A0A087WZI8_HUMAN Loading...

Mucin 1, cell surface associated

AlphaFold DB , UniProt , Accession A0A087WZI8, Species HUMAN (Homo sapiens, Human), Gene MUC1, Length 126 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
1M48.6Very low68.9Low236 Ų236113.5 Ų113.5100%1.16362%0.617SS**  01190-65166.392.200106.7P3M1-P3 VanDerWaalsContact O-CD 3.22Å; M1-P3 WeakPolarHBondContact O-CD 3.22Å
2T59.4Low70.3Confident108 Ų108112.4 Ų112.466%0.66361%0.61SS**  trans-74.9111.1177.140.90000108.9G4T2-G4 PolarHBondContact O-N 3.45Å
3P57.7Low71.7Confident131 Ų131111.9 Ų111.985%0.85161%0.606SS**THydrogen-bonded Turntrans-73.93.5-171.929.6-33.5000114M1M1-P3 VanDerWaalsContact O-CD 3.22Å; M1-P3 WeakPolarHBondContact O-CD 3.22Å
4G60Low72.8Confident23 Ų23110.3 Ų110.324%0.23760%0.596CS.*THydrogen-bonded Turntrans-91.6-20.3-174.700000115.8T2 Q6 F10T2-G4 PolarHBondContact O-N 3.45Å; G4-Q6 VanDerWaalsContact C-N 3.35Å; G4-Q6 PolarHBondContact O-N 3.08Å; G4-F10 VanDerWaalsContact O-CB 3.28Å; G4-F10 WeakPolarHBondContact O-CB 3.07Å; G4-F10 WeakPolarHBondContact O-CD1 3.44Å; G4-F10 VanDerWaalsContact O-CG 3.27Å; G4-F10 WeakPolarHBondContact O-CG 3.28Å
5T59.9Low73.6Confident86 Ų86109.9 Ų109.953%0.52859%0.592SS.*THydrogen-bonded Turntrans-82.4-8-17246.80000114.8
6Q65Low74.3Confident185 Ų185108.2 Ų108.286%0.86459%0.587SS**THydrogen-bonded Turntrans-90.1-13.5176.2-71-169.3-1200113.6G4 P8G4-Q6 VanDerWaalsContact C-N 3.35Å; G4-Q6 PolarHBondContact O-N 3.08Å; Q6-P8 WeakPolarHBondContact O-CD 3.28Å
7S78.4Confident75Confident49 Ų49106.6 Ų106.634%0.34358%0.581SS.*  trans-84.3117.5-179.8-179.10000109.8F9 F10 L11S7-F9 PolarHBondContact O-N 3.49Å; S7-F9 PolarHBondContact OG-N 2.98Å; S7-F10 WeakPolarHBondContact O-CB 3.27Å; S7-F10 PolarHBondContact O-N 2.96Å; S7-L11 PolarHBondContact O-N 3.15Å
8P76.9Confident75.6Confident82 Ų82106.5 Ų106.553%0.53258%0.58SS.*Hα-helixtrans-59.8-29.7175.824.8-33.2000111.3Q6 F10 L11 L12Q6-P8 WeakPolarHBondContact O-CD 3.28Å; P8-F10 PolarHBondContact O-N 3.11Å; P8-L11 PolarHBondContact O-N 3.2Å; P8-L12 WeakPolarHBondContact O-CB 3.48Å; P8-L12 VanDerWaalsContact O-CG 3.26Å; P8-L12 WeakPolarHBondContact O-CG 3.34Å; P8-L12 PolarHBondContact O-N 3Å
9F82.9Confident75.9Confident161 Ų161105.2 Ų105.271%0.70658%0.576SS**Hα-helixtrans-65.5-36.2174.5-67.9-81.5000113.1S7 L12 L13S7-F9 PolarHBondContact O-N 3.49Å; S7-F9 PolarHBondContact OG-N 2.98Å; F9-L12 PolarHBondContact O-N 3.06Å; F9-L13 VanDerWaalsContact O-CB 3.28Å; F9-L13 WeakPolarHBondContact O-CB 3.38Å; F9-L13 PolarHBondContact O-N 3.33Å
10F83.6Confident76.1Confident90 Ų90105.5 Ų105.540%0.39558%0.58SS.*Hα-helixtrans-68.7-40.5178.8-173.8-101.2000111.2G4 S7 P8 L13 L14G4-F10 VanDerWaalsContact O-CB 3.28Å; G4-F10 WeakPolarHBondContact O-CB 3.07Å; G4-F10 WeakPolarHBondContact O-CD1 3.44Å; G4-F10 VanDerWaalsContact O-CG 3.27Å; G4-F10 WeakPolarHBondContact O-CG 3.28Å; S7-F10 WeakPolarHBondContact O-CB 3.27Å; S7-F10 PolarHBondContact O-N 2.96Å; P8-F10 PolarHBondContact O-N 3.11Å; F10-L13 PolarHBondContact O-N 2.87Å; F10-L14 HydrophobicContact CD1-CD1 3.76Å; F10-L14 HydrophobicContact CD2-CD1 4.19Å; F10-L14 HydrophobicContact CE1-CD1 3.43Å; F10-L14 VanDerWaalsContact CE1-CD1 3.43Å; F10-L14 HydrophobicContact CE1-CD2 4.35Å; F10-L14 HydrophobicContact CE2-CD1 3.9Å; F10-L14 HydrophobicContact CG-CD1 4.13Å; F10-L14 HydrophobicContact CZ-CD1 3.51Å; F10-L14 WeakPolarHBondContact O-CD1 3.26Å; F10-L14 PolarHBondContact O-N 3.29Å
