A0A5K4FCX6_SCHMA Loading...

BEGAIN-like coiled-coil domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FCX6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 248 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
1M58.7Low79.3Confident205 Ų205119.4 Ų119.4100%1.0161%0.607SS**  0-39.80-69-58.6-172.900113Y3 R4M1-Y3 PolarHBondContact O-N 3.22Å; M1-R4 PolarHBondContact O-N 3.11Å
2S65.2Low80.5Confident100 Ų100119.3 Ų119.370%0.69960%0.602SS**Hα-helixtrans-54-39.4-177.4-155.80000116.1R4 H5 A6S2-R4 VanDerWaalsContact C-N 3.34Å; S2-R4 PolarHBondContact O-N 3.16Å; S2-H5 PolarHBondContact O-N 2.92Å; S2-A6 PolarHBondContact O-N 3.39Å
3Y73.1Confident81.5Confident215 Ų215119.6 Ų119.684%0.84360%0.601SS**Hα-helixtrans-66.1-30.5-179.2-76.8-80.7000114.2M1 S7M1-Y3 PolarHBondContact O-N 3.22Å; Y3-S7 WeakPolarHBondContact O-CB 3.4Å; Y3-S7 PolarHBondContact O-N 2.99Å; Y3-S7 VanDerWaalsContact O-N 3.16Å
4R74.5Confident82.4Confident194 Ų194117.2 Ų117.273%0.73259%0.59SS**Hα-helixtrans-71.4-38.2177.2-90.5-169.1-175.3164.81.1111.8M1 S2 S7 L8M1-R4 PolarHBondContact O-N 3.11Å; S2-R4 VanDerWaalsContact C-N 3.34Å; S2-R4 PolarHBondContact O-N 3.16Å; R4-S7 PolarHBondContact O-N 3.02Å; R4-L8 WeakPolarHBondContact O-CG 3.42Å; R4-L8 PolarHBondContact O-N 3.45Å
5H76.8Confident83.3Confident125 Ų125116.7 Ų116.758%0.57959%0.585SS**Hα-helixtrans-66.1-48.3178.7-151.3-54.9000110.5S2 S7 L8 D9S2-H5 PolarHBondContact O-N 2.92Å; H5-S7 VanDerWaalsContact C-N 3.28Å; H5-S7 PolarHBondContact O-N 3.32Å; H5-L8 PolarHBondContact O-N 2.99Å; H5-D9 IonicContact CE1-OD1 3.6Å; H5-D9 PolarHBondContact CE1-OD1 3.03Å; H5-D9 IonicContact CE1-OD2 2.98Å; H5-D9 IonicContact CG-OD2 3.36Å; H5-D9 IonicContact ND1-OD1 2.83Å; H5-D9 PolarHBondContact ND1-OD1 2.83Å; H5-D9 IonicContact ND1-OD2 2.6Å; H5-D9 PolarHBondContact ND1-OD2 3.41Å; H5-D9 PolarHBondContact O-N 3.13Å; H5-D9 VanDerWaalsContact O-OD2 3.11Å
6A82Confident84.1Confident59 Ų59115.9 Ų115.949%0.48858%0.583SS.*Hα-helixtrans-59.7-35.8176.800000113.3S2 C10S2-A6 PolarHBondContact O-N 3.39Å; A6-C10 WeakPolarHBondContact O-CB 3.5Å; A6-C10 PolarHBondContact O-N 3.44Å; A6-C10 VanDerWaalsContact O-N 3.14Å
7S85.3Confident84.8Confident66 Ų66115 Ų11546%0.46258%0.579SS.*Hα-helixtrans-70-36.8175.4-175.50000112.8Y3 R4 H5 Q11Y3-S7 WeakPolarHBondContact O-CB 3.4Å; Y3-S7 PolarHBondContact O-N 2.99Å; Y3-S7 VanDerWaalsContact O-N 3.16Å; R4-S7 PolarHBondContact O-N 3.02Å; H5-S7 VanDerWaalsContact C-N 3.28Å; H5-S7 PolarHBondContact O-N 3.32Å; S7-Q11 WeakPolarHBondContact O-CG 3.28Å; S7-Q11 PolarHBondContact O-N 3.41Å
8L86.4Confident85.5Confident86 Ų86117.5 Ų117.545%0.4558%0.581SS.*Hα-helixtrans-70.1-43.5176-77166.1000110.6R4 H5 C10 Q11 H12R4-L8 WeakPolarHBondContact O-CG 3.42Å; R4-L8 PolarHBondContact O-N 3.45Å; H5-L8 PolarHBondContact O-N 2.99Å; L8-C10 VanDerWaalsContact C-N 3.33Å; L8-C10 PolarHBondContact O-N 3.3Å; L8-Q11 WeakPolarHBondContact O-CB 3.31Å; L8-Q11 PolarHBondContact O-N 3.43Å; L8-Q11 VanDerWaalsContact O-N 3.11Å; L8-H12 PolarHBondContact O-N 3.27Å; L8-H12 PolarHBondContact O-ND1 3.45Å
9D88.8Confident86.1Confident81 Ų81114.7 Ų114.743%0.43357%0.574SS.*Hα-helixtrans-60-44.3178.7-61.5-29000111H5 Q11 H12 E13H5-D9 IonicContact CE1-OD1 3.6Å; H5-D9 PolarHBondContact CE1-OD1 3.03Å; H5-D9 IonicContact CE1-OD2 2.98Å; H5-D9 IonicContact CG-OD2 3.36Å; H5-D9 IonicContact ND1-OD1 2.83Å; H5-D9 PolarHBondContact ND1-OD1 2.83Å; H5-D9 IonicContact ND1-OD2 2.6Å; H5-D9 PolarHBondContact ND1-OD2 3.41Å; H5-D9 PolarHBondContact O-N 3.13Å; H5-D9 VanDerWaalsContact O-OD2 3.11Å; D9-Q11 VanDerWaalsContact C-N 3.33Å; D9-Q11 PolarHBondContact O-N 3.3Å; D9-H12 PolarHBondContact O-N 3.28Å; D9-E13 WeakPolarHBondContact O-CB 3.19Å; D9-E13 PolarHBondContact O-N 3.4Å
10C90.6Very high86.7Confident65 Ų65113.9 Ų113.944%0.43957%0.572SS.*Hα-helixtrans-62.1-36.6174.5178.90000113A6 L8 L14A6-C10 WeakPolarHBondContact O-CB 3.5Å; A6-C10 PolarHBondContact O-N 3.44Å; A6-C10 VanDerWaalsContact O-N 3.14Å; L8-C10 VanDerWaalsContact C-N 3.33Å; L8-C10 PolarHBondContact O-N 3.3Å; C10-L14 WeakPolarHBondContact O-CB 3.47Å; C10-L14 WeakPolarHBondContact O-CG 3.13Å; C10-L14 PolarHBondContact O-N 3.36Å
11Q91.5Very high87.2Confident117 Ų117113.6 Ų113.655%0.54757%0.571SS.*Hα-helixtrans-68.6-41.1175.5-78.4179.4-13.800112.5S7 L8 D9 L14 E15S7-Q11 WeakPolarHBondContact O-CG 3.28Å; S7-Q11 PolarHBondContact O-N 3.41Å; L8-Q11 WeakPolarHBondContact O-CB 3.31Å; L8-Q11 PolarHBondContact O-N 3.43Å; L8-Q11 VanDerWaalsContact O-N 3.11Å; D9-Q11 VanDerWaalsContact C-N 3.33Å; D9-Q11 PolarHBondContact O-N 3.3Å; Q11-L14 PolarHBondContact O-N 2.9Å; Q11-E15 PolarHBondContact O-N 3.45Å
12H92.7Very high89Confident118 Ų118106.6 Ų106.655%0.54655%0.546SS..Hα-helixtrans-64.5-44.3175.3-71.285.3000110.7L8 D9 L14 E15 D16L8-H12 PolarHBondContact O-N 3.27Å; L8-H12 PolarHBondContact O-ND1 3.45Å; D9-H12 PolarHBondContact O-N 3.28Å; H12-L14 VanDerWaalsContact C-N 3.33Å; H12-L14 PolarHBondContact O-N 2.9Å; H12-E15 PolarHBondContact O-N 3.21Å; H12-E15 VanDerWaalsContact O-N 3.13Å; H12-D16 PolarHBondContact O-N 3.36Å
13E94.7Very high90.6Very high124 Ų124105.7 Ų105.758%0.57954%0.536SS*.Hα-helixtrans-59.9-42175.9-174.6178.4-174.400112D9 E15 D16 L17D9-E13 WeakPolarHBondContact O-CB 3.19Å; D9-E13 PolarHBondContact O-N 3.4Å; E13-E15 VanDerWaalsContact C-N 3.34Å; E13-E15 PolarHBondContact O-N 2.93Å; E13-D16 PolarHBondContact O-N 2.85Å; E13-L17 HydrophobicContact CG-CD1 4.27Å; E13-L17 WeakPolarHBondContact O-CB 3.4Å; E13-L17 VanDerWaalsContact O-CG 3.25Å; E13-L17 WeakPolarHBondContact O-CG 3.29Å; E13-L17 PolarHBondContact O-N 3.37Å
14L94Very high91.7Very high86 Ų8697.6 Ų97.645%0.4551%0.514SS..Hα-helixtrans-62.5-39.5174.4-82.6168.6000112.7C10 Q11 H12 R18C10-L14 WeakPolarHBondContact O-CB 3.47Å; C10-L14 WeakPolarHBondContact O-CG 3.13Å; C10-L14 PolarHBondContact O-N 3.36Å; Q11-L14 PolarHBondContact O-N 2.9Å; H12-L14 VanDerWaalsContact C-N 3.33Å; H12-L14 PolarHBondContact O-N 2.9Å; L14-R18 WeakPolarHBondContact O-CB 3.45Å; L14-R18 VanDerWaalsContact O-CG 3.25Å; L14-R18 WeakPolarHBondContact O-CG 3.21Å; L14-R18 PolarHBondContact O-N 3.01Å
15E95Very high92.9Very high110 Ų11092.7 Ų92.751%0.51450%0.502SS..Hα-helixtrans-70.8-41178.7-165.958.7-152.100111.6Q11 H12 E13 L17 R18 S19Q11-E15 PolarHBondContact O-N 3.45Å; H12-E15 PolarHBondContact O-N 3.21Å; H12-E15 VanDerWaalsContact O-N 3.13Å; E13-E15 VanDerWaalsContact C-N 3.34Å; E13-E15 PolarHBondContact O-N 2.93Å; E15-L17 PolarHBondContact O-N 3.02Å; E15-R18 WeakPolarHBondContact O-CB 3.47Å; E15-R18 PolarHBondContact O-N 3.25Å; E15-R18 IonicContact OE2-NH1 3.93Å; E15-S19 WeakPolarHBondContact O-CB 3.17Å; E15-S19 PolarHBondContact O-N 3.37Å
16D95.8Very high93.9Very high104 Ų10490.6 Ų90.656%0.55650%0.501SS*.Hα-helixtrans-60.7-44.6173.5-75-16.9000111.2H12 E13 R18 S19 N20H12-D16 PolarHBondContact O-N 3.36Å; E13-D16 PolarHBondContact O-N 2.85Å; D16-R18 VanDerWaalsContact C-N 3.34Å; D16-R18 PolarHBondContact O-N 3.35Å; D16-S19 PolarHBondContact O-N 3.04Å; D16-N20 WeakPolarHBondContact O-CB 3.28Å; D16-N20 PolarHBondContact O-N 2.96Å; D16-N20 PolarHBondContact O-ND2 3.02Å
17L96.6Very high94.6Very high100 Ų10092.3 Ų92.352%0.52450%0.502SS..Hα-helixtrans-63-39.1175.4-74.2172.6000112.3E13 E15 N20 L21E13-L17 HydrophobicContact CG-CD1 4.27Å; E13-L17 WeakPolarHBondContact O-CB 3.4Å; E13-L17 VanDerWaalsContact O-CG 3.25Å; E13-L17 WeakPolarHBondContact O-CG 3.29Å; E13-L17 PolarHBondContact O-N 3.37Å; E15-L17 PolarHBondContact O-N 3.02Å; L17-N20 PolarHBondContact O-N 3.29Å; L17-L21 WeakPolarHBondContact O-CB 3.47Å; L17-L21 PolarHBondContact O-N 3.13Å
18R97.3Very high95.3Very high160 Ų16093.1 Ų93.160%0.60450%0.5SS*.Hα-helixtrans-65.9-43.2175.4-78.4172174.3175.3-0.7112.1L14 E15 D16 L21 A22L14-R18 WeakPolarHBondContact O-CB 3.45Å; L14-R18 VanDerWaalsContact O-CG 3.25Å; L14-R18 WeakPolarHBondContact O-CG 3.21Å; L14-R18 PolarHBondContact O-N 3.01Å; E15-R18 WeakPolarHBondContact O-CB 3.47Å; E15-R18 PolarHBondContact O-N 3.25Å; E15-R18 IonicContact OE2-NH1 3.93Å; D16-R18 VanDerWaalsContact C-N 3.34Å; D16-R18 PolarHBondContact O-N 3.35Å; R18-L21 PolarHBondContact O-N 3.23Å; R18-A22 WeakPolarHBondContact O-CB 3.4Å; R18-A22 PolarHBondContact O-N 2.89Å
19S96.6Very high95.8Very high64 Ų6491.2 Ų91.245%0.44850%0.497SS..Hα-helixtrans-61-46.4174.6-177.80000111.1E15 D16 L21 A22 T23E15-S19 WeakPolarHBondContact O-CB 3.17Å; E15-S19 PolarHBondContact O-N 3.37Å; D16-S19 PolarHBondContact O-N 3.04Å; S19-L21 PolarHBondContact O-N 2.92Å; S19-A22 PolarHBondContact O-N 3.5Å; S19-T23 WeakPolarHBondContact O-CG2 3.48Å; S19-T23 PolarHBondContact O-N 2.89Å; S19-T23 PolarHBondContact O-OG1 3.36Å
20N97.6Very high96.3Very high99 Ų9991.5 Ų91.553%0.52950%0.496SS..Hα-helixtrans-62-40176.4-72.6-25.8000112.5D16 L17 T23 A24D16-N20 WeakPolarHBondContact O-CB 3.28Å; D16-N20 PolarHBondContact O-N 2.96Å; D16-N20 PolarHBondContact O-ND2 3.02Å; L17-N20 PolarHBondContact O-N 3.29Å; N20-T23 WeakPolarHBondContact CA-OG1 3.38Å; N20-T23 PolarHBondContact O-OG1 2.97Å; N20-A24 VanDerWaalsContact O-CB 3.3Å; N20-A24 WeakPolarHBondContact O-CB 3.48Å; N20-A24 PolarHBondContact O-N 3.42Å
21L97.6Very high96.6Very high108 Ų10892.6 Ų92.657%0.56550%0.497SS*.Hα-helixtrans-67.5-39.8175.4-176.7143.6000112L17 R18 S19 A24 N25L17-L21 WeakPolarHBondContact O-CB 3.47Å; L17-L21 PolarHBondContact O-N 3.13Å; R18-L21 PolarHBondContact O-N 3.23Å; S19-L21 PolarHBondContact O-N 2.92Å; L21-A24 PolarHBondContact O-N 3.39Å; L21-N25 VanDerWaalsContact CD2-ND2 3.31Å; L21-N25 WeakPolarHBondContact CD2-ND2 3.39Å; L21-N25 WeakPolarHBondContact O-CB 3.47Å; L21-N25 VanDerWaalsContact O-CG 3.26Å; L21-N25 PolarHBondContact O-N 2.6Å; L21-N25 PolarHBondContact O-ND2 2.9Å
22A97.4Very high97Very high57 Ų5792.9 Ų92.947%0.47150%0.498SS..Hα-helixtrans-64.2-44.2176.300000112R18 S19 N25 S26R18-A22 WeakPolarHBondContact O-CB 3.4Å; R18-A22 PolarHBondContact O-N 2.89Å; S19-A22 PolarHBondContact O-N 3.5Å; A22-N25 PolarHBondContact O-N 3.46Å; A22-S26 PolarHBondContact O-N 3.17Å
23T97.6Very high97.2Very high82 Ų8291 Ų9150%0.50350%0.495SS..Hα-helixtrans-64.6-42.5175.555.80000111.9S19 N20 S26 L27S19-T23 WeakPolarHBondContact O-CG2 3.48Å; S19-T23 PolarHBondContact O-N 2.89Å; S19-T23 PolarHBondContact O-OG1 3.36Å; N20-T23 WeakPolarHBondContact CA-OG1 3.38Å; N20-T23 PolarHBondContact O-OG1 2.97Å; T23-S26 WeakPolarHBondContact O-CB 3.41Å; T23-S26 PolarHBondContact O-N 3.29Å; T23-L27 PolarHBondContact O-N 2.92Å
