A0A077ZI06_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZI06, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 276 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M42.2Very low38.8Very low245 Ų245177.7 Ų177.7100%1.20784%0.842SS**  072.10-75.9-72.6-142.700110.4
2G37.3Very low38.6Very low74 Ų74171.5 Ų171.576%0.76383%0.832SS**  trans-97.3103.5179.500000111.1L4G2-L4 PolarHBondContact O-N 3.08Å
3R42Very low38.2Very low229 Ų229170.7 Ų170.786%0.86483%0.834SS**  trans-82.296.4173.8-77.1-173.2-102.8-140-2.7109.6F5R3-F5 HydrophobicContact CB-CD2 4.44Å; R3-F5 HydrophobicContact CB-CE2 4.47Å; R3-F5 PolarHBondContact O-N 3.06Å
4L41.3Very low38.1Very low169 Ų169167.3 Ų167.389%0.88583%0.828SS**  trans-75.596.3169.1-110.290.8000109.7G2 R6G2-L4 PolarHBondContact O-N 3.08Å; L4-R6 PolarHBondContact O-N 3.28Å
5F43.6Very low38Very low187 Ų187162.7 Ų162.782%0.8283%0.828SS**  trans-74.5109.3166.3-89.7-90.1000109.5R3 R7R3-F5 HydrophobicContact CB-CD2 4.44Å; R3-F5 HydrophobicContact CB-CE2 4.47Å; R3-F5 PolarHBondContact O-N 3.06Å; F5-R7 PolarHBondContact O-N 3.35Å
6R44.2Very low37.9Very low235 Ų235161 Ų16189%0.88783%0.828SS**  trans-71.4108.7167.5-87.2-176.6-112.5-145.2-2.6109.2L4 V8L4-R6 PolarHBondContact O-N 3.28Å; R6-V8 PolarHBondContact O-N 3.14Å
7R36.3Very low37.4Very low223 Ų223155.5 Ų155.584%0.84282%0.82SS**  trans-77.2112.9174.2-161.5176.3-145.4149.44.3109.3F5 H9F5-R7 PolarHBondContact O-N 3.35Å; R7-H9 PolarHBondContact O-N 3.23Å
8V37.5Very low37.4Very low120 Ų120156.5 Ų156.573%0.72783%0.825SS**  trans-77.4112.5173.3177.80000108.2R6 C10R6-V8 PolarHBondContact O-N 3.14Å; V8-C10 PolarHBondContact O-N 2.55Å
9H33.3Very low37.2Very low150 Ų150156.9 Ų156.969%0.69483%0.827SS**  trans-82.698170.8-86-85.3000109R7 Y11R7-H9 PolarHBondContact O-N 3.23Å; H9-Y11 PolarHBondContact O-N 2.7Å
10C35.8Very low37.4Very low107 Ų107154.5 Ų154.572%0.72382%0.824SS**  trans-73.5114163.5-63.80000108.2V8 S12V8-C10 PolarHBondContact O-N 2.55Å; C10-S12 PolarHBondContact O-N 3.14Å
11Y33.9Very low37.3Very low216 Ų216150.7 Ų150.785%0.84782%0.822SS**  trans-73107.3168.8-83.8-96.9000108.5H9H9-Y11 PolarHBondContact O-N 2.7Å
12S36Very low37Very low103 Ų103147.9 Ų147.972%0.7280%0.803SS**  trans-92.1102.6165.1-60.10000108.1C10 T14C10-S12 PolarHBondContact O-N 3.14Å; S12-T14 PolarHBondContact O-N 3.41Å; S12-T14 VanDerWaalsContact O-N 3.1Å
13D33.4Very low36.9Very low161 Ų161151.1 Ų151.186%0.86180%0.803SS**  trans-71.893167.5-95.4-33.4000109.1
14T36.2Very low36.9Very low123 Ų123144.8 Ų144.876%0.75579%0.794SS**  trans-9689163.6500000108.8S12S12-T14 PolarHBondContact O-N 3.41Å; S12-T14 VanDerWaalsContact O-N 3.1Å
15A37Very low36.8Very low99 Ų99142.1 Ų142.182%0.81879%0.785SS**  trans-112.869.4165.900000109
16T37Very low36.3Very low135 Ų135145 Ų14583%0.82879%0.79SS**  trans-76.8116.4165.3380000109.8
17G29.8Very low35.7Very low67 Ų67141.1 Ų141.169%0.69179%0.787SS**  trans67.495.6139.500000118.1
18L36.3Very low35.7Very low174 Ų174136.4 Ų136.491%0.91179%0.789SS**  trans-135.5105.3139.8-74.8178.7000108.7S20L18-S20 PolarHBondContact O-N 3.32Å
19D33.9Very low35.7Very low164 Ų164134.3 Ų134.388%0.87778%0.784SS**  trans-58.3115.6163.4178.225.3000109.4
20S41.7Very low35.7Very low108 Ų108134.3 Ų134.376%0.75579%0.789SS**  trans-132.288.7167.358.30000109L18 F22L18-S20 PolarHBondContact O-N 3.32Å; S20-F22 PolarHBondContact O-N 3.28Å
21G34.2Very low35.6Very low76 Ų76140.3 Ų140.378%0.78480%0.798SS**  trans-56.6104.4164.300000110.1
22F36.3Very low35.5Very low185 Ų185138.8 Ų138.881%0.81180%0.799SS**  trans-95.393.4171.3-167.4-100.2000108.9S20 S24S20-F22 PolarHBondContact O-N 3.28Å; F22-S24 PolarHBondContact O-N 2.93Å
23D36.2Very low35.2Very low142 Ų142138.7 Ų138.776%0.75980%0.798SS**  trans-66.5113.1177.4-157.4-13.6000110.1T25D23-T25 PolarHBondContact O-N 3.05Å
24S41.6Very low35.2Very low97 Ų97136.7 Ų136.768%0.67879%0.792SS**  trans-8967.6-170.8-68.60000111.5F22F22-S24 PolarHBondContact O-N 2.93Å
25T38Very low35.1Very low113 Ų113137 Ų13769%0.69379%0.794SS**  trans-155.991.7165.748.90000113.3D23D23-T25 PolarHBondContact O-N 3.05Å
26R33.3Very low35.1Very low246 Ų246137.1 Ų137.193%0.92879%0.794SS**  trans-178.6126.4134.1-109.4168.3147.1139.5-6.5114.8
27N33Very low35.2Very low154 Ų154136.1 Ų136.182%0.82479%0.793SS**  trans66.298.7150.1-98.83.1000120.5A29N27-A29 PolarHBondContact O-N 3.01Å
28S36.4Very low35.7Very low125 Ų125138.5 Ų138.587%0.87480%0.799SS**  trans-47.3112.7141.2-58.50000112
29A35.7Very low36Very low76 Ų76135.6 Ų135.663%0.62878%0.784SS**  trans-165.3119.914400000108.8N27N27-A29 PolarHBondContact O-N 3.01Å
30D34.8Very low36.9Very low150 Ų150131 Ų13180%0.80277%0.765SS**  trans60.769.7151.6-51.7-28.3000119.2
31Y34.1Very low37.5Very low233 Ų233130.6 Ų130.691%0.91476%0.762SS**  trans-114.378.6145.7-86.5-84.5000109.9S33Y31-S33 PolarHBondContact O-N 2.91Å
32Q30.2Very low38.5Very low184 Ų184133.1 Ų133.186%0.8675%0.753SS**  trans-80.4103.1151.4-72.7-168.84.200107.6
33S30.5Very low39.6Very low101 Ų101127.8 Ų127.871%0.70673%0.733SS**  trans154.1110.2140.2-75.20000112.5Y31Y31-S33 PolarHBondContact O-N 2.91Å
34T32.4Very low40.9Very low119 Ų119130.3 Ų130.373%0.7373%0.732SS**  trans86.5103.4132.4-35.30000118.9
35T35.3Very low42.3Very low129 Ų129131.8 Ų131.879%0.79172%0.723SS**  trans63.894.2142.262.40000119.9
36A37.3Very low43.4Very low101 Ų101129.6 Ų129.684%0.83570%0.702SS**  -162.159.6129.500000108.3S38A36-S38 VanDerWaalsContact C-N 3.31Å; A36-S38 PolarHBondContact O-N 3.4Å
37S37.8Very low44.9Very low115 Ų115123.4 Ų123.480%0.80468%0.684SS**  trans-66.697171.9-52.60000107.7L39S37-L39 PolarHBondContact O-N 3.35Å; S37-L39 VanDerWaalsContact O-N 3.13Å
38S41.1Very low46.7Very low116 Ų116118.9 Ų118.981%0.81166%0.664SS**  trans11.790.7154.5-50.80000113.6A36 S40A36-S38 VanDerWaalsContact C-N 3.31Å; A36-S38 PolarHBondContact O-N 3.4Å; S38-S40 PolarHBondContact O-N 2.88Å
39L42.3Very low48Very low113 Ų113115.3 Ų115.359%0.59264%0.635SS**  trans-50.8114.9172.1-72.3167000107.8S37 D43S37-L39 PolarHBondContact O-N 3.35Å; S37-L39 VanDerWaalsContact O-N 3.13Å; L39-D43 HydrophobicContact CB-CB 4.43Å; L39-D43 HydrophobicContact CD2-CB 4.25Å
40S53Low49.3Very low68 Ų68117.5 Ų117.548%0.47663%0.634SS.*  trans-51.9145.1176.8-1780000109.1S38 E42 D43S38-S40 PolarHBondContact O-N 2.88Å; S40-E42 PolarHBondContact O-N 2.88Å; S40-D43 PolarHBondContact O-N 3.45Å
41S53.9Low50.4Low99 Ų99116 Ų11669%0.69263%0.625SS**Hα-helixtrans-51.2-26.3-177.8-166.40000113.2
42E54.8Low51.5Low129 Ų129111.3 Ų111.360%0.60361%0.612SS**Hα-helixtrans-56.9-44.3170.7-100.477.1-178.500114.2S40 R44 W45 Y46S40-E42 PolarHBondContact O-N 2.88Å; E42-R44 PolarHBondContact O-N 3.06Å; E42-W45 PolarHBondContact O-N 2.9Å; E42-Y46 VanDerWaalsContact O-CD2 3.25Å; E42-Y46 WeakPolarHBondContact O-CD2 3.5Å; E42-Y46 PolarHBondContact O-N 2.84Å
43D58.9Low52.5Low73 Ų73106.1 Ų106.139%0.3960%0.596SS.*Hα-helixtrans-72-29.7-174.1-75.8-28.6000112.8L39 S40 W45 Y46 Q47L39-D43 HydrophobicContact CB-CB 4.43Å; L39-D43 HydrophobicContact CD2-CB 4.25Å; S40-D43 PolarHBondContact O-N 3.45Å; D43-W45 VanDerWaalsContact C-N 3.27Å; D43-W45 PolarHBondContact O-N 3.19Å; D43-Y46 WeakPolarHBondContact O-CB 3.47Å; D43-Y46 PolarHBondContact O-N 2.8Å; D43-Q47 PolarHBondContact O-N 2.71Å; D43-Q47 VanDerWaalsContact O-N 3.14Å
44R64.7Low53.5Low195 Ų195105.4 Ų105.474%0.73659%0.587SS**Hα-helixtrans-62.4-36.3172.5-92.2-178.6139.1-161.8-4112E42 Q47 S48E42-R44 PolarHBondContact O-N 3.06Å; R44-Q47 PolarHBondContact O-N 2.75Å; R44-S48 PolarHBondContact O-N 3.14Å
45W70.2Confident54.4Low128 Ų128103.5 Ų103.549%0.48558%0.584SS.*Hα-helixtrans-69.9-37.6177.9-161.173.9000111.4E42 D43 Q47 S48 L49E42-W45 PolarHBondContact O-N 2.9Å; D43-W45 VanDerWaalsContact C-N 3.27Å; D43-W45 PolarHBondContact O-N 3.19Å; W45-Q47 PolarHBondContact O-N 3.33Å; W45-S48 PolarHBondContact O-N 3.41Å; W45-L49 HydrophobicContact CZ3-CD2 4.4Å; W45-L49 PolarHBondContact O-N 3.41Å
46Y61.4Low55.2Low67 Ų67105.8 Ų105.826%0.26358%0.578SS.*Hα-helixtrans-58.9-45.4173-79.4-74.4000112.6E42 D43 M50 L202E42-Y46 VanDerWaalsContact O-CD2 3.25Å; E42-Y46 WeakPolarHBondContact O-CD2 3.5Å; E42-Y46 PolarHBondContact O-N 2.84Å; D43-Y46 WeakPolarHBondContact O-CB 3.47Å; D43-Y46 PolarHBondContact O-N 2.8Å; Y46-M50 WeakPolarHBondContact O-CG 3.44Å; Y46-M50 PolarHBondContact O-N 2.95Å; Y46-L202 HydrophobicContact CD1-CD1 4.22Å; Y46-L202 HydrophobicContact CE1-CD1 3.89Å
47Q65.5Low55.3Low116 Ų116104.4 Ų104.454%0.54257%0.567SS.*Hα-helixtrans-66-41176.3-73.3-173.415.700112.4D43 R44 W45 L49 M50 L51D43-Q47 PolarHBondContact O-N 2.71Å; D43-Q47 VanDerWaalsContact O-N 3.14Å; R44-Q47 PolarHBondContact O-N 2.75Å; W45-Q47 PolarHBondContact O-N 3.33Å; Q47-L49 VanDerWaalsContact C-N 3.35Å; Q47-L49 PolarHBondContact O-N 3.37Å; Q47-M50 PolarHBondContact O-N 2.91Å; Q47-L51 WeakPolarHBondContact O-CB 3.48Å; Q47-L51 WeakPolarHBondContact O-CD1 3.41Å; Q47-L51 WeakPolarHBondContact O-CG 3.25Å; Q47-L51 PolarHBondContact O-N 2.82Å
48S70.6Confident55.5Low60 Ų60107.2 Ų107.242%0.4256%0.564SS.*Hα-helixtrans-61.9-42179.6-168.50000112.1R44 W45 L51 Q52R44-S48 PolarHBondContact O-N 3.14Å; W45-S48 PolarHBondContact O-N 3.41Å; S48-L51 PolarHBondContact O-N 3.49Å; S48-Q52 PolarHBondContact O-N 3.47Å; S48-Q52 VanDerWaalsContact O-N 3.14Å
49L62.7Low55.6Low50 Ų50108.8 Ų108.826%0.26256%0.563SS.*Hα-helixtrans-64.7-43.3178.5-161.973.5000111.7W45 Q47 L51 Q52 S53 L202W45-L49 HydrophobicContact CZ3-CD2 4.4Å; W45-L49 PolarHBondContact O-N 3.41Å; Q47-L49 VanDerWaalsContact C-N 3.35Å; Q47-L49 PolarHBondContact O-N 3.37Å; L49-L51 PolarHBondContact O-N 3.04Å; L49-Q52 PolarHBondContact O-N 3.24Å; L49-S53 PolarHBondContact O-N 3.31Å; L49-S53 PolarHBondContact O-OG 3.46Å; L49-L202 HydrophobicContact CD2-CB 4.37Å; L49-L202 HydrophobicContact CD2-CD1 4.26Å
50M63.6Low55.7Low122 Ų122110.5 Ų110.560%0.60157%0.572SS**Hα-helixtrans-65.7-37.5178.3-70.5-62.5-68.400113Y46 Q47 T54Y46-M50 WeakPolarHBondContact O-CG 3.44Å; Y46-M50 PolarHBondContact O-N 2.95Å; Q47-M50 PolarHBondContact O-N 2.91Å; M50-T54 PolarHBondContact O-N 2.96Å; M50-T54 PolarHBondContact O-OG1 2.58Å
51L58.5Low54.8Low118 Ų118112.1 Ų112.162%0.61858%0.584SS**Hα-helixtrans-69.7-36.3179.1-75.2162.3000112Q47 S48 L49 T54 A55Q47-L51 WeakPolarHBondContact O-CB 3.48Å; Q47-L51 WeakPolarHBondContact O-CD1 3.41Å; Q47-L51 WeakPolarHBondContact O-CG 3.25Å; Q47-L51 PolarHBondContact O-N 2.82Å; S48-L51 PolarHBondContact O-N 3.49Å; L49-L51 PolarHBondContact O-N 3.04Å; L51-T54 PolarHBondContact O-N 3.38Å; L51-A55 PolarHBondContact O-N 3.32Å; L51-A55 VanDerWaalsContact O-N 3.14Å
52Q56.7Low53.8Low135 Ų135112.8 Ų112.863%0.63159%0.588SS**Hα-helixtrans-67-38.1178.9-125.9177.778.300112.4S48 L49 T54S48-Q52 PolarHBondContact O-N 3.47Å; S48-Q52 VanDerWaalsContact O-N 3.14Å; L49-Q52 PolarHBondContact O-N 3.24Å; Q52-T54 VanDerWaalsContact C-N 3.32Å; Q52-T54 PolarHBondContact O-N 3.24Å
53S50.4Low52.8Low75 Ų75111.9 Ų111.952%0.52460%0.596SS.*Hα-helixtrans-62-40.1173.9-45.50000112L49L49-S53 PolarHBondContact O-N 3.31Å; L49-S53 PolarHBondContact O-OG 3.46Å
