A0A077ZF24_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZF24, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 107 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
1M41.8Very low54.7Low239 Ų239144.8 Ų144.8100%1.17782%0.822SS**  01010-60.7-79.1-103.400105.6
2S47.3Very low55.9Low117 Ų117148.3 Ų148.382%0.81883%0.826SS**  trans-70.5131.4-172.2-58.60000110.4T4S2-T4 PolarHBondContact O-N 2.64Å
3L52.9Low56.6Low175 Ų175146.8 Ų146.892%0.91681%0.814SS**  trans-69.893.5171.9-70.6160.6000107.6E5L3-E5 PolarHBondContact O-N 2.84Å
4T50.8Low57.4Low134 Ų134142 Ų14282%0.82279%0.786SS**  trans-66.9110.4167.223.10000108.1S2 A6S2-T4 PolarHBondContact O-N 2.64Å; T4-A6 PolarHBondContact O-N 2.73Å
5E54.8Low58Low191 Ų191143.1 Ų143.189%0.89379%0.789SS**  trans-43.4109.3164.5-94.4166.6124.100109.5L3 G7L3-E5 PolarHBondContact O-N 2.84Å; E5-G7 PolarHBondContact O-N 3.3Å
6A54.8Low58.4Low97 Ų97146.6 Ų146.680%0.80279%0.787SS**  trans-71.687.9162.100000106.6T4 N8T4-A6 PolarHBondContact O-N 2.73Å; A6-N8 PolarHBondContact O-N 3.1Å
7G50.7Low58.4Low66 Ų66146.8 Ų146.868%0.6879%0.787SS**  trans-59.9100.5167.400000108.2E5 E9E5-G7 PolarHBondContact O-N 3.3Å; G7-E9 VanDerWaalsContact C-N 3.29Å; G7-E9 PolarHBondContact O-N 2.66Å
8N56.7Low58.1Low114 Ų114146.3 Ų146.361%0.6179%0.785SS**  trans-74.589.5175.8-166.588.5000108.1A6 F10A6-N8 PolarHBondContact O-N 3.1Å; N8-F10 VanDerWaalsContact C-N 3.33Å; N8-F10 HydrophobicContact CB-CE2 4.44Å; N8-F10 VanDerWaalsContact ND2-CD2 3.35Å; N8-F10 WeakPolarHBondContact ND2-CD2 3.39Å; N8-F10 WeakPolarHBondContact ND2-CE1 3.47Å; N8-F10 WeakPolarHBondContact ND2-CE2 3.33Å; N8-F10 WeakPolarHBondContact ND2-CZ 3.07Å; N8-F10 WeakPolarHBondContact O-CD2 3.39Å; N8-F10 PolarHBondContact O-N 2.85Å
9E64Low58Low181 Ų181142.7 Ų142.785%0.84678%0.777SS**  trans-6186.617247.3-177.8177.600110.4G7 S11G7-E9 VanDerWaalsContact C-N 3.29Å; G7-E9 PolarHBondContact O-N 2.66Å; E9-S11 PolarHBondContact O-N 3.15Å; E9-S11 VanDerWaalsContact O-N 3.12Å
10F62.9Low57.7Low181 Ų181140 Ų14079%0.79477%0.769SS**  trans-70.1105.1162.6-69-77.8000107.5N8 E12N8-F10 VanDerWaalsContact C-N 3.33Å; N8-F10 HydrophobicContact CB-CE2 4.44Å; N8-F10 VanDerWaalsContact ND2-CD2 3.35Å; N8-F10 WeakPolarHBondContact ND2-CD2 3.39Å; N8-F10 WeakPolarHBondContact ND2-CE1 3.47Å; N8-F10 WeakPolarHBondContact ND2-CE2 3.33Å; N8-F10 WeakPolarHBondContact ND2-CZ 3.07Å; N8-F10 WeakPolarHBondContact O-CD2 3.39Å; N8-F10 PolarHBondContact O-N 2.85Å; F10-E12 PolarHBondContact O-N 3.03Å
11S65Low57.6Low98 Ų98140.3 Ų140.369%0.68577%0.768SS**  trans-64.8112.8171.434.80000109.1E9 I13E9-S11 PolarHBondContact O-N 3.15Å; E9-S11 VanDerWaalsContact O-N 3.12Å; S11-I13 WeakPolarHBondContact O-CD1 3.03Å; S11-I13 PolarHBondContact O-N 3.5Å
12E68.9Low58.1Low186 Ų186136.6 Ų136.687%0.86975%0.753SS**  trans-62.2106171.2-173.5175.3129.500108.2F10 D14F10-E12 PolarHBondContact O-N 3.03Å; E12-D14 PolarHBondContact O-N 2.86Å
13I65.5Low58Low130 Ų130133.1 Ų133.167%0.66774%0.736SS**  trans-75.5106.3173.6-64.7110.7000107.5S11 L15S11-I13 WeakPolarHBondContact O-CD1 3.03Å; S11-I13 PolarHBondContact O-N 3.5Å; I13-L15 HydrophobicContact CG2-CD2 3.86Å; I13-L15 HydrophobicContact CG2-CG 4.41Å; I13-L15 PolarHBondContact O-N 2.85Å; I13-L15 VanDerWaalsContact O-N 3.17Å
14D67.6Low57.7Low79 Ų79129.6 Ų129.642%0.42273%0.732SS.*  trans-72.8100.7172.2-169.2-2.9000109.2E12 R16E12-D14 PolarHBondContact O-N 2.86Å; D14-R16 PolarHBondContact O-N 3.47Å; D14-R16 WeakPolarHBondContact OD1-CB 3.38Å; D14-R16 VanDerWaalsContact OD1-CG 3.24Å; D14-R16 WeakPolarHBondContact OD1-CG 3.25Å; D14-R16 IonicContact OD1-CZ 3.7Å; D14-R16 PolarHBondContact OD1-N 2.75Å; D14-R16 IonicContact OD1-NE 3.7Å; D14-R16 PolarHBondContact OD1-NE 3.29Å; D14-R16 IonicContact OD1-NH2 3.96Å; D14-R16 IonicContact OD2-CZ 2.72Å; D14-R16 VanDerWaalsContact OD2-CZ 3.27Å; D14-R16 IonicContact OD2-NE 3.27Å; D14-R16 PolarHBondContact OD2-NE 2.76Å; D14-R16 IonicContact OD2-NH2 3.76Å; D14-R16 PolarHBondContact OD2-NH2 3.22Å
15L65.8Low57.9Low159 Ų159130.8 Ų130.883%0.83273%0.732SS**THydrogen-bonded Turntrans-73.215.5-179.5-64.4173000113.5I13 D17I13-L15 HydrophobicContact CG2-CD2 3.86Å; I13-L15 HydrophobicContact CG2-CG 4.41Å; I13-L15 PolarHBondContact O-N 2.85Å; I13-L15 VanDerWaalsContact O-N 3.17Å; L15-D17 PolarHBondContact O-N 3.4Å
16R64.9Low57.6Low199 Ų199126.9 Ų126.975%0.75173%0.725SS**THydrogen-bonded Turntrans-78.911.7173.2-71.3-175.8-73.2-176.6-2.6113.5D14 D18D14-R16 PolarHBondContact O-N 3.47Å; D14-R16 WeakPolarHBondContact OD1-CB 3.38Å; D14-R16 VanDerWaalsContact OD1-CG 3.24Å; D14-R16 WeakPolarHBondContact OD1-CG 3.25Å; D14-R16 IonicContact OD1-CZ 3.7Å; D14-R16 PolarHBondContact OD1-N 2.75Å; D14-R16 IonicContact OD1-NE 3.7Å; D14-R16 PolarHBondContact OD1-NE 3.29Å; D14-R16 IonicContact OD1-NH2 3.96Å; D14-R16 IonicContact OD2-CZ 2.72Å; D14-R16 VanDerWaalsContact OD2-CZ 3.27Å; D14-R16 IonicContact OD2-NE 3.27Å; D14-R16 PolarHBondContact OD2-NE 2.76Å; D14-R16 IonicContact OD2-NH2 3.76Å; D14-R16 PolarHBondContact OD2-NH2 3.22Å; R16-D18 PolarHBondContact O-N 3.19Å
