A0A087XH74_POEFO Loading...

Podocalyxin

AlphaFold DB , UniProt , Accession A0A087XH74, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 435 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
1M49.7Very low58.5Low213 Ų213129.7 Ų129.7100%1.04967%0.667SS**  0-41.40-62.3-175.9-172.300114.5T4M1-T4 PolarHBondContact O-OG1 3.34Å
2R48.8Very low59.3Low238 Ų238127.8 Ų127.890%0.89866%0.657SS**Hα-helixtrans-66.3-37.4179.6-82.3-177.1169.7169.7-3.7114.9T4 L5R2-T4 PolarHBondContact O-N 3.06Å; R2-L5 PolarHBondContact O-N 3.06Å
3A48Very low59.6Low75 Ų75121.3 Ų121.362%0.6263%0.63SS**Hα-helixtrans-71.6-21.6-17600000115.4L5 T6A3-L5 VanDerWaalsContact C-N 3.33Å; A3-T6 PolarHBondContact O-OG1 3.15Å; A3-T6 VanDerWaalsContact O-OG1 3.09Å
4T52.8Low59.3Low100 Ų100119.4 Ų119.461%0.61362%0.621SS**Hα-helixtrans-74.4-26.7176.942.50000112.2M1 R2 T8M1-T4 PolarHBondContact O-OG1 3.34Å; R2-T4 PolarHBondContact O-N 3.06Å; T4-T8 PolarHBondContact O-N 2.94Å; T4-T8 PolarHBondContact O-OG1 3.46Å
5L55.2Low59.4Low127 Ų127116.1 Ų116.167%0.66561%0.612SS**Hα-helixtrans-81.3-25.1-173.9-156.7134.8000112.9R2 A3 T8 W9R2-L5 PolarHBondContact O-N 3.06Å; A3-L5 VanDerWaalsContact C-N 3.33Å; L5-T8 PolarHBondContact O-OG1 2.78Å; L5-W9 PolarHBondContact O-N 2.75Å
6T61.7Low59.3Low89 Ų89116.2 Ų116.255%0.54661%0.611SS.*Hα-helixtrans-74.8-38.4171.650.60000111.7A3 W9 L10A3-T6 PolarHBondContact O-OG1 3.15Å; A3-T6 VanDerWaalsContact O-OG1 3.09Å; T6-W9 PolarHBondContact O-N 2.69Å; T6-L10 WeakPolarHBondContact O-CB 3.47Å; T6-L10 PolarHBondContact O-N 2.86Å
7V64.2Low58.6Low84 Ų84114.7 Ų114.751%0.50961%0.612SS.*Hα-helixtrans-66.8-43.6179.4177.30000111.6W9 L10 L11V7-W9 PolarHBondContact O-N 3.44Å; V7-L10 PolarHBondContact O-N 3.45Å; V7-L11 HydrophobicContact CG1-CD1 4.08Å; V7-L11 WeakPolarHBondContact O-CG 3.32Å; V7-L11 PolarHBondContact O-N 3.43Å
8T66.9Low58Low89 Ų89113.3 Ų113.355%0.54661%0.612SS.*Hα-helixtrans-65.1-37.517648.40000112.5T4 L5 L12T4-T8 PolarHBondContact O-N 2.94Å; T4-T8 PolarHBondContact O-OG1 3.46Å; L5-T8 PolarHBondContact O-OG1 2.78Å; T8-L12 WeakPolarHBondContact O-CB 3.2Å; T8-L12 PolarHBondContact O-N 3.39Å
9W66.5Low57.3Low188 Ų188115.9 Ų115.971%0.71262%0.62SS**Hα-helixtrans-66.2-38.2175.8-163.465.6000112.4L5 T6 V7 L12 S13L5-W9 PolarHBondContact O-N 2.75Å; T6-W9 PolarHBondContact O-N 2.69Å; V7-W9 PolarHBondContact O-N 3.44Å; W9-L12 PolarHBondContact O-N 3.29Å; W9-S13 PolarHBondContact O-N 3Å; W9-S13 PolarHBondContact O-OG 3.29Å
10L64.6Low56.6Low110 Ų110115.3 Ų115.358%0.57663%0.625SS**Hα-helixtrans-67.8-43.2177.9-142.8144.4000111.4T6 V7 S13 L14T6-L10 WeakPolarHBondContact O-CB 3.47Å; T6-L10 PolarHBondContact O-N 2.86Å; V7-L10 PolarHBondContact O-N 3.45Å; L10-S13 WeakPolarHBondContact O-CB 3.46Å; L10-S13 PolarHBondContact O-N 3.4Å; L10-L14 HydrophobicContact CD2-CD1 3.85Å; L10-L14 WeakPolarHBondContact O-CD1 3.42Å; L10-L14 PolarHBondContact O-N 3.42Å; L10-L14 VanDerWaalsContact O-N 3.1Å
11L65.5Low56Low114 Ų114114.6 Ų114.660%0.59763%0.629SS**Hα-helixtrans-62.8-42.2173.5-70.9170000112.4V7 S13 L14 S15V7-L11 HydrophobicContact CG1-CD1 4.08Å; V7-L11 WeakPolarHBondContact O-CG 3.32Å; V7-L11 PolarHBondContact O-N 3.43Å; L11-S13 VanDerWaalsContact C-N 3.3Å; L11-S13 PolarHBondContact O-N 3.23Å; L11-L14 PolarHBondContact O-N 3.06Å; L11-S15 PolarHBondContact O-N 2.95Å
12L68.1Low55.6Low106 Ų106107.9 Ų107.956%0.55561%0.614SS**Hα-helixtrans-63.6-37.1176.1-162.871.2000111.7T8 W9 S15 I16T8-L12 WeakPolarHBondContact O-CB 3.2Å; T8-L12 PolarHBondContact O-N 3.39Å; W9-L12 PolarHBondContact O-N 3.29Å; L12-S15 WeakPolarHBondContact O-CB 3.29Å; L12-S15 PolarHBondContact O-N 3.09Å; L12-I16 HydrophobicContact CG-CD1 4.38Å; L12-I16 WeakPolarHBondContact O-CG1 3.35Å; L12-I16 PolarHBondContact O-N 3.41Å; L12-I16 VanDerWaalsContact O-N 3.1Å
13S62.8Low55Low44 Ų44103 Ų10331%0.30861%0.611SS.*Hα-helixtrans-63.3-44.7174.9-55.40000112.2W9 L10 L11 S15 I16 C17W9-S13 PolarHBondContact O-N 3Å; W9-S13 PolarHBondContact O-OG 3.29Å; L10-S13 WeakPolarHBondContact O-CB 3.46Å; L10-S13 PolarHBondContact O-N 3.4Å; L11-S13 VanDerWaalsContact C-N 3.3Å; L11-S13 PolarHBondContact O-N 3.23Å; S13-S15 VanDerWaalsContact C-N 3.31Å; S13-S15 PolarHBondContact O-N 3.42Å; S13-I16 PolarHBondContact O-N 3.31Å; S13-C17 PolarHBondContact O-N 3.42Å; S13-C17 VanDerWaalsContact O-N 3.09Å; S13-C17 PolarHBondContact O-SG 3.47Å
14L56Low54.4Low95 Ų95104.2 Ų104.250%0.49762%0.615SS.*Hα-helixtrans-64.7-34.6175.9-88.478.8000112.4L10 L11 C17 S18L10-L14 HydrophobicContact CD2-CD1 3.85Å; L10-L14 WeakPolarHBondContact O-CD1 3.42Å; L10-L14 PolarHBondContact O-N 3.42Å; L10-L14 VanDerWaalsContact O-N 3.1Å; L11-L14 PolarHBondContact O-N 3.06Å; L14-C17 PolarHBondContact O-N 2.82Å; L14-S18 PolarHBondContact O-N 3.16Å; L14-S18 PolarHBondContact O-OG 2.81Å
15S60.7Low53.7Low70 Ų70106.3 Ų106.349%0.4963%0.627SS.*Hα-helixtrans-61.9-47.2174.6-160.40000111.3L11 L12 S13 C17 S18L11-S15 PolarHBondContact O-N 2.95Å; L12-S15 WeakPolarHBondContact O-CB 3.29Å; L12-S15 PolarHBondContact O-N 3.09Å; S13-S15 VanDerWaalsContact C-N 3.31Å; S13-S15 PolarHBondContact O-N 3.42Å; S15-C17 VanDerWaalsContact C-N 3.31Å; S15-C17 PolarHBondContact O-N 3.19Å; S15-S18 WeakPolarHBondContact O-CB 3.44Å; S15-S18 PolarHBondContact O-N 3.15Å
16I57.9Low52.7Low117 Ų117106.1 Ų106.160%0.663%0.632SS**Hα-helixtrans-65-35.2-180-65.9163.2000111.5L12 S13 S18L12-I16 HydrophobicContact CG-CD1 4.38Å; L12-I16 WeakPolarHBondContact O-CG1 3.35Å; L12-I16 PolarHBondContact O-N 3.41Å; L12-I16 VanDerWaalsContact O-N 3.1Å; S13-I16 PolarHBondContact O-N 3.31Å; I16-S18 PolarHBondContact O-N 3.38Å
17C46.3Very low51.5Low91 Ų91111.5 Ų111.562%0.61565%0.647SS**Hα-helixtrans-68.7-18.3173.7-69.40000114.3S13 L14 S15S13-C17 PolarHBondContact O-N 3.42Å; S13-C17 VanDerWaalsContact O-N 3.09Å; S13-C17 PolarHBondContact O-SG 3.47Å; L14-C17 PolarHBondContact O-N 2.82Å; S15-C17 VanDerWaalsContact C-N 3.31Å; S15-C17 PolarHBondContact O-N 3.19Å
18S48.5Very low50.2Low89 Ų89113.3 Ų113.362%0.62266%0.661SS**Hα-helixtrans-83.4-30.3179.9-56.70000112.4L14 S15 I16 S20L14-S18 PolarHBondContact O-N 3.16Å; L14-S18 PolarHBondContact O-OG 2.81Å; S15-S18 WeakPolarHBondContact O-CB 3.44Å; S15-S18 PolarHBondContact O-N 3.15Å; I16-S18 PolarHBondContact O-N 3.38Å; S18-S20 PolarHBondContact O-N 3.49Å
19E45.5Very low48.5Very low164 Ų164116.4 Ų116.477%0.76667%0.674SS**Hα-helixtrans-71.9-25.6-175.8-147.894.7154.900113.5S21E19-S21 VanDerWaalsContact C-N 3.31Å; E19-S21 PolarHBondContact O-N 3.36Å
20S43.3Very low47Very low102 Ų102116.3 Ų116.371%0.71368%0.682SS**THydrogen-bonded Turntrans-81.22-166.172.80000116.1S18S18-S20 PolarHBondContact O-N 3.49Å
21S43Very low45.5Very low102 Ų102117.8 Ų117.871%0.71370%0.695SS**THydrogen-bonded Turntrans-93.7-2.6-177.9-63.90000114.6E19 V23E19-S21 VanDerWaalsContact C-N 3.31Å; E19-S21 PolarHBondContact O-N 3.36Å; S21-V23 VanDerWaalsContact C-N 3.33Å; S21-V23 PolarHBondContact O-N 2.86Å
22G41.2Very low44Very low71 Ų71115.7 Ų115.773%0.73270%0.701SS**  trans-80.159.3-177.600000115.2S24G22-S24 PolarHBondContact O-N 2.88Å
23V35.6Very low42.6Very low137 Ų137120.5 Ų120.583%0.8372%0.718SS**  trans-76.987.5175.969.80000111.5S21S21-V23 VanDerWaalsContact C-N 3.33Å; S21-V23 PolarHBondContact O-N 2.86Å
24S35.4Very low42.1Very low100 Ų100123.3 Ų123.370%0.69974%0.735SS**  trans-86.9115.6178.1-165.20000111.3G22 T26G22-S24 PolarHBondContact O-N 2.88Å; S24-T26 PolarHBondContact O-N 3.26Å; S24-T26 VanDerWaalsContact O-N 3.1Å
25T37.9Very low40.9Very low144 Ų144125.5 Ų125.588%0.88375%0.752SS**  trans-82.383.8-176.3-12.30000111.8
26T35.6Very low39.6Very low123 Ų123127.4 Ų127.476%0.75577%0.766SS**  trans-112.1133.6166.548.90000111.4S24S24-T26 PolarHBondContact O-N 3.26Å; S24-T26 VanDerWaalsContact O-N 3.1Å
27K35.1Very low38.4Very low201 Ų201126.2 Ų126.287%0.87477%0.773SS**  trans-80.7138.2-178.9-158.6179.4-175.6-171.90108.8
28P38.3Very low37.8Very low122 Ų122126.8 Ų126.879%0.79278%0.778SS**  trans-72.1143.7176.230.5-34.6000110.8
29D31.8Very low36.9Very low154 Ų154128.4 Ų128.482%0.82479%0.785SS**  trans-125.3157.1157.5-155.6-14.3000107.4
30E34.4Very low36.4Very low187 Ų187126.3 Ų126.387%0.87478%0.782SS**  trans-71.1151-168.3-70.2-169.987.300113.3
31T31.8Very low35.7Very low140 Ų140127.2 Ų127.286%0.85978%0.784SS**  trans-141.4118.2167.2-69.50000109.9
32G35.6Very low35.3Very low70 Ų70127.5 Ų127.572%0.72279%0.786SS**  trans-66.4162.4176.600000113.5
33K37.9Very low34.8Very low208 Ų208129 Ų12990%0.90479%0.791SS**  trans-67.4170.5-179.4-111.8-149.2164.2-179.50113.2
34P52.1Low34.6Very low102 Ų102128 Ų12866%0.66279%0.791SS**  trans-106.8179-141.641.9-39000114.9
35T32.1Very low34.5Very low142 Ų142130.3 Ų130.387%0.87179%0.793SS**  trans-146.3152.5154.1-71.20000109.9
36S33.4Very low34.3Very low110 Ų110131.3 Ų131.377%0.76979%0.792SS**  trans-97.1160.9-172.4-52.60000114.2
37A32.4Very low34.2Very low91 Ų91129.5 Ų129.575%0.75279%0.789SS**  trans79.8131.9141.900000121.7
38S32.6Very low34.6Very low103 Ų103126.3 Ų126.372%0.7279%0.789SS**  trans78.192.8135.2-62.20000123.4
39T31.2Very low34.1Very low124 Ų124123.8 Ų123.876%0.76179%0.785SS**  75.2147.8117.8-20.90000122.5
40V33Very low34.2Very low119 Ų119122.1 Ų122.172%0.72179%0.786SS**  trans74.8112156.3-1050000123.4
41T30.2Very low34Very low122 Ų122119.2 Ų119.275%0.74878%0.781SS**  trans72.7132.613634.30000124.9
42S33Very low34.1Very low107 Ų107121.1 Ų121.175%0.74878%0.777SS**  trans77.494.6134.4-60.90000121.5
43A32.6Very low33.9Very low103 Ų103122.5 Ų122.585%0.85178%0.776SS**  24.7127.1125.800000120.5
44S29.6Very low33.6Very low117 Ų117116.4 Ų116.482%0.81876%0.759SS**  -168.3156.3100.1-163.50000113.9
45I35.1Very low32.8Very low147 Ų147119 Ų11975%0.75476%0.763SS**  trans-57.7140.6173-50.6163.2000111.7
46I32.2Very low33Very low166 Ų166119.3 Ų119.385%0.85175%0.754SS**  178.3146.5129-93.3159000111.4
47A34.6Very low32.9Very low85 Ų85118.6 Ų118.670%0.70275%0.749SS**  trans-90.5-162176.500000110.1
48P43.8Very low33Very low134 Ų134123.3 Ų123.387%0.8775%0.753SS**  cis-135.4-150.9144-23.7000112.4
49G27.4Very low32.9Very low69 Ų69125.1 Ų125.171%0.71175%0.747SS**  trans134.471.4148.300000118.1
50S33.2Very low33.7Very low118 Ų118124.9 Ų124.983%0.82575%0.748SS**  trans-92.4111.4171.857.90000113.1
51T30.6Very low33.6Very low127 Ų127123.9 Ų123.978%0.77974%0.742SS**  trans-169.1150.1168.714.10000109.2
52K34.3Very low33.8Very low179 Ų179121.4 Ų121.478%0.77873%0.73SS**  cis-166.8156.90.1-156.4175-175.5177.70109.4
53S30.7Very low33.9Very low99 Ų99125.1 Ų125.169%0.69274%0.735SS**  trans67.3156.7148.3-94.70000119.1
54S32.7Very low33.9Very low80 Ų80125 Ų12556%0.55973%0.734SS**  cis-171.4171.1-9.3-123.40000113.3
55H34.8Very low34Very low158 Ų158124.2 Ų124.273%0.73174%0.735SS**  trans65.7141.7150.9-70.5-62.5000118.7
56E35Very low33.8Very low147 Ų147123.3 Ų123.369%0.68774%0.737SS**  cis-160.7145-10.4-179.2159.2131.500113.7
57S31.2Very low33.9Very low96 Ų96121.9 Ų121.967%0.67173%0.73SS**  trans20.7140.2145.8-141.80000120.6
58K35Very low33.7Very low190 Ų190125.4 Ų125.483%0.82673%0.731SS**  -158.6148.759.6-81.1174.2179.6169.70116.3
59K31.9Very low33Very low140 Ų140126.7 Ų126.761%0.60973%0.726SS**  trans-80.7164.7160.1-144.3-152.8176.8-159.40109.7T61 S62K59-T61 VanDerWaalsContact CE-N 3.31Å; K59-T61 PolarHBondContact NZ-OG1 3.48Å; K59-S62 PolarHBondContact NZ-OG 2.7Å
60P46.3Very low33.4Very low119 Ų119131.9 Ų131.977%0.77373%0.731SS**  -128141.170.20.824.6000114.1
