G4M143_SCHMA Loading...

Transmembrane protein

AlphaFold DB , UniProt , Accession G4M143, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 144 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
1M37.1Very low43.8Very low245 Ų245114.8 Ų114.8100%1.20774%0.744SS**  0101.50-75.6149.368.900108.6G3M1-G3 PolarHBondContact O-N 3.11Å
2S41.3Very low44.4Very low128 Ų128110.7 Ų110.790%0.89572%0.715SS**  trans-83.7100.1175-152.30000107G4S2-G4 PolarHBondContact O-N 3.03Å; S2-G4 VanDerWaalsContact O-N 3.11Å
3G40.6Very low45.1Very low73 Ų73107.9 Ų107.975%0.75370%0.695SS**  trans-58.6114.5175.600000108.6M1 G5M1-G3 PolarHBondContact O-N 3.11Å; G3-G5 PolarHBondContact O-N 2.78Å
4G38.4Very low45.5Very low69 Ų69108.6 Ų108.671%0.71168%0.682SS**  trans-52.6113177.800000109S2 V6S2-G4 PolarHBondContact O-N 3.03Å; S2-G4 VanDerWaalsContact O-N 3.11Å; G4-V6 PolarHBondContact O-N 2.66Å
5G42.7Very low46.4Very low72 Ų72105.1 Ų105.174%0.74266%0.663SS**  trans-55.4114.3167.600000106.6G3 S7G3-G5 PolarHBondContact O-N 2.78Å; G5-S7 VanDerWaalsContact C-N 3.32Å; G5-S7 PolarHBondContact O-N 3.04Å
6V44.9Very low47.1Very low126 Ų126109.4 Ų109.476%0.76466%0.662SS**  trans-51.9104.4173.3177.50000105.6G4 I8G4-V6 PolarHBondContact O-N 2.66Å; V6-I8 HydrophobicContact CG1-CG1 3.93Å; V6-I8 PolarHBondContact O-N 2.66Å
7S47.7Very low47.7Very low108 Ų108106.9 Ų106.976%0.75564%0.643SS**  trans-65.984.1167.352.80000104.9G5 D9G5-S7 VanDerWaalsContact C-N 3.32Å; G5-S7 PolarHBondContact O-N 3.04Å; S7-D9 PolarHBondContact O-N 3.13Å
8I46.4Very low48.3Very low121 Ų121105.7 Ų105.762%0.62164%0.636SS**  trans-59.5102.6167.1-60.8174.6000103.1V6 K10 V13V6-I8 HydrophobicContact CG1-CG1 3.93Å; V6-I8 PolarHBondContact O-N 2.66Å; I8-K10 PolarHBondContact O-N 3.09Å; I8-V13 HydrophobicContact CG2-CG2 4.09Å
9D44.5Very low49.2Very low99 Ų99108.8 Ų108.853%0.52964%0.636SS.*  trans-50.2109-173.1-174.1-1.1000107.7S7 A11 V12S7-D9 PolarHBondContact O-N 3.13Å; D9-A11 PolarHBondContact O-N 2.84Å; D9-A11 PolarHBondContact OD1-N 2.84Å; D9-V12 HydrophobicContact CB-CG2 3.85Å; D9-V12 WeakPolarHBondContact O-CB 3.43Å; D9-V12 PolarHBondContact O-N 3.05Å
10K47.3Very low49.7Very low161 Ų161108.5 Ų108.570%0.763%0.631SS**Hα-helixtrans-53.4-32.5-173.7-69.7-179.8178.1-177.50109.7I8 V12 V13 F14I8-K10 PolarHBondContact O-N 3.09Å; K10-V12 VanDerWaalsContact C-N 3.28Å; K10-V12 PolarHBondContact O-N 2.74Å; K10-V13 PolarHBondContact O-N 2.8Å; K10-F14 VanDerWaalsContact O-CD2 3.22Å; K10-F14 WeakPolarHBondContact O-CD2 2.87Å; K10-F14 PolarHBondContact O-N 3.06Å
11A50.9Low50Low61 Ų61108 Ų10850%0.50463%0.625SS.*Hα-helixtrans-59.5-34.4175.800000113.2D9 S15D9-A11 PolarHBondContact O-N 2.84Å; D9-A11 PolarHBondContact OD1-N 2.84Å; A11-S15 WeakPolarHBondContact O-CB 3.25Å; A11-S15 PolarHBondContact O-N 2.81Å
12V51.5Low50.9Low65 Ų65102.7 Ų102.739%0.39460%0.595SS.*Hα-helixtrans-71.1-39.6-177.1178.60000111.5D9 K10 S15 R16D9-V12 HydrophobicContact CB-CG2 3.85Å; D9-V12 WeakPolarHBondContact O-CB 3.43Å; D9-V12 PolarHBondContact O-N 3.05Å; K10-V12 VanDerWaalsContact C-N 3.28Å; K10-V12 PolarHBondContact O-N 2.74Å; V12-S15 PolarHBondContact O-N 2.88Å; V12-S15 PolarHBondContact O-OG 3.28Å; V12-R16 PolarHBondContact O-N 3.02Å
13V52.8Low51.6Low75 Ų75105.1 Ų105.146%0.45559%0.585SS.*Hα-helixtrans-70.1-46.8179.7-176.60000110.5I8 K10 S15 R16 I17I8-V13 HydrophobicContact CG2-CG2 4.09Å; K10-V13 PolarHBondContact O-N 2.8Å; V13-S15 VanDerWaalsContact C-N 3.26Å; V13-S15 PolarHBondContact O-N 2.9Å; V13-R16 PolarHBondContact O-N 2.81Å; V13-I17 HydrophobicContact CG1-CD1 3.99Å; V13-I17 WeakPolarHBondContact O-CG1 3.34Å; V13-I17 PolarHBondContact O-N 3.31Å
14F51.7Low52.2Low118 Ų118107.3 Ų107.352%0.51858%0.579SS.*Hα-helixtrans-59.3-39171.9-76.1-74.3000111.1K10 R16 I17 V18 F116K10-F14 VanDerWaalsContact O-CD2 3.22Å; K10-F14 WeakPolarHBondContact O-CD2 2.87Å; K10-F14 PolarHBondContact O-N 3.06Å; F14-R16 VanDerWaalsContact C-N 3.33Å; F14-R16 PolarHBondContact O-N 3.33Å; F14-I17 PolarHBondContact O-N 2.78Å; F14-V18 WeakPolarHBondContact O-CB 3.46Å; F14-V18 WeakPolarHBondContact O-CG2 3.34Å; F14-V18 PolarHBondContact O-N 3.04Å; F14-F116 HydrophobicContact CE1-CZ 4.13Å
15S58.5Low52.8Low56 Ų56108 Ų10839%0.39257%0.569SS.*Hα-helixtrans-62.1-38.1177.583.10000112.7A11 V12 V13 R19A11-S15 WeakPolarHBondContact O-CB 3.25Å; A11-S15 PolarHBondContact O-N 2.81Å; V12-S15 PolarHBondContact O-N 2.88Å; V12-S15 PolarHBondContact O-OG 3.28Å; V13-S15 VanDerWaalsContact C-N 3.26Å; V13-S15 PolarHBondContact O-N 2.9Å; S15-R19 WeakPolarHBondContact O-CB 2.99Å; S15-R19 PolarHBondContact O-N 2.81Å
16R58Low53Low174 Ų174111.2 Ų111.266%0.65756%0.563SS**Hα-helixtrans-71.2-43.6178.3-74.2-172.1-178.5-1651.7111.1V12 V13 F14 R19 L20V12-R16 PolarHBondContact O-N 3.02Å; V13-R16 PolarHBondContact O-N 2.81Å; F14-R16 VanDerWaalsContact C-N 3.33Å; F14-R16 PolarHBondContact O-N 3.33Å; R16-R19 PolarHBondContact O-N 3.45Å; R16-L20 WeakPolarHBondContact O-CB 3.12Å; R16-L20 VanDerWaalsContact O-CG 3.24Å; R16-L20 WeakPolarHBondContact O-CG 3.26Å; R16-L20 PolarHBondContact O-N 3.24Å
17I57.2Low53.2Low67 Ų67109 Ų10934%0.34455%0.549SS..Hα-helixtrans-67.7-46179.5-63170.1000110.4V13 F14 R19 L20 L21V13-I17 HydrophobicContact CG1-CD1 3.99Å; V13-I17 WeakPolarHBondContact O-CG1 3.34Å; V13-I17 PolarHBondContact O-N 3.31Å; F14-I17 PolarHBondContact O-N 2.78Å; I17-R19 VanDerWaalsContact C-N 3.32Å; I17-R19 PolarHBondContact O-N 3.49Å; I17-L20 PolarHBondContact O-N 3.35Å; I17-L21 HydrophobicContact CG2-CD1 3.87Å; I17-L21 WeakPolarHBondContact O-CB 3.49Å; I17-L21 WeakPolarHBondContact O-CG 3.39Å; I17-L21 PolarHBondContact O-N 3.42Å
18V58.5Low53.3Low85 Ų85106 Ų10652%0.51553%0.528SS..Hα-helixtrans-63.4-38.2174.5175.10000110.9F14 L21 K22F14-V18 WeakPolarHBondContact O-CB 3.46Å; F14-V18 WeakPolarHBondContact O-CG2 3.34Å; F14-V18 PolarHBondContact O-N 3.04Å; V18-L21 PolarHBondContact O-N 3.32Å; V18-K22 WeakPolarHBondContact O-CB 3.27Å; V18-K22 PolarHBondContact O-N 3.29Å
19R64.2Low53.6Low165 Ų165104.2 Ų104.262%0.62353%0.525SS*.Hα-helixtrans-67.5-36.3174.4-177.2-179.4-85.2170.6-6.3112S15 R16 I17 R23S15-R19 WeakPolarHBondContact O-CB 2.99Å; S15-R19 PolarHBondContact O-N 2.81Å; R16-R19 PolarHBondContact O-N 3.45Å; I17-R19 VanDerWaalsContact C-N 3.32Å; I17-R19 PolarHBondContact O-N 3.49Å; R19-R23 WeakPolarHBondContact O-CG 3.42Å; R19-R23 PolarHBondContact O-N 2.83Å