11L85.4Confident76.1Confident97 Ų97106.1 Ų106.151%0.50859%0.587SS.*Hα-helixtrans-66.1-41.4175-63176.7000112S7 P8 L14 L15S7-L11 PolarHBondContact O-N 3.15Å; P8-L11 PolarHBondContact O-N 3.2Å; L11-L14 PolarHBondContact O-N 3.44Å; L11-L15 VanDerWaalsContact O-CB 3.28Å; L11-L15 WeakPolarHBondContact O-CB 3.37Å; L11-L15 PolarHBondContact O-N 3.42Å
12L85.8Confident77.2Confident101 Ų10198.8 Ų98.853%0.52956%0.556SS.*Hα-helixtrans-63-43.6174.5-72.7169.5000111.4P8 F9 L15 T16P8-L12 WeakPolarHBondContact O-CB 3.48Å; P8-L12 VanDerWaalsContact O-CG 3.26Å; P8-L12 WeakPolarHBondContact O-CG 3.34Å; P8-L12 PolarHBondContact O-N 3Å; F9-L12 PolarHBondContact O-N 3.06Å; L12-L15 PolarHBondContact O-N 3.5Å; L12-T16 WeakPolarHBondContact O-CB 3.26Å; L12-T16 PolarHBondContact O-N 3.49Å; L12-T16 PolarHBondContact O-OG1 3.19Å
13L88.1Confident77.3Confident106 Ų10696.5 Ų96.556%0.55555%0.554SS**Hα-helixtrans-61.9-46.4176.6-177.165.3000111.3F9 F10 L15 T16 V17F9-L13 VanDerWaalsContact O-CB 3.28Å; F9-L13 WeakPolarHBondContact O-CB 3.38Å; F9-L13 PolarHBondContact O-N 3.33Å; F10-L13 PolarHBondContact O-N 2.87Å; L13-L15 VanDerWaalsContact C-N 3.33Å; L13-L15 PolarHBondContact O-N 2.8Å; L13-T16 PolarHBondContact O-N 2.9Å; L13-V17 HydrophobicContact CD1-CG2 4.39Å; L13-V17 WeakPolarHBondContact O-CB 3.28Å; L13-V17 VanDerWaalsContact O-CG2 3.26Å; L13-V17 WeakPolarHBondContact O-CG2 3.45Å; L13-V17 PolarHBondContact O-N 2.96Å
14L87.7Confident77.4Confident89 Ų8996.3 Ų96.347%0.46656%0.555SS.*Hα-helixtrans-59.8-44.6174.4-99.479000111.3F10 L11 V17 L18F10-L14 HydrophobicContact CD1-CD1 3.76Å; F10-L14 HydrophobicContact CD2-CD1 4.19Å; F10-L14 HydrophobicContact CE1-CD1 3.43Å; F10-L14 VanDerWaalsContact CE1-CD1 3.43Å; F10-L14 HydrophobicContact CE1-CD2 4.35Å; F10-L14 HydrophobicContact CE2-CD1 3.9Å; F10-L14 HydrophobicContact CG-CD1 4.13Å; F10-L14 HydrophobicContact CZ-CD1 3.51Å; F10-L14 WeakPolarHBondContact O-CD1 3.26Å; F10-L14 PolarHBondContact O-N 3.29Å; L11-L14 PolarHBondContact O-N 3.44Å; L14-V17 PolarHBondContact O-N 2.91Å; L14-L18 WeakPolarHBondContact O-CB 3.22Å; L14-L18 PolarHBondContact O-N 3.27Å
15L84.2Confident77.4Confident104 Ų10498 Ų9855%0.54557%0.572SS.*Hα-helixtrans-64.2-42.6179.9-17763000111.3L11 L12 L13 T19L11-L15 VanDerWaalsContact O-CB 3.28Å; L11-L15 WeakPolarHBondContact O-CB 3.37Å; L11-L15 PolarHBondContact O-N 3.42Å; L12-L15 PolarHBondContact O-N 3.5Å; L13-L15 VanDerWaalsContact C-N 3.33Å; L13-L15 PolarHBondContact O-N 2.8Å; L15-T19 WeakPolarHBondContact O-CB 3.43Å; L15-T19 PolarHBondContact O-N 2.91Å; L15-T19 PolarHBondContact O-OG1 2.83Å
16T84.8Confident77.1Confident83 Ų83103.2 Ų103.251%0.50959%0.59SS.*Hα-helixtrans-65.3-47.1176.2-60.30000111.3L12 L13 L18 T19 V20L12-T16 WeakPolarHBondContact O-CB 3.26Å; L12-T16 PolarHBondContact O-N 3.49Å; L12-T16 PolarHBondContact O-OG1 3.19Å; L13-T16 PolarHBondContact O-N 2.9Å; T16-L18 VanDerWaalsContact C-N 3.34Å; T16-L18 PolarHBondContact O-N 3.42Å; T16-T19 PolarHBondContact O-N 2.89Å; T16-V20 HydrophobicContact CG2-CG2 4.42Å; T16-V20 WeakPolarHBondContact O-CB 3.26Å; T16-V20 VanDerWaalsContact O-CG2 3.29Å; T16-V20 WeakPolarHBondContact O-CG2 3.5Å; T16-V20 PolarHBondContact O-N 3.38Å
17V87.6Confident76.4Confident81 Ų8198.9 Ų98.949%0.49159%0.586SS.*Hα-helixtrans-61.6-45.5177171.50000110.2L13 L14 T19 V20 V21L13-V17 HydrophobicContact CD1-CG2 4.39Å; L13-V17 WeakPolarHBondContact O-CB 3.28Å; L13-V17 VanDerWaalsContact O-CG2 3.26Å; L13-V17 WeakPolarHBondContact O-CG2 3.45Å; L13-V17 PolarHBondContact O-N 2.96Å; L14-V17 PolarHBondContact O-N 2.91Å; V17-T19 VanDerWaalsContact C-N 3.33Å; V17-T19 PolarHBondContact O-N 3.41Å; V17-V20 PolarHBondContact O-N 3.47Å; V17-V21 HydrophobicContact CG1-CG2 4.18Å; V17-V21 VanDerWaalsContact O-CB 3.26Å; V17-V21 WeakPolarHBondContact O-CB 3.33Å; V17-V21 WeakPolarHBondContact O-CG2 3.4Å; V17-V21 PolarHBondContact O-N 2.88Å