24A97.8Very high97.4Very high45 Ų4590.5 Ų90.537%0.37249%0.491SS..Hα-helixtrans-61.4-44.4175.200000112.1N20 L21 S26 L27 I28N20-A24 VanDerWaalsContact O-CB 3.3Å; N20-A24 WeakPolarHBondContact O-CB 3.48Å; N20-A24 PolarHBondContact O-N 3.42Å; L21-A24 PolarHBondContact O-N 3.39Å; A24-S26 VanDerWaalsContact C-N 3.33Å; A24-S26 PolarHBondContact O-N 2.85Å; A24-L27 PolarHBondContact O-N 3.42Å; A24-I28 VanDerWaalsContact O-CG1 3.27Å; A24-I28 WeakPolarHBondContact O-CG1 3.47Å; A24-I28 PolarHBondContact O-N 2.88Å
25N98.3Very high97.6Very high90 Ų9092 Ų9248%0.48150%0.498SS..Hα-helixtrans-62.7-39.4175.7-75-19.9000112.2L21 A22 I28 A29L21-N25 VanDerWaalsContact CD2-ND2 3.31Å; L21-N25 WeakPolarHBondContact CD2-ND2 3.39Å; L21-N25 WeakPolarHBondContact O-CB 3.47Å; L21-N25 VanDerWaalsContact O-CG 3.26Å; L21-N25 PolarHBondContact O-N 2.6Å; L21-N25 PolarHBondContact O-ND2 2.9Å; A22-N25 PolarHBondContact O-N 3.46Å; N25-I28 PolarHBondContact O-N 2.9Å; N25-A29 WeakPolarHBondContact O-CB 3.37Å; N25-A29 PolarHBondContact O-N 3.26Å
26S97.7Very high97.8Very high81 Ų8189.9 Ų89.957%0.56650%0.496SS*.Hα-helixtrans-62.8-42.3174.5-172.70000111.9A22 T23 A24 A29 E30A22-S26 PolarHBondContact O-N 3.17Å; T23-S26 WeakPolarHBondContact O-CB 3.41Å; T23-S26 PolarHBondContact O-N 3.29Å; A24-S26 VanDerWaalsContact C-N 3.33Å; A24-S26 PolarHBondContact O-N 2.85Å; S26-A29 PolarHBondContact O-N 3Å; S26-E30 PolarHBondContact O-N 3.5Å
27L98.3Very high97.9Very high95 Ų9590.3 Ų90.350%0.49750%0.499SS..Hα-helixtrans-67.2-40.3177.3-179.266000111.7T23 A24 E30 L31T23-L27 PolarHBondContact O-N 2.92Å; A24-L27 PolarHBondContact O-N 3.42Å; L27-E30 PolarHBondContact O-N 3.19Å; L27-L31 HydrophobicContact CG-CD1 4.21Å; L27-L31 WeakPolarHBondContact O-CG 3.38Å; L27-L31 PolarHBondContact O-N 3.37Å
28I98.2Very high98Very high84 Ų8490.8 Ų90.843%0.43150%0.501SS..Hα-helixtrans-59.6-48.1174.8-70.8165.3000109.8A24 N25 E30 L31 E32A24-I28 VanDerWaalsContact O-CG1 3.27Å; A24-I28 WeakPolarHBondContact O-CG1 3.47Å; A24-I28 PolarHBondContact O-N 2.88Å; N25-I28 PolarHBondContact O-N 2.9Å; I28-E30 VanDerWaalsContact C-N 3.31Å; I28-E30 PolarHBondContact O-N 3.43Å; I28-L31 PolarHBondContact O-N 2.98Å; I28-L31 VanDerWaalsContact O-N 3.12Å; I28-E32 HydrophobicContact CG2-CG 4.23Å; I28-E32 WeakPolarHBondContact O-CB 3.35Å; I28-E32 VanDerWaalsContact O-CG 3.3Å; I28-E32 WeakPolarHBondContact O-CG 3.2Å; I28-E32 PolarHBondContact O-N 2.98Å
29A98.1Very high98Very high46 Ų4691.7 Ų91.738%0.3850%0.504SS..Hα-helixtrans-60.6-39.1177.200000112.5N25 S26 E32 T33N25-A29 WeakPolarHBondContact O-CB 3.37Å; N25-A29 PolarHBondContact O-N 3.26Å; S26-A29 PolarHBondContact O-N 3Å; A29-E32 PolarHBondContact O-N 3.32Å; A29-T33 WeakPolarHBondContact O-CG2 3.3Å; A29-T33 PolarHBondContact O-N 3.41Å; A29-T33 PolarHBondContact O-OG1 3.46Å
30E98.3Very high98.1Very high87 Ų8793.6 Ų93.641%0.40751%0.507SS..Hα-helixtrans-65.2-40.3174-168.5-169.8153.800112.2S26 L27 I28 T33 K34S26-E30 PolarHBondContact O-N 3.5Å; L27-E30 PolarHBondContact O-N 3.19Å; I28-E30 VanDerWaalsContact C-N 3.31Å; I28-E30 PolarHBondContact O-N 3.43Å; E30-T33 WeakPolarHBondContact CA-OG1 3.33Å; E30-T33 PolarHBondContact O-OG1 3.38Å; E30-K34 HydrophobicContact CG-CD 4.39Å; E30-K34 WeakPolarHBondContact O-CB 3.46Å; E30-K34 WeakPolarHBondContact O-CG 3.35Å; E30-K34 PolarHBondContact O-N 2.98Å; E30-K34 VanDerWaalsContact OE1-CE 3.31Å; E30-K34 WeakPolarHBondContact OE1-CE 3.4Å; E30-K34 IonicContact OE1-NZ 3.41Å; E30-K34 PolarHBondContact OE1-NZ 3.49Å
31L98.4Very high98.1Very high88 Ų8895 Ų9546%0.46151%0.509SS..Hα-helixtrans-69.5-38.4176.3-71.7173.3000112.1L27 I28 K34 L35L27-L31 HydrophobicContact CG-CD1 4.21Å; L27-L31 WeakPolarHBondContact O-CG 3.38Å; L27-L31 PolarHBondContact O-N 3.37Å; I28-L31 PolarHBondContact O-N 2.98Å; I28-L31 VanDerWaalsContact O-N 3.12Å; L31-K34 PolarHBondContact O-N 3.48Å; L31-L35 WeakPolarHBondContact O-CB 3.27Å; L31-L35 VanDerWaalsContact O-CG 3.31Å; L31-L35 WeakPolarHBondContact O-CG 3.44Å; L31-L35 PolarHBondContact O-N 3.41Å
32E98.4Very high98.2Very high122 Ų12297.4 Ų97.457%0.5751%0.512SS*.Hα-helixtrans-62.5-44.1175.5-75175.4163.800111.5I28 A29 L35 S36I28-E32 HydrophobicContact CG2-CG 4.23Å; I28-E32 WeakPolarHBondContact O-CB 3.35Å; I28-E32 VanDerWaalsContact O-CG 3.3Å; I28-E32 WeakPolarHBondContact O-CG 3.2Å; I28-E32 PolarHBondContact O-N 2.98Å; A29-E32 PolarHBondContact O-N 3.32Å; E32-L35 PolarHBondContact O-N 2.97Å; E32-S36 WeakPolarHBondContact O-CB 3.47Å; E32-S36 PolarHBondContact O-N 3.48Å
33T98.1Very high98.2Very high79 Ų7997.5 Ų97.549%0.48550%0.504SS..Hα-helixtrans-62.9-47174.349.30000111.8A29 E30 L35 S36 D37A29-T33 WeakPolarHBondContact O-CG2 3.3Å; A29-T33 PolarHBondContact O-N 3.41Å; A29-T33 PolarHBondContact O-OG1 3.46Å; E30-T33 WeakPolarHBondContact CA-OG1 3.33Å; E30-T33 PolarHBondContact O-OG1 3.38Å; T33-L35 VanDerWaalsContact C-N 3.34Å; T33-L35 PolarHBondContact O-N 3.29Å; T33-S36 WeakPolarHBondContact O-CB 3.49Å; T33-S36 PolarHBondContact O-N 3.27Å; T33-D37 PolarHBondContact O-N 3.05Å
34K98.5Very high98.3Very high113 Ų11397 Ų9749%0.49150%0.501SS..Hα-helixtrans-59.9-40.1175.2-76.4171.2172.8171.10113.2E30 L31 L38E30-K34 HydrophobicContact CG-CD 4.39Å; E30-K34 WeakPolarHBondContact O-CB 3.46Å; E30-K34 WeakPolarHBondContact O-CG 3.35Å; E30-K34 PolarHBondContact O-N 2.98Å; E30-K34 VanDerWaalsContact OE1-CE 3.31Å; E30-K34 WeakPolarHBondContact OE1-CE 3.4Å; E30-K34 IonicContact OE1-NZ 3.41Å; E30-K34 PolarHBondContact OE1-NZ 3.49Å; L31-K34 PolarHBondContact O-N 3.48Å; K34-L38 WeakPolarHBondContact O-CB 3.5Å; K34-L38 PolarHBondContact O-N 3.38Å
35L98.3Very high98.3Very high117 Ų11797 Ų9761%0.61350%0.495SS*.Hα-helixtrans-66.8-40.4175.8-77.9173.8000111.5L31 E32 T33 L38 R39L31-L35 WeakPolarHBondContact O-CB 3.27Å; L31-L35 VanDerWaalsContact O-CG 3.31Å; L31-L35 WeakPolarHBondContact O-CG 3.44Å; L31-L35 PolarHBondContact O-N 3.41Å; E32-L35 PolarHBondContact O-N 2.97Å; T33-L35 VanDerWaalsContact C-N 3.34Å; T33-L35 PolarHBondContact O-N 3.29Å; L35-L38 PolarHBondContact O-N 3.04Å; L35-R39 WeakPolarHBondContact O-CB 3.39Å; L35-R39 PolarHBondContact O-N 2.88Å
36S98.2Very high98.3Very high67 Ų6794.5 Ų94.547%0.46948%0.484SS..Hα-helixtrans-61.1-46.8174.5-171.90000111.6E32 T33 R39 M40E32-S36 WeakPolarHBondContact O-CB 3.47Å; E32-S36 PolarHBondContact O-N 3.48Å; T33-S36 WeakPolarHBondContact O-CB 3.49Å; T33-S36 PolarHBondContact O-N 3.27Å; S36-R39 PolarHBondContact O-N 3.4Å; S36-M40 WeakPolarHBondContact O-CG 3.42Å; S36-M40 PolarHBondContact O-N 2.86Å
37D98.3Very high98.3Very high113 Ų11394.4 Ų94.460%0.60448%0.482SS*.Hα-helixtrans-63.2-43.2177.5-71.4-15.1000112.1T33 R39 M40 K41T33-D37 PolarHBondContact O-N 3.05Å; D37-R39 VanDerWaalsContact C-N 3.34Å; D37-M40 PolarHBondContact O-N 3Å; D37-K41 WeakPolarHBondContact O-CB 3.47Å; D37-K41 PolarHBondContact O-N 3.41Å
38L98.4Very high98.3Very high110 Ų11095.3 Ų95.358%0.57648%0.482SS*.Hα-helixtrans-65.1-39.9177.9-174.362.2000111.6K34 L35 K41 Y42K34-L38 WeakPolarHBondContact O-CB 3.5Å; K34-L38 PolarHBondContact O-N 3.38Å; L35-L38 PolarHBondContact O-N 3.04Å; L38-K41 PolarHBondContact O-N 2.93Å; L38-Y42 WeakPolarHBondContact O-CB 3.45Å; L38-Y42 PolarHBondContact O-N 3.32Å
39R98.5Very high98.4Very high178 Ų17898.2 Ų98.267%0.67249%0.489SS*.Hα-helixtrans-61.9-47.1174.1-178.5178.4179.9-173.31.6111L35 S36 D37 K41 Y42 D43L35-R39 WeakPolarHBondContact O-CB 3.39Å; L35-R39 PolarHBondContact O-N 2.88Å; S36-R39 PolarHBondContact O-N 3.4Å; D37-R39 VanDerWaalsContact C-N 3.34Å; R39-K41 VanDerWaalsContact C-N 3.33Å; R39-K41 PolarHBondContact O-N 2.98Å; R39-Y42 PolarHBondContact O-N 3.14Å; R39-D43 PolarHBondContact O-N 3.38Å
40M98.3Very high98.4Very high104 Ų104102.2 Ų102.251%0.51250%0.5SS..Hα-helixtrans-62.7-39.8178.4-73.5-79.872.800112.9S36 D37 D43 T44S36-M40 WeakPolarHBondContact O-CG 3.42Å; S36-M40 PolarHBondContact O-N 2.86Å; D37-M40 PolarHBondContact O-N 3Å; M40-D43 HydrophobicContact CE-CB 4.18Å; M40-D43 WeakPolarHBondContact CE-OD2 3.36Å; M40-T44 VanDerWaalsContact O-CB 3.3Å; M40-T44 WeakPolarHBondContact O-CB 3.23Å; M40-T44 PolarHBondContact O-N 3.05Å; M40-T44 PolarHBondContact O-OG1 2.86Å
41K98.3Very high98.4Very high130 Ų130103.7 Ų103.757%0.56551%0.506SS*.Hα-helixtrans-62.1-45.9173.4-175.9-174.9174-172.10111.6D37 L38 R39 T44 D45D37-K41 WeakPolarHBondContact O-CB 3.47Å; D37-K41 PolarHBondContact O-N 3.41Å; L38-K41 PolarHBondContact O-N 2.93Å; R39-K41 VanDerWaalsContact C-N 3.33Å; R39-K41 PolarHBondContact O-N 2.98Å; K41-T44 PolarHBondContact O-N 3.32Å; K41-D45 WeakPolarHBondContact O-CB 3.22Å; K41-D45 PolarHBondContact O-N 3.41Å
42Y98.4Very high98.4Very high158 Ų158105.4 Ų105.462%0.6251%0.51SS*.Hα-helixtrans-61.3-49.5178.3179.6-94000111.6L38 R39 T44 D45 C46L38-Y42 WeakPolarHBondContact O-CB 3.45Å; L38-Y42 PolarHBondContact O-N 3.32Å; R39-Y42 PolarHBondContact O-N 3.14Å; Y42-T44 VanDerWaalsContact C-N 3.29Å; Y42-T44 PolarHBondContact O-N 3.48Å; Y42-D45 PolarHBondContact O-N 3.17Å; Y42-C46 WeakPolarHBondContact CE1-SG 3.4Å; Y42-C46 WeakPolarHBondContact O-CB 3.35Å; Y42-C46 PolarHBondContact O-N 3.33Å; Y42-C46 PolarHBondContact O-SG 2.92Å
43D98.3Very high98.4Very high59 Ų59104.7 Ų104.732%0.31651%0.509SS..Hα-helixtrans-59.4-42.4178.4-68.6-18.7000110.9R39 M40 C46 C47R39-D43 PolarHBondContact O-N 3.38Å; M40-D43 HydrophobicContact CE-CB 4.18Å; M40-D43 WeakPolarHBondContact CE-OD2 3.36Å; D43-C46 PolarHBondContact O-N 2.86Å; D43-C47 PolarHBondContact O-N 3.14Å; D43-C47 PolarHBondContact O-SG 3.5Å
44T98.4Very high98.4Very high70 Ų70107.6 Ų107.643%0.42952%0.517SS..Hα-helixtrans-62-45.1176.4-60.20000112.1M40 K41 Y42 C47 K48M40-T44 VanDerWaalsContact O-CB 3.3Å; M40-T44 WeakPolarHBondContact O-CB 3.23Å; M40-T44 PolarHBondContact O-N 3.05Å; M40-T44 PolarHBondContact O-OG1 2.86Å; K41-T44 PolarHBondContact O-N 3.32Å; Y42-T44 VanDerWaalsContact C-N 3.29Å; Y42-T44 PolarHBondContact O-N 3.48Å; T44-C47 PolarHBondContact O-N 3.22Å; T44-K48 WeakPolarHBondContact O-CG 3.42Å; T44-K48 PolarHBondContact O-N 2.8Å; T44-K48 VanDerWaalsContact O-N 3.13Å
45D98.5Very high98.4Very high47 Ų47106.8 Ų106.825%0.25152%0.517SS..Hα-helixtrans-70.8-36.5-179.7-72.6-17.4000111.5K41 Y42 K48 Y49K41-D45 WeakPolarHBondContact O-CB 3.22Å; K41-D45 PolarHBondContact O-N 3.41Å; Y42-D45 PolarHBondContact O-N 3.17Å; D45-K48 PolarHBondContact O-N 2.91Å; D45-K48 IonicContact OD1-NZ 3.88Å; D45-K48 PolarHBondContact OD1-NZ 2.93Å; D45-Y49 HydrophobicContact CB-CD2 4.47Å; D45-Y49 HydrophobicContact CB-CE2 4.19Å; D45-Y49 WeakPolarHBondContact O-CD2 3.31Å; D45-Y49 PolarHBondContact O-N 3.48Å
46C98.4Very high98.4Very high37 Ų37105.6 Ų105.625%0.2551%0.511CS..Hα-helixtrans-55.6-51.8170.3-780000111.5Y42 D43 K48 Y49 E50Y42-C46 WeakPolarHBondContact CE1-SG 3.4Å; Y42-C46 WeakPolarHBondContact O-CB 3.35Å; Y42-C46 PolarHBondContact O-N 3.33Å; Y42-C46 PolarHBondContact O-SG 2.92Å; D43-C46 PolarHBondContact O-N 2.86Å; C46-K48 VanDerWaalsContact C-N 3.32Å; C46-K48 PolarHBondContact O-N 3.09Å; C46-Y49 PolarHBondContact O-N 3.15Å; C46-Y49 VanDerWaalsContact O-N 3.16Å; C46-E50 WeakPolarHBondContact O-CG 3.38Å; C46-E50 PolarHBondContact O-N 3.39Å