20L59Low53.9Low102 Ų102104 Ų10453%0.53453%0.526SS..Hα-helixtrans-68.2-45173.5-75.1168.9000111.3R16 I17 K22 R23 L24R16-L20 WeakPolarHBondContact O-CB 3.12Å; R16-L20 VanDerWaalsContact O-CG 3.24Å; R16-L20 WeakPolarHBondContact O-CG 3.26Å; R16-L20 PolarHBondContact O-N 3.24Å; I17-L20 PolarHBondContact O-N 3.35Å; L20-K22 VanDerWaalsContact C-N 3.33Å; L20-K22 PolarHBondContact O-N 3.42Å; L20-R23 CarbonylContact O-C 3.58Å; L20-R23 WeakPolarHBondContact O-CA 3.2Å; L20-R23 WeakPolarHBondContact O-CB 3.29Å; L20-R23 PolarHBondContact O-N 3.39Å; L20-L24 PolarHBondContact O-N 3.5Å
21L58Low54.3Low97 Ų97105.1 Ų105.151%0.50853%0.527SS..Hα-helixtrans-60.7-42.6173.8-79.7159.5000111.3I17 V18 R23 L24 T25I17-L21 HydrophobicContact CG2-CD1 3.87Å; I17-L21 WeakPolarHBondContact O-CB 3.49Å; I17-L21 WeakPolarHBondContact O-CG 3.39Å; I17-L21 PolarHBondContact O-N 3.42Å; V18-L21 PolarHBondContact O-N 3.32Å; L21-R23 VanDerWaalsContact C-N 3.28Å; L21-R23 PolarHBondContact O-N 3.38Å; L21-L24 PolarHBondContact O-N 2.83Å; L21-L24 VanDerWaalsContact O-N 3.16Å; L21-T25 PolarHBondContact O-N 2.79Å; L21-T25 PolarHBondContact O-OG1 2.97Å
22K54.2Low54.3Low135 Ų135110 Ų11059%0.58753%0.532SS*.Hα-helixtrans-63.4-33.8173.4-157.9173.3-170.7176.10111.1V18 L20 T25 F26V18-K22 WeakPolarHBondContact O-CB 3.27Å; V18-K22 PolarHBondContact O-N 3.29Å; L20-K22 VanDerWaalsContact C-N 3.33Å; L20-K22 PolarHBondContact O-N 3.42Å; K22-T25 WeakPolarHBondContact CA-OG1 3.43Å; K22-F26 HydrophobicContact CG-CD2 3.95Å; K22-F26 HydrophobicContact CG-CE2 3.83Å; K22-F26 WeakPolarHBondContact O-CB 3.21Å; K22-F26 WeakPolarHBondContact O-CD2 3.4Å; K22-F26 PolarHBondContact O-N 2.9Å
23R56.9Low54.2Low178 Ų178110.6 Ų110.667%0.67253%0.532SS*.Hα-helixtrans-69.7-37.8172-77.3178.2177.5-166.6-1.2112.5R19 L20 L21R19-R23 WeakPolarHBondContact O-CG 3.42Å; R19-R23 PolarHBondContact O-N 2.83Å; L20-R23 CarbonylContact O-C 3.58Å; L20-R23 WeakPolarHBondContact O-CA 3.2Å; L20-R23 WeakPolarHBondContact O-CB 3.29Å; L20-R23 PolarHBondContact O-N 3.39Å; L21-R23 VanDerWaalsContact C-N 3.28Å; L21-R23 PolarHBondContact O-N 3.38Å
24L52.5Low54.1Low120 Ų120116 Ų11663%0.62855%0.545SS*.Hα-helixtrans-73-43.1179.9-74.1162.5000112.6L20 L21 F26 V27L20-L24 PolarHBondContact O-N 3.5Å; L21-L24 PolarHBondContact O-N 2.83Å; L21-L24 VanDerWaalsContact O-N 3.16Å; L24-F26 VanDerWaalsContact C-N 3.28Å; L24-F26 PolarHBondContact O-N 3.27Å; L24-V27 PolarHBondContact O-N 3.14Å
25T52.1Low54.2Low84 Ų84113.3 Ų113.352%0.51554%0.544SS..Hα-helixtrans-68.5-24.4177.535.50000113.3L21 K22L21-T25 PolarHBondContact O-N 2.79Å; L21-T25 PolarHBondContact O-OG1 2.97Å; K22-T25 WeakPolarHBondContact CA-OG1 3.43Å
26F46.5Very low53.8Low139 Ų139112.8 Ų112.861%0.6155%0.547SS*.THydrogen-bonded Turntrans-83.4-6.1178-91-94.8000114.7K22 L24 S28K22-F26 HydrophobicContact CG-CD2 3.95Å; K22-F26 HydrophobicContact CG-CE2 3.83Å; K22-F26 WeakPolarHBondContact O-CB 3.21Å; K22-F26 WeakPolarHBondContact O-CD2 3.4Å; K22-F26 PolarHBondContact O-N 2.9Å; L24-F26 VanDerWaalsContact C-N 3.28Å; L24-F26 PolarHBondContact O-N 3.27Å; F26-S28 PolarHBondContact O-N 3.33Å
27V48.3Very low53.4Low78 Ų78110.4 Ų110.447%0.47355%0.548SS..SBendtrans-78.862.8157.3-167.60000107.1L24L24-V27 PolarHBondContact O-N 3.14Å
28S50.6Low52.9Low45 Ų45113.6 Ų113.632%0.31556%0.561SS.*  trans-49.8134.3170.5170.90000107.6F26 V30 R31F26-S28 PolarHBondContact O-N 3.33Å; S28-V30 PolarHBondContact O-N 3.38Å; S28-V30 VanDerWaalsContact OG-CB 3.3Å; S28-V30 WeakPolarHBondContact OG-CB 3.35Å; S28-V30 VanDerWaalsContact OG-CG2 3.29Å; S28-V30 WeakPolarHBondContact OG-CG2 3.41Å; S28-V30 PolarHBondContact OG-N 3.42Å; S28-R31 PolarHBondContact O-N 2.9Å
29P51.7Low52.4Low84 Ų84115 Ų11555%0.54557%0.57SS.*Hα-helixtrans-49-22.9170.8-2632.8000112.6R31 W32 L33P29-R31 VanDerWaalsContact C-N 3.32Å; P29-R31 PolarHBondContact O-N 3.37Å; P29-W32 CarbonylContact O-C 3.58Å; P29-W32 WeakPolarHBondContact O-CA 3.39Å; P29-W32 WeakPolarHBondContact O-CB 3.49Å; P29-W32 PolarHBondContact O-N 3.44Å; P29-W32 VanDerWaalsContact O-N 3.1Å; P29-L33 PolarHBondContact O-N 3.49Å
30V52Low51.6Low94 Ų94113.3 Ų113.357%0.5757%0.573SS**Hα-helixtrans-62-33.1173.6-175.30000113S28 W32 L33 R34S28-V30 PolarHBondContact O-N 3.38Å; S28-V30 VanDerWaalsContact OG-CB 3.3Å; S28-V30 WeakPolarHBondContact OG-CB 3.35Å; S28-V30 VanDerWaalsContact OG-CG2 3.29Å; S28-V30 WeakPolarHBondContact OG-CG2 3.41Å; S28-V30 PolarHBondContact OG-N 3.42Å; V30-W32 VanDerWaalsContact C-N 3.35Å; V30-L33 WeakPolarHBondContact O-CB 3.46Å; V30-L33 PolarHBondContact O-N 2.98Å; V30-R34 PolarHBondContact O-N 3.32Å
31R55.8Low50.8Low186 Ų186111 Ų11170%0.70257%0.574SS**Hα-helixtrans-69.8-33.7172.7-84.1-173.8165.7-161.8-3.9112S28 P29 R34 A35S28-R31 PolarHBondContact O-N 2.9Å; P29-R31 VanDerWaalsContact C-N 3.32Å; P29-R31 PolarHBondContact O-N 3.37Å; R31-R34 PolarHBondContact O-N 3.42Å; R31-A35 WeakPolarHBondContact O-CB 3.3Å; R31-A35 PolarHBondContact O-N 2.95Å
32W50.9Low50.2Low164 Ų164114.8 Ų114.862%0.62160%0.595SS**Hα-helixtrans-68.9-39.7170.6-79.574.5000111.5P29 V30 R34 A35 G36P29-W32 CarbonylContact O-C 3.58Å; P29-W32 WeakPolarHBondContact O-CA 3.39Å; P29-W32 WeakPolarHBondContact O-CB 3.49Å; P29-W32 PolarHBondContact O-N 3.44Å; P29-W32 VanDerWaalsContact O-N 3.1Å; V30-W32 VanDerWaalsContact C-N 3.35Å; W32-R34 VanDerWaalsContact C-N 3.29Å; W32-R34 PolarHBondContact O-N 3.19Å; W32-A35 PolarHBondContact O-N 3.48Å; W32-G36 PolarHBondContact O-N 2.92Å
33L48.9Very low49.5Very low76 Ų76111.3 Ų111.340%0.39860%0.597SS.*Hα-helixtrans-57.4-41.8170.7-78.3160.2000111.5P29 V30 N37 F98P29-L33 PolarHBondContact O-N 3.49Å; V30-L33 WeakPolarHBondContact O-CB 3.46Å; V30-L33 PolarHBondContact O-N 2.98Å; L33-N37 WeakPolarHBondContact O-CB 3.39Å; L33-N37 PolarHBondContact O-N 2.93Å; L33-F98 HydrophobicContact CD2-CZ 4.28Å
34R51.7Low48.6Very low190 Ų190111.3 Ų111.372%0.71761%0.605SS**Hα-helixtrans-73-30.6178-146-175.6-146.1-166.15.9113.3V30 R31 W32 Q38V30-R34 PolarHBondContact O-N 3.32Å; R31-R34 PolarHBondContact O-N 3.42Å; W32-R34 VanDerWaalsContact C-N 3.29Å; W32-R34 PolarHBondContact O-N 3.19Å; R34-Q38 WeakPolarHBondContact O-CB 3.33Å; R34-Q38 VanDerWaalsContact O-CG 3.27Å; R34-Q38 WeakPolarHBondContact O-CG 3.49Å; R34-Q38 PolarHBondContact O-N 2.98Å; R34-Q38 PolarHBondContact O-NE2 3.22Å
35A53.7Low47.9Very low60 Ų60114.9 Ų114.950%0.49662%0.615SS.*Hα-helixtrans-77.3-41.8175.700000111.5R31 W32 Q38R31-A35 WeakPolarHBondContact O-CB 3.3Å; R31-A35 PolarHBondContact O-N 2.95Å; W32-A35 PolarHBondContact O-N 3.48Å; A35-Q38 PolarHBondContact O-N 3.37Å
