A0A5K4ELR1_SCHMA Loading...

Prominin (Prom) protein, putative AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4ELR1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 849 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
1M25.3Very low28.6Very low144 Ų14493.1 Ų93.171%0.70946%0.464SS*.  0-440-130170.5177.900112.5V4 V5M1-V4 CarbonylContact O-C 3.58Å; M1-V4 VanDerWaalsContact O-CA 3.28Å; M1-V4 WeakPolarHBondContact O-CA 3.49Å; M1-V4 VanDerWaalsContact O-CB 3.25Å; M1-V4 WeakPolarHBondContact O-CB 3.31Å; M1-V4 PolarHBondContact O-N 3.16Å; M1-V5 WeakPolarHBondContact O-CG2 3.32Å; M1-V5 PolarHBondContact O-N 3.16Å
2M25.5Very low28.7Very low31 Ų3188.7 Ų88.715%0.15344%0.442CS..Hα-helixtrans-77.3-33.7175.6-152.1168.4-176.200114.2V4 V5 F6 F65 Y522 S526M2-V4 PolarHBondContact O-N 3.32Å; M2-V5 PolarHBondContact O-N 3.5Å; M2-F6 HydrophobicContact CE-CD2 4.36Å; M2-F6 WeakPolarHBondContact O-CB 3.04Å; M2-F6 PolarHBondContact O-N 3.37Å; M2-F65 HydrophobicContact CE-CD2 4.39Å; M2-F65 HydrophobicContact SD-CD2 3.36Å; M2-F65 WeakPolarHBondContact SD-CD2 3.29Å; M2-F65 HydrophobicContact SD-CE2 3.43Å; M2-F65 WeakPolarHBondContact SD-CE2 3.11Å; M2-F65 HydrophobicContact SD-CG 4.42Å; M2-Y522 HydrophobicContact CE-CD1 3.97Å; M2-Y522 HydrophobicContact CE-CE1 3.21Å; M2-Y522 HydrophobicContact CE-CE2 4.48Å; M2-Y522 HydrophobicContact SD-CE1 4.39Å; M2-S526 VanDerWaalsContact CE-CB 3.44Å; M2-S526 WeakPolarHBondContact CE-OG 3.36Å
3R27.1Very low28.8Very low216 Ų21687.6 Ų87.682%0.81545%0.447SS*.Hα-helixtrans-62.6-13.3158.6-92.7-170.8-178.4-178.40.4113.2S7R3-S7 WeakPolarHBondContact O-CB 3.33Å
4V30.2Very low28.8Very low86 Ų8684.9 Ų84.952%0.52144%0.437SS..Hα-helixtrans-89-62.7168.5-176.50000106.3M1 M2 F6 S7 T8M1-V4 CarbonylContact O-C 3.58Å; M1-V4 VanDerWaalsContact O-CA 3.28Å; M1-V4 WeakPolarHBondContact O-CA 3.49Å; M1-V4 VanDerWaalsContact O-CB 3.25Å; M1-V4 WeakPolarHBondContact O-CB 3.31Å; M1-V4 PolarHBondContact O-N 3.16Å; M2-V4 PolarHBondContact O-N 3.32Å; V4-F6 PolarHBondContact O-N 2.02Å; V4-S7 CarbonylContact O-C 3.48Å; V4-S7 PolarHBondContact O-N 3.01Å; V4-T8 VanDerWaalsContact C-OG1 3.28Å; V4-T8 HydrophobicContact CG1-CG2 3.75Å; V4-T8 VanDerWaalsContact O-CA 3.31Å; V4-T8 WeakPolarHBondContact O-CA 3.16Å; V4-T8 WeakPolarHBondContact O-CB 3.4Å; V4-T8 WeakPolarHBondContact O-CG2 3.12Å; V4-T8 PolarHBondContact O-N 2.95Å; V4-T8 PolarHBondContact O-OG1 3.44Å
5V29Very low28.8Very low54 Ų5483.1 Ų83.133%0.32744%0.435SS..Hα-helixtrans-56.6-48.3-176.9-178.60000115.3M1 M2 T8 V9M1-V5 WeakPolarHBondContact O-CG2 3.32Å; M1-V5 PolarHBondContact O-N 3.16Å; M2-V5 PolarHBondContact O-N 3.5Å; V5-T8 WeakPolarHBondContact CA-OG1 3.44Å; V5-T8 CarbonylContact O-C 3.51Å; V5-T8 PolarHBondContact O-N 3.17Å; V5-T8 PolarHBondContact O-OG1 3.5Å; V5-T8 VanDerWaalsContact O-OG1 3.06Å; V5-V9 VanDerWaalsContact O-CG2 3.27Å; V5-V9 WeakPolarHBondContact O-CG2 2.92Å; V5-V9 PolarHBondContact O-N 2.99Å
6F27.3Very low29Very low99 Ų9981.2 Ų81.243%0.43443%0.425SS..Hα-helixtrans-76.9-40.9179.2-118.8-88.4000111.7M2 V4 T8 V9 L10 V523M2-F6 HydrophobicContact CE-CD2 4.36Å; M2-F6 WeakPolarHBondContact O-CB 3.04Å; M2-F6 PolarHBondContact O-N 3.37Å; V4-F6 PolarHBondContact O-N 2.02Å; F6-T8 PolarHBondContact O-N 3.05Å; F6-V9 PolarHBondContact O-N 2.88Å; F6-L10 WeakPolarHBondContact O-CB 3.37Å; F6-L10 PolarHBondContact O-N 2.99Å; F6-V523 HydrophobicContact CE2-CG2 3.73Å; F6-V523 HydrophobicContact CZ-CG1 4.12Å; F6-V523 HydrophobicContact CZ-CG2 3.82Å
7S31.9Very low29.4Very low51 Ų5181.1 Ų81.136%0.35743%0.425SS..Hα-helixtrans-69.1-16.8170.9-159.20000111.5R3 V4 F11R3-S7 WeakPolarHBondContact O-CB 3.33Å; V4-S7 CarbonylContact O-C 3.48Å; V4-S7 PolarHBondContact O-N 3.01Å; S7-F11 WeakPolarHBondContact O-CA 3.27Å; S7-F11 WeakPolarHBondContact O-CB 3.39Å; S7-F11 WeakPolarHBondContact O-CD2 3.28Å; S7-F11 VanDerWaalsContact O-CG 3.27Å; S7-F11 WeakPolarHBondContact O-CG 3.33Å; S7-F11 PolarHBondContact O-N 3.1Å; S7-F11 VanDerWaalsContact OG-CD2 3.27Å; S7-F11 WeakPolarHBondContact OG-CD2 3.39Å
8T29.8Very low29.9Very low48 Ų4877.2 Ų77.229%0.29440%0.404SS..Hα-helixtrans-97.8-20.4175.755.40000110.7V4 V5 F6 L12V4-T8 VanDerWaalsContact C-OG1 3.28Å; V4-T8 HydrophobicContact CG1-CG2 3.75Å; V4-T8 VanDerWaalsContact O-CA 3.31Å; V4-T8 WeakPolarHBondContact O-CA 3.16Å; V4-T8 WeakPolarHBondContact O-CB 3.4Å; V4-T8 WeakPolarHBondContact O-CG2 3.12Å; V4-T8 PolarHBondContact O-N 2.95Å; V4-T8 PolarHBondContact O-OG1 3.44Å; V5-T8 WeakPolarHBondContact CA-OG1 3.44Å; V5-T8 CarbonylContact O-C 3.51Å; V5-T8 PolarHBondContact O-N 3.17Å; V5-T8 PolarHBondContact O-OG1 3.5Å; V5-T8 VanDerWaalsContact O-OG1 3.06Å; F6-T8 PolarHBondContact O-N 3.05Å; T8-L12 VanDerWaalsContact O-CA 3.31Å; T8-L12 WeakPolarHBondContact O-CA 3.31Å; T8-L12 WeakPolarHBondContact O-CB 3.19Å; T8-L12 WeakPolarHBondContact O-CD1 3.44Å; T8-L12 WeakPolarHBondContact O-CG 3.44Å; T8-L12 PolarHBondContact O-N 3.33Å
9V29.5Very low30.7Very low54 Ų5474.2 Ų74.233%0.32739%0.392SS..Hα-helixtrans-75-42.5165.4172.50000108.2V5 F6 C13 L500 V504V5-V9 VanDerWaalsContact O-CG2 3.27Å; V5-V9 WeakPolarHBondContact O-CG2 2.92Å; V5-V9 PolarHBondContact O-N 2.99Å; F6-V9 PolarHBondContact O-N 2.88Å; V9-C13 PolarHBondContact O-N 2.85Å; V9-C13 VanDerWaalsContact O-N 3.12Å; V9-C13 PolarHBondContact O-SG 3.49Å; V9-C13 VanDerWaalsContact O-SG 3.39Å; V9-L500 HydrophobicContact CG2-CD1 3.99Å; V9-V504 HydrophobicContact CG2-CG2 4.35Å
10L28.9Very low31.1Very low123 Ų12372.7 Ų72.764%0.64439%0.385SS*.Hα-helixtrans-71.2-40.5171.6-139.686.9000112.1F6 C13 V14F6-L10 WeakPolarHBondContact O-CB 3.37Å; F6-L10 PolarHBondContact O-N 2.99Å; L10-C13 CarbonylContact O-C 3.57Å; L10-C13 PolarHBondContact O-N 2.87Å; L10-V14 WeakPolarHBondContact O-CB 3.41Å; L10-V14 WeakPolarHBondContact O-CG2 3.37Å; L10-V14 PolarHBondContact O-N 3.38Å
11F30.2Very low31.5Very low118 Ų11871.5 Ų71.552%0.51838%0.382SS..Hα-helixtrans-69.7-38.8171.8-92.9-115.4000110.7S7 C13 V14 S15S7-F11 WeakPolarHBondContact O-CA 3.27Å; S7-F11 WeakPolarHBondContact O-CB 3.39Å; S7-F11 WeakPolarHBondContact O-CD2 3.28Å; S7-F11 VanDerWaalsContact O-CG 3.27Å; S7-F11 WeakPolarHBondContact O-CG 3.33Å; S7-F11 PolarHBondContact O-N 3.1Å; S7-F11 VanDerWaalsContact OG-CD2 3.27Å; S7-F11 WeakPolarHBondContact OG-CD2 3.39Å; F11-C13 PolarHBondContact O-N 3.5Å; F11-V14 CarbonylContact O-C 3.59Å; F11-V14 WeakPolarHBondContact O-CA 3.48Å; F11-V14 PolarHBondContact O-N 2.95Å; F11-S15 WeakPolarHBondContact O-CA 3.42Å; F11-S15 WeakPolarHBondContact O-CB 3.49Å; F11-S15 PolarHBondContact O-N 2.99Å; F11-S15 PolarHBondContact O-OG 2.72Å
12L29.6Very low32Very low40 Ų4072.5 Ų72.521%0.20939%0.391CS..Hα-helixtrans-65.8-29.4178.3-74.3158.5000111.2T8 V14 L16 F496 L500T8-L12 VanDerWaalsContact O-CA 3.31Å; T8-L12 WeakPolarHBondContact O-CA 3.31Å; T8-L12 WeakPolarHBondContact O-CB 3.19Å; T8-L12 WeakPolarHBondContact O-CD1 3.44Å; T8-L12 WeakPolarHBondContact O-CG 3.44Å; T8-L12 PolarHBondContact O-N 3.33Å; L12-V14 VanDerWaalsContact C-N 3.3Å; L12-L16 HydrophobicContact CD2-CD1 3.53Å; L12-L16 PolarHBondContact O-N 2.94Å; L12-F496 HydrophobicContact CD1-CE2 3.56Å; L12-F496 HydrophobicContact CD1-CZ 3.44Å; L12-F496 VanDerWaalsContact CD1-CZ 3.44Å; L12-F496 HydrophobicContact CD2-CE2 3.86Å; L12-F496 HydrophobicContact CD2-CZ 3.55Å; L12-F496 HydrophobicContact CG-CE2 4.28Å; L12-F496 HydrophobicContact CG-CZ 4.14Å; L12-L500 HydrophobicContact CD1-CD2 4.5Å
13C30.3Very low32.4Very low75 Ų7575 Ų7551%0.50741%0.412SS..Hα-helixtrans-76.3-13.2167-67.80000114.1V9 L10 F11V9-C13 PolarHBondContact O-N 2.85Å; V9-C13 VanDerWaalsContact O-N 3.12Å; V9-C13 PolarHBondContact O-SG 3.49Å; V9-C13 VanDerWaalsContact O-SG 3.39Å; L10-C13 CarbonylContact O-C 3.57Å; L10-C13 PolarHBondContact O-N 2.87Å; F11-C13 PolarHBondContact O-N 3.5Å
14V28.7Very low32.8Very low49 Ų4973.6 Ų73.630%0.29741%0.414SS..Hα-helixtrans-116.6-4.2-178.5172.50000113.1L10 F11 L12L10-V14 WeakPolarHBondContact O-CB 3.41Å; L10-V14 WeakPolarHBondContact O-CG2 3.37Å; L10-V14 PolarHBondContact O-N 3.38Å; F11-V14 CarbonylContact O-C 3.59Å; F11-V14 WeakPolarHBondContact O-CA 3.48Å; F11-V14 PolarHBondContact O-N 2.95Å; L12-V14 VanDerWaalsContact C-N 3.3Å
15S29Very low33.1Very low58 Ų5875.9 Ų75.941%0.40643%0.428SS..Hα-helixtrans-138.10.5-168.383.40000112.2F11F11-S15 WeakPolarHBondContact O-CA 3.42Å; F11-S15 WeakPolarHBondContact O-CB 3.49Å; F11-S15 PolarHBondContact O-N 2.99Å; F11-S15 PolarHBondContact O-OG 2.72Å
16L31.7Very low33.8Very low53 Ų5380.4 Ų80.428%0.27745%0.45SS..SBendtrans-100.6104.7144.9-89.787000104.9L12 I18 F182L12-L16 HydrophobicContact CD2-CD1 3.53Å; L12-L16 PolarHBondContact O-N 2.94Å; L16-I18 WeakPolarHBondContact O-CG1 3.39Å; L16-I18 PolarHBondContact O-N 3.4Å; L16-F182 HydrophobicContact CD2-CZ 4.35Å
17D35.6Very low35.4Very low79 Ų7979.3 Ų79.342%0.42245%0.449SS..  trans-65.2122.6176-60.5-52.4000108.8E409 Y418D17-E409 HydrophobicContact CB-CG 4.27Å; D17-Y418 WeakPolarHBondContact O-CD2 3.42Å; D17-Y418 WeakPolarHBondContact O-CE2 3.39Å
