Å; L177-I181 HydrophobicContact CD2-CD1 4.09Å; L177-I181 WeakPolarHBondContact O-CB 3.33Å; L177-I181 PolarHBondContact O-N 3.28Å; L177-N191 HydrophobicContact CB-CB 3.98Å; L177-N191 PolarHBondContact O-ND2 2.97Å; L177-A194 HydrophobicContact CD1-CB 4.37Å; L177-A195 HydrophobicContact CD1-CB 4.11Å
178S69.7Low68.9Low60 Ų6078.4 Ų78.442%0.4244%0.441SS..Hα-helixtrans-68.5-35173.9-1650000112.4K174 K175K174-S178 WeakPolarHBondContact O-CB 3.02Å; K174-S178 PolarHBondContact O-N 3.18Å; K175-S178 PolarHBondContact O-N 3.21Å; K175-S178 VanDerWaalsContact O-N 3.07Å
179D71Confident67.9Low131 Ų13182.7 Ų82.770%0.70146%0.459SS*.Hα-helixtrans-74.8-31.3178.4-59.5-30.1000112.3K175K175-D179 PolarHBondContact O-N 3.06Å; K175-D179 VanDerWaalsContact O-OD2 3.13Å
180T69.3Low67Low102 Ų10285 Ų8563%0.62648%0.479SS*.Hα-helixtrans-89.2-24.7-173.3-53.10000113.4T176T176-T180 VanDerWaalsContact O-CB 3.3Å; T176-T180 WeakPolarHBondContact O-CB 3.15Å; T176-T180 PolarHBondContact O-N 2.88Å; T176-T180 VanDerWaalsContact O-N 3.09Å; T176-T180 PolarHBondContact O-OG1 3.36Å
181I65.8Low66.5Low67 Ų6784 Ų8434%0.34448%0.477SS..SBendtrans-114.9115.4-173-63.7167.6000109.1L177 N191L177-I181 HydrophobicContact CD2-CD1 4.09Å; L177-I181 WeakPolarHBondContact O-CB 3.33Å; L177-I181 PolarHBondContact O-N 3.28Å; I181-N191 WeakPolarHBondContact CD1-OD1 3.48Å
182H55.5Low66.1Low173 Ų17383.6 Ų83.680%0.80148%0.477SS*.  trans-51.8149.6-177-65.1-40.5000113.7G184 S187H182-G184 VanDerWaalsContact C-N 3.35Å; H182-G184 PolarHBondContact O-N 2.99Å; H182-S187 PolarHBondContact O-OG 3.22Å
183P52.2Low65.5Low132 Ų13277 Ų7786%0.85745%0.452SS*.  trans-72.883.9-175.630.3-36.2000112
184G53.8Low65Low42 Ų4277.1 Ų77.143%0.43346%0.46SS..  trans-95.3139.8157.300000109.4H182 N186 S187H182-G184 VanDerWaalsContact C-N 3.35Å; H182-G184 PolarHBondContact O-N 2.99Å; G184-N186 PolarHBondContact O-N 3.31Å; G184-S187 PolarHBondContact O-N 2.82Å; G184-S187 PolarHBondContact O-OG 3.35Å
185A50.2Low65.1Low101 Ų10174.9 Ų74.984%0.83545%0.45SS*.THydrogen-bonded Turntrans-53.8-23.1-170.900000115.6
186N51.5Low65.1Low146 Ų14670.3 Ų70.378%0.78143%0.433SS*.THydrogen-bonded Turntrans-96.8-7.1-179.8-61.3-23.8000114.4G184G184-N186 PolarHBondContact O-N 3.31Å
187S58.1Low64.9Low26 Ų2668.6 Ų68.618%0.18242%0.424CS..Hα-helixtrans-80.1-33.3-175.264.70000113.4H182 G184 L189 A190 N191H182-S187 PolarHBondContact O-OG 3.22Å; G184-S187 PolarHBondContact O-N 2.82Å; G184-S187 PolarHBondContact O-OG 3.35Å; S187-L189 PolarHBondContact O-N 3.1Å; S187-A190 PolarHBondContact O-N 2.69Å; S187-N191 VanDerWaalsContact O-CB 3.28Å; S187-N191 WeakPolarHBondContact O-CB 3.49Å; S187-N191 PolarHBondContact O-N 3.46Å; S187-N191 PolarHBondContact O-ND2 3.39Å; S187-N191 PolarHBondContact O-OD1 3.02Å
188H62.2Low65.4Low88 Ų8869.7 Ų69.741%0.40743%0.432SS..Hα-helixtrans-62-45.8-174.3-175.1-106.4000113.3N191 A192H188-N191 PolarHBondContact O-N 3.34Å; H188-A192 WeakPolarHBondContact O-CB 3.16Å; H188-A192 PolarHBondContact O-N 3.16Å
189L61.3Low65.9Low120 Ų12066.8 Ų66.863%0.62841%0.412SS*.Hα-helixtrans-65.5-42177-82.3149000112.4S187 A192 G193S187-L189 PolarHBondContact O-N 3.1Å; L189-A192 PolarHBondContact O-N 3.22Å; L189-G193 PolarHBondContact O-N 3.34Å
190A64.5Low66.4Low64 Ų6462.2 Ų62.253%0.52939%0.389SS..Hα-helixtrans-64-41.1176.300000111.8S187 G193 A194S187-A190 PolarHBondContact O-N 2.69Å; A190-G193 PolarHBondContact O-N 3.1Å; A190-A194 WeakPolarHBondContact O-CB 3.45Å; A190-A194 PolarHBondContact O-N 2.84Å
191N69.4Low67.1Low20 Ų2059.8 Ų59.811%0.10737%0.372CS..Hα-helixtrans-66.4-43.6176.7-70.2-8.6000111.9L177 I181 S187 H188 A194 A195L177-N191 HydrophobicContact CB-CB 3.98Å; L177-N191 PolarHBondContact O-ND2 2.97Å; I181-N191 WeakPolarHBondContact CD1-OD1 3.48Å; S187-N191 VanDerWaalsContact O-CB 3.28Å; S187-N191 WeakPolarHBondContact O-CB 3.49Å; S187-N191 PolarHBondContact O-N 3.46Å; S187-N191 PolarHBondContact O-ND2 3.39Å; S187-N191 PolarHBondContact O-OD1 3.02Å; H188-N191 PolarHBondContact O-N 3.34Å; N191-A194 PolarHBondContact O-N 3.15Å; N191-A195 WeakPolarHBondContact O-CB 3.27Å; N191-A195 PolarHBondContact O-N 2.86Å
192A68Low68Low14 Ų1459.9 Ų59.912%0.11637%0.373CS..Hα-helixtrans-62.8-41174.400000111.8H188 L189 A195 G196H188-A192 WeakPolarHBondContact O-CB 3.16Å; H188-A192 PolarHBondContact O-N 3.16Å; L189-A192 PolarHBondContact O-N 3.22Å; A192-A195 PolarHBondContact O-N 3.26Å; A192-G196 PolarHBondContact O-N 3.31Å
193G69.1Low69.6Low13 Ų1352.8 Ų52.813%0.13434%0.34CS..Hα-helixtrans-63.4-42.9173.800000113L189 A190 G196 C197L189-G193 PolarHBondContact O-N 3.34Å; A190-G193 PolarHBondContact O-N 3.1Å; G193-G196 PolarHBondContact O-N 2.98Å; G193-C197 PolarHBondContact O-N 3.41Å; G193-C197 PolarHBondContact O-SG 3.43Å; G193-C197 VanDerWaalsContact O-SG 3.39Å
194A71.8Confident71.2Confident48 Ų4847.2 Ų47.240%0.39730%0.303SS..Hα-helixtrans-64.4-43.8175.300000112.2L177 A190 N191 C197 V198L177-A194 HydrophobicContact CD1-CB 4.37Å; A190-A194 WeakPolarHBondContact O-CB 3.45Å; A190-A194 PolarHBondContact O-N 2.84Å; N191-A194 PolarHBondContact O-N 3.15Å; A194-C197 PolarHBondContact O-N 2.96Å; A194-V198 PolarHBondContact O-N 3.02Å; A194-V198 VanDerWaalsContact O-N 3.15Å
195A76.9Confident72.8Confident0 Ų046.5 Ų46.50%029%0.292CS..Hα-helixtrans-59.1-46.9173.200000111.7Y170 L173 L177 N191 A192 V198 A199Y170-A195 HydrophobicContact CD2-CB 4.17Å; Y170-A195 HydrophobicContact CE2-CB 4.27Å; L173-A195 HydrophobicContact CB-CB 3.59Å; L177-A195 HydrophobicContact CD1-CB 4.11Å; N191-A195 WeakPolarHBondContact O-CB 3.27Å; N191-A195 PolarHBondContact O-N 2.86Å; A192-A195 PolarHBondContact O-N 3.26Å; A195-V198 PolarHBondContact O-N 3.09Å; A195-A199 WeakPolarHBondContact O-CB 3.32Å; A195-A199 PolarHBondContact O-N 2.91Å
196G75.4Confident74.7Confident11 Ų1143.5 Ų43.511%0.11327%0.268CS..Hα-helixtrans-59-46.5176.300000112.6A192 G193 V198 A199 T200A192-G196 PolarHBondContact O-N 3.31Å; G193-G196 PolarHBondContact O-N 2.98Å; G196-V198 PolarHBondContact O-N 3.41Å; G196-A199 PolarHBondContact O-N 3.06Å; G196-T200 WeakPolarHBondContact O-CB 3.5Å; G196-T200 PolarHBondContact O-N 3.37Å; G196-T200 PolarHBondContact O-OG1 3.26Å
197C74.9Confident76.5Confident39 Ų3936.7 Ų36.726%0.26423%0.231SC..Hα-helixtrans-55.4-52.6175.1-78.60000112G193 A194 T200 L201G193-C197 PolarHBondContact O-N 3.41Å; G193-C197 PolarHBondContact O-SG 3.43Å; G193-C197 VanDerWaalsContact O-SG 3.39Å; A194-C197 PolarHBondContact O-N 2.96Å; C197-T200 WeakPolarHBondContact O-CB 2.98Å; C197-T200 PolarHBondContact O-N 3.32Å; C197-L201 VanDerWaalsContact O-CG 3.28Å; C197-L201 WeakPolarHBondContact O-CG 3.5Å; C197-L201 PolarHBondContact O-N 3.5Å; C197-L201 VanDerWaalsContact O-N 3.08Å
198V82.4Confident78Confident66 Ų6635.5 Ų35.540%0.422%0.223SC..Hα-helixtrans-65.1-40.8-178.8176.50000111.6L173 A194 A195 G196 T200 L201 L202L173-V198 HydrophobicContact CD1-CB 3.78Å; L173-V198 HydrophobicContact CD1-CG1 3.6Å; A194-V198 PolarHBondContact O-N 3.02Å; A194-V198 VanDerWaalsContact O-N 3.15Å; A195-V198 PolarHBondContact O-N 3.09Å; G196-V198 PolarHBondContact O-N 3.41Å; V198-T200 VanDerWaalsContact C-N 3.33Å; V198-T200 PolarHBondContact O-N 3.05Å; V198-L201 PolarHBondContact O-N 3.33Å; V198-L202 HydrophobicContact CG1-CD1 4.43Å; V198-L202 PolarHBondContact O-N 2.97Å; V198-L202 VanDerWaalsContact O-N 3.13Å
199A80.8Confident79.4Confident0 Ų032.9 Ų32.90%021%0.214CC..Hα-helixtrans-60.5-41.1174.800000112.1Y166 S169 A195 G196 L201 L202 H203Y166-A199 HydrophobicContact CD2-CB 3.7Å; Y166-A199 HydrophobicContact CE2-CB 3.73Å; Y166-A199 HydrophobicContact CG-CB 4.37Å; S169-A199 WeakPolarHBondContact OG-CA 3.46Å; S169-A199 WeakPolarHBondContact OG-CB 3.27Å; A195-A199 WeakPolarHBondContact O-CB 3.32Å; A195-A199 PolarHBondContact O-N 2.91Å; G196-A199 PolarHBondContact O-N 3.06Å; A199-L201 VanDerWaalsContact C-N 3.34Å; A199-L201 PolarHBondContact O-N 3.25Å; A199-L202 PolarHBondContact O-N 3.03Å; A199-H203 WeakPolarHBondContact O-CB 3.16Å; A199-H203 PolarHBondContact O-N 3.35Å
200T81.2Confident80.9Confident34 Ų3427.7 Ų27.721%0.20919%0.188CC..Hα-helixtrans-62.7-37.3173.9-59.90000112.2G196 C197 V198 D204G196-T200 WeakPolarHBondContact O-CB 3.5Å; G196-T200 PolarHBondContact O-N 3.37Å; G196-T200 PolarHBondContact O-OG1 3.26Å; C197-T200 WeakPolarHBondContact O-CB 2.98Å; C197-T200 PolarHBondContact O-N 3.32Å; V198-T200 VanDerWaalsContact C-N 3.33Å; V198-T200 PolarHBondContact O-N 3.05Å; T200-D204 WeakPolarHBondContact O-CB 3.29Å; T200-D204 PolarHBondContact O-N 3.5Å
201L83.5Confident82Confident51 Ų5126.4 Ų26.427%0.26717%0.171SC..Hα-helixtrans-66.2-40.7176.7-49.3-165.7000111.3C197 V198 A199 D204 A205 Y247 L251C197-L201 VanDerWaalsContact O-CG 3.28Å; C197-L201 WeakPolarHBondContact O-CG 3.5Å; C197-L201 PolarHBondContact O-N 3.5Å; C197-L201 VanDerWaalsContact O-N 3.08Å; V198-L201 PolarHBondContact O-N 3.33Å; A199-L201 VanDerWaalsContact C-N 3.34Å; A199-L201 PolarHBondContact O-N 3.25Å; L201-D204 PolarHBondContact O-N 3.02Å; L201-A205 WeakPolarHBondContact O-CB 3.46Å; L201-A205 PolarHBondContact O-N 3.11Å; L201-Y247 PolarHBondContact O-OH 2.97Å; L201-L251 HydrophobicContact CB-CD2 3.99Å; L201-L251 HydrophobicContact CD1-CD2 4.01Å; L201-L251 HydrophobicContact CD2-CD2 3.67Å; L201-L251 HydrophobicContact CG-CD2 4.05Å
202L86.4Confident82.9Confident70 Ų7025.4 Ų25.437%0.36617%0.166SC..Hα-helixtrans-68.9-41.5177.8-67.3173.1000112.2L165 V198 A199 A205 A206L165-L202 HydrophobicContact CD2-CB 4.09Å; L165-L202 WeakPolarHBondContact CD2-O 3.37Å; L165-L202 HydrophobicContact CG-CB 4.14Å; V198-L202 HydrophobicContact CG1-CD1 4.43Å; V198-L202 PolarHBondContact O-N 2.97Å; V198-L202 VanDerWaalsContact O-N 3.13Å; A199-L202 PolarHBondContact O-N 3.03Å; L202-A205 PolarHBondContact O-N 3.41Å; L202-A206 PolarHBondContact O-N 2.99Å
203H87.6Confident84.1Confident23 Ų2325 Ų2511%0.10616%0.162CC..Hα-helixtrans-52.9-54169.5170.1-86.7000111A162 H163 Y166 A199 A205 A206 M207A162-H203 VanDerWaalsContact C-CD2 3.48Å; A162-H203 PolarHBondContact O-CD2 3.23Å; H163-H203 AromaticContact CE1-NE2 3.34Å; H163-H203 PolarHBondContact CE1-NE2 3.4Å; H163-H203 VanDerWaalsContact CE1-NE2 3.34Å; H163-H203 AromaticContact ND1-NE2 3.54Å; H163-H203 AromaticContact NE2-NE2 3.96Å; Y166-H203 HydrophobicContact CD2-CB 4.17Å; A199-H203 WeakPolarHBondContact O-CB 3.16Å; A199-H203 PolarHBondContact O-N 3.35Å; H203-A205 VanDerWaalsContact C-N 3.31Å; H203-A205 PolarHBondContact O-N 3.5Å; H203-A206 PolarHBondContact O-N 3.31Å; H203-A206 VanDerWaalsContact O-N 3.09Å; H203-M207 WeakPolarHBondContact O-CB 3.19Å; H203-M207 PolarHBondContact O-N 3.4Å
204D85.9Confident85.1Confident16 Ų1625 Ų259%0.08616%0.158CC..Hα-helixtrans-66-34.5-175.9-81.317.5000112T200 L201 A206 M207 N208 Y247 Q250 N254T200-D204 WeakPolarHBondContact O-CB 3.29Å; T200-D204 PolarHBondContact O-N 3.5Å; L201-D204 PolarHBondContact O-N 3.02Å; D204-A206 VanDerWaalsContact C-N 3.31Å; D204-A206 PolarHBondContact O-N 2.92Å; D204-M207 PolarHBondContact O-N 3.26Å; D204-N208 VanDerWaalsContact O-CB 3.27Å; D204-N208 WeakPolarHBondContact O-CB 3.29Å; D204-N208 PolarHBondContact O-N 3Å; D204-Y247 HydrophobicContact CB-CE2 4.32Å; D204-Q250 HydrophobicContact CB-CG 4.24Å; D204-Q250 WeakPolarHBondContact OD2-CG 3.35Å; D204-Q250 PolarHBondContact OD2-NE2 3.42Å; D204-N254 PolarHBondContact OD2-ND2 3.48Å
205A88.7Confident85.9Confident26 Ų2623.4 Ų23.422%0.21514%0.143CC..Hα-helixtrans-59-41.517200000112.4L201 L202 H203 Y244 Y247L201-A205 WeakPolarHBondContact O-CB 3.46Å; L201-A205 PolarHBondContact O-N 3.11Å; L202-A205 PolarHBondContact O-N 3.41Å; H203-A205 VanDerWaalsContact C-N 3.31Å; H203-A205 PolarHBondContact O-N 3.5Å; A205-Y244 WeakPolarHBondContact O-CE1 3.33Å; A205-Y244 PolarHBondContact O-OH 3.02Å; A205-Y247 HydrophobicContact CB-CE2 3.93Å
206A90.3Very high86.5Confident38 Ų3823.9 Ų23.931%0.31414%0.144SC..Hα-helixtrans-74.5-34.9176.700000112.7A162 L165 L202 H203 D204A162-A206 HydrophobicContact CB-CB 3.97Å; L165-A206 HydrophobicContact CD2-CB 4.15Å; L202-A206 PolarHBondContact O-N 2.99Å; H203-A206 PolarHBondContact O-N 3.31Å; H203-A206 VanDerWaalsContact O-N 3.09Å; D204-A206 VanDerWaalsContact C-N 3.31Å; D204-A206 PolarHBondContact O-N 2.92Å
207M88.4Confident87.1Confident4 Ų423.6 Ų23.62%0.0214%0.14CC..Hα-helixtrans-83.9-27.9-174.1-16752.4166.300113.8T155 G158 A159 A162 H203 D204 P209 A210 E211T155-M207 HydrophobicContact CG2-CE 3.69Å; G158-M207 VanDerWaalsContact C-SD 3.57Å; A159-M207 HydrophobicContact CB-CE 4.09Å; A162-M207 HydrophobicContact CB-CB 3.88Å; A162-M207 HydrophobicContact CB-SD 4.42Å; H203-M207 WeakPolarHBondContact O-CB 3.19Å; H203-M207 PolarHBondContact O-N 3.4Å; D204-M207 PolarHBondContact O-N 3.26Å; M207-P209 VanDerWaalsContact C-CD 3.5Å; M207-A210 WeakPolarHBondContact O-CB 3.27Å; M207-A210 PolarHBondContact O-N 3.04Å; M207-A210 HydrophobicContact SD-CB 4.1Å; M207-E211 HydrophobicContact CG-CG 4.09Å; M207-E211 PolarHBondContact O-N 3.46Å
208N89.6Confident87.7Confident0 Ų021.8 Ų21.80%013%0.128CC..Hα-helixtrans-56-39.2-171.4-163.563.5000114.8D204 A210 E211 V212 F243 S246 Q250D204-N208 VanDerWaalsContact O-CB 3.27Å; D204-N208 WeakPolarHBondContact O-CB 3.29Å; D204-N208 PolarHBondContact O-N 3Å; N208-A210 VanDerWaalsContact C-N 3.3Å; N208-A210 PolarHBondContact O-N 2.6Å; N208-E211 WeakPolarHBondContact O-CB 3.41Å; N208-E211 PolarHBondContact O-N 3.19Å; N208-E211 VanDerWaalsContact O-N 3.15Å; N208-V212 VanDerWaalsContact O-CG2 3.27Å; N208-V212 WeakPolarHBondContact O-CG2 3.44Å; N208-V212 PolarHBondContact O-N 2.76Å; N208-F243 PolarHBondContact ND2-O 3.05Å; N208-S246 PolarHBondContact ND2-OG 2.95Å; N208-S246 PolarHBondContact OD1-OG 3.16Å; N208-Q250 PolarHBondContact OD1-OE1 3.34Å; N208-Q250 VanDerWaalsContact OD1-OE1 3.11Å
209P91.9Very high87.8Confident33 Ų3319.9 Ų19.921%0.21412%0.115CC..Hα-helixtrans-60-38.4175-2535.6000113.3M207 V213 F243 Y244M207-P209 VanDerWaalsContact C-CD 3.5Å; P209-V213 WeakPolarHBondContact O-CG2 3.32Å; P209-V213 PolarHBondContact O-N 3.32Å; P209-F243 HydrophobicContact CB-CB 4.27Å; P209-F243 HydrophobicContact CB-CD1 4.16Å; P209-F243 HydrophobicContact CG-CB 4.45Å; P209-Y244 HydrophobicContact CG-CE1 4.36Å; P209-Y244 HydrophobicContact CG-CE2 3.98Å; P209-Y244 WeakPolarHBondContact CG-OH 3.38Å
210A91.5Very high87.7Confident11 Ų1122.6 Ų22.69%0.09113%0.126CC..Hα-helixtrans-70.6-36.3175.300000111.7A154 M207 N208 K214A154-A210 WeakPolarHBondContact O-CB 3.31Å; M207-A210 WeakPolarHBondContact O-CB 3.27Å; M207-A210 PolarHBondContact O-N 3.04Å; M207-A210 HydrophobicContact SD-CB 4.1Å; N208-A210 VanDerWaalsContact C-N 3.3Å; N208-A210 PolarHBondContact O-N 2.6Å; A210-K214 WeakPolarHBondContact O-CB 3.49Å; A210-K214 PolarHBondContact O-N 2.93Å