47C98.3Very high98.5Very high78 Ų78105.9 Ų105.953%0.52751%0.51SS..Hα-helixtrans-58.5-41.9177.8-66.50000112.5D43 T44 Y49 E50 E51D43-C47 PolarHBondContact O-N 3.14Å; D43-C47 PolarHBondContact O-SG 3.5Å; T44-C47 PolarHBondContact O-N 3.22Å; C47-Y49 PolarHBondContact O-N 3.15Å; C47-E50 PolarHBondContact O-N 2.73Å; C47-E51 PolarHBondContact O-N 2.99Å
48K98.5Very high98.5Very high115 Ų115105.2 Ų105.250%0.550%0.503SS..Hα-helixtrans-62.5-41176.7-70.9171.6-168.6155.40112.6T44 D45 C46 K52T44-K48 WeakPolarHBondContact O-CG 3.42Å; T44-K48 PolarHBondContact O-N 2.8Å; T44-K48 VanDerWaalsContact O-N 3.13Å; D45-K48 PolarHBondContact O-N 2.91Å; D45-K48 IonicContact OD1-NZ 3.88Å; D45-K48 PolarHBondContact OD1-NZ 2.93Å; C46-K48 VanDerWaalsContact C-N 3.32Å; C46-K48 PolarHBondContact O-N 3.09Å; K48-K52 WeakPolarHBondContact O-CB 3.18Å; K48-K52 PolarHBondContact O-N 3.4Å
49Y98.5Very high98.5Very high145 Ų145108.7 Ų108.757%0.56951%0.509SS*.Hα-helixtrans-72.9-36.9-179.9-71.8-57.2000112D45 C46 C47 K52 I53D45-Y49 HydrophobicContact CB-CD2 4.47Å; D45-Y49 HydrophobicContact CB-CE2 4.19Å; D45-Y49 WeakPolarHBondContact O-CD2 3.31Å; D45-Y49 PolarHBondContact O-N 3.48Å; C46-Y49 PolarHBondContact O-N 3.15Å; C46-Y49 VanDerWaalsContact O-N 3.16Å; C47-Y49 PolarHBondContact O-N 3.15Å; Y49-K52 PolarHBondContact O-N 2.89Å; Y49-I53 WeakPolarHBondContact O-CB 3.39Å; Y49-I53 VanDerWaalsContact O-CG1 3.24Å; Y49-I53 WeakPolarHBondContact O-CG1 3.33Å; Y49-I53 PolarHBondContact O-N 3.34Å
50E98.6Very high98.5Very high130 Ų130105.3 Ų105.361%0.60750%0.5SS*.Hα-helixtrans-60-47.5172.6-73.5173.9175.200111.4C46 C47 K52 I53 Q54C46-E50 WeakPolarHBondContact O-CG 3.38Å; C46-E50 PolarHBondContact O-N 3.39Å; C47-E50 PolarHBondContact O-N 2.73Å; E50-K52 PolarHBondContact O-N 2.86Å; E50-I53 PolarHBondContact O-N 3.45Å; E50-Q54 WeakPolarHBondContact O-CB 3.46Å; E50-Q54 PolarHBondContact O-N 3.05Å
51E98.6Very high98.5Very high117 Ų117105.2 Ų105.255%0.54750%0.499SS..Hα-helixtrans-59.7-45.2175.4-176.1-179.1-164.900111.6C47 I53 Q54 I55C47-E51 PolarHBondContact O-N 2.99Å; E51-I53 PolarHBondContact O-N 3.24Å; E51-Q54 WeakPolarHBondContact O-CB 3.44Å; E51-Q54 PolarHBondContact O-N 3.35Å; E51-I55 HydrophobicContact CG-CD1 4.03Å; E51-I55 WeakPolarHBondContact O-CG1 3.45Å; E51-I55 PolarHBondContact O-N 2.95Å
52K98.6Very high98.5Very high124 Ų124106.7 Ų106.754%0.53950%0.501SS..Hα-helixtrans-62.4-41.5178-175.1175.9-179.7179.10112.3K48 Y49 E50 Q54 I55 L56K48-K52 WeakPolarHBondContact O-CB 3.18Å; K48-K52 PolarHBondContact O-N 3.4Å; Y49-K52 PolarHBondContact O-N 2.89Å; E50-K52 PolarHBondContact O-N 2.86Å; K52-Q54 VanDerWaalsContact C-N 3.33Å; K52-I55 PolarHBondContact O-N 3.38Å; K52-L56 HydrophobicContact CG-CD1 4.21Å; K52-L56 WeakPolarHBondContact O-CB 3.42Å; K52-L56 WeakPolarHBondContact O-CG 3.5Å; K52-L56 PolarHBondContact O-N 2.93Å
53I98.7Very high98.5Very high107 Ų107104.7 Ų104.755%0.54950%0.5SS..Hα-helixtrans-63.9-42.2176-71.7166.1000109.9Y49 E50 E51 L56 T57Y49-I53 WeakPolarHBondContact O-CB 3.39Å; Y49-I53 VanDerWaalsContact O-CG1 3.24Å; Y49-I53 WeakPolarHBondContact O-CG1 3.33Å; Y49-I53 PolarHBondContact O-N 3.34Å; E50-I53 PolarHBondContact O-N 3.45Å; E51-I53 PolarHBondContact O-N 3.24Å; I53-L56 PolarHBondContact O-N 2.68Å; I53-T57 WeakPolarHBondContact O-CB 3.38Å; I53-T57 PolarHBondContact O-N 2.91Å; I53-T57 PolarHBondContact O-OG1 3.48Å
54Q98.6Very high98.5Very high141 Ų141104.5 Ų104.566%0.65950%0.498SS*.Hα-helixtrans-60.8-47.9177.2-172177.515.600111.8E50 E51 K52 L56 T57 E58E50-Q54 WeakPolarHBondContact O-CB 3.46Å; E50-Q54 PolarHBondContact O-N 3.05Å; E51-Q54 WeakPolarHBondContact O-CB 3.44Å; E51-Q54 PolarHBondContact O-N 3.35Å; K52-Q54 VanDerWaalsContact C-N 3.33Å; Q54-L56 PolarHBondContact O-N 2.94Å; Q54-T57 PolarHBondContact O-N 2.97Å; Q54-E58 PolarHBondContact O-N 3.42Å
55I98.6Very high98.5Very high95 Ų95104.3 Ų104.349%0.48750%0.5SS..Hα-helixtrans-60.4-44.4177.3-68.5166.7000111.4E51 K52 T57 E58 R59E51-I55 HydrophobicContact CG-CD1 4.03Å; E51-I55 WeakPolarHBondContact O-CG1 3.45Å; E51-I55 PolarHBondContact O-N 2.95Å; K52-I55 PolarHBondContact O-N 3.38Å; I55-T57 VanDerWaalsContact C-N 3.35Å; I55-E58 PolarHBondContact O-N 2.98Å; I55-R59 WeakPolarHBondContact O-CB 3.5Å; I55-R59 PolarHBondContact O-N 3.28Å
56L98.4Very high98.5Very high92 Ų92104 Ų10448%0.48250%0.502SS..Hα-helixtrans-66.5-38.4179-74.5173.5000112.1K52 I53 Q54 R59 H60K52-L56 HydrophobicContact CG-CD1 4.21Å; K52-L56 WeakPolarHBondContact O-CB 3.42Å; K52-L56 WeakPolarHBondContact O-CG 3.5Å; K52-L56 PolarHBondContact O-N 2.93Å; I53-L56 PolarHBondContact O-N 2.68Å; Q54-L56 PolarHBondContact O-N 2.94Å; L56-R59 PolarHBondContact O-N 3.34Å; L56-H60 WeakPolarHBondContact O-CB 3.49Å; L56-H60 PolarHBondContact O-N 3.18Å
57T98.7Very high98.5Very high73 Ų73108.3 Ų108.345%0.44852%0.518SS..Hα-helixtrans-63.3-49.2176-56.80000110.2I53 Q54 I55 R59 H60 E61I53-T57 WeakPolarHBondContact O-CB 3.38Å; I53-T57 PolarHBondContact O-N 2.91Å; I53-T57 PolarHBondContact O-OG1 3.48Å; Q54-T57 PolarHBondContact O-N 2.97Å; I55-T57 VanDerWaalsContact C-N 3.35Å; T57-R59 VanDerWaalsContact C-N 3.32Å; T57-R59 PolarHBondContact O-N 3.17Å; T57-H60 WeakPolarHBondContact O-CB 3.46Å; T57-H60 PolarHBondContact O-N 2.89Å; T57-H60 VanDerWaalsContact O-N 3.09Å; T57-E61 WeakPolarHBondContact O-CG 3.48Å; T57-E61 PolarHBondContact O-N 3.38Å
58E98.6Very high98.5Very high100 Ų100110.3 Ų110.347%0.46752%0.52SS..Hα-helixtrans-60.3-42.4176.9-171.5-176.6-174.700112Q54 I55 H60 E61 R62Q54-E58 PolarHBondContact O-N 3.42Å; I55-E58 PolarHBondContact O-N 2.98Å; E58-H60 VanDerWaalsContact C-N 3.31Å; E58-H60 PolarHBondContact O-N 3.14Å; E58-E61 PolarHBondContact O-N 3.11Å; E58-R62 VanDerWaalsContact CD-NH2 3.32Å; E58-R62 WeakPolarHBondContact O-CG 3.36Å; E58-R62 PolarHBondContact O-N 3.45Å; E58-R62 IonicContact OE1-CZ 2.73Å; E58-R62 IonicContact OE1-NE 3.76Å; E58-R62 PolarHBondContact OE1-NE 3.18Å; E58-R62 IonicContact OE1-NH2 3.41Å; E58-R62 PolarHBondContact OE1-NH2 2.81Å; E58-R62 IonicContact OE2-NH2 2.65Å
59R98.6Very high98.5Very high183 Ų183111.8 Ų111.869%0.69152%0.522SS*.Hα-helixtrans-60.6-41.2174.9-177.9179.3178.4177.30.3111.8I55 L56 T57 L63I55-R59 WeakPolarHBondContact O-CB 3.5Å; I55-R59 PolarHBondContact O-N 3.28Å; L56-R59 PolarHBondContact O-N 3.34Å; T57-R59 VanDerWaalsContact C-N 3.32Å; T57-R59 PolarHBondContact O-N 3.17Å; R59-L63 WeakPolarHBondContact O-CB 3.25Å; R59-L63 PolarHBondContact O-N 2.77Å
60H98.8Very high98.5Very high107 Ų107108.6 Ų108.650%0.49551%0.514SS..Hα-helixtrans-64.5-45.9178.1-173.863.5000111.5L56 T57 E58 R62 L63 I64L56-H60 WeakPolarHBondContact O-CB 3.49Å; L56-H60 PolarHBondContact O-N 3.18Å; T57-H60 WeakPolarHBondContact O-CB 3.46Å; T57-H60 PolarHBondContact O-N 2.89Å; T57-H60 VanDerWaalsContact O-N 3.09Å; E58-H60 VanDerWaalsContact C-N 3.31Å; E58-H60 PolarHBondContact O-N 3.14Å; H60-R62 PolarHBondContact O-N 3Å; H60-L63 WeakPolarHBondContact O-CB 3.48Å; H60-L63 PolarHBondContact O-N 3.33Å; H60-L63 VanDerWaalsContact O-N 3.12Å; H60-I64 VanDerWaalsContact NE2-CD1 3.31Å; H60-I64 WeakPolarHBondContact NE2-CD1 3.37Å; H60-I64 WeakPolarHBondContact O-CG1 3.47Å; H60-I64 PolarHBondContact O-N 3.32Å
61E98.6Very high98.5Very high101 Ų101105.7 Ų105.747%0.47251%0.508SS..Hα-helixtrans-61.6-42.2177-69.7-53.8135.700112.4T57 E58 L63 I64 S65T57-E61 WeakPolarHBondContact O-CG 3.48Å; T57-E61 PolarHBondContact O-N 3.38Å; E58-E61 PolarHBondContact O-N 3.11Å; E61-L63 VanDerWaalsContact C-N 3.32Å; E61-L63 PolarHBondContact O-N 2.87Å; E61-I64 PolarHBondContact O-N 3.42Å; E61-S65 WeakPolarHBondContact O-CB 3.36Å; E61-S65 PolarHBondContact O-N 3.23Å; E61-S65 PolarHBondContact O-OG 3.46Å
62R98.4Very high98.5Very high162 Ų162106.7 Ų106.761%0.61151%0.511SS*.Hα-helixtrans-61.8-40.1173.9-70.5179.4-167.2-167.77.2111.7E58 H60 S66E58-R62 VanDerWaalsContact CD-NH2 3.32Å; E58-R62 WeakPolarHBondContact O-CG 3.36Å; E58-R62 PolarHBondContact O-N 3.45Å; E58-R62 IonicContact OE1-CZ 2.73Å; E58-R62 IonicContact OE1-NE 3.76Å; E58-R62 PolarHBondContact OE1-NE 3.18Å; E58-R62 IonicContact OE1-NH2 3.41Å; E58-R62 PolarHBondContact OE1-NH2 2.81Å; E58-R62 IonicContact OE2-NH2 2.65Å; H60-R62 PolarHBondContact O-N 3Å; R62-S66 WeakPolarHBondContact O-CB 3.4Å; R62-S66 PolarHBondContact O-N 2.87Å
63L98.5Very high98.5Very high115 Ų115104.5 Ų104.560%0.60251%0.505SS*.Hα-helixtrans-66.8-46178-178.263000111.6R59 H60 E61 S65 S66 H67R59-L63 WeakPolarHBondContact O-CB 3.25Å; R59-L63 PolarHBondContact O-N 2.77Å; H60-L63 WeakPolarHBondContact O-CB 3.48Å; H60-L63 PolarHBondContact O-N 3.33Å; H60-L63 VanDerWaalsContact O-N 3.12Å; E61-L63 VanDerWaalsContact C-N 3.32Å; E61-L63 PolarHBondContact O-N 2.87Å; L63-S65 VanDerWaalsContact C-N 3.33Å; L63-S65 PolarHBondContact O-N 3.42Å; L63-S66 PolarHBondContact O-N 2.8Å; L63-H67 WeakPolarHBondContact O-CB 3.37Å; L63-H67 PolarHBondContact O-N 3.37Å
64I98.6Very high98.5Very high55 Ų55103.3 Ų103.328%0.28250%0.499SS..Hα-helixtrans-57.5-48.4174.9-71.9171.3000110.1H60 E61 S66 H67 Q68H60-I64 VanDerWaalsContact NE2-CD1 3.31Å; H60-I64 WeakPolarHBondContact NE2-CD1 3.37Å; H60-I64 WeakPolarHBondContact O-CG1 3.47Å; H60-I64 PolarHBondContact O-N 3.32Å; E61-I64 PolarHBondContact O-N 3.42Å; I64-S66 VanDerWaalsContact C-N 3.32Å; I64-S66 PolarHBondContact O-N 3Å; I64-H67 PolarHBondContact O-N 2.95Å; I64-Q68 HydrophobicContact CG2-CG 4.31Å; I64-Q68 WeakPolarHBondContact O-CG 3.44Å; I64-Q68 PolarHBondContact O-N 2.93Å
65S98.2Very high98.5Very high66 Ų66102.3 Ų102.346%0.46249%0.494SS..Hα-helixtrans-59.4-42.6178.8-61.90000111.9E61 L63 R69E61-S65 WeakPolarHBondContact O-CB 3.36Å; E61-S65 PolarHBondContact O-N 3.23Å; E61-S65 PolarHBondContact O-OG 3.46Å; L63-S65 VanDerWaalsContact C-N 3.33Å; L63-S65 PolarHBondContact O-N 3.42Å; S65-R69 WeakPolarHBondContact O-CB 3.36Å; S65-R69 PolarHBondContact O-N 3.29Å; S65-R69 VanDerWaalsContact O-N 3.07Å
66S98.2Very high98.4Very high42 Ų42101 Ų10129%0.29449%0.486SS..Hα-helixtrans-65.4-42.1175.7-168.90000112.3R62 L63 I64 R69 L70R62-S66 WeakPolarHBondContact O-CB 3.4Å; R62-S66 PolarHBondContact O-N 2.87Å; L63-S66 PolarHBondContact O-N 2.8Å; I64-S66 VanDerWaalsContact C-N 3.32Å; I64-S66 PolarHBondContact O-N 3Å; S66-R69 PolarHBondContact O-N 3.17Å; S66-R69 PolarHBondContact OG-NH2 2.89Å; S66-L70 WeakPolarHBondContact O-CG 3.33Å; S66-L70 PolarHBondContact O-N 3.37Å