18I38.7Very low37.2Very low12 Ų1282.4 Ų82.46%0.06246%0.462CS..  trans-109.6139.4-158.9-51.8178.4000111L16 F182 I406L16-I18 WeakPolarHBondContact O-CG1 3.39Å; L16-I18 PolarHBondContact O-N 3.4Å; I18-F182 HydrophobicContact CB-CD1 4.31Å; I18-F182 HydrophobicContact CB-CE1 4.48Å; I18-F182 HydrophobicContact CD1-CD1 3.86Å; I18-F182 HydrophobicContact CD1-CE1 3.77Å; I18-F182 HydrophobicContact CG1-CD1 4.01Å; I18-F182 HydrophobicContact CG1-CE1 3.79Å; I18-F182 HydrophobicContact CG2-CB 4Å; I18-F182 HydrophobicContact CG2-CD1 3.39Å; I18-F182 HydrophobicContact CG2-CE1 4Å; I18-F182 HydrophobicContact CG2-CG 3.78Å; I18-I406 HydrophobicContact CD1-CB 4.41Å; I18-I406 HydrophobicContact CD1-CG1 3.66Å; I18-I406 HydrophobicContact CG2-CG2 4.04Å; I18-I406 WeakPolarHBondContact CG2-O 3.15Å
19A45.6Very low39.3Very low20 Ų2084.1 Ų84.117%0.16548%0.476CS..  trans-119.4145.2177.300000113.3N415 Y418A19-N415 HydrophobicContact CB-CB 4.12Å; A19-N415 VanDerWaalsContact CB-CG 3.47Å; A19-N415 WeakPolarHBondContact CB-OD1 3.33Å; A19-Y418 HydrophobicContact CB-CD1 4.18Å
20V38.9Very low41.7Very low43 Ų4383.9 Ų83.926%0.26148%0.476SS..  trans-136.1131.5165.4175.50000107.7I410V20-I410 HydrophobicContact CB-CD1 4.12Å; V20-I410 WeakPolarHBondContact O-CD1 3.49Å; V20-I410 WeakPolarHBondContact O-CG1 2.77Å
21C38.2Very low44.2Very low48 Ų4878.1 Ų78.132%0.32445%0.446SS..  trans-135.4142.4173.5-99.20000111.8R175 N415C21-R175 VanDerWaalsContact O-CD 3.24Å; C21-R175 WeakPolarHBondContact O-CD 3.47Å; C21-R175 PolarHBondContact O-NE 3.43Å; C21-N415 PolarHBondContact SG-ND2 3.4Å
22N36.2Very low46.9Very low166 Ų16680.4 Ų80.489%0.88845%0.451SS*.  trans-86115.4172.5-80.4-15.3000110.4
23S34.9Very low49.6Very low84 Ų8482.5 Ų82.559%0.58747%0.466SS*.  trans-151.3114.7148.370.70000108.1R175S23-R175 PolarHBondContact O-NH1 3.45Å; S23-R175 PolarHBondContact OG-NH1 2.91Å
24E34.6Very low52.4Low186 Ų18679.7 Ų79.787%0.86945%0.446SS*.  trans-72.2159.1174.2-72.4172.913800110.6
25V37.5Very low55.3Low133 Ų13378.8 Ų78.881%0.80644%0.44SS*.SBendtrans105.7115.5162.2-167.60000115.2
26D43.8Very low58.2Low149 Ų14981.7 Ų81.780%0.79745%0.447SS*.SBendtrans94.725.5170.6-75-12.5000121.8
27D60.1Low61.1Low77 Ų7781.7 Ų81.741%0.41245%0.447SS..  trans-97.8-7.5-169.5-148.86.2000118.2S30 T31D27-S30 VanDerWaalsContact C-OG 3.27Å; D27-S30 WeakPolarHBondContact CA-OG 3.46Å; D27-S30 PolarHBondContact O-OG 2.76Å; D27-S30 PolarHBondContact OD1-OG 2.93Å; D27-T31 WeakPolarHBondContact O-CB 3.4Å; D27-T31 PolarHBondContact O-N 3.47Å; D27-T31 PolarHBondContact O-OG1 3.15Å
28D69.4Low63.7Low116 Ų11680.4 Ų80.462%0.6244%0.436SS*.Hα-helixtrans-77.7-31.1-167.6-150.233000113.2R32 R178D28-R32 WeakPolarHBondContact O-CB 3.37Å; D28-R32 PolarHBondContact O-N 3.36Å; D28-R32 VanDerWaalsContact O-N 3.08Å; D28-R178 IonicContact OD1-NH2 3.18Å; D28-R178 PolarHBondContact OD1-NH2 2.96Å
29S74.9Confident66.2Low84 Ų8484 Ų8459%0.58746%0.456SS*.Hα-helixtrans-76.3-40178.3750000113.1T33S29-T33 PolarHBondContact O-N 2.93Å; S29-T33 VanDerWaalsContact O-N 3.14Å; S29-T33 PolarHBondContact O-OG1 3.14Å
30S78.9Confident68.4Low48 Ų4886.2 Ų86.234%0.33647%0.47SS..Hα-helixtrans-60-50.5171.239.90000109.6D27 R32 T33 T34D27-S30 VanDerWaalsContact C-OG 3.27Å; D27-S30 WeakPolarHBondContact CA-OG 3.46Å; D27-S30 PolarHBondContact O-OG 2.76Å; D27-S30 PolarHBondContact OD1-OG 2.93Å; S30-R32 PolarHBondContact O-N 3.5Å; S30-T33 WeakPolarHBondContact O-CB 3.46Å; S30-T33 PolarHBondContact O-N 2.96Å; S30-T33 VanDerWaalsContact O-N 3.1Å; S30-T34 PolarHBondContact O-N 3.27Å; S30-T34 PolarHBondContact O-OG1 3.02Å
31T82.4Confident71.1Confident2 Ų284.3 Ų84.31%0.01246%0.458CS..Hα-helixtrans-57.1-48.8180-64.20000111.9D27 T33 T34 L35 D176 I179D27-T31 WeakPolarHBondContact O-CB 3.4Å; D27-T31 PolarHBondContact O-N 3.47Å; D27-T31 PolarHBondContact O-OG1 3.15Å; T31-T33 VanDerWaalsContact C-N 3.28Å; T31-T33 PolarHBondContact O-N 3.12Å; T31-T34 PolarHBondContact O-N 2.95Å; T31-L35 HydrophobicContact CG2-CD1 3.95Å; T31-L35 HydrophobicContact CG2-CG 4.39Å; T31-L35 VanDerWaalsContact O-CG 3.32Å; T31-L35 WeakPolarHBondContact O-CG 3.38Å; T31-L35 PolarHBondContact O-N 2.99Å; T31-D176 HydrophobicContact CG2-CB 4.42Å; T31-D176 WeakPolarHBondContact CG2-OD2 3.49Å; T31-I179 HydrophobicContact CG2-CD1 3.6Å; T31-I179 HydrophobicContact CG2-CG1 4.34Å
32R85.1Confident73.7Confident166 Ų16686.8 Ų86.863%0.62647%0.465SS*.Hα-helixtrans-60.4-39.4178.5-169.517870.2178.3-0.1112.1D28 S30 L35 Q36D28-R32 WeakPolarHBondContact O-CB 3.37Å; D28-R32 PolarHBondContact O-N 3.36Å; D28-R32 VanDerWaalsContact O-N 3.08Å; S30-R32 PolarHBondContact O-N 3.5Å; R32-L35 PolarHBondContact O-N 3.13Å; R32-Q36 WeakPolarHBondContact O-CB 3.49Å; R32-Q36 VanDerWaalsContact O-CG 3.31Å; R32-Q36 WeakPolarHBondContact O-CG 3.17Å; R32-Q36 PolarHBondContact O-N 3.02Å
33T87.8Confident76.4Confident84 Ų8484 Ų8452%0.51545%0.445SS..Hα-helixtrans-66.1-44179.1-53.50000111S29 S30 T31 Q36 L37S29-T33 PolarHBondContact O-N 2.93Å; S29-T33 VanDerWaalsContact O-N 3.14Å; S29-T33 PolarHBondContact O-OG1 3.14Å; S30-T33 WeakPolarHBondContact O-CB 3.46Å; S30-T33 PolarHBondContact O-N 2.96Å; S30-T33 VanDerWaalsContact O-N 3.1Å; T31-T33 VanDerWaalsContact C-N 3.28Å; T31-T33 PolarHBondContact O-N 3.12Å; T33-Q36 PolarHBondContact O-N 3.18Å; T33-L37 WeakPolarHBondContact O-CB 3.49Å; T33-L37 PolarHBondContact O-N 2.99Å
34T87.7Confident79.2Confident16 Ų1680.4 Ų80.410%0.09842%0.42CS..Hα-helixtrans-65.9-39177.5-560000112.1S30 T31 L37 R38 L167 E170 I179S30-T34 PolarHBondContact O-N 3.27Å; S30-T34 PolarHBondContact O-OG1 3.02Å; T31-T34 PolarHBondContact O-N 2.95Å; T34-L37 PolarHBondContact O-N 2.92Å; T34-R38 WeakPolarHBondContact O-CB 3.39Å; T34-R38 PolarHBondContact O-N 2.86Å; T34-L167 HydrophobicContact CG2-CD2 3.86Å; T34-E170 HydrophobicContact CG2-CB 4.12Å; T34-E170 HydrophobicContact CG2-CG 4.05Å; T34-I179 HydrophobicContact CG2-CD1 3.82Å; T34-I179 HydrophobicContact CG2-CG1 4.25Å; T34-I179 HydrophobicContact CG2-CG2 3.79Å
35L89.3Confident82.1Confident31 Ų3171.8 Ų71.816%0.16238%0.379CS..Hα-helixtrans-62.8-47.2174.1-71.4172.5000111.6T31 R32 L37 R38 D39 R178 I179T31-L35 HydrophobicContact CG2-CD1 3.95Å; T31-L35 HydrophobicContact CG2-CG 4.39Å; T31-L35 VanDerWaalsContact O-CG 3.32Å; T31-L35 WeakPolarHBondContact O-CG 3.38Å; T31-L35 PolarHBondContact O-N 2.99Å; R32-L35 PolarHBondContact O-N 3.13Å; L35-L37 VanDerWaalsContact C-N 3.28Å; L35-L37 PolarHBondContact O-N 3.42Å; L35-R38 WeakPolarHBondContact O-CB 3.49Å; L35-R38 PolarHBondContact O-N 3.45Å; L35-D39 VanDerWaalsContact O-CG 3.22Å; L35-D39 PolarHBondContact O-N 3.39Å; L35-R178 HydrophobicContact CD1-CB 4.41Å; L35-R178 HydrophobicContact CD2-CB 4.18Å; L35-I179 HydrophobicContact CD2-CG1 4.01Å; L35-I179 HydrophobicContact CG-CD1 4.44Å; L35-I179 HydrophobicContact CG-CG1 4.2Å
36Q91.1Very high84.8Confident118 Ų11868.9 Ų68.955%0.55137%0.365SS*.Hα-helixtrans-60-39.5175.1-74.8178.9-23.600112.2R32 T33 D39 S40R32-Q36 WeakPolarHBondContact O-CB 3.49Å; R32-Q36 VanDerWaalsContact O-CG 3.31Å; R32-Q36 WeakPolarHBondContact O-CG 3.17Å; R32-Q36 PolarHBondContact O-N 3.02Å; T33-Q36 PolarHBondContact O-N 3.18Å; Q36-D39 PolarHBondContact O-N 2.89Å; Q36-S40 WeakPolarHBondContact O-CB 3.06Å; Q36-S40 PolarHBondContact O-N 2.88Å
37L91.3Very high87.2Confident53 Ų5365.1 Ų65.128%0.27734%0.344SS..Hα-helixtrans-64.5-43.4176.6-173.164.3000111.4T33 T34 L35 D39 S40 V41 I163 L167T33-L37 WeakPolarHBondContact O-CB 3.49Å; T33-L37 PolarHBondContact O-N 2.99Å; T34-L37 PolarHBondContact O-N 2.92Å; L35-L37 VanDerWaalsContact C-N 3.28Å; L35-L37 PolarHBondContact O-N 3.42Å; L37-D39 PolarHBondContact O-N 3.37Å; L37-S40 PolarHBondContact O-N 3.32Å; L37-S40 PolarHBondContact O-OG 2.86Å; L37-V41 PolarHBondContact O-N 3.34Å; L37-I163 HydrophobicContact CD1-CD1 4.26Å; L37-I163 HydrophobicContact CD1-CG1 4.26Å; L37-I163 HydrophobicContact CD1-CG2 3.65Å; L37-I163 HydrophobicContact CD2-CG2 3.9Å; L37-I163 HydrophobicContact CG-CG2 3.57Å; L37-L167 HydrophobicContact CB-CD2 4.48Å; L37-L167 HydrophobicContact CD2-CD2 4.3Å; L37-L167 HydrophobicContact CG-CD2 4.4Å
38R91.5Very high88.9Confident53 Ų5361.5 Ų61.520%0.233%0.325CS..Hα-helixtrans-59.2-46.3175.1-174.6-17870.1-169.5-1.7111.9T34 L35 S40 V41 E42 Y45 L167 R178T34-R38 WeakPolarHBondContact O-CB 3.39Å; T34-R38 PolarHBondContact O-N 2.86Å; L35-R38 WeakPolarHBondContact O-CB 3.49Å; L35-R38 PolarHBondContact O-N 3.45Å; R38-S40 VanDerWaalsContact C-N 3.28Å; R38-S40 PolarHBondContact O-N 3.36Å; R38-V41 VanDerWaalsContact O-CG2 3.3Å; R38-V41 WeakPolarHBondContact O-CG2 3.45Å; R38-V41 PolarHBondContact O-N 3.07Å; R38-E42 PolarHBondContact O-N 3.45Å; R38-Y45 HydrophobicContact CG-CE2 4.19Å; R38-L167 HydrophobicContact CB-CD1 4.27Å; R38-L167 HydrophobicContact CB-CD2 4.07Å; R38-R178 PolarHBondContact NH1-O 3.44Å
39D91.4Very high90.1Very high88 Ų8857 Ų5747%0.47130%0.301SS..Hα-helixtrans-64.7-36-179.8-62.2-12.8000110.8L35 Q36 L37 V41 E42L35-D39 VanDerWaalsContact O-CG 3.22Å; L35-D39 PolarHBondContact O-N 3.39Å; Q36-D39 PolarHBondContact O-N 2.89Å; L37-D39 PolarHBondContact O-N 3.37Å; D39-V41 PolarHBondContact O-N 3.2Å; D39-E42 WeakPolarHBondContact O-CB 3.44Å; D39-E42 PolarHBondContact O-N 3.44Å
40S92.1Very high91Very high66 Ų6659.8 Ų59.846%0.46230%0.302SS..Hα-helixtrans-64.7-21.8177.779.80000114.4Q36 L37 R38Q36-S40 WeakPolarHBondContact O-CB 3.06Å; Q36-S40 PolarHBondContact O-N 2.88Å; L37-S40 PolarHBondContact O-N 3.32Å; L37-S40 PolarHBondContact O-OG 2.86Å; R38-S40 VanDerWaalsContact C-N 3.28Å; R38-S40 PolarHBondContact O-N 3.36Å