211E87.9Confident87.7Confident37 Ų3728.6 Ų28.617%0.17315%0.15CC..Hα-helixtrans-63.5-42.7173.1-65-159.4113.500112.9M207 N208 V213 K214 Q215 Q250 K305M207-E211 HydrophobicContact CG-CG 4.09Å; M207-E211 PolarHBondContact O-N 3.46Å; N208-E211 WeakPolarHBondContact O-CB 3.41Å; N208-E211 PolarHBondContact O-N 3.19Å; N208-E211 VanDerWaalsContact O-N 3.15Å; E211-V213 VanDerWaalsContact C-N 3.33Å; E211-V213 PolarHBondContact O-N 3.37Å; E211-K214 WeakPolarHBondContact O-CB 3.28Å; E211-K214 PolarHBondContact O-N 2.94Å; E211-Q215 WeakPolarHBondContact O-CB 3.31Å; E211-Q215 WeakPolarHBondContact O-CG 3.32Å; E211-Q215 PolarHBondContact O-N 3.2Å; E211-Q250 PolarHBondContact OE2-NE2 2.71Å; E211-K305 IonicContact OE1-NZ 3.21Å; E211-K305 PolarHBondContact OE1-NZ 3.21Å; E211-K305 WeakPolarHBondContact OE2-CE 3.35Å; E211-K305 IonicContact OE2-NZ 2.79Å; E211-K305 PolarHBondContact OE2-NZ 3.39Å
212V89.8Confident87.6Confident0 Ų026.7 Ų26.70%014%0.141CC..Hα-helixtrans-59.8-45.6178.5174.30000110.4N208 R216 F243 N309N208-V212 VanDerWaalsContact O-CG2 3.27Å; N208-V212 WeakPolarHBondContact O-CG2 3.44Å; N208-V212 PolarHBondContact O-N 2.76Å; V212-R216 WeakPolarHBondContact O-CB 3.31Å; V212-R216 WeakPolarHBondContact O-CD 2.96Å; V212-R216 VanDerWaalsContact O-CG 3.29Å; V212-R216 WeakPolarHBondContact O-CG 3.38Å; V212-R216 PolarHBondContact O-N 3.44Å; V212-F243 HydrophobicContact CG1-CD1 4.47Å; V212-N309 WeakPolarHBondContact CG2-OD1 3.42Å
213V91.8Very high87.5Confident4 Ų428.2 Ų28.22%0.02416%0.155CC..Hα-helixtrans-66.8-47.2177.2177.80000111.1A154 P209 E211 Q215 R216 M217 V227 C230 V231 F243A154-V213 HydrophobicContact CB-CB 4.4Å; A154-V213 HydrophobicContact CB-CG1 4.03Å; P209-V213 WeakPolarHBondContact O-CG2 3.32Å; P209-V213 PolarHBondContact O-N 3.32Å; E211-V213 VanDerWaalsContact C-N 3.33Å; E211-V213 PolarHBondContact O-N 3.37Å; V213-Q215 PolarHBondContact O-N 3.17Å; V213-R216 PolarHBondContact O-N 3.34Å; V213-M217 HydrophobicContact CG1-CG 4.23Å; V213-M217 HydrophobicContact CG1-SD 4.23Å; V213-M217 WeakPolarHBondContact O-CB 3.36Å; V213-M217 VanDerWaalsContact O-CG 3.32Å; V213-M217 WeakPolarHBondContact O-CG 3.16Å; V213-M217 PolarHBondContact O-N 2.88Å; V213-V227 HydrophobicContact CG1-CG1 4.2Å; V213-C230 HydrophobicContact CG1-CB 4.13Å; V213-V231 HydrophobicContact CG2-CG2 3.63Å; V213-F243 HydrophobicContact CG2-CE1 3.99Å
214K90.7Very high87.5Confident15 Ų1528.3 Ų28.37%0.06515%0.154CC..Hα-helixtrans-50.5-56.7175.7175-171-174.1173.90111.2F109 D112 T155 A210 E211 R216 M217 Q218F109-K214 HydrophobicContact CE2-CD 4.08Å; F109-K214 HydrophobicContact CE2-CG 3.89Å; F109-K214 HydrophobicContact CZ-CG 4.04Å; D112-K214 IonicContact OD2-NZ 3.98Å; D112-K214 PolarHBondContact OD2-NZ 2.93Å; T155-K214 HydrophobicContact CG2-CD 4.38Å; T155-K214 WeakPolarHBondContact OG1-CD 3.36Å; A210-K214 WeakPolarHBondContact O-CB 3.49Å; A210-K214 PolarHBondContact O-N 2.93Å; E211-K214 WeakPolarHBondContact O-CB 3.28Å; E211-K214 PolarHBondContact O-N 2.94Å; K214-R216 PolarHBondContact O-N 2.91Å; K214-M217 PolarHBondContact O-N 3.18Å; K214-Q218 WeakPolarHBondContact O-CB 3.44Å; K214-Q218 WeakPolarHBondContact O-CG 3.26Å; K214-Q218 PolarHBondContact O-N 3.41Å
215Q88.2Confident87.5Confident14 Ų1438.1 Ų38.17%0.06519%0.19CC..Hα-helixtrans-62.6-43.4-175.1-69.1-178.115.100111.3T116 E211 V213 M217 Q218 M219 N309 T310T116-Q215 HydrophobicContact CG2-CB 4.09Å; T116-Q215 HydrophobicContact CG2-CG 4.2Å; E211-Q215 WeakPolarHBondContact O-CB 3.31Å; E211-Q215 WeakPolarHBondContact O-CG 3.32Å; E211-Q215 PolarHBondContact O-N 3.2Å; V213-Q215 PolarHBondContact O-N 3.17Å; Q215-M217 PolarHBondContact O-N 3.13Å; Q215-Q218 PolarHBondContact O-N 3.03Å; Q215-M219 WeakPolarHBondContact O-CG 3.39Å; Q215-M219 PolarHBondContact O-N 2.9Å; Q215-N309 HydrophobicContact CB-CB 4.48Å; Q215-N309 PolarHBondContact NE2-ND2 3.2Å; Q215-N309 PolarHBondContact OE1-ND2 3.48Å; Q215-T310 HydrophobicContact CB-CG2 4.27Å
216R89.1Confident87.6Confident10 Ų1038.1 Ų38.14%0.03819%0.192CC..Hα-helixtrans-64-35.7176.4-74.1172.6178.3-111.410.2113.7V212 V213 K214 S222 Y224 E238 N309V212-R216 WeakPolarHBondContact O-CB 3.31Å; V212-R216 WeakPolarHBondContact O-CD 2.96Å; V212-R216 VanDerWaalsContact O-CG 3.29Å; V212-R216 WeakPolarHBondContact O-CG 3.38Å; V212-R216 PolarHBondContact O-N 3.44Å; V213-R216 PolarHBondContact O-N 3.34Å; K214-R216 PolarHBondContact O-N 2.91Å; R216-S222 WeakPolarHBondContact O-CB 3.49Å; R216-S222 PolarHBondContact O-OG 3.01Å; R216-Y224 HydrophobicContact CB-CD2 4.48Å; R216-Y224 HydrophobicContact CB-CE2 4.05Å; R216-E238 IonicContact CZ-OE1 3.19Å; R216-E238 VanDerWaalsContact CZ-OE1 3.24Å; R216-E238 IonicContact CZ-OE2 2.95Å; R216-E238 IonicContact NH1-OE1 3.01Å; R216-E238 PolarHBondContact NH1-OE1 3.2Å; R216-E238 VanDerWaalsContact NH2-CD 3.26Å; R216-E238 IonicContact NH2-OE1 3.27Å; R216-E238 PolarHBondContact NH2-OE1 2.93Å; R216-E238 IonicContact NH2-OE2 2.86Å; R216-E238 PolarHBondContact NH2-OE2 3.36Å; R216-N309 PolarHBondContact NE-O 2.96Å; R216-N309 PolarHBondContact NH2-O 2.9Å
217M89.3Confident87.7Confident4 Ų438.1 Ų38.12%0.0219%0.188CC..Hα-helixtrans-74-29.2175.8-71-157.883.900113.3R150 V213 K214 Q215 V227 C230R150-M217 HydrophobicContact CG-CB 4.48Å; R150-M217 HydrophobicContact CG-CE 3.7Å; V213-M217 HydrophobicContact CG1-CG 4.23Å; V213-M217 HydrophobicContact CG1-SD 4.23Å; V213-M217 WeakPolarHBondContact O-CB 3.36Å; V213-M217 VanDerWaalsContact O-CG 3.32Å; V213-M217 WeakPolarHBondContact O-CG 3.16Å; V213-M217 PolarHBondContact O-N 2.88Å; K214-M217 PolarHBondContact O-N 3.18Å; Q215-M217 PolarHBondContact O-N 3.13Å; M217-V227 HydrophobicContact SD-CB 4.31Å; M217-V227 HydrophobicContact SD-CG2 3.62Å; M217-C230 HydrophobicContact CG-CB 4.22Å
218Q87.6Confident87.9Confident2 Ų245 Ų451%0.00922%0.224CC..Hα-helixtrans-80-18-179.6-73.8178.3-3000113.8F109 C113 R117 K214 Q215F109-Q218 HydrophobicContact CE1-CG 4.48Å; F109-Q218 HydrophobicContact CZ-CG 4.47Å; F109-Q218 VanDerWaalsContact CZ-NE2 3.27Å; C113-Q218 HydrophobicContact CB-CG 4.12Å; R117-Q218 PolarHBondContact NE-O 3.45Å; R117-Q218 PolarHBondContact NH2-O 3.14Å; K214-Q218 WeakPolarHBondContact O-CB 3.44Å; K214-Q218 WeakPolarHBondContact O-CG 3.26Å; K214-Q218 PolarHBondContact O-N 3.41Å; Q215-Q218 PolarHBondContact O-N 3.03Å
219M83.7Confident88Confident26 Ų2648.5 Ų48.513%0.12824%0.243CC..SBendtrans-55.3147.9177.4-66-55.2-83.300113.8T116 S120 Q215 K221 S222 T310 E312T116-M219 HydrophobicContact CG2-SD 4.08Å; S120-M219 VanDerWaalsContact OG-CE 3.27Å; S120-M219 WeakPolarHBondContact OG-CE 3.13Å; Q215-M219 WeakPolarHBondContact O-CG 3.39Å; Q215-M219 PolarHBondContact O-N 2.9Å; M219-K221 PolarHBondContact O-N 3.48Å; M219-S222 WeakPolarHBondContact O-CB 3.38Å; M219-S222 PolarHBondContact O-N 3.47Å; M219-T310 HydrophobicContact CE-CG2 4.03Å; M219-T310 HydrophobicContact CG-CG2 4.03Å; M219-T310 HydrophobicContact SD-CG2 3.45Å; M219-T310 WeakPolarHBondContact SD-CG2 3.09Å; M219-E312 HydrophobicContact CE-CG 3.9Å
220F79.1Confident88Confident56 Ų5647 Ų4725%0.24623%0.233CC..THydrogen-bonded Turntrans-58.2135.3171.9-177.2-113.8000110.6D124 E143 S222D124-F220 HydrophobicContact CB-CD1 3.81Å; D124-F220 HydrophobicContact CB-CD2 4.16Å; D124-F220 HydrophobicContact CB-CE1 3.62Å; D124-F220 HydrophobicContact CB-CE2 4Å; D124-F220 HydrophobicContact CB-CG 4.05Å; D124-F220 HydrophobicContact CB-CZ 3.72Å; E143-F220 WeakPolarHBondContact OE1-CD2 3.42Å; F220-S222 PolarHBondContact O-N 2.93Å
221K80.1Confident88.1Confident160 Ų16048.9 Ų48.970%0.69624%0.244SC*.THydrogen-bonded Turntrans48.332.1-175.5-68.4176.7176.9173.70114.4M219M219-K221 PolarHBondContact O-N 3.48Å
222S82.8Confident88.3Confident12 Ų1248.4 Ų48.48%0.08425%0.248CC..  trans-48.2127.1175.6-178.80000111.8R216 M219 F220 Y224R216-S222 WeakPolarHBondContact O-CB 3.49Å; R216-S222 PolarHBondContact O-OG 3.01Å; M219-S222 WeakPolarHBondContact O-CB 3.38Å; M219-S222 PolarHBondContact O-N 3.47Å; F220-S222 PolarHBondContact O-N 2.93Å; S222-Y224 VanDerWaalsContact C-N 3.29Å; S222-Y224 PolarHBondContact O-N 3.34Å
223P84Confident88.4Confident101 Ų10148.8 Ų48.866%0.65625%0.252SS*.  trans-75.9-15.7-171.230.9-36.7000113.5
224Y87.8Confident88.3Confident25 Ų2548.6 Ų48.610%0.09825%0.251CS..  trans-82.4128.3-173.4-48.4-70.4000111.5R150 R216 S222 D229 C230 A233R150-Y224 PolarHBondContact NH2-O 2.84Å; R216-Y224 HydrophobicContact CB-CD2 4.48Å; R216-Y224 HydrophobicContact CB-CE2 4.05Å; S222-Y224 VanDerWaalsContact C-N 3.29Å; S222-Y224 PolarHBondContact O-N 3.34Å; Y224-D229 VanDerWaalsContact CA-OD2 3.31Å; Y224-D229 WeakPolarHBondContact CA-OD2 3.29Å; Y224-C230 HydrophobicContact CD1-CB 4.09Å; Y224-C230 HydrophobicContact CD2-CB 4.09Å; Y224-C230 VanDerWaalsContact CD2-SG 3.51Å; Y224-C230 HydrophobicContact CG-CB 3.72Å; Y224-A233 HydrophobicContact CD1-CB 4.03Å; Y224-A233 HydrophobicContact CE1-CB 3.61Å
225R85.6Confident88.4Confident223 Ų22355 Ų5584%0.84228%0.275SS*.SBendtrans-70.9-35.3178.9-70.3-174.8171.7-165.3-2.5112.7R150 D229R150-R225 PolarHBondContact NH2-O 2.82Å; R225-D229 PolarHBondContact N-OD2 2.86Å
226G89.9Confident88.5Confident25 Ų2562.2 Ų62.226%0.25831%0.308SS..SBendtrans-154.4177.9-17700000113.4D229 C230G226-D229 PolarHBondContact O-N 3.4Å; G226-C230 WeakPolarHBondContact O-CB 3.2Å; G226-C230 PolarHBondContact O-N 3.49Å
227V91.9Very high88.3Confident38 Ų3870.5 Ų70.523%0.2334%0.34CS..Hα-helixtrans-59.5-50.8-179.6168.30000111.4A154 V213 M217 D229 C230 V231A154-V227 HydrophobicContact CB-CG1 3.79Å; A154-V227 HydrophobicContact CB-CG2 3.92Å; V213-V227 HydrophobicContact CG1-CG1 4.2Å; M217-V227 HydrophobicContact SD-CB 4.31Å; M217-V227 HydrophobicContact SD-CG2 3.62Å; V227-D229 PolarHBondContact O-N 3.19Å; V227-C230 WeakPolarHBondContact O-CB 3.47Å; V227-C230 PolarHBondContact O-N 3.49Å; V227-V231 WeakPolarHBondContact O-CG2 3.44Å; V227-V231 PolarHBondContact O-N 3.32Å
228L92.9Very high88Confident148 Ų14871.9 Ų71.978%0.77535%0.346SS*.Hα-helixtrans-65.9-37.2-177.9-60.1178.3000112.6V231 G232L228-V231 PolarHBondContact O-N 3Å; L228-G232 PolarHBondContact O-N 3.45Å
229D93.1Very high88Confident75 Ų7572.8 Ų72.840%0.40136%0.355SS..Hα-helixtrans-63.2-42.9173174.347.7000111.3Y224 R225 G226 V227 A233Y224-D229 VanDerWaalsContact CA-OD2 3.31Å; Y224-D229 WeakPolarHBondContact CA-OD2 3.29Å; R225-D229 PolarHBondContact N-OD2 2.86Å; G226-D229 PolarHBondContact O-N 3.4Å; V227-D229 PolarHBondContact O-N 3.19Å; D229-A233 WeakPolarHBondContact O-CB 3.25Å; D229-A233 PolarHBondContact O-N 3.03Å
230C91.6Very high88.2Confident0 Ų075 Ų750%037%0.372CS..Hα-helixtrans-61.7-47.9172.8-168.70000112.2V213 M217 Y224 G226 V227 A233 V234V213-C230 HydrophobicContact CG1-CB 4.13Å; M217-C230 HydrophobicContact CG-CB 4.22Å; Y224-C230 HydrophobicContact CD1-CB 4.09Å; Y224-C230 HydrophobicContact CD2-CB 4.09Å; Y224-C230 VanDerWaalsContact CD2-SG 3.51Å; Y224-C230 HydrophobicContact CG-CB 3.72Å; G226-C230 WeakPolarHBondContact O-CB 3.2Å; G226-C230 PolarHBondContact O-N 3.49Å; V227-C230 WeakPolarHBondContact O-CB 3.47Å; V227-C230 PolarHBondContact O-N 3.49Å; C230-A233 PolarHBondContact O-N 2.89Å; C230-V234 WeakPolarHBondContact O-CB 3.37Å; C230-V234 VanDerWaalsContact O-CG2 3.26Å; C230-V234 WeakPolarHBondContact O-CG2 3.44Å; C230-V234 PolarHBondContact O-N 3.39Å
231V93.2Very high88.6Confident52 Ų5275.8 Ų75.832%0.31539%0.389SS..Hα-helixtrans-59.7-51178.1170.90000111.1V213 V227 L228 A233 V234 W235 F243V213-V231 HydrophobicContact CG2-CG2 3.63Å; V227-V231 WeakPolarHBondContact O-CG2 3.44Å; V227-V231 PolarHBondContact O-N 3.32Å; L228-V231 PolarHBondContact O-N 3Å; V231-A233 PolarHBondContact O-N 3.44Å; V231-V234 PolarHBondContact O-N 3.27Å; V231-W235 VanDerWaalsContact O-CB 3.29Å; V231-W235 WeakPolarHBondContact O-CB 3.48Å; V231-W235 PolarHBondContact O-N 3.07Å; V231-F243 HydrophobicContact CG1-CZ 4.15Å
232G93.1Very high88.9Confident26 Ų2668.3 Ų68.327%0.26836%0.357SS..Hα-helixtrans-62-43.7179.800000112.6L228 W235 Q236L228-G232 PolarHBondContact O-N 3.45Å; G232-W235 PolarHBondContact O-N 2.9Å; G232-Q236 WeakPolarHBondContact O-CB 3.42Å; G232-Q236 VanDerWaalsContact O-CG 3.27Å; G232-Q236 WeakPolarHBondContact O-CG 3.47Å; G232-Q236 PolarHBondContact O-N 2.98Å
233A90.2Very high89.2Confident9 Ų968.5 Ų68.57%0.07436%0.356CS..Hα-helixtrans-68.8-37178.500000113.1Y224 D229 C230 V231 R237Y224-A233 HydrophobicContact CD1-CB 4.03Å; Y224-A233 HydrophobicContact CE1-CB 3.61Å; D229-A233 WeakPolarHBondContact O-CB 3.25Å; D229-A233 PolarHBondContact O-N 3.03Å; C230-A233 PolarHBondContact O-N 2.89Å; V231-A233 PolarHBondContact O-N 3.44Å; A233-R237 WeakPolarHBondContact O-CB 3.3Å; A233-R237 VanDerWaalsContact O-CG 3.22Å; A233-R237 WeakPolarHBondContact O-CG 3.48Å; A233-R237 PolarHBondContact O-N 3.27Å
234V90.1Very high89.4Confident0 Ų069 Ų690%035%0.346CS..Hα-helixtrans-66.4-46.3173170.70000110.2C230 V231 Q236 R237 E238 G239 A242 F243C230-V234 WeakPolarHBondContact O-CB 3.37Å; C230-V234 VanDerWaalsContact O-CG2 3.26Å; C230-V234 WeakPolarHBondContact O-CG2 3.44Å; C230-V234 PolarHBondContact O-N 3.39Å; V231-V234 PolarHBondContact O-N 3.27Å; V234-Q236 PolarHBondContact O-N 2.92Å; V234-R237 PolarHBondContact O-N 2.96Å; V234-E238 WeakPolarHBondContact O-CA 3.34Å; V234-E238 WeakPolarHBondContact O-CB 3.26Å; V234-E238 PolarHBondContact O-N 3.47Å; V234-G239 PolarHBondContact O-N 3.43Å; V234-A242 HydrophobicContact CG1-CB 3.71Å; V234-F243 HydrophobicContact CB-CE1 4.49Å; V234-F243 HydrophobicContact CB-CE2 4.41Å; V234-F243 HydrophobicContact CB-CZ 3.93Å; V234-F243 HydrophobicContact CG1-CD2 4.35Å; V234-F243 HydrophobicContact CG1-CE1 4.11Å; V234-F243 HydrophobicContact CG1-CE2 3.79Å; V234-F243 HydrophobicContact CG1-CZ 3.66Å
235W92.4Very high89.1Confident150 Ų15069.5 Ų69.557%0.56835%0.347SS*.Hα-helixtrans-58-47.1177.8-173.5-80.4000112.3V231 G232 G239 P240 F243V231-W235 VanDerWaalsContact O-CB 3.29Å; V231-W235 WeakPolarHBondContact O-CB 3.48Å; V231-W235 PolarHBondContact O-N 3.07Å; G232-W235 PolarHBondContact O-N 2.9Å; W235-G239 VanDerWaalsContact O-CA 3.23Å; W235-G239 WeakPolarHBondContact O-CA 3.45Å; W235-G239 PolarHBondContact O-N 3.44Å; W235-G239 VanDerWaalsContact O-N 3.14Å; W235-P240 HydrophobicContact CE3-CB 4.2Å; W235-P240 HydrophobicContact CH2-CB 3.88Å; W235-P240 HydrophobicContact CZ2-CB 4.4Å; W235-P240 HydrophobicContact CZ3-CB 3.76Å; W235-F243 HydrophobicContact CB-CE2 4.4Å; W235-F243 AromaticContact CE3-CE2 3.99Å; W235-F243 HydrophobicContact CE3-CE2 3.99Å