18L84.6Confident75.1Confident105 Ų105102 Ų10255%0.5561%0.608SS.*Hα-helixtrans-62.6-41.5176.2-174.664.4000111.1L14 T16 V20 V21 T22L14-L18 WeakPolarHBondContact O-CB 3.22Å; L14-L18 PolarHBondContact O-N 3.27Å; T16-L18 VanDerWaalsContact C-N 3.34Å; T16-L18 PolarHBondContact O-N 3.42Å; L18-V20 PolarHBondContact O-N 3.39Å; L18-V21 PolarHBondContact O-N 2.83Å; L18-T22 WeakPolarHBondContact CD1-OG1 3.28Å; L18-T22 WeakPolarHBondContact O-CA 3.46Å; L18-T22 WeakPolarHBondContact O-CB 3.32Å; L18-T22 PolarHBondContact O-N 3.26Å; L18-T22 PolarHBondContact O-OG1 3.02Å
19T80.9Confident73.6Confident82 Ų82103 Ų10350%0.50362%0.617SS.*Hα-helixtrans-68.8-33178.5-58.20000111.9L15 T16 V17 G23L15-T19 WeakPolarHBondContact O-CB 3.43Å; L15-T19 PolarHBondContact O-N 2.91Å; L15-T19 PolarHBondContact O-OG1 2.83Å; T16-T19 PolarHBondContact O-N 2.89Å; V17-T19 VanDerWaalsContact C-N 3.33Å; V17-T19 PolarHBondContact O-N 3.41Å; T19-G23 WeakPolarHBondContact O-CA 3.16Å; T19-G23 PolarHBondContact O-N 3.47Å
20V79.9Confident72Confident111 Ų111100.4 Ų100.467%0.67362%0.615SS**Hα-helixtrans-76.2-40.4175.6171.50000110.9T16 V17 L18T16-V20 HydrophobicContact CG2-CG2 4.42Å; T16-V20 WeakPolarHBondContact O-CB 3.26Å; T16-V20 VanDerWaalsContact O-CG2 3.29Å; T16-V20 WeakPolarHBondContact O-CG2 3.5Å; T16-V20 PolarHBondContact O-N 3.38Å; V17-V20 PolarHBondContact O-N 3.47Å; L18-V20 PolarHBondContact O-N 3.39Å
21V77.3Confident70.3Confident118 Ų118102.2 Ų102.272%0.71564%0.635SS**Hα-helixtrans-72.7-30.4178.4173.80000111.7V17 L18V17-V21 HydrophobicContact CG1-CG2 4.18Å; V17-V21 VanDerWaalsContact O-CB 3.26Å; V17-V21 WeakPolarHBondContact O-CB 3.33Å; V17-V21 WeakPolarHBondContact O-CG2 3.4Å; V17-V21 PolarHBondContact O-N 2.88Å; L18-V21 PolarHBondContact O-N 2.83Å
22T72.1Confident68.5Low83 Ų83101 Ų10151%0.50965%0.646SS.*Hα-helixtrans-99.1-10.5179-41.10000112.2L18 S24 G25L18-T22 WeakPolarHBondContact CD1-OG1 3.28Å; L18-T22 WeakPolarHBondContact O-CA 3.46Å; L18-T22 WeakPolarHBondContact O-CB 3.32Å; L18-T22 PolarHBondContact O-N 3.26Å; L18-T22 PolarHBondContact O-OG1 3.02Å; T22-S24 PolarHBondContact O-N 2.85Å; T22-G25 PolarHBondContact O-N 3.44Å
23G61.6Low67.3Low60 Ų6099.6 Ų99.662%0.61966%0.656SS**THydrogen-bonded Turntrans-79.141.8-170.100000115.7T19T19-G23 WeakPolarHBondContact O-CA 3.16Å; T19-G23 PolarHBondContact O-N 3.47Å
24S58.8Low65.4Low127 Ų127103.5 Ų103.589%0.88867%0.671SS**THydrogen-bonded Turntrans-136.920.3166.4-177.10000112.5T22T22-S24 PolarHBondContact O-N 2.85Å
25G59.2Low63.8Low57 Ų57108.3 Ų108.359%0.58869%0.689SS**SBendtrans-161.8103.9177.400000113.6T22T22-G25 PolarHBondContact O-N 3.44Å
26H54.4Low61.8Low196 Ų196112.4 Ų112.491%0.90771%0.705SS**SBendtrans85.277.2147.1-140.481.6000118.5
27A50.3Low59.9Low95 Ų95113.6 Ų113.679%0.78571%0.712SS**  trans-159.725143.800000114.5S29A27-S29 PolarHBondContact O-N 3.01Å
28S51.7Low58Low113 Ų113115.1 Ų115.179%0.7973%0.727SS**  trans-86.465.4155.3170.80000107.7T30S28-T30 PolarHBondContact O-N 3.2Å; S28-T30 VanDerWaalsContact O-N 3.1Å
29S43.8Very low56.1Low104 Ų104114.1 Ų114.173%0.72773%0.733SS**  trans-79.587.916351.80000107.2A27A27-S29 PolarHBondContact O-N 3.01Å