41V94.2Very high91.7Very high2 Ų260.5 Ų60.51%0.01230%0.3CS..THydrogen-bonded Turntrans-108.39.2-179.6-59.30000113.6L37 R38 D39 F43 S44 Y45 L160 I163 L167L37-V41 PolarHBondContact O-N 3.34Å; R38-V41 VanDerWaalsContact O-CG2 3.3Å; R38-V41 WeakPolarHBondContact O-CG2 3.45Å; R38-V41 PolarHBondContact O-N 3.07Å; D39-V41 PolarHBondContact O-N 3.2Å; V41-F43 PolarHBondContact O-N 2.82Å; V41-F43 VanDerWaalsContact O-N 3.14Å; V41-S44 WeakPolarHBondContact O-CA 3.28Å; V41-S44 VanDerWaalsContact O-CB 3.27Å; V41-S44 WeakPolarHBondContact O-CB 3.36Å; V41-S44 PolarHBondContact O-N 3.33Å; V41-S44 PolarHBondContact O-OG 3.44Å; V41-Y45 HydrophobicContact CG2-CE1 4.38Å; V41-L160 HydrophobicContact CG1-CD2 3.89Å; V41-I163 HydrophobicContact CG1-CB 4.18Å; V41-I163 HydrophobicContact CG1-CD1 4.2Å; V41-I163 HydrophobicContact CG1-CG2 3.54Å; V41-I163 HydrophobicContact CG2-CG2 4.34Å; V41-L167 HydrophobicContact CG2-CD1 3.47Å; V41-L167 VanDerWaalsContact CG2-CD1 3.47Å
42E92.8Very high92.3Very high101 Ų10160.4 Ų60.447%0.47230%0.299SS..Hα-helixtrans-56.8-33.3-179.4-169-177.3-176.400112.7R38 D39 S44 Y45 S46R38-E42 PolarHBondContact O-N 3.45Å; D39-E42 WeakPolarHBondContact O-CB 3.44Å; D39-E42 PolarHBondContact O-N 3.44Å; E42-S44 PolarHBondContact O-N 2.89Å; E42-Y45 WeakPolarHBondContact O-CB 3.43Å; E42-Y45 PolarHBondContact O-N 3.47Å; E42-Y45 VanDerWaalsContact O-N 3.13Å; E42-S46 PolarHBondContact O-N 3.48Å; E42-S46 VanDerWaalsContact O-N 3.12Å; E42-S46 PolarHBondContact O-OG 2.97Å
43F93.9Very high92.6Very high107 Ų10754.9 Ų54.947%0.46928%0.282SS..Hα-helixtrans-61.1-31.5174.480.4-89.3000112.4V41 Y45 S46 I47 L160V41-F43 PolarHBondContact O-N 2.82Å; V41-F43 VanDerWaalsContact O-N 3.14Å; F43-Y45 VanDerWaalsContact C-N 3.34Å; F43-S46 WeakPolarHBondContact O-CB 3.44Å; F43-S46 PolarHBondContact O-N 3.06Å; F43-I47 HydrophobicContact CD2-CD1 3.84Å; F43-I47 HydrophobicContact CE2-CD1 4.16Å; F43-I47 WeakPolarHBondContact O-CG1 3.5Å; F43-I47 PolarHBondContact O-N 3.3Å; F43-L160 HydrophobicContact CE1-CD2 3.92Å; F43-L160 HydrophobicContact CE2-CD1 3.81Å; F43-L160 HydrophobicContact CZ-CD1 3.49Å; F43-L160 VanDerWaalsContact CZ-CD1 3.49Å; F43-L160 HydrophobicContact CZ-CD2 3.57Å; F43-L160 HydrophobicContact CZ-CG 4.16Å
44S94.4Very high92.8Very high8 Ų856.5 Ų56.56%0.05629%0.287CS..Hα-helixtrans-69.8-33.8177.8780000111.6V41 E42 I47 S48 N164V41-S44 WeakPolarHBondContact O-CA 3.28Å; V41-S44 VanDerWaalsContact O-CB 3.27Å; V41-S44 WeakPolarHBondContact O-CB 3.36Å; V41-S44 PolarHBondContact O-N 3.33Å; V41-S44 PolarHBondContact O-OG 3.44Å; E42-S44 PolarHBondContact O-N 2.89Å; S44-I47 PolarHBondContact O-N 2.94Å; S44-S48 PolarHBondContact O-N 3.01Å; S44-N164 PolarHBondContact OG-ND2 3.28Å; S44-N164 VanDerWaalsContact OG-ND2 3.16Å
45Y94.9Very high92.9Very high6 Ų656.8 Ų56.82%0.02429%0.287CS..Hα-helixtrans-64.6-42.5171.3-57-22.2000111.3R38 V41 E42 F43 I47 S48 N49 N164 M778 P779 A782R38-Y45 HydrophobicContact CG-CE2 4.19Å; V41-Y45 HydrophobicContact CG2-CE1 4.38Å; E42-Y45 WeakPolarHBondContact O-CB 3.43Å; E42-Y45 PolarHBondContact O-N 3.47Å; E42-Y45 VanDerWaalsContact O-N 3.13Å; F43-Y45 VanDerWaalsContact C-N 3.34Å; Y45-I47 VanDerWaalsContact C-N 3.35Å; Y45-I47 PolarHBondContact O-N 2.86Å; Y45-S48 PolarHBondContact O-N 3.5Å; Y45-N49 WeakPolarHBondContact O-CB 3.37Å; Y45-N49 PolarHBondContact O-N 3.42Å; Y45-N49 PolarHBondContact O-ND2 3.02Å; Y45-N164 WeakPolarHBondContact CE1-OD1 3.45Å; Y45-M778 HydrophobicContact CD1-CB 3.71Å; Y45-M778 HydrophobicContact CD2-CB 3.94Å; Y45-M778 HydrophobicContact CD2-CE 4.06Å; Y45-M778 HydrophobicContact CD2-SD 4.05Å; Y45-M778 VanDerWaalsContact CE1-C 3.5Å; Y45-M778 HydrophobicContact CE1-CB 3.93Å; Y45-M778 HydrophobicContact CE2-CB 4.15Å; Y45-M778 HydrophobicContact CG-CB 3.73Å; Y45-M778 HydrophobicContact CG-CG 4.45Å; Y45-M778 HydrophobicContact CG-SD 3.97Å; Y45-P779 HydrophobicContact CE1-CB 4.34Å; Y45-A782 HydrophobicContact CD1-CB 3.74Å; Y45-A782 HydrophobicContact CE1-CB 3.98Å
46S94.2Very high92.9Very high71 Ų7155.5 Ų55.550%0.49728%0.28SS..Hα-helixtrans-61.2-42.4176-65.20000112E42 F43 F50E42-S46 PolarHBondContact O-N 3.48Å; E42-S46 VanDerWaalsContact O-N 3.12Å; E42-S46 PolarHBondContact O-OG 2.97Å; F43-S46 WeakPolarHBondContact O-CB 3.44Å; F43-S46 PolarHBondContact O-N 3.06Å; S46-F50 VanDerWaalsContact O-CB 3.23Å; S46-F50 WeakPolarHBondContact O-CB 3.45Å; S46-F50 PolarHBondContact O-N 2.86Å
47I94.1Very high92.5Very high71 Ų7151.2 Ų51.236%0.36427%0.268SS..Hα-helixtrans-62.5-46.4175.8-68.4167.8000111F43 S44 Y45 F50 F51 T785 F789F43-I47 HydrophobicContact CD2-CD1 3.84Å; F43-I47 HydrophobicContact CE2-CD1 4.16Å; F43-I47 WeakPolarHBondContact O-CG1 3.5Å; F43-I47 PolarHBondContact O-N 3.3Å; S44-I47 PolarHBondContact O-N 2.94Å; Y45-I47 VanDerWaalsContact C-N 3.35Å; Y45-I47 PolarHBondContact O-N 2.86Å; I47-F50 PolarHBondContact O-N 3.45Å; I47-F51 PolarHBondContact O-N 3.02Å; I47-T785 HydrophobicContact CG2-CG2 4.11Å; I47-F789 HydrophobicContact CG2-CE2 3.76Å; I47-F789 HydrophobicContact CG2-CZ 4.22Å
48S95.2Very high91.9Very high1 Ų157.4 Ų57.41%0.00729%0.293CS..Hα-helixtrans-62.4-47.9179.4-169.60000111.6S44 Y45 F50 F51 L52 N781 T785S44-S48 PolarHBondContact O-N 3.01Å; Y45-S48 PolarHBondContact O-N 3.5Å; S48-F50 PolarHBondContact O-N 3.21Å; S48-F51 PolarHBondContact O-N 3.04Å; S48-L52 WeakPolarHBondContact O-CB 3.35Å; S48-L52 VanDerWaalsContact O-CG 3.27Å; S48-L52 WeakPolarHBondContact O-CG 3.46Å; S48-L52 PolarHBondContact O-N 3.41Å; S48-N781 WeakPolarHBondContact OG-CB 3.48Å; S48-N781 PolarHBondContact OG-O 2.9Å; S48-T785 WeakPolarHBondContact CB-OG1 3.47Å; S48-T785 PolarHBondContact OG-OG1 3.41Å
49N94.4Very high91.2Very high21 Ų2159.3 Ų59.311%0.11230%0.302CS..Hα-helixtrans-61-43.3176.8-78.8-35.2000112.1Y45 F51 L52 D53 Q501 R511Y45-N49 WeakPolarHBondContact O-CB 3.37Å; Y45-N49 PolarHBondContact O-N 3.42Å; Y45-N49 PolarHBondContact O-ND2 3.02Å; N49-F51 PolarHBondContact O-N 2.87Å; N49-L52 PolarHBondContact O-N 2.92Å; N49-D53 WeakPolarHBondContact O-CB 3.41Å; N49-D53 PolarHBondContact O-N 3.24Å; N49-Q501 PolarHBondContact OD1-NE2 2.91Å; N49-R511 PolarHBondContact OD1-NH1 2.62Å; N49-R511 PolarHBondContact OD1-NH2 2.96Å
50F94.2Very high90Very high143 Ų14357.4 Ų57.463%0.62730%0.295SS*.Hα-helixtrans-59.4-46.4176.3175.3-97.8000111.7S46 I47 S48 D53 L54S46-F50 VanDerWaalsContact O-CB 3.23Å; S46-F50 WeakPolarHBondContact O-CB 3.45Å; S46-F50 PolarHBondContact O-N 2.86Å; I47-F50 PolarHBondContact O-N 3.45Å; S48-F50 PolarHBondContact O-N 3.21Å; F50-D53 PolarHBondContact O-N 2.97Å; F50-L54 VanDerWaalsContact O-CB 3.3Å; F50-L54 WeakPolarHBondContact O-CB 3.48Å; F50-L54 PolarHBondContact O-N 3.04Å
51F94.7Very high88.7Confident63 Ų6354.4 Ų54.428%0.27627%0.274SS..Hα-helixtrans-63.4-45.2177.3175.3-100.3000111.9I47 S48 N49 D53 L54 I55 F494 W784I47-F51 PolarHBondContact O-N 3.02Å; S48-F51 PolarHBondContact O-N 3.04Å; N49-F51 PolarHBondContact O-N 2.87Å; F51-D53 PolarHBondContact O-N 2.97Å; F51-L54 WeakPolarHBondContact O-CB 3.33Å; F51-L54 PolarHBondContact O-N 2.94Å; F51-I55 HydrophobicContact CD2-CG2 4.38Å; F51-I55 HydrophobicContact CE1-CD1 4.11Å; F51-I55 HydrophobicContact CE1-CG2 4.2Å; F51-I55 HydrophobicContact CE2-CG2 3.94Å; F51-I55 HydrophobicContact CZ-CG2 3.86Å; F51-I55 WeakPolarHBondContact O-CG2 3.34Å; F51-I55 PolarHBondContact O-N 3.14Å; F51-F494 AromaticContact CE1-CE2 3.94Å; F51-F494 HydrophobicContact CE1-CE2 3.94Å; F51-W784 AromaticContact CD1-CH2 3.74Å; F51-W784 HydrophobicContact CD1-CH2 3.74Å; F51-W784 HydrophobicContact CD1-CZ3 4.14Å; F51-W784 AromaticContact CE1-CH2 3.88Å; F51-W784 HydrophobicContact CE1-CH2 3.88Å; F51-W784 AromaticContact CE1-CZ3 3.96Å; F51-W784 HydrophobicContact CE1-CZ3 3.96Å
52L94.6Very high87.3Confident0 Ų056.3 Ų56.30%029%0.285CS..Hα-helixtrans-62.8-41.7178.3-72.8176.7000112.5S48 N49 L54 I55 R56 Y94 F494 Q501 T502 W784S48-L52 WeakPolarHBondContact O-CB 3.35Å; S48-L52 VanDerWaalsContact O-CG 3.27Å; S48-L52 WeakPolarHBondContact O-CG 3.46Å; S48-L52 PolarHBondContact O-N 3.41Å; N49-L52 PolarHBondContact O-N 2.92Å; L52-L54 VanDerWaalsContact C-N 3.34Å; L52-I55 HydrophobicContact CD2-CD1 3.98Å; L52-I55 VanDerWaalsContact O-CG1 3.22Å; L52-I55 WeakPolarHBondContact O-CG1 3.49Å; L52-R56 VanDerWaalsContact O-CB 3.25Å; L52-R56 WeakPolarHBondContact O-CB 3.23Å; L52-R56 PolarHBondContact O-N 3.46Å; L52-R56 VanDerWaalsContact O-N 3.07Å; L52-Y94 HydrophobicContact CD2-CE1 4.49Å; L52-F494 HydrophobicContact CD2-CD2 4.49Å; L52-F494 HydrophobicContact CD2-CE2 4.19Å; L52-Q501 HydrophobicContact CD1-CB 3.89Å; L52-Q501 HydrophobicContact CD1-CG 3.72Å; L52-T502 HydrophobicContact CB-CG2 3.74Å; L52-W784 HydrophobicContact CD1-CZ2 4.24Å; L52-W784 HydrophobicContact CD2-CH2 3.99Å; L52-W784 HydrophobicContact CD2-CZ2 3.85Å; L52-W784 HydrophobicContact CG-CH2 4.33Å; L52-W784 HydrophobicContact CG-CZ2 4.15Å
53D90.6Very high86Confident49 Ų4952.8 Ų52.826%0.26227%0.274SS..Hα-helixtrans-68.4-35176.7-70.2-23.3000111.6N49 F50 F51 G57 R506 R511N49-D53 WeakPolarHBondContact O-CB 3.41Å; N49-D53 PolarHBondContact O-N 3.24Å; F50-D53 PolarHBondContact O-N 2.97Å; F51-D53 PolarHBondContact O-N 2.97Å; D53-G57 PolarHBondContact O-N 2.88Å; D53-R506 WeakPolarHBondContact OD1-CD 3.44Å; D53-R511 VanDerWaalsContact CG-NH1 3.32Å; D53-R511 IonicContact OD1-NH1 3.17Å; D53-R511 PolarHBondContact OD1-NH1 2.89Å; D53-R511 VanDerWaalsContact OD1-NH1 3.17Å; D53-R511 IonicContact OD2-CZ 2.89Å; D53-R511 IonicContact OD2-NH1 3.05Å; D53-R511 PolarHBondContact OD2-NH1 3.42Å