236Q90.1Very high88.7Confident164 Ų16458.9 Ų58.977%0.76631%0.307SS*.Hα-helixtrans-75.3-33.9-177.6-69.6174.25.100113.8G232 V234G232-Q236 WeakPolarHBondContact O-CB 3.42Å; G232-Q236 VanDerWaalsContact O-CG 3.27Å; G232-Q236 WeakPolarHBondContact O-CG 3.47Å; G232-Q236 PolarHBondContact O-N 2.98Å; V234-Q236 PolarHBondContact O-N 2.92Å
237R86.6Confident88.4Confident185 Ų18560.1 Ų60.170%0.69830%0.304SS*.Hα-helixtrans-96.4-26.6-174.1-61.1176.2-177179.72.3114.4A233 V234 Q328A233-R237 WeakPolarHBondContact O-CB 3.3Å; A233-R237 VanDerWaalsContact O-CG 3.22Å; A233-R237 WeakPolarHBondContact O-CG 3.48Å; A233-R237 PolarHBondContact O-N 3.27Å; V234-R237 PolarHBondContact O-N 2.96Å; R237-Q328 PolarHBondContact O-NE2 3.4Å
238E83.1Confident87.8Confident33 Ų3362.6 Ų62.615%0.15432%0.32CS..Hα-helixtrans-125.3-9.3-175.2-54.8-170.4-142.400113.9R216 V234 A242 R245R216-E238 IonicContact CZ-OE1 3.19Å; R216-E238 VanDerWaalsContact CZ-OE1 3.24Å; R216-E238 IonicContact CZ-OE2 2.95Å; R216-E238 IonicContact NH1-OE1 3.01Å; R216-E238 PolarHBondContact NH1-OE1 3.2Å; R216-E238 VanDerWaalsContact NH2-CD 3.26Å; R216-E238 IonicContact NH2-OE1 3.27Å; R216-E238 PolarHBondContact NH2-OE1 2.93Å; R216-E238 IonicContact NH2-OE2 2.86Å; R216-E238 PolarHBondContact NH2-OE2 3.36Å; V234-E238 WeakPolarHBondContact O-CA 3.34Å; V234-E238 WeakPolarHBondContact O-CB 3.26Å; V234-E238 PolarHBondContact O-N 3.47Å; E238-A242 HydrophobicContact CB-CB 3.54Å; E238-R245 IonicContact OE2-CZ 3.73Å; E238-R245 IonicContact OE2-NH1 3.95Å; E238-R245 PolarHBondContact OE2-NH1 3.5Å; E238-R245 IonicContact OE2-NH2 3.4Å
239G87.8Confident87Confident20 Ų2055.7 Ų55.721%0.20628%0.284CS..  trans77.8169.9-179.800000114.1V234 W235 A241 A242V234-G239 PolarHBondContact O-N 3.43Å; W235-G239 VanDerWaalsContact O-CA 3.23Å; W235-G239 WeakPolarHBondContact O-CA 3.45Å; W235-G239 PolarHBondContact O-N 3.44Å; W235-G239 VanDerWaalsContact O-N 3.14Å; G239-A241 PolarHBondContact O-N 2.92Å; G239-A242 VanDerWaalsContact O-CB 3.27Å; G239-A242 WeakPolarHBondContact O-CB 3.4Å; G239-A242 PolarHBondContact O-N 3.43Å; G239-A242 VanDerWaalsContact O-N 3.1Å
240P87.7Confident86.1Confident73 Ų7352.2 Ų52.247%0.47427%0.265SS..G310 helixtrans-61-29.3-178.423.1-33.8000113.5W235 A242 F243W235-P240 HydrophobicContact CE3-CB 4.2Å; W235-P240 HydrophobicContact CH2-CB 3.88Å; W235-P240 HydrophobicContact CZ2-CB 4.4Å; W235-P240 HydrophobicContact CZ3-CB 3.76Å; P240-A242 PolarHBondContact O-N 3.32Å; P240-A242 VanDerWaalsContact O-N 3.16Å; P240-F243 WeakPolarHBondContact O-CD2 3.38Å; P240-F243 PolarHBondContact O-N 2.68Å
241A86.9Confident85.5Confident73 Ų7354.5 Ų54.560%0.60328%0.277SS*.G310 helixtrans-62.8-20.2177.300000113.5G239 F243 Y244 R245G239-A241 PolarHBondContact O-N 2.92Å; A241-F243 PolarHBondContact O-N 3.35Å; A241-Y244 PolarHBondContact O-N 3.27Å; A241-R245 PolarHBondContact O-N 3.07Å; A241-R245 VanDerWaalsContact O-N 3.13Å
242A85.3Confident84.8Confident2 Ų255.1 Ų55.12%0.01728%0.281CS..G310 helixtrans-62.4-30.8176.700000113V234 E238 G239 P240 Y244V234-A242 HydrophobicContact CG1-CB 3.71Å; E238-A242 HydrophobicContact CB-CB 3.54Å; G239-A242 VanDerWaalsContact O-CB 3.27Å; G239-A242 WeakPolarHBondContact O-CB 3.4Å; G239-A242 PolarHBondContact O-N 3.43Å; G239-A242 VanDerWaalsContact O-N 3.1Å; P240-A242 PolarHBondContact O-N 3.32Å; P240-A242 VanDerWaalsContact O-N 3.16Å; A242-Y244 PolarHBondContact O-N 2.85Å
243F89Confident84.1Confident17 Ų1754.5 Ų54.58%0.07527%0.272CS..G310 helixtrans-72.6-10.5178.1-64.5-82.5000114.1N208 P209 V212 V213 V231 V234 W235 P240 A241N208-F243 PolarHBondContact ND2-O 3.05Å; P209-F243 HydrophobicContact CB-CB 4.27Å; P209-F243 HydrophobicContact CB-CD1 4.16Å; P209-F243 HydrophobicContact CG-CB 4.45Å; V212-F243 HydrophobicContact CG1-CD1 4.47Å; V213-F243 HydrophobicContact CG2-CE1 3.99Å; V231-F243 HydrophobicContact CG1-CZ 4.15Å; V234-F243 HydrophobicContact CB-CE1 4.49Å; V234-F243 HydrophobicContact CB-CE2 4.41Å; V234-F243 HydrophobicContact CB-CZ 3.93Å; V234-F243 HydrophobicContact CG1-CD2 4.35Å; V234-F243 HydrophobicContact CG1-CE1 4.11Å; V234-F243 HydrophobicContact CG1-CE2 3.79Å; V234-F243 HydrophobicContact CG1-CZ 3.66Å; W235-F243 HydrophobicContact CB-CE2 4.4Å; W235-F243 AromaticContact CE3-CE2 3.99Å; W235-F243 HydrophobicContact CE3-CE2 3.99Å; P240-F243 WeakPolarHBondContact O-CD2 3.38Å; P240-F243 PolarHBondContact O-N 2.68Å; A241-F243 PolarHBondContact O-N 3.35Å
244Y89.1Confident83.4Confident111 Ų11155.2 Ų55.244%0.43527%0.274SS..G310 helixtrans-126.13.8179.9-71.8-83.5000113.7A205 P209 A241 A242 S246 Y247A205-Y244 WeakPolarHBondContact O-CE1 3.33Å; A205-Y244 PolarHBondContact O-OH 3.02Å; P209-Y244 HydrophobicContact CG-CE1 4.36Å; P209-Y244 HydrophobicContact CG-CE2 3.98Å; P209-Y244 WeakPolarHBondContact CG-OH 3.38Å; A241-Y244 PolarHBondContact O-N 3.27Å; A242-Y244 PolarHBondContact O-N 2.85Å; Y244-S246 PolarHBondContact O-N 3.43Å; Y244-S246 VanDerWaalsContact O-N 3.17Å; Y244-Y247 HydrophobicContact CD1-CG 4.37Å; Y244-Y247 VanDerWaalsContact O-CB 3.26Å; Y244-Y247 WeakPolarHBondContact O-CB 3.39Å; Y244-Y247 PolarHBondContact O-N 3.08Å
245R80.7Confident82.7Confident35 Ų3558.7 Ų58.713%0.13230%0.295CS..THydrogen-bonded Turntrans-60-30.2-175.3-171.2179.7-65.8151.81.3114.2E238 A241 Q311 I329E238-R245 IonicContact OE2-CZ 3.73Å; E238-R245 IonicContact OE2-NH1 3.95Å; E238-R245 PolarHBondContact OE2-NH1 3.5Å; E238-R245 IonicContact OE2-NH2 3.4Å; A241-R245 PolarHBondContact O-N 3.07Å; A241-R245 VanDerWaalsContact O-N 3.13Å; R245-Q311 VanDerWaalsContact NH1-NE2 3.16Å; R245-I329 VanDerWaalsContact CD-O 3.32Å; R245-I329 WeakPolarHBondContact CD-O 3.43Å
246S79.1Confident82.2Confident0 Ų053.6 Ų53.60%028%0.282CS..THydrogen-bonded Turntrans-90.7-15.6177.951.70000114N208 Y244 T248 T249 Q250 N309N208-S246 PolarHBondContact ND2-OG 2.95Å; N208-S246 PolarHBondContact OD1-OG 3.16Å; Y244-S246 PolarHBondContact O-N 3.43Å; Y244-S246 VanDerWaalsContact O-N 3.17Å; S246-T248 VanDerWaalsContact C-N 3.31Å; S246-T248 PolarHBondContact O-N 2.97Å; S246-T249 WeakPolarHBondContact O-CA 3.25Å; S246-T249 VanDerWaalsContact O-CB 3.31Å; S246-T249 WeakPolarHBondContact O-CB 3.36Å; S246-T249 PolarHBondContact O-N 2.96Å; S246-Q250 PolarHBondContact O-N 2.89Å; S246-N309 WeakPolarHBondContact CB-OD1 3.31Å; S246-N309 PolarHBondContact OG-OD1 3.44Å
247Y82.4Confident81.8Confident51 Ų5147.9 Ų47.920%0.225%0.254CS..Hα-helixtrans-58-42.2-171.8179.2-119.3000111.7L201 D204 A205 Y244 T249 Q250 L251L201-Y247 PolarHBondContact O-OH 2.97Å; D204-Y247 HydrophobicContact CB-CE2 4.32Å; A205-Y247 HydrophobicContact CB-CE2 3.93Å; Y244-Y247 HydrophobicContact CD1-CG 4.37Å; Y244-Y247 VanDerWaalsContact O-CB 3.26Å; Y244-Y247 WeakPolarHBondContact O-CB 3.39Å; Y244-Y247 PolarHBondContact O-N 3.08Å; Y247-T249 VanDerWaalsContact C-N 3.26Å; Y247-T249 PolarHBondContact O-N 3.41Å; Y247-Q250 WeakPolarHBondContact O-CB 3.48Å; Y247-Q250 PolarHBondContact O-N 3.42Å; Y247-Q250 VanDerWaalsContact O-N 3.12Å; Y247-L251 HydrophobicContact CD1-CD1 4.18Å; Y247-L251 HydrophobicContact CD2-CG 4.48Å; Y247-L251 HydrophobicContact CE1-CD1 3.75Å; Y247-L251 HydrophobicContact CE1-CD2 4.41Å; Y247-L251 HydrophobicContact CE1-CG 4.19Å; Y247-L251 HydrophobicContact CE2-CD2 3.91Å; Y247-L251 HydrophobicContact CE2-CG 4.15Å; Y247-L251 WeakPolarHBondContact O-CG 3.38Å; Y247-L251 PolarHBondContact O-N 3.38Å
248T79.4Confident81.3Confident91 Ų9141.4 Ų41.456%0.55823%0.232SC*.Hα-helixtrans-58.4-36.5173.4-43.50000112.8S246 T252S246-T248 VanDerWaalsContact C-N 3.31Å; S246-T248 PolarHBondContact O-N 2.97Å; T248-T252 PolarHBondContact O-N 3.27Å; T248-T252 VanDerWaalsContact O-N 3.1Å; T248-T252 PolarHBondContact O-OG1 3.26Å
249T75.6Confident81.1Confident2 Ų243.3 Ų43.31%0.01225%0.246CC..Hα-helixtrans-72.3-37.2177.3-580000111.6S246 Y247 T252 M253 C304 K305 L308 L332S246-T249 WeakPolarHBondContact O-CA 3.25Å; S246-T249 VanDerWaalsContact O-CB 3.31Å; S246-T249 WeakPolarHBondContact O-CB 3.36Å; S246-T249 PolarHBondContact O-N 2.96Å; Y247-T249 VanDerWaalsContact C-N 3.26Å; Y247-T249 PolarHBondContact O-N 3.41Å; T249-T252 PolarHBondContact O-N 2.87Å; T249-M253 WeakPolarHBondContact O-CB 3.44Å; T249-M253 PolarHBondContact O-N 3.28Å; T249-C304 HydrophobicContact CG2-CB 4.27Å; T249-K305 HydrophobicContact CG2-CB 4.03Å; T249-L308 VanDerWaalsContact OG1-CD1 3.25Å; T249-L308 WeakPolarHBondContact OG1-CD1 3.42Å; T249-L332 HydrophobicContact CG2-CD1 3.7Å
250Q74.3Confident80.9Confident2 Ų246.8 Ų46.81%0.00926%0.255CS..Hα-helixtrans-62.2-47.3173.3178.517130.400111.2D204 N208 E211 S246 Y247 T252 M253 N254 K305D204-Q250 HydrophobicContact CB-CG 4.24Å; D204-Q250 WeakPolarHBondContact OD2-CG 3.35Å; D204-Q250 PolarHBondContact OD2-NE2 3.42Å; N208-Q250 PolarHBondContact OD1-OE1 3.34Å; N208-Q250 VanDerWaalsContact OD1-OE1 3.11Å; E211-Q250 PolarHBondContact OE2-NE2 2.71Å; S246-Q250 PolarHBondContact O-N 2.89Å; Y247-Q250 WeakPolarHBondContact O-CB 3.48Å; Y247-Q250 PolarHBondContact O-N 3.42Å; Y247-Q250 VanDerWaalsContact O-N 3.12Å; Q250-T252 PolarHBondContact O-N 3.09Å; Q250-M253 WeakPolarHBondContact O-CB 3.35Å; Q250-M253 PolarHBondContact O-N 3.22Å; Q250-N254 PolarHBondContact O-N 3Å; Q250-N254 PolarHBondContact O-OD1 3.01Å; Q250-K305 HydrophobicContact CB-CD 4.2Å
251L78.7Confident80.5Confident48 Ų4845.3 Ų45.325%0.25124%0.242SC..Hα-helixtrans-54.8-48.7172.6-66.2-179000112.2L201 Y247 M253L201-L251 HydrophobicContact CB-CD2 3.99Å; L201-L251 HydrophobicContact CD1-CD2 4.01Å; L201-L251 HydrophobicContact CD2-CD2 3.67Å; L201-L251 HydrophobicContact CG-CD2 4.05Å; Y247-L251 HydrophobicContact CD1-CD1 4.18Å; Y247-L251 HydrophobicContact CD2-CG 4.48Å; Y247-L251 HydrophobicContact CE1-CD1 3.75Å; Y247-L251 HydrophobicContact CE1-CD2 4.41Å; Y247-L251 HydrophobicContact CE1-CG 4.19Å; Y247-L251 HydrophobicContact CE2-CD2 3.91Å; Y247-L251 HydrophobicContact CE2-CG 4.15Å; Y247-L251 WeakPolarHBondContact O-CG 3.38Å; Y247-L251 PolarHBondContact O-N 3.38Å; L251-M253 PolarHBondContact O-N 2.77Å
252T78.5Confident80Confident66 Ų6646 Ų4641%0.40523%0.231SC..Hα-helixtrans-66.6-20.4177.6-52.80000113.3T248 T249 Q250 P256 L332T248-T252 PolarHBondContact O-N 3.27Å; T248-T252 VanDerWaalsContact O-N 3.1Å; T248-T252 PolarHBondContact O-OG1 3.26Å; T249-T252 PolarHBondContact O-N 2.87Å; Q250-T252 PolarHBondContact O-N 3.09Å; T252-P256 WeakPolarHBondContact O-CD 3.34Å; T252-P256 VanDerWaalsContact O-CG 3.27Å; T252-P256 WeakPolarHBondContact O-CG 3.32Å; T252-L332 HydrophobicContact CG2-CD2 4.07Å
253M78.9Confident79.8Confident13 Ų1352 Ų526%0.06426%0.261CS..Hα-helixtrans-88.1-41.2177.3-175.7-173.176.700112.8T249 Q250 L251 P256 F257 L301 D302T249-M253 WeakPolarHBondContact O-CB 3.44Å; T249-M253 PolarHBondContact O-N 3.28Å; Q250-M253 WeakPolarHBondContact O-CB 3.35Å; Q250-M253 PolarHBondContact O-N 3.22Å; L251-M253 PolarHBondContact O-N 2.77Å; M253-P256 WeakPolarHBondContact O-CD 3.36Å; M253-F257 WeakPolarHBondContact O-CB 3.27Å; M253-F257 PolarHBondContact O-N 3.17Å; M253-L301 HydrophobicContact CB-CB 3.95Å; M253-L301 HydrophobicContact CB-CD1 4.19Å; M253-L301 HydrophobicContact CG-CB 3.91Å; M253-L301 HydrophobicContact CG-CD1 4.46Å; M253-L301 HydrophobicContact SD-CB 4.48Å; M253-D302 HydrophobicContact SD-CB 3.63Å
254N75.1Confident79.4Confident23 Ų2352.3 Ų52.312%0.12326%0.264CS..Hα-helixtrans-67.2-42-171-700.9000112.2D204 Q250 F257 Q258D204-N254 PolarHBondContact OD2-ND2 3.48Å; Q250-N254 PolarHBondContact O-N 3Å; Q250-N254 PolarHBondContact O-OD1 3.01Å; N254-F257 PolarHBondContact O-N 3.13Å; N254-Q258 WeakPolarHBondContact O-CB 3.27Å; N254-Q258 PolarHBondContact O-N 3.19Å
255V76Confident79Confident73 Ų7349.3 Ų49.344%0.44225%0.252SS..Hα-helixtrans-62.5-50.8180175.10000111.3F257 Q258 V259V255-F257 VanDerWaalsContact C-N 3.34Å; V255-F257 PolarHBondContact O-N 3.39Å; V255-Q258 PolarHBondContact O-N 3.22Å; V255-V259 WeakPolarHBondContact O-CG2 3.16Å; V255-V259 PolarHBondContact O-N 3.31Å
256P82.3Confident78.8Confident44 Ų4450.3 Ų50.329%0.28626%0.258SS..Hα-helixtrans-57.5-40.5170.4-27.936000114.2T252 M253 Q258 V259 F260 T298T252-P256 WeakPolarHBondContact O-CD 3.34Å; T252-P256 VanDerWaalsContact O-CG 3.27Å; T252-P256 WeakPolarHBondContact O-CG 3.32Å; M253-P256 WeakPolarHBondContact O-CD 3.36Å; P256-Q258 PolarHBondContact O-N 3.29Å; P256-V259 PolarHBondContact O-N 3.39Å; P256-F260 HydrophobicContact CB-CD2 4.43Å; P256-F260 HydrophobicContact CB-CE2 4.39Å; P256-F260 WeakPolarHBondContact O-CD2 3.1Å; P256-F260 PolarHBondContact O-N 2.88Å; P256-T298 HydrophobicContact CB-CG2 4.03Å
257F81.2Confident79.1Confident44 Ų4457.4 Ų57.419%0.19329%0.286CS..Hα-helixtrans-59.3-47.9178.4-179.9-91.9000110.9M253 N254 V255 F260 H261 A294 A295 T298M253-F257 WeakPolarHBondContact O-CB 3.27Å; M253-F257 PolarHBondContact O-N 3.17Å; N254-F257 PolarHBondContact O-N 3.13Å; V255-F257 VanDerWaalsContact C-N 3.34Å; V255-F257 PolarHBondContact O-N 3.39Å; F257-F260 PolarHBondContact O-N 3.45Å; F257-H261 VanDerWaalsContact O-CB 3.27Å; F257-H261 WeakPolarHBondContact O-CB 3.42Å; F257-H261 PolarHBondContact O-N 2.92Å; F257-A294 HydrophobicContact CD2-CB 3.69Å; F257-A294 HydrophobicContact CE2-CB 3.69Å; F257-A294 HydrophobicContact CG-CB 4.27Å; F257-A294 HydrophobicContact CZ-CB 4.26Å; F257-A294 WeakPolarHBondContact O-CB 3.42Å; F257-A295 HydrophobicContact CE2-CB 4.3Å; F257-T298 HydrophobicContact CB-CG2 3.99Å
258Q76.3Confident79.1Confident48 Ų4855.8 Ų55.822%0.22428%0.281CS..Hα-helixtrans-66.7-39.7-178.8-161.66243.100112.3N254 V255 P256 H261 F262N254-Q258 WeakPolarHBondContact O-CB 3.27Å; N254-Q258 PolarHBondContact O-N 3.19Å; V255-Q258 PolarHBondContact O-N 3.22Å; P256-Q258 PolarHBondContact O-N 3.29Å; Q258-H261 PolarHBondContact O-N 3.24Å; Q258-F262 HydrophobicContact CG-CD2 3.75Å; Q258-F262 HydrophobicContact CG-CE2 3.54Å; Q258-F262 VanDerWaalsContact NE2-CZ 3.31Å; Q258-F262 WeakPolarHBondContact O-CD2 3.42Å; Q258-F262 PolarHBondContact O-N 3.13Å
259V78.9Confident79Confident74 Ų7451.7 Ų51.745%0.44826%0.255SS..Hα-helixtrans-62.4-51.2175.3170.40000111.1V255 P256 H261 F262 M263V255-V259 WeakPolarHBondContact O-CG2 3.16Å; V255-V259 PolarHBondContact O-N 3.31Å; P256-V259 PolarHBondContact O-N 3.39Å; V259-H261 VanDerWaalsContact C-N 3.29Å; V259-H261 PolarHBondContact O-N 3.3Å; V259-F262 PolarHBondContact O-N 2.94Å; V259-M263 HydrophobicContact CG1-CG 4.39Å; V259-M263 HydrophobicContact CG1-SD 3.74Å; V259-M263 WeakPolarHBondContact O-CB 3.39Å; V259-M263 VanDerWaalsContact O-CG 3.3Å; V259-M263 WeakPolarHBondContact O-CG 3.35Å; V259-M263 PolarHBondContact O-N 2.93Å