17D58.7Low57.2Low149 Ų149126.2 Ų126.280%0.79773%0.728SS**  trans-62.190.4163.1-78.4-24.4000108.4L15 A19L15-D17 PolarHBondContact O-N 3.4Å; D17-A19 PolarHBondContact O-N 2.89Å
18D52.7Low56.9Low139 Ų139125.4 Ų125.474%0.74372%0.719SS**  trans-51.176.9169.2-155-6.7000107.2R16 S20R16-D18 PolarHBondContact O-N 3.19Å; D18-S20 PolarHBondContact O-N 2.64Å
19A55.7Low56.6Low78 Ų78122.5 Ų122.565%0.64571%0.708SS**  trans-66.381.1164.700000105.4D17 I21D17-A19 PolarHBondContact O-N 2.89Å; A19-I21 HydrophobicContact CB-CG1 4.48Å; A19-I21 PolarHBondContact O-N 2.98Å
20S51.8Low56.1Low87 Ų87121.3 Ų121.361%0.60871%0.707SS**  trans-5681.2161-79.80000106.9D18 N22D18-S20 PolarHBondContact O-N 2.64Å; S20-N22 PolarHBondContact O-N 2.89Å
21I57.1Low55.7Low147 Ų147119.7 Ų119.775%0.75470%0.702SS**  trans-72.183.5165.7-61.5169.3000104.2A19 G23A19-I21 HydrophobicContact CB-CG1 4.48Å; A19-I21 PolarHBondContact O-N 2.98Å; I21-G23 PolarHBondContact O-N 2.99Å
22N50.7Low55Low162 Ų162121.5 Ų121.587%0.86670%0.699SS**  trans-68.538.5161.3-90.9-2.6000110.3S20 A24S20-N22 PolarHBondContact O-N 2.89Å; N22-A24 PolarHBondContact O-N 2.97Å
23G46.6Very low54.1Low44 Ų44116 Ų11645%0.45469%0.686SS.*  trans-76101.8164.800000106I21 I25I21-G23 PolarHBondContact O-N 2.99Å; G23-I25 PolarHBondContact O-N 2.78Å
24A46.2Very low53.2Low100 Ų100117 Ų11783%0.82669%0.693SS**  trans-57.979.2161.600000108.1N22 S26N22-A24 PolarHBondContact O-N 2.97Å; A24-S26 PolarHBondContact O-N 3.19Å
25I53.8Low52.4Low160 Ų160120.8 Ų120.882%0.82171%0.708SS**  trans-70.189.5159.555.7166.9000103.7G23 G27G23-I25 PolarHBondContact O-N 2.78Å; I25-G27 PolarHBondContact O-N 3.06Å
26S50.2Low51.8Low108 Ų108120.5 Ų120.576%0.75571%0.705SS**  trans-44.1117.8161.749.70000105.6A24 G28A24-S26 PolarHBondContact O-N 3.19Å; S26-G28 PolarHBondContact O-N 2.98Å
27G45.6Very low50.9Low83 Ų83115.2 Ų115.286%0.85670%0.699SS**  trans-6377.3178.400000109.3I25 S29I25-G27 PolarHBondContact O-N 3.06Å; G27-S29 PolarHBondContact O-N 3.44Å; G27-S29 VanDerWaalsContact O-N 3.1Å
28G44.5Very low50.3Low49 Ų49114.6 Ų114.651%0.50570%0.7SS.*  trans-61.9109.1156.700000104S26 L30S26-G28 PolarHBondContact O-N 2.98Å; G28-L30 PolarHBondContact O-N 2.91Å
29S49.6Very low50Low54 Ų54116.2 Ų116.238%0.37871%0.705SS.*  trans-50.3135.3169.2-175.20000106.7G27 E31 E32G27-S29 PolarHBondContact O-N 3.44Å; G27-S29 VanDerWaalsContact O-N 3.1Å; S29-E31 PolarHBondContact O-N 3.09Å; S29-E31 VanDerWaalsContact OG-CD 3.23Å; S29-E31 WeakPolarHBondContact OG-CG 3.35Å; S29-E31 PolarHBondContact OG-OE2 2.69Å; S29-E32 PolarHBondContact O-N 2.57Å
30L54.2Low49.6Very low156 Ų156121.9 Ų121.982%0.81772%0.718SS**THydrogen-bonded Turntrans-53.3-15.4175.6-124154.5000111.7G28G28-L30 PolarHBondContact O-N 2.91Å
31E54.6Low49.3Very low147 Ų147123.8 Ų123.869%0.68773%0.727SS**THydrogen-bonded Turntrans-67.7-31.4172.5-60.6163.9150.400114S29S29-E31 PolarHBondContact O-N 3.09Å; S29-E31 VanDerWaalsContact OG-CD 3.23Å; S29-E31 WeakPolarHBondContact OG-CG 3.35Å; S29-E31 PolarHBondContact OG-OE2 2.69Å
32E51.1Low48.8Very low136 Ų136121.4 Ų121.464%0.63672%0.716SS**THydrogen-bonded Turntrans-75.9-31.6177.8-82.8-175.6154.800112.5S29 N34 Q35S29-E32 PolarHBondContact O-N 2.57Å; E32-N34 PolarHBondContact O-N 3.23Å; E32-N34 VanDerWaalsContact O-N 3.15Å; E32-Q35 PolarHBondContact O-N 3.49Å
33A49.9Very low48.7Very low70 Ų70119.3 Ų119.358%0.57971%0.711SS**G310 helixtrans-63.2-21.6176.300000112.5
34N46.5Very low49.1Very low152 Ų152121.1 Ų121.181%0.81372%0.721SS**G310 helixtrans-86.3-2.2176.9-111.5-19000114.1E32E32-N34 PolarHBondContact O-N 3.23Å; E32-N34 VanDerWaalsContact O-N 3.15Å
35Q49.9Very low49.2Very low158 Ų158121.6 Ų121.674%0.73871%0.714SS**G310 helixtrans-97.18176.6-76-172.652.500114.1E32 S37E32-Q35 PolarHBondContact O-N 3.49Å; Q35-S37 PolarHBondContact O-N 3.01Å
36I53.8Low48.9Very low152 Ų152120.9 Ų120.978%0.77971%0.711SS**SBendtrans-74.278.1167.6-68.7165.7000108.7V38I36-V38 PolarHBondContact O-N 3.42Å
37S45.8Very low48.9Very low89 Ų89121 Ų12162%0.62271%0.709SS**  trans18.5101.2140.2-1770000115.9Q35 M39Q35-S37 PolarHBondContact O-N 3.01Å; S37-M39 PolarHBondContact O-N 3.45Å
38V46.4Very low49Very low136 Ų136124.1 Ų124.182%0.82471%0.705SS**  trans-23.489.6145-172.20000113I36I36-V38 PolarHBondContact O-N 3.42Å
39M45.5Very low49.3Very low173 Ų173125.3 Ų125.385%0.85271%0.706SS**  trans-151.7135.1153.8-87.3-153.1142.200108.4S37S37-M39 PolarHBondContact O-N 3.45Å
40E47.3Very low49.5Very low196 Ų196131.4 Ų131.492%0.91673%0.728SS**  trans8161.1-180-121.1172.1148.200115.3D42E40-D42 VanDerWaalsContact C-N 3.27Å; E40-D42 PolarHBondContact O-N 3.11Å