67H98.5Very high98.5Very high126 Ų126101 Ų10158%0.58349%0.486SS*.Hα-helixtrans-62.6-45.1176.4176.2-84.9000111.6L63 I64 R69 L70 S71L63-H67 WeakPolarHBondContact O-CB 3.37Å; L63-H67 PolarHBondContact O-N 3.37Å; I64-H67 PolarHBondContact O-N 2.95Å; H67-R69 VanDerWaalsContact C-N 3.33Å; H67-R69 PolarHBondContact O-N 3.18Å; H67-L70 PolarHBondContact O-N 2.86Å; H67-S71 WeakPolarHBondContact O-CB 3.49Å; H67-S71 PolarHBondContact O-N 3.48Å
68Q98.5Very high98.4Very high121 Ų121102.1 Ų102.157%0.56549%0.486SS*.Hα-helixtrans-59.8-43.5176.3-73.7172.7-11.600111.7I64 S71 K72I64-Q68 HydrophobicContact CG2-CG 4.31Å; I64-Q68 WeakPolarHBondContact O-CG 3.44Å; I64-Q68 PolarHBondContact O-N 2.93Å; Q68-S71 PolarHBondContact O-N 2.93Å; Q68-K72 WeakPolarHBondContact O-CB 3.35Å; Q68-K72 PolarHBondContact O-N 3.3Å
69R98.5Very high98.4Very high145 Ų145102.5 Ų102.555%0.54749%0.488SS..Hα-helixtrans-62.1-43.5175.2-177.8-175.657.477.39.5112.2S65 S66 H67 K72 L73S65-R69 WeakPolarHBondContact O-CB 3.36Å; S65-R69 PolarHBondContact O-N 3.29Å; S65-R69 VanDerWaalsContact O-N 3.07Å; S66-R69 PolarHBondContact O-N 3.17Å; S66-R69 PolarHBondContact OG-NH2 2.89Å; H67-R69 VanDerWaalsContact C-N 3.33Å; H67-R69 PolarHBondContact O-N 3.18Å; R69-K72 PolarHBondContact O-N 3.45Å; R69-L73 PolarHBondContact O-N 2.76Å
70L98.4Very high98.4Very high79 Ų79101.3 Ų101.341%0.41448%0.484SS..Hα-helixtrans-65.7-42.2176.2-78170.8000111.9S66 H67 K72 L73 N74S66-L70 WeakPolarHBondContact O-CG 3.33Å; S66-L70 PolarHBondContact O-N 3.37Å; H67-L70 PolarHBondContact O-N 2.86Å; L70-K72 VanDerWaalsContact C-N 3.3Å; L70-K72 PolarHBondContact O-N 2.83Å; L70-L73 PolarHBondContact O-N 3.3Å; L70-N74 WeakPolarHBondContact O-CB 3.29Å; L70-N74 PolarHBondContact O-N 3.01Å
71S98.1Very high98.4Very high68 Ų68101.2 Ų101.248%0.47649%0.486SS..Hα-helixtrans-60.9-40.7176.2-173.20000111.4H67 Q68 N74 H75H67-S71 WeakPolarHBondContact O-CB 3.49Å; H67-S71 PolarHBondContact O-N 3.48Å; Q68-S71 PolarHBondContact O-N 2.93Å; S71-N74 PolarHBondContact O-N 3.42Å; S71-H75 WeakPolarHBondContact O-CB 3.45Å; S71-H75 PolarHBondContact O-N 2.96Å
72K98.3Very high98.4Very high138 Ų138101.9 Ų101.960%0.649%0.492SS*.Hα-helixtrans-64.9-48.1175.2-172.3-179.8179.9-172.10111.6Q68 R69 L70 N74 H75 E76Q68-K72 WeakPolarHBondContact O-CB 3.35Å; Q68-K72 PolarHBondContact O-N 3.3Å; R69-K72 PolarHBondContact O-N 3.45Å; L70-K72 VanDerWaalsContact C-N 3.3Å; L70-K72 PolarHBondContact O-N 2.83Å; K72-N74 VanDerWaalsContact C-N 3.3Å; K72-N74 PolarHBondContact O-N 2.79Å; K72-H75 PolarHBondContact O-N 3.14Å; K72-E76 WeakPolarHBondContact CE-OE1 3.25Å; K72-E76 WeakPolarHBondContact O-CG 3.5Å; K72-E76 PolarHBondContact O-N 2.94Å
73L98.5Very high98.4Very high79 Ų7998.4 Ų98.441%0.41449%0.486SS..Hα-helixtrans-59.9-41.6176.5177.963.3000111.7R69 L70 E76 L77R69-L73 PolarHBondContact O-N 2.76Å; L70-L73 PolarHBondContact O-N 3.3Å; L73-E76 PolarHBondContact O-N 3.3Å; L73-L77 HydrophobicContact CD1-CD1 4.37Å; L73-L77 HydrophobicContact CD1-CG 4.35Å; L73-L77 HydrophobicContact CG-CD1 4.16Å; L73-L77 WeakPolarHBondContact O-CB 3.49Å; L73-L77 VanDerWaalsContact O-CG 3.29Å; L73-L77 WeakPolarHBondContact O-CG 3.41Å; L73-L77 PolarHBondContact O-N 2.97Å
74N98.2Very high98.4Very high81 Ų8197.2 Ų97.243%0.43348%0.483SS..Hα-helixtrans-63.8-44178-170.454.9000111.2L70 S71 K72 E76 L77 E78L70-N74 WeakPolarHBondContact O-CB 3.29Å; L70-N74 PolarHBondContact O-N 3.01Å; S71-N74 PolarHBondContact O-N 3.42Å; K72-N74 VanDerWaalsContact C-N 3.3Å; K72-N74 PolarHBondContact O-N 2.79Å; N74-E76 PolarHBondContact O-N 3.28Å; N74-L77 PolarHBondContact O-N 3.31Å; N74-E78 PolarHBondContact ND2-OE1 3.15Å; N74-E78 WeakPolarHBondContact O-CG 3.37Å; N74-E78 PolarHBondContact O-N 3.38Å
75H98.3Very high98.4Very high120 Ų12098.9 Ų98.956%0.55649%0.492SS*.Hα-helixtrans-60-45.2174.8-176.659.3000112.3S71 K72 L77 E78 E79S71-H75 WeakPolarHBondContact O-CB 3.45Å; S71-H75 PolarHBondContact O-N 2.96Å; K72-H75 PolarHBondContact O-N 3.14Å; H75-L77 VanDerWaalsContact C-N 3.29Å; H75-L77 PolarHBondContact O-N 2.88Å; H75-E78 PolarHBondContact O-N 3.19Å; H75-E79 PolarHBondContact O-N 3.45Å
76E98.4Very high98.4Very high68 Ų68102 Ų10232%0.31850%0.499SS..Hα-helixtrans-62.5-34.2175.9-71.3173.8-168.200112.5K72 L73 N74 R80K72-E76 WeakPolarHBondContact CE-OE1 3.25Å; K72-E76 WeakPolarHBondContact O-CG 3.5Å; K72-E76 PolarHBondContact O-N 2.94Å; L73-E76 PolarHBondContact O-N 3.3Å; N74-E76 PolarHBondContact O-N 3.28Å; E76-R80 VanDerWaalsContact O-CG 3.25Å; E76-R80 WeakPolarHBondContact O-CG 3.34Å; E76-R80 PolarHBondContact O-N 3Å; E76-R80 VanDerWaalsContact O-N 3.15Å
77L98.6Very high98.4Very high91 Ų91107.1 Ų107.148%0.47652%0.516SS..Hα-helixtrans-74.1-39.1176.3-72.8173.9000112.3L73 N74 H75 R80 L81L73-L77 HydrophobicContact CD1-CD1 4.37Å; L73-L77 HydrophobicContact CD1-CG 4.35Å; L73-L77 HydrophobicContact CG-CD1 4.16Å; L73-L77 WeakPolarHBondContact O-CB 3.49Å; L73-L77 VanDerWaalsContact O-CG 3.29Å; L73-L77 WeakPolarHBondContact O-CG 3.41Å; L73-L77 PolarHBondContact O-N 2.97Å; N74-L77 PolarHBondContact O-N 3.31Å; H75-L77 VanDerWaalsContact C-N 3.29Å; H75-L77 PolarHBondContact O-N 2.88Å; L77-R80 PolarHBondContact O-N 3.46Å; L77-L81 WeakPolarHBondContact O-CB 3.45Å; L77-L81 PolarHBondContact O-N 3.26Å
78E98.4Very high98.4Very high98 Ų98103.5 Ų103.546%0.45851%0.505SS..Hα-helixtrans-61.8-44.7174-74.5170.1-173.900111N74 H75 L81 L82N74-E78 PolarHBondContact ND2-OE1 3.15Å; N74-E78 WeakPolarHBondContact O-CG 3.37Å; N74-E78 PolarHBondContact O-N 3.38Å; H75-E78 PolarHBondContact O-N 3.19Å; E78-L81 PolarHBondContact O-N 2.96Å; E78-L82 WeakPolarHBondContact O-CG 3.45Å; E78-L82 PolarHBondContact O-N 2.91Å
79E98.4Very high98.4Very high107 Ų107101 Ų10150%0.550%0.501SS..Hα-helixtrans-59.2-50.2175.2-173.7179.5-161.200111.4H75 L81 L82 D83H75-E79 PolarHBondContact O-N 3.45Å; E79-L81 VanDerWaalsContact C-N 3.28Å; E79-L81 PolarHBondContact O-N 3.49Å; E79-L82 WeakPolarHBondContact O-CB 3.46Å; E79-L82 PolarHBondContact O-N 3.41Å; E79-L82 VanDerWaalsContact O-N 3.14Å; E79-D83 PolarHBondContact O-N 2.96Å
80R98.5Very high98.4Very high158 Ų15897.1 Ų97.160%0.59649%0.494SS*.Hα-helixtrans-61.2-35.7177.1-72.9174.5-175.1-164.74.2113.4E76 L77 T84E76-R80 VanDerWaalsContact O-CG 3.25Å; E76-R80 WeakPolarHBondContact O-CG 3.34Å; E76-R80 PolarHBondContact O-N 3Å; E76-R80 VanDerWaalsContact O-N 3.15Å; L77-R80 PolarHBondContact O-N 3.46Å; R80-T84 WeakPolarHBondContact O-CB 3.49Å; R80-T84 PolarHBondContact O-N 3.3Å; R80-T84 PolarHBondContact O-OG1 3Å
81L98.6Very high98.4Very high106 Ų10698.4 Ų98.456%0.55550%0.498SS*.Hα-helixtrans-66.5-44.9176.4178.763.1000110.3L77 E78 E79 T84 I85L77-L81 WeakPolarHBondContact O-CB 3.45Å; L77-L81 PolarHBondContact O-N 3.26Å; E78-L81 PolarHBondContact O-N 2.96Å; E79-L81 VanDerWaalsContact C-N 3.28Å; E79-L81 PolarHBondContact O-N 3.49Å; L81-T84 PolarHBondContact O-N 3.49Å; L81-I85 HydrophobicContact CD1-CD1 4.07Å; L81-I85 HydrophobicContact CD1-CG1 4.35Å; L81-I85 HydrophobicContact CG-CD1 3.88Å; L81-I85 WeakPolarHBondContact O-CB 3.5Å; L81-I85 VanDerWaalsContact O-CG1 3.25Å; L81-I85 WeakPolarHBondContact O-CG1 3.19Å; L81-I85 PolarHBondContact O-N 3.26Å
82L98.5Very high98.4Very high114 Ų114100.2 Ų100.260%0.59750%0.501SS*.Hα-helixtrans-60.5-46.6175.7-70.1172.2000111.4E78 E79 T84 I85 E86E78-L82 WeakPolarHBondContact O-CG 3.45Å; E78-L82 PolarHBondContact O-N 2.91Å; E79-L82 WeakPolarHBondContact O-CB 3.46Å; E79-L82 PolarHBondContact O-N 3.41Å; E79-L82 VanDerWaalsContact O-N 3.14Å; L82-T84 VanDerWaalsContact C-N 3.31Å; L82-T84 PolarHBondContact O-N 2.82Å; L82-I85 PolarHBondContact O-N 3.42Å; L82-E86 PolarHBondContact O-N 3.38Å
83D98.4Very high98.4Very high89 Ų8999.1 Ų99.148%0.47650%0.498SS..Hα-helixtrans-58.3-42.9175.9-71.9-12.6000112.1E79 E86 K87E79-D83 PolarHBondContact O-N 2.96Å; D83-E86 PolarHBondContact O-N 3.38Å; D83-K87 WeakPolarHBondContact O-CB 3.31Å; D83-K87 PolarHBondContact O-N 3.44Å
84T98.5Very high98.4Very high90 Ų90100.9 Ų100.955%0.55250%0.504SS*.Hα-helixtrans-66.5-40.9178.7-57.30000111R80 L81 L82 S88R80-T84 WeakPolarHBondContact O-CB 3.49Å; R80-T84 PolarHBondContact O-N 3.3Å; R80-T84 PolarHBondContact O-OG1 3Å; L81-T84 PolarHBondContact O-N 3.49Å; L82-T84 VanDerWaalsContact C-N 3.31Å; L82-T84 PolarHBondContact O-N 2.82Å; T84-S88 WeakPolarHBondContact O-CB 3.37Å; T84-S88 PolarHBondContact O-N 3.26Å; T84-S88 PolarHBondContact O-OG 2.95Å
85I98.5Very high98.5Very high90 Ų90101.5 Ų101.546%0.46251%0.507SS..Hα-helixtrans-63.5-47.2176.1-71.4166.9000110L81 L82 K87 S88 S89L81-I85 HydrophobicContact CD1-CD1 4.07Å; L81-I85 HydrophobicContact CD1-CG1 4.35Å; L81-I85 HydrophobicContact CG-CD1 3.88Å; L81-I85 WeakPolarHBondContact O-CB 3.5Å; L81-I85 VanDerWaalsContact O-CG1 3.25Å; L81-I85 WeakPolarHBondContact O-CG1 3.19Å; L81-I85 PolarHBondContact O-N 3.26Å; L82-I85 PolarHBondContact O-N 3.42Å; I85-K87 PolarHBondContact O-N 2.95Å; I85-S88 WeakPolarHBondContact CA-OG 3.46Å; I85-S88 PolarHBondContact O-N 3.38Å; I85-S88 PolarHBondContact O-OG 3.43Å; I85-S89 WeakPolarHBondContact O-CB 3.41Å; I85-S89 PolarHBondContact O-N 3.36Å
86E98.5Very high98.5Very high131 Ų13199.3 Ų99.361%0.61250%0.502SS*.Hα-helixtrans-59.3-48.1177.6-176176-172.600111.3L82 D83 S88 S89 T90L82-E86 PolarHBondContact O-N 3.38Å; D83-E86 PolarHBondContact O-N 3.38Å; E86-S88 PolarHBondContact O-N 2.98Å; E86-S89 WeakPolarHBondContact O-CB 3.35Å; E86-S89 PolarHBondContact O-N 3.07Å; E86-T90 WeakPolarHBondContact O-CG2 3.47Å; E86-T90 PolarHBondContact O-N 3.41Å; E86-T90 PolarHBondContact O-OG1 2.8Å
87K98.5Very high98.5Very high151 Ų151101.7 Ų101.766%0.65751%0.513SS*.Hα-helixtrans-58.5-45.7175-174-179.5176-1750111.9D83 I85 S89 T90 E91D83-K87 WeakPolarHBondContact O-CB 3.31Å; D83-K87 PolarHBondContact O-N 3.44Å; I85-K87 PolarHBondContact O-N 2.95Å; K87-S89 VanDerWaalsContact C-N 3.32Å; K87-S89 PolarHBondContact O-N 2.84Å; K87-T90 PolarHBondContact O-N 3.43Å; K87-T90 PolarHBondContact O-OG1 2.87Å; K87-E91 WeakPolarHBondContact O-CB 3.32Å; K87-E91 PolarHBondContact O-N 3.17Å
88S98.3Very high98.5Very high49 Ų49103.1 Ų103.134%0.34352%0.517SS..Hα-helixtrans-65.1-36.6177.873.30000112.3T84 I85 E86 E91 I92T84-S88 WeakPolarHBondContact O-CB 3.37Å; T84-S88 PolarHBondContact O-N 3.26Å; T84-S88 PolarHBondContact O-OG 2.95Å; I85-S88 WeakPolarHBondContact CA-OG 3.46Å; I85-S88 PolarHBondContact O-N 3.38Å; I85-S88 PolarHBondContact O-OG 3.43Å; E86-S88 PolarHBondContact O-N 2.98Å; S88-E91 PolarHBondContact O-N 3.47Å; S88-I92 WeakPolarHBondContact O-CB 3.37Å; S88-I92 WeakPolarHBondContact O-CD1 3.45Å; S88-I92 WeakPolarHBondContact O-CG1 3.32Å; S88-I92 PolarHBondContact O-N 3.24Å