260F83.5Confident79.3Confident93 Ų9357.4 Ų57.441%0.40828%0.282SS..Hα-helixtrans-62.4-37.2177.3-75.8-59.2000112.1P256 F257 T264 A294 A297P256-F260 HydrophobicContact CB-CD2 4.43Å; P256-F260 HydrophobicContact CB-CE2 4.39Å; P256-F260 WeakPolarHBondContact O-CD2 3.1Å; P256-F260 PolarHBondContact O-N 2.88Å; F257-F260 PolarHBondContact O-N 3.45Å; F260-T264 VanDerWaalsContact O-CB 3.24Å; F260-T264 WeakPolarHBondContact O-CB 3.49Å; F260-T264 PolarHBondContact O-N 3.12Å; F260-T264 VanDerWaalsContact O-N 3.08Å; F260-T264 PolarHBondContact O-OG1 3.48Å; F260-A294 HydrophobicContact CB-CB 3.89Å; F260-A297 HydrophobicContact CD2-CB 3.87Å; F260-A297 HydrophobicContact CE2-CB 3.97Å; F260-A297 HydrophobicContact CG-CB 4.31Å; F260-A297 HydrophobicContact CZ-CB 4.47Å
261H80.1Confident79.8Confident41 Ų4162.7 Ų62.719%0.1931%0.31CS..Hα-helixtrans-63.9-54.2177.8-173.373000111.3F257 Q258 V259 T264 Y265 G291 A294F257-H261 VanDerWaalsContact O-CB 3.27Å; F257-H261 WeakPolarHBondContact O-CB 3.42Å; F257-H261 PolarHBondContact O-N 2.92Å; Q258-H261 PolarHBondContact O-N 3.24Å; V259-H261 VanDerWaalsContact C-N 3.29Å; V259-H261 PolarHBondContact O-N 3.3Å; H261-T264 PolarHBondContact O-N 2.99Å; H261-Y265 WeakPolarHBondContact O-CB 3.38Å; H261-Y265 PolarHBondContact O-N 3.05Å; H261-G291 WeakPolarHBondContact ND1-CA 3.49Å; H261-G291 PolarHBondContact ND1-N 3.4Å; H261-A294 HydrophobicContact CB-CB 4.05Å
262F76.5Confident79.9Confident87 Ų8764.2 Ų64.238%0.38232%0.317SS..Hα-helixtrans-62.1-47.2179.4-78.7-52.8000112.8Q258 V259 T264 Y265 E266Q258-F262 HydrophobicContact CG-CD2 3.75Å; Q258-F262 HydrophobicContact CG-CE2 3.54Å; Q258-F262 VanDerWaalsContact NE2-CZ 3.31Å; Q258-F262 WeakPolarHBondContact O-CD2 3.42Å; Q258-F262 PolarHBondContact O-N 3.13Å; V259-F262 PolarHBondContact O-N 2.94Å; F262-T264 VanDerWaalsContact C-N 3.31Å; F262-T264 PolarHBondContact O-N 3.3Å; F262-Y265 PolarHBondContact O-N 3.03Å; F262-E266 PolarHBondContact O-N 3.47Å
263M80.6Confident79.9Confident130 Ų13061.7 Ų61.764%0.6430%0.301SS*.Hα-helixtrans-60.1-41.9179.6-70.5-179.673.200112.2V259 Y267V259-M263 HydrophobicContact CG1-CG 4.39Å; V259-M263 HydrophobicContact CG1-SD 3.74Å; V259-M263 WeakPolarHBondContact O-CB 3.39Å; V259-M263 VanDerWaalsContact O-CG 3.3Å; V259-M263 WeakPolarHBondContact O-CG 3.35Å; V259-M263 PolarHBondContact O-N 2.93Å; M263-Y267 WeakPolarHBondContact O-CB 3.28Å; M263-Y267 PolarHBondContact O-N 3.48Å
264T81.3Confident79.7Confident22 Ų2265.4 Ų65.414%0.13533%0.327CS..Hα-helixtrans-73.1-35.6178.8-48.90000111.4F260 H261 F262 L268 A290 I293F260-T264 VanDerWaalsContact O-CB 3.24Å; F260-T264 WeakPolarHBondContact O-CB 3.49Å; F260-T264 PolarHBondContact O-N 3.12Å; F260-T264 VanDerWaalsContact O-N 3.08Å; F260-T264 PolarHBondContact O-OG1 3.48Å; H261-T264 PolarHBondContact O-N 2.99Å; F262-T264 VanDerWaalsContact C-N 3.31Å; F262-T264 PolarHBondContact O-N 3.3Å; T264-L268 HydrophobicContact CG2-CD1 3.89Å; T264-L268 HydrophobicContact CG2-CG 4.4Å; T264-L268 WeakPolarHBondContact O-CB 3.42Å; T264-L268 WeakPolarHBondContact O-CD1 3.18Å; T264-L268 WeakPolarHBondContact O-CG 3.5Å; T264-L268 PolarHBondContact O-N 2.93Å; T264-A290 HydrophobicContact CG2-CB 4.01Å; T264-I293 HydrophobicContact CG2-CB 4.35Å; T264-I293 HydrophobicContact CG2-CD1 3.72Å; T264-I293 HydrophobicContact CG2-CG2 4.47Å
265Y79.2Confident79.6Confident48 Ų4871.5 Ų71.519%0.18835%0.354CS..Hα-helixtrans-66.5-50.6179174.2-95.3000112.1H261 F262 Y267 L268 Q269 H283H261-Y265 WeakPolarHBondContact O-CB 3.38Å; H261-Y265 PolarHBondContact O-N 3.05Å; F262-Y265 PolarHBondContact O-N 3.03Å; Y265-Y267 VanDerWaalsContact C-N 3.35Å; Y265-Y267 PolarHBondContact O-N 3.37Å; Y265-L268 PolarHBondContact O-N 3.25Å; Y265-Q269 HydrophobicContact CD1-CG 4.21Å; Y265-Q269 HydrophobicContact CD2-CG 4.47Å; Y265-Q269 HydrophobicContact CE1-CG 3.8Å; Y265-Q269 HydrophobicContact CE2-CG 4.08Å; Y265-Q269 WeakPolarHBondContact O-CG 3.45Å; Y265-Q269 PolarHBondContact O-N 2.94Å; Y265-Q269 PolarHBondContact OH-NE2 3.1Å; Y265-H283 PolarHBondContact OH-ND1 3.38Å
266E77.9Confident79.3Confident56 Ų5674.7 Ų74.726%0.26236%0.358SS..Hα-helixtrans-61.1-44.1178.1-71.5-61.512400111.1F262 L268 Q269 E270 R276F262-E266 PolarHBondContact O-N 3.47Å; E266-L268 VanDerWaalsContact C-N 3.31Å; E266-L268 PolarHBondContact O-N 3.38Å; E266-Q269 PolarHBondContact O-N 3.37Å; E266-Q269 VanDerWaalsContact O-N 3.12Å; E266-E270 WeakPolarHBondContact O-CG 3.42Å; E266-E270 PolarHBondContact O-N 2.95Å; E266-R276 IonicContact OE2-CZ 3.24Å; E266-R276 IonicContact OE2-NH1 2.92Å; E266-R276 PolarHBondContact OE2-NH1 2.68Å; E266-R276 VanDerWaalsContact OE2-NH1 3.07Å; E266-R276 IonicContact OE2-NH2 2.95Å; E266-R276 PolarHBondContact OE2-NH2 3.28Å
267Y84.4Confident78.9Confident150 Ų15078.3 Ų78.359%0.58837%0.374SS*.Hα-helixtrans-59-39.6175.6177.4-106.4000113.1M263 Y265 L271M263-Y267 WeakPolarHBondContact O-CB 3.28Å; M263-Y267 PolarHBondContact O-N 3.48Å; Y265-Y267 VanDerWaalsContact C-N 3.35Å; Y265-Y267 PolarHBondContact O-N 3.37Å; Y267-L271 PolarHBondContact O-N 3.09Å
268L82.7Confident78.1Confident16 Ų1684.2 Ų84.28%0.08440%0.397CS..Hα-helixtrans-73.1-32.9175.8-71.5170.6000112.5T264 Y265 E266 L271 L272 L289T264-L268 HydrophobicContact CG2-CD1 3.89Å; T264-L268 HydrophobicContact CG2-CG 4.4Å; T264-L268 WeakPolarHBondContact O-CB 3.42Å; T264-L268 WeakPolarHBondContact O-CD1 3.18Å; T264-L268 WeakPolarHBondContact O-CG 3.5Å; T264-L268 PolarHBondContact O-N 2.93Å; Y265-L268 PolarHBondContact O-N 3.25Å; E266-L268 VanDerWaalsContact C-N 3.31Å; E266-L268 PolarHBondContact O-N 3.38Å; L268-L271 PolarHBondContact O-N 3.29Å; L268-L272 HydrophobicContact CB-CD1 4.49Å; L268-L272 VanDerWaalsContact O-CB 3.22Å; L268-L272 WeakPolarHBondContact O-CB 3.35Å; L268-L272 WeakPolarHBondContact O-CG 3.25Å; L268-L272 PolarHBondContact O-N 2.94Å; L268-L289 HydrophobicContact CD1-CB 3.78Å; L268-L289 HydrophobicContact CD1-CD2 3.73Å; L268-L289 HydrophobicContact CD1-CG 3.78Å; L268-L289 HydrophobicContact CD2-CD2 3.9Å
269Q77.8Confident78Confident6 Ų685 Ų853%0.02840%0.402CS..Hα-helixtrans-67.6-40.7173.2-73.3-67.7-14.700112Y265 E266 L271 N273 H283Y265-Q269 HydrophobicContact CD1-CG 4.21Å; Y265-Q269 HydrophobicContact CD2-CG 4.47Å; Y265-Q269 HydrophobicContact CE1-CG 3.8Å; Y265-Q269 HydrophobicContact CE2-CG 4.08Å; Y265-Q269 WeakPolarHBondContact O-CG 3.45Å; Y265-Q269 PolarHBondContact O-N 2.94Å; Y265-Q269 PolarHBondContact OH-NE2 3.1Å; E266-Q269 PolarHBondContact O-N 3.37Å; E266-Q269 VanDerWaalsContact O-N 3.12Å; Q269-L271 PolarHBondContact O-N 3.43Å; Q269-N273 CarbonylContact O-C 3.12Å; Q269-N273 VanDerWaalsContact O-CA 3.27Å; Q269-N273 WeakPolarHBondContact O-CA 3.19Å; Q269-N273 PolarHBondContact O-N 2.86Å; Q269-H283 PolarHBondContact NE2-ND1 2.84Å
270E81.4Confident77.7Confident121 Ų12183.3 Ų83.357%0.56539%0.393SS*.Hα-helixtrans-59.4-34.9173.5-72.6176.7173.600112.1E266E266-E270 WeakPolarHBondContact O-CG 3.42Å; E266-E270 PolarHBondContact O-N 2.95Å
271L85Confident77.4Confident114 Ų11482.5 Ų82.560%0.59740%0.399SS*.Hα-helixtrans-83.6-41179.8-173.662.5000113.9Y267 L268 Q269Y267-L271 PolarHBondContact O-N 3.09Å; L268-L271 PolarHBondContact O-N 3.29Å; Q269-L271 PolarHBondContact O-N 3.43Å
272L79.6Confident77.2Confident79 Ų7980.9 Ų80.941%0.41439%0.392SS..Hα-helixtrans-98.6-17.8-172.3-61.6175.3000113.7L268 S282 V285L268-L272 HydrophobicContact CB-CD1 4.49Å; L268-L272 VanDerWaalsContact O-CB 3.22Å; L268-L272 WeakPolarHBondContact O-CB 3.35Å; L268-L272 WeakPolarHBondContact O-CG 3.25Å; L268-L272 PolarHBondContact O-N 2.94Å; L272-S282 WeakPolarHBondContact CB-OG 3.26Å; L272-V285 HydrophobicContact CD1-CG1 4.01Å
273N78.9Confident77.1Confident13 Ų1378.8 Ų78.87%0.0738%0.383CS..  trans-142.664.5177.4-169.512.5000112.3Q269 H275 R276 L277Q269-N273 CarbonylContact O-C 3.12Å; Q269-N273 VanDerWaalsContact O-CA 3.27Å; Q269-N273 WeakPolarHBondContact O-CA 3.19Å; Q269-N273 PolarHBondContact O-N 2.86Å; N273-H275 PolarHBondContact O-N 3.32Å; N273-R276 PolarHBondContact O-N 3.02Å; N273-R276 PolarHBondContact OD1-N 2.9Å; N273-L277 PolarHBondContact ND2-O 3.04Å; N273-L277 PolarHBondContact OD1-N 2.94Å; N273-L277 VanDerWaalsContact OD1-N 3.13Å; N273-L277 PolarHBondContact OD1-O 2.99Å
274P75.6Confident76.7Confident91 Ų9177 Ų7759%0.59138%0.375SS*.THydrogen-bonded Turntrans-60.3-22.2-173.9-22.132.4000114.6
275H72.1Confident76.8Confident152 Ų15280 Ų8070%0.70439%0.392SS*.THydrogen-bonded Turntrans-94.91.1-179.6-63.570.8000112.8N273 L277N273-H275 PolarHBondContact O-N 3.32Å; H275-L277 HydrophobicContact CB-CD1 3.97Å; H275-L277 HydrophobicContact CB-CG 3.87Å; H275-L277 PolarHBondContact O-N 3.27Å
276R70.1Confident76.8Confident140 Ų14077.7 Ų77.753%0.52838%0.383SS..  trans47.331-174.8-64.6-168.5177.9-123.2-4.9114.4E266 N273E266-R276 IonicContact OE2-CZ 3.24Å; E266-R276 IonicContact OE2-NH1 2.92Å; E266-R276 PolarHBondContact OE2-NH1 2.68Å; E266-R276 VanDerWaalsContact OE2-NH1 3.07Å; E266-R276 IonicContact OE2-NH2 2.95Å; E266-R276 PolarHBondContact OE2-NH2 3.28Å; N273-R276 PolarHBondContact O-N 3.02Å; N273-R276 PolarHBondContact OD1-N 2.9Å
277L73.6Confident76.8Confident119 Ų11975.5 Ų75.562%0.62338%0.376SS*.  trans-77.2156.6177.9-65.9173.6000111.1N273 H275 N279N273-L277 PolarHBondContact ND2-O 3.04Å; N273-L277 PolarHBondContact OD1-N 2.94Å; N273-L277 VanDerWaalsContact OD1-N 3.13Å; N273-L277 PolarHBondContact OD1-O 2.99Å; H275-L277 HydrophobicContact CB-CD1 3.97Å; H275-L277 HydrophobicContact CB-CG 3.87Å; H275-L277 PolarHBondContact O-N 3.27Å; L277-N279 PolarHBondContact O-N 3.47Å
278Y65.6Low76.6Confident169 Ų16969.5 Ų69.566%0.66336%0.358SS*.  trans-61.8100.8179.2-176.6-98.3000112.1Y81 P280Y81-Y278 HydrophobicContact CD2-CE2 4.1Å; Y81-Y278 AromaticContact CE2-CE2 3.83Å; Y81-Y278 HydrophobicContact CE2-CE2 3.83Å; Y278-P280 HydrophobicContact CD1-CG 4.28Å; Y278-P280 HydrophobicContact CE1-CG 3.58Å; Y278-P280 HydrophobicContact CE2-CG 4.45Å
279N73.5Confident76.7Confident63 Ų6372.6 Ų72.634%0.33737%0.374SS..  trans-135.991.5177.3-175.5-14.3000111L277 S281 S282 H283L277-N279 PolarHBondContact O-N 3.47Å; N279-S281 PolarHBondContact O-N 3.14Å; N279-S281 VanDerWaalsContact O-N 3.11Å; N279-S281 PolarHBondContact OD1-N 3.36Å; N279-S281 PolarHBondContact OD1-OG 3.08Å; N279-S282 WeakPolarHBondContact O-CB 3.35Å; N279-S282 PolarHBondContact O-N 2.92Å; N279-S282 PolarHBondContact OD1-N 2.96Å; N279-H283 PolarHBondContact O-CD2 3.16Å; N279-H283 PolarHBondContact O-N 3.2Å
280P73.1Confident76.9Confident40 Ų4072.3 Ų72.326%0.2637%0.372SS..Hα-helixtrans-53.6-34.9-177.3-29.636.5000114.2Y278 H283 M284Y278-P280 HydrophobicContact CD1-CG 4.28Å; Y278-P280 HydrophobicContact CE1-CG 3.58Å; Y278-P280 HydrophobicContact CE2-CG 4.45Å; P280-H283 PolarHBondContact O-N 3Å; P280-M284 VanDerWaalsContact O-CG 3.3Å; P280-M284 WeakPolarHBondContact O-CG 3.41Å; P280-M284 PolarHBondContact O-N 3.2Å
281S75.6Confident76.8Confident76 Ų7666.5 Ų66.553%0.53135%0.345SS..Hα-helixtrans-67.8-37.2179.869.90000112.5N279 M284 V285N279-S281 PolarHBondContact O-N 3.14Å; N279-S281 VanDerWaalsContact O-N 3.11Å; N279-S281 PolarHBondContact OD1-N 3.36Å; N279-S281 PolarHBondContact OD1-OG 3.08Å; S281-M284 PolarHBondContact O-N 3.12Å; S281-V285 WeakPolarHBondContact O-CB 3.1Å; S281-V285 VanDerWaalsContact O-CG2 3.32Å; S281-V285 WeakPolarHBondContact O-CG2 3.37Å; S281-V285 PolarHBondContact O-N 2.92Å
282S76.5Confident76.9Confident6 Ų662 Ų624%0.04232%0.324CS..Hα-helixtrans-65.4-43.8173.4-174.80000111.6L272 N279 M284 V285 S286L272-S282 WeakPolarHBondContact CB-OG 3.26Å; N279-S282 WeakPolarHBondContact O-CB 3.35Å; N279-S282 PolarHBondContact O-N 2.92Å; N279-S282 PolarHBondContact OD1-N 2.96Å; S282-M284 PolarHBondContact O-N 3.02Å; S282-V285 PolarHBondContact O-N 3.13Å; S282-S286 WeakPolarHBondContact O-CB 3.31Å; S282-S286 PolarHBondContact O-N 3.33Å; S282-S286 PolarHBondContact O-OG 3.46Å
283H74.2Confident77.3Confident44 Ų4461.8 Ų61.820%0.20432%0.323CS..Hα-helixtrans-62.1-43.2175.7-66.8-75.7000112.4Y265 Q269 N279 P280 G287Y265-H283 PolarHBondContact OH-ND1 3.38Å; Q269-H283 PolarHBondContact NE2-ND1 2.84Å; N279-H283 PolarHBondContact O-CD2 3.16Å; N279-H283 PolarHBondContact O-N 3.2Å; P280-H283 PolarHBondContact O-N 3Å; H283-G287 PolarHBondContact O-N 3.34Å
284M73.3Confident77.5Confident93 Ų9361.2 Ų61.246%0.45832%0.32SS..Hα-helixtrans-63.8-45.8176.9-72-179.876.300112.4P280 S281 S282 A288P280-M284 VanDerWaalsContact O-CG 3.3Å; P280-M284 WeakPolarHBondContact O-CG 3.41Å; P280-M284 PolarHBondContact O-N 3.2Å; S281-M284 PolarHBondContact O-N 3.12Å; S282-M284 PolarHBondContact O-N 3.02Å; M284-A288 WeakPolarHBondContact O-CB 3.36Å; M284-A288 PolarHBondContact O-N 3.36Å
285V82.4Confident77.9Confident83 Ų8356.9 Ų56.950%0.50329%0.292SS..Hα-helixtrans-67.6-46.6179.4171.60000111.2L272 S281 S282 A288 L289L272-V285 HydrophobicContact CD1-CG1 4.01Å; S281-V285 WeakPolarHBondContact O-CB 3.1Å; S281-V285 VanDerWaalsContact O-CG2 3.32Å; S281-V285 WeakPolarHBondContact O-CG2 3.37Å; S281-V285 PolarHBondContact O-N 2.92Å; S282-V285 PolarHBondContact O-N 3.13Å; V285-A288 PolarHBondContact O-N 3.04Å; V285-L289 WeakPolarHBondContact O-CB 3.36Å; V285-L289 PolarHBondContact O-N 3.01Å
286S79.9Confident78.7Confident0 Ų051.2 Ų51.20%027%0.271CS..Hα-helixtrans-60.7-48.2178.1-58.60000111.3S282 A290S282-S286 WeakPolarHBondContact O-CB 3.31Å; S282-S286 PolarHBondContact O-N 3.33Å; S282-S286 PolarHBondContact O-OG 3.46Å; S286-A290 WeakPolarHBondContact O-CB 3.39Å; S286-A290 PolarHBondContact O-N 2.78Å
287G77.8Confident79.5Confident10 Ų1046.9 Ų46.910%0.10327%0.265CS..Hα-helixtrans-64.4-42.6178.300000113.2H283 G291H283-G287 PolarHBondContact O-N 3.34Å; G287-G291 PolarHBondContact O-N 2.71Å
288A79.1Confident80.2Confident25 Ų2541.3 Ų41.321%0.20724%0.236CC..Hα-helixtrans-65.4-44.517800000112.2M284 V285 A292M284-A288 WeakPolarHBondContact O-CB 3.36Å; M284-A288 PolarHBondContact O-N 3.36Å; V285-A288 PolarHBondContact O-N 3.04Å; A288-A292 VanDerWaalsContact O-CB 3.28Å; A288-A292 WeakPolarHBondContact O-CB 3.42Å; A288-A292 PolarHBondContact O-N 2.93Å
289L85.4Confident81.3Confident80 Ų8033.3 Ų33.342%0.41921%0.205SC..Hα-helixtrans-71.6-40.3179.5-17857000111.9L268 V285 A292 I293L268-L289 HydrophobicContact CD1-CB 3.78Å; L268-L289 HydrophobicContact CD1-CD2 3.73Å; L268-L289 HydrophobicContact CD1-CG 3.78Å; L268-L289 HydrophobicContact CD2-CD2 3.9Å; V285-L289 WeakPolarHBondContact O-CB 3.36Å; V285-L289 PolarHBondContact O-N 3.01Å; L289-A292 PolarHBondContact O-N 3.14Å; L289-I293 HydrophobicContact CD1-CD1 3.96Å; L289-I293 HydrophobicContact CD1-CG1 4.35Å; L289-I293 HydrophobicContact CG-CD1 4.06Å; L289-I293 WeakPolarHBondContact O-CG1 3.44Å; L289-I293 PolarHBondContact O-N 3.34Å