41T45.9Very low49.5Very low128 Ų128127.4 Ų127.479%0.78572%0.717SS**  trans-59.989.9155.7-46.20000108.8P43T41-P43 VanDerWaalsContact O-CD 3.25Å; T41-P43 WeakPolarHBondContact O-CD 3.46Å
42D47.1Very low49.4Very low97 Ų97123.3 Ų123.352%0.51971%0.709SS.*  trans-66.7112.8160.7-172.5-14.7000107.2E40 A44 V45E40-D42 VanDerWaalsContact C-N 3.27Å; E40-D42 PolarHBondContact O-N 3.11Å; D42-A44 PolarHBondContact O-N 3.45Å; D42-A44 WeakPolarHBondContact OD1-CB 3.27Å; D42-A44 PolarHBondContact OD1-N 2.82Å; D42-A44 VanDerWaalsContact OD1-N 3.09Å; D42-V45 PolarHBondContact O-N 3.13Å
43P49.5Very low49.2Very low118 Ų118121.9 Ų121.977%0.76671%0.713SS**THydrogen-bonded Turntrans-64.9-4.1-178.428.3-35.1000113.3T41 V45T41-P43 VanDerWaalsContact O-CD 3.25Å; T41-P43 WeakPolarHBondContact O-CD 3.46Å; P43-V45 VanDerWaalsContact C-N 3.33Å
44A53.8Low49.1Very low81 Ų81128 Ų12867%0.66972%0.721SS**THydrogen-bonded Turntrans-75.6-19.3171.400000113.6D42 L46D42-A44 PolarHBondContact O-N 3.45Å; D42-A44 WeakPolarHBondContact OD1-CB 3.27Å; D42-A44 PolarHBondContact OD1-N 2.82Å; D42-A44 VanDerWaalsContact OD1-N 3.09Å; A44-L46 PolarHBondContact O-N 3.35Å
45V48.5Very low49.2Very low111 Ų111126.5 Ų126.567%0.67372%0.719SS**  trans-92.976.2177.1-166.80000108.3D42 P43 P47D42-V45 PolarHBondContact O-N 3.13Å; P43-V45 VanDerWaalsContact C-N 3.33Å; V45-P47 WeakPolarHBondContact O-CD 3.26Å; V45-P47 VanDerWaalsContact O-N 3.13Å
46L47.3Very low49.2Very low145 Ų145125.3 Ų125.376%0.75972%0.723SS**  trans-52.8123161.5-75.3170.4000106.3A44 L48A44-L46 PolarHBondContact O-N 3.35Å; L46-L48 PolarHBondContact O-N 2.95Å
47P49.8Very low48.8Very low109 Ų109126.4 Ų126.471%0.70872%0.722SS**  trans-52.7122.4174.821-30.3000105.6V45 S49V45-P47 WeakPolarHBondContact O-CD 3.26Å; V45-P47 VanDerWaalsContact O-N 3.13Å; P47-S49 PolarHBondContact O-N 3.32Å
48L48.5Very low48.7Very low150 Ų150127.6 Ų127.679%0.78573%0.727SS**  trans-55.394.1166.7-76.8168.8000104.2L46 E50 A52L46-L48 PolarHBondContact O-N 2.95Å; L48-E50 PolarHBondContact O-N 2.97Å; L48-A52 HydrophobicContact CD2-CB 4.39Å
49S51.5Low48.5Very low73 Ų73127.9 Ų127.951%0.5172%0.72SS.*  trans-50.5134-17956.50000105.2P47 A51 A52P47-S49 PolarHBondContact O-N 3.32Å; S49-A51 CarbonylContact O-C 3.55Å; S49-A51 PolarHBondContact O-N 3.48Å; S49-A52 PolarHBondContact O-N 3.06Å
50E53.6Low48.2Very low183 Ų183124.8 Ų124.886%0.85571%0.711SS**G310 helixtrans-49.8-17.3-176.8-70.3168.1137.800113.1L48 A52 C53L48-E50 PolarHBondContact O-N 2.97Å; E50-A52 PolarHBondContact O-N 2.72Å; E50-C53 PolarHBondContact O-N 2.72Å
51A52.6Low47.8Very low71 Ų71118.2 Ų118.259%0.58768%0.681SS**G310 helixtrans-51.6-32.8165.500000115.1S49 C53 R54S49-A51 CarbonylContact O-C 3.55Å; S49-A51 PolarHBondContact O-N 3.48Å; A51-C53 VanDerWaalsContact C-N 3.33Å; A51-R54 PolarHBondContact O-N 2.84Å
52A53.8Low47.8Very low62 Ų62116.7 Ų116.751%0.51268%0.676SS.*G310 helixtrans-74.5-21.8-179.900000113L48 S49 E50 R54L48-A52 HydrophobicContact CD2-CB 4.39Å; S49-A52 PolarHBondContact O-N 3.06Å; E50-A52 PolarHBondContact O-N 2.72Å; A52-R54 VanDerWaalsContact C-N 3.27Å; A52-R54 PolarHBondContact O-N 2.85Å
53C47.4Very low47.9Very low106 Ų106114.2 Ų114.272%0.71666%0.663SS**G310 helixtrans-88.412.5175.3-710000113.1E50 A51 P55E50-C53 PolarHBondContact O-N 2.72Å; A51-C53 VanDerWaalsContact C-N 3.33Å; C53-P55 WeakPolarHBondContact O-CD 3.43Å
54R46.6Very low48.1Very low197 Ų197115.9 Ų115.974%0.74367%0.665SS**SBendtrans-65.4125164.5-82-174.2172.8177.7-0.1107.5A51 A52 V56A51-R54 PolarHBondContact O-N 2.84Å; A52-R54 VanDerWaalsContact C-N 3.27Å; A52-R54 PolarHBondContact O-N 2.85Å; R54-V56 PolarHBondContact O-N 3.19Å
55P48.2Very low48.3Very low121 Ų121116.3 Ų116.379%0.78666%0.656SS**  trans-54.3111.7168.321.8-30.3000106.5C53 K57C53-P55 WeakPolarHBondContact O-CD 3.43Å; P55-K57 VanDerWaalsContact C-N 3.3Å; P55-K57 PolarHBondContact O-N 3.1Å
56V50.7Low48.8Very low133 Ų133115.7 Ų115.781%0.80666%0.655SS**  trans-63.9103.1174-1800000104R54 P58R54-V56 PolarHBondContact O-N 3.19Å; V56-P58 WeakPolarHBondContact O-CD 3.32Å; V56-P58 VanDerWaalsContact O-N 3.09Å
57K44.6Very low49.4Very low175 Ų175110.2 Ų110.276%0.76163%0.626SS**  trans-56121.8173178.8172.6179.11680105P55 Q59P55-K57 VanDerWaalsContact C-N 3.3Å; P55-K57 PolarHBondContact O-N 3.1Å; K57-Q59 VanDerWaalsContact C-N 3.34Å; K57-Q59 PolarHBondContact O-N 3.36Å
58P44.7Very low50Low114 Ų114113 Ų11374%0.7462%0.622SS**  trans-58106.1176.920.3-29.4000106.8V56V56-P58 WeakPolarHBondContact O-CD 3.32Å; V56-P58 VanDerWaalsContact O-N 3.09Å
59Q41.7Very low50.4Low143 Ų143112 Ų11267%0.66862%0.622SS**  trans-89.7114.1175.4-146.8166.521.800104.3K57 L61K57-Q59 VanDerWaalsContact C-N 3.34Å; K57-Q59 PolarHBondContact O-N 3.36Å; Q59-L61 VanDerWaalsContact C-N 3.3Å; Q59-L61 HydrophobicContact CB-CG 4.41Å; Q59-L61 HydrophobicContact CG-CD2 4.33Å; Q59-L61 PolarHBondContact O-N 3.02Å