54T53Low51.7Low85 Ų85113.4 Ų113.452%0.52161%0.613SS.*Hα-helixtrans-76.9-33.4-173-51.80000112.5M50 L51 Q52 R56M50-T54 PolarHBondContact O-N 2.96Å; M50-T54 PolarHBondContact O-OG1 2.58Å; L51-T54 PolarHBondContact O-N 3.38Å; Q52-T54 VanDerWaalsContact C-N 3.32Å; Q52-T54 PolarHBondContact O-N 3.24Å; T54-R56 VanDerWaalsContact C-N 3.34Å; T54-R56 PolarHBondContact O-N 2.8Å
55A51.3Low50.3Low80 Ų80110 Ų11066%0.66162%0.619SS**Hα-helixtrans-70.7-28-178.800000113.4L51L51-A55 PolarHBondContact O-N 3.32Å; L51-A55 VanDerWaalsContact O-N 3.14Å
56R51.2Low48.6Very low176 Ų176107.9 Ų107.966%0.66464%0.637SS**Hα-helixtrans-93.3-21-175.1-158.3172.2170.5128.2-1113.9T54 K58 E213T54-R56 VanDerWaalsContact C-N 3.34Å; T54-R56 PolarHBondContact O-N 2.8Å; R56-K58 PolarHBondContact O-N 2.96Å; R56-E213 IonicContact NE-OE1 2.89Å
57A40.4Very low47.2Very low73 Ų73108.2 Ų108.260%0.60366%0.661SS**G310 helixtrans-66.6-15.5178.200000114.3N59A57-N59 VanDerWaalsContact C-N 3.33Å; A57-N59 PolarHBondContact O-N 3.42Å
58K42.3Very low45.7Very low174 Ų174107.4 Ų107.476%0.75767%0.668SS**G310 helixtrans-83.33.2-178.1-70-174.1178.31790115.5R56R56-K58 PolarHBondContact O-N 2.96Å
59N43.1Very low44.3Very low148 Ų148110.2 Ų110.279%0.79169%0.687SS**G310 helixtrans-117.88.2-177.6-107.7-42.8000115.5A57A57-N59 VanDerWaalsContact C-N 3.33Å; A57-N59 PolarHBondContact O-N 3.42Å
60L42.7Very low43Very low149 Ų149114.6 Ų114.678%0.7871%0.711SS**  trans-128.363.1-178.9-64.1172.2000110.9
61S34Very low41.9Very low103 Ų103117 Ų11772%0.7273%0.726SS**  trans-139.682.9165.2520000108.3
62S33Very low40.7Very low112 Ų112117 Ų11778%0.78374%0.735SS**  trans-173121.5159.8-71.70000111
63S35Very low39.8Very low110 Ų110116.3 Ų116.377%0.76975%0.746SS**  trans76.699.1146.7-43.10000117.5
64S34.8Very low39Very low105 Ų105122.1 Ų122.173%0.73476%0.764SS**  90.3103.862.675.50000114.2
65S35.6Very low38.3Very low123 Ų123122.8 Ų122.886%0.8678%0.779SS**  trans42.7122.3134.464.90000121.2
66G34.5Very low37.4Very low84 Ų84123.3 Ų123.387%0.86678%0.783SS**  trans138.7122.9158.500000108.6
67G31.5Very low36.6Very low74 Ų74120.3 Ų120.376%0.76378%0.784SS**  cis152.9124.316.300000104.6
68S34.7Very low36.4Very low99 Ų99126.2 Ų126.269%0.69280%0.799SS**  trans-48.1142.8-175.2167.90000114.4
69S40.3Very low35.8Very low119 Ų119127 Ų12783%0.83281%0.805SS**  trans-155.6103142.5-69.80000109.2
70D35.5Very low35.2Very low143 Ų143123.2 Ų123.277%0.76580%0.801SS**  trans-61.9124.7165.2-63.9-57.8000110.1
71L41.1Very low34.7Very low173 Ų173125.3 Ų125.391%0.90680%0.804SS**  trans-149.7108.6148.8-76.2-173.8000110.6
72S34.5Very low34.7Very low116 Ų116126.3 Ų126.381%0.81181%0.806SS**  trans-59.2127.7163.1176.90000110.6
73S36.9Very low34.6Very low122 Ų122127.1 Ų127.185%0.85380%0.801SS**  trans-155105152.4-77.70000110.4
74E34.7Very low34.7Very low196 Ų196127.8 Ų127.892%0.91680%0.801SS**  trans-57.8123.1165.7-179.4175.9122.300110.9
75A36.6Very low34.6Very low100 Ų100128.8 Ų128.883%0.82680%0.802SS**  trans-149.7120.2161.400000110.5
76A33.9Very low34.3Very low91 Ų91130.9 Ų130.975%0.75280%0.803SS**  trans-72.5136.9-170.600000114.1
77V34Very low34.2Very low112 Ų112134.4 Ų134.468%0.67980%0.801SS**  trans41.1104.4130.1-172.60000117.4Q79V77-Q79 HydrophobicContact CG1-CG 4.48Å
78H34.8Very low34.1Very low197 Ų197139.5 Ų139.591%0.91281%0.805SS**  trans-129.3119.6142-82.9-17.6000110.8G80H78-G80 PolarHBondContact O-N 3.35Å
79Q30.5Very low34.2Very low190 Ų190139 Ų13989%0.88880%0.799SS**  trans-65.2110.6-179.2-73.7166.8-25.300110.8V77V77-Q79 HydrophobicContact CG1-CG 4.48Å
80G31.3Very low33.8Very low69 Ų69141.8 Ų141.871%0.71180%0.799SS**  trans-103.898.416700000110H78 V82H78-G80 PolarHBondContact O-N 3.35Å; G80-V82 PolarHBondContact O-N 2.98Å
81K30.7Very low33.9Very low193 Ų193140.5 Ų140.584%0.83980%0.796SS**  trans-67.4105.2178.4-159.6171.5-177.1-179.60109
82V34.9Very low33.7Very low125 Ų125135.1 Ų135.176%0.75878%0.783SS**  trans-109.5112.6171.5-178.20000107.8G80 T84G80-V82 PolarHBondContact O-N 2.98Å; V82-T84 PolarHBondContact O-N 2.82Å; V82-T84 VanDerWaalsContact O-N 3.13Å
83D30.5Very low34.1Very low129 Ų129135.4 Ų135.469%0.6978%0.779SS**  trans-62.2106.2-178.4-66.3-50.2000111.2T85D83-T85 VanDerWaalsContact C-N 3.27Å; D83-T85 PolarHBondContact O-N 2.72Å
84T37.5Very low34.2Very low124 Ų124131.3 Ų131.376%0.76176%0.756SS**  trans-90.152.617139.90000111.2V82 L86V82-T84 PolarHBondContact O-N 2.82Å; V82-T84 VanDerWaalsContact O-N 3.13Å; T84-L86 PolarHBondContact O-N 3.38Å; T84-L86 VanDerWaalsContact O-N 3.09Å
85T32Very low34.6Very low125 Ų125127 Ų12777%0.76774%0.739SS**THydrogen-bonded Turntrans-83.860.3168.752.80000110.8D83D83-T85 VanDerWaalsContact C-N 3.27Å; D83-T85 PolarHBondContact O-N 2.72Å
86L31.1Very low35Very low168 Ų168126 Ų12688%0.8872%0.72SS**THydrogen-bonded Turntrans-151.130.8166.6-98.2-173.7000113.4T84T84-L86 PolarHBondContact O-N 3.38Å; T84-L86 VanDerWaalsContact O-N 3.09Å
87L30.9Very low35.6Very low158 Ų158126.2 Ų126.283%0.82771%0.711SS**  trans-129.884.2166.1-69.1171.7000108.1P89L87-P89 WeakPolarHBondContact O-CD 3.27Å
88H28.9Very low36.4Very low181 Ų181126 Ų12684%0.83871%0.705SS**  trans-86.2100.3160-158.893.1000106.1Q90H88-Q90 PolarHBondContact O-N 3.04Å
89P37.1Very low37.7Very low87 Ų87119.7 Ų119.757%0.56569%0.693SS**  trans-71.2102.7179.228-32.3000108.6L87 V91L87-P89 WeakPolarHBondContact O-CD 3.27Å; P89-V91 PolarHBondContact O-N 2.8Å
90Q32.1Very low39Very low179 Ų179116.9 Ų116.984%0.83670%0.695SS**  trans-64.2119.8163.8-96.1-163.2-2200108.4H88 G92H88-Q90 PolarHBondContact O-N 3.04Å; Q90-G92 VanDerWaalsContact C-N 3.33Å; Q90-G92 PolarHBondContact O-N 3.39Å
91V38.3Very low39.6Very low115 Ų115123 Ų12370%0.69770%0.696SS**  trans-60.494.8169179.60000107.9P89 V93P89-V91 PolarHBondContact O-N 2.8Å; V91-V93 PolarHBondContact O-N 2.74Å
92G37.9Very low40.3Very low61 Ų61119 Ų11963%0.62968%0.684SS**  trans-82.8106.2173.700000109.5Q90 G94Q90-G92 VanDerWaalsContact C-N 3.33Å; Q90-G92 PolarHBondContact O-N 3.39Å; G92-G94 VanDerWaalsContact C-N 3.31Å; G92-G94 PolarHBondContact O-N 2.9Å
93V41Very low41.1Very low122 Ų122117.4 Ų117.474%0.73967%0.671SS**  trans-70.194.1166.1-175.80000107.1V91V91-V93 PolarHBondContact O-N 2.74Å
94G40.6Very low42.1Very low35 Ų35116.2 Ų116.236%0.36167%0.67SS.*EExtended strand (participates in β ladder)trans-97.3135.717500000110.7G92 L105G92-G94 VanDerWaalsContact C-N 3.31Å; G92-G94 PolarHBondContact O-N 2.9Å; G94-L105 PolarHBondContact O-N 2.81Å
95N43.3Very low42.7Very low106 Ų106114 Ų11457%0.56765%0.653SS**EExtended strand (participates in β ladder)trans-89124.3167.8-69.1-13.3000108.4
96L43.8Very low43.2Very low80 Ų80115.1 Ų115.142%0.41965%0.654SS.*EExtended strand (participates in β ladder)trans-90.7113.3168-175.264.6000108.2I98 L103 L105L96-I98 HydrophobicContact CD2-CD1 3.74Å; L96-I98 HydrophobicContact CD2-CG1 3.95Å; L96-I98 HydrophobicContact CG-CD1 4.21Å; L96-I98 HydrophobicContact CG-CG1 3.83Å; L96-I98 PolarHBondContact O-N 3.44Å; L96-L103 PolarHBondContact N-O 3.25Å; L96-L103 VanDerWaalsContact N-O 3.12Å; L96-L103 PolarHBondContact O-N 3.5Å; L96-L105 HydrophobicContact CB-CD1 3.6Å; L96-L105 HydrophobicContact CB-CG 3.86Å; L96-L105 HydrophobicContact CD2-CD1 4.16Å; L96-L105 HydrophobicContact CG-CD1 4.38Å
97V46Very low43.9Very low95 Ų95113 Ų11358%0.57664%0.642SS**EExtended strand (participates in β ladder)trans-82.8106.1174.1-173.70000107.7G99 N102V97-G99 WeakPolarHBondContact CG1-O 3.23Å; V97-N102 WeakPolarHBondContact CG2-OD1 3.32Å
98I51.1Low44.3Very low108 Ų108110 Ų11055%0.55464%0.635SS**EExtended strand (participates in β ladder)trans-111104.5168.6-53.1-177.2000107.6L96 R101L96-I98 HydrophobicContact CD2-CD1 3.74Å; L96-I98 HydrophobicContact CD2-CG1 3.95Å; L96-I98 HydrophobicContact CG-CD1 4.21Å; L96-I98 HydrophobicContact CG-CG1 3.83Å; L96-I98 PolarHBondContact O-N 3.44Å; I98-R101 PolarHBondContact N-O 2.87Å; I98-R101 PolarHBondContact O-N 3.44Å
99G62.4Low44.8Very low64 Ų64106.1 Ų106.166%0.6662%0.624SS**THydrogen-bonded Turntrans63.1-134.7-173.100000111.6V97 R101V97-G99 WeakPolarHBondContact CG1-O 3.23Å; G99-R101 VanDerWaalsContact C-N 3.3Å; G99-R101 PolarHBondContact O-N 3.37Å
100S57.8Low45Very low131 Ų131108.8 Ų108.892%0.91663%0.632SS**THydrogen-bonded Turntrans-86.810.5-179.1-42.40000114.2
101R43.8Very low45Very low198 Ų198103.4 Ų103.475%0.74762%0.624SS**EExtended strand (participates in β ladder)trans-119.8121.9-175.3-63.6-173.6178.9-171.40.3110.5I98 G99I98-R101 PolarHBondContact N-O 2.87Å; I98-R101 PolarHBondContact O-N 3.44Å; G99-R101 VanDerWaalsContact C-N 3.3Å; G99-R101 PolarHBondContact O-N 3.37Å
102N46.1Very low44.7Very low108 Ų108103.7 Ų103.758%0.57863%0.631SS**EExtended strand (participates in β ladder)trans-78.9117.2169.8-69.4-41.8000108.4V97V97-N102 WeakPolarHBondContact CG2-OD1 3.32Å
103L50.3Low44.5Very low92 Ų92107.1 Ų107.148%0.48264%0.635SS.*EExtended strand (participates in β ladder)trans-107.1125.1172.3-65.7171.4000108.8L96 L105L96-L103 PolarHBondContact N-O 3.25Å; L96-L103 VanDerWaalsContact N-O 3.12Å; L96-L103 PolarHBondContact O-N 3.5Å; L103-L105 PolarHBondContact O-N 3.34Å
104P53Low44.3Very low103 Ų103110 Ų11067%0.66964%0.638SS**EExtended strand (participates in β ladder)trans-70.3123.7174.627.3-30.9000109.4
105L48.5Very low43.7Very low77 Ų77112 Ų11240%0.40366%0.659SS.*EExtended strand (participates in β ladder)trans-93.4118.7170.2-70.4178.8000109.2G94 L96 L103G94-L105 PolarHBondContact O-N 2.81Å; L96-L105 HydrophobicContact CB-CD1 3.6Å; L96-L105 HydrophobicContact CB-CG 3.86Å; L96-L105 HydrophobicContact CD2-CD1 4.16Å; L96-L105 HydrophobicContact CG-CD1 4.38Å; L103-L105 PolarHBondContact O-N 3.34Å
106N43.3Very low43.3Very low150 Ų150111.6 Ų111.680%0.80267%0.669SS**  trans-106.394.8172.4-159.1-15000108.4S108N106-S108 PolarHBondContact O-N 3.06Å
107I46.3Very low43.2Very low122 Ų122114.1 Ų114.163%0.62669%0.691SS**  trans-90.394177.9-55.1174.7000107.3V109I107-V109 PolarHBondContact O-N 2.81Å
108S39.2Very low42.7Very low97 Ų97113.5 Ų113.568%0.67870%0.696SS**  trans-76.1111.9166.91770000108.6N106 I110N106-S108 PolarHBondContact O-N 3.06Å; S108-I110 PolarHBondContact O-N 3.03Å
109V39.5Very low41.8Very low99 Ų99116.9 Ų116.960%0.671%0.711SS**  trans-66.7114.2172169.30000108.4I107 G111I107-V109 PolarHBondContact O-N 2.81Å; V109-G111 PolarHBondContact O-N 3.44Å
110I40.9Very low40.6Very low143 Ų143121.5 Ų121.573%0.73372%0.716SS**  trans-70.696.8174.5-60.1169.4000107.2S108S108-I110 PolarHBondContact O-N 3.03Å
111G32.2Very low39.3Very low65 Ų65120.9 Ų120.967%0.6771%0.706SS**  trans-74.6122.2171.500000110.4V109 D113V109-G111 PolarHBondContact O-N 3.44Å; G111-D113 PolarHBondContact O-N 3.47Å
112S31.4Very low39Very low121 Ų121118.7 Ų118.785%0.84671%0.708SS**  trans-46.1124.1169.5-610000112.9
113D34.7Very low38.1Very low134 Ų134118.5 Ų118.572%0.71772%0.715SS**  -166.2133.5121.1-131.3-9.1000112.2G111G111-D113 PolarHBondContact O-N 3.47Å
114K36.3Very low37.3Very low183 Ų183121 Ų12180%0.79673%0.729SS**  trans50.9106156.7-46.3-164.7-177175.70120
115G28.1Very low36.5Very low77 Ų77120 Ų12079%0.79473%0.729SS**  92.9126.7126.400000116.4