61T31.9Very low34.4Very low98 Ų98131.6 Ų131.660%0.60173%0.727SS**  92.811083.5-67.20000111.3K59K59-T61 VanDerWaalsContact CE-N 3.31Å; K59-T61 PolarHBondContact NZ-OG1 3.48Å
62S34.4Very low34.5Very low70 Ų70131.5 Ų131.549%0.4973%0.726SS.*  73.514272.2-71.10000112.3K59K59-S62 PolarHBondContact NZ-OG 2.7Å
63E33.8Very low34.4Very low185 Ų185128.6 Ų128.686%0.86472%0.724SS**  cis-159-175.1-5.3-127.1154.9110.200112.3
64A33.7Very low34.5Very low100 Ų100130.1 Ų130.183%0.82673%0.729SS**  trans-84.6166-171.100000116.3
65A31.3Very low34.5Very low101 Ų101131.5 Ų131.584%0.83573%0.734SS**  trans-156.3164.3160.100000111.7
66T32.1Very low34.7Very low129 Ų129130.6 Ų130.679%0.79173%0.734SS**  trans-144.6175.4-167.2-49.90000110.9
67I33.8Very low34.6Very low136 Ų136130.5 Ų130.570%0.69774%0.739SS**  trans125.9143.4146.1-62.4-64.2000118.2
68Q29.6Very low35.2Very low158 Ų158133.3 Ų133.374%0.73875%0.745SS**  trans74.3129.9166.2-80.6158.130.700119
69Q29.6Very low36.2Very low162 Ų162129.4 Ų129.476%0.75774%0.739SS**  cis93.6121.948.1-73.7172.312.600112.3
70Q35.2Very low36.4Very low177 Ų177128.2 Ų128.283%0.82774%0.744SS**  74.313366.1-166.7171.117.600111.9
71P54.4Low35.9Very low113 Ų113128.6 Ų128.673%0.73474%0.744SS**  cis-121.8-150.54723.53.6000114
72T32.9Very low36Very low125 Ų125128.3 Ų128.377%0.76775%0.752SS**  cis-154.2-141.519-33.90000113.8
73T32.3Very low36Very low118 Ų118129.2 Ų129.272%0.72476%0.763SS**  trans-152.5159.1-152.8-38.80000113.7
74V33.2Very low36.1Very low131 Ų131124.5 Ų124.579%0.79476%0.756SS**  trans164.4114.1140.2152.20000108.5
75T32.7Very low36.1Very low109 Ų109126.4 Ų126.467%0.66975%0.752SS**  74.8128.166.3-50.20000111.3
76N37.8Very low36.2Very low139 Ų139127.1 Ų127.174%0.74375%0.746SS**  cis-162.8179.727.9-151.11.6000115.5
77N33.5Very low36.2Very low145 Ų145126.8 Ų126.878%0.77574%0.744SS**  trans110138.1149.5-63.3-13.3000122.2
78L43.7Very low36.2Very low155 Ų155126.6 Ų126.681%0.81275%0.749SS**  trans-113.9-178.6178.1-15437.9000106.5
79P56.8Low36.3Very low108 Ų108123.8 Ų123.870%0.70175%0.753SS**  cis-152.1154.926.241.8-18.2000122.8
80T35.3Very low36.4Very low114 Ų114125.2 Ų125.270%0.69976%0.76SS**  trans58.3137.5131.1-45.10000119.8
81V35.8Very low36.4Very low127 Ų127121.8 Ų121.877%0.7776%0.756SS**  -169.7130.781.8161.90000112.4
82A33.9Very low35.5Very low93 Ų93125.2 Ų125.277%0.76976%0.759SS**  trans48.4157.1148.500000123.9
83A35.3Very low35.5Very low89 Ų89125.2 Ų125.274%0.73676%0.759SS**  cis-175157.6-28.400000111.8
84A35.4Very low35.5Very low85 Ų85126.2 Ų126.270%0.70276%0.76SS**  trans60.3151.3149.100000120.8
85N33.4Very low35.5Very low140 Ų140125.3 Ų125.375%0.74976%0.755SS**  cis-155.9147.4-16.5-94.8-12.4000106.7
86T32.9Very low35.8Very low117 Ų117128 Ų12872%0.71876%0.759SS**  52.2133.282.8-3.30000113.7
87T33.7Very low35.5Very low121 Ų121127.3 Ų127.374%0.74276%0.755SS**  cis-162.6150.928.1-39.20000114.3
88T32.1Very low35.6Very low132 Ų132127.6 Ų127.681%0.8176%0.755SS**  trans-4.7140.8154.2-43.70000122.7
89A31.8Very low35Very low99 Ų99126.2 Ų126.282%0.81875%0.753SS**  trans-170155.5132.200000117
90Q33.1Very low34Very low193 Ų193127 Ų12790%0.90276%0.757SS**  trans-55.7-176.5173.2-65.8161-6.700116.3
91S33.8Very low34.8Very low105 Ų105127.5 Ų127.573%0.73476%0.762SS**  cis171.5166.5-31-169.80000108.8
92K35.9Very low34.7Very low185 Ų185126.2 Ų126.280%0.80477%0.765SS**  trans79.1109.3162.9-65.1-174177.7179.50123.4
93T32.4Very low34.7Very low124 Ų124128 Ų12876%0.76177%0.766SS**  61.4128.5117.2-18.80000125
94N32.8Very low34.7Very low140 Ų140129.3 Ų129.375%0.74977%0.765SS**  109.3118.3128.2-128.65.4000123.6
95T33.7Very low34.6Very low112 Ų112131 Ų13169%0.68777%0.772SS**  trans-21.2139.5147.5-20.40000120.1
96Q38.1Very low34.5Very low164 Ų164128.2 Ų128.277%0.76678%0.776SS**  163.9145.3110.2-95.5-165.1-2100118.4
97I33.1Very low34.7Very low126 Ų126127.6 Ų127.665%0.64678%0.782SS**  trans77.6125.1137.4-72.6173.6000123.6
98L34.3Very low34.8Very low151 Ų151129.8 Ų129.879%0.79179%0.788SS**  trans49.6163.5149.2-87.950.6000121.3
99T30.7Very low35.1Very low125 Ų125130.6 Ų130.677%0.76779%0.787SS**  cis-145.7160.316.3-24.40000113.5
100T36.3Very low35.9Very low126 Ų126131.1 Ų131.177%0.77378%0.782SS**  trans-92.6174.1162.361.50000109.7
101P52.4Low36.6Very low124 Ų124127.2 Ų127.281%0.80577%0.774SS**  -150.8170.652.442.8-22.2000118.6
102A33.6Very low36.6Very low100 Ų100128.1 Ų128.183%0.82678%0.775SS**  trans-171139.6139.700000112.5
103T34.6Very low36.7Very low130 Ų130124.2 Ų124.280%0.79877%0.767SS**  trans-82175.3169.439.10000111.4
104T33.7Very low36.6Very low116 Ų116124.6 Ų124.671%0.71277%0.769SS**  cis-166.6165.229.1-24.20000111.9
105S34.8Very low36.8Very low122 Ų122123 Ų12385%0.85376%0.764SS**  trans72.5142.4148.3-620000122.6
106G31.1Very low36.6Very low80 Ų80123.8 Ų123.883%0.82577%0.769SS**  trans117.194.2140.500000117.5
107A36.3Very low36.5Very low104 Ų104121.3 Ų121.386%0.8677%0.765SS**  trans-103.6123.1167.100000110.9
108I36.4Very low36.4Very low167 Ų167119.7 Ų119.786%0.85677%0.765SS**  trans-142.6145.7170.6-54.6-178.7000108.9
109N39.3Very low36.5Very low150 Ų150119.9 Ų119.980%0.80277%0.765SS**PPolyproline II helixtrans-71.7158.8-174.8-69-16.8000114.7
110P48Very low36.6Very low110 Ų110119.8 Ų119.871%0.71477%0.765SS**PPolyproline II helixtrans-79.9150.4169.333.7-35.7000113.2
111P46.6Very low36.3Very low111 Ų111120 Ų12072%0.72177%0.766SS**PPolyproline II helixtrans-77.9140.5160.434.1-33.1000109.9
112T34.6Very low35.3Very low123 Ų123119.9 Ų119.976%0.75576%0.763SS**  cis65.7139.346.571.70000115
113T38.7Very low35.4Very low104 Ų104122.6 Ų122.664%0.63876%0.762SS**  cis-166.3150.4-21-82.30000107.6V115T113-V115 HydrophobicContact CG2-CG2 3.73Å
114T29.4Very low35.2Very low132 Ų132121.8 Ų121.881%0.8176%0.761SS**  trans160104.4144.6-69.90000107.6
115V36.3Very low35.1Very low105 Ų105122.9 Ų122.964%0.63677%0.768SS**  74.1105.451.3-176.50000113.9T113T113-V115 HydrophobicContact CG2-CG2 3.73Å
116T29.7Very low35Very low130 Ų130123 Ų12380%0.79877%0.769SS**  trans-161.6103.2131-700000109.4
117T35.9Very low35Very low111 Ų111125.5 Ų125.568%0.68177%0.768SS**  12.9146.3128.80.90000118.6
118S32.7Very low34.7Very low92 Ų92126.7 Ų126.764%0.64377%0.765SS**  cis-165.3168.526.1-30.50000115.1
119I35.4Very low34.6Very low155 Ų155125.8 Ų125.880%0.79576%0.762SS**  trans81.4121.3147.8-66.9157.5000119.8
120T32.1Very low34.1Very low124 Ų124128.2 Ų128.276%0.76177%0.768SS**  trans-90.1148.7166.9-50.30000110.8
121T30.2Very low33.3Very low131 Ų131127.2 Ų127.280%0.80477%0.77SS**  trans-118.1135.6160.8-60.10000110.3
122V33Very low32.8Very low121 Ų121130.4 Ų130.473%0.73378%0.779SS**  trans-94.4148.5-173.8-147.70000110.9
123I33.8Very low32.6Very low157 Ų157127.6 Ų127.681%0.80577%0.774SS**  trans-96.9133.8163.6-62.3176.1000108.3
124S30.5Very low32.1Very low112 Ų112128.4 Ų128.478%0.78378%0.784SS**  trans-151.5143.5169-75.50000110
125T33.5Very low33.3Very low140 Ų140127.4 Ų127.486%0.85978%0.78SS**  trans-103.4129.7-170.649.90000112.2
126S32.1Very low33Very low124 Ų124129.4 Ų129.487%0.86779%0.787SS**  trans-148.9144.5155.158.90000111
127T31Very low33.2Very low132 Ų132128.7 Ų128.781%0.8179%0.787SS**  trans-87.3147.5177.145.30000111.3
128T30.3Very low33Very low129 Ų129130.6 Ų130.679%0.79179%0.793SS**  -179.4152.5116.1-71.20000110.9
129N32.7Very low33Very low149 Ų149131.3 Ų131.380%0.79780%0.798SS**  trans-57.1153.5-180-47.3-39000114.5
130Q29.4Very low32.8Very low200 Ų200130.8 Ų130.894%0.93580%0.797SS**  trans-138.8152.7134.7-91.3-146.886.200110.6
131A31.6Very low32.8Very low90 Ų90130.1 Ų130.174%0.74480%0.798SS**  trans-106.8167.918000000111.3
132I35.2Very low32.8Very low178 Ų178130.4 Ų130.491%0.91380%0.798SS**  trans-70.6134.9173.6-62.4169.4000108.9
133G30.5Very low32.9Very low63 Ų63131.4 Ų131.465%0.64980%0.799SS**  trans-93.3-175.4-16600000116.6
134S29.8Very low32.7Very low121 Ų121130.5 Ų130.585%0.84680%0.801SS**  trans-155.6160.5167-77.10000108.8
135P53Low32.8Very low111 Ų111130.8 Ų130.872%0.72180%0.798SS**  trans-101.5170.3-148.538.8-38.2000116.9
136D30.4Very low32.8Very low148 Ų148128.3 Ų128.379%0.79179%0.792SS**  trans51.6113.5153.1-58.1-32.3000121.3
137S33.7Very low32.7Very low115 Ų115129.1 Ų129.180%0.80479%0.792SS**  -178.9130.6118.5-81.40000114.9
138N31.3Very low32.8Very low150 Ų150129.3 Ų129.380%0.80279%0.793SS**  trans20.8124.6148.1-56.8-22.9000121.5
139S32.8Very low32.8Very low107 Ų107129 Ų12975%0.74880%0.796SS**  162.6133.4107.4-700000114.9
140N31.3Very low32.8Very low145 Ų145128.7 Ų128.778%0.77579%0.794SS**  trans31.1120143.1-56.1-13.4000120.3
141S32.6Very low33.1Very low110 Ų110130.4 Ų130.477%0.76979%0.792SS**  68.6143.686.898.30000115.3
142V29.8Very low33Very low136 Ų136129.3 Ų129.382%0.82479%0.789SS**  cis-154.3179.312.187.70000112.7
143L35.9Very low33Very low143 Ų143126.9 Ų126.975%0.74978%0.783SS**  trans-80.3157.3-177.7-176.269000114.6
144T29.7Very low33.2Very low137 Ų137130.6 Ų130.684%0.8479%0.793SS**  trans-160.8159.7161.4-71.10000110.3
145T31.5Very low33.3Very low118 Ų118129.4 Ų129.472%0.72479%0.79SS**  trans-147.4157.3-168.2-39.90000114.6
146A33.7Very low32.4Very low89 Ų89129.4 Ų129.474%0.73679%0.793SS**  trans77.6163.6167.700000116.4
147T29.9Very low32.4Very low140 Ų140128.3 Ų128.386%0.85979%0.792SS**  cis-147.5178.119.5-42.80000113.3
148V34.7Very low32.3Very low137 Ų137131 Ų13183%0.8380%0.796SS**  trans-112151.2-168.1170.70000113.1
149S28.7Very low32.3Very low122 Ų122133.1 Ų133.185%0.85380%0.798SS**  trans-174.7178135.2-151.70000114.7
150N34.2Very low32.7Very low142 Ų142133.8 Ų133.876%0.75980%0.8SS**  trans-155.6163-156.3-159.2-7.6000114.4
151R34.2Very low32.7Very low237 Ų237131.3 Ų131.389%0.89479%0.794SS**  trans63.5157.8175.8-65.5178.4166.2-176.9-5.3118
152G30.8Very low32.7Very low66 Ų66133.6 Ų133.668%0.6879%0.792SS**  cis149.6157.2-15.300000116.5
153T34.4Very low32.7Very low128 Ų128134.1 Ų134.179%0.78579%0.791SS**  trans97.3137.9155.3-16.80000122
154V36.1Very low32.6Very low141 Ų141131.1 Ų131.186%0.85579%0.786SS**  trans56.9153.3160.1-77.60000121.8
155A31.9Very low32.7Very low95 Ų95130.9 Ų130.979%0.78579%0.785SS**  cis-162.1177-13.800000112.1
156S33.5Very low32.8Very low112 Ų112133.4 Ų133.478%0.78379%0.788SS**  trans-81.8169.5-174.5-45.70000116.7
157T29.9Very low32.7Very low125 Ų125137.7 Ų137.777%0.76779%0.79SS**  162.3120.4124.6-70.90000117.3
158L31.7Very low32.9Very low172 Ų172136 Ų13690%0.90178%0.78SS**  trans64.6164.5149.1-67.5171.6000126.7
159K31.1Very low32.7Very low194 Ų194134.8 Ų134.884%0.84377%0.773SS**  trans-78.4169.6-178.8-112.1-178.3178.9-176.30113.4
160P42.3Very low32.9Very low120 Ų120136 Ų13678%0.77977%0.769SS**  -144.9157.752.835.2-11.6000117
161S29.7Very low32.8Very low93 Ų93134.7 Ų134.765%0.6577%0.767SS**  86.5129.491.1-144.50000119.9
162E32.7Very low32.7Very low158 Ų158128 Ų12874%0.73876%0.762SS**  trans68.6143.6145.8-84.1165.7118.700127.4
163N30.2Very low32.7Very low148 Ų148128 Ų12879%0.79176%0.763SS**  trans72.8146.7154-66.2-30.2000119.4
164A33.1Very low33.8Very low80 Ų80127.9 Ų127.966%0.66176%0.764SS**  cis-151.3161.36.100000113.6
165V33Very low34.7Very low132 Ų132126.4 Ų126.480%0.876%0.757SS**  trans49.7128.2137.4174.10000118.6
166E33Very low34.9Very low170 Ų170128.3 Ų128.379%0.79476%0.759SS**  -158.2139.165.3-162158.4-138.100117.3
167K32.8Very low34.9Very low180 Ų180125.9 Ų125.978%0.78375%0.752SS**  trans9.4143.9144.8-130.3166.7178.4179.30119.1