60T39.2Very low50.8Low108 Ų108112.1 Ų112.166%0.66364%0.635SS**  trans-70.197.8169.7-54.10000106.5
61L39.2Very low51.4Low57 Ų57106 Ų10630%0.29861%0.606SS.*  trans-92.3112.5169.1-65.9175.9000106Q59 L63 G87 E88Q59-L61 VanDerWaalsContact C-N 3.3Å; Q59-L61 HydrophobicContact CB-CG 4.41Å; Q59-L61 HydrophobicContact CG-CD2 4.33Å; Q59-L61 PolarHBondContact O-N 3.02Å; L61-L63 PolarHBondContact O-N 3.15Å; L61-G87 WeakPolarHBondContact CD1-O 3.4Å; L61-E88 WeakPolarHBondContact CB-O 3.48Å; L61-E88 VanDerWaalsContact CD1-CA 3.47Å
62S45.9Very low52.4Low96 Ų96104.7 Ų104.767%0.67159%0.592SS**  trans-69.5125.7-179.7-159.80000107.7N64S62-N64 PolarHBondContact O-N 3.23Å; S62-N64 VanDerWaalsContact O-N 3.11Å
63L49.3Very low53.2Low45 Ų45103 Ų10324%0.23658%0.579CS.*  trans-58118.2170.1-65.6175.9000108.6L61 D65 E83 I89 D93 S97L61-L63 PolarHBondContact O-N 3.15Å; L63-D65 VanDerWaalsContact C-N 3.27Å; L63-E83 WeakPolarHBondContact CD2-OE2 3.21Å; L63-I89 HydrophobicContact CD1-CD1 4.09Å; L63-I89 HydrophobicContact CD2-CB 4.31Å; L63-I89 HydrophobicContact CD2-CD1 3.95Å; L63-I89 HydrophobicContact CD2-CG1 3.95Å; L63-I89 HydrophobicContact CG-CD1 4.4Å; L63-I89 HydrophobicContact CG-CG1 4.39Å; L63-D93 HydrophobicContact CD1-CB 4.5Å; L63-S97 WeakPolarHBondContact CD1-OG 3.49Å
64N53.7Low54.7Low154 Ų154104.6 Ų104.682%0.82458%0.576SS**SBendtrans-75.3-23.5171.7-73.3-52.5000111.3S62 P66S62-N64 PolarHBondContact O-N 3.23Å; S62-N64 VanDerWaalsContact O-N 3.11Å; N64-P66 VanDerWaalsContact O-CD 3.27Å; N64-P66 WeakPolarHBondContact O-CD 3.41Å
65D57.4Low56.1Low89 Ų89100.8 Ų100.848%0.47657%0.566SS.*SBendtrans-107.897.3-178.5-82-38.7000111.2L63 I67 R79L63-D65 VanDerWaalsContact C-N 3.27Å; D65-I67 PolarHBondContact O-N 2.92Å; D65-R79 PolarHBondContact O-NH1 3.23Å; D65-R79 PolarHBondContact O-NH2 3.13Å
66P59.5Low57.5Low99 Ų9995.3 Ų95.364%0.64353%0.53SS*.PPolyproline II helixtrans-56.8140168.424.9-32.6000109.1N64 R68N64-P66 VanDerWaalsContact O-CD 3.27Å; N64-P66 WeakPolarHBondContact O-CD 3.41Å; P66-R68 PolarHBondContact O-N 2.88Å; P66-R68 VanDerWaalsContact O-N 3.11Å
67I60.2Low58.8Low29 Ų2993.1 Ų93.115%0.14951%0.51CS..PPolyproline II helixtrans-50.4120.7171.8-62.1169.8000107.8D65 I76 Y100D65-I67 PolarHBondContact O-N 2.92Å; I67-I76 HydrophobicContact CD1-CG2 4.2Å; I67-I76 HydrophobicContact CG1-CG2 4.33Å; I67-I76 HydrophobicContact CG2-CD1 3.54Å; I67-I76 HydrophobicContact CG2-CG1 4.05Å; I67-Y100 HydrophobicContact CB-CD1 4.18Å; I67-Y100 HydrophobicContact CB-CE1 4.13Å; I67-Y100 HydrophobicContact CD1-CD1 3.63Å; I67-Y100 HydrophobicContact CD1-CE1 4.43Å; I67-Y100 HydrophobicContact CD1-CG 4.09Å; I67-Y100 HydrophobicContact CG2-CD1 3.88Å; I67-Y100 HydrophobicContact CG2-CE1 3.65Å
68R61.2Low60.5Low167 Ų16787.6 Ų87.663%0.6350%0.497SS*.PPolyproline II helixtrans-82.5131.9-178.5-65.3-177.2178.7-1774.1108.2P66 G70 E71P66-R68 PolarHBondContact O-N 2.88Å; P66-R68 VanDerWaalsContact O-N 3.11Å; R68-G70 PolarHBondContact O-N 3.46Å; R68-G70 VanDerWaalsContact O-N 3.15Å; R68-E71 HydrophobicContact CB-CG 4.01Å; R68-E71 PolarHBondContact N-OE2 3.02Å; R68-E71 PolarHBondContact O-N 2.86Å; R68-E71 VanDerWaalsContact O-N 3.15Å
69V56.9Low62Low130 Ų13084.4 Ų84.479%0.78847%0.47SS*.THydrogen-bonded Turntrans-58120.5172.9179.40000108.5
70G61Low63.6Low75 Ų7577.8 Ų77.877%0.77344%0.439SS*.THydrogen-bonded Turntrans105.5-3.8-179.100000115.7R68R68-G70 PolarHBondContact O-N 3.46Å; R68-G70 VanDerWaalsContact O-N 3.15Å
71E65.6Low65.4Low56 Ų5679.1 Ų79.126%0.26244%0.438SS..  trans-67141.5166.6-70.7176.1155.900110.1R68 I76 R79R68-E71 HydrophobicContact CB-CG 4.01Å; R68-E71 PolarHBondContact N-OE2 3.02Å; R68-E71 PolarHBondContact O-N 2.86Å; R68-E71 VanDerWaalsContact O-N 3.15Å; E71-I76 HydrophobicContact CB-CD1 4.04Å; E71-I76 HydrophobicContact CB-CG1 3.79Å; E71-R79 IonicContact OE2-NH2 3.04Å
72S72.8Confident67.2Low42 Ų4279.1 Ų79.129%0.29444%0.443SS..  trans-70.8152174.71010000110.2E74 E75 I76S72-E74 VanDerWaalsContact CB-OE2 3.3Å; S72-E74 WeakPolarHBondContact CB-OE2 3.34Å; S72-E74 PolarHBondContact O-N 3.45Å; S72-E74 PolarHBondContact OG-N 2.87Å; S72-E74 PolarHBondContact OG-OE2 2.9Å; S72-E75 PolarHBondContact N-OE2 3.46Å; S72-E75 WeakPolarHBondContact O-CB 3.43Å; S72-E75 PolarHBondContact O-N 3.35Å; S72-E75 VanDerWaalsContact O-N 3.09Å; S72-E75 PolarHBondContact OG-N 3.46Å; S72-I76 WeakPolarHBondContact O-CG1 3.36Å; S72-I76 PolarHBondContact O-N 2.84Å
73A72.2Confident68.6Low28 Ų2875.7 Ų75.723%0.23142%0.416CS..Hα-helixtrans-56.1-39.2176.600000111.1E75 I76 F77 V101A73-E75 PolarHBondContact O-N 3.07Å; A73-I76 PolarHBondContact O-N 3.39Å; A73-F77 HydrophobicContact CB-CE2 4.39Å; A73-F77 WeakPolarHBondContact O-CD2 3.01Å; A73-F77 PolarHBondContact O-N 3.04Å; A73-V101 HydrophobicContact CB-CG1 3.76Å