36G48.8Very low47.3Very low45 Ų45115.1 Ų115.146%0.46462%0.62SS.*Hα-helixtrans-67.2-39.2176.700000113W32 Q38W32-G36 PolarHBondContact O-N 2.92Å; G36-Q38 VanDerWaalsContact C-N 3.34Å; G36-Q38 PolarHBondContact O-N 2.88Å
37N50.4Low47.2Very low125 Ų125116.4 Ų116.467%0.66863%0.632SS**THydrogen-bonded Turntrans-80.9-10178.4-66.7-4.3000113.9L33L33-N37 WeakPolarHBondContact O-CB 3.39Å; L33-N37 PolarHBondContact O-N 2.93Å
38Q46.2Very low46.8Very low133 Ų133117 Ų11762%0.62164%0.636SS**THydrogen-bonded Turntrans-87.2-10.3173.8-87.3179.596.600113.2R34 A35 G36 D40 G41R34-Q38 WeakPolarHBondContact O-CB 3.33Å; R34-Q38 VanDerWaalsContact O-CG 3.27Å; R34-Q38 WeakPolarHBondContact O-CG 3.49Å; R34-Q38 PolarHBondContact O-N 2.98Å; R34-Q38 PolarHBondContact O-NE2 3.22Å; A35-Q38 PolarHBondContact O-N 3.37Å; G36-Q38 VanDerWaalsContact C-N 3.34Å; G36-Q38 PolarHBondContact O-N 2.88Å; Q38-D40 PolarHBondContact O-N 3.29Å; Q38-G41 PolarHBondContact O-N 2.96Å
39V48.2Very low46.6Very low116 Ų116120.3 Ų120.370%0.70366%0.655SS**THydrogen-bonded Turntrans-69.4-17.8177.11760000112.3
40D48.3Very low46.2Very low128 Ų128122.8 Ų122.868%0.68466%0.664SS**THydrogen-bonded Turntrans-107.68.5176.9-63.1-36.1000114Q38Q38-D40 PolarHBondContact O-N 3.29Å
41G41Very low45.6Very low54 Ų54125.6 Ų125.656%0.55768%0.676SS**SBendtrans-76.4-34.3-177.500000115.1Q38Q38-G41 PolarHBondContact O-N 2.96Å
42D46.6Very low45Very low177 Ų177123.2 Ų123.295%0.94768%0.675SS**SBendtrans-995.8-180-80.8-22.3000113.2
43G39.2Very low44.6Very low61 Ų61122.1 Ų122.163%0.62968%0.68SS**  trans-99.7-10.5-17700000115.4K45G43-K45 PolarHBondContact O-N 3.1Å
44Q37.3Very low44.2Very low179 Ų179123.7 Ų123.784%0.83670%0.695SS**  trans-73.475.8170.6-82.2-173.82.700109.4S46Q44-S46 PolarHBondContact O-N 3.21Å
45K38.7Very low43.7Very low195 Ų195121.6 Ų121.685%0.84870%0.696SS**  trans-51.4101.2146.9-88.3-179.2175.4177.80106.1G43 L47G43-K45 PolarHBondContact O-N 3.1Å; K45-L47 VanDerWaalsContact C-N 3.26Å; K45-L47 PolarHBondContact O-N 3.4Å
46S39Very low42.8Very low89 Ų89129.2 Ų129.262%0.62271%0.712SS**  trans-45.596.5159.3-178.80000107.6Q44 T48Q44-S46 PolarHBondContact O-N 3.21Å; S46-T48 PolarHBondContact O-N 2.81Å; S46-T48 WeakPolarHBondContact OG-CG2 3.24Å
47L43.6Very low42.3Very low165 Ų165133.9 Ų133.986%0.86473%0.727SS**  trans-80.468.9162.9-137.4113000104.7K45 T49K45-L47 VanDerWaalsContact C-N 3.26Å; K45-L47 PolarHBondContact O-N 3.4Å; L47-T49 PolarHBondContact O-N 2.92Å
48T40Very low41.7Very low91 Ų91131.2 Ų131.256%0.55872%0.722SS**  trans-52.3131.2168.634.10000107.6S46 D50S46-T48 PolarHBondContact O-N 2.81Å; S46-T48 WeakPolarHBondContact OG-CG2 3.24Å; T48-D50 PolarHBondContact O-N 3.36Å
49T46.8Very low41.3Very low114 Ų114132.4 Ų132.470%0.69973%0.733SS**THydrogen-bonded Turntrans-64.625.8-168.9-52.10000114.5L47 I52L47-T49 PolarHBondContact O-N 2.92Å; T49-I52 HydrophobicContact CG2-CD1 4.37Å
50D44Very low40.8Very low137 Ų137132.9 Ų132.973%0.73374%0.741SS**THydrogen-bonded Turntrans-101.2-1.9-172-62.8-34.4000114.3T48T48-D50 PolarHBondContact O-N 3.36Å
51N37.8Very low40.1Very low153 Ų153132.8 Ų132.882%0.81875%0.745SS**  trans-10316.6176.4-81.89.1000114.6I53N51-I53 PolarHBondContact O-N 2.9Å
52I44.7Very low39.6Very low136 Ų136135.8 Ų135.870%0.69775%0.753SS**  trans-73.788.2164.5-52.8177.9000107T49 P54T49-I52 HydrophobicContact CG2-CD1 4.37Å; I52-P54 WeakPolarHBondContact O-CD 3.36Å; I52-P54 VanDerWaalsContact O-N 3.15Å
53I41.2Very low38.8Very low140 Ų140133.7 Ų133.772%0.71874%0.742SS**  trans-49.6120.1165.3-61.3168.5000106.6N51 I55N51-I53 PolarHBondContact O-N 2.9Å; I53-I55 PolarHBondContact O-N 2.86Å
54P41Very low38.5Very low110 Ų110140.1 Ų140.171%0.71475%0.752SS**  trans-63.6115.5175.923.1-29.8000108.2I52 R56I52-P54 WeakPolarHBondContact O-CD 3.36Å; I52-P54 VanDerWaalsContact O-N 3.15Å; P54-R56 PolarHBondContact O-N 3.4Å
55I41.2Very low38.3Very low145 Ų145140.4 Ų140.474%0.74476%0.758SS**  trans-67.491.8169.1-59.2175.1000106.1I53 D57I53-I55 PolarHBondContact O-N 2.86Å; I55-D57 VanDerWaalsContact C-N 3.27Å; I55-D57 PolarHBondContact O-N 2.78Å; I55-D57 VanDerWaalsContact O-N 3.09Å
56R35.1Very low38.1Very low220 Ų220137.1 Ų137.183%0.8376%0.755SS**  trans-74.585.3167.9-177.1-177168.7-173.3-3.4107.2P54 A58P54-R56 PolarHBondContact O-N 3.4Å; R56-A58 VanDerWaalsContact C-N 3.28Å; R56-A58 PolarHBondContact O-N 3.38Å
57D37.1Very low37.8Very low144 Ų144135.8 Ų135.877%0.7775%0.754SS**  trans-75.691.6160.8-71.9-26000107.5I55I55-D57 VanDerWaalsContact C-N 3.27Å; I55-D57 PolarHBondContact O-N 2.78Å; I55-D57 VanDerWaalsContact O-N 3.09Å
58A39.1Very low37.4Very low68 Ų68138.4 Ų138.456%0.56275%0.754SS**  trans-66.8128.7167.200000109R56R56-A58 VanDerWaalsContact C-N 3.28Å; R56-A58 PolarHBondContact O-N 3.38Å
59N38Very low37.4Very low159 Ų159143.5 Ų143.585%0.8577%0.772SS**  trans7992.6167.5-60.4-3.4000117.8
60S36.6Very low37.2Very low126 Ų126142 Ų14288%0.88177%0.766SS**  -154.6105.2120.7-166.70000110.2
61T34.8Very low36.8Very low125 Ų125141.8 Ų141.877%0.76776%0.761SS**  trans-76.3134.9175.543.20000111.4
62T30.4Very low37.1Very low117 Ų117143.3 Ų143.372%0.71877%0.768SS**  trans81.3132.2141.7-129.70000120.5
63N29.1Very low36.7Very low134 Ų134148.3 Ų148.372%0.71778%0.778SS**  trans78.493.9153.3-60.5-7.2000118.8
64K32.7Very low36.7Very low196 Ų196148.8 Ų148.885%0.85278%0.775SS**  -168.595.3110.9-98.3166.8-172.3-177.20110.7V66K64-V66 VanDerWaalsContact C-N 3.3Å; K64-V66 PolarHBondContact O-N 3.37Å; K64-V66 VanDerWaalsContact O-N 3.11Å
65L34.2Very low36.8Very low184 Ų184148.3 Ų148.396%0.96377%0.774SS**  trans-64.692.8149.8-95.4117.6000107.4
66V33.4Very low36.8Very low127 Ų127148.5 Ų148.577%0.7778%0.777SS**  trans-145.196.1158.2-178.90000108.1K64K64-V66 VanDerWaalsContact C-N 3.3Å; K64-V66 PolarHBondContact O-N 3.37Å; K64-V66 VanDerWaalsContact O-N 3.11Å
67G33.9Very low37.3Very low60 Ų60147 Ų14762%0.61978%0.776SS**  trans45.6110146.500000119.3
68Y34.1Very low38Very low220 Ų220149.9 Ų149.986%0.86378%0.776SS**  trans-147.978134.8-101.5-82.3000108.1S70Y68-S70 PolarHBondContact O-N 2.82Å
69E39.9Very low38.5Very low199 Ų199157.8 Ų157.893%0.9379%0.791SS**  trans-7534.6166.6-145.2178.5-159.300110.9
70S42.2Very low39.1Very low81 Ų81156 Ų15657%0.56678%0.781SS**  trans-147.187.5-173.3-64.30000108.1Y68Y68-S70 PolarHBondContact O-N 2.82Å