168T32.6Very low35.8Very low104 Ų104125.7 Ų125.764%0.63875%0.752SS**  -170.1133.756.2-52.80000115.3
169T31.4Very low35.7Very low111 Ų111123.9 Ų123.968%0.68175%0.749SS**  trans54.6126.7161.152.50000120.5
170N33.2Very low35.8Very low147 Ų147119.1 Ų119.179%0.78674%0.74SS**  cis86.2139.148.1-67.98.7000113.7
171T31.3Very low35.4Very low116 Ų116122.1 Ų122.171%0.71274%0.743SS**  cis-167.4146.7-8.6-92.30000111.6
172A32.1Very low35.3Very low95 Ų95128.8 Ų128.879%0.78575%0.754SS**  trans64.4141.9157.500000123.2
173G31.2Very low35.5Very low68 Ų68125.3 Ų125.370%0.70175%0.747SS**  trans-114.8-140.2147.200000108.3
174P57.2Low35.8Very low124 Ų124126.7 Ų126.781%0.80575%0.749SS**  cis-120-138.6-18.643.6-26.7000108.3
175P55.6Low35.9Very low110 Ų110126.9 Ų126.971%0.71475%0.75SS**  cis-113.4-132.7-40.539.2-24.4000110.5
176V35.5Very low35.7Very low136 Ų136126.6 Ų126.682%0.82475%0.75SS**  trans86.5131.2167.9-171.80000117.9
177G32.9Very low35.7Very low61 Ų61125.8 Ų125.863%0.62975%0.75SS**  trans-122171.8152.500000108.9
178P49Very low35.6Very low120 Ų120122.3 Ų122.378%0.77974%0.744SS**  -147.3-162.955.537.5-15.4000114.5
179T30.8Very low35.6Very low135 Ų135123.8 Ų123.883%0.82875%0.753SS**  trans72.7153.1156.3-54.50000116.9
180S31.2Very low35.5Very low93 Ų93123.6 Ų123.665%0.6576%0.763SS**  cis-173.7157-38.6-169.60000109.1
181Q35.2Very low35.6Very low183 Ų183122.3 Ų122.386%0.85577%0.765SS**  trans54.9116.4159.6-75.4-179.95.100123
182R28.2Very low35.6Very low233 Ų233122.4 Ų122.488%0.87977%0.77SS**  -166.4147.2118.7-114.2-173.3161.6136.2-4.6108.7
183S35.1Very low35.6Very low85 Ų85125 Ų12559%0.59477%0.771SS**  cis-144.5149.44.9-65.30000111.6
184Q38.3Very low35.5Very low177 Ų177131.2 Ų131.283%0.82778%0.782SS**  trans23.9142.5130.7-58.6172.4-23.700119.9
185A34.1Very low34.1Very low84 Ų84128.4 Ų128.469%0.69478%0.776SS**  cis-161.1164.116.400000115.6
186T30.1Very low33Very low127 Ų127129.2 Ų129.278%0.77978%0.784SS**  30.7128.1124.3-54.30000119.9
187L32Very low32.8Very low153 Ų153132.7 Ų132.780%0.80179%0.788SS**  cis-151-141.7-6.3-117.7-177.5000112.2
188T31.3Very low32.8Very low107 Ų107134.4 Ų134.466%0.65680%0.796SS**  trans-150.2157.8-141.4-63.20000115.3
189T31.3Very low32Very low135 Ų135132.1 Ų132.183%0.82879%0.794SS**  trans64.2125.6163.643.10000122
190A30.5Very low32.9Very low107 Ų107131.9 Ų131.988%0.88480%0.795SS**  -170.4168.1122.200000111.4
191S34.1Very low33.3Very low120 Ų120132.9 Ų132.984%0.83980%0.797SS**  trans-116.6141.8178.11740000111.6
192S32Very low33.8Very low118 Ų118129.9 Ų129.983%0.82579%0.794SS**  trans-167.8169.7159.854.30000112.8
193N32.1Very low34.3Very low148 Ų148126.5 Ų126.579%0.79179%0.788SS**  trans-87.5176.1-174.7-59.5-39.2000114.2
194E30.2Very low34.1Very low199 Ų199127.4 Ų127.493%0.9379%0.79SS**  trans67.1157.1164.5-58.8-179.2118.200116
195G27.4Very low33.9Very low66 Ų66125.3 Ų125.368%0.6879%0.789SS**  cis170.3147.9-9.100000112.6
196S31.3Very low33.6Very low126 Ų126127 Ų12788%0.88179%0.791SS**  trans58.4106.6157.6-60.70000122
197K32.4Very low34.1Very low210 Ų210130.2 Ų130.291%0.91379%0.794SS**  trans-151.5146.3136.7-81.8-162.5179.5-178.40108.7
198A32.5Very low34Very low96 Ų96129.3 Ų129.379%0.79380%0.801SS**  cis-156.2161.6-20.700000108.2
199G31.5Very low34Very low73 Ų73127.6 Ų127.675%0.75380%0.804SS**  trans-82.1-156.7-178.700000114.9
200P50.3Low34Very low129 Ų129129.6 Ų129.684%0.83881%0.809SS**  cis-133.8167.534.240.8-24.9000118
201T38.8Very low34Very low114 Ų114129 Ų12970%0.69980%0.804SS**  trans-82.6171.6168.2-5.80000112.4
202P46.1Very low33.8Very low121 Ų121128.4 Ų128.479%0.78680%0.8SS**  -123.8137.194.80.720.9000112.4
203Q38.5Very low33.6Very low162 Ų162129.2 Ų129.276%0.75780%0.8SS**  8213956-74.1-145.674.300114.3
204T31.3Very low33.6Very low103 Ų103126.6 Ų126.663%0.63280%0.799SS**  cis-165.9178.4-9.5-84.30000108.9
205V33.8Very low34.2Very low133 Ų133122.5 Ų122.581%0.80679%0.79SS**  trans96.2139.7168.3-174.20000114.9
206T29Very low34.2Very low121 Ų121124.8 Ų124.874%0.74280%0.795SS**  cis-167.8168.2-36.2-91.40000108.3
207K39.4Very low34.1Very low194 Ų194126.2 Ų126.284%0.84379%0.793SS**  trans-125153.9170.6-71.8179.5175.3177.80112.9
208S30.4Very low34Very low134 Ų134120.2 Ų120.294%0.93778%0.777SS**  trans177.7164.5141.1-80.80000109.5
209G30.4Very low33.8Very low71 Ų71122.4 Ų122.473%0.73278%0.776SS**  cis179157.4-1.900000110.2
210L31.9Very low33.8Very low176 Ų176127.4 Ų127.492%0.92178%0.78SS**  trans-65.5140.1-165.4-98.862.8000117.9
211A31.2Very low33Very low95 Ų95127 Ų12779%0.78578%0.775SS**  trans45130.9132.900000123.3
212S28.7Very low33.1Very low107 Ų107127.3 Ų127.375%0.74878%0.778SS**  162.6173.5107.7-161.20000113.6
213T28.2Very low32.3Very low135 Ų135128 Ų12883%0.82877%0.771SS**  trans62.6122.1167.1450000120.8
214A31.7Very low31.9Very low94 Ų94129.9 Ų129.978%0.77777%0.771SS**  trans-95.717114900000108.6
215P43.3Very low31.8Very low112 Ų112129.8 Ų129.873%0.72778%0.775SS**  -149.8-178.463.841.9-22.6000116.7
216S28.5Very low31.5Very low114 Ų114128.4 Ų128.480%0.79777%0.771SS**  trans70.7155.2156.1-67.10000119.7
217N28Very low31.4Very low157 Ų157128.6 Ų128.684%0.8477%0.772SS**  cis-167.3177.6-33.6-162.44000108.2
218S30.4Very low31Very low83 Ų83127.6 Ų127.658%0.5877%0.77SS**  trans102.399.7158.7-171.50000118.8
219N28.2Very low30.9Very low143 Ų143125.9 Ų125.977%0.76576%0.758SS**  trans68.8153.1136-57.1-13.4000118.8
220Q31.3Very low30.8Very low178 Ų178131 Ų13183%0.83276%0.763SS**  cis-146.115914.5-152.4165.337.400112.6
221V32.9Very low30.6Very low121 Ų121129.1 Ų129.173%0.73376%0.759SS**  trans-135.2142.4178.4172.70000109.4
222P42.9Very low31.1Very low119 Ų119130 Ų13077%0.77376%0.756SS**  -118.1134.8126.5-4.925.7000109.9
223E28.4Very low30.8Very low136 Ų136131.3 Ų131.364%0.63676%0.76SS**  53.4132.571.1-72.1-148.9118.400113.6
224R29.2Very low30.8Very low201 Ų201128.9 Ų128.976%0.75875%0.754SS**  cis-155.2166.318.5-135.8172-149.7173.119.9115
225S29.2Very low30.6Very low101 Ų101133.8 Ų133.871%0.70676%0.758SS**  trans-23165.1165.4-45.20000119.3
226S29.3Very low30Very low105 Ų105135.8 Ų135.873%0.73476%0.762SS**  cis-162152.335.6-40.30000116.4
227T25.7Very low29.9Very low124 Ų124136.3 Ų136.376%0.76176%0.761SS**  trans7.5128.4149.6480000121.8
228H30.1Very low30Very low173 Ų173136 Ų13680%0.80176%0.758SS**  -158.3162.7110.3-111.571.5000112.6
229S28.8Very low29.7Very low99 Ų99137.4 Ų137.469%0.69276%0.763SS**  trans-134.5117-171.355.50000112.6
230H29.7Very low30Very low177 Ų177137.2 Ų137.282%0.81976%0.761SS**  trans-145.7126.8170.2-73.1-67.6000113.7
231T26.3Very low29.7Very low137 Ų137134.1 Ų134.184%0.8475%0.754SS**  trans-120.2167.4151.912.50000106.6
232P42.3Very low29.4Very low113 Ų113136.7 Ų136.773%0.73476%0.758SS**  cis-132-168.4-237.1-17.7000113.6
233T22.9Very low28.8Very low135 Ų135136.2 Ų136.283%0.82876%0.757SS**  trans133.5138137.9-51.10000114.1
234A28.4Very low29.1Very low84 Ų84135.9 Ų135.969%0.69477%0.767SS**  trans-67.4162.5-170.700000116.7
235K27.2Very low29.1Very low198 Ų198132.6 Ų132.686%0.86177%0.769SS**  -163.8158.5125.3-104.5155.6-171.71770112.1
236D29.5Very low29.7Very low154 Ų154133.9 Ų133.982%0.82478%0.775SS**  trans-60.7148.5176.6-52.7-92.1000112.5
237T26.3Very low29.6Very low124 Ų124133.9 Ų133.976%0.76178%0.782SS**  trans-147.9111.3155.4-65.40000109.4V239T237-V239 HydrophobicContact CG2-CG2 4.11Å; T237-V239 PolarHBondContact O-N 3.35Å
238L31.2Very low29.9Very low151 Ų151133 Ų13379%0.79179%0.787SS**  trans-66122.3169.4-17689.4000109.3I240L238-I240 HydrophobicContact CD2-CD1 3.9Å; L238-I240 HydrophobicContact CD2-CG1 4.18Å; L238-I240 HydrophobicContact CG-CD1 4.45Å; L238-I240 HydrophobicContact CG-CG1 4.26Å
239V24.6Very low29.9Very low112 Ų112134 Ų13468%0.67980%0.795SS**  trans-115.694.9175.6-177.80000110T237 T241T237-V239 HydrophobicContact CG2-CG2 4.11Å; T237-V239 PolarHBondContact O-N 3.35Å; V239-T241 WeakPolarHBondContact CG1-OG1 3.18Å
240I33.4Very low30Very low140 Ų140136.1 Ų136.172%0.71880%0.804SS**  trans-97.2108.3165.7-61.9175.2000107.4L238L238-I240 HydrophobicContact CD2-CD1 3.9Å; L238-I240 HydrophobicContact CD2-CG1 4.18Å; L238-I240 HydrophobicContact CG-CD1 4.45Å; L238-I240 HydrophobicContact CG-CG1 4.26Å
241T24.5Very low30Very low112 Ų112139 Ų13969%0.68781%0.807SS**  trans-120.390.1179.5-54.40000111.8V239V239-T241 WeakPolarHBondContact CG1-OG1 3.18Å
242Q28.5Very low30.7Very low176 Ų176138.6 Ų138.682%0.82281%0.807SS**  trans40.5123.8136.7-58.8-178.91.600120.5
243S30.3Very low30.4Very low108 Ų108136.9 Ų136.976%0.75581%0.81SS**PPolyproline II helixtrans-74.6144165.353.30000113.8
244P34.8Very low30.7Very low129 Ų129136.5 Ų136.584%0.83881%0.807SS**PPolyproline II helixtrans-90.2136.9161.4-1.621.1000112.5
245T27.6Very low30.9Very low132 Ų132138.7 Ų138.781%0.8181%0.812SS**PPolyproline II helixtrans-93.1147.3171.8-63.80000109.2
246P41.4Very low31.3Very low128 Ų128137.5 Ų137.583%0.83181%0.809SS**PPolyproline II helixtrans-84.3153-152.832-37.3000115.7
247A28.3Very low31.7Very low105 Ų105133 Ų13387%0.86879%0.787SS**  trans-116.5131.3162.200000109.3
248A32.2Very low32.4Very low107 Ų107132.8 Ų132.888%0.88478%0.781SS**  trans-97.9130.8-176.200000112
249M29.1Very low32.9Very low194 Ų194128.7 Ų128.796%0.95676%0.763SS**  trans-147.4145.6160.8-140.2176.9-168.800110.8
250T31.5Very low33.9Very low143 Ų143126.9 Ų126.988%0.87775%0.747SS**  trans-107.5122.9-155.6-48.40000113.7
251R29.3Very low34.4Very low238 Ų238124.2 Ų124.290%0.89874%0.738SS**  trans-174.7144.6136.8-157.9157.3176.3-168.1-5.9110
252P40.9Very low35.6Very low127 Ų127120.1 Ų120.183%0.82571%0.71SS**  trans-91163.3-167.536.3-36.9000113.8
253G36Very low36.5Very low77 Ų77117.4 Ų117.479%0.79470%0.701SS**  trans164.3-0.7168.100000119.2
254V29.1Very low37.4Very low127 Ų127113 Ų11377%0.7767%0.668SS**  trans-132127.6177.4-176.70000110.3E256V254-E256 HydrophobicContact CG1-CG 4.33Å; V254-E256 PolarHBondContact O-N 3.48Å
255T32.5Very low37.8Very low130 Ų130109.6 Ų109.680%0.79865%0.647SS**  trans-79.994.8165.1-540000107.8T257T255-T257 PolarHBondContact O-N 2.93Å
256E36Very low38.6Very low174 Ų174108.7 Ų108.781%0.81364%0.637SS**  trans-68.3100.7173.6-68.9-168.8134.800109.9V254 N258V254-E256 HydrophobicContact CG1-CG 4.33Å; V254-E256 PolarHBondContact O-N 3.48Å; E256-N258 PolarHBondContact O-N 2.84Å
257T37.5Very low38.6Very low59 Ų59107.5 Ų107.536%0.36263%0.632SS.*  trans-69.380.7170.5-55.80000109.5T255 T259 Q298 N300T255-T257 PolarHBondContact O-N 2.93Å; T257-T259 PolarHBondContact O-N 2.92Å; T257-T259 PolarHBondContact O-OG1 3.37Å; T257-Q298 HydrophobicContact CG2-CG 3.65Å; T257-N300 VanDerWaalsContact CG2-OD1 3.25Å; T257-N300 WeakPolarHBondContact CG2-OD1 3.41Å
258N42.4Very low39.5Very low119 Ų119107 Ų10764%0.63662%0.615SS**  trans-55.5112.8176.7-170.1-87.4000109.3E256E256-N258 PolarHBondContact O-N 2.84Å
259T40.2Very low40.2Very low65 Ų65106.1 Ų106.140%0.39960%0.602SS.*EExtended strand (participates in β ladder)trans-109.292.8-173.1-62.30000108.1T257 T261T257-T259 PolarHBondContact O-N 2.92Å; T257-T259 PolarHBondContact O-OG1 3.37Å; T259-T261 PolarHBondContact O-N 3.47Å
260E46.7Very low41.3Very low75 Ų75104.9 Ų104.935%0.3559%0.594SS.*EExtended strand (participates in β ladder)trans-74.2109.1171.7-63.2-153.3109.900109.5F262 K273 L297E260-F262 HydrophobicContact CB-CD2 4.37Å; E260-F262 HydrophobicContact CB-CE2 3.57Å; E260-F262 HydrophobicContact CB-CZ 3.71Å; E260-F262 HydrophobicContact CG-CZ 4.43Å; E260-F262 WeakPolarHBondContact OE2-CZ 3.45Å; E260-K273 IonicContact OE1-NZ 2.86Å; E260-K273 PolarHBondContact OE1-NZ 2.82Å; E260-K273 IonicContact OE2-NZ 2.63Å; E260-K273 PolarHBondContact OE2-NZ 2.87Å; E260-L297 PolarHBondContact O-N 3.37Å