54L91.4Very high84.6Confident119 Ų11947.9 Ų47.962%0.62325%0.252SS*.Hα-helixtrans-64.3-49.6175-178.468.9000111.8F50 F51 L52 R56F50-L54 VanDerWaalsContact O-CB 3.3Å; F50-L54 WeakPolarHBondContact O-CB 3.48Å; F50-L54 PolarHBondContact O-N 3.04Å; F51-L54 WeakPolarHBondContact O-CB 3.33Å; F51-L54 PolarHBondContact O-N 2.94Å; L52-L54 VanDerWaalsContact C-N 3.34Å; L54-R56 VanDerWaalsContact C-N 3.33Å; L54-R56 PolarHBondContact O-N 3.33Å
55I91.3Very high82.9Confident21 Ų2148 Ų4811%0.10825%0.252CS..Hα-helixtrans-70.1-30.9-178.164.2174.4000112.4F51 L52 G93 Y94 F494F51-I55 HydrophobicContact CD2-CG2 4.38Å; F51-I55 HydrophobicContact CE1-CD1 4.11Å; F51-I55 HydrophobicContact CE1-CG2 4.2Å; F51-I55 HydrophobicContact CE2-CG2 3.94Å; F51-I55 HydrophobicContact CZ-CG2 3.86Å; F51-I55 WeakPolarHBondContact O-CG2 3.34Å; F51-I55 PolarHBondContact O-N 3.14Å; L52-I55 HydrophobicContact CD2-CD1 3.98Å; L52-I55 VanDerWaalsContact O-CG1 3.22Å; L52-I55 WeakPolarHBondContact O-CG1 3.49Å; I55-G93 WeakPolarHBondContact O-CA 3.4Å; I55-Y94 HydrophobicContact CD1-CD1 3.96Å; I55-Y94 HydrophobicContact CD1-CD2 4.08Å; I55-Y94 HydrophobicContact CD1-CE1 3.7Å; I55-Y94 HydrophobicContact CD1-CE2 3.82Å; I55-Y94 HydrophobicContact CD1-CG 4.13Å; I55-Y94 HydrophobicContact CG1-CD2 4.31Å; I55-Y94 HydrophobicContact CG1-CE2 3.99Å; I55-F494 HydrophobicContact CD1-CE2 3.54Å; I55-F494 HydrophobicContact CD1-CZ 3.67Å
56R87.9Confident81.3Confident5 Ų553.4 Ų53.42%0.01928%0.277CS..Hα-helixtrans-82.3-32.7-179.3-175.658.9178.169.60.5112.9L52 L54 Y94 T502 E503L52-R56 VanDerWaalsContact O-CB 3.25Å; L52-R56 WeakPolarHBondContact O-CB 3.23Å; L52-R56 PolarHBondContact O-N 3.46Å; L52-R56 VanDerWaalsContact O-N 3.07Å; L54-R56 VanDerWaalsContact C-N 3.33Å; L54-R56 PolarHBondContact O-N 3.33Å; R56-Y94 HydrophobicContact CB-CE2 4.19Å; R56-T502 HydrophobicContact CB-CG2 3.98Å; R56-T502 HydrophobicContact CG-CG2 4.33Å; R56-E503 IonicContact CZ-OE1 2.79Å; R56-E503 IonicContact CZ-OE2 3.41Å; R56-E503 IonicContact NE-OE1 2.68Å; R56-E503 PolarHBondContact NE-OE1 3.13Å; R56-E503 IonicContact NE-OE2 3.89Å; R56-E503 IonicContact NH2-OE1 3.88Å; R56-E503 PolarHBondContact NH2-OE1 3.44Å; R56-E503 IonicContact NH2-OE2 2.9Å; R56-E503 PolarHBondContact NH2-OE2 2.76Å; R56-E503 VanDerWaalsContact NH2-OE2 3.16Å
57G84.2Confident79.9Confident28 Ų2850.4 Ų50.429%0.28926%0.256SS..  trans69.6-171.4-175.900000114.1D53 R506D53-G57 PolarHBondContact O-N 2.88Å; G57-R506 PolarHBondContact O-NH1 2.91Å
58K78.8Confident78.4Confident183 Ų18348.9 Ų48.980%0.79625%0.249SC*.SBendtrans-97.2-0.2-171.8-64.6-174.7178-177.20115.1Y512K58-Y512 PolarHBondContact O-OH 3.4Å
59K74.8Confident76.7Confident92 Ų9249.6 Ų49.640%0.425%0.253SS..  trans-62.6134.2-178.9-74.2-177.3175.3175.30110.7T89 T90K59-T89 VanDerWaalsContact NZ-CB 3.26Å; K59-T89 PolarHBondContact NZ-OG1 2.88Å; K59-T90 HydrophobicContact CB-CG2 4.45Å
60P67.4Low75.1Confident49 Ų4953.2 Ų53.232%0.31827%0.272SS..  trans-67.1156.2-179.629.7-35.2000111T62P60-T62 VanDerWaalsContact C-N 3.27Å; P60-T62 PolarHBondContact O-N 3.45Å
61P65.4Low73.6Confident3 Ų348.1 Ų48.12%0.01925%0.251CS..THydrogen-bonded Turntrans-69.8-26.2-177.527.9-29.6000112.1A63 V64 Y507 Y522P61-A63 VanDerWaalsContact C-N 3.29Å; P61-A63 PolarHBondContact O-N 3.33Å; P61-V64 WeakPolarHBondContact O-CB 3.3Å; P61-V64 PolarHBondContact O-N 2.93Å; P61-V64 VanDerWaalsContact O-N 3.15Å; P61-Y507 VanDerWaalsContact CD-OH 3.27Å; P61-Y507 WeakPolarHBondContact CD-OH 3.3Å; P61-Y507 HydrophobicContact CG-CE1 4.02Å; P61-Y507 HydrophobicContact CG-CE2 4.26Å; P61-Y522 HydrophobicContact CB-CD2 3.69Å; P61-Y522 HydrophobicContact CB-CE2 3.92Å; P61-Y522 HydrophobicContact CB-CG 4.08Å; P61-Y522 HydrophobicContact CG-CD2 4.12Å; P61-Y522 HydrophobicContact CG-CG 4.17Å; P61-Y522 VanDerWaalsContact O-CE2 3.32Å; P61-Y522 WeakPolarHBondContact O-CE2 3.4Å
62T64.6Low72Confident41 Ų4152.4 Ų52.425%0.25227%0.272SS..Hα-helixtrans-54.8-38.6-179.651.20000113.8P60 V64 F65 E66P60-T62 VanDerWaalsContact C-N 3.27Å; P60-T62 PolarHBondContact O-N 3.45Å; T62-V64 VanDerWaalsContact C-N 3.3Å; T62-V64 PolarHBondContact O-N 3.37Å; T62-F65 PolarHBondContact O-N 2.81Å; T62-F65 VanDerWaalsContact O-N 3.14Å; T62-E66 PolarHBondContact O-N 2.93Å
63A64.1Low70.3Confident28 Ų2855.1 Ų55.123%0.23129%0.289CS..Hα-helixtrans-62.8-33.5-179.200000113.6P61 F65 T67 P86P61-A63 VanDerWaalsContact C-N 3.29Å; P61-A63 PolarHBondContact O-N 3.33Å; A63-F65 VanDerWaalsContact C-N 3.34Å; A63-T67 PolarHBondContact O-OG1 3.17Å; A63-P86 HydrophobicContact CB-CB 4.42Å
64V64.3Low68.7Low3 Ų354.7 Ų54.72%0.01829%0.289CS..Hα-helixtrans-69.6-37.1178.2178.60000110.4P61 T62 T67 L68 V87 T90 Y91P61-V64 WeakPolarHBondContact O-CB 3.3Å; P61-V64 PolarHBondContact O-N 2.93Å; P61-V64 VanDerWaalsContact O-N 3.15Å; T62-V64 VanDerWaalsContact C-N 3.3Å; T62-V64 PolarHBondContact O-N 3.37Å; V64-T67 WeakPolarHBondContact O-CB 3.35Å; V64-L68 HydrophobicContact CG1-CD1 3.94Å; V64-L68 PolarHBondContact O-N 2.95Å; V64-L68 VanDerWaalsContact O-N 3.08Å; V64-V87 HydrophobicContact CB-CG2 4.4Å; V64-V87 HydrophobicContact CG1-CB 4.48Å; V64-V87 HydrophobicContact CG1-CG1 4.32Å; V64-V87 HydrophobicContact CG1-CG2 3.83Å; V64-V87 WeakPolarHBondContact O-CG2 3.11Å; V64-T90 HydrophobicContact CG2-CG2 3.47Å; V64-T90 VanDerWaalsContact CG2-CG2 3.47Å; V64-Y91 HydrophobicContact CG1-CE2 3.7Å; V64-Y91 HydrophobicContact CG2-CE2 4.05Å
65F59.9Low67Low10 Ų1057.8 Ų57.84%0.04430%0.3CS..Hα-helixtrans-83.3-43.6-173179.1-91.4000113.2M2 T62 A63 T67 L68 V69 Y522 S526 S529M2-F65 HydrophobicContact CE-CD2 4.39Å; M2-F65 HydrophobicContact SD-CD2 3.36Å; M2-F65 WeakPolarHBondContact SD-CD2 3.29Å; M2-F65 HydrophobicContact SD-CE2 3.43Å; M2-F65 WeakPolarHBondContact SD-CE2 3.11Å; M2-F65 HydrophobicContact SD-CG 4.42Å; T62-F65 PolarHBondContact O-N 2.81Å; T62-F65 VanDerWaalsContact O-N 3.14Å; A63-F65 VanDerWaalsContact C-N 3.34Å; F65-T67 CarbonylContact O-C 3.36Å; F65-T67 PolarHBondContact O-N 2.87Å; F65-L68 WeakPolarHBondContact O-CA 3.45Å; F65-L68 PolarHBondContact O-N 3.23Å; F65-V69 HydrophobicContact CD1-CG2 3.71Å; F65-V69 HydrophobicContact CD2-CG2 4.31Å; F65-V69 HydrophobicContact CE1-CB 4.27Å; F65-V69 HydrophobicContact CE1-CG2 2.92Å; F65-V69 HydrophobicContact CE2-CG2 3.7Å; F65-V69 HydrophobicContact CG-CG2 4.32Å; F65-V69 HydrophobicContact CZ-CB 4.43Å; F65-V69 HydrophobicContact CZ-CG2 2.95Å; F65-V69 WeakPolarHBondContact O-CG2 3.48Å; F65-V69 PolarHBondContact O-N 3.48Å; F65-Y522 HydrophobicContact CB-CD2 4.14Å; F65-Y522 HydrophobicContact CB-CE2 3.48Å; F65-Y522 VanDerWaalsContact CB-CE2 3.48Å; F65-Y522 HydrophobicContact CG-CE2 4.28Å; F65-S526 WeakPolarHBondContact CD1-OG 3.24Å; F65-S526 WeakPolarHBondContact CD2-OG 3.38Å; F65-S526 WeakPolarHBondContact CE1-OG 3.33Å; F65-S526 WeakPolarHBondContact CE2-OG 3.44Å; F65-S526 VanDerWaalsContact CG-OG 3.24Å; F65-S526 WeakPolarHBondContact CG-OG 3.45Å; F65-S526 VanDerWaalsContact CZ-CB 3.41Å; F65-S526 WeakPolarHBondContact CZ-O 3.35Å; F65-S526 WeakPolarHBondContact CZ-OG 3.39Å; F65-S529 WeakPolarHBondContact CE1-OG 3.5Å; F65-S529 WeakPolarHBondContact CZ-OG 2.74Å
66E61.6Low65Low121 Ų12163.7 Ų63.757%0.56533%0.327SS*.Hα-helixtrans-49.5-39.6171.6-74.6178.3-176.600110.5T62 N70T62-E66 PolarHBondContact O-N 2.93Å; E66-N70 VanDerWaalsContact O-CB 3.23Å; E66-N70 WeakPolarHBondContact O-CB 3.49Å; E66-N70 PolarHBondContact O-N 3.33Å; E66-N70 PolarHBondContact O-ND2 2.95Å
67T63.7Low63.5Low8 Ų869.5 Ų69.55%0.04937%0.369CS..Hα-helixtrans-63.1-53.4171.7-62.80000113.4A63 V64 F65 V69 N70 I71 S83 P86 V87A63-T67 PolarHBondContact O-OG1 3.17Å; V64-T67 WeakPolarHBondContact O-CB 3.35Å; F65-T67 CarbonylContact O-C 3.36Å; F65-T67 PolarHBondContact O-N 2.87Å; T67-V69 VanDerWaalsContact C-N 3.31Å; T67-V69 PolarHBondContact O-N 2.99Å; T67-N70 PolarHBondContact O-N 2.79Å; T67-I71 HydrophobicContact CG2-CD1 3.65Å; T67-I71 HydrophobicContact CG2-CG1 4.42Å; T67-I71 WeakPolarHBondContact O-CB 3.25Å; T67-I71 WeakPolarHBondContact O-CG1 3.26Å; T67-I71 PolarHBondContact O-N 2.97Å; T67-S83 WeakPolarHBondContact CG2-O 3.24Å; T67-S83 PolarHBondContact OG1-O 3.39Å; T67-P86 WeakPolarHBondContact OG1-CB 3.17Å; T67-P86 VanDerWaalsContact OG1-CG 3.25Å; T67-P86 WeakPolarHBondContact OG1-CG 3.28Å; T67-V87 HydrophobicContact CG2-CB 4.35Å; T67-V87 HydrophobicContact CG2-CG2 3.32Å
68L62.6Low62.1Low39 Ų3978.8 Ų78.820%0.20440%0.395CS..Hα-helixtrans-59.6-39.7-178.7-87.1156.4000112.6V64 F65 I71 Q72V64-L68 HydrophobicContact CG1-CD1 3.94Å; V64-L68 PolarHBondContact O-N 2.95Å; V64-L68 VanDerWaalsContact O-N 3.08Å; F65-L68 WeakPolarHBondContact O-CA 3.45Å; F65-L68 PolarHBondContact O-N 3.23Å; L68-I71 WeakPolarHBondContact O-CB 3.47Å; L68-I71 PolarHBondContact O-N 3.46Å; L68-Q72 PolarHBondContact O-N 3.2Å
69V60.6Low61.2Low16 Ų1674.3 Ų74.310%0.09738%0.379CS..Hα-helixtrans-63.4-54.2172.9173.40000110.3F65 T67 I71 Q72 T73 S529F65-V69 HydrophobicContact CD1-CG2 3.71Å; F65-V69 HydrophobicContact CD2-CG2 4.31Å; F65-V69 HydrophobicContact CE1-CB 4.27Å; F65-V69 HydrophobicContact CE1-CG2 2.92Å; F65-V69 HydrophobicContact CE2-CG2 3.7Å; F65-V69 HydrophobicContact CG-CG2 4.32Å; F65-V69 HydrophobicContact CZ-CB 4.43Å; F65-V69 HydrophobicContact CZ-CG2 2.95Å; F65-V69 WeakPolarHBondContact O-CG2 3.48Å; F65-V69 PolarHBondContact O-N 3.48Å; T67-V69 VanDerWaalsContact C-N 3.31Å; T67-V69 PolarHBondContact O-N 2.99Å; V69-I71 PolarHBondContact O-N 3.18Å; V69-I71 VanDerWaalsContact O-N 3.1Å; V69-Q72 CarbonylContact O-C 3.55Å; V69-Q72 PolarHBondContact O-N 3.14Å; V69-T73 HydrophobicContact CG1-CG2 3.88Å; V69-T73 WeakPolarHBondContact O-CG2 3.25Å; V69-T73 PolarHBondContact O-N 3.27Å; V69-T73 PolarHBondContact O-OG1 3.32Å; V69-S529 WeakPolarHBondContact CG2-OG 3.11Å