74E77.5Confident69.7Low138 Ų13876.8 Ų76.865%0.64543%0.425SS*.Hα-helixtrans-62.2-41.6177-57.178.9-172.400112.5S72 I76 F77 A78S72-E74 VanDerWaalsContact CB-OE2 3.3Å; S72-E74 WeakPolarHBondContact CB-OE2 3.34Å; S72-E74 PolarHBondContact O-N 3.45Å; S72-E74 PolarHBondContact OG-N 2.87Å; S72-E74 PolarHBondContact OG-OE2 2.9Å; E74-I76 VanDerWaalsContact C-N 3.34Å; E74-F77 PolarHBondContact O-N 2.84Å; E74-A78 WeakPolarHBondContact O-CB 3.5Å; E74-A78 PolarHBondContact O-N 2.69Å
75E77.6Confident70.7Confident117 Ų11775.6 Ų75.655%0.54742%0.423SS..Hα-helixtrans-64.1-40.9176.1-69.8174.4153.900111.4S72 A73 A78 R79S72-E75 PolarHBondContact N-OE2 3.46Å; S72-E75 WeakPolarHBondContact O-CB 3.43Å; S72-E75 PolarHBondContact O-N 3.35Å; S72-E75 VanDerWaalsContact O-N 3.09Å; S72-E75 PolarHBondContact OG-N 3.46Å; A73-E75 PolarHBondContact O-N 3.07Å; E75-A78 PolarHBondContact O-N 3.16Å; E75-R79 WeakPolarHBondContact O-CB 3.21Å; E75-R79 PolarHBondContact O-N 3Å
76I76.3Confident71.6Confident7 Ų776.9 Ų76.94%0.03643%0.426CS..Hα-helixtrans-66.2-44.8178.1-60.1163.9000110.3I67 E71 S72 A73 E74 R79 L80 V101I67-I76 HydrophobicContact CD1-CG2 4.2Å; I67-I76 HydrophobicContact CG1-CG2 4.33Å; I67-I76 HydrophobicContact CG2-CD1 3.54Å; I67-I76 HydrophobicContact CG2-CG1 4.05Å; E71-I76 HydrophobicContact CB-CD1 4.04Å; E71-I76 HydrophobicContact CB-CG1 3.79Å; S72-I76 WeakPolarHBondContact O-CG1 3.36Å; S72-I76 PolarHBondContact O-N 2.84Å; A73-I76 PolarHBondContact O-N 3.39Å; E74-I76 VanDerWaalsContact C-N 3.34Å; I76-R79 PolarHBondContact O-N 2.72Å; I76-L80 HydrophobicContact CG2-CD1 3.97Å; I76-L80 HydrophobicContact CG2-CG 4.28Å; I76-L80 WeakPolarHBondContact O-CB 3.26Å; I76-L80 VanDerWaalsContact O-CG 3.29Å; I76-L80 WeakPolarHBondContact O-CG 3.4Å; I76-L80 PolarHBondContact O-N 2.95Å; I76-V101 HydrophobicContact CB-CG2 3.94Å; I76-V101 HydrophobicContact CD1-CG2 3.8Å; I76-V101 HydrophobicContact CG1-CG2 4.46Å; I76-V101 HydrophobicContact CG2-CG2 3.4Å; I76-V101 VanDerWaalsContact CG2-CG2 3.4Å
77F78.2Confident72.2Confident86 Ų8674.6 Ų74.638%0.37742%0.42SS..Hα-helixtrans-63.9-42.7176.9-76.9-62.5000112.3A73 E74 R79 L80 E81 V98 V101A73-F77 HydrophobicContact CB-CE2 4.39Å; A73-F77 WeakPolarHBondContact O-CD2 3.01Å; A73-F77 PolarHBondContact O-N 3.04Å; E74-F77 PolarHBondContact O-N 2.84Å; F77-R79 VanDerWaalsContact C-N 3.28Å; F77-R79 PolarHBondContact O-N 3.34Å; F77-L80 PolarHBondContact O-N 3.46Å; F77-E81 WeakPolarHBondContact O-CB 3.31Å; F77-E81 WeakPolarHBondContact O-CG 3.5Å; F77-E81 PolarHBondContact O-N 3.43Å; F77-V98 HydrophobicContact CE1-CG1 4.41Å; F77-V98 HydrophobicContact CE1-CG2 4.18Å; F77-V101 HydrophobicContact CE2-CG1 3.83Å; F77-V101 HydrophobicContact CZ-CG1 4.06Å
78A80.4Confident72.8Confident59 Ų5978 Ų7849%0.48844%0.436SS..Hα-helixtrans-60.7-38.7176.400000112E74 E75 S82E74-A78 WeakPolarHBondContact O-CB 3.5Å; E74-A78 PolarHBondContact O-N 2.69Å; E75-A78 PolarHBondContact O-N 3.16Å; A78-S82 PolarHBondContact O-N 3.3Å; A78-S82 VanDerWaalsContact O-N 3.16Å
79R76.3Confident73.3Confident47 Ų4771 Ų7118%0.17741%0.41CS..Hα-helixtrans-66.2-48.9173.9-178.7170.366108.2-16.1111.8D65 E71 E75 I76 F77 E81 S82 E83D65-R79 PolarHBondContact O-NH1 3.23Å; D65-R79 PolarHBondContact O-NH2 3.13Å; E71-R79 IonicContact OE2-NH2 3.04Å; E75-R79 WeakPolarHBondContact O-CB 3.21Å; E75-R79 PolarHBondContact O-N 3Å; I76-R79 PolarHBondContact O-N 2.72Å; F77-R79 VanDerWaalsContact C-N 3.28Å; F77-R79 PolarHBondContact O-N 3.34Å; R79-E81 VanDerWaalsContact C-N 3.3Å; R79-E81 PolarHBondContact O-N 3.29Å; R79-S82 WeakPolarHBondContact O-CA 3.24Å; R79-S82 WeakPolarHBondContact O-CB 3.33Å; R79-S82 PolarHBondContact O-N 3.17Å; R79-E83 HydrophobicContact CG-CG 4.31Å; R79-E83 WeakPolarHBondContact CG-OE1 3.49Å; R79-E83 IonicContact CZ-OE1 2.84Å; R79-E83 IonicContact NE-OE1 3.91Å; R79-E83 IonicContact NH1-OE1 2.86Å; R79-E83 PolarHBondContact NH1-OE1 3.43Å; R79-E83 WeakPolarHBondContact O-CG 3.48Å; R79-E83 PolarHBondContact O-N 2.72Å
80L76.4Confident74.1Confident4 Ų465.3 Ų65.32%0.02138%0.376CS..Hα-helixtrans-60-40.7178.8-70.9173.3000111.6I76 F77 S82 E83 V84 I89 L94 V98I76-L80 HydrophobicContact CG2-CD1 3.97Å; I76-L80 HydrophobicContact CG2-CG 4.28Å; I76-L80 WeakPolarHBondContact O-CB 3.26Å; I76-L80 VanDerWaalsContact O-CG 3.29Å; I76-L80 WeakPolarHBondContact O-CG 3.4Å; I76-L80 PolarHBondContact O-N 2.95Å; F77-L80 PolarHBondContact O-N 3.46Å; L80-S82 VanDerWaalsContact C-N 3.32Å; L80-S82 PolarHBondContact O-N 2.92Å; L80-E83 PolarHBondContact O-N 2.88Å; L80-V84 WeakPolarHBondContact O-CB 3.38Å; L80-V84 WeakPolarHBondContact O-CG2 3.4Å; L80-V84 PolarHBondContact O-N 3.24Å; L80-I89 HydrophobicContact CD2-CD1 3.54Å; L80-L94 HydrophobicContact CB-CD1 4.14Å; L80-L94 HydrophobicContact CD1-CD1 4.36Å; L80-L94 HydrophobicContact CD2-CD1 4.23Å; L80-L94 HydrophobicContact CG-CD1 4.48Å; L80-V98 HydrophobicContact CD1-CG2 4.16Å