261T43.8Very low42.2Very low84 Ų8499.6 Ų99.652%0.51556%0.562SS.*EExtended strand (participates in β ladder)trans-90112.8170.6-62.80000109T259 I294 T296T259-T261 PolarHBondContact O-N 3.47Å; T261-I294 HydrophobicContact CG2-CG2 4.21Å; T261-T296 HydrophobicContact CG2-CG2 4.11Å
262F50.3Low43.2Very low26 Ų2694.2 Ų94.211%0.11456%0.556CS.*EExtended strand (participates in β ladder)trans-95.7121.9173.8-59.4-83.3000109.9E260 F264 K273 A295 L297E260-F262 HydrophobicContact CB-CD2 4.37Å; E260-F262 HydrophobicContact CB-CE2 3.57Å; E260-F262 HydrophobicContact CB-CZ 3.71Å; E260-F262 HydrophobicContact CG-CZ 4.43Å; E260-F262 WeakPolarHBondContact OE2-CZ 3.45Å; F262-F264 HydrophobicContact CB-CD2 4.22Å; F262-F264 HydrophobicContact CB-CE2 3.51Å; F262-F264 HydrophobicContact CB-CZ 4.03Å; F262-F264 HydrophobicContact CG-CE2 4.41Å; F262-K273 HydrophobicContact CE1-CB 4.47Å; F262-K273 HydrophobicContact CE1-CD 4.05Å; F262-K273 HydrophobicContact CZ-CB 4.39Å; F262-K273 HydrophobicContact CZ-CD 3.97Å; F262-A295 WeakPolarHBondContact CB-O 3.4Å; F262-A295 PolarHBondContact N-O 3.33Å; F262-A295 PolarHBondContact O-N 2.77Å; F262-L297 HydrophobicContact CE2-CB 4.3Å
263L46.1Very low43.7Very low118 Ų11894 Ų9462%0.61854%0.542SS*.EExtended strand (participates in β ladder)trans-97.2122.6173.2-147.181.9000108.2I294L263-I294 HydrophobicContact CD1-CB 4.45Å; L263-I294 HydrophobicContact CD1-CD1 3.73Å; L263-I294 HydrophobicContact CD1-CG1 3.69Å; L263-I294 HydrophobicContact CD1-CG2 4.16Å
264F50.3Low44.9Very low16 Ų1693.1 Ų93.17%0.0752%0.52CS..EExtended strand (participates in β ladder)trans-116103.9174.6-67.1-77.8000110.9F262 S271 L277 V278 C293 A295F262-F264 HydrophobicContact CB-CD2 4.22Å; F262-F264 HydrophobicContact CB-CE2 3.51Å; F262-F264 HydrophobicContact CB-CZ 4.03Å; F262-F264 HydrophobicContact CG-CE2 4.41Å; F264-S271 VanDerWaalsContact CE1-CB 3.46Å; F264-L277 HydrophobicContact CE2-CD2 3.8Å; F264-L277 HydrophobicContact CZ-CD2 4.48Å; F264-V278 HydrophobicContact CE1-CG2 3.81Å; F264-V278 HydrophobicContact CE2-CG2 4.5Å; F264-V278 HydrophobicContact CZ-CG2 3.62Å; F264-C293 HydrophobicContact CB-CB 4.35Å; F264-C293 WeakPolarHBondContact CB-O 3.49Å; F264-C293 PolarHBondContact N-O 2.98Å; F264-C293 PolarHBondContact O-N 3.33Å; F264-A295 HydrophobicContact CD2-CB 4.43Å; F264-A295 HydrophobicContact CE2-CB 4.4Å
265S43.3Very low46.4Very low58 Ų5895 Ų9541%0.40652%0.517SS..  trans-75.5155.4160-167.60000109.9S267 D268S265-S267 PolarHBondContact O-N 3.44Å; S265-S267 VanDerWaalsContact O-N 3.14Å; S265-D268 VanDerWaalsContact CB-OD2 3.24Å; S265-D268 WeakPolarHBondContact CB-OD2 3.32Å; S265-D268 PolarHBondContact O-N 3.29Å
266L43.6Very low47.8Very low112 Ų11294.6 Ų94.659%0.58652%0.515SS*.THydrogen-bonded Turntrans-64.2-17.9178.8-157.174.2000112.8M285L266-M285 HydrophobicContact CB-CE 4.43Å; L266-M285 HydrophobicContact CD1-CB 3.8Å; L266-M285 HydrophobicContact CD1-CE 3.89Å
267S42.4Very low48.9Very low104 Ų10487.7 Ų87.773%0.72748%0.483SS*.THydrogen-bonded Turntrans-85.2-20.5178.9-530000114.7S265 S269S265-S267 PolarHBondContact O-N 3.44Å; S265-S267 VanDerWaalsContact O-N 3.14Å; S267-S269 PolarHBondContact O-N 2.94Å
268D46.5Very low50.2Low95 Ų9585.6 Ų85.651%0.50847%0.47SS..  trans-88.9111.9-169.3-68.4-58000111.8S265S265-D268 VanDerWaalsContact CB-OD2 3.24Å; S265-D268 WeakPolarHBondContact CB-OD2 3.32Å; S265-D268 PolarHBondContact O-N 3.29Å
269S47.8Very low51.3Low88 Ų8886.1 Ų86.162%0.61547%0.469SS*.  trans-80.4-33.6-17151.30000114S267 K282S267-S269 PolarHBondContact O-N 2.94Å; S269-K282 PolarHBondContact O-NZ 3.48Å
270E51.1Low52.5Low168 Ų16887.8 Ų87.879%0.78548%0.475SS*.  trans-119.3107.7-165.9-68.4-166.1103.600114.8
271S50.5Low53.4Low31 Ų3184.6 Ų84.622%0.21746%0.461CS..  trans-130.1109.2150.1178.40000108F264 K273F264-S271 VanDerWaalsContact CE1-CB 3.46Å; S271-K273 VanDerWaalsContact C-N 3.32Å; S271-K273 PolarHBondContact O-N 3.28Å
272T50.4Low54.6Low126 Ų12685.6 Ų85.677%0.77346%0.458SS*.  trans-78.3-15.1-172.248.80000113.5
273K51.9Low55.2Low121 Ų12188.3 Ų88.353%0.52648%0.48SS..SBendtrans-72.1-30.9-170.4-75.3-173.7169.8-169.50115.5E260 F262 S271E260-K273 IonicContact OE1-NZ 2.86Å; E260-K273 PolarHBondContact OE1-NZ 2.82Å; E260-K273 IonicContact OE2-NZ 2.63Å; E260-K273 PolarHBondContact OE2-NZ 2.87Å; F262-K273 HydrophobicContact CE1-CB 4.47Å; F262-K273 HydrophobicContact CE1-CD 4.05Å; F262-K273 HydrophobicContact CZ-CB 4.39Å; F262-K273 HydrophobicContact CZ-CD 3.97Å; S271-K273 VanDerWaalsContact C-N 3.32Å; S271-K273 PolarHBondContact O-N 3.28Å
274N60.3Low56.1Low60 Ų6086.7 Ų86.732%0.32147%0.468SS..  trans-145.973.7-175.5-82.5-68000112.9T276 L277 V278N274-T276 VanDerWaalsContact C-N 3.26Å; N274-T276 PolarHBondContact O-N 3.32Å; N274-T276 VanDerWaalsContact O-N 3.14Å; N274-L277 HydrophobicContact CB-CB 4.01Å; N274-L277 PolarHBondContact O-N 3.29Å; N274-V278 WeakPolarHBondContact O-CG2 3.21Å; N274-V278 PolarHBondContact O-N 2.92Å
275K61.2Low56.7Low167 Ų16786.3 Ų86.373%0.72647%0.467SS*.Hα-helixtrans-49.2-41.8-178.6-172.8175.1-179.6177.90113.7L277 V278 Q279K275-L277 PolarHBondContact O-N 3.45Å; K275-V278 PolarHBondContact O-N 3.33Å; K275-Q279 VanDerWaalsContact O-CB 3.26Å; K275-Q279 WeakPolarHBondContact O-CB 3.39Å; K275-Q279 PolarHBondContact O-N 3.5Å
276T60.8Low57.5Low120 Ų12088.3 Ų88.374%0.73648%0.481SS*.Hα-helixtrans-62.3-41.7179-43.90000112.8N274 Q279 L280N274-T276 VanDerWaalsContact C-N 3.26Å; N274-T276 PolarHBondContact O-N 3.32Å; N274-T276 VanDerWaalsContact O-N 3.14Å; T276-Q279 PolarHBondContact O-N 2.87Å; T276-L280 WeakPolarHBondContact O-CB 3.42Å; T276-L280 PolarHBondContact O-N 2.98Å
277L60.8Low58Low29 Ų2987.4 Ų87.415%0.15248%0.484CS..Hα-helixtrans-74.3-39.7-179.9179149.7000111F264 N274 K275 Q279 L280 C281 A295 L307F264-L277 HydrophobicContact CE2-CD2 3.8Å; F264-L277 HydrophobicContact CZ-CD2 4.48Å; N274-L277 HydrophobicContact CB-CB 4.01Å; N274-L277 PolarHBondContact O-N 3.29Å; K275-L277 PolarHBondContact O-N 3.45Å; L277-Q279 VanDerWaalsContact C-N 3.28Å; L277-Q279 PolarHBondContact O-N 3.3Å; L277-L280 PolarHBondContact O-N 3.27Å; L277-C281 WeakPolarHBondContact O-CB 3.3Å; L277-C281 PolarHBondContact O-N 3.38Å; L277-A295 HydrophobicContact CD1-CB 4.23Å; L277-A295 HydrophobicContact CD2-CB 3.68Å; L277-A295 HydrophobicContact CG-CB 4.35Å; L277-L307 HydrophobicContact CD1-CD1 4.41Å
278V63.8Low58.8Low16 Ų1683.2 Ų83.210%0.09745%0.453CS..Hα-helixtrans-59.4-41.1170.7176.30000110.6F264 N274 K275 K282F264-V278 HydrophobicContact CE1-CG2 3.81Å; F264-V278 HydrophobicContact CE2-CG2 4.5Å; F264-V278 HydrophobicContact CZ-CG2 3.62Å; N274-V278 WeakPolarHBondContact O-CG2 3.21Å; N274-V278 PolarHBondContact O-N 2.92Å; K275-V278 PolarHBondContact O-N 3.33Å; V278-K282 HydrophobicContact CG1-CD 3.96Å; V278-K282 HydrophobicContact CG1-CG 4.44Å; V278-K282 VanDerWaalsContact O-CB 3.31Å; V278-K282 WeakPolarHBondContact O-CB 3.27Å; V278-K282 VanDerWaalsContact O-CG 3.29Å; V278-K282 WeakPolarHBondContact O-CG 3.29Å; V278-K282 PolarHBondContact O-N 2.97Å
279Q66.1Low59.1Low130 Ų13089.3 Ų89.361%0.60747%0.469SS*.Hα-helixtrans-70.8-39.4179-174.2168.8-18.900112.6K275 T276 L277 S283K275-Q279 VanDerWaalsContact O-CB 3.26Å; K275-Q279 WeakPolarHBondContact O-CB 3.39Å; K275-Q279 PolarHBondContact O-N 3.5Å; T276-Q279 PolarHBondContact O-N 2.87Å; L277-Q279 VanDerWaalsContact C-N 3.28Å; L277-Q279 PolarHBondContact O-N 3.3Å; Q279-S283 VanDerWaalsContact O-CB 3.26Å; Q279-S283 WeakPolarHBondContact O-CB 3.42Å; Q279-S283 PolarHBondContact O-N 3.21Å
280L65.4Low59.2Low100 Ų10092 Ų9252%0.52448%0.477SS..Hα-helixtrans-63.4-47.5173.1-177.964.2000111.3T276 L277 S283 F284 L307T276-L280 WeakPolarHBondContact O-CB 3.42Å; T276-L280 PolarHBondContact O-N 2.98Å; L277-L280 PolarHBondContact O-N 3.27Å; L280-S283 PolarHBondContact O-N 2.9Å; L280-F284 WeakPolarHBondContact O-CB 3.25Å; L280-F284 PolarHBondContact O-N 2.95Å; L280-L307 HydrophobicContact CD2-CD2 3.84Å
281C66Low59.3Low8 Ų884.6 Ų84.65%0.05444%0.443CS..Hα-helixtrans-58.6-49175.1178.30000111.3L277 S283 F284 M285 C293L277-C281 WeakPolarHBondContact O-CB 3.3Å; L277-C281 PolarHBondContact O-N 3.38Å; C281-S283 PolarHBondContact O-N 3.4Å; C281-F284 PolarHBondContact O-N 2.92Å; C281-M285 VanDerWaalsContact O-CB 3.29Å; C281-M285 WeakPolarHBondContact O-CB 3.35Å; C281-M285 WeakPolarHBondContact O-CG 3.49Å; C281-M285 PolarHBondContact O-N 2.92Å; C281-C293 HydrophobicContact CB-CB 4.47Å; C281-C293 WeakPolarHBondContact CB-SG 3.49Å; C281-C293 WeakPolarHBondContact SG-CB 3.35Å; C281-C293 CovalentContact SG-SG 2.04Å; C281-C293 PolarHBondContact SG-SG 3.13Å
282K67.3Low59.3Low104 Ų10486.9 Ų86.945%0.45246%0.456SS..Hα-helixtrans-62.2-40175.9-75.5179.3-178.7179.40112.7S269 V278 F284 M285 S286S269-K282 PolarHBondContact O-NZ 3.48Å; V278-K282 HydrophobicContact CG1-CD 3.96Å; V278-K282 HydrophobicContact CG1-CG 4.44Å; V278-K282 VanDerWaalsContact O-CB 3.31Å; V278-K282 WeakPolarHBondContact O-CB 3.27Å; V278-K282 VanDerWaalsContact O-CG 3.29Å; V278-K282 WeakPolarHBondContact O-CG 3.29Å; V278-K282 PolarHBondContact O-N 2.97Å; K282-F284 VanDerWaalsContact C-N 3.31Å; K282-F284 PolarHBondContact O-N 2.88Å; K282-M285 PolarHBondContact O-N 3.47Å; K282-S286 WeakPolarHBondContact O-CB 3.43Å; K282-S286 PolarHBondContact O-N 3.41Å; K282-S286 PolarHBondContact O-OG 3.31Å
283S64.3Low59.7Low84 Ų8481 Ų8159%0.58742%0.42SS*.Hα-helixtrans-69.4-26.1177.3-172.10000113.7Q279 L280 C281 S286Q279-S283 VanDerWaalsContact O-CB 3.26Å; Q279-S283 WeakPolarHBondContact O-CB 3.42Å; Q279-S283 PolarHBondContact O-N 3.21Å; L280-S283 PolarHBondContact O-N 2.9Å; C281-S283 PolarHBondContact O-N 3.4Å; S283-S286 PolarHBondContact O-OG 2.91Å
284F63.6Low59.8Low83 Ų8377.6 Ų77.636%0.36441%0.407SS..Hα-helixtrans-78.7-50.4172.1-172.7-100.9000110.3L280 C281 K282 S286 S287 L288 I309 V311L280-F284 WeakPolarHBondContact O-CB 3.25Å; L280-F284 PolarHBondContact O-N 2.95Å; C281-F284 PolarHBondContact O-N 2.92Å; K282-F284 VanDerWaalsContact C-N 3.31Å; K282-F284 PolarHBondContact O-N 2.88Å; F284-S286 VanDerWaalsContact C-N 3.28Å; F284-S286 PolarHBondContact O-N 3.48Å; F284-S287 WeakPolarHBondContact O-CB 3.3Å; F284-S287 PolarHBondContact O-N 2.9Å; F284-L288 HydrophobicContact CD1-CD1 4.03Å; F284-L288 HydrophobicContact CE1-CD1 3.75Å; F284-L288 HydrophobicContact CE2-CD1 4.44Å; F284-L288 HydrophobicContact CG-CD1 4.49Å; F284-L288 HydrophobicContact CZ-CD1 3.97Å; F284-L288 WeakPolarHBondContact O-CD1 3.46Å; F284-I309 HydrophobicContact CD1-CG2 4.45Å; F284-I309 HydrophobicContact CE1-CG2 4.1Å; F284-V311 HydrophobicContact CE1-CG2 3.8Å; F284-V311 HydrophobicContact CZ-CG2 4.1Å
285M62.7Low59.4Low9 Ų974.7 Ų74.74%0.04439%0.392CS..Hα-helixtrans-63.6-28.1-179-64.3-92.7-87.500113.1L266 C281 K282 S287 L288 S291 C293L266-M285 HydrophobicContact CB-CE 4.43Å; L266-M285 HydrophobicContact CD1-CB 3.8Å; L266-M285 HydrophobicContact CD1-CE 3.89Å; C281-M285 VanDerWaalsContact O-CB 3.29Å; C281-M285 WeakPolarHBondContact O-CB 3.35Å; C281-M285 WeakPolarHBondContact O-CG 3.49Å; C281-M285 PolarHBondContact O-N 2.92Å; K282-M285 PolarHBondContact O-N 3.47Å; M285-S287 PolarHBondContact O-N 2.99Å; M285-S287 VanDerWaalsContact O-N 3.12Å; M285-L288 CarbonylContact O-C 3.56Å; M285-L288 PolarHBondContact O-N 3.48Å; M285-L288 VanDerWaalsContact O-O 3.05Å; M285-S291 WeakPolarHBondContact CE-O 3.37Å; M285-S291 PolarHBondContact SD-OG 3.44Å; M285-C293 HydrophobicContact CE-CB 3.68Å; M285-C293 HydrophobicContact CG-CB 3.84Å; M285-C293 HydrophobicContact SD-CB 3.5Å; M285-C293 VanDerWaalsContact SD-CB 3.5Å