71E36Very low39.8Very low133 Ų133153.5 Ų153.562%0.62176%0.763SS**  trans162.915.6148.8-90.7179.5160.300114.2R73 F74E71-R73 PolarHBondContact O-N 3.46Å; E71-F74 HydrophobicContact CB-CD2 4.11Å; E71-F74 HydrophobicContact CB-CE2 3.43Å; E71-F74 VanDerWaalsContact CB-CE2 3.43Å; E71-F74 HydrophobicContact CB-CZ 3.76Å; E71-F74 HydrophobicContact CG-CE2 4.34Å; E71-F74 HydrophobicContact CG-CZ 4.18Å; E71-F74 WeakPolarHBondContact O-CD2 3.1Å; E71-F74 WeakPolarHBondContact O-CE2 3.24Å; E71-F74 WeakPolarHBondContact O-CG 3.37Å; E71-F74 PolarHBondContact O-N 2.91Å; E71-F74 VanDerWaalsContact OE2-CZ 3.25Å; E71-F74 WeakPolarHBondContact OE2-CZ 3.4Å
72L43.5Very low40.7Very low185 Ų185151.3 Ų151.397%0.96976%0.758SS**THydrogen-bonded Turntrans-69.420.5168.7-100.5158.6000114.6F74L72-F74 VanDerWaalsContact C-N 3.27Å
73R37.2Very low41.9Very low242 Ų242150 Ų15091%0.91375%0.753SS**THydrogen-bonded Turntrans-88.617.2157.1-99.5-170-178.5-129.12.4112.5E71 S75E71-R73 PolarHBondContact O-N 3.46Å; R73-S75 PolarHBondContact O-N 3.46Å
74F41.6Very low42.9Very low150 Ų150146 Ų14666%0.65874%0.736SS**  trans-60.287.9170.6-76.7-62.2000110.6E71 L72 N76E71-F74 HydrophobicContact CB-CD2 4.11Å; E71-F74 HydrophobicContact CB-CE2 3.43Å; E71-F74 VanDerWaalsContact CB-CE2 3.43Å; E71-F74 HydrophobicContact CB-CZ 3.76Å; E71-F74 HydrophobicContact CG-CE2 4.34Å; E71-F74 HydrophobicContact CG-CZ 4.18Å; E71-F74 WeakPolarHBondContact O-CD2 3.1Å; E71-F74 WeakPolarHBondContact O-CE2 3.24Å; E71-F74 WeakPolarHBondContact O-CG 3.37Å; E71-F74 PolarHBondContact O-N 2.91Å; E71-F74 VanDerWaalsContact OE2-CZ 3.25Å; E71-F74 WeakPolarHBondContact OE2-CZ 3.4Å; L72-F74 VanDerWaalsContact C-N 3.27Å; F74-N76 PolarHBondContact O-N 3.49Å; F74-N76 VanDerWaalsContact O-N 3.13Å
75S42Very low44Very low100 Ų100141.6 Ų141.670%0.69972%0.72SS**  trans-14.6111.3145.8-1750000108.9R73 K77R73-S75 PolarHBondContact O-N 3.46Å; S75-K77 PolarHBondContact O-N 3.38Å
76N42.6Very low44.9Very low148 Ų148139.7 Ų139.779%0.79171%0.706SS**  trans-63.964.4167.9-173.919.5000108.1F74 R78F74-N76 PolarHBondContact O-N 3.49Å; F74-N76 VanDerWaalsContact O-N 3.13Å; N76-R78 PolarHBondContact O-N 3.44Å
77K44.1Very low46Very low188 Ų188136.1 Ų136.182%0.81769%0.687SS**  trans-7374.7163.7-163.6167.8-172.4176.30103.7S75 R79S75-K77 PolarHBondContact O-N 3.38Å; K77-R79 PolarHBondContact O-N 2.93Å
78R53.1Low46.9Very low206 Ų206137.7 Ų137.778%0.77768%0.681SS**  trans-37.8106.9172.3-166.1-176.5-149.7-173.16.3105.1N76 I80N76-R78 PolarHBondContact O-N 3.44Å; R78-I80 WeakPolarHBondContact O-CG1 3.22Å; R78-I80 PolarHBondContact O-N 3.24Å
79R49.6Very low48.2Very low233 Ų233130.8 Ų130.888%0.87966%0.659SS**  trans-59.598.2179.6-165175.8179.5-180-0.6103.9K77 S81K77-R79 PolarHBondContact O-N 2.93Å; R79-S81 PolarHBondContact O-N 2.91Å
80I50.2Low49.3Very low123 Ų123124.7 Ų124.763%0.63164%0.638SS**  trans-65.195.9177.2-60.5179.3000103.1R78 A82 S84R78-I80 WeakPolarHBondContact O-CG1 3.22Å; R78-I80 PolarHBondContact O-N 3.24Å; I80-A82 PolarHBondContact O-N 3.39Å; I80-S84 WeakPolarHBondContact CG2-OG 3.44Å
81S51.5Low50.6Low73 Ų73126.2 Ų126.251%0.5164%0.636SS.*  trans-52130.9175.1-56.70000106.8R79 S83 S84R79-S81 PolarHBondContact O-N 2.91Å; S81-S83 WeakPolarHBondContact CB-OG 3.5Å; S81-S83 PolarHBondContact O-N 2.89Å; S81-S84 PolarHBondContact O-N 3.36Å
82A53.9Low52.4Low79 Ų79128.8 Ų128.865%0.65364%0.64SS**THydrogen-bonded Turntrans-51.3-17.3179.400000113.3I80 S84 I85 H86I80-A82 PolarHBondContact O-N 3.39Å; A82-S84 VanDerWaalsContact C-N 3.28Å; A82-S84 PolarHBondContact O-N 3.34Å; A82-I85 PolarHBondContact O-N 2.67Å; A82-H86 PolarHBondContact O-N 2.85Å
83S55.7Low53.9Low89 Ų89127.4 Ų127.462%0.62263%0.627SS**Hα-helixtrans-57.1-31.8170.159.80000114.6S81 S87S81-S83 WeakPolarHBondContact CB-OG 3.5Å; S81-S83 PolarHBondContact O-N 2.89Å; S83-S87 PolarHBondContact O-N 3.39Å
84S50.5Low55.7Low49 Ų49119 Ų11934%0.34360%0.604SS.*Hα-helixtrans-81.4-15.3179.382.70000113.6I80 S81 A82 S87I80-S84 WeakPolarHBondContact CG2-OG 3.44Å; S81-S84 PolarHBondContact O-N 3.36Å; A82-S84 VanDerWaalsContact C-N 3.28Å; A82-S84 PolarHBondContact O-N 3.34Å; S84-S87 PolarHBondContact O-OG 3.5Å
85I55.1Low57.5Low104 Ų104117.7 Ų117.753%0.53360%0.603SS.*Hα-helixtrans-76.3-40.3173-59.1175.9000108.6A82 S87 L88 D89A82-I85 PolarHBondContact O-N 2.67Å; I85-S87 PolarHBondContact O-N 2.8Å; I85-L88 PolarHBondContact O-N 2.94Å; I85-D89 PolarHBondContact O-N 3.39Å
86H52.8Low59.2Low144 Ų144118.6 Ų118.667%0.66760%0.596SS**Hα-helixtrans-67.5-30.6176.1-107.3-3.5000114.1A82 L88 D89 S90A82-H86 PolarHBondContact O-N 2.85Å; H86-L88 VanDerWaalsContact C-N 3.33Å; H86-D89 IonicContact ND1-OD2 3.79Å; H86-D89 PolarHBondContact O-N 3.34Å; H86-S90 PolarHBondContact O-N 2.99Å
87S55.8Low60.9Low52 Ų52118.2 Ų118.236%0.36459%0.588SS.*Hα-helixtrans-68.9-30.6175.565.60000112.9S83 S84 I85 S90 E91S83-S87 PolarHBondContact O-N 3.39Å; S84-S87 PolarHBondContact O-OG 3.5Å; I85-S87 PolarHBondContact O-N 2.8Å; S87-S90 PolarHBondContact O-OG 3.38Å; S87-E91 PolarHBondContact O-N 3.35Å
88L54.5Low62.7Low94 Ų94113 Ų11349%0.49257%0.566SS.*Hα-helixtrans-72.4-32.4175.8-69.6172.8000112.1I85 H86 S90 E91 R92I85-L88 PolarHBondContact O-N 2.94Å; H86-L88 VanDerWaalsContact C-N 3.33Å; L88-S90 VanDerWaalsContact C-N 3.33Å; L88-E91 PolarHBondContact O-N 2.86Å; L88-R92 WeakPolarHBondContact O-CG 3.4Å; L88-R92 PolarHBondContact O-N 3.32Å
89D59.7Low64.1Low74 Ų74108.6 Ų108.640%0.39656%0.557SS.*Hα-helixtrans-66-35.6176.2-77.2-27.9000112.1I85 H86 K93I85-D89 PolarHBondContact O-N 3.39Å; H86-D89 IonicContact ND1-OD2 3.79Å; H86-D89 PolarHBondContact O-N 3.34Å; D89-K93 WeakPolarHBondContact O-CB 3.33Å; D89-K93 VanDerWaalsContact O-CG 3.26Å; D89-K93 WeakPolarHBondContact O-CG 3.21Å; D89-K93 PolarHBondContact O-N 3.48Å; D89-K93 VanDerWaalsContact O-N 3.14Å
90S64.3Low65.8Low71 Ų71102 Ų10250%0.49754%0.538SS..Hα-helixtrans-69.9-42.3175.260.30000111.6H86 S87 L88 R92 K93 C94H86-S90 PolarHBondContact O-N 2.99Å; S87-S90 PolarHBondContact O-OG 3.38Å; L88-S90 VanDerWaalsContact C-N 3.33Å; S90-R92 PolarHBondContact O-N 2.98Å; S90-K93 PolarHBondContact O-N 2.95Å; S90-C94 WeakPolarHBondContact O-CB 3.42Å; S90-C94 PolarHBondContact O-N 3.42Å
91E69.8Low67.4Low114 Ų114101.6 Ų101.653%0.53353%0.532SS..Hα-helixtrans-62.1-43.1176.3-73.2179.9-171.600112.3S87 L88 C94 L95S87-E91 PolarHBondContact O-N 3.35Å; L88-E91 PolarHBondContact O-N 2.86Å; E91-C94 WeakPolarHBondContact O-CB 3.45Å; E91-C94 PolarHBondContact O-N 3.44Å; E91-L95 PolarHBondContact O-N 3.3Å