116A34.1Very low35.6Very low96 Ų96122.8 Ų122.879%0.79374%0.744SS**  trans83.8131.6171.100000116.6A118A116-A118 PolarHBondContact O-N 3.34Å; A116-A118 VanDerWaalsContact O-N 3.12Å
117P42.2Very low35.4Very low134 Ų134121.9 Ų121.987%0.8774%0.744SS**  trans-8590.6-174.234.7-30.2000109.1M119P117-M119 PolarHBondContact O-N 3.09Å
118A35.1Very low34.7Very low82 Ų82122 Ų12268%0.67875%0.746SS**  trans-79.7114.8161.200000107.3A116 E120A116-A118 PolarHBondContact O-N 3.34Å; A116-A118 VanDerWaalsContact O-N 3.12Å; A118-E120 VanDerWaalsContact C-N 3.26Å; A118-E120 PolarHBondContact O-N 3.39Å
119M33.3Very low34.5Very low178 Ų178122.5 Ų122.588%0.87775%0.75SS**  trans-54.995.7161.3-80.2-147.8-173.900108.3P117 T121P117-M119 PolarHBondContact O-N 3.09Å; M119-T121 PolarHBondContact O-N 2.73Å; M119-T121 PolarHBondContact O-OG1 2.83Å
120E35.4Very low34.1Very low162 Ų162122 Ų12276%0.75776%0.756SS**  trans-73.287.2167.8-75.6-168.1162.900107.7A118 I122A118-E120 VanDerWaalsContact C-N 3.26Å; A118-E120 PolarHBondContact O-N 3.39Å; E120-I122 PolarHBondContact O-N 3.27Å; E120-I122 VanDerWaalsContact O-N 3.09Å
121T31.7Very low33.6Very low117 Ų117125.8 Ų125.872%0.71876%0.761SS**  trans-49.2110.3165.7-55.70000106.9M119 S123M119-T121 PolarHBondContact O-N 2.73Å; M119-T121 PolarHBondContact O-OG1 2.83Å; T121-S123 PolarHBondContact O-N 2.83Å
122I36.5Very low33.7Very low152 Ų152128 Ų12878%0.77976%0.764SS**  trans-60.597.1168.4-58.2169.1000105.3E120 L124E120-I122 PolarHBondContact O-N 3.27Å; E120-I122 VanDerWaalsContact O-N 3.09Å; I122-L124 VanDerWaalsContact C-N 3.28Å; I122-L124 HydrophobicContact CG2-CD1 4.38Å; I122-L124 PolarHBondContact O-N 2.94Å
123S28.2Very low33.9Very low105 Ų105131.9 Ų131.973%0.73477%0.765SS**  trans-66.196.1170.4-177.50000106T121 A125T121-S123 PolarHBondContact O-N 2.83Å; S123-A125 VanDerWaalsContact C-N 3.34Å; S123-A125 PolarHBondContact O-N 2.66Å
124L33.2Very low33.7Very low145 Ų145131.7 Ų131.776%0.75977%0.765SS**  trans-55109.8156.3-107.471.4000104.8I122 D126I122-L124 VanDerWaalsContact C-N 3.28Å; I122-L124 HydrophobicContact CG2-CD1 4.38Å; I122-L124 PolarHBondContact O-N 2.94Å; L124-D126 VanDerWaalsContact C-N 3.31Å; L124-D126 PolarHBondContact O-N 2.89Å
125A35.2Very low34.1Very low82 Ų82129 Ų12968%0.67877%0.765SS**  trans-54.9104.2170.300000107.2S123 T127S123-A125 VanDerWaalsContact C-N 3.34Å; S123-A125 PolarHBondContact O-N 2.66Å; A125-T127 PolarHBondContact O-N 3.47Å
126D30.2Very low34.4Very low135 Ų135130.1 Ų130.172%0.72276%0.76SS**  trans-54.388.6164.3-88.2-43.3000107.3L124 N128L124-D126 VanDerWaalsContact C-N 3.31Å; L124-D126 PolarHBondContact O-N 2.89Å; D126-N128 HydrophobicContact CB-CB 4.45Å; D126-N128 PolarHBondContact O-N 3.06Å; D126-N128 PolarHBondContact OD1-ND2 2.77Å
127T38.6Very low35Very low131 Ų131130.2 Ų130.280%0.80476%0.755SS**  trans-81.553.1153.954.20000108A125 S129A125-T127 PolarHBondContact O-N 3.47Å; T127-S129 PolarHBondContact O-N 2.81Å
128N31.6Very low34.9Very low125 Ų125125.9 Ų125.967%0.66874%0.735SS**  trans-66.868.9151.8-85.8-37.9000107.2D126 A130D126-N128 HydrophobicContact CB-CB 4.45Å; D126-N128 PolarHBondContact O-N 3.06Å; D126-N128 PolarHBondContact OD1-ND2 2.77Å; N128-A130 PolarHBondContact O-N 2.7Å
129S35.1Very low35.4Very low107 Ų107126.1 Ų126.175%0.74874%0.737SS**  trans-67.882.5153.8168.20000105.6T127 R131T127-S129 PolarHBondContact O-N 2.81Å; S129-R131 PolarHBondContact O-N 3.48Å
130A32.3Very low36.1Very low89 Ų89125.8 Ų125.874%0.73673%0.73SS**  trans-5582.316900000108.9N128 P132N128-A130 PolarHBondContact O-N 2.7Å; A130-P132 WeakPolarHBondContact O-CD 3.47Å
131R29.5Very low36.7Very low221 Ų221125.4 Ų125.483%0.83472%0.723SS**  trans-75.3115.5157.9-137.9177.3-164.5-133.92.8104.3S129 F133S129-R131 PolarHBondContact O-N 3.48Å; R131-F133 PolarHBondContact O-N 3.35Å
132P34Very low37.2Very low112 Ų112128.9 Ų128.973%0.72772%0.723SS**  trans-54.8123.3-177.620.5-29.8000107.4A130 N134A130-P132 WeakPolarHBondContact O-CD 3.47Å; P132-N134 PolarHBondContact O-N 3.28Å
133F36.4Very low37.7Very low202 Ų202125.6 Ų125.689%0.88671%0.713SS**  trans-53.595.8164.4-81.6-89.2000106R131 P135R131-F133 PolarHBondContact O-N 3.35Å; F133-P135 WeakPolarHBondContact O-CD 3.21Å
134N31.1Very low38.9Very low131 Ų131123.8 Ų123.870%0.70170%0.701SS**  trans-73.9104168-173.81.7000105P132 C136P132-N134 PolarHBondContact O-N 3.28Å; N134-C136 PolarHBondContact O-N 2.93Å; N134-C136 WeakPolarHBondContact OD1-CB 3.43Å
135P43.1Very low39.7Very low125 Ų125124.7 Ų124.781%0.81269%0.694SS**  trans-83.667-178.332.9-21.2000107F133F133-P135 WeakPolarHBondContact O-CD 3.21Å
136C36.1Very low40.3Very low102 Ų102127.8 Ų127.869%0.68969%0.693SS**  trans-148.241.8-177.4-139.80000113.5N134N134-C136 PolarHBondContact O-N 2.93Å; N134-C136 WeakPolarHBondContact OD1-CB 3.43Å
137S46.1Very low41.3Very low98 Ų98124.8 Ų124.869%0.68569%0.687SS**SBendtrans-132.3-6.8159.3-63.50000113.5A139 K140 Y141S137-A139 PolarHBondContact O-N 2.92Å; S137-K140 PolarHBondContact O-N 2.97Å; S137-Y141 PolarHBondContact O-N 2.96Å
138G41Very low41.5Very low43 Ų43124.9 Ų124.944%0.44368%0.682SS.*Hα-helixtrans-63.4-42.1179.500000113K140 Y141 W142G138-K140 PolarHBondContact O-N 2.9Å; G138-K140 VanDerWaalsContact O-N 3.14Å; G138-Y141 PolarHBondContact O-N 3.28Å; G138-W142 VanDerWaalsContact O-CD1 3.27Å; G138-W142 PolarHBondContact O-N 3.06Å
139A45.4Very low41.9Very low86 Ų86121.8 Ų121.871%0.71167%0.667SS**Hα-helixtrans-62-27.6-177.500000113.5S137 S143S137-A139 PolarHBondContact O-N 2.92Å; A139-S143 PolarHBondContact O-N 2.81Å
140K47.6Very low42.2Very low172 Ų172120.8 Ų120.875%0.74866%0.658SS**Hα-helixtrans-82.9-26.4175.5-71.8-175.4178-178.90113.4S137 G138 W142 S143 S144S137-K140 PolarHBondContact O-N 2.97Å; G138-K140 PolarHBondContact O-N 2.9Å; G138-K140 VanDerWaalsContact O-N 3.14Å; K140-W142 VanDerWaalsContact C-N 3.34Å; K140-S143 PolarHBondContact O-N 3Å; K140-S144 PolarHBondContact O-N 2.83Å
141Y48.2Very low42.6Very low154 Ų154121.9 Ų121.960%0.60466%0.661SS**Hα-helixtrans-70.5-32.6178.3-156.5-96.2000112.1S137 G138S137-Y141 PolarHBondContact O-N 2.96Å; G138-Y141 PolarHBondContact O-N 3.28Å
142W41.2Very low43.3Very low190 Ų190116.1 Ų116.172%0.7265%0.651SS**Hα-helixtrans-73.3-41.4172.1-67.673.7000111.3G138 K140 S144 F146G138-W142 VanDerWaalsContact O-CD1 3.27Å; G138-W142 PolarHBondContact O-N 3.06Å; K140-W142 VanDerWaalsContact C-N 3.34Å; W142-S144 PolarHBondContact O-N 3.09Å; W142-F146 WeakPolarHBondContact O-CD2 3.39Å
143S48.3Very low43.8Very low82 Ų82116.2 Ų116.257%0.57365%0.654SS**Hα-helixtrans-64.4-37.7176.7-780000113.5A139 K140 F146 A147A139-S143 PolarHBondContact O-N 2.81Å; K140-S143 PolarHBondContact O-N 3Å; S143-F146 PolarHBondContact O-N 3.48Å; S143-A147 WeakPolarHBondContact O-CB 3.19Å; S143-A147 PolarHBondContact O-N 2.79Å
144S52.5Low44.4Very low67 Ų67111 Ų11147%0.46964%0.638SS.*Hα-helixtrans-72.5-31.2-177.1-145.50000113.1K140 W142 F146 A147 D148K140-S144 PolarHBondContact O-N 2.83Å; W142-S144 PolarHBondContact O-N 3.09Å; S144-F146 PolarHBondContact O-N 3.41Å; S144-A147 PolarHBondContact O-N 3.29Å; S144-D148 PolarHBondContact O-N 3.06Å
145R49.9Very low45.5Very low165 Ų165107.5 Ų107.562%0.62362%0.62SS**Hα-helixtrans-69.1-18.6174.1-72.7-127.6-99.5-155.4-4.2113.4
146F48.8Very low46.1Very low147 Ų147106.7 Ų106.765%0.64561%0.608SS**Hα-helixtrans-99.7-15.6171.1-64.4-68.7000114W142 S143 S144 V149W142-F146 WeakPolarHBondContact O-CD2 3.39Å; S143-F146 PolarHBondContact O-N 3.48Å; S144-F146 PolarHBondContact O-N 3.41Å; F146-V149 HydrophobicContact CB-CG2 4.3Å; F146-V149 HydrophobicContact CD1-CG2 3.91Å; F146-V149 WeakPolarHBondContact O-CB 3.47Å; F146-V149 WeakPolarHBondContact O-CG2 3.48Å; F146-V149 PolarHBondContact O-N 3.03Å
147A50.4Low47.4Very low72 Ų72107.7 Ų107.760%0.59561%0.611SS**Hα-helixtrans-70.8-36.2176.600000111.8S143 S144 V149S143-A147 WeakPolarHBondContact O-CB 3.19Å; S143-A147 PolarHBondContact O-N 2.79Å; S144-A147 PolarHBondContact O-N 3.29Å; A147-V149 VanDerWaalsContact C-N 3.3Å
148D42.5Very low48.4Very low132 Ų132109.8 Ų109.871%0.70661%0.608SS**THydrogen-bonded Turntrans-9726.6172.9-57.6-42.1000111.7S144 P150S144-D148 PolarHBondContact O-N 3.06Å; D148-P150 WeakPolarHBondContact O-CD 3.42Å
149V39.6Very low49.6Very low60 Ų60108.8 Ų108.836%0.36459%0.594SS.*  trans-58.7111.1157.2164.20000104.1F146 A147 S151F146-V149 HydrophobicContact CB-CG2 4.3Å; F146-V149 HydrophobicContact CD1-CG2 3.91Å; F146-V149 WeakPolarHBondContact O-CB 3.47Å; F146-V149 WeakPolarHBondContact O-CG2 3.48Å; F146-V149 PolarHBondContact O-N 3.03Å; A147-V149 VanDerWaalsContact C-N 3.3Å; V149-S151 PolarHBondContact O-N 3.45Å
150P41.6Very low51.2Low86 Ų86110.5 Ų110.556%0.55860%0.601SS**  trans-53.1124.2164.3-9.724.9000102.5D148 T152D148-P150 WeakPolarHBondContact O-CD 3.42Å; P150-T152 HydrophobicContact CB-CG2 4.16Å; P150-T152 PolarHBondContact O-N 3.36Å
151S42.1Very low53Low112 Ų112104.6 Ų104.678%0.78358%0.581SS**  trans-60.477.4163.9-65.60000105.2V149 S153V149-S151 PolarHBondContact O-N 3.45Å; S151-S153 PolarHBondContact O-N 3.39Å
152T43.3Very low55Low101 Ų101104 Ų10462%0.6259%0.588SS**  trans-62.199165.649.80000100.6P150 T154P150-T152 HydrophobicContact CB-CG2 4.16Å; P150-T152 PolarHBondContact O-N 3.36Å; T152-T154 PolarHBondContact O-N 2.85Å
153S43.7Very low57.4Low114 Ų11499.6 Ų99.680%0.79758%0.581SS**  trans-71.634.9-168.758.50000110.9S151 D155S151-S153 PolarHBondContact O-N 3.39Å; S153-D155 PolarHBondContact O-N 3.35Å
154T50.2Low59.2Low91 Ų9198.9 Ų98.956%0.55857%0.571SS**  trans-8351.8165.126.40000109.5T152 L156 R168T152-T154 PolarHBondContact O-N 2.85Å; T154-L156 PolarHBondContact O-N 2.87Å; T154-R168 PolarHBondContact O-NH1 3.23Å
155D53.2Low61Low58 Ų5898.8 Ų98.831%0.3157%0.565SS.*  trans28.673.1145.7-147-0.4000113.7S153 T157 K158 R168S153-D155 PolarHBondContact O-N 3.35Å; D155-T157 PolarHBondContact O-N 3.45Å; D155-T157 WeakPolarHBondContact OD1-CB 3.35Å; D155-T157 PolarHBondContact OD1-OG1 3.26Å; D155-K158 HydrophobicContact CB-CD 4.1Å; D155-K158 HydrophobicContact CB-CG 4.09Å; D155-K158 WeakPolarHBondContact O-CB 3.39Å; D155-K158 PolarHBondContact O-N 3.38Å; D155-K158 VanDerWaalsContact OD2-CE 3.25Å; D155-K158 WeakPolarHBondContact OD2-CE 3.32Å; D155-K158 IonicContact OD2-NZ 3.26Å; D155-K158 PolarHBondContact OD2-NZ 3.36Å; D155-R168 PolarHBondContact O-NH1 3.12Å; D155-R168 VanDerWaalsContact O-NH1 3.14Å
156L56.5Low62.8Low109 Ų10993.2 Ų93.257%0.57155%0.554SS**G310 helixtrans-57.1-18.6173.4-69.8154.1000110.7T154 K158 C159 L165T154-L156 PolarHBondContact O-N 2.87Å; L156-K158 PolarHBondContact O-N 2.92Å; L156-C159 PolarHBondContact O-N 3.12Å; L156-L165 HydrophobicContact CB-CD1 4.11Å; L156-L165 HydrophobicContact CD2-CD1 3.36Å; L156-L165 HydrophobicContact CG-CD1 4.31Å
157T62.7Low64.6Low122 Ų12289.2 Ų89.275%0.74854%0.542SS*.G310 helixtrans-67.9-14.1173.882.20000113.7D155D155-T157 PolarHBondContact O-N 3.45Å; D155-T157 WeakPolarHBondContact OD1-CB 3.35Å; D155-T157 PolarHBondContact OD1-OG1 3.26Å