286S60.5Low59Low99 Ų9968.6 Ų68.669%0.69237%0.368SS*.THydrogen-bonded Turntrans-61.9-16.7172.252.40000114.1K282 S283 F284K282-S286 WeakPolarHBondContact O-CB 3.43Å; K282-S286 PolarHBondContact O-N 3.41Å; K282-S286 PolarHBondContact O-OG 3.31Å; S283-S286 PolarHBondContact O-OG 2.91Å; F284-S286 VanDerWaalsContact C-N 3.28Å; F284-S286 PolarHBondContact O-N 3.48Å
287S54.8Low58.6Low93 Ų9364.7 Ų64.765%0.6534%0.343SS*.THydrogen-bonded Turntrans-92.8-20.8173-164.70000113.2F284 M285F284-S287 WeakPolarHBondContact O-CB 3.3Å; F284-S287 PolarHBondContact O-N 2.9Å; M285-S287 PolarHBondContact O-N 2.99Å; M285-S287 VanDerWaalsContact O-N 3.12Å
288L58.6Low58Low17 Ų1767 Ų679%0.08935%0.353CS..  trans-118.2101.4-175.8-70.4100.1000111.4F284 M285 N290 S291 V311 L315F284-L288 HydrophobicContact CD1-CD1 4.03Å; F284-L288 HydrophobicContact CE1-CD1 3.75Å; F284-L288 HydrophobicContact CE2-CD1 4.44Å; F284-L288 HydrophobicContact CG-CD1 4.49Å; F284-L288 HydrophobicContact CZ-CD1 3.97Å; F284-L288 WeakPolarHBondContact O-CD1 3.46Å; M285-L288 CarbonylContact O-C 3.56Å; M285-L288 PolarHBondContact O-N 3.48Å; M285-L288 VanDerWaalsContact O-O 3.05Å; L288-N290 PolarHBondContact O-N 3.4Å; L288-S291 VanDerWaalsContact CB-OG 3.26Å; L288-S291 WeakPolarHBondContact CB-OG 3.32Å; L288-V311 HydrophobicContact CD2-CG1 3.56Å; L288-L315 HydrophobicContact CB-CD2 4.46Å; L288-L315 HydrophobicContact CD2-CD2 4.23Å
289R54.1Low57.4Low222 Ų22271.3 Ų71.384%0.83838%0.376SS*.THydrogen-bonded Turntrans-58.9-19.1-170.5-74.2-174.4173.1176.9-2.4116.5
290N49.7Very low56.6Low145 Ų14569.6 Ų69.678%0.77537%0.37SS*.THydrogen-bonded Turntrans-146.139.2-175.6-69.9-50.7000113.5L288L288-N290 PolarHBondContact O-N 3.4Å
291S52.6Low56Low12 Ų1268.4 Ų68.48%0.08438%0.382CS..  trans-96.2156.417352.90000112.9M285 L288M285-S291 WeakPolarHBondContact CE-O 3.37Å; M285-S291 PolarHBondContact SD-OG 3.44Å; L288-S291 VanDerWaalsContact CB-OG 3.26Å; L288-S291 WeakPolarHBondContact CB-OG 3.32Å
292T51.2Low55.1Low79 Ų7973.6 Ų73.649%0.48542%0.419SS..  trans-106.8124.1170.1-600000109.3I294T292-I294 HydrophobicContact CG2-CG1 4.29Å
293C57.7Low53.9Low2 Ų277 Ų771%0.01443%0.433CS..EExtended strand (participates in β ladder)trans-99.6101-177.4169.50000109.6F264 C281 M285F264-C293 HydrophobicContact CB-CB 4.35Å; F264-C293 WeakPolarHBondContact CB-O 3.49Å; F264-C293 PolarHBondContact N-O 2.98Å; F264-C293 PolarHBondContact O-N 3.33Å; C281-C293 HydrophobicContact CB-CB 4.47Å; C281-C293 WeakPolarHBondContact CB-SG 3.49Å; C281-C293 WeakPolarHBondContact SG-CB 3.35Å; C281-C293 CovalentContact SG-SG 2.04Å; C281-C293 PolarHBondContact SG-SG 3.13Å; M285-C293 HydrophobicContact CE-CB 3.68Å; M285-C293 HydrophobicContact CG-CB 3.84Å; M285-C293 HydrophobicContact SD-CB 3.5Å; M285-C293 VanDerWaalsContact SD-CB 3.5Å
294I54.9Low53.2Low50 Ų5081 Ų8126%0.25645%0.447SS..EExtended strand (participates in β ladder)trans-89.6137.1171-51.4-174000108.5T261 L263 T292 K308T261-I294 HydrophobicContact CG2-CG2 4.21Å; L263-I294 HydrophobicContact CD1-CB 4.45Å; L263-I294 HydrophobicContact CD1-CD1 3.73Å; L263-I294 HydrophobicContact CD1-CG1 3.69Å; L263-I294 HydrophobicContact CD1-CG2 4.16Å; T292-I294 HydrophobicContact CG2-CG1 4.29Å; I294-K308 VanDerWaalsContact O-O 3.1Å
295A52.3Low52.3Low0 Ų078 Ų780%044%0.439CS..EExtended strand (participates in β ladder)trans-13797.7-179.800000111.6F262 F264 L277 L307F262-A295 WeakPolarHBondContact CB-O 3.4Å; F262-A295 PolarHBondContact N-O 3.33Å; F262-A295 PolarHBondContact O-N 2.77Å; F264-A295 HydrophobicContact CD2-CB 4.43Å; F264-A295 HydrophobicContact CE2-CB 4.4Å; L277-A295 HydrophobicContact CD1-CB 4.23Å; L277-A295 HydrophobicContact CD2-CB 3.68Å; L277-A295 HydrophobicContact CG-CB 4.35Å; A295-L307 HydrophobicContact CB-CD1 3.54Å
296T50.9Low51.3Low38 Ų3881.7 Ų81.723%0.23347%0.466CS..EExtended strand (participates in β ladder)trans-82.2120.8173.750.80000110.9T261 S306T261-T296 HydrophobicContact CG2-CG2 4.11Å; T296-S306 VanDerWaalsContact O-O 3.13Å; T296-S306 PolarHBondContact OG1-O 2.58Å
297L52.5Low50.9Low39 Ų3980.1 Ų80.120%0.20445%0.449CS..EExtended strand (participates in β ladder)trans-105.388.6173.7-173.368.6000110.4E260 F262 N299 I304E260-L297 PolarHBondContact O-N 3.37Å; F262-L297 HydrophobicContact CE2-CB 4.3Å; L297-N299 PolarHBondContact O-N 3.17Å; L297-I304 HydrophobicContact CD1-CG2 4.33Å
298Q48.7Very low50.7Low76 Ų7681.1 Ų81.136%0.35544%0.442SS..EExtended strand (participates in β ladder)trans-80.7111.8174.8-171.2172.592.700110.9T257 N300 G305T257-Q298 HydrophobicContact CG2-CG 3.65Å; Q298-N300 PolarHBondContact O-N 3.29Å; Q298-N300 PolarHBondContact OE1-ND2 3.09Å; Q298-G305 WeakPolarHBondContact O-CA 3.28Å
299N52.5Low50.6Low108 Ų10883.2 Ų83.258%0.57845%0.452SS*.  trans-89.783.1-178.5-175.612.1000112.2L297 G301L297-N299 PolarHBondContact O-N 3.17Å; N299-G301 VanDerWaalsContact C-N 3.33Å; N299-G301 PolarHBondContact O-N 2.88Å; N299-G301 VanDerWaalsContact O-N 3.1Å
300N48.2Very low50.5Low93 Ų9377.9 Ų77.950%0.49744%0.437SS..BIsolated β-bridgetrans-85.473.1174.9-71.5-32000111.6T257 Q298 S302T257-N300 VanDerWaalsContact CG2-OD1 3.25Å; T257-N300 WeakPolarHBondContact CG2-OD1 3.41Å; Q298-N300 PolarHBondContact O-N 3.29Å; Q298-N300 PolarHBondContact OE1-ND2 3.09Å; N300-S302 PolarHBondContact O-N 3.42Å
301G52.7Low50.9Low75 Ų7572.8 Ų72.877%0.77341%0.411SS*.THydrogen-bonded Turntrans71-31.215800000118.9N299N299-G301 VanDerWaalsContact C-N 3.33Å; N299-G301 PolarHBondContact O-N 2.88Å; N299-G301 VanDerWaalsContact O-N 3.1Å
302S47.1Very low51.3Low117 Ų11776.4 Ų76.482%0.81843%0.43SS*.THydrogen-bonded Turntrans-160.9-0.7-179.8-143.80000115.8N300N300-S302 PolarHBondContact O-N 3.42Å
303K43.2Very low51.5Low176 Ų17678.8 Ų78.877%0.76544%0.438SS*.BIsolated β-bridgetrans-132141.1178.8-70.9-172.9177.6-179.90111.7
304I47.8Very low51.8Low169 Ų16984.1 Ų84.187%0.86747%0.466SS*.  trans-63.3134.4-177.3-63.4153000109.3L297L297-I304 HydrophobicContact CD1-CG2 4.33Å
305G45.3Very low52.3Low20 Ų2083.5 Ų83.521%0.20646%0.463CS..  trans-70.6162.6-164.900000116.1Q298 L307Q298-G305 WeakPolarHBondContact O-CA 3.28Å; G305-L307 PolarHBondContact O-N 3.39Å
306S43Very low52.8Low86 Ų8686.7 Ų86.760%0.60148%0.482SS*.  trans-75.7108.7-178.153.30000113.1T296 K308T296-S306 VanDerWaalsContact O-O 3.13Å; T296-S306 PolarHBondContact OG1-O 2.58Å; S306-K308 PolarHBondContact O-N 2.8Å
307L51.3Low53.5Low65 Ų6591.2 Ų91.234%0.3450%0.501SS..  trans-72.4102.2173.5177.260.7000111.4L277 L280 A295 G305 I309L277-L307 HydrophobicContact CD1-CD1 4.41Å; L280-L307 HydrophobicContact CD2-CD2 3.84Å; A295-L307 HydrophobicContact CB-CD1 3.54Å; G305-L307 PolarHBondContact O-N 3.39Å; L307-I309 HydrophobicContact CD1-CG1 4.18Å; L307-I309 HydrophobicContact CD2-CD1 4.18Å; L307-I309 HydrophobicContact CD2-CG1 4.17Å; L307-I309 HydrophobicContact CG-CD1 4.42Å; L307-I309 HydrophobicContact CG-CG1 3.86Å
308K50Low54.4Low115 Ų11595.4 Ų95.450%0.552%0.519SS..  trans-91.194.2169.7-171.7-150.3176.3-162.70110.3I294 S306 E310I294-K308 VanDerWaalsContact O-O 3.1Å; S306-K308 PolarHBondContact O-N 2.8Å; K308-E310 IonicContact NZ-OE1 2.59Å; K308-E310 PolarHBondContact NZ-OE1 2.95Å; K308-E310 IonicContact NZ-OE2 2.79Å; K308-E310 PolarHBondContact NZ-OE2 3.01Å
309I57.7Low55.4Low60 Ų6095.5 Ų95.531%0.30852%0.52SS..  trans-78.3129.6167.9-46-178.2000108.4F284 L307 V311F284-I309 HydrophobicContact CD1-CG2 4.45Å; F284-I309 HydrophobicContact CE1-CG2 4.1Å; L307-I309 HydrophobicContact CD1-CG1 4.18Å; L307-I309 HydrophobicContact CD2-CD1 4.18Å; L307-I309 HydrophobicContact CD2-CG1 4.17Å; L307-I309 HydrophobicContact CG-CD1 4.42Å; L307-I309 HydrophobicContact CG-CG1 3.86Å; I309-V311 HydrophobicContact CG2-CG2 3.75Å
310E50.6Low56.1Low111 Ų11196 Ų9652%0.51952%0.522SS..  trans-116116.6177.3-167.6146.3-137.100108.3K308K308-E310 IonicContact NZ-OE1 2.59Å; K308-E310 PolarHBondContact NZ-OE1 2.95Å; K308-E310 IonicContact NZ-OE2 2.79Å; K308-E310 PolarHBondContact NZ-OE2 3.01Å
311V59.7Low57.2Low37 Ų3794.3 Ų94.322%0.22452%0.518CS..  trans-121.9141.3-171.2-1680000108.7F284 L288 I309 I313 V316F284-V311 HydrophobicContact CE1-CG2 3.8Å; F284-V311 HydrophobicContact CZ-CG2 4.1Å; L288-V311 HydrophobicContact CD2-CG1 3.56Å; I309-V311 HydrophobicContact CG2-CG2 3.75Å; V311-I313 PolarHBondContact O-N 2.67Å; V311-I313 VanDerWaalsContact O-N 3.09Å; V311-V316 HydrophobicContact CB-CG2 4.14Å; V311-V316 HydrophobicContact CG1-CG2 3.54Å
312D60.4Low58.2Low89 Ų8996.5 Ų96.548%0.47651%0.506SS..  trans-60.9114.8174.1-168.7-27.5000110.3N314 L315 V316D312-N314 PolarHBondContact O-N 3.27Å; D312-N314 WeakPolarHBondContact OD1-CB 3.27Å; D312-N314 PolarHBondContact OD1-N 3.28Å; D312-N314 PolarHBondContact OD1-ND2 3.1Å; D312-L315 HydrophobicContact CB-CB 4.32Å; D312-L315 PolarHBondContact O-N 2.9Å; D312-V316 PolarHBondContact O-N 3.01Å; D312-V316 VanDerWaalsContact O-N 3.12Å
313I55.8Low59.3Low128 Ų12895.8 Ų95.866%0.65649%0.492SS*.Hα-helixtrans-59.2-33.5-177.6-61.2172.9000110.7V311 V316 Q317V311-I313 PolarHBondContact O-N 2.67Å; V311-I313 VanDerWaalsContact O-N 3.09Å; I313-V316 PolarHBondContact O-N 3.33Å; I313-Q317 VanDerWaalsContact O-CB 3.27Å; I313-Q317 WeakPolarHBondContact O-CB 3.3Å; I313-Q317 PolarHBondContact O-N 3.31Å
314N63.8Low60.4Low115 Ų11595 Ų9562%0.61549%0.489SS*.Hα-helixtrans-66.2-44.2179.9-54.9-80.5000110.9D312 Q317 E318D312-N314 PolarHBondContact O-N 3.27Å; D312-N314 WeakPolarHBondContact OD1-CB 3.27Å; D312-N314 PolarHBondContact OD1-N 3.28Å; D312-N314 PolarHBondContact OD1-ND2 3.1Å; N314-Q317 PolarHBondContact O-N 3.27Å; N314-E318 PolarHBondContact O-N 3.29Å
315L64.1Low61.4Low37 Ų3793.8 Ų93.819%0.19448%0.48CS..Hα-helixtrans-67.1-39.2177.5-177.462.2000111.6L288 D312 E318 Q319L288-L315 HydrophobicContact CB-CD2 4.46Å; L288-L315 HydrophobicContact CD2-CD2 4.23Å; D312-L315 HydrophobicContact CB-CB 4.32Å; D312-L315 PolarHBondContact O-N 2.9Å; L315-E318 PolarHBondContact O-N 2.91Å; L315-Q319 WeakPolarHBondContact O-CG 3.31Å; L315-Q319 PolarHBondContact O-N 2.88Å
316V63.8Low62.2Low66 Ų6698.5 Ų98.540%0.450%0.496SS..Hα-helixtrans-62.8-44173.3176.10000110.7V311 D312 I313 E318 Q319 L320V311-V316 HydrophobicContact CB-CG2 4.14Å; V311-V316 HydrophobicContact CG1-CG2 3.54Å; D312-V316 PolarHBondContact O-N 3.01Å; D312-V316 VanDerWaalsContact O-N 3.12Å; I313-V316 PolarHBondContact O-N 3.33Å; V316-E318 PolarHBondContact O-N 3.03Å; V316-Q319 PolarHBondContact O-N 3.48Å; V316-L320 WeakPolarHBondContact O-CB 3.29Å; V316-L320 PolarHBondContact O-N 3.42Å
317Q65.1Low62.9Low133 Ų133100.8 Ų100.862%0.62150%0.495SS*.Hα-helixtrans-64.2-38179.2-177.2171.9-25.700112.3I313 N314 L320 S321I313-Q317 VanDerWaalsContact O-CB 3.27Å; I313-Q317 WeakPolarHBondContact O-CB 3.3Å; I313-Q317 PolarHBondContact O-N 3.31Å; N314-Q317 PolarHBondContact O-N 3.27Å; Q317-L320 PolarHBondContact O-N 3.04Å; Q317-S321 PolarHBondContact O-N 3.43Å; Q317-S321 PolarHBondContact O-OG 3.41Å