290A81.6Confident82Confident0 Ų031.6 Ų31.60%020%0.197CC..Hα-helixtrans-61.6-45.2173.100000112.2T264 S286 I293 A294T264-A290 HydrophobicContact CG2-CB 4.01Å; S286-A290 WeakPolarHBondContact O-CB 3.39Å; S286-A290 PolarHBondContact O-N 2.78Å; A290-I293 PolarHBondContact O-N 2.97Å; A290-A294 VanDerWaalsContact O-CB 3.31Å; A290-A294 WeakPolarHBondContact O-CB 3.23Å; A290-A294 PolarHBondContact O-N 3.16Å
291G81Confident82.7Confident0 Ų031.4 Ų31.40%019%0.194CC..Hα-helixtrans-64.8-38.4174.800000112.7H261 G287 A295H261-G291 WeakPolarHBondContact ND1-CA 3.49Å; H261-G291 PolarHBondContact ND1-N 3.4Å; G287-G291 PolarHBondContact O-N 2.71Å; G291-A295 WeakPolarHBondContact O-CB 3.26Å; G291-A295 PolarHBondContact O-N 3.12Å
292A85.3Confident83.1Confident18 Ų1828 Ų2815%0.14917%0.17CC..Hα-helixtrans-61.9-44.717400000112.6A288 L289 A295 A296 V356A288-A292 VanDerWaalsContact O-CB 3.28Å; A288-A292 WeakPolarHBondContact O-CB 3.42Å; A288-A292 PolarHBondContact O-N 2.93Å; L289-A292 PolarHBondContact O-N 3.14Å; A292-A295 PolarHBondContact O-N 2.96Å; A292-A296 WeakPolarHBondContact O-CB 3.23Å; A292-A296 PolarHBondContact O-N 2.71Å; A292-V356 HydrophobicContact CB-CG1 3.89Å
293I88.1Confident83.5Confident76 Ų7627.8 Ų27.839%0.3917%0.168SC..Hα-helixtrans-67.6-46.3178.3-72.1166.9000110.6T264 L289 A290 A295 A296 A297T264-I293 HydrophobicContact CG2-CB 4.35Å; T264-I293 HydrophobicContact CG2-CD1 3.72Å; T264-I293 HydrophobicContact CG2-CG2 4.47Å; L289-I293 HydrophobicContact CD1-CD1 3.96Å; L289-I293 HydrophobicContact CD1-CG1 4.35Å; L289-I293 HydrophobicContact CG-CD1 4.06Å; L289-I293 WeakPolarHBondContact O-CG1 3.44Å; L289-I293 PolarHBondContact O-N 3.34Å; A290-I293 PolarHBondContact O-N 2.97Å; I293-A295 VanDerWaalsContact C-N 3.33Å; I293-A295 PolarHBondContact O-N 3.39Å; I293-A296 PolarHBondContact O-N 3.11Å; I293-A297 WeakPolarHBondContact O-CB 3.3Å; I293-A297 PolarHBondContact O-N 3.5Å
294A84.1Confident84Confident0 Ų025.7 Ų25.70%016%0.158CC..Hα-helixtrans-60.7-40.117500000112.5F257 F260 H261 A290 T298F257-A294 HydrophobicContact CD2-CB 3.69Å; F257-A294 HydrophobicContact CE2-CB 3.69Å; F257-A294 HydrophobicContact CG-CB 4.27Å; F257-A294 HydrophobicContact CZ-CB 4.26Å; F257-A294 WeakPolarHBondContact O-CB 3.42Å; F260-A294 HydrophobicContact CB-CB 3.89Å; H261-A294 HydrophobicContact CB-CB 4.05Å; A290-A294 VanDerWaalsContact O-CB 3.31Å; A290-A294 WeakPolarHBondContact O-CB 3.23Å; A290-A294 PolarHBondContact O-N 3.16Å; A294-T298 WeakPolarHBondContact O-CB 3.48Å; A294-T298 WeakPolarHBondContact O-CG2 3.37Å; A294-T298 PolarHBondContact O-N 3.11Å; A294-T298 PolarHBondContact O-OG1 2.99Å
295A84.2Confident84.5Confident1 Ų121.7 Ų21.71%0.00814%0.138CC..Hα-helixtrans-63-46.6174.600000111.7F257 G291 A292 I293 T298 T299 R355F257-A295 HydrophobicContact CE2-CB 4.3Å; G291-A295 WeakPolarHBondContact O-CB 3.26Å; G291-A295 PolarHBondContact O-N 3.12Å; A292-A295 PolarHBondContact O-N 2.96Å; I293-A295 VanDerWaalsContact C-N 3.33Å; I293-A295 PolarHBondContact O-N 3.39Å; A295-T298 PolarHBondContact O-N 2.85Å; A295-T299 PolarHBondContact O-N 3.21Å; A295-T299 PolarHBondContact O-OG1 2.88Å; A295-R355 HydrophobicContact CB-CG 3.89Å; A295-R355 PolarHBondContact O-NH1 3.15Å
296A88.3Confident84.5Confident32 Ų3217.8 Ų17.826%0.26412%0.115SC..Hα-helixtrans-61.7-50.7177.500000111.5A292 I293 T298 T299 V352 V356A292-A296 WeakPolarHBondContact O-CB 3.23Å; A292-A296 PolarHBondContact O-N 2.71Å; I293-A296 PolarHBondContact O-N 3.11Å; A296-T298 VanDerWaalsContact C-N 3.29Å; A296-T298 PolarHBondContact O-N 3.13Å; A296-T299 WeakPolarHBondContact O-CB 3.32Å; A296-T299 PolarHBondContact O-N 3.32Å; A296-T299 PolarHBondContact O-OG1 3.11Å; A296-V352 HydrophobicContact CB-CG2 4.23Å; A296-V356 HydrophobicContact CB-CG2 4.26Å
297A87.9Confident84.6Confident49 Ų4917.9 Ų17.941%0.40512%0.115SC..Hα-helixtrans-58.1-38.2179.200000113F260 I293F260-A297 HydrophobicContact CD2-CB 3.87Å; F260-A297 HydrophobicContact CE2-CB 3.97Å; F260-A297 HydrophobicContact CG-CB 4.31Å; F260-A297 HydrophobicContact CZ-CB 4.47Å; I293-A297 WeakPolarHBondContact O-CB 3.3Å; I293-A297 PolarHBondContact O-N 3.5Å
298T87.4Confident84.7Confident3 Ų317.4 Ų17.42%0.01811%0.11CC..THydrogen-bonded Turntrans-95.46.1-178.862.10000114.6P256 F257 A294 A295 A296 P300 L301 D302 R355P256-T298 HydrophobicContact CB-CG2 4.03Å; F257-T298 HydrophobicContact CB-CG2 3.99Å; A294-T298 WeakPolarHBondContact O-CB 3.48Å; A294-T298 WeakPolarHBondContact O-CG2 3.37Å; A294-T298 PolarHBondContact O-N 3.11Å; A294-T298 PolarHBondContact O-OG1 2.99Å; A295-T298 PolarHBondContact O-N 2.85Å; A296-T298 VanDerWaalsContact C-N 3.29Å; A296-T298 PolarHBondContact O-N 3.13Å; T298-P300 VanDerWaalsContact C-CD 3.49Å; T298-L301 PolarHBondContact O-N 3.05Å; T298-D302 PolarHBondContact O-N 2.91Å; T298-R355 PolarHBondContact O-NH1 2.87Å; T298-R355 VanDerWaalsContact OG1-CZ 3.24Å; T298-R355 PolarHBondContact OG1-NH1 2.94Å; T298-R355 PolarHBondContact OG1-NH2 3.46Å
299T88.1Confident84.7Confident0 Ų016.3 Ų16.30%010%0.101CC..Hα-helixtrans-58.5-39.7178.2-64.50000113.6A295 A296 L301 D302 V303 F348 V352A295-T299 PolarHBondContact O-N 3.21Å; A295-T299 PolarHBondContact O-OG1 2.88Å; A296-T299 WeakPolarHBondContact O-CB 3.32Å; A296-T299 PolarHBondContact O-N 3.32Å; A296-T299 PolarHBondContact O-OG1 3.11Å; T299-L301 PolarHBondContact O-N 2.69Å; T299-D302 PolarHBondContact O-N 2.95Å; T299-D302 VanDerWaalsContact O-N 3.14Å; T299-V303 HydrophobicContact CG2-CG2 4.2Å; T299-V303 WeakPolarHBondContact O-CG2 3.28Å; T299-V303 PolarHBondContact O-N 3.36Å; T299-F348 CarbonylContact C-O 3.39Å; T299-F348 WeakPolarHBondContact CG2-O 3.45Å; T299-V352 HydrophobicContact CG2-CB 4.02Å; T299-V352 HydrophobicContact CG2-CG2 4.37Å
300P89.2Confident84.1Confident27 Ų2713 Ų1318%0.1758%0.084CC..Hα-helixtrans-55.7-36.1177-29.437.4000114.5T298 C304 F348 F349T298-P300 VanDerWaalsContact C-CD 3.49Å; P300-C304 PolarHBondContact O-N 3.25Å; P300-C304 PolarHBondContact O-SG 3.27Å; P300-F348 WeakPolarHBondContact CA-O 3.44Å; P300-F348 HydrophobicContact CB-CB 3.93Å; P300-F348 HydrophobicContact CB-CD1 3.95Å; P300-F348 HydrophobicContact CB-CG 4.26Å; P300-F348 HydrophobicContact CG-CB 4.12Å; P300-F349 HydrophobicContact CG-CE1 4.17Å; P300-F349 HydrophobicContact CG-CZ 4.03Å
301L86.8Confident83.4Confident37 Ų3713.9 Ų13.919%0.1949%0.088CC..Hα-helixtrans-77.2-36.9178.7-63.7175.2000112.1M253 T298 T299 C304 K305 L332M253-L301 HydrophobicContact CB-CB 3.95Å; M253-L301 HydrophobicContact CB-CD1 4.19Å; M253-L301 HydrophobicContact CG-CB 3.91Å; M253-L301 HydrophobicContact CG-CD1 4.46Å; M253-L301 HydrophobicContact SD-CB 4.48Å; T298-L301 PolarHBondContact O-N 3.05Å; T299-L301 PolarHBondContact O-N 2.69Å; L301-C304 CarbonylContact O-C 3.56Å; L301-C304 WeakPolarHBondContact O-CB 3.47Å; L301-C304 PolarHBondContact O-N 2.85Å; L301-C304 VanDerWaalsContact O-N 3.16Å; L301-K305 PolarHBondContact O-N 3.4Å; L301-L332 HydrophobicContact CD2-CD1 4.29Å; L301-L332 HydrophobicContact CD2-CD2 4.32Å
302D84.4Confident82.6Confident4 Ų414.4 Ų14.42%0.0219%0.091CC..Hα-helixtrans-66-39.9176.9-165.537.9000111.3K115 Q119 M253 T298 T299 C304 K305 T306 R355K115-D302 WeakPolarHBondContact CE-OD2 3.43Å; K115-D302 IonicContact NZ-OD1 2.65Å; K115-D302 PolarHBondContact NZ-OD1 3.25Å; K115-D302 IonicContact NZ-OD2 3.43Å; K115-D302 PolarHBondContact NZ-OD2 3Å; Q119-D302 PolarHBondContact NE2-OD2 3.44Å; M253-D302 HydrophobicContact SD-CB 3.63Å; T298-D302 PolarHBondContact O-N 2.91Å; T299-D302 PolarHBondContact O-N 2.95Å; T299-D302 VanDerWaalsContact O-N 3.14Å; D302-C304 VanDerWaalsContact C-N 3.3Å; D302-C304 PolarHBondContact O-N 3.23Å; D302-K305 WeakPolarHBondContact O-CB 3.3Å; D302-K305 PolarHBondContact O-N 2.97Å; D302-T306 PolarHBondContact O-N 3.23Å; D302-T306 PolarHBondContact O-OG1 2.98Å; D302-R355 VanDerWaalsContact CB-NH1 3.31Å; D302-R355 IonicContact OD2-CZ 2.69Å; D302-R355 IonicContact OD2-NE 2.81Å; D302-R355 IonicContact OD2-NH1 3.29Å
303V84.9Confident80.9Confident1 Ų116.8 Ų16.81%0.00611%0.106CC..Hα-helixtrans-60.4-39.7170.8175.70000111.3T299 L307 V339T299-V303 HydrophobicContact CG2-CG2 4.2Å; T299-V303 WeakPolarHBondContact O-CG2 3.28Å; T299-V303 PolarHBondContact O-N 3.36Å; V303-L307 WeakPolarHBondContact O-CB 3.17Å; V303-L307 PolarHBondContact O-N 3.47Å; V303-V339 HydrophobicContact CG1-CG1 4.16Å; V303-V339 HydrophobicContact CG1-CG2 4.04Å
304C85.6Confident79Confident0 Ų019.3 Ų19.30%012%0.116CC..Hα-helixtrans-67.9-39.4175.1-65.10000112.3T249 P300 L301 D302 L307 L308 L332 A335T249-C304 HydrophobicContact CG2-CB 4.27Å; P300-C304 PolarHBondContact O-N 3.25Å; P300-C304 PolarHBondContact O-SG 3.27Å; L301-C304 CarbonylContact O-C 3.56Å; L301-C304 WeakPolarHBondContact O-CB 3.47Å; L301-C304 PolarHBondContact O-N 2.85Å; L301-C304 VanDerWaalsContact O-N 3.16Å; D302-C304 VanDerWaalsContact C-N 3.3Å; D302-C304 PolarHBondContact O-N 3.23Å; C304-L307 PolarHBondContact O-N 3.34Å; C304-L308 WeakPolarHBondContact O-CG 3.42Å; C304-L308 PolarHBondContact O-N 3.43Å; C304-L308 VanDerWaalsContact O-N 3.07Å; C304-L332 HydrophobicContact CB-CD1 3.73Å; C304-A335 HydrophobicContact CB-CB 4.09Å
305K84.1Confident77.4Confident9 Ų919.6 Ų19.64%0.03912%0.118CC..Hα-helixtrans-59.3-50.1173.2-175.8-173.5173.4-175.20110.5E211 T249 Q250 L301 D302 L307 L308 N309E211-K305 IonicContact OE1-NZ 3.21Å; E211-K305 PolarHBondContact OE1-NZ 3.21Å; E211-K305 WeakPolarHBondContact OE2-CE 3.35Å; E211-K305 IonicContact OE2-NZ 2.79Å; E211-K305 PolarHBondContact OE2-NZ 3.39Å; T249-K305 HydrophobicContact CG2-CB 4.03Å; Q250-K305 HydrophobicContact CB-CD 4.2Å; L301-K305 PolarHBondContact O-N 3.4Å; D302-K305 WeakPolarHBondContact O-CB 3.3Å; D302-K305 PolarHBondContact O-N 2.97Å; K305-L307 PolarHBondContact O-N 2.92Å; K305-L308 PolarHBondContact O-N 3.03Å; K305-N309 PolarHBondContact O-N 2.95Å
306T81.8Confident75.8Confident1 Ų121.5 Ų21.51%0.00613%0.127CC..Hα-helixtrans-59-48.4179-54.30000111T116 Q119 D302 L308 N309 T310T116-T306 HydrophobicContact CG2-CG2 4.44Å; Q119-T306 HydrophobicContact CB-CG2 4.03Å; Q119-T306 PolarHBondContact OE1-OG1 3.13Å; D302-T306 PolarHBondContact O-N 3.23Å; D302-T306 PolarHBondContact O-OG1 2.98Å; T306-L308 VanDerWaalsContact C-N 3.34Å; T306-L308 PolarHBondContact O-N 3.11Å; T306-N309 PolarHBondContact O-N 3.49Å; T306-N309 VanDerWaalsContact O-N 3.16Å; T306-T310 HydrophobicContact CG2-CG2 3.98Å; T306-T310 WeakPolarHBondContact O-CB 3.49Å; T306-T310 WeakPolarHBondContact O-CG2 3.39Å; T306-T310 PolarHBondContact O-N 2.95Å; T306-T310 PolarHBondContact O-OG1 3.33Å
307L81.7Confident73.9Confident2 Ų224.3 Ų24.31%0.0115%0.146CC..Hα-helixtrans-58.1-42.5177.5178.761.8000113L121 V303 C304 K305 N309 Q311 I329 A335 T338 V339L121-L307 HydrophobicContact CD1-CD1 3.89Å; L121-L307 HydrophobicContact CD1-CD2 4.04Å; L121-L307 HydrophobicContact CD1-CG 4.49Å; L121-L307 HydrophobicContact CG-CD1 4.49Å; V303-L307 WeakPolarHBondContact O-CB 3.17Å; V303-L307 PolarHBondContact O-N 3.47Å; C304-L307 PolarHBondContact O-N 3.34Å; K305-L307 PolarHBondContact O-N 2.92Å; L307-N309 VanDerWaalsContact C-N 3.34Å; L307-Q311 PolarHBondContact O-N 2.9Å; L307-I329 HydrophobicContact CD1-CD1 4.02Å; L307-I329 HydrophobicContact CD2-CD1 4.09Å; L307-I329 HydrophobicContact CG-CD1 3.99Å; L307-A335 HydrophobicContact CD2-CB 4.33Å; L307-T338 HydrophobicContact CD2-CG2 3.97Å; L307-V339 HydrophobicContact CD2-CG2 3.79Å
308L80.6Confident71.9Confident1 Ų126.6 Ų26.61%0.00516%0.158CC..Hα-helixtrans-66.9-34.1178.1-74.7171.7000112.8T249 C304 K305 T306 Q311 I329 A335T249-L308 VanDerWaalsContact OG1-CD1 3.25Å; T249-L308 WeakPolarHBondContact OG1-CD1 3.42Å; C304-L308 WeakPolarHBondContact O-CG 3.42Å; C304-L308 PolarHBondContact O-N 3.43Å; C304-L308 VanDerWaalsContact O-N 3.07Å; K305-L308 PolarHBondContact O-N 3.03Å; T306-L308 VanDerWaalsContact C-N 3.34Å; T306-L308 PolarHBondContact O-N 3.11Å; L308-Q311 WeakPolarHBondContact O-CG 3.46Å; L308-Q311 PolarHBondContact O-NE2 3.47Å; L308-I329 HydrophobicContact CD2-CB 4.27Å; L308-I329 HydrophobicContact CD2-CG2 3.74Å; L308-I329 WeakPolarHBondContact CD2-O 3.36Å; L308-A335 HydrophobicContact CD1-CB 4.11Å; L308-A335 HydrophobicContact CD2-CB 4.03Å; L308-A335 HydrophobicContact CG-CB 3.81Å
309N78.8Confident70.2Confident1 Ų129 Ų291%0.00518%0.179CC..Hα-helixtrans-76.6-43.3177.8-86.5-14000113V212 Q215 R216 S246 K305 T306 L307V212-N309 WeakPolarHBondContact CG2-OD1 3.42Å; Q215-N309 HydrophobicContact CB-CB 4.48Å; Q215-N309 PolarHBondContact NE2-ND2 3.2Å; Q215-N309 PolarHBondContact OE1-ND2 3.48Å; R216-N309 PolarHBondContact NE-O 2.96Å; R216-N309 PolarHBondContact NH2-O 2.9Å; S246-N309 WeakPolarHBondContact CB-OD1 3.31Å; S246-N309 PolarHBondContact OG-OD1 3.44Å; K305-N309 PolarHBondContact O-N 2.95Å; T306-N309 PolarHBondContact O-N 3.49Å; T306-N309 VanDerWaalsContact O-N 3.16Å; L307-N309 VanDerWaalsContact C-N 3.34Å
310T73Confident68.1Low12 Ų1232.2 Ų32.27%0.07421%0.212CC..Hα-helixtrans-80.7-25.3-174.459.40000112.8T116 Q215 M219 T306 E312T116-T310 HydrophobicContact CG2-CG2 4.47Å; Q215-T310 HydrophobicContact CB-CG2 4.27Å; M219-T310 HydrophobicContact CE-CG2 4.03Å; M219-T310 HydrophobicContact CG-CG2 4.03Å; M219-T310 HydrophobicContact SD-CG2 3.45Å; M219-T310 WeakPolarHBondContact SD-CG2 3.09Å; T306-T310 HydrophobicContact CG2-CG2 3.98Å; T306-T310 WeakPolarHBondContact O-CB 3.49Å; T306-T310 WeakPolarHBondContact O-CG2 3.39Å; T306-T310 PolarHBondContact O-N 2.95Å; T306-T310 PolarHBondContact O-OG1 3.33Å; T310-E312 PolarHBondContact O-N 3.32Å
311Q67.3Low66.1Low17 Ų1736.9 Ų36.98%0.07923%0.231CC..  trans45.761.5-179.6-66.5-72.1-41.400111.6R245 L307 L308 S313 I329R245-Q311 VanDerWaalsContact NH1-NE2 3.16Å; L307-Q311 PolarHBondContact O-N 2.9Å; L308-Q311 WeakPolarHBondContact O-CG 3.46Å; L308-Q311 PolarHBondContact O-NE2 3.47Å; Q311-S313 PolarHBondContact O-N 3.21Å; Q311-I329 PolarHBondContact NE2-O 2.82Å
312E63.6Low63.7Low12 Ų1240.2 Ų40.26%0.05626%0.258CS..  trans-6478-177-67.2-179.8-15000112.5S120 L121 Q122 M219 T310 H314 T315S120-E312 VanDerWaalsContact CA-OE1 3.27Å; S120-E312 WeakPolarHBondContact CA-OE1 3.38Å; S120-E312 PolarHBondContact OG-OE1 3.15Å; L121-E312 WeakPolarHBondContact CA-OE2 3.12Å; L121-E312 WeakPolarHBondContact CB-OE2 3.46Å; L121-E312 PolarHBondContact N-OE1 3.31Å; L121-E312 PolarHBondContact N-OE2 2.85Å; Q122-E312 PolarHBondContact N-OE2 3.19Å; M219-E312 HydrophobicContact CE-CG 3.9Å; T310-E312 PolarHBondContact O-N 3.32Å; E312-H314 PolarHBondContact O-N 3.41Å; E312-H314 VanDerWaalsContact O-N 3.16Å; E312-T315 HydrophobicContact CB-CG2 3.82Å; E312-T315 WeakPolarHBondContact O-CB 3.49Å; E312-T315 PolarHBondContact O-N 3.41Å; E312-T315 PolarHBondContact O-OG1 2.92Å; E312-T315 WeakPolarHBondContact OE2-CG2 3.5Å