81E76.3Confident74.5Confident137 Ų13764.4 Ų64.464%0.6437%0.367SS*.Hα-helixtrans-59-44.5173.5-77.2-175.8171.800111.4F77 R79 V84 V85F77-E81 WeakPolarHBondContact O-CB 3.31Å; F77-E81 WeakPolarHBondContact O-CG 3.5Å; F77-E81 PolarHBondContact O-N 3.43Å; R79-E81 VanDerWaalsContact C-N 3.3Å; R79-E81 PolarHBondContact O-N 3.29Å; E81-V84 PolarHBondContact O-N 3.3Å; E81-V85 WeakPolarHBondContact O-CB 3.46Å; E81-V85 WeakPolarHBondContact O-CG2 3.29Å; E81-V85 PolarHBondContact O-N 3.06Å
82S76.8Confident75Confident56 Ų5670.9 Ų70.939%0.39239%0.389SS..Hα-helixtrans-62.4-46.5176.7-161.50000112.2A78 R79 L80 V84 V85 Q86A78-S82 PolarHBondContact O-N 3.3Å; A78-S82 VanDerWaalsContact O-N 3.16Å; R79-S82 WeakPolarHBondContact O-CA 3.24Å; R79-S82 WeakPolarHBondContact O-CB 3.33Å; R79-S82 PolarHBondContact O-N 3.17Å; L80-S82 VanDerWaalsContact C-N 3.32Å; L80-S82 PolarHBondContact O-N 2.92Å; S82-V84 PolarHBondContact O-N 2.96Å; S82-V85 PolarHBondContact O-N 3.01Å; S82-Q86 WeakPolarHBondContact O-CB 3.28Å; S82-Q86 VanDerWaalsContact O-CG 3.26Å; S82-Q86 WeakPolarHBondContact O-CG 3.4Å; S82-Q86 PolarHBondContact O-N 3.46Å; S82-Q86 PolarHBondContact OG-NE2 3.04Å
83E74.8Confident75.1Confident24 Ų2470.5 Ų70.511%0.11238%0.383CS..Hα-helixtrans-64.8-38.5179.6-68.7172.3-178.800111.6L63 R79 L80 G87 E88 I89L63-E83 WeakPolarHBondContact CD2-OE2 3.21Å; R79-E83 HydrophobicContact CG-CG 4.31Å; R79-E83 WeakPolarHBondContact CG-OE1 3.49Å; R79-E83 IonicContact CZ-OE1 2.84Å; R79-E83 IonicContact NE-OE1 3.91Å; R79-E83 IonicContact NH1-OE1 2.86Å; R79-E83 PolarHBondContact NH1-OE1 3.43Å; R79-E83 WeakPolarHBondContact O-CG 3.48Å; R79-E83 PolarHBondContact O-N 2.72Å; L80-E83 PolarHBondContact O-N 2.88Å; E83-G87 PolarHBondContact O-N 3.23Å; E83-G87 VanDerWaalsContact O-N 3.13Å; E83-E88 PolarHBondContact O-N 3.08Å; E83-I89 HydrophobicContact CB-CB 4.05Å; E83-I89 HydrophobicContact CB-CG2 3.98Å
84V72.8Confident75.3Confident69 Ų6971.7 Ų71.742%0.41839%0.386SS..Hα-helixtrans-64.7-45.9174.5171.30000111.1L80 E81 S82 Q86 G87 I89 L94L80-V84 WeakPolarHBondContact O-CB 3.38Å; L80-V84 WeakPolarHBondContact O-CG2 3.4Å; L80-V84 PolarHBondContact O-N 3.24Å; E81-V84 PolarHBondContact O-N 3.3Å; S82-V84 PolarHBondContact O-N 2.96Å; V84-Q86 VanDerWaalsContact C-N 3.31Å; V84-Q86 PolarHBondContact O-N 3.36Å; V84-G87 PolarHBondContact O-N 3.11Å; V84-I89 HydrophobicContact CB-CG2 4.11Å; V84-I89 HydrophobicContact CG2-CG2 3.39Å; V84-L94 HydrophobicContact CG2-CD1 3.8Å; V84-L94 HydrophobicContact CG2-CD2 3.81Å; V84-L94 HydrophobicContact CG2-CG 4.34Å
85V75.5Confident75.2Confident129 Ų12969.1 Ų69.178%0.78238%0.379SS*.Hα-helixtrans-64.7-37.5-179.9169.50000111.5E81 S82 G87E81-V85 WeakPolarHBondContact O-CB 3.46Å; E81-V85 WeakPolarHBondContact O-CG2 3.29Å; E81-V85 PolarHBondContact O-N 3.06Å; S82-V85 PolarHBondContact O-N 3.01Å; V85-G87 PolarHBondContact O-N 3.38Å
86Q75.5Confident75.2Confident116 Ų11667.5 Ų67.554%0.54237%0.374SS..THydrogen-bonded Turntrans-74.7-9.4175.4-65.7179.947.400112.6S82 V84 E88S82-Q86 WeakPolarHBondContact O-CB 3.28Å; S82-Q86 VanDerWaalsContact O-CG 3.26Å; S82-Q86 WeakPolarHBondContact O-CG 3.4Å; S82-Q86 PolarHBondContact O-N 3.46Å; S82-Q86 PolarHBondContact OG-NE2 3.04Å; V84-Q86 VanDerWaalsContact C-N 3.31Å; V84-Q86 PolarHBondContact O-N 3.36Å; Q86-E88 HydrophobicContact CB-CB 4.35Å; Q86-E88 HydrophobicContact CB-CG 3.77Å; Q86-E88 PolarHBondContact O-N 2.93Å; Q86-E88 PolarHBondContact OE1-OE2 3.28Å
87G71.9Confident75.2Confident50 Ų5067.6 Ų67.652%0.51538%0.375SS..THydrogen-bonded Turntrans67.824-175.100000112.4L61 E83 V84 V85L61-G87 WeakPolarHBondContact CD1-O 3.4Å; E83-G87 PolarHBondContact O-N 3.23Å; E83-G87 VanDerWaalsContact O-N 3.13Å; V84-G87 PolarHBondContact O-N 3.11Å; V85-G87 PolarHBondContact O-N 3.38Å
88E72.3Confident75.2Confident102 Ų10265.9 Ų65.948%0.47737%0.372SS..  trans-90.4-3.2-175.8-70.4-167153.500113.9L61 E83 Q86L61-E88 WeakPolarHBondContact CB-O 3.48Å; L61-E88 VanDerWaalsContact CD1-CA 3.47Å; E83-E88 PolarHBondContact O-N 3.08Å; Q86-E88 HydrophobicContact CB-CB 4.35Å; Q86-E88 HydrophobicContact CB-CG 3.77Å; Q86-E88 PolarHBondContact O-N 2.93Å; Q86-E88 PolarHBondContact OE1-OE2 3.28Å
89I71.6Confident75.1Confident18 Ų1867.7 Ų67.79%0.09237%0.373CS..SBendtrans-126.7138179.6-168.6175000111L63 L80 E83 V84 D93 L94L63-I89 HydrophobicContact CD1-CD1 4.09Å; L63-I89 HydrophobicContact CD2-CB 4.31Å; L63-I89 HydrophobicContact CD2-CD1 3.95Å; L63-I89 HydrophobicContact CD2-CG1 3.95Å; L63-I89 HydrophobicContact CG-CD1 4.4Å; L63-I89 HydrophobicContact CG-CG1 4.39Å; L80-I89 HydrophobicContact CD2-CD1 3.54Å; E83-I89 HydrophobicContact CB-CB 4.05Å; E83-I89 HydrophobicContact CB-CG2 3.98Å; V84-I89 HydrophobicContact CB-CG2 4.11Å; V84-I89 HydrophobicContact CG2-CG2 3.39Å; I89-D93 HydrophobicContact CD1-CB 4.37Å; I89-D93 HydrophobicContact CG1-CB 3.83Å; I89-L94 HydrophobicContact CD1-CB 4.04Å; I89-L94 HydrophobicContact CD1-CD1 4.3Å; I89-L94 HydrophobicContact CG1-CB 4.43Å