30T50.9Low54.3Low107 Ų107116.2 Ų116.266%0.65675%0.746SS**  trans-30.9132151-460000110.1S28 G32S28-T30 PolarHBondContact O-N 3.2Å; S28-T30 VanDerWaalsContact O-N 3.1Å; T30-G32 PolarHBondContact O-N 2.74Å
31P47.4Very low52.8Low128 Ų128119.5 Ų119.583%0.83175%0.754SS**  trans-73.480.7168.930.3-28.9000107.4G33P31-G33 PolarHBondContact O-N 2.67Å
32G48.4Very low51.4Low71 Ų71125.2 Ų125.273%0.73276%0.763SS**  trans-6996.4171.800000108.4T30 E34T30-G32 PolarHBondContact O-N 2.74Å; G32-E34 PolarHBondContact O-N 3.03Å
33G60.5Low50.6Low71 Ų71126.4 Ų126.473%0.73278%0.775SS**  trans-70.4124.5170.300000110.3P31P31-G33 PolarHBondContact O-N 2.67Å
34E47.3Very low49.8Very low189 Ų189128.8 Ų128.888%0.88378%0.782SS**  trans-160.3126.2136.149-165.4135.200110.3G32G32-E34 PolarHBondContact O-N 3.03Å
35K54.8Low49.5Very low190 Ų190128.4 Ų128.483%0.82677%0.774SS**  trans85.671.7161.6-152.1169.6-175.5-71.10117.5
36E40.8Very low48.9Very low189 Ų189131.2 Ų131.288%0.88378%0.782SS**  trans-117121.7141.2-170.193.1123.600108.4
37T45.4Very low48.4Very low109 Ų109125.3 Ų125.367%0.66976%0.762SS**  trans-58.9126.1178.8-54.70000111.5
38S47.9Very low48.5Very low113 Ų113125.1 Ų125.179%0.7976%0.755SS**  trans69.2136.3148.8-146.20000120.4
39A45.6Very low48.5Very low84 Ų84124.4 Ų124.469%0.69475%0.747SS**  trans85.5106.6151.800000119.8
40T42.8Very low48.9Very low126 Ų126126.6 Ų126.677%0.77375%0.745SS**  trans81.298.2132.4-52.90000118.4
41Q48.7Very low49Very low179 Ų179128.8 Ų128.884%0.83675%0.746SS**  55106.1128.4-158.5-169.763.400118.1
42R48.2Very low49.4Very low238 Ų238127.2 Ų127.290%0.89873%0.73SS**  -163121.2129.1-115.8178.5-179.2-170.50.3112.6
43S53.6Low49.9Very low109 Ų109126.4 Ų126.476%0.76272%0.717SS**  trans-58.2133.1161.31670000110.4
44S46.7Very low49.9Very low109 Ų109125.8 Ų125.876%0.76271%0.705SS**  trans-158.2104.8146.460.10000110.2
45V51.8Low50.6Low120 Ų120121.5 Ų121.573%0.72769%0.687SS**  trans-10.7133154-171.90000114.6S47V45-S47 PolarHBondContact O-N 2.98Å; V45-S47 VanDerWaalsContact O-N 3.11Å
46P45.2Very low51.2Low116 Ų116118.7 Ų118.775%0.75368%0.677SS**  trans-59.4121.1171.425.5-31.8000109.1S48P46-S48 PolarHBondContact O-N 3.41Å
47S45.9Very low52.5Low71 Ų71116.1 Ų116.150%0.49767%0.665SS.*  trans-56.2122.5-173.1-177.20000111V45 T49 E50V45-S47 PolarHBondContact O-N 2.98Å; V45-S47 VanDerWaalsContact O-N 3.11Å; S47-T49 PolarHBondContact O-N 2.91Å; S47-T49 PolarHBondContact OG-OG1 3.28Å; S47-E50 PolarHBondContact O-N 2.94Å
48S52.3Low53.7Low91 Ų91113.6 Ų113.664%0.63666%0.655SS**THydrogen-bonded Turntrans-53.1-2.2173.1-167.90000114.8P46 N52P46-S48 PolarHBondContact O-N 3.41Å; S48-N52 PolarHBondContact O-ND2 3.01Å
49T51.3Low54.7Low99 Ų99114.6 Ų114.661%0.60765%0.647SS**Hα-helixtrans-74.7-33.1-178.5-48.20000112.6S47 A53S47-T49 PolarHBondContact O-N 2.91Å; S47-T49 PolarHBondContact OG-OG1 3.28Å; T49-A53 PolarHBondContact O-N 3.02Å
50E51.3Low56Low149 Ų149115.8 Ų115.870%0.69664%0.641SS**Hα-helixtrans-73-35.7-176.8-68.6-179.996.300112.6S47 N52 A53 A54S47-E50 PolarHBondContact O-N 2.94Å; E50-N52 PolarHBondContact O-N 3.46Å; E50-A53 PolarHBondContact O-N 3.38Å; E50-A54 PolarHBondContact O-N 2.78Å; E50-A54 VanDerWaalsContact O-N 3.14Å
51K52.4Low57.3Low154 Ų154115.6 Ų115.667%0.6764%0.635SS**Hα-helixtrans-68.5-36.3178.9-170.5174.3175.7170.30112.2L55K51-L55 HydrophobicContact CG-CD1 4.26Å; K51-L55 WeakPolarHBondContact O-CB 3.26Å; K51-L55 VanDerWaalsContact O-CG 3.28Å; K51-L55 WeakPolarHBondContact O-CG 3.29Å; K51-L55 PolarHBondContact O-N 3.23Å