313S50.1Low61.5Low67 Ų6749.2 Ų49.247%0.46930%0.3SS..Hα-helixtrans-54.1-37.1-171.952.70000113.5Q311 T315 L316 S317Q311-S313 PolarHBondContact O-N 3.21Å; S313-T315 VanDerWaalsContact C-N 3.32Å; S313-T315 PolarHBondContact O-N 2.91Å; S313-L316 PolarHBondContact O-N 3.3Å; S313-S317 PolarHBondContact O-N 3.25Å; S313-S317 PolarHBondContact O-OG 2.72Å
314H48Very low59.1Low129 Ų12953.2 Ų53.260%0.59734%0.341SS*.Hα-helixtrans-66.8-26.6176.5-78-83.4000113.8Q122 E312 L316 S317 S318Q122-H314 VanDerWaalsContact NE2-CB 3.32Å; E312-H314 PolarHBondContact O-N 3.41Å; E312-H314 VanDerWaalsContact O-N 3.16Å; H314-L316 VanDerWaalsContact C-N 3.34Å; H314-S317 PolarHBondContact O-N 3.07Å; H314-S318 PolarHBondContact O-N 2.94Å; H314-S318 VanDerWaalsContact O-N 3.16Å; H314-S318 PolarHBondContact O-OG 3.14Å
315T49.2Very low56.8Low6 Ų656.9 Ų56.94%0.03737%0.371CS..Hα-helixtrans-68.4-36.2176.263.10000112L121 Q122 E312 S313 S317 S318 A319 L342L121-T315 HydrophobicContact CB-CG2 4.34Å; Q122-T315 HydrophobicContact CG-CG2 3.52Å; E312-T315 HydrophobicContact CB-CG2 3.82Å; E312-T315 WeakPolarHBondContact O-CB 3.49Å; E312-T315 PolarHBondContact O-N 3.41Å; E312-T315 PolarHBondContact O-OG1 2.92Å; E312-T315 WeakPolarHBondContact OE2-CG2 3.5Å; S313-T315 VanDerWaalsContact C-N 3.32Å; S313-T315 PolarHBondContact O-N 2.91Å; T315-S317 VanDerWaalsContact C-N 3.3Å; T315-S317 PolarHBondContact O-N 3.32Å; T315-S318 PolarHBondContact O-N 3.05Å; T315-A319 WeakPolarHBondContact O-CB 3.43Å; T315-A319 PolarHBondContact O-N 3.2Å; T315-A319 VanDerWaalsContact O-N 3.11Å; T315-L342 HydrophobicContact CG2-CD1 4.34Å
316L51.7Low54.8Low41 Ų4164.2 Ų64.222%0.21541%0.405CS..Hα-helixtrans-65.7-36.3176.2-69.3143.8000110.8S313 H314 A319 I329S313-L316 PolarHBondContact O-N 3.3Å; H314-L316 VanDerWaalsContact C-N 3.34Å; L316-A319 PolarHBondContact O-N 3.44Å; L316-I329 HydrophobicContact CD1-CD1 4.16Å; L316-I329 HydrophobicContact CD1-CG1 4.03Å; L316-I329 HydrophobicContact CD2-CD1 4.21Å; L316-I329 HydrophobicContact CD2-CG1 3.95Å; L316-I329 HydrophobicContact CG-CD1 4.37Å; L316-I329 HydrophobicContact CG-CG1 4.43Å
317S48.2Very low53.3Low92 Ų9273.7 Ų73.764%0.64344%0.441SS*.Hα-helixtrans-66.7-36.4173.7-47.30000113S313 H314 T315S313-S317 PolarHBondContact O-N 3.25Å; S313-S317 PolarHBondContact O-OG 2.72Å; H314-S317 PolarHBondContact O-N 3.07Å; T315-S317 VanDerWaalsContact C-N 3.3Å; T315-S317 PolarHBondContact O-N 3.32Å
318S46.2Very low52.3Low96 Ų9676.3 Ų76.367%0.67145%0.453SS*.Hα-helixtrans-76.9-22.2178.7-54.90000113.8H314 T315 G320H314-S318 PolarHBondContact O-N 2.94Å; H314-S318 VanDerWaalsContact O-N 3.16Å; H314-S318 PolarHBondContact O-OG 3.14Å; T315-S318 PolarHBondContact O-N 3.05Å; S318-G320 PolarHBondContact O-N 3.04Å; S318-G320 VanDerWaalsContact O-N 3.09Å
319A50.4Low51.4Low54 Ų5476.2 Ų76.245%0.44645%0.453SS..THydrogen-bonded Turntrans-77.715.4-174.500000115T315 L316 Q321 L342T315-A319 WeakPolarHBondContact O-CB 3.43Å; T315-A319 PolarHBondContact O-N 3.2Å; T315-A319 VanDerWaalsContact O-N 3.11Å; L316-A319 PolarHBondContact O-N 3.44Å; A319-Q321 PolarHBondContact O-N 2.9Å; A319-L342 HydrophobicContact CB-CD2 4.29Å
320G45Very low50.9Low68 Ų6880.2 Ų80.270%0.70148%0.48SS*.THydrogen-bonded Turntrans70.38.6172.800000116S318 S322S318-G320 PolarHBondContact O-N 3.04Å; S318-G320 VanDerWaalsContact O-N 3.09Å; G320-S322 PolarHBondContact O-N 3.4Å
321Q46Very low51.1Low125 Ų12581.1 Ų81.158%0.58449%0.492SS*.  trans-81.498.6171.7-73.3-166.7-27.900109.9A319A319-Q321 PolarHBondContact O-N 2.9Å
322S37.4Very low51.8Low106 Ų10682.2 Ų82.274%0.74150%0.498SS*.  trans-56.8137.1177.332.30000112.9G320G320-S322 PolarHBondContact O-N 3.4Å
323Q38.8Very low52.8Low194 Ų19486.9 Ų86.991%0.90753%0.527SS*.SBendtrans29.2113.8147.1-57.2178.87.300117.6
324G33.7Very low54.3Low84 Ų8486.2 Ų86.287%0.86652%0.517SS*.SBendtrans135.310.8155.900000119.1
325A36.4Very low55.9Low77 Ų7780.1 Ų80.164%0.63649%0.488SS*.  trans-164.4142.5159.800000111.5R327A325-R327 HydrophobicContact CB-CB 4.14Å; A325-R327 PolarHBondContact O-N 3.22Å
326H42.8Very low57.7Low164 Ų16484.5 Ų84.576%0.75951%0.507SS*.  trans-75.357.8169.8-161.8-66.4000110.2Q328H326-Q328 VanDerWaalsContact C-N 3.31Å; H326-Q328 PolarHBondContact O-N 3.02Å
327R51.1Low59.4Low199 Ų19989.1 Ų89.175%0.75152%0.522SS*.  trans-78.278.1-163.5-156.3167.7-173.5162.61.2111.5A325A325-R327 HydrophobicContact CB-CB 4.14Å; A325-R327 PolarHBondContact O-N 3.22Å
328Q59.5Low61Low57 Ų5785.3 Ų85.327%0.26650%0.495SS..  trans-44.1138.2173.6-66.2164.910.500110.7R237 H326 S330R237-Q328 PolarHBondContact O-NE2 3.4Å; H326-Q328 VanDerWaalsContact C-N 3.31Å; H326-Q328 PolarHBondContact O-N 3.02Å; Q328-S330 PolarHBondContact O-N 2.83Å
329I63.2Low62.8Low0 Ų080.8 Ų80.80%046%0.463CS..  trans-72.4104.9-179.2-56.8173.9000107.3R245 L307 L308 Q311 L316 H334 A335 T338R245-I329 VanDerWaalsContact CD-O 3.32Å; R245-I329 WeakPolarHBondContact CD-O 3.43Å; L307-I329 HydrophobicContact CD1-CD1 4.02Å; L307-I329 HydrophobicContact CD2-CD1 4.09Å; L307-I329 HydrophobicContact CG-CD1 3.99Å; L308-I329 HydrophobicContact CD2-CB 4.27Å; L308-I329 HydrophobicContact CD2-CG2 3.74Å; L308-I329 WeakPolarHBondContact CD2-O 3.36Å; Q311-I329 PolarHBondContact NE2-O 2.82Å; L316-I329 HydrophobicContact CD1-CD1 4.16Å; L316-I329 HydrophobicContact CD1-CG1 4.03Å; L316-I329 HydrophobicContact CD2-CD1 4.21Å; L316-I329 HydrophobicContact CD2-CG1 3.95Å; L316-I329 HydrophobicContact CG-CD1 4.37Å; L316-I329 HydrophobicContact CG-CG1 4.43Å; I329-H334 HydrophobicContact CG2-CB 4.22Å; I329-A335 HydrophobicContact CG2-CB 4.25Å; I329-T338 HydrophobicContact CD1-CG2 4.07Å
330S67.6Low64.5Low84 Ų8484.4 Ų84.459%0.58747%0.466SS*.  trans-103.1129.6174.2-169.80000111.1Q328 H334Q328-S330 PolarHBondContact O-N 2.83Å; S330-H334 WeakPolarHBondContact O-CB 3.49Å
331G76.7Confident66.3Low31 Ų3188.6 Ų88.632%0.3246%0.461SS..SBendtrans83.7149.9171.800000116.3V333 H334 A335G331-V333 PolarHBondContact O-N 3.32Å; G331-H334 PolarHBondContact O-N 2.93Å; G331-A335 PolarHBondContact O-N 3.46Å; G331-A335 VanDerWaalsContact O-N 3.11Å
332L82.8Confident67.8Low40 Ų4086 Ų8621%0.20945%0.45CS..Hα-helixtrans-57-44.3-177.317852.3000113.2T249 T252 L301 C304 H334 A335 F336T249-L332 HydrophobicContact CG2-CD1 3.7Å; T252-L332 HydrophobicContact CG2-CD2 4.07Å; L301-L332 HydrophobicContact CD2-CD1 4.29Å; L301-L332 HydrophobicContact CD2-CD2 4.32Å; C304-L332 HydrophobicContact CB-CD1 3.73Å; L332-H334 VanDerWaalsContact C-N 3.28Å; L332-H334 PolarHBondContact O-N 3.07Å; L332-A335 PolarHBondContact O-N 3.37Å; L332-F336 WeakPolarHBondContact O-CB 3.32Å; L332-F336 PolarHBondContact O-N 3.3Å
333V83.8Confident69.6Low110 Ų11082.2 Ų82.267%0.66743%0.428SS*.Hα-helixtrans-61.9-36.5-179.2-178.80000111.8G331 R337G331-V333 PolarHBondContact O-N 3.32Å; V333-R337 WeakPolarHBondContact O-CB 3.45Å; V333-R337 PolarHBondContact O-N 3.43Å; V333-R337 VanDerWaalsContact O-N 3.13Å
334H81.6Confident71.8Confident54 Ų5474.2 Ų74.225%0.2540%0.398CS..Hα-helixtrans-73.7-41.6177.3-167.2-155.6000111.2I329 S330 G331 L332 R337 T338I329-H334 HydrophobicContact CG2-CB 4.22Å; S330-H334 WeakPolarHBondContact O-CB 3.49Å; G331-H334 PolarHBondContact O-N 2.93Å; L332-H334 VanDerWaalsContact C-N 3.28Å; L332-H334 PolarHBondContact O-N 3.07Å; H334-R337 PolarHBondContact O-N 2.9Å; H334-T338 WeakPolarHBondContact O-CB 3.42Å; H334-T338 PolarHBondContact O-N 3.46Å; H334-T338 PolarHBondContact O-OG1 3.26Å
335A82.4Confident74.3Confident0 Ų076.2 Ų76.20%039%0.388CS..Hα-helixtrans-57.8-49173.100000111.8C304 L307 L308 I329 G331 L332 R337 T338 V339C304-A335 HydrophobicContact CB-CB 4.09Å; L307-A335 HydrophobicContact CD2-CB 4.33Å; L308-A335 HydrophobicContact CD1-CB 4.11Å; L308-A335 HydrophobicContact CD2-CB 4.03Å; L308-A335 HydrophobicContact CG-CB 3.81Å; I329-A335 HydrophobicContact CG2-CB 4.25Å; G331-A335 PolarHBondContact O-N 3.46Å; G331-A335 VanDerWaalsContact O-N 3.11Å; L332-A335 PolarHBondContact O-N 3.37Å; A335-R337 PolarHBondContact O-N 3.08Å; A335-T338 WeakPolarHBondContact O-CB 3.22Å; A335-T338 PolarHBondContact O-N 2.88Å; A335-T338 VanDerWaalsContact O-N 3.08Å; A335-V339 WeakPolarHBondContact O-CG2 3.43Å; A335-V339 PolarHBondContact O-N 3.4Å
336F87.1Confident76.6Confident99 Ų9980.5 Ų80.543%0.43440%0.395SS..Hα-helixtrans-58.3-47.6178.6-166.5-83.6000111.9L332 T338 V339 Y340 F348L332-F336 WeakPolarHBondContact O-CB 3.32Å; L332-F336 PolarHBondContact O-N 3.3Å; F336-T338 VanDerWaalsContact C-N 3.28Å; F336-T338 PolarHBondContact O-N 2.89Å; F336-V339 PolarHBondContact O-N 3.1Å; F336-Y340 PolarHBondContact O-N 2.62Å; F336-F348 HydrophobicContact CB-CE1 4.49Å; F336-F348 HydrophobicContact CD1-CE1 4.24Å; F336-F348 AromaticContact CD1-CZ 3.71Å; F336-F348 HydrophobicContact CD1-CZ 3.71Å; F336-F348 HydrophobicContact CD2-CD1 4.3Å; F336-F348 AromaticContact CD2-CE1 3.34Å; F336-F348 HydrophobicContact CD2-CE1 3.34Å; F336-F348 AromaticContact CD2-CZ 3.67Å; F336-F348 HydrophobicContact CD2-CZ 3.67Å; F336-F348 HydrophobicContact CE1-CE1 4.28Å; F336-F348 HydrophobicContact CE1-CE2 4.21Å; F336-F348 AromaticContact CE1-CZ 3.6Å; F336-F348 HydrophobicContact CE1-CZ 3.6Å; F336-F348 HydrophobicContact CE2-CD1 4.1Å; F336-F348 AromaticContact CE2-CE1 3.41Å; F336-F348 HydrophobicContact CE2-CE1 3.41Å; F336-F348 VanDerWaalsContact CE2-CE1 3.41Å; F336-F348 HydrophobicContact CE2-CE2 4.39Å; F336-F348 AromaticContact CE2-CZ 3.57Å; F336-F348 HydrophobicContact CE2-CZ 3.57Å; F336-F348 AromaticContact CG-CE1 3.78Å; F336-F348 HydrophobicContact CG-CE1 3.78Å; F336-F348 AromaticContact CG-CZ 3.73Å; F336-F348 HydrophobicContact CG-CZ 3.73Å; F336-F348 AromaticContact CZ-CE1 3.89Å; F336-F348 HydrophobicContact CZ-CE1 3.89Å; F336-F348 HydrophobicContact CZ-CE2 4.06Å; F336-F348 AromaticContact CZ-CZ 3.53Å; F336-F348 HydrophobicContact CZ-CZ 3.53Å; F336-F348 WeakPolarHBondContact O-CZ 3.44Å
337R85.9Confident78.4Confident137 Ų13772.8 Ų72.852%0.51736%0.36SS..Hα-helixtrans-60.8-36.4175.2177.5174.6-82.3142.1-6.8112.4V333 H334 A335 R341V333-R337 WeakPolarHBondContact O-CB 3.45Å; V333-R337 PolarHBondContact O-N 3.43Å; V333-R337 VanDerWaalsContact O-N 3.13Å; H334-R337 PolarHBondContact O-N 2.9Å; A335-R337 PolarHBondContact O-N 3.08Å; R337-R341 WeakPolarHBondContact O-CB 3.44Å; R337-R341 VanDerWaalsContact O-CG 3.3Å; R337-R341 WeakPolarHBondContact O-CG 3.47Å; R337-R341 PolarHBondContact O-N 2.69Å; R337-R341 VanDerWaalsContact O-N 3.07Å
338T81.9Confident80.1Confident13 Ų1363.7 Ų63.78%0.0833%0.326CS..Hα-helixtrans-71.1-44.8178.3-62.90000112L307 I329 H334 A335 F336 Y340 R341 L342L307-T338 HydrophobicContact CD2-CG2 3.97Å; I329-T338 HydrophobicContact CD1-CG2 4.07Å; H334-T338 WeakPolarHBondContact O-CB 3.42Å; H334-T338 PolarHBondContact O-N 3.46Å; H334-T338 PolarHBondContact O-OG1 3.26Å; A335-T338 WeakPolarHBondContact O-CB 3.22Å; A335-T338 PolarHBondContact O-N 2.88Å; A335-T338 VanDerWaalsContact O-N 3.08Å; F336-T338 VanDerWaalsContact C-N 3.28Å; F336-T338 PolarHBondContact O-N 2.89Å; T338-Y340 VanDerWaalsContact C-N 3.35Å; T338-Y340 PolarHBondContact O-N 3.03Å; T338-R341 PolarHBondContact O-N 2.97Å; T338-L342 HydrophobicContact CG2-CD1 3.71Å; T338-L342 HydrophobicContact CG2-CG 4.41Å; T338-L342 WeakPolarHBondContact O-CB 3.28Å; T338-L342 WeakPolarHBondContact O-CG 3.46Å; T338-L342 PolarHBondContact O-N 3.29Å
339V84.8Confident81.4Confident0 Ų066 Ų660%034%0.335CS..Hα-helixtrans-58.3-47.1174.2175.80000110.7L121 V303 L307 A335 F336 R341 L342 G343 F348L121-V339 HydrophobicContact CD1-CG2 4.33Å; V303-V339 HydrophobicContact CG1-CG1 4.16Å; V303-V339 HydrophobicContact CG1-CG2 4.04Å; L307-V339 HydrophobicContact CD2-CG2 3.79Å; A335-V339 WeakPolarHBondContact O-CG2 3.43Å; A335-V339 PolarHBondContact O-N 3.4Å; F336-V339 PolarHBondContact O-N 3.1Å; V339-R341 PolarHBondContact O-N 3.49Å; V339-L342 PolarHBondContact O-N 2.85Å; V339-G343 PolarHBondContact O-N 3.26Å; V339-F348 HydrophobicContact CB-CD1 4.23Å; V339-F348 HydrophobicContact CB-CE1 3.74Å; V339-F348 HydrophobicContact CB-CZ 3.95Å; V339-F348 HydrophobicContact CG1-CD1 3.61Å; V339-F348 HydrophobicContact CG1-CD2 4.14Å; V339-F348 HydrophobicContact CG1-CE1 3.62Å; V339-F348 HydrophobicContact CG1-CE2 4.16Å; V339-F348 HydrophobicContact CG1-CG 3.89Å; V339-F348 HydrophobicContact CG1-CZ 3.91Å; V339-F348 HydrophobicContact CG2-CE1 4.48Å
340Y85.9Confident82.3Confident131 Ų13169.3 Ų69.351%0.51435%0.35SS..Hα-helixtrans-61.9-40.5178.2-175.2-104.3000112.8F336 T338 G344 L345 F348F336-Y340 PolarHBondContact O-N 2.62Å; T338-Y340 VanDerWaalsContact C-N 3.35Å; T338-Y340 PolarHBondContact O-N 3.03Å; Y340-G344 WeakPolarHBondContact O-CA 3.44Å; Y340-G344 PolarHBondContact O-N 3.29Å; Y340-L345 HydrophobicContact CD2-CD2 4.34Å; Y340-L345 HydrophobicContact CE2-CD2 4.02Å; Y340-L345 HydrophobicContact CE2-CG 4.21Å; Y340-F348 HydrophobicContact CD2-CE2 4.13Å
341R82.5Confident82.8Confident155 Ų15565.9 Ų65.959%0.58533%0.327SS*.Hα-helixtrans-67.4-37.8176.8-77.7175.4177.5-177.8-2.4113.4R337 T338 V339R337-R341 WeakPolarHBondContact O-CB 3.44Å; R337-R341 VanDerWaalsContact O-CG 3.3Å; R337-R341 WeakPolarHBondContact O-CG 3.47Å; R337-R341 PolarHBondContact O-N 2.69Å; R337-R341 VanDerWaalsContact O-N 3.07Å; T338-R341 PolarHBondContact O-N 2.97Å; V339-R341 PolarHBondContact O-N 3.49Å
342L78.3Confident83.2Confident70 Ų7066.2 Ų66.237%0.36632%0.323SS..Hα-helixtrans-87.6-29.5-174.1-69.4173.7000113.8L121 T315 A319 T338 V339L121-L342 HydrophobicContact CD1-CD1 3.76Å; T315-L342 HydrophobicContact CG2-CD1 4.34Å; A319-L342 HydrophobicContact CB-CD2 4.29Å; T338-L342 HydrophobicContact CG2-CD1 3.71Å; T338-L342 HydrophobicContact CG2-CG 4.41Å; T338-L342 WeakPolarHBondContact O-CB 3.28Å; T338-L342 WeakPolarHBondContact O-CG 3.46Å; T338-L342 PolarHBondContact O-N 3.29Å; V339-L342 PolarHBondContact O-N 2.85Å
343G74.5Confident83.2Confident27 Ų2770.2 Ų70.228%0.27834%0.341SS..Hα-helixtrans-1354.4-174.300000115.5V339 G347V339-G343 PolarHBondContact O-N 3.26Å; G343-G347 PolarHBondContact O-N 2.97Å
344G85Confident82.9Confident27 Ų2765 Ų6528%0.27831%0.309SS..Hα-helixtrans57.8-151.5-174.100000112.5Y340 Q346 G347Y340-G344 WeakPolarHBondContact O-CA 3.44Å; Y340-G344 PolarHBondContact O-N 3.29Å; G344-Q346 VanDerWaalsContact C-N 3.32Å; G344-Q346 PolarHBondContact O-N 3.47Å; G344-G347 PolarHBondContact O-N 3.41Å