70N60.8Low60.6Low96 Ų9673.1 Ų73.151%0.51339%0.386SS..Hα-helixtrans-55.4-34-179.1-74.3-21.8000110.7E66 T67 S74E66-N70 VanDerWaalsContact O-CB 3.23Å; E66-N70 WeakPolarHBondContact O-CB 3.49Å; E66-N70 PolarHBondContact O-N 3.33Å; E66-N70 PolarHBondContact O-ND2 2.95Å; T67-N70 PolarHBondContact O-N 2.79Å; N70-S74 WeakPolarHBondContact O-CB 3.45Å; N70-S74 PolarHBondContact O-N 3.11Å; N70-S74 PolarHBondContact O-OG 3.33Å
71I63.1Low60.7Low36 Ų3678.1 Ų78.119%0.18540%0.4CS..Hα-helixtrans-67.4-52.4172.3-71.3167.5000111.8T67 L68 V69 T73 S74 L79 V84T67-I71 HydrophobicContact CG2-CD1 3.65Å; T67-I71 HydrophobicContact CG2-CG1 4.42Å; T67-I71 WeakPolarHBondContact O-CB 3.25Å; T67-I71 WeakPolarHBondContact O-CG1 3.26Å; T67-I71 PolarHBondContact O-N 2.97Å; L68-I71 WeakPolarHBondContact O-CB 3.47Å; L68-I71 PolarHBondContact O-N 3.46Å; V69-I71 PolarHBondContact O-N 3.18Å; V69-I71 VanDerWaalsContact O-N 3.1Å; I71-T73 PolarHBondContact O-N 2.79Å; I71-S74 PolarHBondContact O-N 3.13Å; I71-S74 PolarHBondContact O-OG 3.47Å; I71-L79 HydrophobicContact CB-CD2 4.14Å; I71-L79 HydrophobicContact CD1-CD2 3.91Å; I71-L79 HydrophobicContact CG1-CD2 3.7Å; I71-L79 HydrophobicContact CG1-CG 4.19Å; I71-L79 HydrophobicContact CG2-CD1 4.4Å; I71-L79 HydrophobicContact CG2-CD2 3.44Å; I71-L79 VanDerWaalsContact CG2-CD2 3.44Å; I71-L79 HydrophobicContact CG2-CG 4.06Å; I71-V84 HydrophobicContact CD1-CB 4.39Å; I71-V84 HydrophobicContact CD1-CG1 4.08Å; I71-V84 HydrophobicContact CD1-CG2 4.09Å
72Q60.1Low60.7Low153 Ų15388 Ų8872%0.71544%0.437SS*.Hα-helixtrans-66.5-34.1-177.6-79.6-171-6900113.5L68 V69L68-Q72 PolarHBondContact O-N 3.2Å; V69-Q72 CarbonylContact O-C 3.55Å; V69-Q72 PolarHBondContact O-N 3.14Å
73T58.4Low60.8Low58 Ų5887.6 Ų87.636%0.35644%0.436SS..Hα-helixtrans-86.9-19179.261.10000112.5V69 I71 H75 A533V69-T73 HydrophobicContact CG1-CG2 3.88Å; V69-T73 WeakPolarHBondContact O-CG2 3.25Å; V69-T73 PolarHBondContact O-N 3.27Å; V69-T73 PolarHBondContact O-OG1 3.32Å; I71-T73 PolarHBondContact O-N 2.79Å; T73-H75 PolarHBondContact O-N 3.41Å; T73-H75 VanDerWaalsContact O-N 3.07Å; T73-A533 HydrophobicContact CG2-CB 3.55Å
74S57Low61.2Low39 Ų3988.1 Ų88.127%0.27344%0.436SS..  trans-67.3111.6175.170.30000110.7N70 I71 H76N70-S74 WeakPolarHBondContact O-CB 3.45Å; N70-S74 PolarHBondContact O-N 3.11Å; N70-S74 PolarHBondContact O-OG 3.33Å; I71-S74 PolarHBondContact O-N 3.13Å; I71-S74 PolarHBondContact O-OG 3.47Å; S74-H76 PolarHBondContact O-N 3.12Å
75H55.7Low61.8Low185 Ų18592 Ų9286%0.85645%0.454SS*.  trans-66.61.7167.8-80.4-81.9000113.6T73T73-H75 PolarHBondContact O-N 3.41Å; T73-H75 VanDerWaalsContact O-N 3.07Å
76H50.8Low62.4Low144 Ų14493.4 Ų93.467%0.66746%0.464SS*.  trans-83.9120.1-175.3-68.380.5000110S74 R78S74-H76 PolarHBondContact O-N 3.12Å; H76-R78 PolarHBondContact O-N 3.3Å
77S56.5Low62.9Low128 Ų12888.8 Ų88.890%0.89544%0.444SS*.SBendtrans-60.6-8.5178.455.80000114.8
78R55Low63.5Low223 Ų22391.4 Ų91.484%0.84246%0.46SS*.SBendtrans-124.2106.5173-77.5-178.3177.4164.8-0.2110.1H76 A80H76-R78 PolarHBondContact O-N 3.3Å; R78-A80 PolarHBondContact O-N 3.38Å
79L58.2Low64.4Low89 Ų8991.9 Ų91.947%0.46646%0.464SS..  trans-63.8112.8163.3-78.468.4000108.2I71 V84I71-L79 HydrophobicContact CB-CD2 4.14Å; I71-L79 HydrophobicContact CD1-CD2 3.91Å; I71-L79 HydrophobicContact CG1-CD2 3.7Å; I71-L79 HydrophobicContact CG1-CG 4.19Å; I71-L79 HydrophobicContact CG2-CD1 4.4Å; I71-L79 HydrophobicContact CG2-CD2 3.44Å; I71-L79 VanDerWaalsContact CG2-CD2 3.44Å; I71-L79 HydrophobicContact CG2-CG 4.06Å; L79-V84 HydrophobicContact CB-CG2 4.43Å; L79-V84 HydrophobicContact CD2-CG2 4.14Å
80A63.9Low65.3Low66 Ų6691.2 Ų91.255%0.54546%0.46SS..  trans-66.5136.9169.700000109.3R78 R82 S83R78-A80 PolarHBondContact O-N 3.38Å; A80-R82 PolarHBondContact O-N 3.35Å; A80-S83 WeakPolarHBondContact O-CB 3.44Å; A80-S83 PolarHBondContact O-N 3.32Å; A80-S83 PolarHBondContact O-OG 3.05Å
81Y67.7Low66.6Low155 Ų15589 Ų8961%0.60845%0.445SS*.Hα-helixtrans-48.8-36-179.5174.3-97.7000113.8S83 V84 E85Y81-S83 PolarHBondContact O-N 3.17Å; Y81-S83 VanDerWaalsContact O-N 3.15Å; Y81-V84 PolarHBondContact O-N 3.48Å; Y81-E85 HydrophobicContact CE1-CB 4.11Å; Y81-E85 HydrophobicContact CE1-CG 4.2Å; Y81-E85 PolarHBondContact O-N 2.89Å
82R66.5Low67.7Low210 Ų21091.9 Ų91.979%0.79246%0.46SS*.Hα-helixtrans-55.5-29.4176.1-177.4177.8-84177.8-5.9113.1A80A80-R82 PolarHBondContact O-N 3.35Å
83S67.3Low69.1Low33 Ų3385.3 Ų85.323%0.23143%0.434CS..Hα-helixtrans-68.9-46.2173.767.50000110.4T67 A80 Y81 P86T67-S83 WeakPolarHBondContact CG2-O 3.24Å; T67-S83 PolarHBondContact OG1-O 3.39Å; A80-S83 WeakPolarHBondContact O-CB 3.44Å; A80-S83 PolarHBondContact O-N 3.32Å; A80-S83 PolarHBondContact O-OG 3.05Å; Y81-S83 PolarHBondContact O-N 3.17Å; Y81-S83 VanDerWaalsContact O-N 3.15Å; S83-P86 VanDerWaalsContact O-CD 3.26Å; S83-P86 WeakPolarHBondContact O-CD 3.48Å
84V71.8Confident70.8Confident39 Ų3983 Ų8324%0.23642%0.419CS..Hα-helixtrans-82.7-16-173.1-146.70000114.1I71 L79 Y81 P86 V87 V88I71-V84 HydrophobicContact CD1-CB 4.39Å; I71-V84 HydrophobicContact CD1-CG1 4.08Å; I71-V84 HydrophobicContact CD1-CG2 4.09Å; L79-V84 HydrophobicContact CB-CG2 4.43Å; L79-V84 HydrophobicContact CD2-CG2 4.14Å; Y81-V84 PolarHBondContact O-N 3.48Å; V84-P86 VanDerWaalsContact C-CD 3.46Å; V84-V87 PolarHBondContact O-N 2.95Å; V84-V88 HydrophobicContact CB-CG2 4.47Å; V84-V88 HydrophobicContact CG1-CG2 4.11Å; V84-V88 WeakPolarHBondContact O-CG2 3.5Å; V84-V88 PolarHBondContact O-N 2.75Å
85E76.4Confident72.4Confident85 Ų8582.9 Ų82.940%0.39742%0.424SS..Hα-helixtrans-48.8-44.9-177.5-179.2-176.3173.700113.9Y81 V87 V88 T89Y81-E85 HydrophobicContact CE1-CB 4.11Å; Y81-E85 HydrophobicContact CE1-CG 4.2Å; Y81-E85 PolarHBondContact O-N 2.89Å; E85-V87 PolarHBondContact O-N 3.04Å; E85-V88 PolarHBondContact O-N 3.4Å; E85-T89 HydrophobicContact CG-CG2 4.03Å; E85-T89 WeakPolarHBondContact O-CB 3.5Å; E85-T89 WeakPolarHBondContact O-CG2 3.42Å; E85-T89 PolarHBondContact O-N 3.35Å; E85-T89 PolarHBondContact O-OG1 2.86Å
86P72.1Confident74.2Confident38 Ų3877.8 Ų77.825%0.24740%0.402CS..Hα-helixtrans-64.2-38.8179.5-22.335.9000112.3A63 T67 S83 V84 T89 T90A63-P86 HydrophobicContact CB-CB 4.42Å; T67-P86 WeakPolarHBondContact OG1-CB 3.17Å; T67-P86 VanDerWaalsContact OG1-CG 3.25Å; T67-P86 WeakPolarHBondContact OG1-CG 3.28Å; S83-P86 VanDerWaalsContact O-CD 3.26Å; S83-P86 WeakPolarHBondContact O-CD 3.48Å; V84-P86 VanDerWaalsContact C-CD 3.46Å; P86-T89 PolarHBondContact O-OG1 3.21Å; P86-T90 WeakPolarHBondContact O-CB 3.41Å; P86-T90 PolarHBondContact O-N 2.79Å; P86-T90 VanDerWaalsContact O-N 3.12Å; P86-T90 PolarHBondContact O-OG1 3.14Å
87V74Confident76.3Confident24 Ų2472.5 Ų72.515%0.14538%0.38CS..Hα-helixtrans-65.9-49.6176.9177.40000110.2V64 T67 V84 E85 T89 T90 Y91V64-V87 HydrophobicContact CB-CG2 4.4Å; V64-V87 HydrophobicContact CG1-CB 4.48Å; V64-V87 HydrophobicContact CG1-CG1 4.32Å; V64-V87 HydrophobicContact CG1-CG2 3.83Å; V64-V87 WeakPolarHBondContact O-CG2 3.11Å; T67-V87 HydrophobicContact CG2-CB 4.35Å; T67-V87 HydrophobicContact CG2-CG2 3.32Å; V84-V87 PolarHBondContact O-N 2.95Å; E85-V87 PolarHBondContact O-N 3.04Å; V87-T89 PolarHBondContact O-N 3.2Å; V87-T90 PolarHBondContact O-N 2.88Å; V87-T90 VanDerWaalsContact O-N 3.12Å; V87-Y91 HydrophobicContact CG1-CD2 4.01Å; V87-Y91 HydrophobicContact CG1-CE2 4.35Å; V87-Y91 WeakPolarHBondContact O-CD2 3.27Å; V87-Y91 PolarHBondContact O-N 3.38Å
88V76.3Confident78.1Confident64 Ų6468.9 Ų68.939%0.38835%0.351SS..Hα-helixtrans-61.7-45.6-177.71750000110.9V84 E85 T90 L92V84-V88 HydrophobicContact CB-CG2 4.47Å; V84-V88 HydrophobicContact CG1-CG2 4.11Å; V84-V88 WeakPolarHBondContact O-CG2 3.5Å; V84-V88 PolarHBondContact O-N 2.75Å; E85-V88 PolarHBondContact O-N 3.4Å; V88-T90 PolarHBondContact O-N 3.21Å; V88-L92 WeakPolarHBondContact O-CA 3.33Å; V88-L92 WeakPolarHBondContact O-CB 3.42Å; V88-L92 PolarHBondContact O-N 3.48Å; V88-L92 VanDerWaalsContact O-N 3.1Å
89T79.8Confident80.1Confident48 Ų4862.1 Ų62.129%0.29433%0.334SS..Hα-helixtrans-72.2-15.2179.760.40000113.2K59 E85 P86 V87K59-T89 VanDerWaalsContact NZ-CB 3.26Å; K59-T89 PolarHBondContact NZ-OG1 2.88Å; E85-T89 HydrophobicContact CG-CG2 4.03Å; E85-T89 WeakPolarHBondContact O-CB 3.5Å; E85-T89 WeakPolarHBondContact O-CG2 3.42Å; E85-T89 PolarHBondContact O-N 3.35Å; E85-T89 PolarHBondContact O-OG1 2.86Å; P86-T89 PolarHBondContact O-OG1 3.21Å; V87-T89 PolarHBondContact O-N 3.2Å
90T81.1Confident81.8Confident3 Ų364.6 Ų64.62%0.01834%0.341CS..Hα-helixtrans-90.1-36.5-179.9-65.20000112.2K59 V64 P86 V87 V88K59-T90 HydrophobicContact CB-CG2 4.45Å; V64-T90 HydrophobicContact CG2-CG2 3.47Å; V64-T90 VanDerWaalsContact CG2-CG2 3.47Å; P86-T90 WeakPolarHBondContact O-CB 3.41Å; P86-T90 PolarHBondContact O-N 2.79Å; P86-T90 VanDerWaalsContact O-N 3.12Å; P86-T90 PolarHBondContact O-OG1 3.14Å; V87-T90 PolarHBondContact O-N 2.88Å; V87-T90 VanDerWaalsContact O-N 3.12Å; V88-T90 PolarHBondContact O-N 3.21Å