52N56.9Low58.5Low95 Ų95112.3 Ų112.351%0.50862%0.622SS.*Hα-helixtrans-70-37.4177.6-75.9-65.5000112.1S48 E50 L55 H56S48-N52 PolarHBondContact O-ND2 3.01Å; E50-N52 PolarHBondContact O-N 3.46Å; N52-L55 PolarHBondContact O-N 2.76Å; N52-H56 WeakPolarHBondContact O-CB 3.48Å; N52-H56 PolarHBondContact O-N 3.44Å
53A58Low58.9Low54 Ų54110.3 Ų110.345%0.44662%0.615SS.*Hα-helixtrans-64.7-43.8175.700000111.9T49 E50 H56 Q57T49-A53 PolarHBondContact O-N 3.02Å; E50-A53 PolarHBondContact O-N 3.38Å; A53-H56 PolarHBondContact O-N 3.48Å; A53-Q57 WeakPolarHBondContact O-CG 3.28Å; A53-Q57 PolarHBondContact O-N 2.65Å
54A60.4Low59.2Low58 Ų58109.7 Ų109.748%0.47961%0.609SS.*Hα-helixtrans-64.4-41176.900000112.4E50 Q57 A58E50-A54 PolarHBondContact O-N 2.78Å; E50-A54 VanDerWaalsContact O-N 3.14Å; A54-Q57 PolarHBondContact O-N 3.45Å; A54-A58 WeakPolarHBondContact O-CB 3.34Å; A54-A58 PolarHBondContact O-N 2.75Å
55L63.6Low59.7Low99 Ų99109.9 Ų109.952%0.51861%0.606SS.*Hα-helixtrans-66.1-39.4176.1-73.1173.3000112.2K51 N52 A58 Q59K51-L55 HydrophobicContact CG-CD1 4.26Å; K51-L55 WeakPolarHBondContact O-CB 3.26Å; K51-L55 VanDerWaalsContact O-CG 3.28Å; K51-L55 WeakPolarHBondContact O-CG 3.29Å; K51-L55 PolarHBondContact O-N 3.23Å; N52-L55 PolarHBondContact O-N 2.76Å; L55-A58 PolarHBondContact O-N 3.44Å; L55-Q59 VanDerWaalsContact O-CB 3.29Å; L55-Q59 WeakPolarHBondContact O-CB 3.44Å; L55-Q59 PolarHBondContact O-N 2.83Å
56H67.8Low59.8Low131 Ų131109 Ų10961%0.60660%0.601SS**Hα-helixtrans-63.7-42174.2-98.6-170.1000112.7N52 A53 Q59 L60N52-H56 WeakPolarHBondContact O-CB 3.48Å; N52-H56 PolarHBondContact O-N 3.44Å; A53-H56 PolarHBondContact O-N 3.48Å; H56-Q59 PolarHBondContact O-N 3.5Å; H56-L60 VanDerWaalsContact O-CG 3.28Å; H56-L60 WeakPolarHBondContact O-CG 3.12Å; H56-L60 PolarHBondContact O-N 3.29Å
57Q66.8Low60Low135 Ų135105.8 Ų105.863%0.63158%0.584SS**Hα-helixtrans-66-41.8176.5-72.5-169.9-11.500112.1A53 A54 Q59 L60 L61A53-Q57 WeakPolarHBondContact O-CG 3.28Å; A53-Q57 PolarHBondContact O-N 2.65Å; A54-Q57 PolarHBondContact O-N 3.45Å; Q57-Q59 VanDerWaalsContact C-N 3.35Å; Q57-Q59 PolarHBondContact O-N 3.44Å; Q57-L60 PolarHBondContact O-N 2.97Å; Q57-L61 WeakPolarHBondContact O-CG 3.18Å; Q57-L61 PolarHBondContact O-N 3.43Å
58A70.4Confident60.1Low55 Ų55108.1 Ų108.146%0.45560%0.598SS.*Hα-helixtrans-64-39.5175.700000112.1A54 L55 L61 L62A54-A58 WeakPolarHBondContact O-CB 3.34Å; A54-A58 PolarHBondContact O-N 2.75Å; L55-A58 PolarHBondContact O-N 3.44Å; A58-L61 PolarHBondContact O-N 2.85Å; A58-L62 WeakPolarHBondContact O-CB 3.36Å; A58-L62 PolarHBondContact O-N 3.49Å
59Q69.9Low59.9Low134 Ų134110.5 Ų110.563%0.62660%0.603SS**Hα-helixtrans-68.1-36.3178.3-162.2178.2-7700112.2L55 H56 Q57 W63L55-Q59 VanDerWaalsContact O-CB 3.29Å; L55-Q59 WeakPolarHBondContact O-CB 3.44Å; L55-Q59 PolarHBondContact O-N 2.83Å; H56-Q59 PolarHBondContact O-N 3.5Å; Q57-Q59 VanDerWaalsContact C-N 3.35Å; Q57-Q59 PolarHBondContact O-N 3.44Å; Q59-W63 WeakPolarHBondContact O-CB 2.91Å; Q59-W63 PolarHBondContact O-N 2.9Å
60L72.3Confident59.7Low110 Ų110112.3 Ų112.358%0.57662%0.616SS**Hα-helixtrans-68.7-43.1174.5-72.4168.8000112H56 Q57 L62 W63 C64H56-L60 VanDerWaalsContact O-CG 3.28Å; H56-L60 WeakPolarHBondContact O-CG 3.12Å; H56-L60 PolarHBondContact O-N 3.29Å; Q57-L60 PolarHBondContact O-N 2.97Å; L60-L62 VanDerWaalsContact C-N 3.31Å; L60-L62 PolarHBondContact O-N 3.4Å; L60-W63 PolarHBondContact O-N 2.61Å; L60-C64 WeakPolarHBondContact O-CB 3.29Å; L60-C64 PolarHBondContact O-N 3.02Å; L60-C64 PolarHBondContact O-SG 2.97Å