345L86.6Confident82.8Confident126 Ų12663.5 Ų63.566%0.6630%0.301SS*.Hα-helixtrans-65.5-33.8176-66.6173.8000112.7Y340 G347 F348Y340-L345 HydrophobicContact CD2-CD2 4.34Å; Y340-L345 HydrophobicContact CE2-CD2 4.02Å; Y340-L345 HydrophobicContact CE2-CG 4.21Å; L345-G347 VanDerWaalsContact C-N 3.26Å; L345-G347 PolarHBondContact O-N 3.02Å; L345-F348 PolarHBondContact O-N 2.92Å
346Q84.4Confident82.8Confident167 Ų16766 Ų6678%0.7832%0.316SS*.Hα-helixtrans-67.8-26.5178.7-66.8-176.6-4.600112.5G344 F348 F349 K350G344-Q346 VanDerWaalsContact C-N 3.32Å; G344-Q346 PolarHBondContact O-N 3.47Å; Q346-F348 VanDerWaalsContact C-N 3.25Å; Q346-F348 PolarHBondContact O-N 3.13Å; Q346-F349 PolarHBondContact O-N 3.17Å; Q346-F349 VanDerWaalsContact O-N 3.12Å; Q346-K350 PolarHBondContact O-N 2.9Å
347G81.6Confident82.5Confident1 Ų165.7 Ų65.71%0.0132%0.318CS..Hα-helixtrans-55.3-38.317500000113.3G343 G344 L345 F349 K350G343-G347 PolarHBondContact O-N 2.97Å; G344-G347 PolarHBondContact O-N 3.41Å; L345-G347 VanDerWaalsContact C-N 3.26Å; L345-G347 PolarHBondContact O-N 3.02Å; G347-F349 VanDerWaalsContact C-N 3.26Å; G347-F349 PolarHBondContact O-N 2.71Å; G347-K350 PolarHBondContact O-N 3.02Å
348F86.8Confident81.9Confident8 Ų859.8 Ų59.84%0.03530%0.296CS..THydrogen-bonded Turntrans-70.7-15.9179.7-69-73.2000114.9T299 P300 F336 V339 Y340 L345 Q346T299-F348 CarbonylContact C-O 3.39Å; T299-F348 WeakPolarHBondContact CG2-O 3.45Å; P300-F348 WeakPolarHBondContact CA-O 3.44Å; P300-F348 HydrophobicContact CB-CB 3.93Å; P300-F348 HydrophobicContact CB-CD1 3.95Å; P300-F348 HydrophobicContact CB-CG 4.26Å; P300-F348 HydrophobicContact CG-CB 4.12Å; F336-F348 HydrophobicContact CB-CE1 4.49Å; F336-F348 HydrophobicContact CD1-CE1 4.24Å; F336-F348 AromaticContact CD1-CZ 3.71Å; F336-F348 HydrophobicContact CD1-CZ 3.71Å; F336-F348 HydrophobicContact CD2-CD1 4.3Å; F336-F348 AromaticContact CD2-CE1 3.34Å; F336-F348 HydrophobicContact CD2-CE1 3.34Å; F336-F348 AromaticContact CD2-CZ 3.67Å; F336-F348 HydrophobicContact CD2-CZ 3.67Å; F336-F348 HydrophobicContact CE1-CE1 4.28Å; F336-F348 HydrophobicContact CE1-CE2 4.21Å; F336-F348 AromaticContact CE1-CZ 3.6Å; F336-F348 HydrophobicContact CE1-CZ 3.6Å; F336-F348 HydrophobicContact CE2-CD1 4.1Å; F336-F348 AromaticContact CE2-CE1 3.41Å; F336-F348 HydrophobicContact CE2-CE1 3.41Å; F336-F348 VanDerWaalsContact CE2-CE1 3.41Å; F336-F348 HydrophobicContact CE2-CE2 4.39Å; F336-F348 AromaticContact CE2-CZ 3.57Å; F336-F348 HydrophobicContact CE2-CZ 3.57Å; F336-F348 AromaticContact CG-CE1 3.78Å; F336-F348 HydrophobicContact CG-CE1 3.78Å; F336-F348 AromaticContact CG-CZ 3.73Å; F336-F348 HydrophobicContact CG-CZ 3.73Å; F336-F348 AromaticContact CZ-CE1 3.89Å; F336-F348 HydrophobicContact CZ-CE1 3.89Å; F336-F348 HydrophobicContact CZ-CE2 4.06Å; F336-F348 AromaticContact CZ-CZ 3.53Å; F336-F348 HydrophobicContact CZ-CZ 3.53Å; F336-F348 WeakPolarHBondContact O-CZ 3.44Å; V339-F348 HydrophobicContact CB-CD1 4.23Å; V339-F348 HydrophobicContact CB-CE1 3.74Å; V339-F348 HydrophobicContact CB-CZ 3.95Å; V339-F348 HydrophobicContact CG1-CD1 3.61Å; V339-F348 HydrophobicContact CG1-CD2 4.14Å; V339-F348 HydrophobicContact CG1-CE1 3.62Å; V339-F348 HydrophobicContact CG1-CE2 4.16Å; V339-F348 HydrophobicContact CG1-CG 3.89Å; V339-F348 HydrophobicContact CG1-CZ 3.91Å; V339-F348 HydrophobicContact CG2-CE1 4.48Å; Y340-F348 HydrophobicContact CD2-CE2 4.13Å; L345-F348 PolarHBondContact O-N 2.92Å; Q346-F348 VanDerWaalsContact C-N 3.25Å; Q346-F348 PolarHBondContact O-N 3.13Å
349F86.8Confident81.5Confident106 Ų10661 Ų6147%0.46530%0.301SS..THydrogen-bonded Turntrans-109.58.8179.1-64.1-83.1000112.5P300 Q346 G347 G351 V352P300-F349 HydrophobicContact CG-CE1 4.17Å; P300-F349 HydrophobicContact CG-CZ 4.03Å; Q346-F349 PolarHBondContact O-N 3.17Å; Q346-F349 VanDerWaalsContact O-N 3.12Å; G347-F349 VanDerWaalsContact C-N 3.26Å; G347-F349 PolarHBondContact O-N 2.71Å; F349-G351 PolarHBondContact O-N 3.24Å; F349-V352 HydrophobicContact CB-CB 4.45Å; F349-V352 HydrophobicContact CB-CG1 4.35Å; F349-V352 WeakPolarHBondContact O-CB 3.39Å; F349-V352 VanDerWaalsContact O-CG1 3.28Å; F349-V352 WeakPolarHBondContact O-CG1 3.31Å; F349-V352 PolarHBondContact O-N 2.89Å
350K81.3Confident80.8Confident70 Ų7067.6 Ų67.630%0.30433%0.333SS..THydrogen-bonded Turntrans-57126169.9-79.4-174.6171.5-174.40109.9L121 Q346 G347 V352L121-K350 HydrophobicContact CD2-CD 4.15Å; L121-K350 PolarHBondContact O-NZ 3.17Å; Q346-K350 PolarHBondContact O-N 2.9Å; G347-K350 PolarHBondContact O-N 3.02Å; K350-V352 VanDerWaalsContact C-N 3.34Å; K350-V352 PolarHBondContact O-N 2.78Å
351G78.1Confident80.1Confident12 Ų1263.4 Ų63.412%0.12432%0.322CS..THydrogen-bonded Turntrans78.56-177.700000115.7F349 Q353 A354 R355F349-G351 PolarHBondContact O-N 3.24Å; G351-Q353 VanDerWaalsContact C-N 3.32Å; G351-Q353 PolarHBondContact O-N 2.85Å; G351-A354 WeakPolarHBondContact O-CA 3.37Å; G351-A354 VanDerWaalsContact O-CB 3.32Å; G351-A354 WeakPolarHBondContact O-CB 3.5Å; G351-A354 PolarHBondContact O-N 2.88Å; G351-R355 PolarHBondContact O-N 2.66Å
352V84.8Confident79.4Confident37 Ų3757.3 Ų57.322%0.22430%0.303CS..Hα-helixtrans-55.1-45.1178.468.10000112.4A296 T299 F349 K350 A354 R355 V356A296-V352 HydrophobicContact CB-CG2 4.23Å; T299-V352 HydrophobicContact CG2-CB 4.02Å; T299-V352 HydrophobicContact CG2-CG2 4.37Å; F349-V352 HydrophobicContact CB-CB 4.45Å; F349-V352 HydrophobicContact CB-CG1 4.35Å; F349-V352 WeakPolarHBondContact O-CB 3.39Å; F349-V352 VanDerWaalsContact O-CG1 3.28Å; F349-V352 WeakPolarHBondContact O-CG1 3.31Å; F349-V352 PolarHBondContact O-N 2.89Å; K350-V352 VanDerWaalsContact C-N 3.34Å; K350-V352 PolarHBondContact O-N 2.78Å; V352-A354 VanDerWaalsContact C-N 3.29Å; V352-A354 PolarHBondContact O-N 2.86Å; V352-R355 PolarHBondContact O-N 2.98Å; V352-V356 HydrophobicContact CG2-CG2 4.46Å; V352-V356 WeakPolarHBondContact O-CG2 3.36Å; V352-V356 PolarHBondContact O-N 3.39Å
353Q82.8Confident78.9Confident125 Ų12556.2 Ų56.258%0.58430%0.299SS*.Hα-helixtrans-60.7-39.5176.5-72.5-177.4-24.600112.1G351 I357G351-Q353 VanDerWaalsContact C-N 3.32Å; G351-Q353 PolarHBondContact O-N 2.85Å; Q353-I357 VanDerWaalsContact O-CB 3.29Å; Q353-I357 WeakPolarHBondContact O-CB 3.17Å; Q353-I357 WeakPolarHBondContact O-CD1 3.48Å; Q353-I357 WeakPolarHBondContact O-CG1 3.1Å; Q353-I357 PolarHBondContact O-N 3.28Å
354A78.4Confident78.6Confident0 Ų056.9 Ų56.90%030%0.302CS..Hα-helixtrans-62.3-52.8176.900000109.4M118 V132 G351 V352 V356 I357 Y358M118-A354 HydrophobicContact CE-CB 4.43Å; M118-A354 HydrophobicContact SD-CB 3.89Å; V132-A354 HydrophobicContact CG2-CB 3.84Å; G351-A354 WeakPolarHBondContact O-CA 3.37Å; G351-A354 VanDerWaalsContact O-CB 3.32Å; G351-A354 WeakPolarHBondContact O-CB 3.5Å; G351-A354 PolarHBondContact O-N 2.88Å; V352-A354 VanDerWaalsContact C-N 3.29Å; V352-A354 PolarHBondContact O-N 2.86Å; A354-V356 VanDerWaalsContact C-N 3.35Å; A354-V356 PolarHBondContact O-N 3.4Å; A354-I357 PolarHBondContact O-N 3.47Å; A354-Y358 VanDerWaalsContact C-CD2 3.41Å; A354-Y358 HydrophobicContact CB-CD2 4.35Å; A354-Y358 HydrophobicContact CB-CE2 3.54Å; A354-Y358 WeakPolarHBondContact O-CD1 3.19Å; A354-Y358 WeakPolarHBondContact O-CD2 3.24Å; A354-Y358 WeakPolarHBondContact O-CE2 3.27Å; A354-Y358 PolarHBondContact O-N 2.81Å
355R79.5Confident77.8Confident23 Ų2357.3 Ų57.39%0.08730%0.298CS..Hα-helixtrans-57.7-42.5179.8-161.7-173.2174.9174.5-0113.3A295 T298 D302 G351 V352 Y358A295-R355 HydrophobicContact CB-CG 3.89Å; A295-R355 PolarHBondContact O-NH1 3.15Å; T298-R355 PolarHBondContact O-NH1 2.87Å; T298-R355 VanDerWaalsContact OG1-CZ 3.24Å; T298-R355 PolarHBondContact OG1-NH1 2.94Å; T298-R355 PolarHBondContact OG1-NH2 3.46Å; D302-R355 VanDerWaalsContact CB-NH1 3.31Å; D302-R355 IonicContact OD2-CZ 2.69Å; D302-R355 IonicContact OD2-NE 2.81Å; D302-R355 IonicContact OD2-NH1 3.29Å; G351-R355 PolarHBondContact O-N 2.66Å; V352-R355 PolarHBondContact O-N 2.98Å; R355-Y358 PolarHBondContact O-N 3.41Å
356V82.3Confident76.8Confident51 Ų5153.2 Ų53.231%0.30928%0.28SS..Hα-helixtrans-65.4-48.4176.4167.90000111.5A292 A296 V352 A354 Y358 Q359A292-V356 HydrophobicContact CB-CG1 3.89Å; A296-V356 HydrophobicContact CB-CG2 4.26Å; V352-V356 HydrophobicContact CG2-CG2 4.46Å; V352-V356 WeakPolarHBondContact O-CG2 3.36Å; V352-V356 PolarHBondContact O-N 3.39Å; A354-V356 VanDerWaalsContact C-N 3.35Å; A354-V356 PolarHBondContact O-N 3.4Å; V356-Y358 PolarHBondContact O-N 2.89Å; V356-Q359 PolarHBondContact O-N 3.38Å
357I80.3Confident75.9Confident93 Ų9349.6 Ų49.648%0.47726%0.259SS..Hα-helixtrans-62.4-31.8179.9-70.6167000111.4V132 Q353 A354 Q359 P361V132-I357 HydrophobicContact CG2-CD1 4.46Å; Q353-I357 VanDerWaalsContact O-CB 3.29Å; Q353-I357 WeakPolarHBondContact O-CB 3.17Å; Q353-I357 WeakPolarHBondContact O-CD1 3.48Å; Q353-I357 WeakPolarHBondContact O-CG1 3.1Å; Q353-I357 PolarHBondContact O-N 3.28Å; A354-I357 PolarHBondContact O-N 3.47Å; I357-Q359 VanDerWaalsContact C-N 3.33Å; I357-Q359 PolarHBondContact O-N 2.95Å; I357-P361 WeakPolarHBondContact O-CD 3.11Å
358Y73.6Confident75.4Confident14 Ų1453.1 Ų53.16%0.05528%0.284CS..Hα-helixtrans-73.2-19.5-179.9-59-29.8000115I111 V114 K115 V132 A354 R355 V356 M360 P361 S362I111-Y358 HydrophobicContact CB-CE1 4.49Å; I111-Y358 HydrophobicContact CG2-CD1 3.13Å; I111-Y358 HydrophobicContact CG2-CD2 4.32Å; I111-Y358 HydrophobicContact CG2-CE1 3.13Å; I111-Y358 HydrophobicContact CG2-CE2 4.34Å; I111-Y358 HydrophobicContact CG2-CG 3.77Å; I111-Y358 PolarHBondContact O-OH 3.04Å; V114-Y358 WeakPolarHBondContact CB-OH 3.2Å; V114-Y358 WeakPolarHBondContact CG1-OH 3.38Å; K115-Y358 HydrophobicContact CB-CD2 4.05Å; K115-Y358 HydrophobicContact CB-CE2 3.44Å; K115-Y358 VanDerWaalsContact CB-CE2 3.44Å; K115-Y358 HydrophobicContact CD-CD2 4.42Å; K115-Y358 HydrophobicContact CG-CD2 4Å; K115-Y358 HydrophobicContact CG-CE2 3.72Å; K115-Y358 PolarHBondContact N-OH 3.47Å; V132-Y358 HydrophobicContact CB-CE1 4.28Å; V132-Y358 HydrophobicContact CG1-CE1 3.52Å; V132-Y358 HydrophobicContact CG2-CE1 3.73Å; V132-Y358 WeakPolarHBondContact CG2-OH 3.27Å; A354-Y358 VanDerWaalsContact C-CD2 3.41Å; A354-Y358 HydrophobicContact CB-CD2 4.35Å; A354-Y358 HydrophobicContact CB-CE2 3.54Å; A354-Y358 WeakPolarHBondContact O-CD1 3.19Å; A354-Y358 WeakPolarHBondContact O-CD2 3.24Å; A354-Y358 WeakPolarHBondContact O-CE2 3.27Å; A354-Y358 PolarHBondContact O-N 2.81Å; R355-Y358 PolarHBondContact O-N 3.41Å; V356-Y358 PolarHBondContact O-N 2.89Å; Y358-M360 VanDerWaalsContact C-N 3.32Å; Y358-M360 PolarHBondContact O-N 3.33Å; Y358-P361 WeakPolarHBondContact O-CD 3.34Å; Y358-S362 VanDerWaalsContact O-CB 3.31Å; Y358-S362 WeakPolarHBondContact O-CB 3.11Å; Y358-S362 PolarHBondContact O-N 3.37Å
359Q72.4Confident74.4Confident38 Ų3853.2 Ų53.218%0.17828%0.284CS..Hα-helixtrans-60.8-43179-171.8625800111.7V356 I357 S362 T363V356-Q359 PolarHBondContact O-N 3.38Å; I357-Q359 VanDerWaalsContact C-N 3.33Å; I357-Q359 PolarHBondContact O-N 2.95Å; Q359-S362 PolarHBondContact O-N 3.44Å; Q359-T363 PolarHBondContact NE2-OG1 3.37Å; Q359-T363 WeakPolarHBondContact O-CB 3.27Å; Q359-T363 PolarHBondContact O-N 3.39Å; Q359-T363 PolarHBondContact O-OG1 2.87Å; Q359-T363 VanDerWaalsContact O-OG1 3.13Å
360M70.4Confident73.3Confident139 Ų13950.9 Ų50.969%0.68527%0.273SS*.Hα-helixtrans-67.9-48.2-175.6-176.9-172.7108.300113Y358 A364Y358-M360 VanDerWaalsContact C-N 3.32Å; Y358-M360 PolarHBondContact O-N 3.33Å; M360-A364 WeakPolarHBondContact O-CB 3.32Å; M360-A364 PolarHBondContact O-N 3.4Å
361P71.9Confident72.7Confident43 Ų4350.6 Ų50.628%0.27927%0.273SS..Hα-helixtrans-61.5-40171-24.634.9000113.5M108 I357 Y358 A364 I365M108-P361 HydrophobicContact SD-CB 4.35Å; I357-P361 WeakPolarHBondContact O-CD 3.11Å; Y358-P361 WeakPolarHBondContact O-CD 3.34Å; P361-A364 PolarHBondContact O-N 2.81Å; P361-I365 WeakPolarHBondContact O-CB 3.38Å; P361-I365 WeakPolarHBondContact O-CD1 3.46Å; P361-I365 VanDerWaalsContact O-CG1 3.27Å; P361-I365 WeakPolarHBondContact O-CG1 3.4Å; P361-I365 PolarHBondContact O-N 2.92Å
362S67.8Low72.5Confident27 Ų2756.5 Ų56.519%0.18930%0.295CS..Hα-helixtrans-59.5-56.2178.3-148.60000110.1Y358 Q359 A364 I365 S366Y358-S362 VanDerWaalsContact O-CB 3.31Å; Y358-S362 WeakPolarHBondContact O-CB 3.11Å; Y358-S362 PolarHBondContact O-N 3.37Å; Q359-S362 PolarHBondContact O-N 3.44Å; S362-A364 VanDerWaalsContact C-N 3.31Å; S362-A364 PolarHBondContact O-N 3.41Å; S362-I365 PolarHBondContact O-N 3.45Å; S362-I365 VanDerWaalsContact O-N 3.09Å; S362-S366 PolarHBondContact O-N 3.15Å; S362-S366 PolarHBondContact O-OG 2.91Å
363T67.3Low71.7Confident46 Ų4656.6 Ų56.628%0.28229%0.293SS..Hα-helixtrans-58.9-40.2179.3-63.10000112.2Q359 W367Q359-T363 PolarHBondContact NE2-OG1 3.37Å; Q359-T363 WeakPolarHBondContact O-CB 3.27Å; Q359-T363 PolarHBondContact O-N 3.39Å; Q359-T363 PolarHBondContact O-OG1 2.87Å; Q359-T363 VanDerWaalsContact O-OG1 3.13Å; T363-W367 VanDerWaalsContact O-CB 3.27Å; T363-W367 WeakPolarHBondContact O-CB 3.27Å; T363-W367 PolarHBondContact O-N 3.39Å
364A68.3Low71Confident41 Ų4153.4 Ų53.434%0.33928%0.277SS..Hα-helixtrans-65.6-38.6176.400000112.9M360 P361 S362 S368M360-A364 WeakPolarHBondContact O-CB 3.32Å; M360-A364 PolarHBondContact O-N 3.4Å; P361-A364 PolarHBondContact O-N 2.81Å; S362-A364 VanDerWaalsContact C-N 3.31Å; S362-A364 PolarHBondContact O-N 3.41Å; A364-S368 WeakPolarHBondContact O-CB 3.33Å; A364-S368 PolarHBondContact O-N 3.04Å; A364-S368 PolarHBondContact O-OG 3.46Å
365I69.1Low70.8Confident37 Ų3760.5 Ų60.519%0.1931%0.305CS..Hα-helixtrans-68.9-52.3175.8-71.6163.7000110E104 L107 M108 P361 S362 W367 S368 V369E104-I365 HydrophobicContact CB-CG2 4.42Å; E104-I365 HydrophobicContact CG-CG2 4.19Å; L107-I365 HydrophobicContact CB-CD1 4.21Å; L107-I365 HydrophobicContact CB-CG2 4.35Å; L107-I365 HydrophobicContact CD1-CG2 3.84Å; M108-I365 HydrophobicContact CG-CD1 4.06Å; M108-I365 HydrophobicContact SD-CD1 3.67Å; P361-I365 WeakPolarHBondContact O-CB 3.38Å; P361-I365 WeakPolarHBondContact O-CD1 3.46Å; P361-I365 VanDerWaalsContact O-CG1 3.27Å; P361-I365 WeakPolarHBondContact O-CG1 3.4Å; P361-I365 PolarHBondContact O-N 2.92Å; S362-I365 PolarHBondContact O-N 3.45Å; S362-I365 VanDerWaalsContact O-N 3.09Å; I365-W367 VanDerWaalsContact C-N 3.26Å; I365-W367 PolarHBondContact O-N 2.9Å; I365-S368 PolarHBondContact O-N 3.4Å; I365-S368 VanDerWaalsContact O-N 3.15Å; I365-V369 HydrophobicContact CG2-CG2 4.07Å; I365-V369 WeakPolarHBondContact O-CB 3.4Å; I365-V369 WeakPolarHBondContact O-CG2 3.25Å; I365-V369 PolarHBondContact O-N 3.13Å