158K67.1Low66.2Low143 Ų14389.7 Ų89.762%0.62253%0.528SS*.G310 helixtrans-89.3-1.8176.1-71.1-175.6172.2114.20114.5D155 L156 S160D155-K158 HydrophobicContact CB-CD 4.1Å; D155-K158 HydrophobicContact CB-CG 4.09Å; D155-K158 WeakPolarHBondContact O-CB 3.39Å; D155-K158 PolarHBondContact O-N 3.38Å; D155-K158 VanDerWaalsContact OD2-CE 3.25Å; D155-K158 WeakPolarHBondContact OD2-CE 3.32Å; D155-K158 IonicContact OD2-NZ 3.26Å; D155-K158 PolarHBondContact OD2-NZ 3.36Å; L156-K158 PolarHBondContact O-N 2.92Å; K158-S160 PolarHBondContact O-N 2.83Å; K158-S160 VanDerWaalsContact O-N 3.14Å
159C67.1Low68.1Low22 Ų2285.8 Ų85.815%0.14952%0.515CS..  trans-76.7100.8173.7-63.70000108.6L156 S161 D164 L165L156-C159 PolarHBondContact O-N 3.12Å; C159-S161 PolarHBondContact O-N 3.46Å; C159-D164 HydrophobicContact CB-CB 4.07Å; C159-L165 HydrophobicContact CB-CB 3.89Å; C159-L165 HydrophobicContact CB-CD1 4.39Å
160S79.3Confident70.2Confident122 Ų12288.2 Ų88.285%0.85352%0.524SS*.SBendtrans-72.7-10.7175.6520000112.7K158K158-S160 PolarHBondContact O-N 2.83Å; K158-S160 VanDerWaalsContact O-N 3.14Å
161S85.3Confident72Confident48 Ų4888.8 Ų88.834%0.33652%0.519SS..SBendtrans-129.7143.5177.6176.80000111.7C159 V163 D164 L165C159-S161 PolarHBondContact O-N 3.46Å; S161-V163 PolarHBondContact O-N 2.82Å; S161-V163 PolarHBondContact OG-N 2.89Å; S161-D164 WeakPolarHBondContact CB-OD2 3.45Å; S161-D164 WeakPolarHBondContact O-CB 3.17Å; S161-D164 PolarHBondContact O-N 2.93Å; S161-L165 PolarHBondContact O-N 3.27Å; S161-L165 VanDerWaalsContact O-N 3.08Å
162L89.5Confident73.7Confident142 Ų14284.9 Ų84.974%0.74350%0.497SS*.Hα-helixtrans-58.3-32.4171.7-175.668.2000111.6L165 A166L162-L165 HydrophobicContact CD1-CD2 4.47Å; L162-L165 PolarHBondContact O-N 3.46Å; L162-A166 WeakPolarHBondContact O-CB 3.08Å; L162-A166 PolarHBondContact O-N 3.35Å
163V91.1Very high74.9Confident96 Ų9684.8 Ų84.858%0.58250%0.496SS*.Hα-helixtrans-65.2-41.1175.7-179.80000110.5S161 L165 A166 T167S161-V163 PolarHBondContact O-N 2.82Å; S161-V163 PolarHBondContact OG-N 2.89Å; V163-L165 VanDerWaalsContact C-N 3.34Å; V163-A166 PolarHBondContact O-N 3.45Å; V163-T167 WeakPolarHBondContact O-CB 3.36Å; V163-T167 PolarHBondContact O-N 2.93Å; V163-T167 PolarHBondContact O-OG1 3.5Å
164D87.2Confident76Confident68 Ų6882.8 Ų82.836%0.36448%0.479SS..Hα-helixtrans-68.3-37.5178.3-60.7-22.6000111.2C159 S161 R168C159-D164 HydrophobicContact CB-CB 4.07Å; S161-D164 WeakPolarHBondContact CB-OD2 3.45Å; S161-D164 WeakPolarHBondContact O-CB 3.17Å; S161-D164 PolarHBondContact O-N 2.93Å; D164-R168 VanDerWaalsContact O-CB 3.23Å; D164-R168 WeakPolarHBondContact O-CB 3.3Å; D164-R168 PolarHBondContact O-N 3.04Å
165L89.4Confident76.5Confident65 Ų6584.9 Ų84.934%0.3448%0.483SS..Hα-helixtrans-63-47.6173.8-176.164.6000111.3L156 C159 S161 L162 V163 R168 A169L156-L165 HydrophobicContact CB-CD1 4.11Å; L156-L165 HydrophobicContact CD2-CD1 3.36Å; L156-L165 HydrophobicContact CG-CD1 4.31Å; C159-L165 HydrophobicContact CB-CB 3.89Å; C159-L165 HydrophobicContact CB-CD1 4.39Å; S161-L165 PolarHBondContact O-N 3.27Å; S161-L165 VanDerWaalsContact O-N 3.08Å; L162-L165 HydrophobicContact CD1-CD2 4.47Å; L162-L165 PolarHBondContact O-N 3.46Å; V163-L165 VanDerWaalsContact C-N 3.34Å; L165-R168 PolarHBondContact O-N 3.18Å; L165-A169 VanDerWaalsContact O-CB 3.27Å; L165-A169 WeakPolarHBondContact O-CB 3.11Å; L165-A169 PolarHBondContact O-N 3.32Å
166A87.7Confident76.7Confident48 Ų4886.9 Ų86.940%0.39749%0.491SS..Hα-helixtrans-63.7-42.8177.500000111.5L162 V163 A169 I170L162-A166 WeakPolarHBondContact O-CB 3.08Å; L162-A166 PolarHBondContact O-N 3.35Å; V163-A166 PolarHBondContact O-N 3.45Å; A166-A169 PolarHBondContact O-N 3.34Å; A166-I170 WeakPolarHBondContact O-CD1 3.38Å; A166-I170 WeakPolarHBondContact O-CG1 3.39Å; A166-I170 PolarHBondContact O-N 3.43Å
167T87.4Confident76.8Confident62 Ų6284.7 Ų84.738%0.3849%0.489SS..Hα-helixtrans-62.3-48.1177.8-55.20000110.4V163 A169 I170 E171V163-T167 WeakPolarHBondContact O-CB 3.36Å; V163-T167 PolarHBondContact O-N 2.93Å; V163-T167 PolarHBondContact O-OG1 3.5Å; T167-A169 VanDerWaalsContact C-N 3.32Å; T167-A169 PolarHBondContact O-N 3.18Å; T167-I170 PolarHBondContact O-N 3.42Å; T167-E171 WeakPolarHBondContact O-CB 3.22Å; T167-E171 WeakPolarHBondContact O-CG 3.41Å; T167-E171 PolarHBondContact O-N 3.25Å
168R82.8Confident76.6Confident82 Ų8283.3 Ų83.331%0.30948%0.48SS..Hα-helixtrans-67.5-32.3179.3-156.4179.9-67171.34.7112.4T154 D155 D164 L165 G172T154-R168 PolarHBondContact O-NH1 3.23Å; D155-R168 PolarHBondContact O-NH1 3.12Å; D155-R168 VanDerWaalsContact O-NH1 3.14Å; D164-R168 VanDerWaalsContact O-CB 3.23Å; D164-R168 WeakPolarHBondContact O-CB 3.3Å; D164-R168 PolarHBondContact O-N 3.04Å; L165-R168 PolarHBondContact O-N 3.18Å; R168-G172 PolarHBondContact O-N 3.39Å
169A83.7Confident76Confident51 Ų5181.7 Ų81.742%0.42149%0.487SS..Hα-helixtrans-66.8-43.1172.200000111.6L165 A166 T167 G172 V173L165-A169 VanDerWaalsContact O-CB 3.27Å; L165-A169 WeakPolarHBondContact O-CB 3.11Å; L165-A169 PolarHBondContact O-N 3.32Å; A166-A169 PolarHBondContact O-N 3.34Å; T167-A169 VanDerWaalsContact C-N 3.32Å; T167-A169 PolarHBondContact O-N 3.18Å; A169-G172 PolarHBondContact O-N 3.33Å; A169-V173 VanDerWaalsContact O-CG2 3.32Å; A169-V173 WeakPolarHBondContact O-CG2 3.4Å; A169-V173 PolarHBondContact O-N 3.37Å
170I82.7Confident75.3Confident110 Ų11085.6 Ų85.656%0.56450%0.503SS*.Hα-helixtrans-65.3-42.3175-66.5163.2000110.5A166 T167 V173 T174A166-I170 WeakPolarHBondContact O-CD1 3.38Å; A166-I170 WeakPolarHBondContact O-CG1 3.39Å; A166-I170 PolarHBondContact O-N 3.43Å; T167-I170 PolarHBondContact O-N 3.42Å; I170-V173 PolarHBondContact O-N 3.38Å; I170-T174 WeakPolarHBondContact O-CB 3.43Å; I170-T174 PolarHBondContact O-N 3.38Å; I170-T174 PolarHBondContact O-OG1 2.88Å
171E80.6Confident74Confident98 Ų9887.7 Ų87.746%0.45850%0.499SS..Hα-helixtrans-62.3-41.6174.6-77.5175.717300112T167 T174 Q175T167-E171 WeakPolarHBondContact O-CB 3.22Å; T167-E171 WeakPolarHBondContact O-CG 3.41Å; T167-E171 PolarHBondContact O-N 3.25Å; E171-T174 WeakPolarHBondContact CA-OG1 3.5Å; E171-T174 PolarHBondContact O-N 3.27Å; E171-T174 PolarHBondContact O-OG1 3.36Å; E171-T174 VanDerWaalsContact O-OG1 3.04Å; E171-Q175 WeakPolarHBondContact O-CB 3.49Å; E171-Q175 VanDerWaalsContact O-CG 3.3Å; E171-Q175 WeakPolarHBondContact O-CG 3.43Å; E171-Q175 PolarHBondContact O-N 3.17Å
172G76.3Confident72.7Confident30 Ų3088.2 Ų88.231%0.30951%0.512SS..Hα-helixtrans-62.4-44.9174.500000112.1R168 A169 Q175 M176R168-G172 PolarHBondContact O-N 3.39Å; A169-G172 PolarHBondContact O-N 3.33Å; G172-Q175 PolarHBondContact O-N 2.98Å; G172-M176 WeakPolarHBondContact O-CG 3.01Å; G172-M176 PolarHBondContact O-N 3.45Å
173V70.1Confident71.2Confident100 Ų10082.7 Ų82.761%0.60649%0.485SS*.Hα-helixtrans-66.1-40.2176.6172.50000111.4A169 I170 M176 A177A169-V173 VanDerWaalsContact O-CG2 3.32Å; A169-V173 WeakPolarHBondContact O-CG2 3.4Å; A169-V173 PolarHBondContact O-N 3.37Å; I170-V173 PolarHBondContact O-N 3.38Å; V173-M176 PolarHBondContact O-N 3.32Å; V173-A177 WeakPolarHBondContact O-CB 3.42Å; V173-A177 PolarHBondContact O-N 3.43Å
174T65.4Low70.2Confident72 Ų7282.4 Ų82.444%0.44249%0.485SS..Hα-helixtrans-69.6-37.5176.741.20000112I170 E171 M176 A177 V178I170-T174 WeakPolarHBondContact O-CB 3.43Å; I170-T174 PolarHBondContact O-N 3.38Å; I170-T174 PolarHBondContact O-OG1 2.88Å; E171-T174 WeakPolarHBondContact CA-OG1 3.5Å; E171-T174 PolarHBondContact O-N 3.27Å; E171-T174 PolarHBondContact O-OG1 3.36Å; E171-T174 VanDerWaalsContact O-OG1 3.04Å; T174-M176 VanDerWaalsContact C-N 3.35Å; T174-A177 PolarHBondContact O-N 3.39Å; T174-V178 WeakPolarHBondContact O-CB 3.44Å; T174-V178 WeakPolarHBondContact O-CG2 3.39Å; T174-V178 PolarHBondContact O-N 3.12Å
175Q61.4Low69.6Low135 Ų13584.9 Ų84.963%0.63150%0.495SS*.Hα-helixtrans-62.7-41.6171.4-77.2-179.323.800111.6E171 G172 A177 V178 S179E171-Q175 WeakPolarHBondContact O-CB 3.49Å; E171-Q175 VanDerWaalsContact O-CG 3.3Å; E171-Q175 WeakPolarHBondContact O-CG 3.43Å; E171-Q175 PolarHBondContact O-N 3.17Å; G172-Q175 PolarHBondContact O-N 2.98Å; Q175-A177 PolarHBondContact O-N 3.38Å; Q175-V178 PolarHBondContact O-N 2.94Å; Q175-S179 WeakPolarHBondContact O-CB 3.3Å; Q175-S179 PolarHBondContact O-N 3.18Å; Q175-S179 PolarHBondContact O-OG 3.22Å
176M57.6Low69.1Low99 Ų9986.6 Ų86.649%0.48850%0.504SS..Hα-helixtrans-64.6-39.4174.1-72.3-173.770.400112.2G172 V173 T174 Q180G172-M176 WeakPolarHBondContact O-CG 3.01Å; G172-M176 PolarHBondContact O-N 3.45Å; V173-M176 PolarHBondContact O-N 3.32Å; T174-M176 VanDerWaalsContact C-N 3.35Å; M176-Q180 WeakPolarHBondContact O-CB 3.28Å; M176-Q180 WeakPolarHBondContact O-CG 3.49Å; M176-Q180 PolarHBondContact O-N 2.97Å
177A58.5Low68.9Low64 Ų6488.7 Ų88.753%0.52951%0.512SS..Hα-helixtrans-67-37.4175.900000112.3V173 T174 Q175 Q180 Q181V173-A177 WeakPolarHBondContact O-CB 3.42Å; V173-A177 PolarHBondContact O-N 3.43Å; T174-A177 PolarHBondContact O-N 3.39Å; Q175-A177 PolarHBondContact O-N 3.38Å; A177-Q180 PolarHBondContact O-N 2.92Å; A177-Q181 PolarHBondContact O-N 2.88Å
178V58Low68.7Low93 Ų9388.9 Ų88.956%0.56452%0.516SS*.Hα-helixtrans-74.4-36.6176.9172.80000111.4T174 Q175 Q180 Q181T174-V178 WeakPolarHBondContact O-CB 3.44Å; T174-V178 WeakPolarHBondContact O-CG2 3.39Å; T174-V178 PolarHBondContact O-N 3.12Å; Q175-V178 PolarHBondContact O-N 2.94Å; V178-Q180 VanDerWaalsContact C-N 3.29Å; V178-Q180 PolarHBondContact O-N 2.86Å; V178-Q181 WeakPolarHBondContact O-CB 3.34Å; V178-Q181 PolarHBondContact O-N 3.5Å; V178-Q181 VanDerWaalsContact O-N 3.09Å
179S54.6Low69Low108 Ų10892.1 Ų92.176%0.75553%0.529SS*.Hα-helixtrans-70.4-25.3172.9-71.30000112.9Q175 Q181Q175-S179 WeakPolarHBondContact O-CB 3.3Å; Q175-S179 PolarHBondContact O-N 3.18Å; Q175-S179 PolarHBondContact O-OG 3.22Å; S179-Q181 PolarHBondContact O-N 3.04Å
180Q53.2Low69.4Low105 Ų10594.3 Ų94.349%0.49153%0.533SS..G310 helixtrans-824.9169.4-71.8-16522.900114.1M176 A177 V178 G182 S183M176-Q180 WeakPolarHBondContact O-CB 3.28Å; M176-Q180 WeakPolarHBondContact O-CG 3.49Å; M176-Q180 PolarHBondContact O-N 2.97Å; A177-Q180 PolarHBondContact O-N 2.92Å; V178-Q180 VanDerWaalsContact C-N 3.29Å; V178-Q180 PolarHBondContact O-N 2.86Å; Q180-G182 PolarHBondContact O-N 2.97Å; Q180-S183 PolarHBondContact O-N 3.13Å
181Q52.4Low69.9Low166 Ų16694.2 Ų94.278%0.77653%0.534SS*.G310 helixtrans-61-5.6177-159.5-172.5-0.100113.4A177 V178 S179A177-Q181 PolarHBondContact O-N 2.88Å; V178-Q181 WeakPolarHBondContact O-CB 3.34Å; V178-Q181 PolarHBondContact O-N 3.5Å; V178-Q181 VanDerWaalsContact O-N 3.09Å; S179-Q181 PolarHBondContact O-N 3.04Å
182G56.2Low70.5Confident58 Ų5894.3 Ų94.360%0.59854%0.541SS*.G310 helixtrans-120.727.2170.400000115.2Q180 P184Q180-G182 PolarHBondContact O-N 2.97Å; G182-P184 WeakPolarHBondContact O-CD 3.49Å; G182-P184 VanDerWaalsContact O-N 3.08Å
183S58.1Low71.4Confident26 Ų2695.1 Ų95.118%0.18254%0.538CS..  trans-52.9119.1-179.6-153.20000109.9Q180 E185 L186 T187Q180-S183 PolarHBondContact O-N 3.13Å; S183-E185 PolarHBondContact O-N 3.28Å; S183-E185 PolarHBondContact OG-OE2 3.2Å; S183-L186 WeakPolarHBondContact O-CB 3.34Å; S183-L186 PolarHBondContact O-N 3.44Å; S183-T187 PolarHBondContact O-N 3.48Å