89S98.5Very high98.5Very high70 Ų70102.7 Ų102.749%0.4952%0.518SS..Hα-helixtrans-66-42.2177.5-172.70000111.3I85 E86 K87 Q93I85-S89 WeakPolarHBondContact O-CB 3.41Å; I85-S89 PolarHBondContact O-N 3.36Å; E86-S89 WeakPolarHBondContact O-CB 3.35Å; E86-S89 PolarHBondContact O-N 3.07Å; K87-S89 VanDerWaalsContact C-N 3.32Å; K87-S89 PolarHBondContact O-N 2.84Å; S89-Q93 WeakPolarHBondContact O-CB 3.35Å; S89-Q93 PolarHBondContact O-N 3.04Å
90T98.3Very high98.5Very high63 Ų63101.6 Ų101.639%0.38751%0.513SS..Hα-helixtrans-66.4-40.8175.956.30000111.9E86 K87 Q93 Q94E86-T90 WeakPolarHBondContact O-CG2 3.47Å; E86-T90 PolarHBondContact O-N 3.41Å; E86-T90 PolarHBondContact O-OG1 2.8Å; K87-T90 PolarHBondContact O-N 3.43Å; K87-T90 PolarHBondContact O-OG1 2.87Å; T90-Q93 PolarHBondContact O-N 3.44Å; T90-Q94 WeakPolarHBondContact O-CG 3.36Å; T90-Q94 PolarHBondContact O-N 3.45Å
91E98.6Very high98.5Very high106 Ų10697.9 Ų97.950%0.49551%0.511SS..Hα-helixtrans-63.9-45175.1-177.3174.4-166.800111.9K87 S88 Q93 Q94 L95K87-E91 WeakPolarHBondContact O-CB 3.32Å; K87-E91 PolarHBondContact O-N 3.17Å; S88-E91 PolarHBondContact O-N 3.47Å; E91-Q93 VanDerWaalsContact C-N 3.28Å; E91-Q93 PolarHBondContact O-N 2.93Å; E91-Q94 PolarHBondContact O-N 2.9Å; E91-L95 HydrophobicContact CG-CD1 3.99Å; E91-L95 HydrophobicContact CG-CG 4.42Å; E91-L95 WeakPolarHBondContact O-CB 3.43Å; E91-L95 WeakPolarHBondContact O-CG 3.35Å; E91-L95 PolarHBondContact O-N 3.12Å
92I98.6Very high98.5Very high106 Ų10696.8 Ų96.854%0.54451%0.509SS..Hα-helixtrans-58.6-42.9174.8-72.5165000110.6S88 T96S88-I92 WeakPolarHBondContact O-CB 3.37Å; S88-I92 WeakPolarHBondContact O-CD1 3.45Å; S88-I92 WeakPolarHBondContact O-CG1 3.32Å; S88-I92 PolarHBondContact O-N 3.24Å; I92-T96 VanDerWaalsContact O-CB 3.31Å; I92-T96 WeakPolarHBondContact O-CB 3.45Å; I92-T96 PolarHBondContact O-N 2.89Å; I92-T96 PolarHBondContact O-OG1 2.92Å
93Q98.4Very high98.5Very high115 Ų11595.5 Ų95.554%0.53750%0.498SS..Hα-helixtrans-63-48.9177.7-176.3177.6-11.100111.4S89 T90 E91 L95 T96 E97S89-Q93 WeakPolarHBondContact O-CB 3.35Å; S89-Q93 PolarHBondContact O-N 3.04Å; T90-Q93 PolarHBondContact O-N 3.44Å; E91-Q93 VanDerWaalsContact C-N 3.28Å; E91-Q93 PolarHBondContact O-N 2.93Å; Q93-L95 PolarHBondContact O-N 3.37Å; Q93-T96 WeakPolarHBondContact O-CB 2.98Å; Q93-T96 PolarHBondContact O-N 3.09Å; Q93-E97 WeakPolarHBondContact CG-OE1 3.45Å; Q93-E97 PolarHBondContact NE2-OE1 2.95Å; Q93-E97 VanDerWaalsContact NE2-OE1 3.11Å; Q93-E97 WeakPolarHBondContact O-CG 3.24Å; Q93-E97 PolarHBondContact O-N 3.42Å
94Q98.5Very high98.5Very high115 Ų11596.5 Ų96.554%0.53750%0.5SS..Hα-helixtrans-58.7-48.5177.8-73.3173.63.800111.9T90 E91 T96 E97 E98T90-Q94 WeakPolarHBondContact O-CG 3.36Å; T90-Q94 PolarHBondContact O-N 3.45Å; E91-Q94 PolarHBondContact O-N 2.9Å; Q94-T96 VanDerWaalsContact C-N 3.26Å; Q94-T96 PolarHBondContact O-N 3.43Å; Q94-E97 PolarHBondContact O-N 2.87Å; Q94-E97 VanDerWaalsContact O-N 3.17Å; Q94-E98 WeakPolarHBondContact O-CG 3.46Å; Q94-E98 PolarHBondContact O-N 3.48Å
95L98.5Very high98.5Very high95 Ų9595.6 Ų95.650%0.49750%0.497SS..Hα-helixtrans-63.4-33.5178-70.2174.5000112.3E91 Q93 L99E91-L95 HydrophobicContact CG-CD1 3.99Å; E91-L95 HydrophobicContact CG-CG 4.42Å; E91-L95 WeakPolarHBondContact O-CB 3.43Å; E91-L95 WeakPolarHBondContact O-CG 3.35Å; E91-L95 PolarHBondContact O-N 3.12Å; Q93-L95 PolarHBondContact O-N 3.37Å; L95-L99 WeakPolarHBondContact O-CB 3.37Å; L95-L99 PolarHBondContact O-N 2.99Å
96T98.6Very high98.5Very high74 Ų7496.2 Ų96.245%0.45450%0.501SS..Hα-helixtrans-67.6-42175-58.90000111.1I92 Q93 Q94 L99 E100I92-T96 VanDerWaalsContact O-CB 3.31Å; I92-T96 WeakPolarHBondContact O-CB 3.45Å; I92-T96 PolarHBondContact O-N 2.89Å; I92-T96 PolarHBondContact O-OG1 2.92Å; Q93-T96 WeakPolarHBondContact O-CB 2.98Å; Q93-T96 PolarHBondContact O-N 3.09Å; Q94-T96 VanDerWaalsContact C-N 3.26Å; Q94-T96 PolarHBondContact O-N 3.43Å; T96-L99 PolarHBondContact O-N 2.65Å; T96-E100 PolarHBondContact O-N 3.07Å
97E98.5Very high98.5Very high117 Ų11795.2 Ų95.255%0.54749%0.491SS..Hα-helixtrans-64-44.1175.4-70.6173-165.200111.6Q93 Q94 E100 S101Q93-E97 WeakPolarHBondContact CG-OE1 3.45Å; Q93-E97 PolarHBondContact NE2-OE1 2.95Å; Q93-E97 VanDerWaalsContact NE2-OE1 3.11Å; Q93-E97 WeakPolarHBondContact O-CG 3.24Å; Q93-E97 PolarHBondContact O-N 3.42Å; Q94-E97 PolarHBondContact O-N 2.87Å; Q94-E97 VanDerWaalsContact O-N 3.17Å; E97-E100 PolarHBondContact O-N 3.27Å; E97-S101 WeakPolarHBondContact O-CB 3.37Å; E97-S101 PolarHBondContact O-N 3.27Å
98E98.6Very high98.5Very high121 Ų12190.4 Ų90.457%0.56548%0.475SS*.Hα-helixtrans-62.8-41.3174.5-73-177.2-166.300112.4Q94 S101 T102Q94-E98 WeakPolarHBondContact O-CG 3.46Å; Q94-E98 PolarHBondContact O-N 3.48Å; E98-S101 PolarHBondContact O-N 2.88Å; E98-T102 WeakPolarHBondContact O-CB 3.41Å; E98-T102 WeakPolarHBondContact O-CG2 3.45Å; E98-T102 PolarHBondContact O-N 3.37Å; E98-T102 PolarHBondContact O-OG1 3.28Å
99L98.5Very high98.5Very high89 Ų8990.7 Ų90.747%0.46648%0.48SS..Hα-helixtrans-62.1-43.4176-179.866.2000111.4L95 T96 T102 K103L95-L99 WeakPolarHBondContact O-CB 3.37Å; L95-L99 PolarHBondContact O-N 2.99Å; T96-L99 PolarHBondContact O-N 2.65Å; L99-T102 WeakPolarHBondContact CA-OG1 3.5Å; L99-T102 PolarHBondContact O-OG1 3.41Å; L99-K103 HydrophobicContact CG-CD 4.36Å; L99-K103 WeakPolarHBondContact O-CB 3.46Å; L99-K103 VanDerWaalsContact O-CG 3.23Å; L99-K103 WeakPolarHBondContact O-CG 3.3Å; L99-K103 PolarHBondContact O-N 2.9Å
100E98.6Very high98.5Very high85 Ų8592.1 Ų92.140%0.39748%0.479SS..Hα-helixtrans-70-37.4177.6-73.3-52.8128.200112.4T96 E97 K103 H104 R107T96-E100 PolarHBondContact O-N 3.07Å; E97-E100 PolarHBondContact O-N 3.27Å; E100-K103 PolarHBondContact O-N 3.02Å; E100-K103 WeakPolarHBondContact OE1-CD 3.49Å; E100-K103 IonicContact OE1-NZ 3.18Å; E100-K103 PolarHBondContact OE1-NZ 2.72Å; E100-H104 WeakPolarHBondContact O-CB 3.41Å; E100-H104 PolarHBondContact O-N 3.49Å; E100-R107 IonicContact OE2-NH2 3.8Å
101S98.6Very high98.5Very high79 Ų7995.4 Ų95.455%0.55249%0.49SS*.Hα-helixtrans-61.2-48173-179.80000112E97 E98 H104 S105E97-S101 WeakPolarHBondContact O-CB 3.37Å; E97-S101 PolarHBondContact O-N 3.27Å; E98-S101 PolarHBondContact O-N 2.88Å; S101-H104 WeakPolarHBondContact O-CB 3.31Å; S101-H104 PolarHBondContact O-N 3.45Å; S101-S105 PolarHBondContact O-N 2.93Å
102T98.3Very high98.5Very high84 Ų8494.2 Ų94.252%0.51549%0.49SS..Hα-helixtrans-66-40.7177.647.40000112.2E98 L99 H104 S105 L106E98-T102 WeakPolarHBondContact O-CB 3.41Å; E98-T102 WeakPolarHBondContact O-CG2 3.45Å; E98-T102 PolarHBondContact O-N 3.37Å; E98-T102 PolarHBondContact O-OG1 3.28Å; L99-T102 WeakPolarHBondContact CA-OG1 3.5Å; L99-T102 PolarHBondContact O-OG1 3.41Å; T102-H104 VanDerWaalsContact C-N 3.29Å; T102-H104 PolarHBondContact O-N 3.34Å; T102-S105 PolarHBondContact O-N 3.44Å; T102-L106 WeakPolarHBondContact O-CB 3.33Å; T102-L106 PolarHBondContact O-N 3.45Å
103K98.5Very high98.5Very high86 Ų8694.1 Ų94.137%0.37449%0.49SS..Hα-helixtrans-59.6-39.2171-77173.8-174167.50112L99 E100 L106 R107L99-K103 HydrophobicContact CG-CD 4.36Å; L99-K103 WeakPolarHBondContact O-CB 3.46Å; L99-K103 VanDerWaalsContact O-CG 3.23Å; L99-K103 WeakPolarHBondContact O-CG 3.3Å; L99-K103 PolarHBondContact O-N 2.9Å; E100-K103 PolarHBondContact O-N 3.02Å; E100-K103 WeakPolarHBondContact OE1-CD 3.49Å; E100-K103 IonicContact OE1-NZ 3.18Å; E100-K103 PolarHBondContact OE1-NZ 2.72Å; K103-L106 PolarHBondContact O-N 3.36Å; K103-R107 WeakPolarHBondContact O-CG 3.35Å; K103-R107 PolarHBondContact O-N 3.2Å
104H98.5Very high98.4Very high111 Ų11193.2 Ų93.251%0.51449%0.489SS..Hα-helixtrans-65.3-48.1176.1-179.377.2000111.9E100 S101 T102 L106 R107 T108E100-H104 WeakPolarHBondContact O-CB 3.41Å; E100-H104 PolarHBondContact O-N 3.49Å; S101-H104 WeakPolarHBondContact O-CB 3.31Å; S101-H104 PolarHBondContact O-N 3.45Å; T102-H104 VanDerWaalsContact C-N 3.29Å; T102-H104 PolarHBondContact O-N 3.34Å; H104-L106 VanDerWaalsContact C-N 3.29Å; H104-L106 PolarHBondContact O-N 3.05Å; H104-R107 WeakPolarHBondContact O-CB 3.46Å; H104-R107 PolarHBondContact O-N 3.21Å; H104-R107 VanDerWaalsContact O-N 3.14Å; H104-T108 WeakPolarHBondContact O-CG2 3.32Å; H104-T108 PolarHBondContact O-N 2.98Å; H104-T108 PolarHBondContact O-OG1 2.93Å
105S98.4Very high98.4Very high71 Ų7191 Ų9150%0.49749%0.486SS..Hα-helixtrans-59.4-38.7175.1-170.80000112.6S101 T102 T108 A109S101-S105 PolarHBondContact O-N 2.93Å; T102-S105 PolarHBondContact O-N 3.44Å; S105-T108 WeakPolarHBondContact CA-OG1 3.39Å; S105-T108 PolarHBondContact O-N 3.29Å; S105-T108 PolarHBondContact O-OG1 2.95Å; S105-A109 WeakPolarHBondContact O-CB 3.4Å; S105-A109 PolarHBondContact O-N 2.93Å
106L98.5Very high98.4Very high102 Ų10291.4 Ų91.453%0.53449%0.488SS..Hα-helixtrans-63.2-44.3174.5-179.162.4000111.7T102 K103 H104 A109 Q110T102-L106 WeakPolarHBondContact O-CB 3.33Å; T102-L106 PolarHBondContact O-N 3.45Å; K103-L106 PolarHBondContact O-N 3.36Å; H104-L106 VanDerWaalsContact C-N 3.29Å; H104-L106 PolarHBondContact O-N 3.05Å; L106-A109 PolarHBondContact O-N 3.44Å; L106-Q110 HydrophobicContact CD1-CG 4.48Å; L106-Q110 WeakPolarHBondContact O-CB 3.42Å; L106-Q110 VanDerWaalsContact O-CG 3.27Å; L106-Q110 WeakPolarHBondContact O-CG 3.4Å; L106-Q110 PolarHBondContact O-N 3.47Å
107R98.6Very high98.4Very high110 Ų11090.4 Ų90.442%0.41548%0.482SS..Hα-helixtrans-62-42.2177-76-177.4-115.3108.7-3.9112E100 K103 H104 Q110 Q111E100-R107 IonicContact OE2-NH2 3.8Å; K103-R107 WeakPolarHBondContact O-CG 3.35Å; K103-R107 PolarHBondContact O-N 3.2Å; H104-R107 WeakPolarHBondContact O-CB 3.46Å; H104-R107 PolarHBondContact O-N 3.21Å; H104-R107 VanDerWaalsContact O-N 3.14Å; R107-Q110 PolarHBondContact O-N 2.98Å; R107-Q111 WeakPolarHBondContact O-CG 3.5Å; R107-Q111 PolarHBondContact O-N 3.03Å
108T98.4Very high98.4Very high51 Ų5190.3 Ų90.331%0.31348%0.481SS..Hα-helixtrans-68.4-39.1178.557.70000112H104 S105 Q111 T112H104-T108 WeakPolarHBondContact O-CG2 3.32Å; H104-T108 PolarHBondContact O-N 2.98Å; H104-T108 PolarHBondContact O-OG1 2.93Å; S105-T108 WeakPolarHBondContact CA-OG1 3.39Å; S105-T108 PolarHBondContact O-N 3.29Å; S105-T108 PolarHBondContact O-OG1 2.95Å; T108-Q111 PolarHBondContact O-N 2.94Å; T108-T112 PolarHBondContact O-N 3.19Å; T108-T112 PolarHBondContact O-OG1 3.18Å
109A98.1Very high98.4Very high55 Ų5589.3 Ų89.346%0.45548%0.476SS..Hα-helixtrans-62.1-43.1172.700000112S105 L106 T112 L113S105-A109 WeakPolarHBondContact O-CB 3.4Å; S105-A109 PolarHBondContact O-N 2.93Å; L106-A109 PolarHBondContact O-N 3.44Å; A109-T112 PolarHBondContact O-N 3.4Å; A109-L113 WeakPolarHBondContact O-CB 3.3Å; A109-L113 PolarHBondContact O-N 3.16Å