91Y86.4Confident83.3Confident48 Ų4861.8 Ų61.819%0.18832%0.319CS..SBendtrans-98.513.5175.3-66.2-73.2000113.8V64 V87 G93 Y94 G95 E503V64-Y91 HydrophobicContact CG1-CE2 3.7Å; V64-Y91 HydrophobicContact CG2-CE2 4.05Å; V87-Y91 HydrophobicContact CG1-CD2 4.01Å; V87-Y91 HydrophobicContact CG1-CE2 4.35Å; V87-Y91 WeakPolarHBondContact O-CD2 3.27Å; V87-Y91 PolarHBondContact O-N 3.38Å; Y91-G93 VanDerWaalsContact C-N 3.27Å; Y91-G93 PolarHBondContact O-N 3.49Å; Y91-Y94 HydrophobicContact CD1-CD2 4.15Å; Y91-Y94 PolarHBondContact O-N 2.91Å; Y91-Y94 VanDerWaalsContact O-N 3.13Å; Y91-G95 PolarHBondContact O-N 2.98Å; Y91-E503 WeakPolarHBondContact CE1-OE1 3.45Å; Y91-E503 PolarHBondContact OH-OE1 3.25Å
92L86.3Confident84.7Confident97 Ų9758.4 Ų58.451%0.50831%0.311SS..Hα-helixtrans-54.4-43.2-175.9-175.963.5000112.1V88 G95 I96V88-L92 WeakPolarHBondContact O-CA 3.33Å; V88-L92 WeakPolarHBondContact O-CB 3.42Å; V88-L92 PolarHBondContact O-N 3.48Å; V88-L92 VanDerWaalsContact O-N 3.1Å; L92-G95 PolarHBondContact O-N 3.38Å; L92-I96 HydrophobicContact CD1-CD1 4.22Å; L92-I96 HydrophobicContact CD1-CG1 4.41Å; L92-I96 HydrophobicContact CD2-CD1 4.48Å; L92-I96 HydrophobicContact CG-CD1 3.85Å; L92-I96 HydrophobicContact CG-CG1 4.45Å; L92-I96 VanDerWaalsContact O-CG1 3.25Å; L92-I96 WeakPolarHBondContact O-CG1 3.36Å; L92-I96 PolarHBondContact O-N 3.46Å
93G91.1Very high86.2Confident15 Ų1552 Ų5216%0.15529%0.292CS..Hα-helixtrans-64-42.8178.800000113.4I55 Y91 G95 I96 C97I55-G93 WeakPolarHBondContact O-CA 3.4Å; Y91-G93 VanDerWaalsContact C-N 3.27Å; Y91-G93 PolarHBondContact O-N 3.49Å; G93-G95 VanDerWaalsContact C-N 3.34Å; G93-G95 PolarHBondContact O-N 2.94Å; G93-I96 PolarHBondContact O-N 3Å; G93-C97 PolarHBondContact O-N 3.4Å; G93-C97 PolarHBondContact O-SG 3.33Å
94Y92.5Very high87.5Confident11 Ų1151.7 Ų51.74%0.04329%0.287CS..Hα-helixtrans-60.7-44.2173-80.8-84.7000112L52 I55 R56 Y91 I96 C97 L98 F494 G498 T499 T502L52-Y94 HydrophobicContact CD2-CE1 4.49Å; I55-Y94 HydrophobicContact CD1-CD1 3.96Å; I55-Y94 HydrophobicContact CD1-CD2 4.08Å; I55-Y94 HydrophobicContact CD1-CE1 3.7Å; I55-Y94 HydrophobicContact CD1-CE2 3.82Å; I55-Y94 HydrophobicContact CD1-CG 4.13Å; I55-Y94 HydrophobicContact CG1-CD2 4.31Å; I55-Y94 HydrophobicContact CG1-CE2 3.99Å; R56-Y94 HydrophobicContact CB-CE2 4.19Å; Y91-Y94 HydrophobicContact CD1-CD2 4.15Å; Y91-Y94 PolarHBondContact O-N 2.91Å; Y91-Y94 VanDerWaalsContact O-N 3.13Å; Y94-I96 PolarHBondContact O-N 2.99Å; Y94-C97 PolarHBondContact O-N 2.78Å; Y94-L98 WeakPolarHBondContact O-CB 3.24Å; Y94-L98 PolarHBondContact O-N 3.19Å; Y94-F494 AromaticContact CD1-CE1 3.86Å; Y94-F494 HydrophobicContact CD1-CE1 3.86Å; Y94-F494 HydrophobicContact CD1-CE2 4.05Å; Y94-F494 AromaticContact CD1-CZ 3.4Å; Y94-F494 HydrophobicContact CD1-CZ 3.4Å; Y94-F494 VanDerWaalsContact CD1-CZ 3.4Å; Y94-F494 HydrophobicContact CE1-CE1 4.38Å; Y94-F494 AromaticContact CE1-CE2 3.84Å; Y94-F494 HydrophobicContact CE1-CE2 3.84Å; Y94-F494 AromaticContact CE1-CZ 3.69Å; Y94-F494 HydrophobicContact CE1-CZ 3.69Å; Y94-F494 HydrophobicContact CG-CZ 4.33Å; Y94-G498 PolarHBondContact OH-O 3.41Å; Y94-T499 HydrophobicContact CD1-CG2 4.39Å; Y94-T499 HydrophobicContact CE1-CG2 4.09Å; Y94-T502 WeakPolarHBondContact OH-CG2 3.27Å; Y94-T502 PolarHBondContact OH-OG1 3.35Å
95G91.5Very high88.7Confident36 Ų3650.5 Ų50.537%0.37128%0.281SS..Hα-helixtrans-60.1-44.7176.800000112.1Y91 L92 G93 L98 V99Y91-G95 PolarHBondContact O-N 2.98Å; L92-G95 PolarHBondContact O-N 3.38Å; G93-G95 VanDerWaalsContact C-N 3.34Å; G93-G95 PolarHBondContact O-N 2.94Å; G95-L98 PolarHBondContact O-N 2.64Å; G95-V99 VanDerWaalsContact O-CG2 3.31Å; G95-V99 WeakPolarHBondContact O-CG2 3.46Å; G95-V99 PolarHBondContact O-N 3.25Å
96I93Very high89.6Confident77 Ų7751.1 Ų51.140%0.39529%0.286SS..Hα-helixtrans-61.2-49.7176.6-70.8168.1000110.7L92 G93 Y94 L98 V99 F100L92-I96 HydrophobicContact CD1-CD1 4.22Å; L92-I96 HydrophobicContact CD1-CG1 4.41Å; L92-I96 HydrophobicContact CD2-CD1 4.48Å; L92-I96 HydrophobicContact CG-CD1 3.85Å; L92-I96 HydrophobicContact CG-CG1 4.45Å; L92-I96 VanDerWaalsContact O-CG1 3.25Å; L92-I96 WeakPolarHBondContact O-CG1 3.36Å; L92-I96 PolarHBondContact O-N 3.46Å; G93-I96 PolarHBondContact O-N 3Å; Y94-I96 PolarHBondContact O-N 2.99Å; I96-L98 VanDerWaalsContact C-N 3.34Å; I96-L98 PolarHBondContact O-N 3.2Å; I96-V99 PolarHBondContact O-N 3.49Å; I96-F100 HydrophobicContact CG2-CD2 3.52Å; I96-F100 HydrophobicContact CG2-CE2 3.44Å; I96-F100 VanDerWaalsContact CG2-CE2 3.44Å; I96-F100 VanDerWaalsContact O-CD2 3.22Å; I96-F100 WeakPolarHBondContact O-CD2 3.18Å; I96-F100 PolarHBondContact O-N 3.3Å
97C94.5Very high90.7Very high33 Ų3354.8 Ų54.822%0.22330%0.298CS..Hα-helixtrans-61-41.5178.8-69.40000112.3G93 Y94 F100 G101 F494G93-C97 PolarHBondContact O-N 3.4Å; G93-C97 PolarHBondContact O-SG 3.33Å; Y94-C97 PolarHBondContact O-N 2.78Å; C97-F100 PolarHBondContact O-N 3.15Å; C97-G101 PolarHBondContact O-N 3.24Å; C97-F494 HydrophobicContact CB-CE1 3.91Å; C97-F494 HydrophobicContact CB-CZ 3.74Å
98L95.4Very high91.7Very high52 Ų5254.3 Ų54.327%0.27229%0.294SS..Hα-helixtrans-62.7-45.7176.7179.960.3000111.5Y94 G95 I96 G101 L102 I491 L495Y94-L98 WeakPolarHBondContact O-CB 3.24Å; Y94-L98 PolarHBondContact O-N 3.19Å; G95-L98 PolarHBondContact O-N 2.64Å; I96-L98 VanDerWaalsContact C-N 3.34Å; I96-L98 PolarHBondContact O-N 3.2Å; L98-G101 PolarHBondContact O-N 3.49Å; L98-L102 HydrophobicContact CD1-CD1 4.16Å; L98-L102 HydrophobicContact CD1-CG 4.2Å; L98-L102 HydrophobicContact CG-CD1 4.08Å; L98-L102 WeakPolarHBondContact O-CB 3.37Å; L98-L102 VanDerWaalsContact O-CG 3.31Å; L98-L102 WeakPolarHBondContact O-CG 3.26Å; L98-L102 PolarHBondContact O-N 3.23Å; L98-I491 HydrophobicContact CD1-CG2 3.66Å; L98-L495 HydrophobicContact CD1-CD1 4.06Å; L98-L495 HydrophobicContact CD1-CD2 4.5Å
99V95.8Very high92.4Very high81 Ų8153.1 Ų53.149%0.49129%0.288SS..Hα-helixtrans-61.2-47.7176.6170.80000110.3G95 I96 G101 L102 L103G95-V99 VanDerWaalsContact O-CG2 3.31Å; G95-V99 WeakPolarHBondContact O-CG2 3.46Å; G95-V99 PolarHBondContact O-N 3.25Å; I96-V99 PolarHBondContact O-N 3.49Å; V99-G101 VanDerWaalsContact C-N 3.34Å; V99-G101 PolarHBondContact O-N 3.01Å; V99-L102 PolarHBondContact O-N 3.02Å; V99-L103 HydrophobicContact CG1-CD1 3.77Å; V99-L103 HydrophobicContact CG1-CG 4.1Å; V99-L103 WeakPolarHBondContact O-CB 3.39Å; V99-L103 WeakPolarHBondContact O-CG 3.47Å; V99-L103 PolarHBondContact O-N 2.7Å
100F95Very high93.1Very high141 Ų14155 Ų5562%0.61830%0.296SS*.Hα-helixtrans-60-42.1176.8-83.1-64.2000112.8I96 C97 L103 F104I96-F100 HydrophobicContact CG2-CD2 3.52Å; I96-F100 HydrophobicContact CG2-CE2 3.44Å; I96-F100 VanDerWaalsContact CG2-CE2 3.44Å; I96-F100 VanDerWaalsContact O-CD2 3.22Å; I96-F100 WeakPolarHBondContact O-CD2 3.18Å; I96-F100 PolarHBondContact O-N 3.3Å; C97-F100 PolarHBondContact O-N 3.15Å; F100-L103 PolarHBondContact O-N 2.88Å; F100-F104 VanDerWaalsContact O-CB 3.28Å; F100-F104 WeakPolarHBondContact O-CB 3.27Å; F100-F104 PolarHBondContact O-N 3.25Å
101G95.7Very high93.7Very high7 Ų758.4 Ų58.47%0.07232%0.316CS..Hα-helixtrans-62.3-45.3176.100000112.6C97 L98 V99 F104 A105 M487C97-G101 PolarHBondContact O-N 3.24Å; L98-G101 PolarHBondContact O-N 3.49Å; V99-G101 VanDerWaalsContact C-N 3.34Å; V99-G101 PolarHBondContact O-N 3.01Å; G101-F104 PolarHBondContact O-N 3.22Å; G101-A105 WeakPolarHBondContact O-CB 3.38Å; G101-A105 PolarHBondContact O-N 3.31Å; G101-M487 WeakPolarHBondContact O-CG 3.39Å
102L96.8Very high94Very high85 Ų8556.6 Ų56.645%0.44531%0.312SS..Hα-helixtrans-66-43.8177.4-70.3174000112L98 V99 F104 A105 I106 I491L98-L102 HydrophobicContact CD1-CD1 4.16Å; L98-L102 HydrophobicContact CD1-CG 4.2Å; L98-L102 HydrophobicContact CG-CD1 4.08Å; L98-L102 WeakPolarHBondContact O-CB 3.37Å; L98-L102 VanDerWaalsContact O-CG 3.31Å; L98-L102 WeakPolarHBondContact O-CG 3.26Å; L98-L102 PolarHBondContact O-N 3.23Å; V99-L102 PolarHBondContact O-N 3.02Å; L102-F104 VanDerWaalsContact C-N 3.31Å; L102-F104 PolarHBondContact O-N 3Å; L102-A105 PolarHBondContact O-N 3.47Å; L102-I106 WeakPolarHBondContact O-CB 3.49Å; L102-I106 VanDerWaalsContact O-CG1 3.29Å; L102-I106 WeakPolarHBondContact O-CG1 3.25Å; L102-I106 PolarHBondContact O-N 2.75Å; L102-I491 HydrophobicContact CD2-CD1 4.4Å
103L96.4Very high94.3Very high76 Ų7656.9 Ų56.940%0.39831%0.313SS..Hα-helixtrans-62.1-40.8175.3-68.1-180000110.8V99 F100 I106 F107V99-L103 HydrophobicContact CG1-CD1 3.77Å; V99-L103 HydrophobicContact CG1-CG 4.1Å; V99-L103 WeakPolarHBondContact O-CB 3.39Å; V99-L103 WeakPolarHBondContact O-CG 3.47Å; V99-L103 PolarHBondContact O-N 2.7Å; F100-L103 PolarHBondContact O-N 2.88Å; L103-I106 PolarHBondContact O-N 3.37Å; L103-F107 HydrophobicContact CB-CD2 4.04Å; L103-F107 HydrophobicContact CB-CE2 4.28Å; L103-F107 HydrophobicContact CD2-CD2 4.33Å; L103-F107 HydrophobicContact CD2-CE2 3.8Å; L103-F107 HydrophobicContact CG-CE2 4.49Å; L103-F107 VanDerWaalsContact O-CB 3.24Å; L103-F107 WeakPolarHBondContact O-CB 3.49Å; L103-F107 VanDerWaalsContact O-CD2 3.24Å; L103-F107 WeakPolarHBondContact O-CD2 3.48Å; L103-F107 PolarHBondContact O-N 3.4Å