184P70.1Confident72.6Confident91 Ų9194.8 Ų94.859%0.59153%0.529SS*.Hα-helixtrans-57.2-26.5-178.820.7-30.8000112.2G182 T187 S188G182-P184 WeakPolarHBondContact O-CD 3.49Å; G182-P184 VanDerWaalsContact O-N 3.08Å; P184-T187 PolarHBondContact O-N 3.42Å; P184-S188 PolarHBondContact O-N 3.42Å
185E75.7Confident74Confident119 Ų11993.1 Ų93.156%0.55652%0.523SS*.Hα-helixtrans-62.7-44.4173.1-64.375-16500112.2S183 T187 S188 Y189S183-E185 PolarHBondContact O-N 3.28Å; S183-E185 PolarHBondContact OG-OE2 3.2Å; E185-T187 VanDerWaalsContact C-N 3.32Å; E185-T187 PolarHBondContact O-N 2.85Å; E185-S188 PolarHBondContact O-N 3.36Å; E185-S188 PolarHBondContact O-OG 3.47Å; E185-Y189 PolarHBondContact O-N 3.41Å
186L77.8Confident75.7Confident101 Ų10189.5 Ų89.553%0.52951%0.513SS..Hα-helixtrans-64.1-39.5176-86.9154.5000110.9S183 Y189 N190S183-L186 WeakPolarHBondContact O-CB 3.34Å; S183-L186 PolarHBondContact O-N 3.44Å; L186-Y189 PolarHBondContact O-N 3.31Å; L186-N190 WeakPolarHBondContact O-CB 3.4Å; L186-N190 PolarHBondContact O-N 3.14Å; L186-N190 PolarHBondContact O-ND2 3.38Å
187T83.8Confident77.6Confident92 Ų9293 Ų9356%0.56452%0.521SS*.Hα-helixtrans-63-44.2175.2-54.40000111.2S183 P184 E185 Y189 N190 L191S183-T187 PolarHBondContact O-N 3.48Å; P184-T187 PolarHBondContact O-N 3.42Å; E185-T187 VanDerWaalsContact C-N 3.32Å; E185-T187 PolarHBondContact O-N 2.85Å; T187-Y189 PolarHBondContact O-N 2.96Å; T187-N190 PolarHBondContact O-N 2.89Å; T187-L191 PolarHBondContact O-N 3.34Å
188S83.8Confident79.4Confident67 Ų6796 Ų9647%0.46952%0.518SS..Hα-helixtrans-62.4-42.5177.377.60000112.2P184 E185 L191 V192P184-S188 PolarHBondContact O-N 3.42Å; E185-S188 PolarHBondContact O-N 3.36Å; E185-S188 PolarHBondContact O-OG 3.47Å; S188-L191 PolarHBondContact O-N 3.29Å; S188-V192 WeakPolarHBondContact O-CG2 3.48Å; S188-V192 PolarHBondContact O-N 2.93Å
189Y89.6Confident81.3Confident149 Ų14996.6 Ų96.658%0.58451%0.513SS*.Hα-helixtrans-64-44.9177.4-178.9-103.9000111.4E185 L186 T187 L191 V192 L193E185-Y189 PolarHBondContact O-N 3.41Å; L186-Y189 PolarHBondContact O-N 3.31Å; T187-Y189 PolarHBondContact O-N 2.96Å; Y189-L191 VanDerWaalsContact C-N 3.3Å; Y189-L191 PolarHBondContact O-N 3.26Å; Y189-V192 PolarHBondContact O-N 2.93Å; Y189-L193 HydrophobicContact CD1-CD1 4Å; Y189-L193 HydrophobicContact CE1-CD1 3.22Å; Y189-L193 HydrophobicContact CE2-CD1 4.27Å; Y189-L193 WeakPolarHBondContact O-CB 3.45Å; Y189-L193 PolarHBondContact O-N 2.95Å; Y189-L193 WeakPolarHBondContact OH-CD1 3.49Å
190N91Very high83.4Confident97 Ų9795.4 Ų95.452%0.51950%0.498SS..Hα-helixtrans-60.8-38.5176.4-81.8-67.8000112.3L186 T187 L193 Q194L186-N190 WeakPolarHBondContact O-CB 3.4Å; L186-N190 PolarHBondContact O-N 3.14Å; L186-N190 PolarHBondContact O-ND2 3.38Å; T187-N190 PolarHBondContact O-N 2.89Å; N190-L193 PolarHBondContact O-N 3.32Å; N190-Q194 VanDerWaalsContact O-CB 3.3Å; N190-Q194 WeakPolarHBondContact O-CB 3.3Å; N190-Q194 PolarHBondContact O-N 3.02Å
191L93.4Very high85.6Confident109 Ų10993.8 Ų93.857%0.57150%0.495SS*.Hα-helixtrans-63.6-46.6176.1-174.466.4000111.5T187 S188 Y189 L193 Q194 A195T187-L191 PolarHBondContact O-N 3.34Å; S188-L191 PolarHBondContact O-N 3.29Å; Y189-L191 VanDerWaalsContact C-N 3.3Å; Y189-L191 PolarHBondContact O-N 3.26Å; L191-L193 VanDerWaalsContact C-N 3.31Å; L191-L193 PolarHBondContact O-N 2.9Å; L191-Q194 PolarHBondContact O-N 3.29Å; L191-A195 WeakPolarHBondContact O-CB 3.48Å; L191-A195 PolarHBondContact O-N 3.07Å
192V93.4Very high87.7Confident99 Ų9988 Ų8860%0.647%0.469SS*.Hα-helixtrans-61.4-41.9175.8173.50000110.9S188 Y189 A195 S196S188-V192 WeakPolarHBondContact O-CG2 3.48Å; S188-V192 PolarHBondContact O-N 2.93Å; Y189-V192 PolarHBondContact O-N 2.93Å; V192-A195 PolarHBondContact O-N 3.01Å; V192-S196 WeakPolarHBondContact O-CB 3.43Å; V192-S196 PolarHBondContact O-N 3.26Å
193L95.4Very high89.8Confident48 Ų4889.4 Ų89.425%0.25146%0.462SS..Hα-helixtrans-67.7-39.6-179.7-142.4145.4000111.4Y189 N190 L191 S196 R197Y189-L193 HydrophobicContact CD1-CD1 4Å; Y189-L193 HydrophobicContact CE1-CD1 3.22Å; Y189-L193 HydrophobicContact CE2-CD1 4.27Å; Y189-L193 WeakPolarHBondContact O-CB 3.45Å; Y189-L193 PolarHBondContact O-N 2.95Å; Y189-L193 WeakPolarHBondContact OH-CD1 3.49Å; N190-L193 PolarHBondContact O-N 3.32Å; L191-L193 VanDerWaalsContact C-N 3.31Å; L191-L193 PolarHBondContact O-N 2.9Å; L193-S196 PolarHBondContact O-N 3.43Å; L193-R197 HydrophobicContact CD2-CG 4.43Å; L193-R197 VanDerWaalsContact CD2-NE 3.29Å; L193-R197 WeakPolarHBondContact O-CB 3.32Å; L193-R197 VanDerWaalsContact O-CG 3.28Å; L193-R197 WeakPolarHBondContact O-CG 3.49Å; L193-R197 PolarHBondContact O-N 3.24Å
194Q95.4Very high91.7Very high92 Ų9293 Ų9343%0.4348%0.476SS..Hα-helixtrans-65.5-43.4173.7-170-177.625.400111.7N190 L191 R197 R198N190-Q194 VanDerWaalsContact O-CB 3.3Å; N190-Q194 WeakPolarHBondContact O-CB 3.3Å; N190-Q194 PolarHBondContact O-N 3.02Å; L191-Q194 PolarHBondContact O-N 3.29Å; Q194-R197 PolarHBondContact O-N 3.39Å; Q194-R198 WeakPolarHBondContact O-CG 3.34Å; Q194-R198 PolarHBondContact O-N 3.03Å
195A94.4Very high93Very high37 Ų3794 Ų9431%0.30647%0.473SS..Hα-helixtrans-62.1-44.3175.100000111.4L191 V192 R197 R198 K199L191-A195 WeakPolarHBondContact O-CB 3.48Å; L191-A195 PolarHBondContact O-N 3.07Å; V192-A195 PolarHBondContact O-N 3.01Å; A195-R197 PolarHBondContact O-N 3.49Å; A195-R198 PolarHBondContact O-N 3.48Å; A195-K199 WeakPolarHBondContact O-CB 3.48Å; A195-K199 PolarHBondContact O-N 3.36Å
196S96.8Very high94.1Very high60 Ų6093 Ų9342%0.4246%0.464SS..Hα-helixtrans-60.3-43.7175.5-172.80000111.7V192 L193 R198 K199 I200V192-S196 WeakPolarHBondContact O-CB 3.43Å; V192-S196 PolarHBondContact O-N 3.26Å; L193-S196 PolarHBondContact O-N 3.43Å; S196-R198 PolarHBondContact O-N 3.1Å; S196-K199 PolarHBondContact O-N 3.49Å; S196-I200 VanDerWaalsContact O-CG1 3.3Å; S196-I200 WeakPolarHBondContact O-CG1 3.25Å; S196-I200 PolarHBondContact O-N 3.03Å
197R97.8Very high95.1Very high172 Ų17292.1 Ų92.165%0.64946%0.462SS*.Hα-helixtrans-60-46175.9-76.1174.3-177.5-174.24.2111.8L193 Q194 A195 K199 I200 V201L193-R197 HydrophobicContact CD2-CG 4.43Å; L193-R197 VanDerWaalsContact CD2-NE 3.29Å; L193-R197 WeakPolarHBondContact O-CB 3.32Å; L193-R197 VanDerWaalsContact O-CG 3.28Å; L193-R197 WeakPolarHBondContact O-CG 3.49Å; L193-R197 PolarHBondContact O-N 3.24Å; Q194-R197 PolarHBondContact O-N 3.39Å; A195-R197 PolarHBondContact O-N 3.49Å; R197-K199 VanDerWaalsContact C-N 3.33Å; R197-K199 PolarHBondContact O-N 3.45Å; R197-I200 PolarHBondContact O-N 3.14Å; R197-V201 WeakPolarHBondContact O-CG2 3.48Å; R197-V201 PolarHBondContact O-N 3.42Å
198R97.6Very high95.8Very high126 Ų12694.3 Ų94.348%0.47546%0.464SS..Hα-helixtrans-60.6-42.6175.7-70.1177.3-178.4131.9-2.7111.8Q194 A195 S196 V201 L202Q194-R198 WeakPolarHBondContact O-CG 3.34Å; Q194-R198 PolarHBondContact O-N 3.03Å; A195-R198 PolarHBondContact O-N 3.48Å; S196-R198 PolarHBondContact O-N 3.1Å; R198-V201 PolarHBondContact O-N 2.86Å; R198-L202 WeakPolarHBondContact O-CG 3.33Å; R198-L202 PolarHBondContact O-N 3.44Å; R198-L202 VanDerWaalsContact O-N 3.12Å
199K97.8Very high96.5Very high106 Ų10695.6 Ų95.646%0.46146%0.462SS..Hα-helixtrans-62.6-41.8178.1-175.2176.2-178.7176.60112A195 S196 R197 L202 L203A195-K199 WeakPolarHBondContact O-CB 3.48Å; A195-K199 PolarHBondContact O-N 3.36Å; S196-K199 PolarHBondContact O-N 3.49Å; R197-K199 VanDerWaalsContact C-N 3.33Å; R197-K199 PolarHBondContact O-N 3.45Å; K199-L202 PolarHBondContact O-N 3Å; K199-L203 HydrophobicContact CG-CD1 4.06Å; K199-L203 HydrophobicContact CG-CG 4.46Å; K199-L203 WeakPolarHBondContact O-CB 3.45Å; K199-L203 VanDerWaalsContact O-CG 3.32Å; K199-L203 WeakPolarHBondContact O-CG 3.45Å; K199-L203 PolarHBondContact O-N 3.14Å
200I98.2Very high96.9Very high84 Ų8492.1 Ų92.143%0.43145%0.454SS..Hα-helixtrans-58.9-49.3176.4-70.7163.3000110.2S196 R197 L202 L203 E204S196-I200 VanDerWaalsContact O-CG1 3.3Å; S196-I200 WeakPolarHBondContact O-CG1 3.25Å; S196-I200 PolarHBondContact O-N 3.03Å; R197-I200 PolarHBondContact O-N 3.14Å; I200-L202 PolarHBondContact O-N 3.48Å; I200-L203 PolarHBondContact O-N 3.11Å; I200-E204 HydrophobicContact CG2-CG 4.33Å; I200-E204 WeakPolarHBondContact CG2-OE1 3.26Å; I200-E204 WeakPolarHBondContact O-CG 3.48Å; I200-E204 PolarHBondContact O-N 3.38Å
201V98.2Very high97.3Very high70 Ų7092.6 Ų92.642%0.42446%0.455SS..Hα-helixtrans-58.1-45.4178.9174.90000111.9R197 R198 L203 E204 E205R197-V201 WeakPolarHBondContact O-CG2 3.48Å; R197-V201 PolarHBondContact O-N 3.42Å; R198-V201 PolarHBondContact O-N 2.86Å; V201-L203 VanDerWaalsContact C-N 3.35Å; V201-L203 PolarHBondContact O-N 2.94Å; V201-E204 WeakPolarHBondContact O-CB 3.31Å; V201-E204 PolarHBondContact O-N 3.34Å; V201-E205 WeakPolarHBondContact O-CG 3.34Å; V201-E205 PolarHBondContact O-N 3.44Å
202L97.9Very high97.5Very high46 Ų4691.9 Ų91.924%0.24146%0.456CS..Hα-helixtrans-64.6-38.6178.3-70.7172.8000112.8Y46 L49 R198 K199 I200 E205 R206Y46-L202 HydrophobicContact CD1-CD1 4.22Å; Y46-L202 HydrophobicContact CE1-CD1 3.89Å; L49-L202 HydrophobicContact CD2-CB 4.37Å; L49-L202 HydrophobicContact CD2-CD1 4.26Å; R198-L202 WeakPolarHBondContact O-CG 3.33Å; R198-L202 PolarHBondContact O-N 3.44Å; R198-L202 VanDerWaalsContact O-N 3.12Å; K199-L202 PolarHBondContact O-N 3Å; I200-L202 PolarHBondContact O-N 3.48Å; L202-E205 PolarHBondContact O-N 2.9Å; L202-R206 WeakPolarHBondContact O-CB 3.13Å; L202-R206 PolarHBondContact O-N 2.67Å
203L98.6Very high97.7Very high86 Ų8689.6 Ų89.645%0.4544%0.439SS..Hα-helixtrans-67-40.8175.7-72.5173.1000111K199 I200 V201 R206 V207K199-L203 HydrophobicContact CG-CD1 4.06Å; K199-L203 HydrophobicContact CG-CG 4.46Å; K199-L203 WeakPolarHBondContact O-CB 3.45Å; K199-L203 VanDerWaalsContact O-CG 3.32Å; K199-L203 WeakPolarHBondContact O-CG 3.45Å; K199-L203 PolarHBondContact O-N 3.14Å; I200-L203 PolarHBondContact O-N 3.11Å; V201-L203 VanDerWaalsContact C-N 3.35Å; V201-L203 PolarHBondContact O-N 2.94Å; L203-R206 PolarHBondContact O-N 3.19Å; L203-V207 WeakPolarHBondContact O-CB 3.44Å; L203-V207 VanDerWaalsContact O-CG2 3.26Å; L203-V207 WeakPolarHBondContact O-CG2 3.42Å; L203-V207 PolarHBondContact O-N 3.14Å
204E98.2Very high97.8Very high103 Ų10390.9 Ų90.948%0.48145%0.446SS..Hα-helixtrans-61-43.6174.5-72.5174.6172.600111.8I200 V201 V207 K208I200-E204 HydrophobicContact CG2-CG 4.33Å; I200-E204 WeakPolarHBondContact CG2-OE1 3.26Å; I200-E204 WeakPolarHBondContact O-CG 3.48Å; I200-E204 PolarHBondContact O-N 3.38Å; V201-E204 WeakPolarHBondContact O-CB 3.31Å; V201-E204 PolarHBondContact O-N 3.34Å; E204-V207 PolarHBondContact O-N 3.28Å; E204-K208 WeakPolarHBondContact O-CG 3.34Å; E204-K208 PolarHBondContact O-N 3.33Å
205E98.3Very high98Very high110 Ų11089.7 Ų89.751%0.51445%0.447SS..Hα-helixtrans-62.3-44.4174.1-73.8176.5178.800112V201 L202 V207 K208 H209V201-E205 WeakPolarHBondContact O-CG 3.34Å; V201-E205 PolarHBondContact O-N 3.44Å; L202-E205 PolarHBondContact O-N 2.9Å; E205-V207 PolarHBondContact O-N 3.47Å; E205-K208 PolarHBondContact O-N 2.57Å; E205-H209 PolarHBondContact O-N 3.2Å