61L71.1Confident59.6Low121 Ų121109 Ų10963%0.63462%0.622SS**Hα-helixtrans-62.2-40.5175.1-74.8163.4000111.6Q57 A58 C64 T65Q57-L61 WeakPolarHBondContact O-CG 3.18Å; Q57-L61 PolarHBondContact O-N 3.43Å; A58-L61 PolarHBondContact O-N 2.85Å; L61-C64 PolarHBondContact O-N 3.36Å; L61-T65 WeakPolarHBondContact O-CB 3.41Å; L61-T65 WeakPolarHBondContact O-CG2 3.02Å; L61-T65 PolarHBondContact O-N 3.07Å; L61-T65 PolarHBondContact O-OG1 2.9Å
62L72.5Confident59.1Low111 Ų111108.2 Ų108.258%0.58163%0.625SS**Hα-helixtrans-67.1-40.2176.2-170.362000111.7A58 L60 T65 T66A58-L62 WeakPolarHBondContact O-CB 3.36Å; A58-L62 PolarHBondContact O-N 3.49Å; L60-L62 VanDerWaalsContact C-N 3.31Å; L60-L62 PolarHBondContact O-N 3.4Å; L62-T65 WeakPolarHBondContact CA-OG1 3.42Å; L62-T65 PolarHBondContact O-N 3.48Å; L62-T65 PolarHBondContact O-OG1 3.4Å; L62-T66 VanDerWaalsContact O-CB 3.26Å; L62-T66 WeakPolarHBondContact O-CB 3.48Å; L62-T66 PolarHBondContact O-N 3.14Å; L62-T66 PolarHBondContact O-OG1 3.33Å
63W56.9Low58.4Low195 Ų195109 Ų10974%0.73964%0.635SS**Hα-helixtrans-65.4-42.4174.2-175.9-93.1000112.1Q59 L60 T65 T66 A67Q59-W63 WeakPolarHBondContact O-CB 2.91Å; Q59-W63 PolarHBondContact O-N 2.9Å; L60-W63 PolarHBondContact O-N 2.61Å; W63-T65 VanDerWaalsContact C-N 3.29Å; W63-T65 PolarHBondContact O-N 2.75Å; W63-T66 PolarHBondContact O-N 3.43Å; W63-A67 WeakPolarHBondContact O-CB 3.49Å; W63-A67 PolarHBondContact O-N 3.5Å
64C59.6Low57.8Low96 Ų96113.4 Ų113.465%0.64965%0.646SS**Hα-helixtrans-67-28.6177.3-73.40000113.2L60 L61L60-C64 WeakPolarHBondContact O-CB 3.29Å; L60-C64 PolarHBondContact O-N 3.02Å; L60-C64 PolarHBondContact O-SG 2.97Å; L61-C64 PolarHBondContact O-N 3.36Å
65T57.2Low57Low114 Ų114116.2 Ų116.270%0.69966%0.659SS**Hα-helixtrans-86.1-21.9175.745.60000113.1L61 L62 W63L61-T65 WeakPolarHBondContact O-CB 3.41Å; L61-T65 WeakPolarHBondContact O-CG2 3.02Å; L61-T65 PolarHBondContact O-N 3.07Å; L61-T65 PolarHBondContact O-OG1 2.9Å; L62-T65 WeakPolarHBondContact CA-OG1 3.42Å; L62-T65 PolarHBondContact O-N 3.48Å; L62-T65 PolarHBondContact O-OG1 3.4Å; W63-T65 VanDerWaalsContact C-N 3.29Å; W63-T65 PolarHBondContact O-N 2.75Å
66T53.6Low56.1Low100 Ų100119.5 Ų119.561%0.61367%0.672SS**Hα-helixtrans-99.5-8.4-179.8-44.40000113L62 W63 P68L62-T66 VanDerWaalsContact O-CB 3.26Å; L62-T66 WeakPolarHBondContact O-CB 3.48Å; L62-T66 PolarHBondContact O-N 3.14Å; L62-T66 PolarHBondContact O-OG1 3.33Å; W63-T66 PolarHBondContact O-N 3.43Å; T66-P68 VanDerWaalsContact O-CD 3.28Å; T66-P68 WeakPolarHBondContact O-CD 3.28Å
67A50.4Low55Low49 Ų49118.2 Ų118.241%0.40568%0.676SS.*SBendtrans-67.8115.717500000110W63 L69W63-A67 WeakPolarHBondContact O-CB 3.49Å; W63-A67 PolarHBondContact O-N 3.5Å; A67-L69 PolarHBondContact O-N 3.46Å
68P47.6Very low53.8Low120 Ų120116 Ų11678%0.77968%0.681SS**  trans-71.2118.3176.528.7-29.3000108.1T66T66-P68 VanDerWaalsContact O-CD 3.28Å; T66-P68 WeakPolarHBondContact O-CD 3.28Å
69L48.2Very low52.9Low142 Ų142125.6 Ų125.674%0.74371%0.705SS**  trans-55.8127.2169.4-111.785.9000108.9A67 G71A67-L69 PolarHBondContact O-N 3.46Å; L69-G71 PolarHBondContact O-N 3.06Å
70P46.6Very low51.6Low137 Ų137122.6 Ų122.689%0.8970%0.703SS**THydrogen-bonded Turntrans-74.594.7173.728.9-29.2000108.4
71G49.6Very low50.1Low80 Ų80124.8 Ų124.883%0.82571%0.714SS**THydrogen-bonded Turntrans1456.3169.700000118.5L69L69-G71 PolarHBondContact O-N 3.06Å
72L42.7Very low49.1Very low137 Ų137128.4 Ų128.472%0.71773%0.728SS**SBendtrans-110.8140.6173.5-137.2121.1000109.8Q74L72-Q74 PolarHBondContact O-N 2.85Å; L72-Q74 VanDerWaalsContact O-N 3.11Å