104F96.5Very high94.3Very high26 Ų2660.9 Ų60.911%0.11433%0.334CS..Hα-helixtrans-61.2-48.3173.9-178.2-81.5000111.3F100 G101 L102 I106 M108 M487 L791 I795F100-F104 VanDerWaalsContact O-CB 3.28Å; F100-F104 WeakPolarHBondContact O-CB 3.27Å; F100-F104 PolarHBondContact O-N 3.25Å; G101-F104 PolarHBondContact O-N 3.22Å; L102-F104 VanDerWaalsContact C-N 3.31Å; L102-F104 PolarHBondContact O-N 3Å; F104-I106 VanDerWaalsContact C-N 3.27Å; F104-I106 PolarHBondContact O-N 2.94Å; F104-M108 HydrophobicContact CD1-CG 3.99Å; F104-M108 HydrophobicContact CD2-CE 4.06Å; F104-M108 HydrophobicContact CD2-CG 4.08Å; F104-M108 HydrophobicContact CE1-CG 3.8Å; F104-M108 HydrophobicContact CE2-CE 3.3Å; F104-M108 HydrophobicContact CE2-CG 3.9Å; F104-M108 HydrophobicContact CE2-SD 4.48Å; F104-M108 HydrophobicContact CG-CG 4.14Å; F104-M108 HydrophobicContact CZ-CE 3.61Å; F104-M108 HydrophobicContact CZ-CG 3.76Å; F104-M108 HydrophobicContact CZ-SD 4.49Å; F104-M108 VanDerWaalsContact O-CB 3.26Å; F104-M108 WeakPolarHBondContact O-CB 2.96Å; F104-M108 WeakPolarHBondContact O-CG 3.44Å; F104-M108 PolarHBondContact O-N 3.39Å; F104-M487 HydrophobicContact CB-CE 4Å; F104-M487 HydrophobicContact CD1-CB 3.98Å; F104-M487 HydrophobicContact CD1-CE 3.29Å; F104-M487 HydrophobicContact CD1-CG 3.95Å; F104-M487 HydrophobicContact CD1-SD 4.46Å; F104-M487 HydrophobicContact CD2-CE 4.2Å; F104-M487 HydrophobicContact CE1-CB 4.31Å; F104-M487 HydrophobicContact CE1-CE 3.68Å; F104-M487 HydrophobicContact CG-CE 3.58Å; F104-M487 HydrophobicContact CZ-CE 4.28Å; F104-L791 HydrophobicContact CE1-CB 4.34Å; F104-L791 HydrophobicContact CE1-CD2 4.22Å; F104-L791 WeakPolarHBondContact CE2-O 3.33Å; F104-L791 HydrophobicContact CZ-CB 4.05Å; F104-L791 HydrophobicContact CZ-CD2 4.32Å; F104-L791 WeakPolarHBondContact CZ-O 3.44Å; F104-I795 HydrophobicContact CD2-CD1 4.34Å; F104-I795 HydrophobicContact CE2-CD1 4.24Å; F104-I795 HydrophobicContact CE2-CG1 4.23Å
105A95.5Very high94.2Very high13 Ų1362.1 Ų62.111%0.10734%0.34CS..Hα-helixtrans-62.8-31.7-178.600000113.2G101 L102 P109 T484 M487G101-A105 WeakPolarHBondContact O-CB 3.38Å; G101-A105 PolarHBondContact O-N 3.31Å; L102-A105 PolarHBondContact O-N 3.47Å; A105-P109 WeakPolarHBondContact O-CD 3.26Å; A105-P109 WeakPolarHBondContact O-CG 3.49Å; A105-T484 HydrophobicContact CB-CG2 4.33Å; A105-T484 PolarHBondContact O-OG1 3.27Å; A105-M487 HydrophobicContact CB-CB 4.2Å; A105-M487 HydrophobicContact CB-CG 4.04Å
106I95Very high94Very high98 Ų9867.1 Ų67.150%0.50335%0.352SS..Hα-helixtrans-85-48.7177.8-66166.8000111.3L102 L103 F104 P109 L110L102-I106 WeakPolarHBondContact O-CB 3.49Å; L102-I106 VanDerWaalsContact O-CG1 3.29Å; L102-I106 WeakPolarHBondContact O-CG1 3.25Å; L102-I106 PolarHBondContact O-N 2.75Å; L103-I106 PolarHBondContact O-N 3.37Å; F104-I106 VanDerWaalsContact C-N 3.27Å; F104-I106 PolarHBondContact O-N 2.94Å; I106-P109 WeakPolarHBondContact O-CD 3.33Å; I106-P109 WeakPolarHBondContact O-CG 3.47Å; I106-L110 HydrophobicContact CG2-CD1 3.83Å; I106-L110 VanDerWaalsContact O-CG 3.28Å; I106-L110 WeakPolarHBondContact O-CG 3.32Å
107F95.1Very high93.8Very high115 Ų11566.7 Ų66.750%0.50436%0.355SS..Hα-helixtrans-76.4-33.3-173.1-76.2-58.2000113.5L103 L110 V111L103-F107 HydrophobicContact CB-CD2 4.04Å; L103-F107 HydrophobicContact CB-CE2 4.28Å; L103-F107 HydrophobicContact CD2-CD2 4.33Å; L103-F107 HydrophobicContact CD2-CE2 3.8Å; L103-F107 HydrophobicContact CG-CE2 4.49Å; L103-F107 VanDerWaalsContact O-CB 3.24Å; L103-F107 WeakPolarHBondContact O-CB 3.49Å; L103-F107 VanDerWaalsContact O-CD2 3.24Å; L103-F107 WeakPolarHBondContact O-CD2 3.48Å; L103-F107 PolarHBondContact O-N 3.4Å; F107-L110 HydrophobicContact CD1-CD1 4.39Å; F107-L110 PolarHBondContact O-N 2.93Å; F107-V111 VanDerWaalsContact O-CB 3.28Å; F107-V111 WeakPolarHBondContact O-CB 3.26Å; F107-V111 WeakPolarHBondContact O-CG2 3.36Å; F107-V111 PolarHBondContact O-N 3.47Å
108M95Very high93.4Very high15 Ų1566.1 Ų66.17%0.07435%0.352CS..Hα-helixtrans-55.8-52.1178.6-84.4-65.6-168.300113.4F104 L110 V111 G112 F480 S483 F794 I795 I798F104-M108 HydrophobicContact CD1-CG 3.99Å; F104-M108 HydrophobicContact CD2-CE 4.06Å; F104-M108 HydrophobicContact CD2-CG 4.08Å; F104-M108 HydrophobicContact CE1-CG 3.8Å; F104-M108 HydrophobicContact CE2-CE 3.3Å; F104-M108 HydrophobicContact CE2-CG 3.9Å; F104-M108 HydrophobicContact CE2-SD 4.48Å; F104-M108 HydrophobicContact CG-CG 4.14Å; F104-M108 HydrophobicContact CZ-CE 3.61Å; F104-M108 HydrophobicContact CZ-CG 3.76Å; F104-M108 HydrophobicContact CZ-SD 4.49Å; F104-M108 VanDerWaalsContact O-CB 3.26Å; F104-M108 WeakPolarHBondContact O-CB 2.96Å; F104-M108 WeakPolarHBondContact O-CG 3.44Å; F104-M108 PolarHBondContact O-N 3.39Å; M108-L110 PolarHBondContact O-N 3.39Å; M108-V111 PolarHBondContact O-N 3.37Å; M108-G112 PolarHBondContact O-N 3.49Å; M108-F480 WeakPolarHBondContact O-CD1 3.31Å; M108-F480 HydrophobicContact SD-CD1 3.86Å; M108-F480 HydrophobicContact SD-CE1 3.75Å; M108-S483 WeakPolarHBondContact CB-OG 3.29Å; M108-F794 HydrophobicContact CE-CB 4.36Å; M108-I795 HydrophobicContact CE-CB 4.39Å; M108-I795 HydrophobicContact CE-CD1 4.22Å; M108-I795 HydrophobicContact CE-CG1 3.28Å; M108-I798 HydrophobicContact CE-CD1 4.12Å; M108-I798 HydrophobicContact SD-CD1 4.21Å
109P92.6Very high92.8Very high39 Ų3965.8 Ų65.825%0.25335%0.347SS..Hα-helixtrans-67-36.8177.326.2-35.7000112.5A105 I106 G112 I113 T484A105-P109 WeakPolarHBondContact O-CD 3.26Å; A105-P109 WeakPolarHBondContact O-CG 3.49Å; I106-P109 WeakPolarHBondContact O-CD 3.33Å; I106-P109 WeakPolarHBondContact O-CG 3.47Å; P109-G112 CarbonylContact O-C 3.59Å; P109-G112 WeakPolarHBondContact O-CA 3.33Å; P109-G112 PolarHBondContact O-N 2.89Å; P109-I113 WeakPolarHBondContact O-CG1 3.44Å; P109-I113 PolarHBondContact O-N 2.74Å; P109-T484 WeakPolarHBondContact CG-OG1 3.44Å
110L93.6Very high92.2Very high87 Ų8766.4 Ų66.446%0.45535%0.354SS..Hα-helixtrans-63.2-46.2176.7-69.3176.1000111.9I106 F107 M108 G112 I113 V114I106-L110 HydrophobicContact CG2-CD1 3.83Å; I106-L110 VanDerWaalsContact O-CG 3.28Å; I106-L110 WeakPolarHBondContact O-CG 3.32Å; F107-L110 HydrophobicContact CD1-CD1 4.39Å; F107-L110 PolarHBondContact O-N 2.93Å; M108-L110 PolarHBondContact O-N 3.39Å; L110-G112 VanDerWaalsContact C-N 3.26Å; L110-G112 PolarHBondContact O-N 2.93Å; L110-I113 PolarHBondContact O-N 3.17Å; L110-V114 WeakPolarHBondContact O-CG2 3.22Å; L110-V114 PolarHBondContact O-N 2.97Å
111V93.9Very high91.6Very high75 Ų7564.1 Ų64.146%0.45536%0.355SS..Hα-helixtrans-61.9-39.2173.4171.90000109.7F107 M108 V114 F115 F480F107-V111 VanDerWaalsContact O-CB 3.28Å; F107-V111 WeakPolarHBondContact O-CB 3.26Å; F107-V111 WeakPolarHBondContact O-CG2 3.36Å; F107-V111 PolarHBondContact O-N 3.47Å; M108-V111 PolarHBondContact O-N 3.37Å; V111-V114 PolarHBondContact O-N 2.96Å; V111-F115 WeakPolarHBondContact O-CA 3.23Å; V111-F115 WeakPolarHBondContact O-CB 3.47Å; V111-F115 PolarHBondContact O-N 3.2Å; V111-F480 HydrophobicContact CB-CE1 4.38Å; V111-F480 HydrophobicContact CG1-CE1 4.01Å; V111-F480 HydrophobicContact CG1-CZ 4.09Å
112G93.2Very high90.6Very high9 Ų964.6 Ų64.69%0.09336%0.36CS..Hα-helixtrans-58.9-45.3173.500000113.4M108 P109 L110 F115 F116M108-G112 PolarHBondContact O-N 3.49Å; P109-G112 CarbonylContact O-C 3.59Å; P109-G112 WeakPolarHBondContact O-CA 3.33Å; P109-G112 PolarHBondContact O-N 2.89Å; L110-G112 VanDerWaalsContact C-N 3.26Å; L110-G112 PolarHBondContact O-N 2.93Å; G112-F115 PolarHBondContact O-N 2.8Å; G112-F116 WeakPolarHBondContact O-CB 3.4Å; G112-F116 PolarHBondContact O-N 3.41Å
113I92.3Very high89.6Confident103 Ų10367.7 Ų67.753%0.52837%0.369SS..Hα-helixtrans-64.6-48.3176.7-66.9163.9000110.5P109 L110 F115 F116 C117P109-I113 WeakPolarHBondContact O-CG1 3.44Å; P109-I113 PolarHBondContact O-N 2.74Å; L110-I113 PolarHBondContact O-N 3.17Å; I113-F115 VanDerWaalsContact C-N 3.3Å; I113-F115 PolarHBondContact O-N 3.28Å; I113-F116 WeakPolarHBondContact O-CB 3.12Å; I113-F116 PolarHBondContact O-N 3.18Å; I113-C117 PolarHBondContact O-N 3.19Å; I113-C117 PolarHBondContact O-SG 3.38Å; I113-C117 VanDerWaalsContact O-SG 3.33Å
114V91.6Very high88.4Confident100 Ų10067.3 Ų67.361%0.60637%0.373SS*.Hα-helixtrans-61.9-41.4177.3173.40000110.8L110 V111 C117 A118L110-V114 WeakPolarHBondContact O-CG2 3.22Å; L110-V114 PolarHBondContact O-N 2.97Å; V111-V114 PolarHBondContact O-N 2.96Å; V114-C117 PolarHBondContact O-N 3.08Å; V114-A118 WeakPolarHBondContact O-CB 3.39Å; V114-A118 PolarHBondContact O-N 2.89Å
115F89.8Confident87.1Confident37 Ų3767.9 Ų67.916%0.16239%0.386CS..Hα-helixtrans-62.1-44.4176.5179.1-96.3000111.2V111 G112 I113 R119 C124 L473 V476 F480 V802V111-F115 WeakPolarHBondContact O-CA 3.23Å; V111-F115 WeakPolarHBondContact O-CB 3.47Å; V111-F115 PolarHBondContact O-N 3.2Å; G112-F115 PolarHBondContact O-N 2.8Å; I113-F115 VanDerWaalsContact C-N 3.3Å; I113-F115 PolarHBondContact O-N 3.28Å; F115-R119 VanDerWaalsContact O-CB 3.23Å; F115-R119 WeakPolarHBondContact O-CB 3.42Å; F115-R119 PolarHBondContact O-N 3.45Å; F115-C124 HydrophobicContact CD2-CB 4.09Å; F115-C124 HydrophobicContact CE2-CB 3.95Å; F115-L473 HydrophobicContact CZ-CD2 4.49Å; F115-V476 HydrophobicContact CE1-CG1 4.26Å; F115-F480 HydrophobicContact CB-CE2 4.37Å; F115-F480 HydrophobicContact CD1-CE2 4.08Å; F115-F480 HydrophobicContact CG-CE2 4.24Å; F115-V802 HydrophobicContact CE1-CG2 4.43Å; F115-V802 HydrophobicContact CE2-CG1 3.9Å; F115-V802 HydrophobicContact CE2-CG2 3.91Å; F115-V802 HydrophobicContact CZ-CB 4.43Å; F115-V802 HydrophobicContact CZ-CG1 3.93Å; F115-V802 HydrophobicContact CZ-CG2 3.53Å
116F87.4Confident85.9Confident141 Ų14168.3 Ų68.362%0.61839%0.392SS*.Hα-helixtrans-60.3-52.6175.4-177.5-99.6000111.3G112 I113 A118 R119 C120G112-F116 WeakPolarHBondContact O-CB 3.4Å; G112-F116 PolarHBondContact O-N 3.41Å; I113-F116 WeakPolarHBondContact O-CB 3.12Å; I113-F116 PolarHBondContact O-N 3.18Å; F116-A118 PolarHBondContact O-N 2.87Å; F116-R119 PolarHBondContact O-N 2.88Å; F116-C120 PolarHBondContact O-N 3.45Å; F116-C120 PolarHBondContact O-SG 3.41Å