206R98.1Very high98.2Very high100 Ų10090 Ų9038%0.37745%0.453SS..Hα-helixtrans-64.1-40.4177.4-17857.5177.7156.36.4111.8L202 L203 H209 L210 E213L202-R206 WeakPolarHBondContact O-CB 3.13Å; L202-R206 PolarHBondContact O-N 2.67Å; L203-R206 PolarHBondContact O-N 3.19Å; R206-H209 PolarHBondContact NH1-CD2 3.47Å; R206-H209 PolarHBondContact O-N 3.02Å; R206-L210 HydrophobicContact CG-CD1 4.13Å; R206-L210 HydrophobicContact CG-CG 4.46Å; R206-L210 WeakPolarHBondContact O-CB 3.47Å; R206-L210 WeakPolarHBondContact O-CG 3.33Å; R206-L210 PolarHBondContact O-N 3.47Å; R206-E213 IonicContact NH1-OE2 2.7Å
207V98.7Very high98.2Very high81 Ų8193.5 Ų93.549%0.49146%0.463SS..Hα-helixtrans-62.4-46.6175.4168.30000110.4L203 E204 E205 H209 L210 L211L203-V207 WeakPolarHBondContact O-CB 3.44Å; L203-V207 VanDerWaalsContact O-CG2 3.26Å; L203-V207 WeakPolarHBondContact O-CG2 3.42Å; L203-V207 PolarHBondContact O-N 3.14Å; E204-V207 PolarHBondContact O-N 3.28Å; E205-V207 PolarHBondContact O-N 3.47Å; V207-H209 VanDerWaalsContact C-N 3.31Å; V207-H209 PolarHBondContact O-N 3.37Å; V207-L210 PolarHBondContact O-N 3.48Å; V207-L211 HydrophobicContact CG1-CD1 4.05Å; V207-L211 HydrophobicContact CG1-CG 4.44Å; V207-L211 VanDerWaalsContact O-CG 3.31Å; V207-L211 WeakPolarHBondContact O-CG 3.23Å; V207-L211 PolarHBondContact O-N 2.89Å
208K98.6Very high98.3Very high139 Ų13992.8 Ų92.860%0.60446%0.461SS*.Hα-helixtrans-56.5-45.9175-74.1171.3-176.6171.90111.6E204 E205 L211 T212E204-K208 WeakPolarHBondContact O-CG 3.34Å; E204-K208 PolarHBondContact O-N 3.33Å; E205-K208 PolarHBondContact O-N 2.57Å; K208-L211 PolarHBondContact O-N 3.37Å; K208-T212 PolarHBondContact O-N 2.89Å; K208-T212 VanDerWaalsContact O-N 3.11Å; K208-T212 PolarHBondContact O-OG1 3.39Å
209H98.5Very high98.3Very high93 Ų9391.4 Ų91.443%0.43146%0.46SS..Hα-helixtrans-62.7-46.2177.9-17887.2000112.6E205 R206 V207 L211 T212 E213E205-H209 PolarHBondContact O-N 3.2Å; R206-H209 PolarHBondContact NH1-CD2 3.47Å; R206-H209 PolarHBondContact O-N 3.02Å; V207-H209 VanDerWaalsContact C-N 3.31Å; V207-H209 PolarHBondContact O-N 3.37Å; H209-L211 VanDerWaalsContact C-N 3.28Å; H209-L211 PolarHBondContact O-N 3.48Å; H209-T212 WeakPolarHBondContact O-CB 3.25Å; H209-T212 PolarHBondContact O-N 3.18Å; H209-T212 VanDerWaalsContact O-N 3.14Å; H209-E213 IonicContact CD2-OE2 3.43Å; H209-E213 PolarHBondContact CD2-OE2 3.02Å; H209-E213 IonicContact NE2-OE1 3.89Å; H209-E213 PolarHBondContact NE2-OE1 2.94Å; H209-E213 IonicContact NE2-OE2 2.59Å; H209-E213 PolarHBondContact NE2-OE2 2.59Å; H209-E213 PolarHBondContact O-N 3.36Å
210L98.7Very high98.3Very high77 Ų7789 Ų8940%0.40346%0.456SS..Hα-helixtrans-61.6-36177.4-76.5171.9000112.3R206 V207 E213 L214R206-L210 HydrophobicContact CG-CD1 4.13Å; R206-L210 HydrophobicContact CG-CG 4.46Å; R206-L210 WeakPolarHBondContact O-CB 3.47Å; R206-L210 WeakPolarHBondContact O-CG 3.33Å; R206-L210 PolarHBondContact O-N 3.47Å; V207-L210 PolarHBondContact O-N 3.48Å; L210-E213 PolarHBondContact O-N 3.06Å; L210-L214 VanDerWaalsContact O-CB 3.23Å; L210-L214 WeakPolarHBondContact O-CB 3.45Å; L210-L214 PolarHBondContact O-N 3.43Å
211L98.6Very high98.4Very high106 Ų10690.5 Ų90.556%0.55546%0.46SS*.Hα-helixtrans-65-40.8174.4-71.8171.4000111.6V207 K208 H209 L214 S215V207-L211 HydrophobicContact CG1-CD1 4.05Å; V207-L211 HydrophobicContact CG1-CG 4.44Å; V207-L211 VanDerWaalsContact O-CG 3.31Å; V207-L211 WeakPolarHBondContact O-CG 3.23Å; V207-L211 PolarHBondContact O-N 2.89Å; K208-L211 PolarHBondContact O-N 3.37Å; H209-L211 VanDerWaalsContact C-N 3.28Å; H209-L211 PolarHBondContact O-N 3.48Å; L211-L214 PolarHBondContact O-N 3.09Å; L211-S215 WeakPolarHBondContact O-CB 3.44Å; L211-S215 PolarHBondContact O-N 2.87Å
212T98.2Very high98.4Very high94 Ų9494.7 Ų94.758%0.57747%0.468SS*.Hα-helixtrans-63-48.4173.2-56.30000111.3K208 H209 L214 S215 G216K208-T212 PolarHBondContact O-N 2.89Å; K208-T212 VanDerWaalsContact O-N 3.11Å; K208-T212 PolarHBondContact O-OG1 3.39Å; H209-T212 WeakPolarHBondContact O-CB 3.25Å; H209-T212 PolarHBondContact O-N 3.18Å; H209-T212 VanDerWaalsContact O-N 3.14Å; T212-L214 VanDerWaalsContact C-N 3.35Å; T212-L214 PolarHBondContact O-N 3.3Å; T212-S215 PolarHBondContact O-N 3.25Å; T212-S215 PolarHBondContact O-OG 3.33Å; T212-G216 PolarHBondContact O-N 3.2Å
213E97.8Very high98.4Very high52 Ų5298.4 Ų98.424%0.24348%0.483CS..Hα-helixtrans-58-46.7176.3-71.9-172.312200111.2R56 R206 H209 L210 S215 G216 E217R56-E213 IonicContact NE-OE1 2.89Å; R206-E213 IonicContact NH1-OE2 2.7Å; H209-E213 IonicContact CD2-OE2 3.43Å; H209-E213 PolarHBondContact CD2-OE2 3.02Å; H209-E213 IonicContact NE2-OE1 3.89Å; H209-E213 PolarHBondContact NE2-OE1 2.94Å; H209-E213 IonicContact NE2-OE2 2.59Å; H209-E213 PolarHBondContact NE2-OE2 2.59Å; H209-E213 PolarHBondContact O-N 3.36Å; L210-E213 PolarHBondContact O-N 3.06Å; E213-S215 VanDerWaalsContact C-N 3.29Å; E213-S215 PolarHBondContact O-N 3.27Å; E213-G216 PolarHBondContact O-N 3.05Å; E213-E217 PolarHBondContact O-N 3.34Å
214L98.2Very high98.4Very high75 Ų7598.5 Ų98.539%0.39348%0.484SS..Hα-helixtrans-61.2-37.9177.8-179.264000112.2L210 L211 T212 R218L210-L214 VanDerWaalsContact O-CB 3.23Å; L210-L214 WeakPolarHBondContact O-CB 3.45Å; L210-L214 PolarHBondContact O-N 3.43Å; L211-L214 PolarHBondContact O-N 3.09Å; T212-L214 VanDerWaalsContact C-N 3.35Å; T212-L214 PolarHBondContact O-N 3.3Å; L214-R218 WeakPolarHBondContact O-CB 3.42Å; L214-R218 VanDerWaalsContact O-CG 3.25Å; L214-R218 WeakPolarHBondContact O-CG 3.43Å; L214-R218 PolarHBondContact O-N 3.13Å
215S98.3Very high98.4Very high67 Ų6798.4 Ų98.447%0.46948%0.484SS..Hα-helixtrans-65.9-41.9175.974.60000112L211 T212 E213 R218 E219L211-S215 WeakPolarHBondContact O-CB 3.44Å; L211-S215 PolarHBondContact O-N 2.87Å; T212-S215 PolarHBondContact O-N 3.25Å; T212-S215 PolarHBondContact O-OG 3.33Å; E213-S215 VanDerWaalsContact C-N 3.29Å; E213-S215 PolarHBondContact O-N 3.27Å; S215-R218 PolarHBondContact O-N 3.2Å; S215-E219 PolarHBondContact O-N 2.97Å
216G98.4Very high98.4Very high42 Ų4296 Ų9643%0.43348%0.483SS..Hα-helixtrans-65.8-40.617600000112.5T212 E213 E219 S220T212-G216 PolarHBondContact O-N 3.2Å; E213-G216 PolarHBondContact O-N 3.05Å; G216-E219 WeakPolarHBondContact O-CB 3.46Å; G216-E219 PolarHBondContact O-N 3.42Å; G216-S220 PolarHBondContact O-N 3.46Å
217E98.1Very high98.5Very high134 Ų13495.7 Ų95.763%0.62649%0.485SS*.Hα-helixtrans-65.4-39.8176.5-164.866.7-150.200111.6E213 E219 S220 K221E213-E217 PolarHBondContact O-N 3.34Å; E217-E219 VanDerWaalsContact C-N 3.33Å; E217-E219 PolarHBondContact O-N 3.49Å; E217-S220 PolarHBondContact O-N 3.41Å; E217-K221 WeakPolarHBondContact O-CB 3.4Å; E217-K221 PolarHBondContact O-N 3.01Å
218R98.5Very high98.4Very high157 Ų15796.5 Ų96.559%0.59249%0.491SS*.Hα-helixtrans-63.3-38.9174.2-76.8171.8176.6164.6-1.3112.2L214 S215 K221 R222L214-R218 WeakPolarHBondContact O-CB 3.42Å; L214-R218 VanDerWaalsContact O-CG 3.25Å; L214-R218 WeakPolarHBondContact O-CG 3.43Å; L214-R218 PolarHBondContact O-N 3.13Å; S215-R218 PolarHBondContact O-N 3.2Å; R218-K221 PolarHBondContact O-N 3.45Å; R218-R222 WeakPolarHBondContact O-CG 3.43Å; R218-R222 PolarHBondContact O-N 3.49Å
219E98.5Very high98.4Very high98 Ų9893 Ų9346%0.45848%0.483SS..Hα-helixtrans-63.7-49.1174.5-173.658.1-151.800111.4S215 G216 E217 K221 R222 H223S215-E219 PolarHBondContact O-N 2.97Å; G216-E219 WeakPolarHBondContact O-CB 3.46Å; G216-E219 PolarHBondContact O-N 3.42Å; E217-E219 VanDerWaalsContact C-N 3.33Å; E217-E219 PolarHBondContact O-N 3.49Å; E219-K221 VanDerWaalsContact C-N 3.28Å; E219-K221 PolarHBondContact O-N 2.88Å; E219-R222 PolarHBondContact O-N 3.32Å; E219-R222 VanDerWaalsContact O-N 3.11Å; E219-R222 IonicContact OE2-CZ 3.47Å; E219-R222 VanDerWaalsContact OE2-CZ 3.26Å; E219-R222 IonicContact OE2-NE 3.52Å; E219-R222 PolarHBondContact OE2-NE 2.94Å; E219-R222 IonicContact OE2-NH2 3.37Å; E219-R222 PolarHBondContact OE2-NH2 3.44Å; E219-H223 PolarHBondContact O-N 3.32Å
220S98.4Very high98.4Very high55 Ų5594.3 Ų94.339%0.38549%0.489SS..Hα-helixtrans-58.9-40.9177.1-177.10000111.9G216 E217 H223 L224G216-S220 PolarHBondContact O-N 3.46Å; E217-S220 PolarHBondContact O-N 3.41Å; S220-H223 PolarHBondContact O-N 2.97Å; S220-L224 WeakPolarHBondContact O-CG 3.28Å; S220-L224 PolarHBondContact O-N 3.1Å
221K98.6Very high98.4Very high116 Ų11694.1 Ų94.150%0.50449%0.488SS..Hα-helixtrans-58.6-48.1174-173179.6-178-81.70111.6E217 R218 E219 H223 L224 E225E217-K221 WeakPolarHBondContact O-CB 3.4Å; E217-K221 PolarHBondContact O-N 3.01Å; R218-K221 PolarHBondContact O-N 3.45Å; E219-K221 VanDerWaalsContact C-N 3.28Å; E219-K221 PolarHBondContact O-N 2.88Å; K221-H223 VanDerWaalsContact C-N 3.32Å; K221-H223 PolarHBondContact O-N 3.11Å; K221-L224 PolarHBondContact O-N 3.31Å; K221-E225 WeakPolarHBondContact CE-OE1 3.44Å; K221-E225 HydrophobicContact CG-CG 4.48Å; K221-E225 IonicContact NZ-OE1 3.7Å; K221-E225 PolarHBondContact NZ-OE1 3.25Å; K221-E225 IonicContact NZ-OE2 3.77Å; K221-E225 WeakPolarHBondContact O-CB 3.43Å; K221-E225 VanDerWaalsContact O-CG 3.28Å; K221-E225 WeakPolarHBondContact O-CG 3.26Å; K221-E225 PolarHBondContact O-N 3.4Å
222R98.5Very high98.4Very high157 Ų15793 Ų9359%0.59248%0.483SS*.Hα-helixtrans-60.8-41.7178.1-73.7-166.6-67.1166.3-9.1112.1R218 E219 E225 A226R218-R222 WeakPolarHBondContact O-CG 3.43Å; R218-R222 PolarHBondContact O-N 3.49Å; E219-R222 PolarHBondContact O-N 3.32Å; E219-R222 VanDerWaalsContact O-N 3.11Å; E219-R222 IonicContact OE2-CZ 3.47Å; E219-R222 VanDerWaalsContact OE2-CZ 3.26Å; E219-R222 IonicContact OE2-NE 3.52Å; E219-R222 PolarHBondContact OE2-NE 2.94Å; E219-R222 IonicContact OE2-NH2 3.37Å; E219-R222 PolarHBondContact OE2-NH2 3.44Å; R222-E225 PolarHBondContact O-N 3.35Å; R222-A226 PolarHBondContact O-N 2.92Å
223H98.5Very high98.5Very high124 Ų12492.3 Ų92.357%0.57448%0.476SS*.Hα-helixtrans-62.8-47.4176.8-178.364.8000112E219 S220 K221 E225 A226 E227E219-H223 PolarHBondContact O-N 3.32Å; S220-H223 PolarHBondContact O-N 2.97Å; K221-H223 VanDerWaalsContact C-N 3.32Å; K221-H223 PolarHBondContact O-N 3.11Å; H223-E225 VanDerWaalsContact C-N 3.33Å; H223-E225 PolarHBondContact O-N 3.45Å; H223-A226 WeakPolarHBondContact O-CB 3.48Å; H223-A226 PolarHBondContact O-N 3.24Å; H223-E227 PolarHBondContact O-N 3.03Å
224L98.7Very high98.5Very high88 Ų8894.2 Ų94.246%0.46149%0.485SS..Hα-helixtrans-64-37.9177.3-71.6172.3000112.2S220 K221 A226 E227 V228S220-L224 WeakPolarHBondContact O-CG 3.28Å; S220-L224 PolarHBondContact O-N 3.1Å; K221-L224 PolarHBondContact O-N 3.31Å; L224-A226 VanDerWaalsContact C-N 3.33Å; L224-E227 PolarHBondContact O-N 3.42Å; L224-V228 WeakPolarHBondContact O-CB 3.24Å; L224-V228 VanDerWaalsContact O-CG2 3.26Å; L224-V228 WeakPolarHBondContact O-CG2 3.35Å; L224-V228 PolarHBondContact O-N 2.95Å
225E98.7Very high98.5Very high101 Ų10195.5 Ų95.547%0.47249%0.492SS..Hα-helixtrans-62.3-41174.3-76173.3157.900111.6K221 R222 H223 V228 S229K221-E225 WeakPolarHBondContact CE-OE1 3.44Å; K221-E225 HydrophobicContact CG-CG 4.48Å; K221-E225 IonicContact NZ-OE1 3.7Å; K221-E225 PolarHBondContact NZ-OE1 3.25Å; K221-E225 IonicContact NZ-OE2 3.77Å; K221-E225 WeakPolarHBondContact O-CB 3.43Å; K221-E225 VanDerWaalsContact O-CG 3.28Å; K221-E225 WeakPolarHBondContact O-CG 3.26Å; K221-E225 PolarHBondContact O-N 3.4Å; R222-E225 PolarHBondContact O-N 3.35Å; H223-E225 VanDerWaalsContact C-N 3.33Å; H223-E225 PolarHBondContact O-N 3.45Å; E225-V228 PolarHBondContact O-N 2.89Å; E225-S229 PolarHBondContact O-N 3.35Å