110Q98.5Very high98.3Very high100 Ų10090.8 Ų90.847%0.46748%0.476SS..Hα-helixtrans-62.1-42.8175.2-75.2173.5-28.800112.3L106 R107 T112 L113 N114L106-Q110 HydrophobicContact CD1-CG 4.48Å; L106-Q110 WeakPolarHBondContact O-CB 3.42Å; L106-Q110 VanDerWaalsContact O-CG 3.27Å; L106-Q110 WeakPolarHBondContact O-CG 3.4Å; L106-Q110 PolarHBondContact O-N 3.47Å; R107-Q110 PolarHBondContact O-N 2.98Å; Q110-T112 VanDerWaalsContact C-N 3.33Å; Q110-T112 PolarHBondContact O-N 3.34Å; Q110-L113 PolarHBondContact O-N 3.13Å; Q110-N114 VanDerWaalsContact O-CG 3.25Å; Q110-N114 PolarHBondContact O-N 2.92Å; Q110-N114 PolarHBondContact O-ND2 3.41Å
111Q98.4Very high98.3Very high132 Ų13289.6 Ų89.662%0.61747%0.472SS*.Hα-helixtrans-61.6-42.3175-74.5172-17.600112R107 T108 N114 S115R107-Q111 WeakPolarHBondContact O-CG 3.5Å; R107-Q111 PolarHBondContact O-N 3.03Å; T108-Q111 PolarHBondContact O-N 2.94Å; Q111-N114 PolarHBondContact O-N 3.44Å; Q111-S115 PolarHBondContact O-N 2.85Å
112T98.5Very high98.3Very high81 Ų8190.9 Ų90.950%0.49747%0.465SS..Hα-helixtrans-65.3-43.3177.9-55.70000111T108 A109 Q110 N114 S115 I116T108-T112 PolarHBondContact O-N 3.19Å; T108-T112 PolarHBondContact O-OG1 3.18Å; A109-T112 PolarHBondContact O-N 3.4Å; Q110-T112 VanDerWaalsContact C-N 3.33Å; Q110-T112 PolarHBondContact O-N 3.34Å; T112-N114 PolarHBondContact O-N 3.42Å; T112-S115 PolarHBondContact O-N 3.32Å; T112-I116 HydrophobicContact CG2-CD1 4.01Å; T112-I116 WeakPolarHBondContact O-CG1 3.35Å; T112-I116 PolarHBondContact O-N 2.88Å
113L98.2Very high98.2Very high104 Ų10490 Ų9055%0.54546%0.461SS..Hα-helixtrans-58.9-47.2175.5178.263000111.4A109 Q110 S115 I116 V117A109-L113 WeakPolarHBondContact O-CB 3.3Å; A109-L113 PolarHBondContact O-N 3.16Å; Q110-L113 PolarHBondContact O-N 3.13Å; L113-S115 VanDerWaalsContact C-N 3.35Å; L113-S115 PolarHBondContact O-N 3.03Å; L113-I116 PolarHBondContact O-N 3.36Å; L113-V117 HydrophobicContact CD1-CG2 4.26Å; L113-V117 HydrophobicContact CG-CG2 4.48Å; L113-V117 VanDerWaalsContact O-CG2 3.3Å; L113-V117 WeakPolarHBondContact O-CG2 3.31Å; L113-V117 PolarHBondContact O-N 3.33Å
114N98.2Very high98.2Very high95 Ų9590.7 Ų90.751%0.50846%0.464SS..Hα-helixtrans-60.4-45178.4-69-13.5000111.4Q110 Q111 T112 I116 V117 E118Q110-N114 VanDerWaalsContact O-CG 3.25Å; Q110-N114 PolarHBondContact O-N 2.92Å; Q110-N114 PolarHBondContact O-ND2 3.41Å; Q111-N114 PolarHBondContact O-N 3.44Å; T112-N114 PolarHBondContact O-N 3.42Å; N114-I116 PolarHBondContact O-N 3.46Å; N114-V117 PolarHBondContact O-N 2.92Å; N114-E118 WeakPolarHBondContact O-CG 3.37Å; N114-E118 PolarHBondContact O-N 3.39Å
115S98.3Very high98.2Very high68 Ų6891.4 Ų91.448%0.47647%0.468SS..Hα-helixtrans-59.1-43.5176.1-179.80000112.6Q111 T112 L113 E118 E119Q111-S115 PolarHBondContact O-N 2.85Å; T112-S115 PolarHBondContact O-N 3.32Å; L113-S115 VanDerWaalsContact C-N 3.35Å; L113-S115 PolarHBondContact O-N 3.03Å; S115-E118 PolarHBondContact O-N 2.6Å; S115-E119 PolarHBondContact O-N 3.04Å
116I98.2Very high98.1Very high104 Ų10493.2 Ų93.253%0.53347%0.472SS..Hα-helixtrans-65.1-40.5176.1-68.5168.6000111.2T112 L113 N114 E119 R120T112-I116 HydrophobicContact CG2-CD1 4.01Å; T112-I116 WeakPolarHBondContact O-CG1 3.35Å; T112-I116 PolarHBondContact O-N 2.88Å; L113-I116 PolarHBondContact O-N 3.36Å; N114-I116 PolarHBondContact O-N 3.46Å; I116-E119 PolarHBondContact O-N 2.8Å; I116-R120 WeakPolarHBondContact O-CB 3.49Å; I116-R120 PolarHBondContact O-N 3.4Å
117V98.2Very high98.1Very high54 Ų5491.7 Ų91.733%0.32747%0.469SS..Hα-helixtrans-63.9-44.2177.8169.50000110.8L113 N114 R120 D121L113-V117 HydrophobicContact CD1-CG2 4.26Å; L113-V117 HydrophobicContact CG-CG2 4.48Å; L113-V117 VanDerWaalsContact O-CG2 3.3Å; L113-V117 WeakPolarHBondContact O-CG2 3.31Å; L113-V117 PolarHBondContact O-N 3.33Å; N114-V117 PolarHBondContact O-N 2.92Å; V117-R120 WeakPolarHBondContact O-CB 3.46Å; V117-R120 PolarHBondContact O-N 2.74Å; V117-D121 WeakPolarHBondContact O-CB 3.39Å; V117-D121 VanDerWaalsContact O-CG 3.28Å; V117-D121 PolarHBondContact O-N 2.98Å
118E98Very high98Very high114 Ų11490.9 Ų90.953%0.53347%0.472SS..Hα-helixtrans-61.5-42.9175.7-71.5173.2-167.100112.2N114 S115 D121 R122N114-E118 WeakPolarHBondContact O-CG 3.37Å; N114-E118 PolarHBondContact O-N 3.39Å; S115-E118 PolarHBondContact O-N 2.6Å; E118-D121 PolarHBondContact O-N 3.39Å; E118-R122 PolarHBondContact O-N 2.91Å; E118-R122 PolarHBondContact O-NH1 3.42Å
119E98Very high97.8Very high100 Ų10091.3 Ų91.347%0.46748%0.477SS..Hα-helixtrans-65.8-41.1175.1-177.159.1-139.700112S115 I116 D121 R122 C123S115-E119 PolarHBondContact O-N 3.04Å; I116-E119 PolarHBondContact O-N 2.8Å; E119-D121 VanDerWaalsContact C-N 3.29Å; E119-D121 PolarHBondContact O-N 3.46Å; E119-R122 PolarHBondContact O-N 3.18Å; E119-R122 IonicContact OE2-CZ 3.26Å; E119-R122 VanDerWaalsContact OE2-CZ 3.26Å; E119-R122 IonicContact OE2-NE 3.17Å; E119-R122 PolarHBondContact OE2-NE 2.92Å; E119-R122 VanDerWaalsContact OE2-NE 3.17Å; E119-R122 IonicContact OE2-NH2 2.6Å; E119-R122 PolarHBondContact OE2-NH2 3.33Å; E119-C123 WeakPolarHBondContact O-CB 3.4Å; E119-C123 PolarHBondContact O-N 2.86Å
120R97.7Very high97.7Very high120 Ų12091 Ų9145%0.45348%0.475SS..Hα-helixtrans-60.3-42.3175.4-173.3-76.6-53-110.94.6110.8I116 V117 K124I116-R120 WeakPolarHBondContact O-CB 3.49Å; I116-R120 PolarHBondContact O-N 3.4Å; V117-R120 WeakPolarHBondContact O-CB 3.46Å; V117-R120 PolarHBondContact O-N 2.74Å; R120-K124 VanDerWaalsContact CZ-NZ 3.31Å; R120-K124 VanDerWaalsContact NH1-NZ 3.11Å; R120-K124 WeakPolarHBondContact O-CG 3.41Å; R120-K124 PolarHBondContact O-N 2.91Å
121D98Very high97.5Very high61 Ų6189.9 Ų89.933%0.32647%0.474SS..Hα-helixtrans-69.6-41.3179-68.9-18.4000111.6V117 E118 E119 K124 E125V117-D121 WeakPolarHBondContact O-CB 3.39Å; V117-D121 VanDerWaalsContact O-CG 3.28Å; V117-D121 PolarHBondContact O-N 2.98Å; E118-D121 PolarHBondContact O-N 3.39Å; E119-D121 VanDerWaalsContact C-N 3.29Å; E119-D121 PolarHBondContact O-N 3.46Å; D121-K124 WeakPolarHBondContact O-CB 3.3Å; D121-K124 PolarHBondContact O-N 2.97Å; D121-E125 WeakPolarHBondContact O-CG 3.43Å; D121-E125 PolarHBondContact O-N 3.24Å
122R97.9Very high97.3Very high106 Ų10689.2 Ų89.240%0.447%0.469SS..Hα-helixtrans-57-49.6169.4-77.5-171.5-63.8-84.27.6112.7E118 E119 K124 E125 D126E118-R122 PolarHBondContact O-N 2.91Å; E118-R122 PolarHBondContact O-NH1 3.42Å; E119-R122 PolarHBondContact O-N 3.18Å; E119-R122 IonicContact OE2-CZ 3.26Å; E119-R122 VanDerWaalsContact OE2-CZ 3.26Å; E119-R122 IonicContact OE2-NE 3.17Å; E119-R122 PolarHBondContact OE2-NE 2.92Å; E119-R122 VanDerWaalsContact OE2-NE 3.17Å; E119-R122 IonicContact OE2-NH2 2.6Å; E119-R122 PolarHBondContact OE2-NH2 3.33Å; R122-K124 PolarHBondContact O-N 2.93Å; R122-E125 WeakPolarHBondContact O-CA 3.49Å; R122-E125 WeakPolarHBondContact O-CB 3.42Å; R122-E125 PolarHBondContact O-N 2.96Å; R122-D126 PolarHBondContact O-N 3.12Å
123C97.7Very high96.9Very high64 Ų6489.7 Ų89.743%0.43247%0.469SS..Hα-helixtrans-61.2-35179.5179.50000111.9E119 D126 C127E119-C123 WeakPolarHBondContact O-CB 3.4Å; E119-C123 PolarHBondContact O-N 2.86Å; C123-D126 PolarHBondContact O-N 2.88Å; C123-C127 WeakPolarHBondContact O-CB 3.27Å; C123-C127 PolarHBondContact O-N 3.37Å; C123-C127 PolarHBondContact O-SG 3.03Å
124K98Very high96.5Very high102 Ų10289 Ų8944%0.44347%0.465SS..Hα-helixtrans-64-44.5171.2-79.4175.1171.2176.10111.9R120 D121 R122 D126 C127 I128R120-K124 VanDerWaalsContact CZ-NZ 3.31Å; R120-K124 VanDerWaalsContact NH1-NZ 3.11Å; R120-K124 WeakPolarHBondContact O-CG 3.41Å; R120-K124 PolarHBondContact O-N 2.91Å; D121-K124 WeakPolarHBondContact O-CB 3.3Å; D121-K124 PolarHBondContact O-N 2.97Å; R122-K124 PolarHBondContact O-N 2.93Å; K124-D126 VanDerWaalsContact C-N 3.34Å; K124-C127 PolarHBondContact O-N 2.81Å; K124-I128 WeakPolarHBondContact O-CB 3.34Å; K124-I128 WeakPolarHBondContact O-CD1 3.5Å; K124-I128 WeakPolarHBondContact O-CG1 3.41Å; K124-I128 PolarHBondContact O-N 3.29Å
125E97.8Very high96.1Very high126 Ų12691.3 Ų91.359%0.58947%0.472SS*.Hα-helixtrans-61.6-42.2176.8-70.4175.7-175.400111.8D121 R122 I128 S129D121-E125 WeakPolarHBondContact O-CG 3.43Å; D121-E125 PolarHBondContact O-N 3.24Å; R122-E125 WeakPolarHBondContact O-CA 3.49Å; R122-E125 WeakPolarHBondContact O-CB 3.42Å; R122-E125 PolarHBondContact O-N 2.96Å; E125-I128 PolarHBondContact O-N 3.47Å; E125-S129 WeakPolarHBondContact O-CB 3.31Å; E125-S129 PolarHBondContact O-N 3.03Å; E125-S129 PolarHBondContact O-OG 2.86Å
126D97.6Very high95.6Very high108 Ų10894.6 Ų94.658%0.57848%0.48SS*.Hα-helixtrans-62.6-46.8174.9-71.6-20.8000111.5R122 C123 K124 I128 S129 A130R122-D126 PolarHBondContact O-N 3.12Å; C123-D126 PolarHBondContact O-N 2.88Å; K124-D126 VanDerWaalsContact C-N 3.34Å; D126-I128 PolarHBondContact O-N 3.4Å; D126-S129 PolarHBondContact O-N 3.01Å; D126-A130 WeakPolarHBondContact O-CB 3.48Å; D126-A130 PolarHBondContact O-N 3.42Å
127C97Very high94.9Very high71 Ų7193 Ų9348%0.4847%0.473SS..Hα-helixtrans-58.7-45.8175.3-72.70000111.8C123 K124 S129 A130 V131C123-C127 WeakPolarHBondContact O-CB 3.27Å; C123-C127 PolarHBondContact O-N 3.37Å; C123-C127 PolarHBondContact O-SG 3.03Å; K124-C127 PolarHBondContact O-N 2.81Å; C127-S129 VanDerWaalsContact C-N 3.3Å; C127-S129 PolarHBondContact O-N 3.44Å; C127-A130 PolarHBondContact O-N 3.23Å; C127-V131 VanDerWaalsContact O-CG2 3.29Å; C127-V131 WeakPolarHBondContact O-CG2 3.35Å; C127-V131 PolarHBondContact O-N 2.91Å
128I96.3Very high94Very high93 Ų9393.3 Ų93.348%0.47748%0.476SS..Hα-helixtrans-61.8-42.1177.8-70.6163.7000110.3K124 E125 D126 V131 K132K124-I128 WeakPolarHBondContact O-CB 3.34Å; K124-I128 WeakPolarHBondContact O-CD1 3.5Å; K124-I128 WeakPolarHBondContact O-CG1 3.41Å; K124-I128 PolarHBondContact O-N 3.29Å; E125-I128 PolarHBondContact O-N 3.47Å; D126-I128 PolarHBondContact O-N 3.4Å; I128-V131 PolarHBondContact O-N 3.44Å; I128-K132 HydrophobicContact CG2-CD 4.42Å; I128-K132 WeakPolarHBondContact O-CG 3.25Å; I128-K132 PolarHBondContact O-N 3.42Å
129S95.8Very high92.8Very high60 Ų6094 Ų9442%0.4248%0.484SS..Hα-helixtrans-64.8-43.6178.3-59.50000111.8E125 D126 C127 K132 L133E125-S129 WeakPolarHBondContact O-CB 3.31Å; E125-S129 PolarHBondContact O-N 3.03Å; E125-S129 PolarHBondContact O-OG 2.86Å; D126-S129 PolarHBondContact O-N 3.01Å; C127-S129 VanDerWaalsContact C-N 3.3Å; C127-S129 PolarHBondContact O-N 3.44Å; S129-K132 PolarHBondContact O-N 2.98Å; S129-L133 WeakPolarHBondContact O-CG 3.25Å; S129-L133 PolarHBondContact O-N 3.19Å
130A95Very high91.7Very high49 Ų4995.9 Ų95.941%0.40549%0.492SS..Hα-helixtrans-61.3-44.3174.500000111.9D126 C127 K132 L133 L134D126-A130 WeakPolarHBondContact O-CB 3.48Å; D126-A130 PolarHBondContact O-N 3.42Å; C127-A130 PolarHBondContact O-N 3.23Å; A130-K132 VanDerWaalsContact C-N 3.34Å; A130-K132 PolarHBondContact O-N 3.46Å; A130-L133 PolarHBondContact O-N 3.45Å; A130-L134 VanDerWaalsContact O-CG 3.28Å; A130-L134 WeakPolarHBondContact O-CG 3.48Å; A130-L134 PolarHBondContact O-N 2.95Å