92R73.3Confident68.9Low187 Ų187105.1 Ų105.171%0.70654%0.535SS*.Hα-helixtrans-64.4-42.5176.9-76-176.3-179.1-155.51.4112.4L88 S90 C94 L95 H96L88-R92 WeakPolarHBondContact O-CG 3.4Å; L88-R92 PolarHBondContact O-N 3.32Å; S90-R92 PolarHBondContact O-N 2.98Å; R92-C94 VanDerWaalsContact C-N 3.29Å; R92-C94 PolarHBondContact O-N 3.47Å; R92-L95 PolarHBondContact O-N 3.16Å; R92-H96 WeakPolarHBondContact O-CB 3.48Å; R92-H96 PolarHBondContact O-N 3.4Å
93K74.8Confident70.4Confident156 Ų156104.8 Ų104.868%0.67853%0.525SS*.Hα-helixtrans-63-39.1175.1-73.8174.1-176176.30111.3D89 S90 H96 F97D89-K93 WeakPolarHBondContact O-CB 3.33Å; D89-K93 VanDerWaalsContact O-CG 3.26Å; D89-K93 WeakPolarHBondContact O-CG 3.21Å; D89-K93 PolarHBondContact O-N 3.48Å; D89-K93 VanDerWaalsContact O-N 3.14Å; S90-K93 PolarHBondContact O-N 2.95Å; K93-H96 PolarHBondContact O-N 3.09Å; K93-F97 WeakPolarHBondContact O-CB 3.46Å; K93-F97 PolarHBondContact O-N 3.05Å
94C74.1Confident71.9Confident66 Ų66105 Ų10545%0.44652%0.522SS..Hα-helixtrans-62.1-51.4176.1-164.30000111.1S90 E91 R92 H96 F97 F98S90-C94 WeakPolarHBondContact O-CB 3.42Å; S90-C94 PolarHBondContact O-N 3.42Å; E91-C94 WeakPolarHBondContact O-CB 3.45Å; E91-C94 PolarHBondContact O-N 3.44Å; R92-C94 VanDerWaalsContact C-N 3.29Å; R92-C94 PolarHBondContact O-N 3.47Å; C94-H96 VanDerWaalsContact C-N 3.32Å; C94-H96 PolarHBondContact O-N 3.34Å; C94-F97 PolarHBondContact O-N 2.78Å; C94-F98 WeakPolarHBondContact O-CD2 3.34Å; C94-F98 PolarHBondContact O-N 2.83Å; C94-F98 VanDerWaalsContact SG-CE2 3.51Å
95L79.1Confident73.6Confident122 Ų122107.2 Ų107.264%0.63952%0.524SS*.Hα-helixtrans-59.4-41.1176.9-77.5170.8000112.5E91 R92 F98 L99E91-L95 PolarHBondContact O-N 3.3Å; R92-L95 PolarHBondContact O-N 3.16Å; L95-F98 PolarHBondContact O-N 2.88Å; L95-L99 WeakPolarHBondContact O-CB 3.43Å; L95-L99 PolarHBondContact O-N 3.48Å
96H78.6Confident74.9Confident119 Ų119104.3 Ų104.355%0.55151%0.512SS*.Hα-helixtrans-63.8-43.2177-172.7-167.9000111.6R92 K93 C94 F98 L99 L100R92-H96 WeakPolarHBondContact O-CB 3.48Å; R92-H96 PolarHBondContact O-N 3.4Å; K93-H96 PolarHBondContact O-N 3.09Å; C94-H96 VanDerWaalsContact C-N 3.32Å; C94-H96 PolarHBondContact O-N 3.34Å; H96-F98 VanDerWaalsContact C-N 3.34Å; H96-F98 PolarHBondContact O-N 3.33Å; H96-L99 PolarHBondContact O-N 2.97Å; H96-L100 WeakPolarHBondContact O-CG 3.43Å; H96-L100 PolarHBondContact O-N 2.85Å
97F79.2Confident76.6Confident139 Ų139104 Ų10461%0.6151%0.511SS*.Hα-helixtrans-61.7-42.1175.3-172.4-95.4000111.9K93 C94 L99 L100 F101K93-F97 WeakPolarHBondContact O-CB 3.46Å; K93-F97 PolarHBondContact O-N 3.05Å; C94-F97 PolarHBondContact O-N 2.78Å; F97-L99 PolarHBondContact O-N 2.86Å; F97-L100 PolarHBondContact O-N 2.97Å; F97-F101 WeakPolarHBondContact O-CB 3.16Å; F97-F101 PolarHBondContact O-N 3Å
98F80.4Confident78Confident80 Ų80105.8 Ų105.835%0.35152%0.516SS..Hα-helixtrans-61.2-42.8174.1-87-69.6000112.5L33 C94 L95 H96 F101 Y102L33-F98 HydrophobicContact CD2-CZ 4.28Å; C94-F98 WeakPolarHBondContact O-CD2 3.34Å; C94-F98 PolarHBondContact O-N 2.83Å; C94-F98 VanDerWaalsContact SG-CE2 3.51Å; L95-F98 PolarHBondContact O-N 2.88Å; H96-F98 VanDerWaalsContact C-N 3.34Å; H96-F98 PolarHBondContact O-N 3.33Å; F98-F101 PolarHBondContact O-N 3.3Å; F98-Y102 VanDerWaalsContact O-CB 3.24Å; F98-Y102 WeakPolarHBondContact O-CB 3.48Å; F98-Y102 PolarHBondContact O-N 2.91Å
99L82.7Confident79.5Confident113 Ų113104.5 Ų104.559%0.59251%0.509SS*.Hα-helixtrans-68.7-40.8-178.5-152.1145.6000111L95 H96 F97 Y102 V103L95-L99 WeakPolarHBondContact O-CB 3.43Å; L95-L99 PolarHBondContact O-N 3.48Å; H96-L99 PolarHBondContact O-N 2.97Å; F97-L99 PolarHBondContact O-N 2.86Å; L99-Y102 PolarHBondContact O-N 3.46Å; L99-V103 HydrophobicContact CD2-CG2 4.2Å; L99-V103 VanDerWaalsContact O-CG2 3.24Å; L99-V103 WeakPolarHBondContact O-CG2 3.38Å; L99-V103 PolarHBondContact O-N 3.04Å
100L85.2Confident80.6Confident94 Ų94105.5 Ų105.549%0.49252%0.518SS..Hα-helixtrans-61.3-47.1172-72.5172.5000111.6H96 F97 Y102 V103 V104H96-L100 WeakPolarHBondContact O-CG 3.43Å; H96-L100 PolarHBondContact O-N 2.85Å; F97-L100 PolarHBondContact O-N 2.97Å; L100-Y102 VanDerWaalsContact C-N 3.32Å; L100-Y102 PolarHBondContact O-N 2.79Å; L100-V103 PolarHBondContact O-N 3.34Å; L100-V104 WeakPolarHBondContact O-CG2 3.38Å; L100-V104 PolarHBondContact O-N 3.36Å
101F83.9Confident81.7Confident115 Ų115108.3 Ų108.350%0.50452%0.521SS..Hα-helixtrans-61.8-42.4177.8-173.4-93.8000111.6F97 F98 V104 Y105F97-F101 WeakPolarHBondContact O-CB 3.16Å; F97-F101 PolarHBondContact O-N 3Å; F98-F101 PolarHBondContact O-N 3.3Å; F101-V104 PolarHBondContact O-N 3.36Å; F101-Y105 VanDerWaalsContact O-CB 3.22Å; F101-Y105 WeakPolarHBondContact O-CB 3.41Å; F101-Y105 PolarHBondContact O-N 3.43Å
102Y83.7Confident82.3Confident147 Ų147108.4 Ų108.458%0.57652%0.52SS*.Hα-helixtrans-62.5-44.3176.9-177.5-101.2000111.9F98 L99 L100 Y105 C106F98-Y102 VanDerWaalsContact O-CB 3.24Å; F98-Y102 WeakPolarHBondContact O-CB 3.48Å; F98-Y102 PolarHBondContact O-N 2.91Å; L99-Y102 PolarHBondContact O-N 3.46Å; L100-Y102 VanDerWaalsContact C-N 3.32Å; L100-Y102 PolarHBondContact O-N 2.79Å; Y102-Y105 PolarHBondContact O-N 2.79Å; Y102-C106 VanDerWaalsContact CZ-SG 3.51Å; Y102-C106 WeakPolarHBondContact O-CB 3.16Å; Y102-C106 PolarHBondContact O-N 2.82Å; Y102-C106 PolarHBondContact O-SG 3.29Å; Y102-C106 VanDerWaalsContact O-SG 3.34Å
103V85.7Confident82.7Confident72 Ų72105.6 Ų105.644%0.43652%0.515SS..Hα-helixtrans-60.8-47.6175.8169.70000111.1L99 L100 Y105 C106 Q107L99-V103 HydrophobicContact CD2-CG2 4.2Å; L99-V103 VanDerWaalsContact O-CG2 3.24Å; L99-V103 WeakPolarHBondContact O-CG2 3.38Å; L99-V103 PolarHBondContact O-N 3.04Å; L100-V103 PolarHBondContact O-N 3.34Å; V103-Y105 VanDerWaalsContact C-N 3.32Å; V103-Y105 PolarHBondContact O-N 3.18Å; V103-C106 PolarHBondContact O-N 2.84Å; V103-Q107 WeakPolarHBondContact O-CB 2.97Å; V103-Q107 PolarHBondContact O-N 2.9Å
104V87Confident83.1Confident93 Ų93102.6 Ų102.656%0.56450%0.503SS*.Hα-helixtrans-61.5-42.4177.3173.20000111L100 F101 Q107 L108L100-V104 WeakPolarHBondContact O-CG2 3.38Å; L100-V104 PolarHBondContact O-N 3.36Å; F101-V104 PolarHBondContact O-N 3.36Å; V104-Q107 PolarHBondContact O-N 3.01Å; V104-L108 WeakPolarHBondContact O-CB 3.46Å; V104-L108 PolarHBondContact O-N 3.37Å