226A98.6Very high98.5Very high60 Ų6097.2 Ų97.250%0.49649%0.491SS..Hα-helixtrans-64.8-42.6174.800000112R222 H223 L224 S229 H230R222-A226 PolarHBondContact O-N 2.92Å; H223-A226 WeakPolarHBondContact O-CB 3.48Å; H223-A226 PolarHBondContact O-N 3.24Å; L224-A226 VanDerWaalsContact C-N 3.33Å; A226-S229 PolarHBondContact O-N 2.88Å; A226-H230 WeakPolarHBondContact O-CB 3.37Å; A226-H230 PolarHBondContact O-N 3.28Å
227E98.4Very high98.5Very high93 Ų9397.9 Ų97.944%0.43549%0.492SS..Hα-helixtrans-63.7-44.1176.1-173.3177.9-173.500111.8H223 L224 S229 H230 L231H223-E227 PolarHBondContact O-N 3.03Å; L224-E227 PolarHBondContact O-N 3.42Å; E227-S229 VanDerWaalsContact C-N 3.31Å; E227-S229 PolarHBondContact O-N 3.34Å; E227-H230 PolarHBondContact O-N 3.36Å; E227-L231 HydrophobicContact CG-CD1 4.06Å; E227-L231 HydrophobicContact CG-CG 4.44Å; E227-L231 WeakPolarHBondContact O-CB 3.48Å; E227-L231 WeakPolarHBondContact O-CG 3.45Å; E227-L231 PolarHBondContact O-N 3.31Å
228V98.5Very high98.6Very high99 Ų9995.5 Ų95.560%0.648%0.484SS*.Hα-helixtrans-60.7-42.1175.2168.60000111L224 E225 N232L224-V228 WeakPolarHBondContact O-CB 3.24Å; L224-V228 VanDerWaalsContact O-CG2 3.26Å; L224-V228 WeakPolarHBondContact O-CG2 3.35Å; L224-V228 PolarHBondContact O-N 2.95Å; E225-V228 PolarHBondContact O-N 2.89Å; V228-N232 VanDerWaalsContact O-CB 3.24Å; V228-N232 WeakPolarHBondContact O-CB 3.46Å; V228-N232 PolarHBondContact O-N 2.87Å
229S98.4Very high98.6Very high64 Ų6491.4 Ų91.445%0.44848%0.479SS..Hα-helixtrans-62.9-46.3175.9-165.50000111.5E225 A226 E227 N232 D233E225-S229 PolarHBondContact O-N 3.35Å; A226-S229 PolarHBondContact O-N 2.88Å; E227-S229 VanDerWaalsContact C-N 3.31Å; E227-S229 PolarHBondContact O-N 3.34Å; S229-N232 WeakPolarHBondContact O-CB 3.46Å; S229-N232 PolarHBondContact O-N 2.95Å; S229-D233 PolarHBondContact O-N 3.45Å
230H98.7Very high98.6Very high121 Ų12192 Ų9256%0.5649%0.485SS*.Hα-helixtrans-59.4-49.9178.2175.650.4000112.1A226 E227 N232 D233 E234A226-H230 WeakPolarHBondContact O-CB 3.37Å; A226-H230 PolarHBondContact O-N 3.28Å; E227-H230 PolarHBondContact O-N 3.36Å; H230-N232 VanDerWaalsContact C-N 3.28Å; H230-N232 PolarHBondContact O-N 3.27Å; H230-D233 PolarHBondContact O-N 3.37Å; H230-D233 VanDerWaalsContact O-N 3.17Å; H230-E234 PolarHBondContact O-N 2.93Å
231L98.8Very high98.6Very high73 Ų7395.6 Ų95.638%0.38250%0.496SS..Hα-helixtrans-63.5-33.8177.5-71.1173000112.3E227 N235E227-L231 HydrophobicContact CG-CD1 4.06Å; E227-L231 HydrophobicContact CG-CG 4.44Å; E227-L231 WeakPolarHBondContact O-CB 3.48Å; E227-L231 WeakPolarHBondContact O-CG 3.45Å; E227-L231 PolarHBondContact O-N 3.31Å; L231-N235 WeakPolarHBondContact O-CB 3.44Å; L231-N235 VanDerWaalsContact O-CG 3.32Å; L231-N235 PolarHBondContact O-N 2.85Å; L231-N235 PolarHBondContact O-ND2 3.17Å
232N98.6Very high98.6Very high82 Ų8296.2 Ų96.244%0.43950%0.504SS..Hα-helixtrans-66.1-40.5175.3-175.345000111.4V228 S229 H230 N235 K236V228-N232 VanDerWaalsContact O-CB 3.24Å; V228-N232 WeakPolarHBondContact O-CB 3.46Å; V228-N232 PolarHBondContact O-N 2.87Å; S229-N232 WeakPolarHBondContact O-CB 3.46Å; S229-N232 PolarHBondContact O-N 2.95Å; H230-N232 VanDerWaalsContact C-N 3.28Å; H230-N232 PolarHBondContact O-N 3.27Å; N232-N235 PolarHBondContact O-N 3.05Å; N232-K236 WeakPolarHBondContact ND2-CE 3.17Å; N232-K236 PolarHBondContact ND2-NZ 3.19Å; N232-K236 WeakPolarHBondContact O-CG 3.34Å; N232-K236 PolarHBondContact O-N 3.47Å
233D98.6Very high98.6Very high80 Ų8094.7 Ų94.743%0.42850%0.502SS..Hα-helixtrans-71.4-38.3177.7-66.6-26.1000112.1S229 H230 K236 A237S229-D233 PolarHBondContact O-N 3.45Å; H230-D233 PolarHBondContact O-N 3.37Å; H230-D233 VanDerWaalsContact O-N 3.17Å; D233-K236 PolarHBondContact O-N 3.37Å; D233-K236 IonicContact OD1-NZ 3.48Å; D233-K236 PolarHBondContact OD1-NZ 2.97Å; D233-A237 PolarHBondContact O-N 2.93Å
234E98.6Very high98.6Very high92 Ų9290.9 Ų90.943%0.4349%0.492SS..Hα-helixtrans-61.2-44.9171.4-172.8178.9-170.500111.5H230 K236 A237 L238H230-E234 PolarHBondContact O-N 2.93Å; E234-K236 VanDerWaalsContact C-N 3.31Å; E234-K236 PolarHBondContact O-N 2.93Å; E234-A237 WeakPolarHBondContact O-CB 3.35Å; E234-A237 PolarHBondContact O-N 3.47Å; E234-A237 VanDerWaalsContact O-N 3.13Å; E234-L238 HydrophobicContact CG-CD1 4.17Å; E234-L238 HydrophobicContact CG-CG 4.47Å; E234-L238 WeakPolarHBondContact O-CG 3.48Å; E234-L238 PolarHBondContact O-N 3.12Å
235N98.4Very high98.5Very high103 Ų10389.1 Ų89.155%0.55149%0.49SS*.Hα-helixtrans-60.7-38.9175.8-82.2-52.7000112.5L231 N232 S239L231-N235 WeakPolarHBondContact O-CB 3.44Å; L231-N235 VanDerWaalsContact O-CG 3.32Å; L231-N235 PolarHBondContact O-N 2.85Å; L231-N235 PolarHBondContact O-ND2 3.17Å; N232-N235 PolarHBondContact O-N 3.05Å; N235-S239 VanDerWaalsContact O-CB 3.3Å; N235-S239 WeakPolarHBondContact O-CB 3.3Å; N235-S239 PolarHBondContact O-N 3.4Å
236K98.6Very high98.5Very high102 Ų10290.5 Ų90.544%0.44350%0.495SS..Hα-helixtrans-64.4-43.5173.4-70.3171.7-159.31540111.3N232 D233 E234 S239 N240N232-K236 WeakPolarHBondContact ND2-CE 3.17Å; N232-K236 PolarHBondContact ND2-NZ 3.19Å; N232-K236 WeakPolarHBondContact O-CG 3.34Å; N232-K236 PolarHBondContact O-N 3.47Å; D233-K236 PolarHBondContact O-N 3.37Å; D233-K236 IonicContact OD1-NZ 3.48Å; D233-K236 PolarHBondContact OD1-NZ 2.97Å; E234-K236 VanDerWaalsContact C-N 3.31Å; E234-K236 PolarHBondContact O-N 2.93Å; K236-S239 PolarHBondContact O-N 2.91Å; K236-N240 VanDerWaalsContact O-CG 3.27Å; K236-N240 PolarHBondContact O-N 3.13Å; K236-N240 PolarHBondContact O-ND2 3.31Å
237A98.5Very high98.5Very high56 Ų5691.8 Ų91.846%0.46349%0.49SS..Hα-helixtrans-60.3-49.7177.800000111.3D233 E234 S239 N240 E241D233-A237 PolarHBondContact O-N 2.93Å; E234-A237 WeakPolarHBondContact O-CB 3.35Å; E234-A237 PolarHBondContact O-N 3.47Å; E234-A237 VanDerWaalsContact O-N 3.13Å; A237-S239 VanDerWaalsContact C-N 3.33Å; A237-S239 PolarHBondContact O-N 3.33Å; A237-N240 WeakPolarHBondContact O-CB 3.46Å; A237-N240 PolarHBondContact O-N 2.93Å; A237-N240 VanDerWaalsContact O-N 3.12Å; A237-E241 PolarHBondContact O-N 3.12Å
238L98.7Very high98.5Very high85 Ų8594 Ų9445%0.44550%0.5SS..Hα-helixtrans-61.4-38.7176-70.6173.3000112.3E234 N240 E241 L242E234-L238 HydrophobicContact CG-CD1 4.17Å; E234-L238 HydrophobicContact CG-CG 4.47Å; E234-L238 WeakPolarHBondContact O-CG 3.48Å; E234-L238 PolarHBondContact O-N 3.12Å; L238-N240 VanDerWaalsContact C-N 3.32Å; L238-N240 PolarHBondContact O-N 2.91Å; L238-E241 PolarHBondContact O-N 3.32Å; L238-L242 WeakPolarHBondContact O-CB 3.45Å; L238-L242 PolarHBondContact O-N 3.23Å
239S98.6Very high98.5Very high71 Ų7194.4 Ų94.450%0.49750%0.499SS..Hα-helixtrans-64.5-36.6175.2-1760000112.3N235 K236 A237 K243N235-S239 VanDerWaalsContact O-CB 3.3Å; N235-S239 WeakPolarHBondContact O-CB 3.3Å; N235-S239 PolarHBondContact O-N 3.4Å; K236-S239 PolarHBondContact O-N 2.91Å; A237-S239 VanDerWaalsContact C-N 3.33Å; A237-S239 PolarHBondContact O-N 3.33Å; S239-K243 WeakPolarHBondContact O-CB 3.42Å; S239-K243 PolarHBondContact O-N 2.86Å; S239-K243 VanDerWaalsContact O-N 3.12Å
240N98.6Very high98.5Very high109 Ų10996.6 Ų96.658%0.58350%0.502SS*.Hα-helixtrans-70.2-42.1176-70.2-25.3000111.2K236 A237 L238 K243 A244K236-N240 VanDerWaalsContact O-CG 3.27Å; K236-N240 PolarHBondContact O-N 3.13Å; K236-N240 PolarHBondContact O-ND2 3.31Å; A237-N240 WeakPolarHBondContact O-CB 3.46Å; A237-N240 PolarHBondContact O-N 2.93Å; A237-N240 VanDerWaalsContact O-N 3.12Å; L238-N240 VanDerWaalsContact C-N 3.32Å; L238-N240 PolarHBondContact O-N 2.91Å; N240-K243 WeakPolarHBondContact O-CB 3.46Å; N240-K243 PolarHBondContact O-N 3.22Å; N240-A244 PolarHBondContact O-N 2.86Å
241E98.4Very high98.5Very high132 Ų13296.8 Ų96.862%0.61750%0.503SS*.Hα-helixtrans-61.6-45.4175.2-173.5179.2174.500111.4A237 L238 K243 A244 A245A237-E241 PolarHBondContact O-N 3.12Å; L238-E241 PolarHBondContact O-N 3.32Å; E241-K243 VanDerWaalsContact C-N 3.27Å; E241-K243 PolarHBondContact O-N 3.33Å; E241-A244 PolarHBondContact O-N 3.39Å; E241-A245 WeakPolarHBondContact O-CB 3.46Å; E241-A245 PolarHBondContact O-N 3.2Å
242L98.3Very high98.4Very high128 Ų12898.9 Ų98.967%0.6751%0.509SS*.Hα-helixtrans-58.2-40.4174.7-178.768.1000111.8L238 K246L238-L242 WeakPolarHBondContact O-CB 3.45Å; L238-L242 PolarHBondContact O-N 3.23Å; L242-K246 WeakPolarHBondContact O-CB 3.43Å; L242-K246 PolarHBondContact O-N 3Å
243K98.6Very high98.4Very high125 Ų12597.8 Ų97.854%0.54351%0.505SS..Hα-helixtrans-66-46176.8-173.5-173.5174.9-161.50111.3S239 N240 E241 K246 E247S239-K243 WeakPolarHBondContact O-CB 3.42Å; S239-K243 PolarHBondContact O-N 2.86Å; S239-K243 VanDerWaalsContact O-N 3.12Å; N240-K243 WeakPolarHBondContact O-CB 3.46Å; N240-K243 PolarHBondContact O-N 3.22Å; E241-K243 VanDerWaalsContact C-N 3.27Å; E241-K243 PolarHBondContact O-N 3.33Å; K243-K246 WeakPolarHBondContact O-CB 3.38Å; K243-K246 PolarHBondContact O-N 3.03Å; K243-E247 WeakPolarHBondContact CE-OE1 3.32Å; K243-E247 IonicContact NZ-OE1 2.57Å; K243-E247 WeakPolarHBondContact O-CG 3.35Å; K243-E247 PolarHBondContact O-N 2.87Å
244A98.5Very high98.3Very high44 Ų44100 Ų10036%0.36451%0.513SS..Hα-helixtrans-60.9-47.3177.300000111.6N240 E241 K246 E247 E248N240-A244 PolarHBondContact O-N 2.86Å; E241-A244 PolarHBondContact O-N 3.39Å; A244-K246 VanDerWaalsContact C-N 3.26Å; A244-K246 PolarHBondContact O-N 3.15Å; A244-E247 PolarHBondContact O-N 3.09Å; A244-E247 VanDerWaalsContact O-N 3.09Å; A244-E248 PolarHBondContact O-N 2.93Å
245A98.4Very high98.1Very high52 Ų52102.4 Ų102.443%0.4352%0.518SS..Hα-helixtrans-59.9-37176.300000112.3E241 L249E241-A245 WeakPolarHBondContact O-CB 3.46Å; E241-A245 PolarHBondContact O-N 3.2Å; A245-L249 WeakPolarHBondContact O-CB 3.41Å; A245-L249 PolarHBondContact O-N 2.9Å
246K98.6Very high98Very high130 Ų130102.3 Ų102.357%0.56551%0.513SS*.Hα-helixtrans-65.6-42.2174.2-178.8-176.3175.3-175.70112.1L242 K243 A244 L249 Q250L242-K246 WeakPolarHBondContact O-CB 3.43Å; L242-K246 PolarHBondContact O-N 3Å; K243-K246 WeakPolarHBondContact O-CB 3.38Å; K243-K246 PolarHBondContact O-N 3.03Å; A244-K246 VanDerWaalsContact C-N 3.26Å; A244-K246 PolarHBondContact O-N 3.15Å; K246-L249 PolarHBondContact O-N 3.1Å; K246-Q250 WeakPolarHBondContact O-CG 3.43Å; K246-Q250 PolarHBondContact O-N 3.42Å
247E98.5Very high97.8Very high86 Ų86102 Ų10240%0.40251%0.513SS..Hα-helixtrans-64.7-44.2177.4-72170.8-177.500111.1K243 A244 L249 Q250 H251K243-E247 WeakPolarHBondContact CE-OE1 3.32Å; K243-E247 IonicContact NZ-OE1 2.57Å; K243-E247 WeakPolarHBondContact O-CG 3.35Å; K243-E247 PolarHBondContact O-N 2.87Å; A244-E247 PolarHBondContact O-N 3.09Å; A244-E247 VanDerWaalsContact O-N 3.09Å; E247-L249 VanDerWaalsContact C-N 3.34Å; E247-L249 PolarHBondContact O-N 2.99Å; E247-Q250 WeakPolarHBondContact O-CB 3.45Å; E247-Q250 PolarHBondContact O-N 3.41Å; E247-Q250 VanDerWaalsContact O-N 3.15Å; E247-H251 PolarHBondContact O-CD2 3.03Å; E247-H251 PolarHBondContact O-N 3.3Å