131V94.4Very high90.2Very high75 Ų7595.1 Ų95.146%0.45549%0.493SS..Hα-helixtrans-60.4-42.6175.9170.10000111.3C127 I128 L134 Q135C127-V131 VanDerWaalsContact O-CG2 3.29Å; C127-V131 WeakPolarHBondContact O-CG2 3.35Å; C127-V131 PolarHBondContact O-N 2.91Å; I128-V131 PolarHBondContact O-N 3.44Å; V131-L134 PolarHBondContact O-N 2.92Å; V131-Q135 HydrophobicContact CG1-CG 4.49Å; V131-Q135 VanDerWaalsContact O-CG 3.28Å; V131-Q135 WeakPolarHBondContact O-CG 3.41Å; V131-Q135 PolarHBondContact O-N 3.28Å
132K93.7Very high88.6Confident118 Ų11897.8 Ų97.851%0.51351%0.506SS..Hα-helixtrans-61.3-47.3176-74175-178.5176.60112.1I128 S129 A130 L134 Q135 E136I128-K132 HydrophobicContact CG2-CD 4.42Å; I128-K132 WeakPolarHBondContact O-CG 3.25Å; I128-K132 PolarHBondContact O-N 3.42Å; S129-K132 PolarHBondContact O-N 2.98Å; A130-K132 VanDerWaalsContact C-N 3.34Å; A130-K132 PolarHBondContact O-N 3.46Å; K132-L134 VanDerWaalsContact C-N 3.32Å; K132-L134 PolarHBondContact O-N 2.88Å; K132-Q135 WeakPolarHBondContact O-CB 3.46Å; K132-Q135 PolarHBondContact O-N 3.42Å; K132-Q135 VanDerWaalsContact O-N 3.11Å; K132-E136 WeakPolarHBondContact O-CG 3.39Å; K132-E136 PolarHBondContact O-N 3.22Å
133L91.8Very high86.8Confident92 Ų9297.8 Ų97.848%0.48252%0.522SS..Hα-helixtrans-60-42.4178-72172.6000112.2S129 A130 Q135 E136 N137S129-L133 WeakPolarHBondContact O-CG 3.25Å; S129-L133 PolarHBondContact O-N 3.19Å; A130-L133 PolarHBondContact O-N 3.45Å; L133-Q135 VanDerWaalsContact C-N 3.3Å; L133-Q135 PolarHBondContact O-N 2.98Å; L133-E136 PolarHBondContact O-N 2.93Å; L133-N137 PolarHBondContact O-N 3.48Å; L133-N137 VanDerWaalsContact O-N 3.16Å
134L89.5Confident84.9Confident88 Ų88103.2 Ų103.246%0.46154%0.541SS..Hα-helixtrans-62.3-37.1175.5-71.4171.4000112.1A130 V131 K132 F141A130-L134 VanDerWaalsContact O-CG 3.28Å; A130-L134 WeakPolarHBondContact O-CG 3.48Å; A130-L134 PolarHBondContact O-N 2.95Å; V131-L134 PolarHBondContact O-N 2.92Å; K132-L134 VanDerWaalsContact C-N 3.32Å; K132-L134 PolarHBondContact O-N 2.88Å; L134-F141 HydrophobicContact CD2-CB 3.74Å; L134-F141 HydrophobicContact CD2-CD1 4.15Å; L134-F141 HydrophobicContact CD2-CD2 3.68Å; L134-F141 HydrophobicContact CD2-CE2 4.29Å; L134-F141 HydrophobicContact CD2-CG 3.58Å
135Q89.4Confident83Confident144 Ų144104.3 Ų104.367%0.67355%0.551SS**Hα-helixtrans-73-37.3177.6-73.5174.7-3.700112.9V131 K132 L133V131-Q135 HydrophobicContact CG1-CG 4.49Å; V131-Q135 VanDerWaalsContact O-CG 3.28Å; V131-Q135 WeakPolarHBondContact O-CG 3.41Å; V131-Q135 PolarHBondContact O-N 3.28Å; K132-Q135 WeakPolarHBondContact O-CB 3.46Å; K132-Q135 PolarHBondContact O-N 3.42Å; K132-Q135 VanDerWaalsContact O-N 3.11Å; L133-Q135 VanDerWaalsContact C-N 3.3Å; L133-Q135 PolarHBondContact O-N 2.98Å
136E88Confident81.2Confident137 Ų137102.8 Ų102.864%0.6455%0.552SS**Hα-helixtrans-71.6-32.9-179.9-72.4-179.9170.600112.8K132 L133K132-E136 WeakPolarHBondContact O-CG 3.39Å; K132-E136 PolarHBondContact O-N 3.22Å; L133-E136 PolarHBondContact O-N 2.93Å
137N82.5Confident79.1Confident70 Ų70103.9 Ų103.937%0.37457%0.565SS.*  trans-132.862.4-175.5-61-77000113.1L133 N139 Q140 F141L133-N137 PolarHBondContact O-N 3.48Å; L133-N137 VanDerWaalsContact O-N 3.16Å; N137-N139 VanDerWaalsContact C-N 3.31Å; N137-N139 PolarHBondContact O-N 3.35Å; N137-Q140 HydrophobicContact CB-CB 4.11Å; N137-Q140 PolarHBondContact O-N 2.86Å; N137-Q140 VanDerWaalsContact O-N 3.13Å; N137-F141 HydrophobicContact CB-CE2 4.24Å; N137-F141 VanDerWaalsContact O-CD2 3.31Å; N137-F141 WeakPolarHBondContact O-CD2 3.38Å
138P79.2Confident77.1Confident62 Ų62106.9 Ų106.940%0.40358%0.575SS.*Hα-helixtrans-59.1-40.9-17222.9-33.6000112.7Q140 F141 I142P138-Q140 PolarHBondContact O-N 3.47Å; P138-F141 PolarHBondContact O-N 3.46Å; P138-I142 HydrophobicContact CB-CD1 4.31Å; P138-I142 WeakPolarHBondContact O-CD1 3.35Å; P138-I142 WeakPolarHBondContact O-CG1 3.46Å; P138-I142 PolarHBondContact O-N 2.86Å
139N74.1Confident75.1Confident129 Ų129111.2 Ų111.269%0.6959%0.593SS**Hα-helixtrans-67-26.9-176.2-60.1-26.3000112.9N137 S143N137-N139 VanDerWaalsContact C-N 3.31Å; N137-N139 PolarHBondContact O-N 3.35Å; N139-S143 PolarHBondContact O-OG 2.91Å
140Q73.8Confident73Confident138 Ų138113.2 Ų113.265%0.64561%0.607SS**Hα-helixtrans-75.6-28.4-174.7-158.415929.800112.3N137 P138N137-Q140 HydrophobicContact CB-CB 4.11Å; N137-Q140 PolarHBondContact O-N 2.86Å; N137-Q140 VanDerWaalsContact O-N 3.13Å; P138-Q140 PolarHBondContact O-N 3.47Å
141F67.3Low71.3Confident105 Ų105115.9 Ų115.946%0.46162%0.62SS.*Hα-helixtrans-97.4-15.8179.6-60.4-75.9000113.6L134 N137 P138L134-F141 HydrophobicContact CD2-CB 3.74Å; L134-F141 HydrophobicContact CD2-CD1 4.15Å; L134-F141 HydrophobicContact CD2-CD2 3.68Å; L134-F141 HydrophobicContact CD2-CE2 4.29Å; L134-F141 HydrophobicContact CD2-CG 3.58Å; N137-F141 HydrophobicContact CB-CE2 4.24Å; N137-F141 VanDerWaalsContact O-CD2 3.31Å; N137-F141 WeakPolarHBondContact O-CD2 3.38Å; P138-F141 PolarHBondContact O-N 3.46Å
142I64.3Low69.5Low117 Ų117117.2 Ų117.260%0.663%0.631SS**Hα-helixtrans-79.4-26.8178.3-66.6164.7000111.7P138 E144P138-I142 HydrophobicContact CB-CD1 4.31Å; P138-I142 WeakPolarHBondContact O-CD1 3.35Å; P138-I142 WeakPolarHBondContact O-CG1 3.46Å; P138-I142 PolarHBondContact O-N 2.86Å; I142-E144 VanDerWaalsContact C-N 3.32Å; I142-E144 PolarHBondContact O-N 3.36Å
143S59.4Low67.7Low106 Ų106116.8 Ų116.874%0.74164%0.64SS**THydrogen-bonded Turntrans-73.9-13.9-174.7-64.60000115.6N139N139-S143 PolarHBondContact O-OG 2.91Å
144E57.7Low65.9Low178 Ų178119.4 Ų119.483%0.83265%0.654SS**THydrogen-bonded Turntrans-102.33.3179.9-80.8-173.7168.500114.3I142 P146I142-E144 VanDerWaalsContact C-N 3.32Å; I142-E144 PolarHBondContact O-N 3.36Å; E144-P146 WeakPolarHBondContact O-CD 3.36Å
145L59.1Low64.1Low124 Ų124123.5 Ų123.565%0.64967%0.668SS**  trans-74.9115.3-179.1-153.175.4000110.5I148L145-I148 HydrophobicContact CD2-CD1 4.09Å
146P59.5Low62.3Low95 Ų95123.8 Ų123.862%0.61767%0.673SS**  trans-63.6151.2173.725.4-31.2000110.2E144 I148E144-P146 WeakPolarHBondContact O-CD 3.36Å; P146-I148 PolarHBondContact O-N 3.47Å
147P54.2Low60.5Low130 Ų130125.1 Ų125.184%0.84468%0.679SS**  trans-55.9117.2178.7-18.929.6000109.8E149P147-E149 PolarHBondContact O-N 2.99Å
148I55Low59Low134 Ų134127.9 Ų127.969%0.68769%0.692SS**  trans-66.6101.2174.9-67.1167.4000107.3L145 P146 S150L145-I148 HydrophobicContact CD2-CD1 4.09Å; P146-I148 PolarHBondContact O-N 3.47Å; I148-S150 PolarHBondContact O-N 3.21Å
149E53.6Low57.5Low184 Ų184132.2 Ų132.286%0.8671%0.711SS**PPolyproline II helixtrans-64.8120.1161.4-159170.1-164.700107.2P147P147-E149 PolarHBondContact O-N 2.99Å
150S51.5Low56.1Low103 Ų103131.3 Ų131.372%0.7271%0.71SS**PPolyproline II helixtrans-51123.6-172.753.70000113.4I148I148-S150 PolarHBondContact O-N 3.21Å
151P59.9Low54.7Low105 Ų105131.6 Ų131.668%0.68272%0.717SS**PPolyproline II helixtrans-78.7143.3164.330.4-29.8000110.4
152P55.5Low53.9Low103 Ų103134.3 Ų134.367%0.66974%0.735SS**PPolyproline II helixtrans-66.6151.7-174.126.5-33.9000112.9D154P152-D154 VanDerWaalsContact C-N 3.26Å; P152-D154 PolarHBondContact O-N 3.39Å
153P55.9Low52.8Low109 Ų109133.5 Ų133.571%0.70874%0.739SS**SBendtrans-8257.1-169.737.1-37.3000112.3
154D54.7Low51.9Low146 Ų146135.8 Ų135.878%0.78174%0.743SS**SBendtrans-13110-177.3-76.2-31.7000115.1P152P152-D154 VanDerWaalsContact C-N 3.26Å; P152-D154 PolarHBondContact O-N 3.39Å
155K51.4Low51.1Low174 Ų174131.2 Ų131.276%0.75774%0.744SS**  trans-132.626.7-177.3-73.7-174.3179.2178.70116.2H157K155-H157 PolarHBondContact O-N 2.85Å
156I53Low50Low151 Ų151132.4 Ų132.477%0.77475%0.751SS**THydrogen-bonded Turntrans-76.91.4-177.7-61.7176.9000113.5
157H49Very low49.1Very low164 Ų164134.5 Ų134.576%0.75977%0.767SS**THydrogen-bonded Turntrans-101.34.3-174.4-82.8-69.4000117.7K155K155-H157 PolarHBondContact O-N 2.85Å
158I51.9Low48.5Very low129 Ų129132.5 Ų132.566%0.66276%0.756SS**SBendtrans-97.1-12.8-168-52.6-178.1000114.1
159L47.5Very low48Very low153 Ų153135 Ų13580%0.80176%0.764SS**SBendtrans-97.63.8-173.5-75.6164.8000116.1
160T44.6Very low47.1Very low109 Ų109129.5 Ų129.567%0.66976%0.756SS**SBendtrans-93.42.9-177.9300000115.9
161N43.4Very low46.6Very low145 Ų145128.6 Ų128.678%0.77576%0.755SS**  trans-10415.1-172.2-72.9-15.4000115.9
162L50.7Low45.7Very low161 Ų161131.5 Ų131.584%0.84376%0.759SS**SBendtrans-92.48.6-177.4-70161.7000114.6
163S41.8Very low45.1Very low100 Ų100134.4 Ų134.470%0.69977%0.769SS**SBendtrans-107.54-166.2-167.60000117
164N39.3Very low44.6Very low154 Ų154133.7 Ų133.782%0.82477%0.767SS**  trans-130.871.1-172.1-65.635.4000111.9
165G40.9Very low44.1Very low82 Ų82132.6 Ų132.685%0.84577%0.767SS**  trans-95.585.216700000110.3
166D36.5Very low43.6Very low150 Ų150133.5 Ų133.580%0.80277%0.772SS**  trans-110.696.9176.2-147.4-2.3000108.3
167C41.7Very low42.9Very low139 Ų139131.8 Ų131.894%0.93977%0.773SS**  trans-116.467.9175.9-70.40000109.1
168S41.6Very low42.5Very low88 Ų88129.3 Ų129.362%0.61577%0.774SS**  trans-111.7109.1164.7170.20000107.6
169H44Very low42.1Very low187 Ų187128 Ų12887%0.86678%0.777SS**  trans-171.198140.1-97.2-56.1000109.7
170G34.3Very low41.9Very low67 Ų67124.5 Ų124.569%0.69177%0.77SS**  trans-69.3121.9164.200000110.9H172G170-H172 PolarHBondContact O-N 3.36Å; G170-H172 PolarHBondContact O-ND1 2.91Å
171A40.5Very low41.9Very low84 Ų84123.5 Ų123.569%0.69477%0.767SS**  trans-94.886.2163.700000109N173A171-N173 PolarHBondContact O-N 3.18Å
172H41.1Very low42.2Very low167 Ų167123.4 Ų123.477%0.77377%0.765SS**  trans-17.7108.4146.148.1-80.9000114.7G170G170-H172 PolarHBondContact O-N 3.36Å; G170-H172 PolarHBondContact O-ND1 2.91Å
173N43.1Very low42.1Very low164 Ų164124 Ų12488%0.87776%0.761SS**PPolyproline II helixtrans-89.5117.9155-77.6-32.2000108A171A171-N173 PolarHBondContact O-N 3.18Å
174S44.8Very low42.3Very low93 Ų93124 Ų12465%0.6576%0.761SS**PPolyproline II helixtrans-63140.4178.247.10000111.7F176S174-F176 PolarHBondContact O-N 2.76Å
175P45.1Very low43.1Very low123 Ų123122 Ų12280%0.79976%0.755SS**PPolyproline II helixtrans-75.5116.2166.428.3-27.4000108.5S177P175-S177 PolarHBondContact O-N 3.11Å
176F40.1Very low43.6Very low194 Ų194125.9 Ų125.985%0.85175%0.749SS**  trans-55112.2165.3-96.7-93000109S174 S178S174-F176 PolarHBondContact O-N 2.76Å; F176-S178 PolarHBondContact O-N 3.42Å; F176-S178 VanDerWaalsContact O-N 3.15Å
177S38Very low44.5Very low115 Ų115123.3 Ų123.380%0.80473%0.734SS**  trans-75.892.7171.1-169.20000108.4P175 S179P175-S177 PolarHBondContact O-N 3.11Å; S177-S179 PolarHBondContact O-N 2.94Å; S177-S179 VanDerWaalsContact O-N 3.15Å