105Y85.3Confident83.5Confident96 Ų96103.7 Ų103.738%0.37650%0.504SS..Hα-helixtrans-62.8-46.3177.5179-103.4000112.2F101 Y102 V103 Q107 L108 I109F101-Y105 VanDerWaalsContact O-CB 3.22Å; F101-Y105 WeakPolarHBondContact O-CB 3.41Å; F101-Y105 PolarHBondContact O-N 3.43Å; Y102-Y105 PolarHBondContact O-N 2.79Å; V103-Y105 VanDerWaalsContact C-N 3.32Å; V103-Y105 PolarHBondContact O-N 3.18Å; Y105-Q107 PolarHBondContact O-N 3.42Å; Y105-L108 PolarHBondContact O-N 2.69Å; Y105-I109 HydrophobicContact CD1-CD1 3.68Å; Y105-I109 HydrophobicContact CE1-CD1 3.18Å; Y105-I109 HydrophobicContact CE1-CG1 4.32Å; Y105-I109 HydrophobicContact CE2-CD1 4.13Å; Y105-I109 HydrophobicContact CG-CD1 4.34Å; Y105-I109 VanDerWaalsContact CZ-CD1 3.43Å; Y105-I109 WeakPolarHBondContact O-CG1 3.44Å; Y105-I109 PolarHBondContact O-N 2.81Å
106C83.5Confident83.6Confident42 Ų42102.8 Ų102.828%0.28450%0.495SS..Hα-helixtrans-61.9-42.4175.7-73.50000112Y102 V103 L108 I109 T110Y102-C106 VanDerWaalsContact CZ-SG 3.51Å; Y102-C106 WeakPolarHBondContact O-CB 3.16Å; Y102-C106 PolarHBondContact O-N 2.82Å; Y102-C106 PolarHBondContact O-SG 3.29Å; Y102-C106 VanDerWaalsContact O-SG 3.34Å; V103-C106 PolarHBondContact O-N 2.84Å; C106-L108 VanDerWaalsContact C-N 3.34Å; C106-L108 PolarHBondContact O-N 3.3Å; C106-I109 PolarHBondContact O-N 3.47Å; C106-T110 WeakPolarHBondContact O-CB 3.22Å; C106-T110 PolarHBondContact O-N 3.46Å; C106-T110 PolarHBondContact O-OG1 2.88Å
107Q87.4Confident83.7Confident138 Ų138105.5 Ų105.565%0.64550%0.501SS*.Hα-helixtrans-64.5-39.8177.4-170169.5-11.100111.7V103 V104 Y105 T110 F111V103-Q107 WeakPolarHBondContact O-CB 2.97Å; V103-Q107 PolarHBondContact O-N 2.9Å; V104-Q107 PolarHBondContact O-N 3.01Å; Y105-Q107 PolarHBondContact O-N 3.42Å; Q107-T110 PolarHBondContact O-N 3.31Å; Q107-F111 WeakPolarHBondContact O-CB 3.39Å; Q107-F111 PolarHBondContact O-N 3.05Å
108L85.8Confident84Confident90 Ų90104.2 Ų104.247%0.47150%0.495SS..Hα-helixtrans-63.9-45.1175.7-17170.2000111.8V104 Y105 C106 T110 F111 F112V104-L108 WeakPolarHBondContact O-CB 3.46Å; V104-L108 PolarHBondContact O-N 3.37Å; Y105-L108 PolarHBondContact O-N 2.69Å; C106-L108 VanDerWaalsContact C-N 3.34Å; C106-L108 PolarHBondContact O-N 3.3Å; L108-T110 VanDerWaalsContact C-N 3.34Å; L108-T110 PolarHBondContact O-N 3.07Å; L108-F111 WeakPolarHBondContact O-CB 3.33Å; L108-F111 PolarHBondContact O-N 3.4Å; L108-F112 HydrophobicContact CD1-CD2 4.17Å; L108-F112 HydrophobicContact CD1-CE2 3.62Å; L108-F112 HydrophobicContact CD1-CZ 4.5Å; L108-F112 HydrophobicContact CD2-CE2 4.12Å; L108-F112 HydrophobicContact CG-CD2 3.86Å; L108-F112 HydrophobicContact CG-CE2 3.6Å; L108-F112 WeakPolarHBondContact O-CD2 3.48Å; L108-F112 PolarHBondContact O-N 3.32Å
109I85.9Confident84.2Confident67 Ų67102.9 Ų102.934%0.34450%0.499SS..Hα-helixtrans-59.3-47.7175.4-71.1167.1000110.5Y105 C106 F111 F112 E113Y105-I109 HydrophobicContact CD1-CD1 3.68Å; Y105-I109 HydrophobicContact CE1-CD1 3.18Å; Y105-I109 HydrophobicContact CE1-CG1 4.32Å; Y105-I109 HydrophobicContact CE2-CD1 4.13Å; Y105-I109 HydrophobicContact CG-CD1 4.34Å; Y105-I109 VanDerWaalsContact CZ-CD1 3.43Å; Y105-I109 WeakPolarHBondContact O-CG1 3.44Å; Y105-I109 PolarHBondContact O-N 2.81Å; C106-I109 PolarHBondContact O-N 3.47Å; I109-F111 VanDerWaalsContact C-N 3.26Å; I109-F111 PolarHBondContact O-N 2.83Å; I109-F112 PolarHBondContact O-N 3.04Å; I109-F112 VanDerWaalsContact O-N 3.09Å; I109-E113 HydrophobicContact CG2-CG 4.17Å; I109-E113 WeakPolarHBondContact O-CG 3.21Å; I109-E113 PolarHBondContact O-N 3.47Å
110T83.7Confident84.1Confident94 Ų9499.9 Ų99.958%0.57749%0.487SS*.Hα-helixtrans-61.8-39.1-178.1-52.90000111C106 Q107 L108 H114C106-T110 WeakPolarHBondContact O-CB 3.22Å; C106-T110 PolarHBondContact O-N 3.46Å; C106-T110 PolarHBondContact O-OG1 2.88Å; Q107-T110 PolarHBondContact O-N 3.31Å; L108-T110 VanDerWaalsContact C-N 3.34Å; L108-T110 PolarHBondContact O-N 3.07Å; T110-H114 WeakPolarHBondContact O-CB 3.38Å; T110-H114 PolarHBondContact O-N 3.18Å
111F85.9Confident84Confident130 Ų13099.3 Ų99.357%0.5748%0.484SS*.Hα-helixtrans-62.1-45.3173.6179.4-95.1000112.2Q107 L108 I109 H114 L115Q107-F111 WeakPolarHBondContact O-CB 3.39Å; Q107-F111 PolarHBondContact O-N 3.05Å; L108-F111 WeakPolarHBondContact O-CB 3.33Å; L108-F111 PolarHBondContact O-N 3.4Å; I109-F111 VanDerWaalsContact C-N 3.26Å; I109-F111 PolarHBondContact O-N 2.83Å; F111-H114 PolarHBondContact O-N 3.12Å; F111-L115 HydrophobicContact CE1-CD2 4.49Å; F111-L115 WeakPolarHBondContact O-CB 3.19Å; F111-L115 PolarHBondContact O-N 2.97Å
112F82.3Confident84Confident116 Ų11699.4 Ų99.451%0.50949%0.489SS..Hα-helixtrans-67-41.3178.4-81.9-64.6000113L108 I109 H114 L115 F116L108-F112 HydrophobicContact CD1-CD2 4.17Å; L108-F112 HydrophobicContact CD1-CE2 3.62Å; L108-F112 HydrophobicContact CD1-CZ 4.5Å; L108-F112 HydrophobicContact CD2-CE2 4.12Å; L108-F112 HydrophobicContact CG-CD2 3.86Å; L108-F112 HydrophobicContact CG-CE2 3.6Å; L108-F112 WeakPolarHBondContact O-CD2 3.48Å; L108-F112 PolarHBondContact O-N 3.32Å; I109-F112 PolarHBondContact O-N 3.04Å; I109-F112 VanDerWaalsContact O-N 3.09Å; F112-H114 VanDerWaalsContact C-N 3.33Å; F112-H114 PolarHBondContact O-N 3.36Å; F112-L115 PolarHBondContact O-N 3.31Å; F112-F116 WeakPolarHBondContact O-CB 3.24Å; F112-F116 PolarHBondContact O-N 2.9Å
113E82.8Confident83.9Confident128 Ų12898.4 Ų98.460%0.59849%0.493SS*.Hα-helixtrans-58.2-46173.9-76.1-65.8144.500111.1I109 F116 W117I109-E113 HydrophobicContact CG2-CG 4.17Å; I109-E113 WeakPolarHBondContact O-CG 3.21Å; I109-E113 PolarHBondContact O-N 3.47Å; E113-F116 PolarHBondContact O-N 3.23Å; E113-W117 WeakPolarHBondContact O-CB 3.37Å; E113-W117 PolarHBondContact O-N 2.85Å
114H82.5Confident83.7Confident94 Ų9499.4 Ų99.444%0.43550%0.496SS..Hα-helixtrans-67.7-38.1178.1-173.7-116.9000112.8T110 F111 F112 F116 W117 K118T110-H114 WeakPolarHBondContact O-CB 3.38Å; T110-H114 PolarHBondContact O-N 3.18Å; F111-H114 PolarHBondContact O-N 3.12Å; F112-H114 VanDerWaalsContact C-N 3.33Å; F112-H114 PolarHBondContact O-N 3.36Å; H114-F116 VanDerWaalsContact C-N 3.33Å; H114-W117 PolarHBondContact O-N 3.43Å; H114-K118 WeakPolarHBondContact CE1-CE 3.47Å; H114-K118 PolarHBondContact CE1-NZ 3.43Å; H114-K118 WeakPolarHBondContact O-CG 3.22Å; H114-K118 PolarHBondContact O-N 3.41Å
115L83.5Confident83.3Confident89 Ų8997.9 Ų97.947%0.46649%0.489SS..Hα-helixtrans-63.4-41.9173.8-174.867.9000111F111 F112 K118 A119F111-L115 HydrophobicContact CE1-CD2 4.49Å; F111-L115 WeakPolarHBondContact O-CB 3.19Å; F111-L115 PolarHBondContact O-N 2.97Å; F112-L115 PolarHBondContact O-N 3.31Å; L115-K118 PolarHBondContact O-N 3.28Å; L115-A119 WeakPolarHBondContact O-CB 3.41Å; L115-A119 PolarHBondContact O-N 3Å