318E72.3Confident63.1Low127 Ų127105.6 Ų105.659%0.59351%0.513SS*.Hα-helixtrans-73.6-37.3177.3-169.9174.9-173.200113.1N314 L315 V316 L320 S321 K322N314-E318 PolarHBondContact O-N 3.29Å; L315-E318 PolarHBondContact O-N 2.91Å; V316-E318 PolarHBondContact O-N 3.03Å; E318-L320 VanDerWaalsContact C-N 3.33Å; E318-S321 WeakPolarHBondContact CA-OG 3.39Å; E318-S321 PolarHBondContact O-OG 2.65Å; E318-K322 VanDerWaalsContact O-CB 3.32Å; E318-K322 WeakPolarHBondContact O-CB 3.27Å; E318-K322 PolarHBondContact O-N 3.06Å
319Q68.4Low63.2Low79 Ų79107.2 Ų107.237%0.36953%0.527SS..Hα-helixtrans-67.1-36.3170.1-64.8-48.5-60.600111.5L315 V316 K322 L323L315-Q319 WeakPolarHBondContact O-CG 3.31Å; L315-Q319 PolarHBondContact O-N 2.88Å; V316-Q319 PolarHBondContact O-N 3.48Å; Q319-K322 PolarHBondContact O-N 3.25Å; Q319-L323 WeakPolarHBondContact O-CB 3.14Å; Q319-L323 VanDerWaalsContact O-CG 3.31Å; Q319-L323 WeakPolarHBondContact O-CG 3.29Å; Q319-L323 PolarHBondContact O-N 3.37Å
320L68.9Low63.1Low118 Ų118108.4 Ų108.462%0.61855%0.545SS*.Hα-helixtrans-72.3-35.7179.3-166.169.9000112.5V316 Q317 E318 K324V316-L320 WeakPolarHBondContact O-CB 3.29Å; V316-L320 PolarHBondContact O-N 3.42Å; Q317-L320 PolarHBondContact O-N 3.04Å; E318-L320 VanDerWaalsContact C-N 3.33Å; L320-K324 WeakPolarHBondContact O-CB 3.38Å; L320-K324 PolarHBondContact O-N 3.43Å
321S70.4Confident63.2Low58 Ų58108.9 Ų108.941%0.40655%0.548SS..Hα-helixtrans-66.3-44.9171.161.90000110.8Q317 E318 K324 E325Q317-S321 PolarHBondContact O-N 3.43Å; Q317-S321 PolarHBondContact O-OG 3.41Å; E318-S321 WeakPolarHBondContact CA-OG 3.39Å; E318-S321 PolarHBondContact O-OG 2.65Å; S321-K324 CarbonylContact O-C 3.46Å; S321-K324 WeakPolarHBondContact O-CA 3.15Å; S321-K324 WeakPolarHBondContact O-CB 3.48Å; S321-K324 PolarHBondContact O-N 3.33Å; S321-K324 VanDerWaalsContact O-N 3.11Å; S321-E325 PolarHBondContact O-N 3.44Å
322K74.3Confident62.9Low121 Ų121113 Ų11353%0.52656%0.564SS.*Hα-helixtrans-60.2-48.1176.9-172.9179.6177.4-1740112.5E318 Q319 K324 E325 E326E318-K322 VanDerWaalsContact O-CB 3.32Å; E318-K322 WeakPolarHBondContact O-CB 3.27Å; E318-K322 PolarHBondContact O-N 3.06Å; Q319-K322 PolarHBondContact O-N 3.25Å; K322-K324 PolarHBondContact O-N 3.32Å; K322-E325 PolarHBondContact O-N 2.97Å; K322-E326 WeakPolarHBondContact O-CB 3.33Å; K322-E326 PolarHBondContact O-N 3.02Å
323L69.3Low62.7Low101 Ų101112.1 Ų112.153%0.52956%0.564SS.*Hα-helixtrans-62.7-31174.8-74.1170.5000112.4Q319 K327Q319-L323 WeakPolarHBondContact O-CB 3.14Å; Q319-L323 VanDerWaalsContact O-CG 3.31Å; Q319-L323 WeakPolarHBondContact O-CG 3.29Å; Q319-L323 PolarHBondContact O-N 3.37Å; L323-K327 VanDerWaalsContact O-CB 3.3Å; L323-K327 WeakPolarHBondContact O-CB 3.19Å; L323-K327 PolarHBondContact O-N 2.79Å
324K67.2Low62.7Low159 Ų159108.7 Ų108.769%0.69155%0.549SS*.Hα-helixtrans-73.2-35.8175.1-173.8177.9-178-178.10112.3L320 S321 K322 K328L320-K324 WeakPolarHBondContact O-CB 3.38Å; L320-K324 PolarHBondContact O-N 3.43Å; S321-K324 CarbonylContact O-C 3.46Å; S321-K324 WeakPolarHBondContact O-CA 3.15Å; S321-K324 WeakPolarHBondContact O-CB 3.48Å; S321-K324 PolarHBondContact O-N 3.33Å; S321-K324 VanDerWaalsContact O-N 3.11Å; K322-K324 PolarHBondContact O-N 3.32Å; K324-K328 WeakPolarHBondContact O-CB 3.45Å; K324-K328 PolarHBondContact O-N 3.1Å
325E67.8Low62.7Low145 Ų145109.3 Ų109.368%0.67855%0.552SS**Hα-helixtrans-71.4-42.1171.8-69.7-164144.200111.9S321 K322 K328 L329S321-E325 PolarHBondContact O-N 3.44Å; K322-E325 PolarHBondContact O-N 2.97Å; E325-K328 CarbonylContact O-C 3.44Å; E325-K328 WeakPolarHBondContact O-CA 3.49Å; E325-K328 PolarHBondContact O-N 3.44Å; E325-K328 VanDerWaalsContact O-N 3.11Å; E325-L329 WeakPolarHBondContact O-CB 3.43Å; E325-L329 PolarHBondContact O-N 3.45Å
326E62Low63.1Low119 Ų119111.9 Ų111.956%0.55657%0.566SS**Hα-helixtrans-60.3-47.2174.8-168.4175.1146.100111.1K322 K328 L329 A330K322-E326 WeakPolarHBondContact O-CB 3.33Å; K322-E326 PolarHBondContact O-N 3.02Å; E326-K328 VanDerWaalsContact C-N 3.33Å; E326-K328 PolarHBondContact O-N 2.92Å; E326-L329 PolarHBondContact O-N 3.36Å; E326-L329 VanDerWaalsContact O-N 3.14Å; E326-A330 WeakPolarHBondContact O-CB 3.39Å; E326-A330 PolarHBondContact O-N 3.43Å
327K57.4Low63.9Low133 Ų133115 Ų11558%0.57858%0.575SS**Hα-helixtrans-62.2-38.4171.5-174.4171.3-170.3-77.70112.2L323 L329 A330 E331L323-K327 VanDerWaalsContact O-CB 3.3Å; L323-K327 WeakPolarHBondContact O-CB 3.19Å; L323-K327 PolarHBondContact O-N 2.79Å; K327-L329 PolarHBondContact O-N 2.79Å; K327-A330 PolarHBondContact O-N 3.4Å; K327-E331 IonicContact NZ-OE2 2.64Å; K327-E331 PolarHBondContact NZ-OE2 2.97Å; K327-E331 WeakPolarHBondContact O-CB 3.36Å; K327-E331 PolarHBondContact O-N 3.31Å
328K55.2Low64.8Low167 Ų167112.1 Ų112.173%0.72657%0.566SS**Hα-helixtrans-72.3-10.3177.5-174.2177.7174.5-61.60113.4K324 E325 E326K324-K328 WeakPolarHBondContact O-CB 3.45Å; K324-K328 PolarHBondContact O-N 3.1Å; E325-K328 CarbonylContact O-C 3.44Å; E325-K328 WeakPolarHBondContact O-CA 3.49Å; E325-K328 PolarHBondContact O-N 3.44Å; E325-K328 VanDerWaalsContact O-N 3.11Å; E326-K328 VanDerWaalsContact C-N 3.33Å; E326-K328 PolarHBondContact O-N 2.92Å
329L54.1Low65.4Low148 Ų148111.5 Ų111.578%0.77557%0.566SS**Hα-helixtrans-98-34.1171.5-167.869.3000112E325 E326 K327E325-L329 WeakPolarHBondContact O-CB 3.43Å; E325-L329 PolarHBondContact O-N 3.45Å; E326-L329 PolarHBondContact O-N 3.36Å; E326-L329 VanDerWaalsContact O-N 3.14Å; K327-L329 PolarHBondContact O-N 2.79Å
330A54.6Low66.3Low85 Ų85111.8 Ų111.870%0.70257%0.573SS**Hα-helixtrans-80.2-26.8175.400000113.5E326 K327 E332E326-A330 WeakPolarHBondContact O-CB 3.39Å; E326-A330 PolarHBondContact O-N 3.43Å; K327-A330 PolarHBondContact O-N 3.4Å; A330-E332 PolarHBondContact O-N 3.09Å
331E52.4Low67.2Low122 Ų122109.1 Ų109.157%0.5757%0.568SS**SBendtrans-80.366.3169.7-166.4174.3146.800109.3K327 P333K327-E331 IonicContact NZ-OE2 2.64Å; K327-E331 PolarHBondContact NZ-OE2 2.97Å; K327-E331 WeakPolarHBondContact O-CB 3.36Å; K327-E331 PolarHBondContact O-N 3.31Å; E331-P333 WeakPolarHBondContact O-CD 3.41Å
332E53.2Low68.3Low122 Ų122111.6 Ų111.657%0.5758%0.576SS**  trans-62.9119.2173.4-148.5-96.4115.200107.9A330 T334A330-E332 PolarHBondContact O-N 3.09Å; E332-T334 VanDerWaalsContact CD-OG1 3.26Å; E332-T334 PolarHBondContact O-N 3.24Å; E332-T334 WeakPolarHBondContact OE1-CB 3.44Å; E332-T334 WeakPolarHBondContact OE2-CB 3.48Å; E332-T334 PolarHBondContact OE2-OG1 3.1Å
333P55.6Low69.1Low71 Ų71111.6 Ų111.646%0.46158%0.581SS.*THydrogen-bonded Turntrans-82.547.5-166.534.7-37.4000111.4E331 N336 K337E331-P333 WeakPolarHBondContact O-CD 3.41Å; P333-N336 VanDerWaalsContact CA-OD1 3.25Å; P333-N336 WeakPolarHBondContact CA-OD1 3.5Å; P333-N336 PolarHBondContact O-OD1 2.63Å; P333-N336 VanDerWaalsContact O-OD1 3.1Å; P333-K337 PolarHBondContact O-NZ 3.02Å
334T57.6Low70.3Confident57 Ų57109.7 Ų109.735%0.3558%0.58SS.*THydrogen-bonded Turntrans-112.8-50.1-171.668.70000110.3E332 N336 K337 T338E332-T334 VanDerWaalsContact CD-OG1 3.26Å; E332-T334 PolarHBondContact O-N 3.24Å; E332-T334 WeakPolarHBondContact OE1-CB 3.44Å; E332-T334 WeakPolarHBondContact OE2-CB 3.48Å; E332-T334 PolarHBondContact OE2-OG1 3.1Å; T334-N336 VanDerWaalsContact C-N 3.26Å; T334-N336 PolarHBondContact O-N 2.91Å; T334-K337 WeakPolarHBondContact O-CB 3.25Å; T334-K337 PolarHBondContact O-N 2.91Å; T334-T338 PolarHBondContact O-N 3.14Å; T334-T338 PolarHBondContact O-OG1 2.91Å; T334-T338 VanDerWaalsContact O-OG1 3.13Å
335D62.8Low71.7Confident128 Ų128105.5 Ų105.568%0.68457%0.57SS**Hα-helixtrans-55-40172.7-87-18.2000112.1K337 T338 L339D335-K337 VanDerWaalsContact C-N 3.3Å; D335-K337 PolarHBondContact O-N 2.99Å; D335-T338 PolarHBondContact O-N 3.1Å; D335-L339 WeakPolarHBondContact O-CB 3.37Å; D335-L339 PolarHBondContact O-N 3.11Å
336N72.8Confident73Confident91 Ų91101.6 Ų101.649%0.48756%0.558SS.*Hα-helixtrans-67.8-30179.182.3-77.1000112.5P333 T334 T340P333-N336 VanDerWaalsContact CA-OD1 3.25Å; P333-N336 WeakPolarHBondContact CA-OD1 3.5Å; P333-N336 PolarHBondContact O-OD1 2.63Å; P333-N336 VanDerWaalsContact O-OD1 3.1Å; T334-N336 VanDerWaalsContact C-N 3.26Å; T334-N336 PolarHBondContact O-N 2.91Å; N336-T340 WeakPolarHBondContact O-CB 3.09Å; N336-T340 PolarHBondContact O-N 3.31Å; N336-T340 PolarHBondContact O-OG1 3.18Å
337K80.4Confident74.5Confident132 Ų13297.3 Ų97.357%0.57455%0.546SS*.Hα-helixtrans-74.3-45.4173.5-63-169-17579.70110.6P333 T334 D335 T340 A341P333-K337 PolarHBondContact O-NZ 3.02Å; T334-K337 WeakPolarHBondContact O-CB 3.25Å; T334-K337 PolarHBondContact O-N 2.91Å; D335-K337 VanDerWaalsContact C-N 3.3Å; D335-K337 PolarHBondContact O-N 2.99Å; K337-T340 PolarHBondContact O-N 2.97Å; K337-A341 WeakPolarHBondContact O-CB 3.3Å; K337-A341 PolarHBondContact O-N 3.2Å
338T84.1Confident76.3Confident72 Ų7293.8 Ų93.844%0.44254%0.542SS..Hα-helixtrans-62.4-45.9178.5-55.70000111.6T334 D335 T340 A341 I342T334-T338 PolarHBondContact O-N 3.14Å; T334-T338 PolarHBondContact O-OG1 2.91Å; T334-T338 VanDerWaalsContact O-OG1 3.13Å; D335-T338 PolarHBondContact O-N 3.1Å; T338-T340 PolarHBondContact O-N 3.43Å; T338-A341 PolarHBondContact O-N 2.84Å; T338-I342 HydrophobicContact CG2-CD1 3.97Å; T338-I342 VanDerWaalsContact O-CG1 3.3Å; T338-I342 WeakPolarHBondContact O-CG1 3.36Å; T338-I342 PolarHBondContact O-N 2.86Å
339L84.9Confident78.2Confident114 Ų11490.1 Ų90.160%0.59753%0.53SS*.Hα-helixtrans-63.1-39.9175.3-177.4147.1000111.9D335 I342 L343D335-L339 WeakPolarHBondContact O-CB 3.37Å; D335-L339 PolarHBondContact O-N 3.11Å; L339-I342 PolarHBondContact O-N 3.34Å; L339-L343 VanDerWaalsContact O-CB 3.29Å; L339-L343 WeakPolarHBondContact O-CB 3.45Å; L339-L343 PolarHBondContact O-N 3.11Å
340T86.6Confident80.2Confident85 Ų8587.8 Ų87.852%0.52152%0.518SS..Hα-helixtrans-63.7-42.1173.7-58.90000111.3N336 K337 T338 L343 A344N336-T340 WeakPolarHBondContact O-CB 3.09Å; N336-T340 PolarHBondContact O-N 3.31Å; N336-T340 PolarHBondContact O-OG1 3.18Å; K337-T340 PolarHBondContact O-N 2.97Å; T338-T340 PolarHBondContact O-N 3.43Å; T340-L343 PolarHBondContact O-N 3.03Å; T340-A344 VanDerWaalsContact O-CB 3.27Å; T340-A344 WeakPolarHBondContact O-CB 3.49Å; T340-A344 PolarHBondContact O-N 3.01Å
341A89.1Confident82.1Confident61 Ų6188.3 Ų88.350%0.50451%0.507SS..Hα-helixtrans-65.9-41.4177.300000112.6K337 T338 S345K337-A341 WeakPolarHBondContact O-CB 3.3Å; K337-A341 PolarHBondContact O-N 3.2Å; T338-A341 PolarHBondContact O-N 2.84Å; A341-S345 VanDerWaalsContact O-CB 3.27Å; A341-S345 WeakPolarHBondContact O-CB 3.31Å; A341-S345 PolarHBondContact O-N 3.15Å
342I92.6Very high84.2Confident111 Ų11187.4 Ų87.457%0.56950%0.504SS*.Hα-helixtrans-62.8-46174.3-69.1164.8000110.5T338 L339 S345 C346T338-I342 HydrophobicContact CG2-CD1 3.97Å; T338-I342 VanDerWaalsContact O-CG1 3.3Å; T338-I342 WeakPolarHBondContact O-CG1 3.36Å; T338-I342 PolarHBondContact O-N 2.86Å; L339-I342 PolarHBondContact O-N 3.34Å; I342-S345 PolarHBondContact O-N 2.89Å; I342-C346 VanDerWaalsContact O-CB 3.32Å; I342-C346 WeakPolarHBondContact O-CB 3.39Å; I342-C346 PolarHBondContact O-N 3.29Å
343L91.6Very high86.1Confident121 Ų12186.9 Ų86.963%0.63450%0.504SS*.Hα-helixtrans-65.5-41.2179.7-173.962.7000112L339 T340 G347L339-L343 VanDerWaalsContact O-CB 3.29Å; L339-L343 WeakPolarHBondContact O-CB 3.45Å; L339-L343 PolarHBondContact O-N 3.11Å; T340-L343 PolarHBondContact O-N 3.03Å; L343-G347 PolarHBondContact O-N 3.05Å
344A94.2Very high88Confident61 Ų6188.9 Ų88.950%0.50451%0.51SS..Hα-helixtrans-64.8-43.5175.100000112.2T340 G347 A348T340-A344 VanDerWaalsContact O-CB 3.27Å; T340-A344 WeakPolarHBondContact O-CB 3.49Å; T340-A344 PolarHBondContact O-N 3.01Å; A344-G347 PolarHBondContact O-N 3.46Å; A344-A348 WeakPolarHBondContact O-CB 3.1Å; A344-A348 PolarHBondContact O-N 3.12Å