90S73.4Confident75.1Confident12 Ų1269.9 Ų69.98%0.08438%0.382CS..  trans-79.3152.4174.590.50000111.4R92 D93 L94S90-R92 PolarHBondContact O-N 3.41Å; S90-R92 VanDerWaalsContact O-N 3.15Å; S90-R92 PolarHBondContact OG-N 3.18Å; S90-D93 WeakPolarHBondContact CB-OD2 3.38Å; S90-D93 PolarHBondContact O-N 2.99Å; S90-D93 PolarHBondContact OG-N 3.4Å; S90-D93 PolarHBondContact OG-OD2 3.28Å; S90-L94 PolarHBondContact O-N 2.85Å
91G70.9Confident74.9Confident55 Ų5570.1 Ų70.157%0.56738%0.383SS*.Hα-helixtrans-58-30.2177.400000113.7V95G91-V95 VanDerWaalsContact O-CG2 3.32Å; G91-V95 WeakPolarHBondContact O-CG2 3.34Å; G91-V95 PolarHBondContact O-N 3.27Å
92R74.6Confident74.7Confident192 Ų19267.3 Ų67.373%0.72538%0.375SS*.Hα-helixtrans-69.9-42.6174.4-179.5179.7179.6179-1.9111.7S90 V95 N96S90-R92 PolarHBondContact O-N 3.41Å; S90-R92 VanDerWaalsContact O-N 3.15Å; S90-R92 PolarHBondContact OG-N 3.18Å; R92-V95 PolarHBondContact O-N 2.89Å; R92-N96 PolarHBondContact O-N 3.48Å; R92-N96 VanDerWaalsContact O-N 3.1Å
93D75.1Confident74.5Confident34 Ų3467.7 Ų67.718%0.18238%0.378CS..Hα-helixtrans-70.2-37.9-178.7-59.7-40.8000110.6L63 I89 S90 V95 N96 S97L63-D93 HydrophobicContact CD1-CB 4.5Å; I89-D93 HydrophobicContact CD1-CB 4.37Å; I89-D93 HydrophobicContact CG1-CB 3.83Å; S90-D93 WeakPolarHBondContact CB-OD2 3.38Å; S90-D93 PolarHBondContact O-N 2.99Å; S90-D93 PolarHBondContact OG-N 3.4Å; S90-D93 PolarHBondContact OG-OD2 3.28Å; D93-V95 PolarHBondContact O-N 3.5Å; D93-N96 PolarHBondContact O-N 3.02Å; D93-S97 WeakPolarHBondContact O-CB 3.03Å; D93-S97 PolarHBondContact O-N 2.92Å; D93-S97 PolarHBondContact O-OG 3.43Å; D93-S97 VanDerWaalsContact O-OG 3.13Å
94L77.3Confident74Confident54 Ų5470.4 Ų70.428%0.28339%0.393SS..Hα-helixtrans-55.8-48.9171.2-179.164000111.6L80 V84 I89 S90 N96 S97 V98L80-L94 HydrophobicContact CB-CD1 4.14Å; L80-L94 HydrophobicContact CD1-CD1 4.36Å; L80-L94 HydrophobicContact CD2-CD1 4.23Å; L80-L94 HydrophobicContact CG-CD1 4.48Å; V84-L94 HydrophobicContact CG2-CD1 3.8Å; V84-L94 HydrophobicContact CG2-CD2 3.81Å; V84-L94 HydrophobicContact CG2-CG 4.34Å; I89-L94 HydrophobicContact CD1-CB 4.04Å; I89-L94 HydrophobicContact CD1-CD1 4.3Å; I89-L94 HydrophobicContact CG1-CB 4.43Å; S90-L94 PolarHBondContact O-N 2.85Å; L94-N96 VanDerWaalsContact C-N 3.34Å; L94-N96 PolarHBondContact O-N 3.04Å; L94-S97 PolarHBondContact O-N 3.09Å; L94-V98 HydrophobicContact CD1-CG2 4.29Å; L94-V98 VanDerWaalsContact O-CG2 3.31Å; L94-V98 WeakPolarHBondContact O-CG2 3.44Å; L94-V98 PolarHBondContact O-N 3.33Å
95V76.2Confident73.4Confident84 Ų8477.5 Ų77.551%0.50941%0.413SS..Hα-helixtrans-60-44.5178170.20000111.3G91 R92 D93 V98 L99G91-V95 VanDerWaalsContact O-CG2 3.32Å; G91-V95 WeakPolarHBondContact O-CG2 3.34Å; G91-V95 PolarHBondContact O-N 3.27Å; R92-V95 PolarHBondContact O-N 2.89Å; D93-V95 PolarHBondContact O-N 3.5Å; V95-V98 PolarHBondContact O-N 3.15Å; V95-L99 HydrophobicContact CG1-CD1 3.87Å; V95-L99 HydrophobicContact CG1-CG 4.38Å; V95-L99 WeakPolarHBondContact O-CB 3.49Å; V95-L99 VanDerWaalsContact O-CG 3.26Å; V95-L99 WeakPolarHBondContact O-CG 3.43Å; V95-L99 PolarHBondContact O-N 3.15Å
96N77.2Confident72.6Confident82 Ų8279 Ų7944%0.43941%0.413SS..Hα-helixtrans-63.3-42.7178.2-72.3-23.6000112.2R92 D93 L94 L99 Y100R92-N96 PolarHBondContact O-N 3.48Å; R92-N96 VanDerWaalsContact O-N 3.1Å; D93-N96 PolarHBondContact O-N 3.02Å; L94-N96 VanDerWaalsContact C-N 3.34Å; L94-N96 PolarHBondContact O-N 3.04Å; N96-L99 PolarHBondContact O-N 2.67Å; N96-Y100 PolarHBondContact O-N 3.22Å
97S75.7Confident71.5Confident9 Ų983.2 Ų83.26%0.06344%0.438CS..Hα-helixtrans-64.2-43.9178.5-66.30000111.8L63 D93 L94 Y100 V101L63-S97 WeakPolarHBondContact CD1-OG 3.49Å; D93-S97 WeakPolarHBondContact O-CB 3.03Å; D93-S97 PolarHBondContact O-N 2.92Å; D93-S97 PolarHBondContact O-OG 3.43Å; D93-S97 VanDerWaalsContact O-OG 3.13Å; L94-S97 PolarHBondContact O-N 3.09Å; S97-Y100 WeakPolarHBondContact O-CB 3.49Å; S97-Y100 PolarHBondContact O-N 2.69Å; S97-V101 WeakPolarHBondContact O-CG2 3Å; S97-V101 PolarHBondContact O-N 3.48Å; S97-V101 VanDerWaalsContact O-N 3.08Å
98V78.8Confident71.5Confident50 Ų5084.9 Ų84.930%0.30344%0.435SS..Hα-helixtrans-64.1-42.8176174.50000111.1F77 L80 L94 V95 Y100 V101 V102F77-V98 HydrophobicContact CE1-CG1 4.41Å; F77-V98 HydrophobicContact CE1-CG2 4.18Å; L80-V98 HydrophobicContact CD1-CG2 4.16Å; L94-V98 HydrophobicContact CD1-CG2 4.29Å; L94-V98 VanDerWaalsContact O-CG2 3.31Å; L94-V98 WeakPolarHBondContact O-CG2 3.44Å; L94-V98 PolarHBondContact O-N 3.33Å; V95-V98 PolarHBondContact O-N 3.15Å; V98-Y100 VanDerWaalsContact C-N 3.29Å; V98-Y100 PolarHBondContact O-N 2.99Å; V98-V101 PolarHBondContact O-N 3.19Å; V98-V102 HydrophobicContact CG1-CG2 4.42Å; V98-V102 WeakPolarHBondContact O-CG2 3.05Å; V98-V102 PolarHBondContact O-N 3.24Å