73P42.1Very low48Very low111 Ų111127.9 Ų127.972%0.72173%0.733SS**  trans-58.1123.2177.223.3-31.4000108.8
74Q45.5Very low47.5Very low147 Ų147126.6 Ų126.669%0.68774%0.736SS**  trans-50.9129.2175.2-169.6-149.7-9.900109.1L72 Q76L72-Q74 PolarHBondContact O-N 2.85Å; L72-Q74 VanDerWaalsContact O-N 3.11Å; Q74-Q76 PolarHBondContact O-N 2.91Å
75P43.1Very low46.7Very low116 Ų116131.8 Ų131.875%0.75375%0.748SS**  trans-62.2108.6163.9-13.126.7000106.6P77P75-P77 WeakPolarHBondContact O-CD 3.47Å
76Q44.3Very low45.9Very low168 Ų168131.2 Ų131.279%0.78575%0.746SS**  trans-55.7126.2169.4-72.3177.2-17.200107Q74 A78Q74-Q76 PolarHBondContact O-N 2.91Å; Q76-A78 PolarHBondContact O-N 3.27Å
77P45.7Very low45.7Very low105 Ų105130.9 Ų130.968%0.68275%0.753SS**  trans-62.1109.6166.824.4-28000105.4P75 R79P75-P77 WeakPolarHBondContact O-CD 3.47Å; P77-R79 VanDerWaalsContact C-N 3.35Å; P77-R79 PolarHBondContact O-N 3.41Å
78A41.2Very low45.7Very low89 Ų89133.5 Ų133.574%0.73676%0.764SS**  trans-52.4104.817500000107.3Q76 A80Q76-A78 PolarHBondContact O-N 3.27Å; A78-A80 PolarHBondContact O-N 2.79Å
79R50.8Low45.7Very low256 Ų256134.3 Ų134.397%0.96677%0.767SS**  trans-66.881.8163.7-87.2-175.4165.8150.7-4107.3P77P77-R79 VanDerWaalsContact C-N 3.35Å; P77-R79 PolarHBondContact O-N 3.41Å
80A42.5Very low45.7Very low70 Ų70135.3 Ų135.358%0.57977%0.772SS**  trans175.8108161.600000104.6A78A78-A80 PolarHBondContact O-N 2.79Å
81L40.3Very low46Very low157 Ų157135.6 Ų135.682%0.82277%0.765SS**  cis-146.6125.545.2-67.9165.1000106.6S83L81-S83 VanDerWaalsContact C-N 3.26Å; L81-S83 PolarHBondContact O-N 3.28Å
82H50.3Low45.7Very low196 Ų196139.2 Ų139.291%0.90776%0.764SS**  30.862.884-80.4-110000113.2
83S49.5Very low45.9Very low100 Ų100140.1 Ų140.170%0.69977%0.769SS**  trans-172.7127.6142.2-165.90000110.6L81L81-S83 VanDerWaalsContact C-N 3.26Å; L81-S83 PolarHBondContact O-N 3.28Å
84Q46Very low46.2Very low169 Ų169140.2 Ų140.279%0.7977%0.77SS**  trans83.170.1149.5-142.6165.4-28.200117.4
85F42.8Very low46.3Very low205 Ų205139.1 Ų139.190%0.89978%0.775SS**  trans-63.8139.5144.7-75.5-88.3000109.8
86P40.5Very low46.5Very low102 Ų102140.7 Ų140.766%0.66278%0.777SS**  trans-104.6124.9139.2-7.626.3000110.3T88P86-T88 PolarHBondContact O-N 3.1Å
87A50.9Low46.5Very low92 Ų92138.4 Ų138.476%0.7678%0.776SS**  trans-73.873.5-173.700000114.2
88T49.1Very low46.9Very low105 Ų105137.2 Ų137.264%0.64478%0.776SS**  trans-134.22.8178.317.70000117.7P86P86-T88 PolarHBondContact O-N 3.1Å
89T47.2Very low47Very low136 Ų136141.1 Ų141.183%0.83478%0.782SS**  trans-109.640.1173.8-42.30000112
90L49.6Very low46.6Very low163 Ų163132.8 Ų132.885%0.85377%0.768SS**  trans-10129.3164.4-69.5-178.4000111.6
91I51.3Low47Very low143 Ų143135.5 Ų135.573%0.73378%0.78SS**SBendtrans-105.6-11.8-179.2-62-175.5000112.7
92L44.3Very low47.7Very low156 Ų156139.1 Ų139.182%0.81778%0.783SS**SBendtrans-132.420.9-172.7-131.781.4000117.1
93L47.9Very low47.5Very low156 Ų156138.2 Ų138.282%0.81778%0.784SS**  trans-136144.2163-97.990.2000107.3
94P48.5Very low47.3Very low113 Ų113141.2 Ų141.273%0.73479%0.788SS**  cis-141-163.98.742.8-20.2000112.5
95P47.4Very low47.4Very low124 Ų124138.1 Ų138.181%0.80578%0.783SS**  -137157.168.232.3-11.6000115.4
96L47.3Very low47.9Very low150 Ų150135.4 Ų135.479%0.78578%0.783SS**  trans-51.4164.4175.6-147.368.6000113.9
97P44Very low48.3Very low119 Ų119134.8 Ų134.877%0.77379%0.787SS**  -135.7138.4110.136-25.2000114.5
98A53.9Low48.4Very low81 Ų81138.3 Ų138.367%0.66979%0.792SS**  trans-56.3132.1166.900000111.8