345S96.1Very high89.8Confident70 Ų7090.5 Ų90.549%0.4952%0.516SS..Hα-helixtrans-61.1-48175.3-177.50000111.7A341 I342 G347 A348 L349A341-S345 VanDerWaalsContact O-CB 3.27Å; A341-S345 WeakPolarHBondContact O-CB 3.31Å; A341-S345 PolarHBondContact O-N 3.15Å; I342-S345 PolarHBondContact O-N 2.89Å; S345-G347 PolarHBondContact O-N 3.46Å; S345-A348 PolarHBondContact O-N 2.9Å; S345-L349 WeakPolarHBondContact O-CG 3.49Å; S345-L349 PolarHBondContact O-N 3.03Å
346C95.2Very high91.1Very high64 Ų6489.2 Ų89.243%0.43251%0.508SS..Hα-helixtrans-60.3-45.8176.1-172.50000111.9I342 A348 L349 L350I342-C346 VanDerWaalsContact O-CB 3.32Å; I342-C346 WeakPolarHBondContact O-CB 3.39Å; I342-C346 PolarHBondContact O-N 3.29Å; C346-A348 PolarHBondContact O-N 3.46Å; C346-L349 PolarHBondContact O-N 2.98Å; C346-L350 WeakPolarHBondContact O-CG 3.41Å; C346-L350 PolarHBondContact O-N 3.43Å
347G95.1Very high92.1Very high29 Ų2986.6 Ų86.630%0.29950%0.503SS..Hα-helixtrans-60-44.2175.800000113.1L343 A344 S345 L350 I351L343-G347 PolarHBondContact O-N 3.05Å; A344-G347 PolarHBondContact O-N 3.46Å; S345-G347 PolarHBondContact O-N 3.46Å; G347-L350 PolarHBondContact O-N 3.3Å; G347-I351 VanDerWaalsContact O-CG1 3.29Å; G347-I351 WeakPolarHBondContact O-CG1 3.32Å; G347-I351 PolarHBondContact O-N 3.02Å
348A94.9Very high92.5Very high59 Ų5983.6 Ų83.649%0.48850%0.495SS..Hα-helixtrans-63.4-41.5176.900000112.4A344 S345 C346 I351 M352A344-A348 WeakPolarHBondContact O-CB 3.1Å; A344-A348 PolarHBondContact O-N 3.12Å; S345-A348 PolarHBondContact O-N 2.9Å; C346-A348 PolarHBondContact O-N 3.46Å; A348-I351 PolarHBondContact O-N 3.41Å; A348-M352 WeakPolarHBondContact O-CB 3.26Å; A348-M352 PolarHBondContact O-N 2.87Å
349L94.9Very high92.7Very high90 Ų9083.1 Ų83.147%0.47149%0.494SS..Hα-helixtrans-63.9-44175.5-71.6169.6000112S345 C346 I351 M352 I353S345-L349 WeakPolarHBondContact O-CG 3.49Å; S345-L349 PolarHBondContact O-N 3.03Å; C346-L349 PolarHBondContact O-N 2.98Å; L349-I351 PolarHBondContact O-N 2.86Å; L349-M352 HydrophobicContact CD2-CE 4.32Å; L349-M352 WeakPolarHBondContact O-CB 3.42Å; L349-M352 PolarHBondContact O-N 3.43Å; L349-I353 WeakPolarHBondContact O-CD1 3.47Å; L349-I353 VanDerWaalsContact O-CG1 3.27Å; L349-I353 WeakPolarHBondContact O-CG1 3.45Å; L349-I353 PolarHBondContact O-N 2.91Å
350L95.9Very high92.9Very high99 Ų9981.2 Ų81.252%0.51849%0.487SS..Hα-helixtrans-62.2-43.3176.3-70.7171.3000111.9C346 G347 I353 I354C346-L350 WeakPolarHBondContact O-CG 3.41Å; C346-L350 PolarHBondContact O-N 3.43Å; G347-L350 PolarHBondContact O-N 3.3Å; L350-I353 PolarHBondContact O-N 3.45Å; L350-I354 VanDerWaalsContact O-CG1 3.28Å; L350-I354 WeakPolarHBondContact O-CG1 3.29Å; L350-I354 PolarHBondContact O-N 3.31Å
351I95.1Very high92.7Very high96 Ų9680.9 Ų80.949%0.49249%0.488SS..Hα-helixtrans-62.8-43.3175.6-68.9165.3000110.7G347 A348 L349 I353 I354 I355G347-I351 VanDerWaalsContact O-CG1 3.29Å; G347-I351 WeakPolarHBondContact O-CG1 3.32Å; G347-I351 PolarHBondContact O-N 3.02Å; A348-I351 PolarHBondContact O-N 3.41Å; L349-I351 PolarHBondContact O-N 2.86Å; I351-I353 PolarHBondContact O-N 3.49Å; I351-I354 PolarHBondContact O-N 2.87Å; I351-I355 HydrophobicContact CG2-CD1 3.77Å; I351-I355 HydrophobicContact CG2-CG1 4.47Å; I351-I355 VanDerWaalsContact O-CG1 3.31Å; I351-I355 WeakPolarHBondContact O-CG1 3.19Å; I351-I355 PolarHBondContact O-N 2.89Å
352M94.8Very high92.2Very high102 Ų10284.5 Ų84.550%0.50250%0.495SS..Hα-helixtrans-59-47.1175.6-171.5-159.4-59.200111.5A348 L349 I354 I355 L356A348-M352 WeakPolarHBondContact O-CB 3.26Å; A348-M352 PolarHBondContact O-N 2.87Å; L349-M352 HydrophobicContact CD2-CE 4.32Å; L349-M352 WeakPolarHBondContact O-CB 3.42Å; L349-M352 PolarHBondContact O-N 3.43Å; M352-I354 PolarHBondContact O-N 3.46Å; M352-I355 PolarHBondContact O-N 2.97Å; M352-L356 HydrophobicContact CG-CD1 4.2Å; M352-L356 WeakPolarHBondContact O-CB 3.48Å; M352-L356 PolarHBondContact O-N 2.87Å
353I94.9Very high91.3Very high111 Ų11190 Ų9057%0.56951%0.508SS*.Hα-helixtrans-62.8-41.2179.3-68.9163000111.1L349 L350 I351 L356 G357L349-I353 WeakPolarHBondContact O-CD1 3.47Å; L349-I353 VanDerWaalsContact O-CG1 3.27Å; L349-I353 WeakPolarHBondContact O-CG1 3.45Å; L349-I353 PolarHBondContact O-N 2.91Å; L350-I353 PolarHBondContact O-N 3.45Å; I351-I353 PolarHBondContact O-N 3.49Å; I353-L356 PolarHBondContact O-N 3.19Å; I353-G357 PolarHBondContact O-N 3Å
354I95.1Very high90.1Very high113 Ų11393.8 Ų93.858%0.57951%0.514SS*.Hα-helixtrans-63.4-45.5175.8-69.1164000110.7L350 I351 M352 G357 V358L350-I354 VanDerWaalsContact O-CG1 3.28Å; L350-I354 WeakPolarHBondContact O-CG1 3.29Å; L350-I354 PolarHBondContact O-N 3.31Å; I351-I354 PolarHBondContact O-N 2.87Å; M352-I354 PolarHBondContact O-N 3.46Å; I354-G357 PolarHBondContact O-N 3.25Å; I354-V358 WeakPolarHBondContact O-CB 3.26Å; I354-V358 VanDerWaalsContact O-CG2 3.29Å; I354-V358 WeakPolarHBondContact O-CG2 3.46Å; I354-V358 PolarHBondContact O-N 2.85Å
355I93.9Very high88.5Confident92 Ų9298.9 Ų98.947%0.47253%0.525SS..Hα-helixtrans-61.9-46.5177.2-68.4167.4000110.6I351 M352 V358 C359I351-I355 HydrophobicContact CG2-CD1 3.77Å; I351-I355 HydrophobicContact CG2-CG1 4.47Å; I351-I355 VanDerWaalsContact O-CG1 3.31Å; I351-I355 WeakPolarHBondContact O-CG1 3.19Å; I351-I355 PolarHBondContact O-N 2.89Å; M352-I355 PolarHBondContact O-N 2.97Å; I355-V358 PolarHBondContact O-N 3.12Å; I355-C359 WeakPolarHBondContact O-CB 3.31Å; I355-C359 PolarHBondContact O-N 3.45Å; I355-C359 PolarHBondContact O-SG 3.38Å
356L91.9Very high86.5Confident100 Ų100100.2 Ų100.252%0.52453%0.532SS..Hα-helixtrans-61.6-45176.4-98.159.9000111.9M352 I353 V358 C359 V360M352-L356 HydrophobicContact CG-CD1 4.2Å; M352-L356 WeakPolarHBondContact O-CB 3.48Å; M352-L356 PolarHBondContact O-N 2.87Å; I353-L356 PolarHBondContact O-N 3.19Å; L356-V358 VanDerWaalsContact C-N 3.34Å; L356-V358 PolarHBondContact O-N 2.99Å; L356-C359 PolarHBondContact O-N 2.89Å; L356-V360 WeakPolarHBondContact O-CB 3.26Å; L356-V360 WeakPolarHBondContact O-CG2 3.22Å; L356-V360 PolarHBondContact O-N 3.46Å
357G92Very high84.5Confident36 Ų36102.3 Ų102.337%0.37153%0.532SS..Hα-helixtrans-60.7-41.3176.700000112.6I353 I354 S361I353-G357 PolarHBondContact O-N 3Å; I354-G357 PolarHBondContact O-N 3.25Å; G357-S361 VanDerWaalsContact O-CB 3.25Å; G357-S361 WeakPolarHBondContact O-CB 3.27Å; G357-S361 PolarHBondContact O-N 3.29Å; G357-S361 PolarHBondContact O-OG 3.47Å
358V90.8Very high82.6Confident69 Ų69104.6 Ų104.642%0.41854%0.537SS..Hα-helixtrans-66.7-45.7174.1169.10000111.2I354 I355 L356 S361 Q362I354-V358 WeakPolarHBondContact O-CB 3.26Å; I354-V358 VanDerWaalsContact O-CG2 3.29Å; I354-V358 WeakPolarHBondContact O-CG2 3.46Å; I354-V358 PolarHBondContact O-N 2.85Å; I355-V358 PolarHBondContact O-N 3.12Å; L356-V358 VanDerWaalsContact C-N 3.34Å; L356-V358 PolarHBondContact O-N 2.99Å; V358-S361 PolarHBondContact O-N 2.87Å; V358-Q362 HydrophobicContact CG1-CG 4.48Å; V358-Q362 VanDerWaalsContact CG1-NE2 3.29Å; V358-Q362 WeakPolarHBondContact O-CB 3.03Å; V358-Q362 VanDerWaalsContact O-CG 3.3Å; V358-Q362 WeakPolarHBondContact O-CG 3.29Å; V358-Q362 PolarHBondContact O-N 3.48Å
359C87.5Confident80.8Confident62 Ų62108.5 Ų108.542%0.41955%0.545SS..Hα-helixtrans-63.1-43.4177.5-73.60000112.3I355 L356 Q362 R363I355-C359 WeakPolarHBondContact O-CB 3.31Å; I355-C359 PolarHBondContact O-N 3.45Å; I355-C359 PolarHBondContact O-SG 3.38Å; L356-C359 PolarHBondContact O-N 2.89Å; C359-Q362 PolarHBondContact O-N 3.12Å; C359-R363 WeakPolarHBondContact O-CB 3.37Å; C359-R363 WeakPolarHBondContact O-CG 3.44Å; C359-R363 PolarHBondContact O-N 3.42Å
360V87.9Confident78.9Confident74 Ų74109.1 Ų109.145%0.44855%0.549SS..Hα-helixtrans-65.1-40.6175.1171.60000110.7L356 Q362 R363 R364L356-V360 WeakPolarHBondContact O-CB 3.26Å; L356-V360 WeakPolarHBondContact O-CG2 3.22Å; L356-V360 PolarHBondContact O-N 3.46Å; V360-Q362 PolarHBondContact O-N 2.96Å; V360-R363 PolarHBondContact O-N 3.02Å; V360-R364 HydrophobicContact CG1-CG 4.3Å; V360-R364 WeakPolarHBondContact O-CB 3.19Å; V360-R364 WeakPolarHBondContact O-CG 3.09Å; V360-R364 PolarHBondContact O-N 3.02Å
361S82.9Confident76.9Confident78 Ų78109.6 Ų109.655%0.54555%0.548SS..Hα-helixtrans-64.3-38.2176-60.60000112.6G357 V358 K365G357-S361 VanDerWaalsContact O-CB 3.25Å; G357-S361 WeakPolarHBondContact O-CB 3.27Å; G357-S361 PolarHBondContact O-N 3.29Å; G357-S361 PolarHBondContact O-OG 3.47Å; V358-S361 PolarHBondContact O-N 2.87Å; S361-K365 VanDerWaalsContact O-CB 3.3Å; S361-K365 WeakPolarHBondContact O-CB 3.48Å; S361-K365 PolarHBondContact O-N 3.46Å
362Q78.9Confident75Confident138 Ų138110.9 Ų110.965%0.64556%0.556SS**Hα-helixtrans-70.6-35.9173.5-71.6175.114.500112.3V358 C359 V360V358-Q362 HydrophobicContact CG1-CG 4.48Å; V358-Q362 VanDerWaalsContact CG1-NE2 3.29Å; V358-Q362 WeakPolarHBondContact O-CB 3.03Å; V358-Q362 VanDerWaalsContact O-CG 3.3Å; V358-Q362 WeakPolarHBondContact O-CG 3.29Å; V358-Q362 PolarHBondContact O-N 3.48Å; C359-Q362 PolarHBondContact O-N 3.12Å; V360-Q362 PolarHBondContact O-N 2.96Å
363R73.3Confident73.1Confident227 Ų227112.1 Ų112.186%0.85756%0.56SS**Hα-helixtrans-72.2-31.4176.5-72-71.7-171.5-167.31.7113.2C359 V360C359-R363 WeakPolarHBondContact O-CB 3.37Å; C359-R363 WeakPolarHBondContact O-CG 3.44Å; C359-R363 PolarHBondContact O-N 3.42Å; V360-R363 PolarHBondContact O-N 3.02Å
364R67.8Low71.1Confident199 Ų199111.7 Ų111.775%0.75156%0.558SS**Hα-helixtrans-84.5-10.3179.5-73-174174.4-150.4-2.4114.3V360 Y367V360-R364 HydrophobicContact CG1-CG 4.3Å; V360-R364 WeakPolarHBondContact O-CB 3.19Å; V360-R364 WeakPolarHBondContact O-CG 3.09Å; V360-R364 PolarHBondContact O-N 3.02Å; R364-Y367 PolarHBondContact O-N 3.14Å
365K58.9Low69.1Low168 Ų168109.8 Ų109.873%0.7355%0.552SS**THydrogen-bonded Turntrans-124.696.5-173.7-157.4170-169.7173.50110.2S361S361-K365 VanDerWaalsContact O-CB 3.3Å; S361-K365 WeakPolarHBondContact O-CB 3.48Å; S361-K365 PolarHBondContact O-N 3.46Å
366P54.9Low67.3Low99 Ų99111.5 Ų111.564%0.64356%0.558SS**THydrogen-bonded Turncis-125.4114.320.435.5-17.1000114.7N368P366-N368 WeakPolarHBondContact CA-OD1 3.24Å
367Y53.1Low65.4Low107 Ų107113.3 Ų113.342%0.4256%0.564SS.*  trans-1217155.2-160.3-111.6000112.1R364 E369 N370 Q371R364-Y367 PolarHBondContact O-N 3.14Å; Y367-E369 PolarHBondContact O-N 3.14Å; Y367-E369 VanDerWaalsContact O-N 3.16Å; Y367-N370 HydrophobicContact CD2-CB 4.42Å; Y367-N370 HydrophobicContact CE2-CB 3.95Å; Y367-Q371 HydrophobicContact CD1-CB 3.65Å; Y367-Q371 HydrophobicContact CD1-CG 4.15Å; Y367-Q371 HydrophobicContact CE1-CB 3.73Å; Y367-Q371 HydrophobicContact CE1-CG 4.06Å; Y367-Q371 WeakPolarHBondContact O-CB 3.35Å; Y367-Q371 PolarHBondContact O-N 3.24Å; Y367-Q371 VanDerWaalsContact O-N 3.15Å
368N55.2Low63.7Low78 Ų78118 Ų11842%0.41758%0.58SS.*THydrogen-bonded Turntrans-72.72.6-17858.5-93.1000115.6P366P366-N368 WeakPolarHBondContact CA-OD1 3.24Å
369E58.3Low61.7Low141 Ų141121.7 Ų121.766%0.65959%0.592SS**THydrogen-bonded Turntrans-108.9-51.8178.8-78.3156.3-126.800110.2Y367 Q371Y367-E369 PolarHBondContact O-N 3.14Å; Y367-E369 VanDerWaalsContact O-N 3.16Å; E369-Q371 PolarHBondContact O-N 3.21Å
370N54.6Low60.1Low103 Ų103123.4 Ų123.455%0.55160%0.601SS**Hα-helixtrans-69.6-30175.5-62.1-44.3000113.3Y367 L374Y367-N370 HydrophobicContact CD2-CB 4.42Å; Y367-N370 HydrophobicContact CE2-CB 3.95Å; N370-L374 PolarHBondContact O-N 3.25Å