116F81.7Confident83Confident103 Ų10397.3 Ų97.345%0.45250%0.498SS..Hα-helixtrans-65.3-43.1178.1-167.6-95000111.4F14 F112 E113 H114 A119 S120F14-F116 HydrophobicContact CE1-CZ 4.13Å; F112-F116 WeakPolarHBondContact O-CB 3.24Å; F112-F116 PolarHBondContact O-N 2.9Å; E113-F116 PolarHBondContact O-N 3.23Å; H114-F116 VanDerWaalsContact C-N 3.33Å; F116-A119 PolarHBondContact O-N 3.43Å; F116-S120 WeakPolarHBondContact O-CB 3.42Å; F116-S120 PolarHBondContact O-N 2.81Å
117W80.8Confident82.8Confident175 Ų175101.3 Ų101.366%0.66351%0.511SS*.Hα-helixtrans-61.5-46.3175.9-171.37.7000111.8E113 H114 A119 S120 I121E113-W117 WeakPolarHBondContact O-CB 3.37Å; E113-W117 PolarHBondContact O-N 2.85Å; H114-W117 PolarHBondContact O-N 3.43Å; W117-A119 VanDerWaalsContact C-N 3.34Å; W117-A119 PolarHBondContact O-N 2.91Å; W117-S120 PolarHBondContact O-N 3.2Å; W117-I121 HydrophobicContact CG-CD1 4.38Å; W117-I121 WeakPolarHBondContact O-CG1 3.47Å; W117-I121 PolarHBondContact O-N 3.46Å
118K84.2Confident82.3Confident112 Ų112100.2 Ų100.249%0.48751%0.508SS..Hα-helixtrans-59.8-43.6174.7-77.4-179.4169.4-176.90112.4H114 L115 S120 I121 L122H114-K118 WeakPolarHBondContact CE1-CE 3.47Å; H114-K118 PolarHBondContact CE1-NZ 3.43Å; H114-K118 WeakPolarHBondContact O-CG 3.22Å; H114-K118 PolarHBondContact O-N 3.41Å; L115-K118 PolarHBondContact O-N 3.28Å; K118-S120 VanDerWaalsContact C-N 3.34Å; K118-I121 PolarHBondContact O-N 2.85Å; K118-L122 WeakPolarHBondContact O-CG 3.36Å; K118-L122 PolarHBondContact O-N 2.91Å
119A84.5Confident81.8Confident52 Ų52101.4 Ų101.443%0.4352%0.515SS..Hα-helixtrans-63.8-40.1177.200000111.8L115 F116 W117 L122 L123L115-A119 WeakPolarHBondContact O-CB 3.41Å; L115-A119 PolarHBondContact O-N 3Å; F116-A119 PolarHBondContact O-N 3.43Å; W117-A119 VanDerWaalsContact C-N 3.34Å; W117-A119 PolarHBondContact O-N 2.91Å; A119-L122 PolarHBondContact O-N 3.44Å; A119-L123 WeakPolarHBondContact O-CB 3.41Å; A119-L123 PolarHBondContact O-N 3.38Å
120S81.2Confident81.4Confident51 Ų51104.8 Ų104.836%0.35753%0.527SS..Hα-helixtrans-62.4-47.5176-1650000111.5F116 W117 K118 L122 L123 D124F116-S120 WeakPolarHBondContact O-CB 3.42Å; F116-S120 PolarHBondContact O-N 2.81Å; W117-S120 PolarHBondContact O-N 3.2Å; K118-S120 VanDerWaalsContact C-N 3.34Å; S120-L122 VanDerWaalsContact C-N 3.32Å; S120-L122 PolarHBondContact O-N 2.92Å; S120-L123 PolarHBondContact O-N 3.37Å; S120-L123 VanDerWaalsContact O-N 3.12Å; S120-D124 PolarHBondContact O-N 2.95Å
121I83.9Confident80.9Confident82 Ų82102.4 Ų102.442%0.42152%0.515SS..Hα-helixtrans-59.6-44.7176.9-67.4166.4000110.7W117 K118 L123 D124 C125W117-I121 HydrophobicContact CG-CD1 4.38Å; W117-I121 WeakPolarHBondContact O-CG1 3.47Å; W117-I121 PolarHBondContact O-N 3.46Å; K118-I121 PolarHBondContact O-N 2.85Å; I121-L123 VanDerWaalsContact C-N 3.28Å; I121-L123 PolarHBondContact O-N 3.35Å; I121-D124 PolarHBondContact O-N 2.75Å; I121-C125 WeakPolarHBondContact O-CB 3.37Å; I121-C125 PolarHBondContact O-N 3.26Å; I121-C125 PolarHBondContact O-SG 3.4Å; I121-C125 VanDerWaalsContact O-SG 3.35Å
122L82Confident80.3Confident117 Ų11799.6 Ų99.661%0.61351%0.511SS*.Hα-helixtrans-60.8-40.7177.1-75.5171000111.5K118 A119 S120 C125 C126K118-L122 WeakPolarHBondContact O-CG 3.36Å; K118-L122 PolarHBondContact O-N 2.91Å; A119-L122 PolarHBondContact O-N 3.44Å; S120-L122 VanDerWaalsContact C-N 3.32Å; S120-L122 PolarHBondContact O-N 2.92Å; L122-C125 PolarHBondContact O-N 3.23Å; L122-C126 WeakPolarHBondContact O-CB 3.5Å; L122-C126 PolarHBondContact O-N 2.95Å; L122-C126 PolarHBondContact O-SG 3.41Å
123L81.6Confident79.8Confident125 Ų12598.2 Ų98.265%0.65451%0.509SS*.Hα-helixtrans-68.6-40.2-179.6-152.8145.6000111.6A119 S120 I121 C126 F127A119-L123 WeakPolarHBondContact O-CB 3.41Å; A119-L123 PolarHBondContact O-N 3.38Å; S120-L123 PolarHBondContact O-N 3.37Å; S120-L123 VanDerWaalsContact O-N 3.12Å; I121-L123 VanDerWaalsContact C-N 3.28Å; I121-L123 PolarHBondContact O-N 3.35Å; L123-C126 PolarHBondContact O-N 2.87Å; L123-F127 WeakPolarHBondContact O-CB 3.34Å; L123-F127 PolarHBondContact O-N 2.81Å
124D82.3Confident79.3Confident93 Ų9399.2 Ų99.250%0.49751%0.511SS..Hα-helixtrans-65.6-43.8173.8-71.1-29.1000111.7S120 I121 F127 L128S120-D124 PolarHBondContact O-N 2.95Å; I121-D124 PolarHBondContact O-N 2.75Å; D124-F127 WeakPolarHBondContact O-CB 3.32Å; D124-F127 PolarHBondContact O-N 2.85Å; D124-L128 WeakPolarHBondContact O-CG 3.48Å; D124-L128 PolarHBondContact O-N 2.88Å
125C79.5Confident78.2Confident62 Ų6299.9 Ų99.942%0.41952%0.517SS..Hα-helixtrans-61.5-44.9174.3-76.60000112I121 L122 F127 L128 L129I121-C125 WeakPolarHBondContact O-CB 3.37Å; I121-C125 PolarHBondContact O-N 3.26Å; I121-C125 PolarHBondContact O-SG 3.4Å; I121-C125 VanDerWaalsContact O-SG 3.35Å; L122-C125 PolarHBondContact O-N 3.23Å; C125-F127 VanDerWaalsContact C-N 3.28Å; C125-F127 PolarHBondContact O-N 3.45Å; C125-L128 PolarHBondContact O-N 2.93Å; C125-L129 WeakPolarHBondContact O-CG 3.47Å; C125-L129 PolarHBondContact O-N 3.34Å
126C78.7Confident77.4Confident83 Ų83100.7 Ų100.756%0.56152%0.519SS*.Hα-helixtrans-60.9-38.4174.9-74.70000111.7L122 L123 F130L122-C126 WeakPolarHBondContact O-CB 3.5Å; L122-C126 PolarHBondContact O-N 2.95Å; L122-C126 PolarHBondContact O-SG 3.41Å; L123-C126 PolarHBondContact O-N 2.87Å; C126-F130 WeakPolarHBondContact O-CB 3.35Å; C126-F130 PolarHBondContact O-N 3.4Å
127F79.1Confident76.7Confident127 Ų127103.6 Ų103.656%0.55753%0.531SS*.Hα-helixtrans-68-41.7177.7-175.6-96.7000112.6L123 D124 C125 F130 S131L123-F127 WeakPolarHBondContact O-CB 3.34Å; L123-F127 PolarHBondContact O-N 2.81Å; D124-F127 WeakPolarHBondContact O-CB 3.32Å; D124-F127 PolarHBondContact O-N 2.85Å; C125-F127 VanDerWaalsContact C-N 3.28Å; C125-F127 PolarHBondContact O-N 3.45Å; F127-F130 PolarHBondContact O-N 3.2Å; F127-S131 WeakPolarHBondContact O-CB 3.4Å; F127-S131 PolarHBondContact O-N 2.86Å; F127-S131 PolarHBondContact O-OG 3Å
128L77.3Confident76Confident114 Ų114102 Ų10260%0.59753%0.529SS*.Hα-helixtrans-62.4-45.9174.5-73.3174.2000111.3D124 C125 F130 S131 S132D124-L128 WeakPolarHBondContact O-CG 3.48Å; D124-L128 PolarHBondContact O-N 2.88Å; C125-L128 PolarHBondContact O-N 2.93Å; L128-F130 VanDerWaalsContact C-N 3.35Å; L128-F130 PolarHBondContact O-N 3.45Å; L128-S131 PolarHBondContact O-N 2.98Å; L128-S132 WeakPolarHBondContact O-CB 3.34Å; L128-S132 PolarHBondContact O-N 3.01Å; L128-S132 PolarHBondContact O-OG 3.34Å