366S64.8Low70.4Confident40 Ų4061.2 Ų61.228%0.2832%0.319SS..Hα-helixtrans-55.2-42.4178.8-47.70000111.5E104 S362 Y370E104-S366 PolarHBondContact OE1-OG 3.17Å; E104-S366 WeakPolarHBondContact OE2-CB 3.35Å; E104-S366 PolarHBondContact OE2-OG 2.66Å; S362-S366 PolarHBondContact O-N 3.15Å; S362-S366 PolarHBondContact O-OG 2.91Å; S366-Y370 VanDerWaalsContact O-CB 3.28Å; S366-Y370 WeakPolarHBondContact O-CB 3.22Å; S366-Y370 PolarHBondContact O-N 2.81Å
367W66.5Low69.9Low91 Ų9160.5 Ų60.535%0.34531%0.313SS..Hα-helixtrans-68.1-43.9177.6-162.377.6000112.6Y81 T363 I365 V369 Y370 E371Y81-W367 PolarHBondContact OH-NE1 3.08Å; T363-W367 VanDerWaalsContact O-CB 3.27Å; T363-W367 WeakPolarHBondContact O-CB 3.27Å; T363-W367 PolarHBondContact O-N 3.39Å; I365-W367 VanDerWaalsContact C-N 3.26Å; I365-W367 PolarHBondContact O-N 2.9Å; W367-V369 VanDerWaalsContact C-N 3.32Å; W367-V369 PolarHBondContact O-N 2.79Å; W367-Y370 PolarHBondContact O-N 2.98Å; W367-E371 HydrophobicContact CD2-CG 4.18Å; W367-E371 HydrophobicContact CE3-CG 4.26Å; W367-E371 HydrophobicContact CH2-CG 4.16Å; W367-E371 HydrophobicContact CZ2-CG 4.07Å; W367-E371 HydrophobicContact CZ3-CG 4.25Å; W367-E371 PolarHBondContact O-N 3.05Å
368S69.5Low69.5Low75 Ų7559.3 Ų59.352%0.52431%0.311SS..Hα-helixtrans-63-38.8176.3-57.60000112.4A364 I365 F372A364-S368 WeakPolarHBondContact O-CB 3.33Å; A364-S368 PolarHBondContact O-N 3.04Å; A364-S368 PolarHBondContact O-OG 3.46Å; I365-S368 PolarHBondContact O-N 3.4Å; I365-S368 VanDerWaalsContact O-N 3.15Å; S368-F372 WeakPolarHBondContact O-CB 3.39Å; S368-F372 PolarHBondContact O-N 3.12Å; S368-F372 VanDerWaalsContact O-N 3.1Å
369V65.6Low69.6Low9 Ų964.6 Ų64.66%0.05533%0.334CS..Hα-helixtrans-66.2-47.1175.5171.80000110.1A100 M103 I365 W367 F372 F373A100-V369 HydrophobicContact CB-CG1 3.47Å; A100-V369 VanDerWaalsContact CB-CG1 3.47Å; M103-V369 HydrophobicContact CE-CB 4.49Å; M103-V369 HydrophobicContact CE-CG1 3.99Å; M103-V369 HydrophobicContact CE-CG2 4Å; M103-V369 HydrophobicContact CG-CG2 4.41Å; I365-V369 HydrophobicContact CG2-CG2 4.07Å; I365-V369 WeakPolarHBondContact O-CB 3.4Å; I365-V369 WeakPolarHBondContact O-CG2 3.25Å; I365-V369 PolarHBondContact O-N 3.13Å; W367-V369 VanDerWaalsContact C-N 3.32Å; W367-V369 PolarHBondContact O-N 2.79Å; V369-F372 PolarHBondContact O-N 2.86Å; V369-F373 HydrophobicContact CG1-CD2 3.85Å; V369-F373 HydrophobicContact CG1-CE2 3.86Å; V369-F373 VanDerWaalsContact O-CD2 3.26Å; V369-F373 WeakPolarHBondContact O-CD2 3.37Å; V369-F373 PolarHBondContact O-N 3.02Å
370Y64.6Low69.7Low57 Ų5768 Ų6822%0.22435%0.35CS..Hα-helixtrans-58.8-50.5177.4176.6-98.7000112.3Y81 G83 L84 S366 W367 F372 F373 K374Y81-Y370 PolarHBondContact O-OH 2.8Å; G83-Y370 PolarHBondContact O-OH 2.95Å; G83-Y370 VanDerWaalsContact O-OH 3.07Å; L84-Y370 HydrophobicContact CD2-CE2 4.38Å; S366-Y370 VanDerWaalsContact O-CB 3.28Å; S366-Y370 WeakPolarHBondContact O-CB 3.22Å; S366-Y370 PolarHBondContact O-N 2.81Å; W367-Y370 PolarHBondContact O-N 2.98Å; Y370-F372 VanDerWaalsContact C-N 3.32Å; Y370-F372 PolarHBondContact O-N 3.35Å; Y370-F373 PolarHBondContact O-N 3.34Å; Y370-F373 VanDerWaalsContact O-N 3.16Å; Y370-K374 HydrophobicContact CE1-CD 3.9Å; Y370-K374 WeakPolarHBondContact O-CB 3.34Å; Y370-K374 PolarHBondContact O-N 3.19Å
371E68.8Low69.7Low65 Ų6564.9 Ų64.930%0.30433%0.333SS..Hα-helixtrans-62.3-37.7178.5-76.4-62.6116.900112.2W367 K374 Y375W367-E371 HydrophobicContact CD2-CG 4.18Å; W367-E371 HydrophobicContact CE3-CG 4.26Å; W367-E371 HydrophobicContact CH2-CG 4.16Å; W367-E371 HydrophobicContact CZ2-CG 4.07Å; W367-E371 HydrophobicContact CZ3-CG 4.25Å; W367-E371 PolarHBondContact O-N 3.05Å; E371-K374 PolarHBondContact O-N 3.31Å; E371-K374 IonicContact OE1-NZ 3.38Å; E371-Y375 VanDerWaalsContact O-CB 3.29Å; E371-Y375 WeakPolarHBondContact O-CB 3.3Å; E371-Y375 PolarHBondContact O-N 3.29Å
372F73.2Confident69.8Low135 Ų13567.5 Ų67.559%0.59234%0.342SS*.Hα-helixtrans-61.1-45173.1177.8-95000112.4S368 V369 Y370 G376S368-F372 WeakPolarHBondContact O-CB 3.39Å; S368-F372 PolarHBondContact O-N 3.12Å; S368-F372 VanDerWaalsContact O-N 3.1Å; V369-F372 PolarHBondContact O-N 2.86Å; Y370-F372 VanDerWaalsContact C-N 3.32Å; Y370-F372 PolarHBondContact O-N 3.35Å; F372-G376 PolarHBondContact O-N 3.3Å
373F69Low70.2Confident40 Ų4070.3 Ų70.318%0.17536%0.355CS..Hα-helixtrans-67.3-42.3176.8-85.8-70.2000112.7A96 V99 A100 M103 V369 Y370 G376 L377A96-F373 HydrophobicContact CB-CD1 4.11Å; A96-F373 HydrophobicContact CB-CG 4.49Å; V99-F373 HydrophobicContact CB-CE1 4.32Å; V99-F373 HydrophobicContact CB-CZ 3.73Å; V99-F373 HydrophobicContact CG1-CE1 4.44Å; V99-F373 HydrophobicContact CG1-CZ 3.65Å; A100-F373 HydrophobicContact CB-CD2 3.95Å; A100-F373 HydrophobicContact CB-CE2 3.83Å; M103-F373 HydrophobicContact CE-CE2 4.09Å; V369-F373 HydrophobicContact CG1-CD2 3.85Å; V369-F373 HydrophobicContact CG1-CE2 3.86Å; V369-F373 VanDerWaalsContact O-CD2 3.26Å; V369-F373 WeakPolarHBondContact O-CD2 3.37Å; V369-F373 PolarHBondContact O-N 3.02Å; Y370-F373 PolarHBondContact O-N 3.34Å; Y370-F373 VanDerWaalsContact O-N 3.16Å; F373-G376 PolarHBondContact O-N 2.95Å; F373-L377 WeakPolarHBondContact O-CG 3.19Å; F373-L377 PolarHBondContact O-N 3.37Å
374K66.9Low70.6Confident58 Ų5871.6 Ų71.625%0.25236%0.36SS..Hα-helixtrans-59.8-49.8176.2-172.8173.9179.9176.70110.9Y370 E371 G376 L377 T378Y370-K374 HydrophobicContact CE1-CD 3.9Å; Y370-K374 WeakPolarHBondContact O-CB 3.34Å; Y370-K374 PolarHBondContact O-N 3.19Å; E371-K374 PolarHBondContact O-N 3.31Å; E371-K374 IonicContact OE1-NZ 3.38Å; K374-G376 VanDerWaalsContact C-N 3.34Å; K374-G376 PolarHBondContact O-N 3.22Å; K374-L377 PolarHBondContact O-N 3.08Å; K374-T378 WeakPolarHBondContact O-CB 3.41Å; K374-T378 PolarHBondContact O-N 3.2Å; K374-T378 PolarHBondContact O-OG1 2.9Å; K374-T378 VanDerWaalsContact O-OG1 3.1Å
375Y74.6Confident70.9Confident149 Ų14974.4 Ų74.458%0.58437%0.367SS*.Hα-helixtrans-57.4-44.4174.1177.4-97.1000112.3E371 K379E371-Y375 VanDerWaalsContact O-CB 3.29Å; E371-Y375 WeakPolarHBondContact O-CB 3.3Å; E371-Y375 PolarHBondContact O-N 3.29Å; Y375-K379 HydrophobicContact CE1-CD 3.94Å; Y375-K379 WeakPolarHBondContact O-CB 3.36Å; Y375-K379 PolarHBondContact O-N 3.45Å
376G72.6Confident71.3Confident38 Ų3879.9 Ų79.939%0.39239%0.386SS..Hα-helixtrans-60.4-45.9177.300000113.4F372 F373 K374 H380F372-G376 PolarHBondContact O-N 3.3Å; F373-G376 PolarHBondContact O-N 2.95Å; K374-G376 VanDerWaalsContact C-N 3.34Å; K374-G376 PolarHBondContact O-N 3.22Å; G376-H380 PolarHBondContact O-N 3.41Å
377L70.3Confident71.9Confident35 Ų3581.5 Ų81.518%0.18339%0.39CS..Hα-helixtrans-66.7-49.6179-74.7167.1000112.1L84 T92 A96 F373 K374 K379 H380 Q381L84-L377 HydrophobicContact CD1-CD1 4.15Å; L84-L377 HydrophobicContact CD2-CD1 3.79Å; T92-L377 HydrophobicContact CG2-CD1 4.42Å; T92-L377 HydrophobicContact CG2-CD2 3.53Å; A96-L377 HydrophobicContact CB-CD1 4.5Å; F373-L377 WeakPolarHBondContact O-CG 3.19Å; F373-L377 PolarHBondContact O-N 3.37Å; K374-L377 PolarHBondContact O-N 3.08Å; L377-K379 VanDerWaalsContact C-N 3.3Å; L377-K379 PolarHBondContact O-N 3.4Å; L377-H380 PolarHBondContact O-N 3.43Å; L377-H380 VanDerWaalsContact O-N 3.11Å; L377-Q381 PolarHBondContact O-N 3.49Å
378T71.8Confident72.4Confident69 Ų6983.5 Ų83.542%0.42340%0.404SS..Hα-helixtrans-59.9-41.3177.5-58.10000111.2K374 H380 Q381 H382K374-T378 WeakPolarHBondContact O-CB 3.41Å; K374-T378 PolarHBondContact O-N 3.2Å; K374-T378 PolarHBondContact O-OG1 2.9Å; K374-T378 VanDerWaalsContact O-OG1 3.1Å; T378-H380 PolarHBondContact O-N 3.35Å; T378-Q381 PolarHBondContact O-N 3Å; T378-H382 WeakPolarHBondContact O-CB 3.2Å; T378-H382 PolarHBondContact O-N 2.9Å
379K77Confident72.7Confident124 Ų12485.9 Ų85.954%0.53941%0.406SS..Hα-helixtrans-63.3-39.7175.4-173.7175.3-176171.90112.1Y375 L377 N383Y375-K379 HydrophobicContact CE1-CD 3.94Å; Y375-K379 WeakPolarHBondContact O-CB 3.36Å; Y375-K379 PolarHBondContact O-N 3.45Å; L377-K379 VanDerWaalsContact C-N 3.3Å; L377-K379 PolarHBondContact O-N 3.4Å; K379-N383 WeakPolarHBondContact O-CB 3.28Å; K379-N383 PolarHBondContact O-N 2.9Å
380H73.1Confident73.3Confident111 Ų11190.6 Ų90.651%0.51443%0.43SS..Hα-helixtrans-67.8-44177.2-170.57.6000112.1G376 L377 T378 N383 N384G376-H380 PolarHBondContact O-N 3.41Å; L377-H380 PolarHBondContact O-N 3.43Å; L377-H380 VanDerWaalsContact O-N 3.11Å; T378-H380 PolarHBondContact O-N 3.35Å; H380-N383 PolarHBondContact O-N 2.88Å; H380-N384 PolarHBondContact CE1-ND2 3.23Å; H380-N384 PolarHBondContact CE1-OD1 2.68Å; H380-N384 PolarHBondContact ND1-OD1 2.87Å; H380-N384 PolarHBondContact O-N 3.46Å; H380-N384 PolarHBondContact O-OD1 3.46Å
381Q71.6Confident73.7Confident72 Ų7295.3 Ų95.334%0.33645%0.452SS..Hα-helixtrans-58.4-48.4174.5-73.3175.4-4200111.2L377 T378 N383 N384 M385L377-Q381 PolarHBondContact O-N 3.49Å; T378-Q381 PolarHBondContact O-N 3Å; Q381-N383 VanDerWaalsContact C-N 3.31Å; Q381-N383 PolarHBondContact O-N 3.07Å; Q381-N384 PolarHBondContact O-N 2.91Å; Q381-M385 PolarHBondContact O-N 3.09Å
382H74.1Confident73.9Confident98 Ų9896.2 Ų96.245%0.45447%0.47SS..Hα-helixtrans-63.4-36.2179-160.892.2000112.4T378 R386T378-H382 WeakPolarHBondContact O-CB 3.2Å; T378-H382 PolarHBondContact O-N 2.9Å; H382-R386 PolarHBondContact CD2-NE 3.18Å; H382-R386 PolarHBondContact NE2-NE 3.44Å; H382-R386 WeakPolarHBondContact O-CG 3.38Å; H382-R386 PolarHBondContact O-N 2.89Å; H382-R386 VanDerWaalsContact O-N 3.09Å
383N76.4Confident73.8Confident87 Ų8797 Ų9747%0.46548%0.476SS..Hα-helixtrans-70.3-37.1175.1-160.457.8000112.5K379 H380 Q381 R386 I387K379-N383 WeakPolarHBondContact O-CB 3.28Å; K379-N383 PolarHBondContact O-N 2.9Å; H380-N383 PolarHBondContact O-N 2.88Å; Q381-N383 VanDerWaalsContact C-N 3.31Å; Q381-N383 PolarHBondContact O-N 3.07Å; N383-R386 PolarHBondContact O-N 3Å; N383-I387 VanDerWaalsContact O-CG1 3.32Å; N383-I387 WeakPolarHBondContact O-CG1 3.43Å; N383-I387 PolarHBondContact O-N 3.32Å
384N75.8Confident73.5Confident72 Ų72103.3 Ų103.339%0.38552%0.517SS..Hα-helixtrans-66.1-42.9175.2-72.6-2.9000111.6H380 Q381 R386 I387 Q388H380-N384 PolarHBondContact CE1-ND2 3.23Å; H380-N384 PolarHBondContact CE1-OD1 2.68Å; H380-N384 PolarHBondContact ND1-OD1 2.87Å; H380-N384 PolarHBondContact O-N 3.46Å; H380-N384 PolarHBondContact O-OD1 3.46Å; Q381-N384 PolarHBondContact O-N 2.91Å; N384-R386 VanDerWaalsContact C-N 3.35Å; N384-R386 PolarHBondContact O-N 3.07Å; N384-I387 PolarHBondContact O-N 3.38Å; N384-Q388 WeakPolarHBondContact O-CG 3.26Å; N384-Q388 PolarHBondContact O-N 3.39Å
385M74.6Confident73.8Confident101 Ų101105.6 Ų105.650%0.49853%0.53SS..Hα-helixtrans-61.5-41.1174.6-71.5-172.6-70.800112Q381 I387 Q388 H389Q381-M385 PolarHBondContact O-N 3.09Å; M385-I387 PolarHBondContact O-N 3.34Å; M385-Q388 PolarHBondContact O-N 3.01Å; M385-H389 PolarHBondContact O-N 2.93Å
386R77.5Confident73.8Confident152 Ų152103.3 Ų103.357%0.57453%0.527SS*.Hα-helixtrans-60.5-43.7172.9-76.3178.7176.7-147.6-4.5112.7H382 N383 N384 Q388 H389 I390H382-R386 PolarHBondContact CD2-NE 3.18Å; H382-R386 PolarHBondContact NE2-NE 3.44Å; H382-R386 WeakPolarHBondContact O-CG 3.38Å; H382-R386 PolarHBondContact O-N 2.89Å; H382-R386 VanDerWaalsContact O-N 3.09Å; N383-R386 PolarHBondContact O-N 3Å; N384-R386 VanDerWaalsContact C-N 3.35Å; N384-R386 PolarHBondContact O-N 3.07Å; R386-Q388 VanDerWaalsContact C-N 3.3Å; R386-Q388 PolarHBondContact O-N 2.73Å; R386-H389 PolarHBondContact O-N 3.32Å; R386-I390 VanDerWaalsContact O-CG1 3.31Å; R386-I390 WeakPolarHBondContact O-CG1 3.3Å; R386-I390 PolarHBondContact O-N 3.22Å
387I77.4Confident73.8Confident74 Ų74106.9 Ų106.938%0.37954%0.535SS..Hα-helixtrans-65.6-34.6177.2-69.3163.7000111.3N383 N384 M385 K391N383-I387 VanDerWaalsContact O-CG1 3.32Å; N383-I387 WeakPolarHBondContact O-CG1 3.43Å; N383-I387 PolarHBondContact O-N 3.32Å; N384-I387 PolarHBondContact O-N 3.38Å; M385-I387 PolarHBondContact O-N 3.34Å; I387-K391 HydrophobicContact CG2-CD 4.3Å; I387-K391 WeakPolarHBondContact O-CB 3.44Å; I387-K391 VanDerWaalsContact O-CG 3.29Å; I387-K391 WeakPolarHBondContact O-CG 3.21Å; I387-K391 PolarHBondContact O-N 2.91Å; I387-K391 VanDerWaalsContact O-N 3.17Å
388Q76Confident74.1Confident133 Ų133111.1 Ų111.162%0.62156%0.555SS**Hα-helixtrans-68.8-43.1174.6-75.6174.8-30.400112.2N384 M385 R386 K391 A392N384-Q388 WeakPolarHBondContact O-CG 3.26Å; N384-Q388 PolarHBondContact O-N 3.39Å; M385-Q388 PolarHBondContact O-N 3.01Å; R386-Q388 VanDerWaalsContact C-N 3.3Å; R386-Q388 PolarHBondContact O-N 2.73Å; Q388-K391 CarbonylContact O-C 3.58Å; Q388-K391 PolarHBondContact O-N 2.88Å; Q388-A392 PolarHBondContact O-N 3.3Å; Q388-A392 VanDerWaalsContact O-N 3.08Å
389H75.2Confident74.2Confident125 Ų125113.8 Ų113.858%0.57956%0.564SS**Hα-helixtrans-57.8-50.5173.3-103.7-86.5000112.1M385 R386 K391 A392 E393M385-H389 PolarHBondContact O-N 2.93Å; R386-H389 PolarHBondContact O-N 3.32Å; H389-K391 PolarHBondContact O-N 2.97Å; H389-A392 PolarHBondContact O-N 2.84Å; H389-E393 IonicContact ND1-OE1 3.07Å; H389-E393 PolarHBondContact O-N 2.8Å; H389-E393 VanDerWaalsContact O-N 3.12Å
390I78.9Confident74Confident108 Ų108113.1 Ų113.155%0.55457%0.565SS**Hα-helixtrans-60.1-31.1178.6-66.3164.3000111.7R386 V394R386-I390 VanDerWaalsContact O-CG1 3.31Å; R386-I390 WeakPolarHBondContact O-CG1 3.3Å; R386-I390 PolarHBondContact O-N 3.22Å; I390-V394 WeakPolarHBondContact O-CG2 3.45Å
391K74Confident74.1Confident156 Ų156113.2 Ų113.268%0.67857%0.569SS**THydrogen-bonded Turntrans-82-9175.2-75.8-179.7177.2-1720114.9I387 Q388 H389I387-K391 HydrophobicContact CG2-CD 4.3Å; I387-K391 WeakPolarHBondContact O-CB 3.44Å; I387-K391 VanDerWaalsContact O-CG 3.29Å; I387-K391 WeakPolarHBondContact O-CG 3.21Å; I387-K391 PolarHBondContact O-N 2.91Å; I387-K391 VanDerWaalsContact O-N 3.17Å; Q388-K391 CarbonylContact O-C 3.58Å; Q388-K391 PolarHBondContact O-N 2.88Å; H389-K391 PolarHBondContact O-N 2.97Å
392A71.7Confident74.3Confident84 Ų84116.4 Ų116.469%0.69459%0.587SS**THydrogen-bonded Turntrans-99.5-16.5175.100000112.1Q388 H389Q388-A392 PolarHBondContact O-N 3.3Å; Q388-A392 VanDerWaalsContact O-N 3.08Å; H389-A392 PolarHBondContact O-N 2.84Å
393E71.2Confident74.3Confident151 Ų151117.9 Ų117.971%0.70660%0.598SS**  trans-93.2-1.6175.9-68.9169.9-169.700113.2H389H389-E393 IonicContact ND1-OE1 3.07Å; H389-E393 PolarHBondContact O-N 2.8Å; H389-E393 VanDerWaalsContact O-N 3.12Å
394V62.8Low74.1Confident172 Ų172120.7 Ų120.7100%1.04261%0.61SS**  trans-1220179.3176.40000110.3I390I390-V394 WeakPolarHBondContact O-CG2 3.45Å

Retrieved 394 of 394 residues in 98.9 ms (Link to these results)