99I44Very low48.6Very low170 Ų170139 Ų13987%0.87280%0.796SS**  trans-128.4122.7149.3-62179.1000107.4
100A40.4Very low48.8Very low81 Ų81140 Ų14067%0.66979%0.794SS**  trans-64.6155.9-165.600000114.9R102A100-R102 PolarHBondContact O-N 2.81Å
101P52.7Low48.9Very low128 Ų128136.9 Ų136.983%0.83179%0.792SS**  trans-88.5102.3167.633.9-25.8000109
102R53.9Low48.9Very low233 Ų233141.7 Ų141.788%0.87980%0.801SS**  trans-150.482.6167.9-85.6-153.8164.7-160.9-3.7112.4A100A100-R102 PolarHBondContact O-N 2.81Å
103L46.8Very low49.1Very low177 Ų177138.4 Ų138.493%0.92779%0.791SS**  trans-127.6108.5146.6-81.1170.3000107.9
104M44.9Very low49.2Very low162 Ų162138.8 Ų138.880%0.79879%0.789SS**  trans-62.3155.5174.1-77.2-151.577.200111.5V106M104-V106 PolarHBondContact O-N 3.11Å; M104-V106 VanDerWaalsContact O-N 3.15Å
105P48.7Very low49.1Very low104 Ų104142.2 Ų142.268%0.67580%0.795SS**  trans-75.8104.3-175.730.1-33.1000111.5A107P105-A107 PolarHBondContact O-N 3.5Å; P105-A107 VanDerWaalsContact O-N 3.08Å
106V53.3Low49.5Very low148 Ų148147.3 Ų147.390%0.89780%0.798SS**  trans-81.762.2160.7-176.20000108.5M104M104-V106 PolarHBondContact O-N 3.11Å; M104-V106 VanDerWaalsContact O-N 3.15Å
107A47.5Very low49.6Very low90 Ų90147.2 Ų147.274%0.74480%0.797SS**  trans-14023.9177.100000112.5P105P105-A107 PolarHBondContact O-N 3.5Å; P105-A107 VanDerWaalsContact O-N 3.08Å
108L54.5Low49.6Very low165 Ų165149.4 Ų149.486%0.86480%0.802SS**  trans-11255.4175.5-161.889.1000111.5
109T53.3Low49.4Very low120 Ų120150.8 Ų150.874%0.73680%0.804SS**SBendtrans-141-12.6174.6-410000115.7
110I51.6Low49.9Very low157 Ų157154.7 Ų154.781%0.80581%0.808SS**SBendtrans-120.438.4-174.2-37.2-176.9000113.1
111A50.3Low49.9Very low97 Ų97155.5 Ų155.580%0.80282%0.815SS**SBendtrans-125.3-0.1172.300000114.2
112R52.8Low49.7Very low244 Ų244153.7 Ų153.792%0.92181%0.81SS**SBendtrans-108.3-3.4178.7-103.1-176.4175.4179.2-0.8115.3
113S47.4Very low49.5Very low88 Ų88150.7 Ų150.762%0.61581%0.806SS**SBendtrans-96.4-4.2-176.6-166.90000115.2
114Q49.6Very low49.4Very low163 Ų163152.1 Ų152.176%0.76280%0.799SS**SBendtrans-102.7-1.6-176.8-61-62.2-12.200114
115H47.2Very low49.3Very low185 Ų185152.2 Ų152.286%0.85680%0.797SS**SBendtrans-94.413.9-176.9-144-72.6000114.1
116R54.7Low49.3Very low232 Ų232160.5 Ų160.588%0.87582%0.823SS**SBendtrans-13919.3-172.4-136.5-175.2-168-130.32.9116.7
117L50.8Low49.1Very low148 Ų148161.2 Ų161.278%0.77582%0.82SS**SBendtrans-150.689.1176.8-74.2173000112.1
118L43.8Very low49.2Very low164 Ų164164.9 Ų164.986%0.85982%0.824SS**  trans156.3156.3130.9-11181.9000111.9
119P48.8Very low48.9Very low111 Ų111164.9 Ų164.972%0.72182%0.821SS**  -122.6170.1-124.920.26.3000113.4A121P119-A121 PolarHBondContact O-N 3.03Å
120R53.8Low48.7Very low251 Ų251167.5 Ų167.595%0.94783%0.826SS**  trans-42.7119163.8-169.1-174-167.7163.63.2114
121A42.1Very low48.5Very low99 Ų99168.2 Ų168.282%0.81883%0.828SS**  trans-176137.2153.800000106.7P119P119-A121 PolarHBondContact O-N 3.03Å
122A48.2Very low48.4Very low89 Ų89172.9 Ų172.974%0.73683%0.83SS**  cis-157.8128.8-0.500000103.3
123E49.3Very low48.1Very low170 Ų170167.9 Ų167.979%0.79482%0.823SS**  45.2126.991.5-142.9-176.1-163.300115.7
124R44.3Very low48.1Very low208 Ų208174 Ų17479%0.78584%0.839SS**  trans79.5130.2172.7-39.7-176.2-154.4164.35.5114.8
125H44.1Very low48Very low163 Ų163174.9 Ų174.976%0.75585%0.845SS**  cis-149.5159.242.1-96.6-100.5000111.5
126F48.5Very low48Very low279 Ų279174 Ų174100%1.22484%0.844SS**  trans-41.30177.8-76.7-96.7000116.8

Retrieved 126 of 126 residues in 193.7 ms (Link to these results)