178S41.1Very low45.5Very low111 Ų111122.5 Ų122.578%0.77673%0.728SS**  trans-75.594.4168.6-66.80000109F176 A180F176-S178 PolarHBondContact O-N 3.42Å; F176-S178 VanDerWaalsContact O-N 3.15Å; S178-A180 PolarHBondContact O-N 2.93Å; S178-A180 VanDerWaalsContact O-N 3.09Å
179S44.1Very low46.5Very low103 Ų103121.4 Ų121.472%0.7272%0.717SS**  trans-68.2103.2162.353.30000108.5S177 S181S177-S179 PolarHBondContact O-N 2.94Å; S177-S179 VanDerWaalsContact O-N 3.15Å; S179-S181 PolarHBondContact O-N 3.13Å
180A42.3Very low46.9Very low79 Ų79122.2 Ų122.265%0.65372%0.718SS**  trans-66.394.7172.700000109.4S178 I182S178-A180 PolarHBondContact O-N 2.93Å; S178-A180 VanDerWaalsContact O-N 3.09Å; A180-I182 PolarHBondContact O-N 3.28Å
181S45.9Very low48.3Very low88 Ų88123.6 Ų123.662%0.61572%0.715SS**  trans-76.9101.5163.5-67.60000108S179 F183S179-S181 PolarHBondContact O-N 3.13Å; S181-F183 PolarHBondContact O-N 3.4Å
182I48.6Very low49.3Very low143 Ų143123.8 Ų123.873%0.73371%0.709SS**  trans-68.197.4177.4-53.3166.1000107.7A180 S184A180-I182 PolarHBondContact O-N 3.28Å; I182-S184 PolarHBondContact O-N 3.41Å
183F48.4Very low50.3Low173 Ų173120.3 Ų120.376%0.75970%0.7SS**  trans-86.6103.7167.9-78-79.5000109.1S181 T185S181-F183 PolarHBondContact O-N 3.4Å; F183-T185 PolarHBondContact O-N 3.48Å; F183-T185 VanDerWaalsContact O-N 3.14Å
184S47.6Very low51.1Low99 Ų99114.8 Ų114.869%0.69268%0.681SS**  trans-71.195.3168.31690000109.3I182I182-S184 PolarHBondContact O-N 3.41Å
185T55.6Low51.8Low113 Ų113116.3 Ų116.369%0.69368%0.682SS**  trans-106.5114.616948.60000109.9F183 L187F183-T185 PolarHBondContact O-N 3.48Å; F183-T185 VanDerWaalsContact O-N 3.14Å; T185-L187 PolarHBondContact O-N 3.02Å
186F51.1Low52.1Low163 Ų163120.5 Ų120.572%0.71569%0.688SS**  trans-65.7117.9162.1-75.3-83.6000107.9
187L55.6Low52.4Low96 Ų96116.6 Ų116.650%0.50368%0.68SS.*  trans-67.6134.4170.1-78.1150000108.7T185 T189 L195T185-L187 PolarHBondContact O-N 3.02Å; L187-T189 HydrophobicContact CB-CG2 4.28Å; L187-T189 PolarHBondContact O-N 2.98Å; L187-L195 HydrophobicContact CD1-CD1 4Å
188P61.9Low52.6Low123 Ų123114.2 Ų114.280%0.79967%0.673SS**  trans-76.865.7174.333.5-34.2000109.7
189T64.1Low52.9Low64 Ų64116.6 Ų116.639%0.39368%0.676SS.*  trans-103150.2166.462.10000109.1L187 P191 P192L187-T189 HydrophobicContact CB-CG2 4.28Å; L187-T189 PolarHBondContact O-N 2.98Å; T189-P191 CarbonylContact O-C 3.33Å; T189-P191 PolarHBondContact OG1-O 3.41Å; T189-P192 WeakPolarHBondContact O-CA 3.47Å
190F51.4Low52.5Low204 Ų204120 Ų12090%0.89568%0.68SS**SBendtrans-119.9118.1173.1-146.2-93000108.4
191P64.8Low52.2Low97 Ų97125.4 Ų125.463%0.6369%0.694SS**SBendcis-73.9148.80.831.8-32.8000112.1T189 V193T189-P191 CarbonylContact O-C 3.33Å; T189-P191 PolarHBondContact OG1-O 3.41Å; P191-V193 PolarHBondContact O-N 2.83Å
192P60.6Low52Low87 Ų87128.8 Ų128.857%0.56570%0.7SS**  trans-58.9119177.2-22.532.5000111.1T189T189-P192 WeakPolarHBondContact O-CA 3.47Å
193V62.3Low51.5Low94 Ų94128.9 Ų128.957%0.5770%0.702SS**  trans-96.6109.9170.3-1770000107.8P191 L195P191-V193 PolarHBondContact O-N 2.83Å; V193-L195 PolarHBondContact O-N 3.44Å
194G60.3Low50.8Low48 Ų48127.3 Ų127.350%0.49570%0.702SS.*  trans-71.9122173.400000110.5
195L58.2Low50.3Low126 Ų126130.7 Ų130.766%0.6671%0.711SS**  trans-92.3106.2169.9-67172.4000108.4L187 V193 T197L187-L195 HydrophobicContact CD1-CD1 4Å; V193-L195 PolarHBondContact O-N 3.44Å; L195-T197 PolarHBondContact O-N 3.06Å
196F52.8Low49.4Very low211 Ų211133.8 Ų133.893%0.92572%0.718SS**  trans-84.399.9166.1-92.6-85.9000108.7G198F196-G198 PolarHBondContact O-N 2.88Å
197T46.4Very low48.6Very low112 Ų112131.1 Ų131.169%0.68772%0.715SS**  trans-9281.6168.1-29.50000108.1L195L195-T197 PolarHBondContact O-N 3.06Å
198G40.8Very low47.6Very low64 Ų64132.4 Ų132.466%0.6673%0.732SS**  trans-10899.4171.800000109.4F196 Q200F196-G198 PolarHBondContact O-N 2.88Å; G198-Q200 PolarHBondContact O-N 3.07Å
199I47.6Very low46.3Very low161 Ų161135 Ų13583%0.82673%0.733SS**  trans-75.8102.7174.1-42.6164.4000106.7
200Q35.5Very low45.1Very low174 Ų174141.5 Ų141.581%0.81376%0.756SS**  trans168.689.9143-166.3175.166.400108.3G198G198-Q200 PolarHBondContact O-N 3.07Å
201M37.3Very low44.1Very low194 Ų194136.9 Ų136.996%0.95675%0.749SS**  trans-111.780.9166.3-76.4-93-98.800107.2
202E41.2Very low42.8Very low159 Ų159138 Ų13874%0.74376%0.759SS**  trans-109.9129.2156.5-79.2-173.716300107.6
203N38.6Very low41.7Very low145 Ų145138.4 Ų138.478%0.77576%0.764SS**SBendtrans95.9112.8166.1-51.5-38.5000118.4
204N32.9Very low40.6Very low139 Ų139140.7 Ų140.774%0.74377%0.773SS**  trans91.175.2157.8-59.3-24.6000118.3Q206N204-Q206 PolarHBondContact O-N 3.19Å; N204-Q206 VanDerWaalsContact O-N 3.14Å
205L38.4Very low39.5Very low170 Ų170145.3 Ų145.389%0.8979%0.786SS**  trans-59.7100.6134.1-86.891000108.6
206Q35.7Very low38.6Very low179 Ų179144.1 Ų144.184%0.83678%0.784SS**  trans-91.799.3152.6-90.7-171.833.100108.7N204 S208N204-Q206 PolarHBondContact O-N 3.19Å; N204-Q206 VanDerWaalsContact O-N 3.14Å; Q206-S208 PolarHBondContact O-N 3.14Å
207V33.6Very low37.9Very low107 Ų107143.8 Ų143.865%0.64878%0.778SS**  trans-50.3121.4153.9169.10000108.8Q209V207-Q209 HydrophobicContact CG1-CG 3.94Å
208S34.9Very low37.4Very low123 Ų123145.6 Ų145.686%0.8678%0.784SS**  trans-12589.9155.1-142.10000108.1Q206Q206-S208 PolarHBondContact O-N 3.14Å
209Q35.5Very low37.4Very low176 Ų176154 Ų15482%0.82280%0.796SS**  trans-63.9124.9162.9-76.2175.2-38.500108.4V207V207-Q209 HydrophobicContact CG1-CG 3.94Å
210K37.2Very low36.7Very low202 Ų202152.8 Ų152.888%0.87879%0.791SS**  trans-127109.8148.9-151.5164.5-173.3173.60108.8
211S32Very low37.1Very low107 Ų107152.2 Ų152.275%0.74879%0.792SS**  trans-53.5137.917538.20000112.5
212S36.2Very low37.2Very low119 Ų119150 Ų15083%0.83278%0.784SS**  -168.7102.9128.5-101.50000109.9
213S38.5Very low36.8Very low96 Ų96147.6 Ų147.667%0.67179%0.785SS**  trans-24.1130.5152.349.50000115.1
214N38Very low36.8Very low142 Ų142148.4 Ų148.476%0.75979%0.788SS**  176.2117.6110.5-82.8-23.4000110
215N38.8Very low37.1Very low145 Ų145148.6 Ų148.678%0.77579%0.789SS**  trans1.4147.9147.3-48.9-25.3000118
216T38.5Very low37.1Very low101 Ų101150 Ų15062%0.6279%0.788SS**  126.1114.5124-61.70000116.2
217Y38.2Very low37.3Very low204 Ų204147.3 Ų147.380%0.878%0.784SS**  trans67.9118.3155.4-53.1-44.6000121.5
218D34.8Very low37.7Very low151 Ų151146.9 Ų146.981%0.80778%0.782SS**  trans42.5107.7134.8-63.6-41.3000119.3
219R42.1Very low38.1Very low239 Ų239147.2 Ų147.290%0.90278%0.778SS**  trans-146.489.3150.9-135.1-174.7-77.8176.9-4112.3I221R219-I221 PolarHBondContact O-N 3.26Å
220N33.6Very low38.3Very low136 Ų136144 Ų14473%0.72777%0.77SS**  trans3.6108.1135-158.5-1.2000115.7N222N220-N222 PolarHBondContact OD1-N 3.39Å
221I43Very low38.6Very low163 Ų163139.9 Ų139.984%0.83676%0.762SS**  trans-127.774.2154.7-58.2-168.1000107.7R219R219-I221 PolarHBondContact O-N 3.26Å
222N38.9Very low39.1Very low147 Ų147139.6 Ų139.679%0.78676%0.76SS**  trans-117.289.1153-88.1-19.2000107N220N220-N222 PolarHBondContact OD1-N 3.39Å
223S32.8Very low39.3Very low109 Ų109138.3 Ų138.376%0.76276%0.757SS**  trans176.589.1149.965.20000111.9
224L39.1Very low39.5Very low161 Ų161140.2 Ų140.284%0.84376%0.764SS**SBendtrans-172.493.5158.9-13067.4000103.4
225N38.3Very low39.5Very low143 Ų143140.4 Ų140.477%0.76577%0.765SS**  -162.998.671.2-65.5-36.2000108.3
226K38.2Very low39.6Very low199 Ų199139 Ų13987%0.86577%0.766SS**  trans-98.584.1164-128.3-178.4-173.6179.30106.3T228K226-T228 PolarHBondContact O-N 3.23Å
227T40.4Very low39.7Very low124 Ų124140.4 Ų140.476%0.76177%0.774SS**  trans-81.981165.9-52.70000107.3V229T227-V229 HydrophobicContact CG2-CG2 3.83Å; T227-V229 PolarHBondContact O-N 3.35Å
228T41.5Very low40.2Very low98 Ų98135.7 Ų135.760%0.60177%0.771SS**  trans-72.399.7160.7-66.40000106.9K226 V230K226-T228 PolarHBondContact O-N 3.23Å; T228-V230 VanDerWaalsContact C-N 3.3Å; T228-V230 HydrophobicContact CG2-CB 4.24Å; T228-V230 HydrophobicContact CG2-CG2 3.51Å; T228-V230 PolarHBondContact O-N 3.2Å
229V43.4Very low40.5Very low129 Ų129133.4 Ų133.478%0.78277%0.767SS**  trans-82.886.5162.8-173.80000107.1T227T227-V229 HydrophobicContact CG2-CG2 3.83Å; T227-V229 PolarHBondContact O-N 3.35Å
230V41.2Very low40.6Very low108 Ų108127.9 Ų127.966%0.65576%0.764SS**  trans-96129.8154170.40000104.5T228T228-V230 VanDerWaalsContact C-N 3.3Å; T228-V230 HydrophobicContact CG2-CB 4.24Å; T228-V230 HydrophobicContact CG2-CG2 3.51Å; T228-V230 PolarHBondContact O-N 3.2Å
231T42Very low41.1Very low116 Ų116130.7 Ų130.771%0.71277%0.77SS**  168.1124.9117.9-53.60000110.6
232S44.3Very low41.4Very low101 Ų101128.1 Ų128.171%0.70677%0.766SS**  trans62.7110151.664.40000120.9
233A38.7Very low41.8Very low93 Ų93126.8 Ų126.877%0.76977%0.768SS**  trans-51139147.900000112.1
234V43.9Very low42.4Very low135 Ų135124.8 Ų124.882%0.81876%0.764SS**  trans-116.397.7154.5-114.80000106.5C236V234-C236 PolarHBondContact O-N 3.25Å
235N38.3Very low42.8Very low146 Ų146124.8 Ų124.878%0.78176%0.764SS**  trans-71.1107.9159.6-93.3-6.5000107.2
236C39.7Very low43.9Very low117 Ų117126.1 Ų126.179%0.79177%0.769SS**  trans-110.185.3160.6-720000108.1V234V234-C236 PolarHBondContact O-N 3.25Å
237T41.9Very low44.5Very low129 Ų129123.5 Ų123.579%0.79176%0.764SS**  trans-78.7112.5160.851.50000108.2
238S49Very low45.4Very low106 Ų106129.4 Ų129.474%0.74179%0.79SS**  trans-136.286.5156.960.60000109.1C240S238-C240 PolarHBondContact O-N 3.16Å
239S40.9Very low45.6Very low103 Ų103131 Ų13172%0.7280%0.8SS**  trans-65.8114.4158.3154.50000108.5
240C44.3Very low45.7Very low123 Ų123131.1 Ų131.183%0.83180%0.801SS**  trans-122.391.2158.9-65.60000108.7S238S238-C240 PolarHBondContact O-N 3.16Å
241K43.8Very low46Very low195 Ų195132.4 Ų132.485%0.84881%0.809SS**  trans-72.2128.6154.1-70.1175.8174.3178.20108.1
242S49.5Very low46.2Very low108 Ų108133.4 Ų133.476%0.75582%0.815SS**  trans-165.499.1155.6-166.80000106.2
243S45.8Very low46.3Very low120 Ų120135.4 Ų135.484%0.83982%0.821SS**  73.3126.882.6-680000113.9
244G46.2Very low46.9Very low66 Ų66138.2 Ų138.268%0.6883%0.825SS**  trans121.284.5164.800000113
245I47Very low47.1Very low162 Ų162138.4 Ų138.483%0.83183%0.825SS**  53.2104.889.8-54.9176.5000112.7
246I61.5Low47.7Very low171 Ų171137.8 Ų137.888%0.87783%0.829SS**  trans-139.4129.4148.4-59.8-179.9000107.9
247D52.1Low48.4Very low143 Ų143139.6 Ų139.677%0.76583%0.832SS**  trans-56.9145.8-178.7-78.4-46.6000116
248L59Low49Very low249 Ų249140.5 Ų140.5100%1.30484%0.836SS**  trans-142.30134.4-112.7122.4000109.1

Retrieved 248 of 248 residues in 86.9 ms (Link to these results)