371Q53.2Low58.4Low108 Ų108125.4 Ų125.451%0.50561%0.613SS.*Hα-helixtrans-75-27.6-176.6-163.4156.154.400113.5Y367 E369 L374 T375Y367-Q371 HydrophobicContact CD1-CB 3.65Å; Y367-Q371 HydrophobicContact CD1-CG 4.15Å; Y367-Q371 HydrophobicContact CE1-CB 3.73Å; Y367-Q371 HydrophobicContact CE1-CG 4.06Å; Y367-Q371 WeakPolarHBondContact O-CB 3.35Å; Y367-Q371 PolarHBondContact O-N 3.24Å; Y367-Q371 VanDerWaalsContact O-N 3.15Å; E369-Q371 PolarHBondContact O-N 3.21Å; Q371-L374 PolarHBondContact O-N 2.04Å; Q371-T375 WeakPolarHBondContact O-CG2 2.94Å; Q371-T375 PolarHBondContact O-N 2.75Å; Q371-T375 PolarHBondContact O-OG1 3.36Å; Q371-T375 VanDerWaalsContact O-OG1 3.06Å
372L56.1Low57.2Low123 Ų123129.9 Ų129.964%0.64463%0.625SS**Hα-helixtrans-63.3-47.5173.9-81.5168.8000110.8L374 T375 E376L372-L374 VanDerWaalsContact C-N 3.33Å; L372-L374 PolarHBondContact O-N 3.18Å; L372-T375 WeakPolarHBondContact CA-OG1 3.13Å; L372-T375 PolarHBondContact O-N 2.9Å; L372-T375 VanDerWaalsContact O-N 3.09Å; L372-T375 PolarHBondContact O-OG1 2.97Å; L372-E376 PolarHBondContact O-N 3.45Å
373H53.1Low55.9Low128 Ų128129.4 Ų129.459%0.59363%0.627SS**Hα-helixtrans-61.2-39.3177.1-153-141.2000111.9E376 E377H373-E376 PolarHBondContact O-N 3.21Å; H373-E377 PolarHBondContact O-N 2.86Å
374L53.6Low55.3Low102 Ų102121.6 Ų121.653%0.53462%0.617SS.*Hα-helixtrans-72.5-24.1174.2-97.665.6000114.1N370 Q371 L372 L378N370-L374 PolarHBondContact O-N 3.25Å; Q371-L374 PolarHBondContact O-N 2.04Å; L372-L374 VanDerWaalsContact C-N 3.33Å; L372-L374 PolarHBondContact O-N 3.18Å; L374-L378 WeakPolarHBondContact O-CB 3.33Å; L374-L378 PolarHBondContact O-N 3.09Å
375T53.9Low54.4Low73 Ų73121.2 Ų121.245%0.44862%0.617SS.*Hα-helixtrans-83.7-18.9172.849.90000113.5Q371 L372 H379Q371-T375 WeakPolarHBondContact O-CG2 2.94Å; Q371-T375 PolarHBondContact O-N 2.75Å; Q371-T375 PolarHBondContact O-OG1 3.36Å; Q371-T375 VanDerWaalsContact O-OG1 3.06Å; L372-T375 WeakPolarHBondContact CA-OG1 3.13Å; L372-T375 PolarHBondContact O-N 2.9Å; L372-T375 VanDerWaalsContact O-N 3.09Å; L372-T375 PolarHBondContact O-OG1 2.97Å; T375-H379 VanDerWaalsContact O-CB 3.29Å; T375-H379 WeakPolarHBondContact O-CB 3.49Å; T375-H379 PolarHBondContact O-N 2.81Å
376E55.3Low54.2Low129 Ų129120.9 Ų120.960%0.60362%0.618SS**Hα-helixtrans-70.5-53.1169.7-170165.8-171.600109.6L372 H373 L378 H379 T380L372-E376 PolarHBondContact O-N 3.45Å; H373-E376 PolarHBondContact O-N 3.21Å; E376-L378 VanDerWaalsContact C-N 3.31Å; E376-L378 PolarHBondContact O-N 2.97Å; E376-H379 PolarHBondContact O-N 2.86Å; E376-T380 WeakPolarHBondContact O-CG2 3.49Å; E376-T380 PolarHBondContact O-N 2.59Å; E376-T380 PolarHBondContact O-OG1 3.4Å
377E53.3Low54Low137 Ų137123.4 Ų123.464%0.6463%0.626SS**Hα-helixtrans-64.6-24.9178.8-69.2-70.3120.300114.8H373 T380 V381H373-E377 PolarHBondContact O-N 2.86Å; E377-T380 PolarHBondContact O-OG1 3.29Å; E377-V381 WeakPolarHBondContact O-CG2 3.19Å
378L54.5Low53.6Low135 Ų135123.6 Ų123.671%0.70763%0.634SS**Hα-helixtrans-90.2-27.1-179.4-162.570.6000113.3L374 E376L374-L378 WeakPolarHBondContact O-CB 3.33Å; L374-L378 PolarHBondContact O-N 3.09Å; E376-L378 VanDerWaalsContact C-N 3.31Å; E376-L378 PolarHBondContact O-N 2.97Å
379H49.3Very low53.7Low147 Ų147125.7 Ų125.768%0.68165%0.652SS**Hα-helixtrans-91.7-19.7-173.8-148.7-173.8000112.6T375 E376 V381T375-H379 VanDerWaalsContact O-CB 3.29Å; T375-H379 WeakPolarHBondContact O-CB 3.49Å; T375-H379 PolarHBondContact O-N 2.81Å; E376-H379 PolarHBondContact O-N 2.86Å; H379-V381 VanDerWaalsContact C-N 3.26Å; H379-V381 PolarHBondContact O-N 3.06Å
380T53.5Low53.2Low98 Ų98123.9 Ų123.960%0.60165%0.651SS**THydrogen-bonded Turntrans-68.9-20.7169.948.20000113.4E376 E377E376-T380 WeakPolarHBondContact O-CG2 3.49Å; E376-T380 PolarHBondContact O-N 2.59Å; E376-T380 PolarHBondContact O-OG1 3.4Å; E377-T380 PolarHBondContact O-OG1 3.29Å
381V52.9Low53Low115 Ų115126 Ų12670%0.69766%0.662SS**THydrogen-bonded Turntrans-82.1-19.4-178.3-150.70000113.2E377 H379E377-V381 WeakPolarHBondContact O-CG2 3.19Å; H379-V381 VanDerWaalsContact C-N 3.26Å; H379-V381 PolarHBondContact O-N 3.06Å
382E56.7Low52.9Low172 Ų172129.7 Ų129.780%0.80468%0.679SS**THydrogen-bonded Turntrans-95-24.3179.4-163.9172.9154.700113.1G384E382-G384 PolarHBondContact O-N 3.25Å
383N52.1Low52.8Low128 Ų128129.1 Ų129.168%0.68468%0.68SS**  trans-80.954.7179.8-159.699000112.8Y385N383-Y385 VanDerWaalsContact C-N 3.27Å; N383-Y385 PolarHBondContact O-N 2.64Å
384G61Low52.4Low63 Ų63131.3 Ų131.365%0.64969%0.692SS**  trans-74.367176.500000113.8E382E382-G384 PolarHBondContact O-N 3.25Å
385Y48.3Very low52.7Low191 Ų191135.3 Ų135.375%0.74971%0.709SS**  trans-136109.4163.9-138-102.3000108.3N383 D387N383-Y385 VanDerWaalsContact C-N 3.27Å; N383-Y385 PolarHBondContact O-N 2.64Å; Y385-D387 PolarHBondContact O-N 2.79Å; Y385-D387 VanDerWaalsContact O-N 3.15Å
386H55Low52.5Low161 Ų161138.4 Ų138.475%0.74573%0.727SS**  58.824.277.4-65.8-65000114.7
387D51.9Low52Low152 Ų152140.5 Ų140.581%0.81374%0.737SS**  trans-90.5106.8146.4-144.3-26.7000109.1Y385 P389Y385-D387 PolarHBondContact O-N 2.79Å; Y385-D387 VanDerWaalsContact O-N 3.15Å; D387-P389 WeakPolarHBondContact O-CD 3.25Å
388N44.7Very low52Low111 Ų111138.1 Ų138.159%0.59473%0.733SS**  trans-110.899.8-175.417429.6000107.3T390N388-T390 PolarHBondContact O-N 3.1Å; N388-T390 WeakPolarHBondContact OD1-CB 3.33Å; N388-T390 PolarHBondContact OD1-OG1 3.02Å
389P55.6Low52.2Low123 Ų123139.4 Ų139.480%0.79974%0.736SS**  trans-75.949.1-177.433.4-37.3000112D387D387-P389 WeakPolarHBondContact O-CD 3.25Å
390T49Very low51.8Low102 Ų102139.6 Ų139.663%0.62674%0.739SS**  trans-124.736.4-176.7-420000110.1N388N388-T390 PolarHBondContact O-N 3.1Å; N388-T390 WeakPolarHBondContact OD1-CB 3.33Å; N388-T390 PolarHBondContact OD1-OG1 3.02Å
391L50.7Low51.5Low149 Ų149141.3 Ų141.378%0.7874%0.74SS**  trans-150.236.2168.1-136.6128.6000116.1V393L391-V393 HydrophobicContact CD2-CG2 3.95Å; L391-V393 HydrophobicContact CG-CG2 3.89Å
392E51.1Low51.5Low185 Ų185144.9 Ų144.986%0.86475%0.749SS**  trans-109.6101.7137.152.3-178.6-174.600106
393V53.9Low51Low110 Ų110145.2 Ų145.267%0.66775%0.748SS**  cis55.160.545.5-162.90000111.5L391L391-V393 HydrophobicContact CD2-CG2 3.95Å; L391-V393 HydrophobicContact CG-CG2 3.89Å
394M43.7Very low50.7Low174 Ų174148 Ų14886%0.85775%0.754SS**  trans-122.8129.3133.3-115.6-179.662.900109.4V396M394-V396 PolarHBondContact O-N 2.84Å
395E59.5Low49.9Very low187 Ų187154.3 Ų154.387%0.87477%0.768SS**  trans-72.2114.6-176.7-60.7162.4105.500110.7
396V50.4Low49.8Very low137 Ų137150 Ų15083%0.8377%0.772SS**  trans-133.7127.5154.1-171.30000108.5M394M394-V396 PolarHBondContact O-N 2.84Å
397Q44.5Very low49.4Very low174 Ų174150.3 Ų150.381%0.81378%0.779SS**  trans-85-175.2-172-135.1-153-15.300111.4
398P54.1Low48.9Very low86 Ų86150.9 Ų150.956%0.55878%0.782SS**  -116.5-155.7-117.937.8-17.9000112.3
399E58.1Low48.9Very low163 Ų163148.5 Ų148.576%0.76278%0.784SS**  trans48.3108.8137.1-170.7-175.5167.600118.1
400M41.7Very low48.5Very low151 Ų151151.1 Ų151.174%0.74479%0.785SS**  trans-174.9140.4133.9-95.9-90.4168.400112.6
401Q47.3Very low48.3Very low134 Ų134156.2 Ų156.263%0.62680%0.799SS**  trans69.270.3149.4-64.8175.93800119.7K403Q401-K403 PolarHBondContact O-N 3.48Å
402E51.7Low48.1Very low190 Ų190153.3 Ų153.389%0.88879%0.791SS**  -0.364.3109.552.5165.1176.400118.5
403K46.3Very low47.6Very low179 Ų179151.6 Ų151.678%0.77879%0.788SS**  trans-163.5137.3162.8-110.2153.7-174.9158.60109.8Q401Q401-K403 PolarHBondContact O-N 3.48Å
404K46.8Very low47.5Very low187 Ų187151.5 Ų151.581%0.81379%0.793SS**  cis-138.8151.819.5-59.5170.6-177.2170.40111.2
405M43.6Very low47.8Very low194 Ų194155.3 Ų155.396%0.95680%0.798SS**  trans-64.1135.4157.4-67.5161.6170.400110
406A45.2Very low47.3Very low101 Ų101153.9 Ų153.984%0.83579%0.794SS**  trans-139.992.5166.700000108.1N408A406-N408 PolarHBondContact O-N 2.8Å
407L47.2Very low47.1Very low168 Ų168152.7 Ų152.788%0.8879%0.787SS**  trans-78.5112.9-172.1176146.5000111.1
408N42.1Very low47.1Very low163 Ų163150.6 Ų150.687%0.87279%0.788SS**  trans-175.2135.1155.4-125.218.4000109.3A406A406-N408 PolarHBondContact O-N 2.8Å
409G44.7Very low46.8Very low62 Ų62153.3 Ų153.364%0.63980%0.797SS**  cis-175138.6-9.100000111
410E46.7Very low46Very low178 Ų178151.8 Ų151.883%0.83279%0.794SS**  trans3494.2152.4-165.7169.8-169.100119
411F46Very low45.9Very low208 Ų208151.8 Ų151.891%0.91280%0.797SS**  trans-146.4117.2134.4-96.3-68.9000111
412S46.5Very low45.8Very low88 Ų88152 Ų15262%0.61580%0.802SS**  trans-71.7163.4167.935.80000111.5
413D39.9Very low45.3Very low149 Ų149151 Ų15180%0.79780%0.799SS**  cis-163.5-178.3-6-119.4-48000110.2
414S52.5Low45.1Very low109 Ų109151.7 Ų151.776%0.76280%0.802SS**  trans68.469.8151.4-60.80000120.3
415W48.9Very low45Very low254 Ų254151 Ų15196%0.96280%0.802SS**  trans-141.739.1139.195-76.4000113.9
416I48.3Very low44.9Very low156 Ų156149.6 Ų149.680%0.880%0.798SS**  trans-146.1126.8176.3-115166.9000104.6
417V46.3Very low45.1Very low113 Ų113149 Ų14969%0.68579%0.793SS**  cis-141.6150.810-166.30000109.7I419V417-I419 PolarHBondContact O-N 2.94Å
418P45.2Very low45.1Very low129 Ų129145.9 Ų145.984%0.83878%0.783SS**  trans-82.1101.4153.7-18.634.6000112.2
419I48.6Very low45.4Very low144 Ų144144.6 Ų144.674%0.73878%0.776SS**  trans-42.4142.9166.740.9171.3000116.6V417V417-I419 PolarHBondContact O-N 2.94Å
420D40.2Very low46Very low130 Ų130149.2 Ų149.270%0.69578%0.781SS**  trans45.4110.1142.7-60.7-64.1000121.9
421N39.2Very low46.6Very low151 Ų151148 Ų14881%0.80778%0.775SS**  -158.7113122.7-96.4-38000107.6
422L45.8Very low47.3Very low140 Ų140145 Ų14573%0.73377%0.769SS**  73.92951.1-134177.8000114.3
423M42Very low48Very low168 Ų168146.2 Ų146.283%0.82877%0.773SS**  trans-126128.1155.1-64.1168.463.900106.6
424K42Very low48.8Very low193 Ų193147.1 Ų147.184%0.83977%0.772SS**  cis84.234.72.8-124.9-161.9-177.2-152.50119.3
425E44.7Very low48.5Very low174 Ų174153.8 Ų153.881%0.81380%0.797SS**  trans-147.6116.6136.6-97.4169.2161.400102.7
426D41.3Very low48.4Very low164 Ų164148.8 Ų148.888%0.87779%0.789SS**  63.4114.753.4-146.628.5000111.7
427A49Very low48.5Very low87 Ų87148.4 Ų148.472%0.71979%0.789SS**  trans-91150.2-176.500000109.4
428P48Very low48.6Very low104 Ų104150.4 Ų150.468%0.67579%0.794SS**  -147.7178.676.243.3-27.5000115
429D47.2Very low48.8Very low135 Ų135151.6 Ų151.672%0.72279%0.792SS**  trans63.9158.5152.4-59.9-23.2000117.8
430E58.6Low48.8Very low160 Ų160152.1 Ų152.175%0.74880%0.795SS**  cis-150.6166.8-7.2-127.7168.9172.200110.2
431E57.7Low49.4Very low152 Ų152153.6 Ų153.671%0.7180%0.802SS**  trans40.2105.3159.5-56.1-163.5130.500121.4T433E431-T433 HydrophobicContact CB-CG2 3.96Å; E431-T433 PolarHBondContact O-N 3.01Å
432D60.9Low50.1Low146 Ų146153.8 Ų153.878%0.78180%0.801SS**  trans-70.188.1153178.119.3000110.3H434D432-H434 PolarHBondContact O-N 3.26Å
433T62.7Low50.4Low113 Ų113154.8 Ų154.869%0.69381%0.807SS**  trans-78.589.3177.862.30000111.4E431E431-T433 HydrophobicContact CB-CG2 3.96Å; E431-T433 PolarHBondContact O-N 3.01Å
434H54.9Low51.1Low168 Ų168153.8 Ų153.878%0.77881%0.805SS**  trans-28.7132171.4-69.8-82.4000116.3D432D432-H434 PolarHBondContact O-N 3.26Å
435L46.4Very low51.9Low249 Ų249150.2 Ų150.2100%1.30480%0.802SS**  trans-163.20138.6-111.5160.9000113.4

Retrieved 435 of 435 residues in 196.3 ms (Link to these results)