248E98.4Very high97.5Very high139 Ų139102.1 Ų102.165%0.6551%0.511SS*.Hα-helixtrans-58.3-44.3173.6-72.1-178.6-17300112.2A244 Q250 H251 F252A244-E248 PolarHBondContact O-N 2.93Å; E248-Q250 VanDerWaalsContact C-N 3.32Å; E248-Q250 PolarHBondContact O-N 2.87Å; E248-H251 PolarHBondContact O-N 3.49Å; E248-F252 WeakPolarHBondContact O-CB 3.3Å; E248-F252 PolarHBondContact O-N 3.28Å
249L98.6Very high97.2Very high108 Ų108100 Ų10057%0.56550%0.502SS*.Hα-helixtrans-62.8-38.9176.1-179.362.1000112A245 K246 E247 T253A245-L249 WeakPolarHBondContact O-CB 3.41Å; A245-L249 PolarHBondContact O-N 2.9Å; K246-L249 PolarHBondContact O-N 3.1Å; E247-L249 VanDerWaalsContact C-N 3.34Å; E247-L249 PolarHBondContact O-N 2.99Å; L249-T253 VanDerWaalsContact O-CB 3.3Å; L249-T253 WeakPolarHBondContact O-CB 3.26Å; L249-T253 PolarHBondContact O-N 2.72Å; L249-T253 PolarHBondContact O-OG1 3.48Å
250Q98.1Very high96.9Very high111 Ų111100.9 Ų100.952%0.51950%0.504SS..Hα-helixtrans-64.8-45.5175.6-75.6178.9-17.900111.4K246 E247 E248 T253 Q254K246-Q250 WeakPolarHBondContact O-CG 3.43Å; K246-Q250 PolarHBondContact O-N 3.42Å; E247-Q250 WeakPolarHBondContact O-CB 3.45Å; E247-Q250 PolarHBondContact O-N 3.41Å; E247-Q250 VanDerWaalsContact O-N 3.15Å; E248-Q250 VanDerWaalsContact C-N 3.32Å; E248-Q250 PolarHBondContact O-N 2.87Å; Q250-T253 PolarHBondContact O-N 3.37Å; Q250-Q254 WeakPolarHBondContact O-CB 3.4Å; Q250-Q254 PolarHBondContact O-N 3.3Å
251H97.9Very high96.3Very high124 Ų124102.2 Ų102.257%0.57451%0.506SS*.Hα-helixtrans-61.2-45175.6-73.1-54000112E247 E248 T253 Q254 W255E247-H251 PolarHBondContact O-CD2 3.03Å; E247-H251 PolarHBondContact O-N 3.3Å; E248-H251 PolarHBondContact O-N 3.49Å; H251-T253 VanDerWaalsContact C-N 3.34Å; H251-T253 PolarHBondContact O-N 2.88Å; H251-Q254 PolarHBondContact O-N 3.44Å; H251-W255 VanDerWaalsContact O-CB 3.26Å; H251-W255 WeakPolarHBondContact O-CB 3.42Å; H251-W255 PolarHBondContact O-N 3.16Å
252F97.8Very high95.7Very high118 Ų118100.7 Ų100.752%0.51850%0.502SS..Hα-helixtrans-59.5-45.9174.9175.5-99.6000111.6E248 Q254 W255 F256E248-F252 WeakPolarHBondContact O-CB 3.3Å; E248-F252 PolarHBondContact O-N 3.28Å; F252-Q254 PolarHBondContact O-N 2.85Å; F252-W255 HydrophobicContact CD2-CE3 4.1Å; F252-W255 HydrophobicContact CD2-CZ3 4.38Å; F252-W255 HydrophobicContact CE2-CE3 4.03Å; F252-W255 AromaticContact CE2-CZ3 3.87Å; F252-W255 HydrophobicContact CE2-CZ3 3.87Å; F252-W255 PolarHBondContact O-N 2.84Å; F252-F256 VanDerWaalsContact O-CB 3.28Å; F252-F256 WeakPolarHBondContact O-CB 3.47Å; F252-F256 PolarHBondContact O-N 2.96Å
253T97.4Very high94.5Very high58 Ų5898.4 Ų98.436%0.35650%0.495SS..Hα-helixtrans-63.1-44.7179.3-58.30000111L249 Q250 H251 F256 H257L249-T253 VanDerWaalsContact O-CB 3.3Å; L249-T253 WeakPolarHBondContact O-CB 3.26Å; L249-T253 PolarHBondContact O-N 2.72Å; L249-T253 PolarHBondContact O-OG1 3.48Å; Q250-T253 PolarHBondContact O-N 3.37Å; H251-T253 VanDerWaalsContact C-N 3.34Å; H251-T253 PolarHBondContact O-N 2.88Å; T253-F256 WeakPolarHBondContact O-CB 3.28Å; T253-F256 PolarHBondContact O-N 3.42Å; T253-H257 PolarHBondContact O-CD2 3.37Å; T253-H257 PolarHBondContact O-N 3.29Å
254Q96.3Very high93.3Very high127 Ų12798.3 Ų98.359%0.59350%0.498SS*.Hα-helixtrans-64.3-43.3177.2-176.4-179.41.600112.3Q250 H251 F252 F256 H257 S258Q250-Q254 WeakPolarHBondContact O-CB 3.4Å; Q250-Q254 PolarHBondContact O-N 3.3Å; H251-Q254 PolarHBondContact O-N 3.44Å; F252-Q254 PolarHBondContact O-N 2.85Å; Q254-F256 VanDerWaalsContact C-N 3.31Å; Q254-F256 PolarHBondContact O-N 2.91Å; Q254-H257 PolarHBondContact O-N 2.83Å; Q254-S258 WeakPolarHBondContact O-CB 3.42Å; Q254-S258 PolarHBondContact O-N 2.8Å; Q254-S258 PolarHBondContact O-OG 2.88Å
255W95.1Very high92Very high142 Ų14299.4 Ų99.454%0.53851%0.507SS..Hα-helixtrans-59.5-44.4174.2170.481.4000111H251 F252 S258 T259H251-W255 VanDerWaalsContact O-CB 3.26Å; H251-W255 WeakPolarHBondContact O-CB 3.42Å; H251-W255 PolarHBondContact O-N 3.16Å; F252-W255 HydrophobicContact CD2-CE3 4.1Å; F252-W255 HydrophobicContact CD2-CZ3 4.38Å; F252-W255 HydrophobicContact CE2-CE3 4.03Å; F252-W255 AromaticContact CE2-CZ3 3.87Å; F252-W255 HydrophobicContact CE2-CZ3 3.87Å; F252-W255 PolarHBondContact O-N 2.84Å; W255-S258 PolarHBondContact O-N 2.97Å; W255-T259 WeakPolarHBondContact O-CB 3.47Å; W255-T259 PolarHBondContact O-N 3.42Å; W255-T259 PolarHBondContact O-OG1 3.35Å
256F95.8Very high90.2Very high102 Ų102104.3 Ų104.345%0.44752%0.516SS..Hα-helixtrans-61.6-49.2177.6-177.2-94.3000111.4F252 T253 Q254 S258 T259 V260F252-F256 VanDerWaalsContact O-CB 3.28Å; F252-F256 WeakPolarHBondContact O-CB 3.47Å; F252-F256 PolarHBondContact O-N 2.96Å; T253-F256 WeakPolarHBondContact O-CB 3.28Å; T253-F256 PolarHBondContact O-N 3.42Å; Q254-F256 VanDerWaalsContact C-N 3.31Å; Q254-F256 PolarHBondContact O-N 2.91Å; F256-S258 PolarHBondContact O-N 3.13Å; F256-T259 PolarHBondContact O-N 3.5Å; F256-V260 HydrophobicContact CD1-CG2 4.15Å; F256-V260 HydrophobicContact CD2-CG2 4.42Å; F256-V260 HydrophobicContact CE1-CG2 3.78Å; F256-V260 HydrophobicContact CE2-CG2 4.08Å; F256-V260 HydrophobicContact CG-CG2 4.46Å; F256-V260 HydrophobicContact CZ-CG2 3.74Å; F256-V260 WeakPolarHBondContact O-CB 3.35Å; F256-V260 WeakPolarHBondContact O-CG2 3.46Å; F256-V260 PolarHBondContact O-N 3.31Å
257H94.3Very high88.6Confident95 Ų95104 Ų10444%0.4452%0.519SS..Hα-helixtrans-56.9-47175.5-84.7-74.5000112.2T253 Q254 T259 V260 E261T253-H257 PolarHBondContact O-CD2 3.37Å; T253-H257 PolarHBondContact O-N 3.29Å; Q254-H257 PolarHBondContact O-N 2.83Å; H257-T259 VanDerWaalsContact C-N 3.29Å; H257-T259 PolarHBondContact O-N 2.86Å; H257-V260 PolarHBondContact O-N 2.92Å; H257-E261 IonicContact ND1-OE1 3.65Å; H257-E261 VanDerWaalsContact O-CB 3.31Å; H257-E261 WeakPolarHBondContact O-CB 3.31Å; H257-E261 WeakPolarHBondContact O-CG 3.48Å; H257-E261 PolarHBondContact O-N 3.35Å
258S93.1Very high86.8Confident58 Ų58108 Ų10841%0.40654%0.538SS..Hα-helixtrans-61.7-39.5180-55.40000112.1Q254 W255 F256 N262Q254-S258 WeakPolarHBondContact O-CB 3.42Å; Q254-S258 PolarHBondContact O-N 2.8Å; Q254-S258 PolarHBondContact O-OG 2.88Å; W255-S258 PolarHBondContact O-N 2.97Å; F256-S258 PolarHBondContact O-N 3.13Å; S258-N262 PolarHBondContact O-N 3.24Å; S258-N262 VanDerWaalsContact O-N 3.13Å
259T92.1Very high84.8Confident42 Ų42109.2 Ų109.226%0.25854%0.544SS..Hα-helixtrans-71-40.1179.8-55.40000111.8W255 F256 H257W255-T259 WeakPolarHBondContact O-CB 3.47Å; W255-T259 PolarHBondContact O-N 3.42Å; W255-T259 PolarHBondContact O-OG1 3.35Å; F256-T259 PolarHBondContact O-N 3.5Å; H257-T259 VanDerWaalsContact C-N 3.29Å; H257-T259 PolarHBondContact O-N 2.86Å
260V91.2Very high82.8Confident89 Ų89109.3 Ų109.354%0.53955%0.551SS.*Hα-helixtrans-75.4-35.7-179.9172.80000112.2F256 H257F256-V260 HydrophobicContact CD1-CG2 4.15Å; F256-V260 HydrophobicContact CD2-CG2 4.42Å; F256-V260 HydrophobicContact CE1-CG2 3.78Å; F256-V260 HydrophobicContact CE2-CG2 4.08Å; F256-V260 HydrophobicContact CG-CG2 4.46Å; F256-V260 HydrophobicContact CZ-CG2 3.74Å; F256-V260 WeakPolarHBondContact O-CB 3.35Å; F256-V260 WeakPolarHBondContact O-CG2 3.46Å; F256-V260 PolarHBondContact O-N 3.31Å; H257-V260 PolarHBondContact O-N 2.92Å
261E87.7Confident81Confident137 Ų137109.8 Ų109.864%0.6456%0.561SS**Hα-helixtrans-81.3-26.5-178.9-69.9176.9-172.100113H257 P263H257-E261 IonicContact ND1-OE1 3.65Å; H257-E261 VanDerWaalsContact O-CB 3.31Å; H257-E261 WeakPolarHBondContact O-CB 3.31Å; H257-E261 WeakPolarHBondContact O-CG 3.48Å; H257-E261 PolarHBondContact O-N 3.35Å; E261-P263 VanDerWaalsContact C-CD 3.41Å; E261-P263 WeakPolarHBondContact O-CD 3.33Å
262N84.9Confident79.1Confident99 Ų99110.6 Ų110.653%0.52957%0.569SS.*  trans-12460.5177.3-74.6-60.4000112.7S258 M264 A265S258-N262 PolarHBondContact O-N 3.24Å; S258-N262 VanDerWaalsContact O-N 3.13Å; N262-M264 PolarHBondContact O-N 3.07Å; N262-M264 VanDerWaalsContact O-N 3.13Å; N262-A265 HydrophobicContact CB-CB 3.95Å; N262-A265 WeakPolarHBondContact O-CB 3.44Å; N262-A265 PolarHBondContact O-N 3.22Å
263P73.9Confident77.3Confident80 Ų80110.9 Ų110.952%0.51958%0.576SS.*G310 helixtrans-60.6-29.5-179.325.6-33.7000112.1E261E261-P263 VanDerWaalsContact C-CD 3.41Å; E261-P263 WeakPolarHBondContact O-CD 3.33Å
264M73Confident75.6Confident124 Ų124114.8 Ų114.861%0.61159%0.594SS**G310 helixtrans-77.5-16.8-179.8-63.2-58-60.300114.1N262 Y266 L267 Q268N262-M264 PolarHBondContact O-N 3.07Å; N262-M264 VanDerWaalsContact O-N 3.13Å; M264-Y266 PolarHBondContact O-N 3.13Å; M264-L267 HydrophobicContact CE-CB 4.17Å; M264-L267 HydrophobicContact CE-CD1 4.05Å; M264-L267 PolarHBondContact O-N 3.38Å; M264-L267 HydrophobicContact SD-CD1 3.68Å; M264-Q268 PolarHBondContact O-N 3.06Å
265A69.9Low73.4Confident66 Ų66116.8 Ų116.855%0.54560%0.603SS.*G310 helixtrans-64.2-24.1179.300000112.4N262N262-A265 HydrophobicContact CB-CB 3.95Å; N262-A265 WeakPolarHBondContact O-CB 3.44Å; N262-A265 PolarHBondContact O-N 3.22Å
266Y62.3Low71.6Confident156 Ų156122.7 Ų122.761%0.61264%0.637SS**G310 helixtrans-94-9.1175.8-63.3-78000113.8M264M264-Y266 PolarHBondContact O-N 3.13Å
267L65.3Low70.4Confident123 Ų123123.8 Ų123.864%0.64465%0.647SS**THydrogen-bonded Turntrans-95.2-12.4178.6-73.1174.5000113.5M264 E269M264-L267 HydrophobicContact CE-CB 4.17Å; M264-L267 HydrophobicContact CE-CD1 4.05Å; M264-L267 PolarHBondContact O-N 3.38Å; M264-L267 HydrophobicContact SD-CD1 3.68Å; L267-E269 PolarHBondContact O-N 2.93Å
268Q59.1Low69.1Low170 Ų170125.3 Ų125.379%0.79466%0.657SS**  trans-78.464164.7-81.2178.1-0.600109.7M264M264-Q268 PolarHBondContact O-N 3.06Å
269E56.7Low67.8Low165 Ų165129 Ų12977%0.77167%0.671SS**  trans-61.1123.1160-161.2165.3-152.400106.5L267 V271L267-E269 PolarHBondContact O-N 2.93Å; E269-V271 PolarHBondContact O-N 2.88Å
270P56.9Low66.4Low110 Ų110134.1 Ų134.171%0.71470%0.696SS**  trans-62.3107.9177.123.7-29.9000106.8L272P270-L272 VanDerWaalsContact C-N 3.27Å; P270-L272 PolarHBondContact O-N 2.78Å
271V60.7Low64.8Low120 Ų120136.9 Ų136.973%0.72771%0.706SS**  trans-53.2104.4163.7178.50000104.7E269 N273E269-V271 PolarHBondContact O-N 2.88Å; V271-N273 PolarHBondContact O-N 2.8Å
272L58.6Low63.3Low141 Ų141136.9 Ų136.974%0.73871%0.71SS**  trans-55.496168.6-78.5164.5000105.3P270 D274P270-L272 VanDerWaalsContact C-N 3.27Å; P270-L272 PolarHBondContact O-N 2.78Å; L272-D274 PolarHBondContact O-N 2.84Å
273N58.3Low61.8Low124 Ų124139.6 Ų139.666%0.66372%0.723SS**  trans-69.979163.2-77.5-23.1000105.7V271 H275V271-N273 PolarHBondContact O-N 2.8Å; N273-H275 PolarHBondContact O-N 3.48Å
274D62.6Low60.8Low140 Ų140144.2 Ų144.275%0.74974%0.738SS**  trans-65.983.7156.5-77.5-30.5000106.4L272 Q276L272-D274 PolarHBondContact O-N 2.84Å; D274-Q276 PolarHBondContact O-N 2.88Å
275H50.6Low59.8Low170 Ų170145.9 Ų145.979%0.78775%0.749SS**  trans-8593.3159.3-81.1-4.8000107.6N273N273-H275 PolarHBondContact O-N 3.48Å
276Q57Low58.9Low266 Ų266153.2 Ų153.2100%1.24377%0.768SS**  trans-121.30148.5-85.3-167.5-42.300108.1D274D274-Q276 PolarHBondContact O-N 2.88Å

Retrieved 276 of 276 residues in 543.1 ms (Link to these results)