129L75.5Confident75.1Confident115 Ų115101.3 Ų101.360%0.60253%0.53SS*.Hα-helixtrans-61.3-42.8176.1-73.6170.6000112.1C125 S132 N133C125-L129 WeakPolarHBondContact O-CG 3.47Å; C125-L129 PolarHBondContact O-N 3.34Å; L129-S132 PolarHBondContact O-N 3.31Å; L129-N133 WeakPolarHBondContact O-CB 3.47Å; L129-N133 PolarHBondContact O-N 3.02Å; L129-N133 PolarHBondContact O-ND2 2.86Å
130F76.8Confident73.9Confident138 Ų138104.6 Ų104.661%0.60554%0.536SS*.Hα-helixtrans-65.1-40.5177.1-170.7-96.9000112.1C126 F127 L128 K134C126-F130 WeakPolarHBondContact O-CB 3.35Å; C126-F130 PolarHBondContact O-N 3.4Å; F127-F130 PolarHBondContact O-N 3.2Å; L128-F130 VanDerWaalsContact C-N 3.35Å; L128-F130 PolarHBondContact O-N 3.45Å; F130-K134 WeakPolarHBondContact O-CB 3.45Å; F130-K134 PolarHBondContact O-N 3.11Å
131S73.6Confident72.9Confident45 Ų45109 Ų10932%0.31556%0.555SS.*Hα-helixtrans-66.3-41.9177.3-61.70000111.8F127 L128 K134 L135F127-S131 WeakPolarHBondContact O-CB 3.4Å; F127-S131 PolarHBondContact O-N 2.86Å; F127-S131 PolarHBondContact O-OG 3Å; L128-S131 PolarHBondContact O-N 2.98Å; S131-K134 PolarHBondContact O-N 2.93Å; S131-L135 WeakPolarHBondContact O-CB 3.46Å; S131-L135 PolarHBondContact O-N 3.11Å
132S72.3Confident71.9Confident71 Ų71113.7 Ų113.750%0.49757%0.572SS.*Hα-helixtrans-62-48174.4-69.40000112L128 L129 K134 L135 E136L128-S132 WeakPolarHBondContact O-CB 3.34Å; L128-S132 PolarHBondContact O-N 3.01Å; L128-S132 PolarHBondContact O-OG 3.34Å; L129-S132 PolarHBondContact O-N 3.31Å; S132-K134 VanDerWaalsContact C-N 3.28Å; S132-K134 PolarHBondContact O-N 3.44Å; S132-L135 WeakPolarHBondContact O-CB 3.47Å; S132-L135 PolarHBondContact O-N 3.11Å; S132-L135 VanDerWaalsContact O-N 3.11Å; S132-E136 WeakPolarHBondContact O-CB 3.42Å; S132-E136 PolarHBondContact O-N 3.34Å
133N73Confident70.9Confident87 Ų87115.4 Ų115.447%0.46558%0.581SS.*Hα-helixtrans-60.8-36.6176.8-77.1-22.7000112.4L129 K137L129-N133 WeakPolarHBondContact O-CB 3.47Å; L129-N133 PolarHBondContact O-N 3.02Å; L129-N133 PolarHBondContact O-ND2 2.86Å; N133-K137 WeakPolarHBondContact O-CG 3.45Å; N133-K137 PolarHBondContact O-N 3.06Å; N133-K137 VanDerWaalsContact O-N 3.1Å
134K70.7Confident69.8Low148 Ų148118.1 Ų118.164%0.64360%0.602SS**Hα-helixtrans-70.5-37176.6-167.9176.8-177.7179.70111.6F130 S131 S132 K138F130-K134 WeakPolarHBondContact O-CB 3.45Å; F130-K134 PolarHBondContact O-N 3.11Å; S131-K134 PolarHBondContact O-N 2.93Å; S132-K134 VanDerWaalsContact C-N 3.28Å; S132-K134 PolarHBondContact O-N 3.44Å; K134-K138 WeakPolarHBondContact O-CB 3.39Å; K134-K138 PolarHBondContact O-N 2.97Å; K134-K138 VanDerWaalsContact O-N 3.11Å
135L60.7Low69.2Low108 Ų108119.4 Ų119.457%0.56561%0.608SS**Hα-helixtrans-66.8-45.1175.4-169.773000110.9S131 S132 K137 K138 I139S131-L135 WeakPolarHBondContact O-CB 3.46Å; S131-L135 PolarHBondContact O-N 3.11Å; S132-L135 WeakPolarHBondContact O-CB 3.47Å; S132-L135 PolarHBondContact O-N 3.11Å; S132-L135 VanDerWaalsContact O-N 3.11Å; L135-K137 PolarHBondContact O-N 2.97Å; L135-K138 CarbonylContact O-C 3.6Å; L135-K138 WeakPolarHBondContact O-CA 3.45Å; L135-K138 WeakPolarHBondContact O-CB 3.49Å; L135-K138 PolarHBondContact O-N 3.2Å; L135-I139 HydrophobicContact CG-CD1 4.13Å; L135-I139 WeakPolarHBondContact O-CG1 3.37Å; L135-I139 PolarHBondContact O-N 3.31Å
136E65.5Low68.7Low107 Ų107122.4 Ų122.450%0.562%0.618SS.*Hα-helixtrans-58.3-47.4176.9-169.9-177.5175.100111.3S132 K138 I139 H140S132-E136 WeakPolarHBondContact O-CB 3.42Å; S132-E136 PolarHBondContact O-N 3.34Å; E136-K138 VanDerWaalsContact C-N 3.27Å; E136-K138 PolarHBondContact O-N 3.35Å; E136-I139 PolarHBondContact O-N 3.1Å; E136-H140 PolarHBondContact O-CD2 3.23Å; E136-H140 PolarHBondContact O-N 3.3Å
137K67.6Low68.1Low163 Ų163124.6 Ų124.671%0.70962%0.621SS**Hα-helixtrans-60.3-35.4173.5-73.3-178.3-178.5-175.40113N133 L135 L141N133-K137 WeakPolarHBondContact O-CG 3.45Å; N133-K137 PolarHBondContact O-N 3.06Å; N133-K137 VanDerWaalsContact O-N 3.1Å; L135-K137 PolarHBondContact O-N 2.97Å; K137-L141 WeakPolarHBondContact O-CB 3.43Å; K137-L141 PolarHBondContact O-N 2.9Å; K137-L141 VanDerWaalsContact O-N 3.1Å
138K65.4Low67.5Low141 Ų141124.4 Ų124.461%0.61362%0.624SS**Hα-helixtrans-73.4-32.3178.7-165.1176.4-176-177.70112.3K134 L135 E136 K142K134-K138 WeakPolarHBondContact O-CB 3.39Å; K134-K138 PolarHBondContact O-N 2.97Å; K134-K138 VanDerWaalsContact O-N 3.11Å; L135-K138 CarbonylContact O-C 3.6Å; L135-K138 WeakPolarHBondContact O-CA 3.45Å; L135-K138 WeakPolarHBondContact O-CB 3.49Å; L135-K138 PolarHBondContact O-N 3.2Å; E136-K138 VanDerWaalsContact C-N 3.27Å; E136-K138 PolarHBondContact O-N 3.35Å; K138-K142 PolarHBondContact O-N 3.04Å
139I66.4Low66.9Low99 Ų99125.1 Ų125.151%0.50863%0.626SS.*Hα-helixtrans-71.1-47.2174.6-66.4166.1000109.8L135 E136 L141 K142 L143L135-I139 HydrophobicContact CG-CD1 4.13Å; L135-I139 WeakPolarHBondContact O-CG1 3.37Å; L135-I139 PolarHBondContact O-N 3.31Å; E136-I139 PolarHBondContact O-N 3.1Å; I139-L141 VanDerWaalsContact C-N 3.3Å; I139-L141 PolarHBondContact O-N 3.46Å; I139-K142 PolarHBondContact O-N 3.1Å; I139-L143 PolarHBondContact O-N 3.42Å
140H58.1Low66.3Low120 Ų120125.7 Ų125.756%0.55663%0.628SS**Hα-helixtrans-58.7-39.7176-86.6-74.1000112.9E136 K142 L143E136-H140 PolarHBondContact O-CD2 3.23Å; E136-H140 PolarHBondContact O-N 3.3Å; H140-K142 VanDerWaalsContact C-N 3.27Å; H140-K142 PolarHBondContact O-N 3.31Å; H140-L143 PolarHBondContact O-N 3.37Å
141L61.2Low65.5Low145 Ų145124.9 Ų124.976%0.75963%0.629SS**Hα-helixtrans-69.9-21177.6-159.682.6000113.6K137 I139K137-L141 WeakPolarHBondContact O-CB 3.43Å; K137-L141 PolarHBondContact O-N 2.9Å; K137-L141 VanDerWaalsContact O-N 3.1Å; I139-L141 VanDerWaalsContact C-N 3.3Å; I139-L141 PolarHBondContact O-N 3.46Å
142K62.8Low64.9Low179 Ų179131 Ų13178%0.77865%0.654SS**Hα-helixtrans-87.9-15.9175.9-91.2-169.7172.5-1680113.4K138 I139 H140K138-K142 PolarHBondContact O-N 3.04Å; I139-K142 PolarHBondContact O-N 3.1Å; H140-K142 VanDerWaalsContact C-N 3.27Å; H140-K142 PolarHBondContact O-N 3.31Å
143L61.9Low64.3Low153 Ų153136 Ų13680%0.80167%0.667SS**Hα-helixtrans-94.4-12.6-176.9-146107.9000113I139 H140I139-L143 PolarHBondContact O-N 3.42Å; H140-L143 PolarHBondContact O-N 3.37Å
144V58.5Low63.5Low182 Ų182140.5 Ų140.5100%1.10369%0.685SS**  trans-96.70171.5179.60000109

Retrieved 144 of 144 residues in 25.1 ms (Link to these results)