99L78.5Confident71.4Confident97 Ų9783.9 Ų83.951%0.50843%0.432SS..Hα-helixtrans-61.9-37.9176-75.5172.2000112.2V95 N96 V102 S103V95-L99 HydrophobicContact CG1-CD1 3.87Å; V95-L99 HydrophobicContact CG1-CG 4.38Å; V95-L99 WeakPolarHBondContact O-CB 3.49Å; V95-L99 VanDerWaalsContact O-CG 3.26Å; V95-L99 WeakPolarHBondContact O-CG 3.43Å; V95-L99 PolarHBondContact O-N 3.15Å; N96-L99 PolarHBondContact O-N 2.67Å; L99-V102 PolarHBondContact O-N 3.21Å; L99-S103 VanDerWaalsContact O-CB 3.28Å; L99-S103 WeakPolarHBondContact O-CB 3.35Å; L99-S103 PolarHBondContact O-N 3.12Å; L99-S103 PolarHBondContact O-OG 3.37Å
100Y75.5Confident71.4Confident93 Ų9387.6 Ų87.637%0.36545%0.451SS..Hα-helixtrans-61.5-49.3175.1-178-89.1000110.9I67 N96 S97 V98 V102 S103 D104I67-Y100 HydrophobicContact CB-CD1 4.18Å; I67-Y100 HydrophobicContact CB-CE1 4.13Å; I67-Y100 HydrophobicContact CD1-CD1 3.63Å; I67-Y100 HydrophobicContact CD1-CE1 4.43Å; I67-Y100 HydrophobicContact CD1-CG 4.09Å; I67-Y100 HydrophobicContact CG2-CD1 3.88Å; I67-Y100 HydrophobicContact CG2-CE1 3.65Å; N96-Y100 PolarHBondContact O-N 3.22Å; S97-Y100 WeakPolarHBondContact O-CB 3.49Å; S97-Y100 PolarHBondContact O-N 2.69Å; V98-Y100 VanDerWaalsContact C-N 3.29Å; V98-Y100 PolarHBondContact O-N 2.99Å; Y100-V102 VanDerWaalsContact C-N 3.34Å; Y100-V102 PolarHBondContact O-N 3.48Å; Y100-S103 PolarHBondContact O-N 3.37Å; Y100-D104 WeakPolarHBondContact O-CB 3.37Å; Y100-D104 PolarHBondContact O-N 3.21Å
101V72.5Confident71.3Confident9 Ų992.1 Ų92.16%0.05547%0.473CS..Hα-helixtrans-58.6-45.4177.9177.50000111.5A73 I76 F77 S97 V98 S103 D104 W105A73-V101 HydrophobicContact CB-CG1 3.76Å; I76-V101 HydrophobicContact CB-CG2 3.94Å; I76-V101 HydrophobicContact CD1-CG2 3.8Å; I76-V101 HydrophobicContact CG1-CG2 4.46Å; I76-V101 HydrophobicContact CG2-CG2 3.4Å; I76-V101 VanDerWaalsContact CG2-CG2 3.4Å; F77-V101 HydrophobicContact CE2-CG1 3.83Å; F77-V101 HydrophobicContact CZ-CG1 4.06Å; S97-V101 WeakPolarHBondContact O-CG2 3Å; S97-V101 PolarHBondContact O-N 3.48Å; S97-V101 VanDerWaalsContact O-N 3.08Å; V98-V101 PolarHBondContact O-N 3.19Å; V101-S103 VanDerWaalsContact C-N 3.33Å; V101-S103 PolarHBondContact O-N 2.93Å; V101-D104 PolarHBondContact O-N 2.97Å; V101-W105 WeakPolarHBondContact O-CB 3.3Å; V101-W105 PolarHBondContact O-N 3.04Å
102V71.4Confident71.3Confident78 Ų7894.4 Ų94.447%0.47347%0.467SS..Hα-helixtrans-66.3-37.5179.2174.30000111.4V98 L99 Y100 M106V98-V102 HydrophobicContact CG1-CG2 4.42Å; V98-V102 WeakPolarHBondContact O-CG2 3.05Å; V98-V102 PolarHBondContact O-N 3.24Å; L99-V102 PolarHBondContact O-N 3.21Å; Y100-V102 VanDerWaalsContact C-N 3.34Å; Y100-V102 PolarHBondContact O-N 3.48Å; V102-M106 WeakPolarHBondContact O-CB 3.49Å; V102-M106 PolarHBondContact O-N 2.95Å
103S72.1Confident71.1Confident65 Ų6587.9 Ų87.946%0.45545%0.45SS..Hα-helixtrans-70.9-40.6179.1-57.30000111.9L99 Y100 V101 W105 M106 L107L99-S103 VanDerWaalsContact O-CB 3.28Å; L99-S103 WeakPolarHBondContact O-CB 3.35Å; L99-S103 PolarHBondContact O-N 3.12Å; L99-S103 PolarHBondContact O-OG 3.37Å; Y100-S103 PolarHBondContact O-N 3.37Å; V101-S103 VanDerWaalsContact C-N 3.33Å; V101-S103 PolarHBondContact O-N 2.93Å; S103-W105 VanDerWaalsContact C-N 3.32Å; S103-M106 PolarHBondContact O-N 2.96Å; S103-L107 PolarHBondContact O-N 3.43Å
104D65.1Low70.8Confident80 Ų8091.7 Ų91.743%0.42847%0.469SS..Hα-helixtrans-65.5-37.1175.9-163.765.9000111Y100 V101 M106 L107Y100-D104 WeakPolarHBondContact O-CB 3.37Å; Y100-D104 PolarHBondContact O-N 3.21Å; V101-D104 PolarHBondContact O-N 2.97Å; D104-M106 VanDerWaalsContact C-N 3.26Å; D104-M106 PolarHBondContact O-N 3.19Å; D104-L107 PolarHBondContact O-N 3.03Å
105W60.8Low70.3Confident218 Ų21894.6 Ų94.683%0.82648%0.483SS*.Hα-helixtrans-70-20.6174.7-16271.1000114.1V101 S103V101-W105 WeakPolarHBondContact O-CB 3.3Å; V101-W105 PolarHBondContact O-N 3.04Å; S103-W105 VanDerWaalsContact C-N 3.32Å
106M57.9Low69.8Low161 Ų16195.5 Ų95.579%0.79348%0.481SS*.THydrogen-bonded Turntrans-91.4-10-179.5-149.2177.281.500113.3V102 S103 D104V102-M106 WeakPolarHBondContact O-CB 3.49Å; V102-M106 PolarHBondContact O-N 2.95Å; S103-M106 PolarHBondContact O-N 2.96Å; D104-M106 VanDerWaalsContact C-N 3.26Å; D104-M106 PolarHBondContact O-N 3.19Å
107L52.6Low69.2Low204 Ų20496.7 Ų96.7100%1.06849%0.485SS*.  trans-95.10177.6-75168.5000111.6S103 D104S103-L107 PolarHBondContact O-N 3.43Å; D104-L107 PolarHBondContact O-N 3.03Å

Retrieved 107 of 107 residues in 46.3 ms (Link to these results)