117C88.7Confident84.8Confident68 Ų6873.3 Ų73.346%0.45940%0.404SS..Hα-helixtrans-60.4-46.5177.7-66.20000112.4I113 V114 R119 C120 C121I113-C117 PolarHBondContact O-N 3.19Å; I113-C117 PolarHBondContact O-SG 3.38Å; I113-C117 VanDerWaalsContact O-SG 3.33Å; V114-C117 PolarHBondContact O-N 3.08Å; C117-R119 PolarHBondContact O-N 3.01Å; C117-C120 WeakPolarHBondContact O-CB 3.26Å; C117-C120 PolarHBondContact O-N 2.99Å; C117-C121 PolarHBondContact O-N 3.44Å; C117-C121 PolarHBondContact O-SG 3.41Å; C117-C121 VanDerWaalsContact O-SG 3.34Å
118A86.5Confident83.6Confident20 Ų2070.4 Ų70.417%0.16540%0.396CS..Hα-helixtrans-59.9-38.5178.300000111.2V114 F116 C121 G122 K123 C124V114-A118 WeakPolarHBondContact O-CB 3.39Å; V114-A118 PolarHBondContact O-N 2.89Å; F116-A118 PolarHBondContact O-N 2.87Å; A118-C121 CarbonylContact O-C 3.53Å; A118-C121 PolarHBondContact O-N 3.49Å; A118-G122 PolarHBondContact O-N 3.37Å; A118-K123 HydrophobicContact CB-CB 4.25Å; A118-K123 CarbonylContact O-C 3.48Å; A118-K123 VanDerWaalsContact O-CA 3.32Å; A118-K123 WeakPolarHBondContact O-CA 3.41Å; A118-K123 WeakPolarHBondContact O-CB 3.21Å; A118-K123 PolarHBondContact O-N 3.3Å; A118-C124 HydrophobicContact CB-CB 4.31Å
119R83.3Confident82.5Confident45 Ų4576.2 Ų76.217%0.1742%0.423CS..Hα-helixtrans-69.3-39.5177.2-165.7166.6-17672.913112.5F115 F116 C117 C121 G122 K123 C124 G125 L473F115-R119 VanDerWaalsContact O-CB 3.23Å; F115-R119 WeakPolarHBondContact O-CB 3.42Å; F115-R119 PolarHBondContact O-N 3.45Å; F116-R119 PolarHBondContact O-N 2.88Å; C117-R119 PolarHBondContact O-N 3.01Å; R119-C121 PolarHBondContact O-N 3.15Å; R119-G122 PolarHBondContact O-N 3.49Å; R119-K123 WeakPolarHBondContact CA-O 3.24Å; R119-C124 PolarHBondContact NH1-O 3.17Å; R119-G125 PolarHBondContact NH1-O 3.18Å; R119-G125 PolarHBondContact NH2-O 3.43Å; R119-L473 VanDerWaalsContact NH2-CD1 3.32Å
120C81.7Confident81.7Confident95 Ų9580 Ų8064%0.64244%0.435SS*.Hα-helixtrans-59.7-35.4170.4-66.40000112.1F116 C117 G122F116-C120 PolarHBondContact O-N 3.45Å; F116-C120 PolarHBondContact O-SG 3.41Å; C117-C120 WeakPolarHBondContact O-CB 3.26Å; C117-C120 PolarHBondContact O-N 2.99Å; C120-G122 PolarHBondContact O-N 3Å
121C82.3Confident81Confident93 Ų9377.6 Ų77.663%0.62842%0.424SS*.THydrogen-bonded Turntrans-80.38.1174.2-60.10000114.2C117 A118 R119 K123C117-C121 PolarHBondContact O-N 3.44Å; C117-C121 PolarHBondContact O-SG 3.41Å; C117-C121 VanDerWaalsContact O-SG 3.34Å; A118-C121 CarbonylContact O-C 3.53Å; A118-C121 PolarHBondContact O-N 3.49Å; R119-C121 PolarHBondContact O-N 3.15Å; C121-K123 VanDerWaalsContact C-N 3.27Å; C121-K123 PolarHBondContact O-N 3.06Å
122G75.4Confident80.5Confident17 Ų1774.4 Ų74.418%0.17541%0.405CS..THydrogen-bonded Turntrans76.74.5-178.800000115.3A118 R119 C120 R127A118-G122 PolarHBondContact O-N 3.37Å; R119-G122 PolarHBondContact O-N 3.49Å; C120-G122 PolarHBondContact O-N 3Å; G122-R127 VanDerWaalsContact O-CG 3.28Å; G122-R127 WeakPolarHBondContact O-CG 3.23Å; G122-R127 PolarHBondContact O-N 3.19Å
123K75Confident80Confident149 Ų14975.9 Ų75.965%0.64841%0.414SS*.THydrogen-bonded Turntrans-87.7175.3172-62.4-177.9179.5177.90110.4A118 R119 C121 G125 G126A118-K123 HydrophobicContact CB-CB 4.25Å; A118-K123 CarbonylContact O-C 3.48Å; A118-K123 VanDerWaalsContact O-CA 3.32Å; A118-K123 WeakPolarHBondContact O-CA 3.41Å; A118-K123 WeakPolarHBondContact O-CB 3.21Å; A118-K123 PolarHBondContact O-N 3.3Å; R119-K123 WeakPolarHBondContact CA-O 3.24Å; C121-K123 VanDerWaalsContact C-N 3.27Å; C121-K123 PolarHBondContact O-N 3.06Å; K123-G125 VanDerWaalsContact C-N 3.28Å; K123-G125 PolarHBondContact O-N 3.35Å; K123-G126 PolarHBondContact O-N 2.96Å
124C72.4Confident79.5Confident69 Ų6977.2 Ų77.247%0.46642%0.416SS..THydrogen-bonded Turntrans5241.6-179.6-61.50000114.3F115 A118 R119F115-C124 HydrophobicContact CD2-CB 4.09Å; F115-C124 HydrophobicContact CE2-CB 3.95Å; A118-C124 HydrophobicContact CB-CB 4.31Å; R119-C124 PolarHBondContact NH1-O 3.17Å
125G68.3Low79.3Confident38 Ų3878.2 Ų78.239%0.39241%0.413SS..THydrogen-bonded Turntrans78.814.5-178.300000114.9R119 K123R119-G125 PolarHBondContact NH1-O 3.18Å; R119-G125 PolarHBondContact NH2-O 3.43Å; K123-G125 VanDerWaalsContact C-N 3.28Å; K123-G125 PolarHBondContact O-N 3.35Å
126G70.5Confident79.1Confident22 Ų2276.7 Ų76.723%0.22741%0.407CS..THydrogen-bonded Turntrans-68.4-37.9173.100000112.4K123 V128K123-G126 PolarHBondContact O-N 2.96Å; G126-V128 PolarHBondContact O-N 3.43Å
127R71.8Confident79.1Confident202 Ų20273.2 Ų73.276%0.76240%0.399SS*.SBendtrans-73.3120.1168.5-77.4172.8-173.7172.21.3110.4G122G122-R127 VanDerWaalsContact O-CG 3.28Å; G122-R127 WeakPolarHBondContact O-CG 3.23Å; G122-R127 PolarHBondContact O-N 3.19Å
128V70.4Confident79.2Confident55 Ų5573.9 Ų73.933%0.33340%0.403SS..PPolyproline II helixtrans-82.1119.6175.3-176.20000108.3G126 R809G126-V128 PolarHBondContact O-N 3.43Å; V128-R809 HydrophobicContact CG1-CB 3.88Å; V128-R809 WeakPolarHBondContact CG1-O 3.49Å; V128-R809 HydrophobicContact CG2-CB 4.41Å
129Q71.9Confident79.4Confident137 Ų13776.6 Ų76.664%0.6441%0.411SS*.PPolyproline II helixtrans-83.5124.5166.8-70.4179.4-23.500107.8K810Q129-K810 WeakPolarHBondContact O-CG 3.26Å
130F76Confident79.8Confident117 Ų11775.9 Ų75.951%0.51341%0.409SS..  trans-72.7-36.1-173.9-59.9-74.4000112.7T811 E812F130-T811 HydrophobicContact CD1-CG2 4.31Å; F130-T811 PolarHBondContact O-N 2.87Å; F130-T811 PolarHBondContact O-OG1 3.31Å; F130-E812 PolarHBondContact O-N 3.39Å
131V79.7Confident80.4Confident38 Ų3875.5 Ų75.523%0.2340%0.403CS..BIsolated β-bridgetrans-101.4135.5-170.9-166.90000112.1K810 E812 Y818V131-K810 PolarHBondContact O-NZ 3.41Å; V131-E812 HydrophobicContact CG1-CB 4.48Å; V131-E812 HydrophobicContact CG2-CB 4.2Å; V131-Y818 HydrophobicContact CG1-CD2 3.82Å; V131-Y818 HydrophobicContact CG1-CE2 3.94Å; V131-Y818 HydrophobicContact CG1-CG 4.49Å; V131-Y818 HydrophobicContact CG2-CD2 4.44Å; V131-Y818 HydrophobicContact CG2-CE1 4.46Å; V131-Y818 HydrophobicContact CG2-CE2 4.07Å
132D81.8Confident81Confident7 Ų774.2 Ų74.24%0.03739%0.392CS..PPolyproline II helixtrans-64.3136.1167.9-80.8-32000110.2D136 R140 R455 K810 E812 Y814D132-D136 HydrophobicContact CB-CB 4.37Å; D132-R140 IonicContact OD1-NH2 2.85Å; D132-R140 PolarHBondContact OD1-NH2 3.08Å; D132-R140 IonicContact OD2-NH2 3.16Å; D132-R455 IonicContact OD2-CZ 3.12Å; D132-R455 IonicContact OD2-NH2 3.36Å; D132-R455 PolarHBondContact OD2-NH2 3.05Å; D132-K810 WeakPolarHBondContact OD1-CB 3.32Å; D132-K810 WeakPolarHBondContact OD1-CD 3.45Å; D132-E812 PolarHBondContact N-O 3.27Å; D132-E812 VanDerWaalsContact N-O 3.12Å; D132-Y814 VanDerWaalsContact O-CA 3.27Å; D132-Y814 WeakPolarHBondContact O-CA 3.35Å; D132-Y814 VanDerWaalsContact O-CB 3.28Å; D132-Y814 WeakPolarHBondContact O-CB 3.41Å; D132-Y814 WeakPolarHBondContact O-CD2 3.41Å
133S83.8Confident82Confident41 Ų4176.3 Ų76.329%0.28740%0.395SS..PPolyproline II helixtrans-83.3163.4166.972.70000110.5H135 D136S133-H135 PolarHBondContact O-N 3Å; S133-D136 WeakPolarHBondContact CB-OD2 3.5Å; S133-D136 PolarHBondContact N-OD2 3.3Å; S133-D136 PolarHBondContact O-N 3.03Å; S133-D136 PolarHBondContact OG-OD1 2.99Å; S133-D136 PolarHBondContact OG-OD2 3.26Å
134K82.3Confident83Confident131 Ų13170.1 Ų70.157%0.5737%0.37SS*.THydrogen-bonded Turntrans-46.8-37.2-177.2-172.6173.9-179.1175.70114.8Y814K134-Y814 HydrophobicContact CB-CD2 4.33Å; K134-Y814 HydrophobicContact CB-CE1 4.23Å; K134-Y814 HydrophobicContact CB-CE2 3.94Å; K134-Y814 HydrophobicContact CG-CE1 4.27Å
135H85.9Confident84.2Confident120 Ų12071.3 Ų71.356%0.55637%0.371SS*.THydrogen-bonded Turntrans-99.5-1.9-175.1-60.299.1000114.5S133 C138 K139S133-H135 PolarHBondContact O-N 3Å; H135-C138 WeakPolarHBondContact O-CB 3.39Å; H135-C138 PolarHBondContact O-N 3.22Å; H135-K139 WeakPolarHBondContact O-CG 3.27Å; H135-K139 PolarHBondContact O-N 2.86Å
136D87Confident85.6Confident5 Ų571.4 Ų71.43%0.02737%0.365CS..Hα-helixtrans-65.5-33-174.2-72.9-15000115.3D132 S133 C138 K139 R140 L807 K810D132-D136 HydrophobicContact CB-CB 4.37Å; S133-D136 WeakPolarHBondContact CB-OD2 3.5Å; S133-D136 PolarHBondContact N-OD2 3.3Å; S133-D136 PolarHBondContact O-N 3.03Å; S133-D136 PolarHBondContact OG-OD1 2.99Å; S133-D136 PolarHBondContact OG-OD2 3.26Å; D136-C138 VanDerWaalsContact C-N 3.32Å; D136-C138 PolarHBondContact O-N 3.4Å; D136-K139 PolarHBondContact O-N 3.49Å; D136-K139 IonicContact OD1-NZ 2.8Å; D136-K139 PolarHBondContact OD1-NZ 3.3Å; D136-R140 WeakPolarHBondContact O-CB 3.43Å; D136-R140 PolarHBondContact O-N 2.95Å; D136-L807 HydrophobicContact CB-CD2 3.93Å; D136-K810 IonicContact OD2-NZ 2.64Å; D136-K810 PolarHBondContact OD2-NZ 2.92Å
137P86.6Confident86.9Confident69 Ų6970.3 Ų70.345%0.44835%0.354SS..Hα-helixtrans-58.7-44.2171.5-25.635.3000112.2R140 V141P137-R140 PolarHBondContact O-N 2.98Å; P137-V141 WeakPolarHBondContact O-CG2 3.38Å; P137-V141 PolarHBondContact O-N 3.13Å; P137-V141 VanDerWaalsContact O-N 3.12Å
138C89.8Confident88.1Confident81 Ų8163.2 Ų63.255%0.54733%0.333SS..Hα-helixtrans-64.7-46.2176.5-179.30000111.1H135 D136 R140 V141 V142H135-C138 WeakPolarHBondContact O-CB 3.39Å; H135-C138 PolarHBondContact O-N 3.22Å; D136-C138 VanDerWaalsContact C-N 3.32Å; D136-C138 PolarHBondContact O-N 3.4Å; C138-R140 VanDerWaalsContact C-N 3.29Å; C138-R140 PolarHBondContact O-N 3.16Å; C138-V141 PolarHBondContact O-N 2.89Å; C138-V142 WeakPolarHBondContact O-CG2 3.44Å; C138-V142 PolarHBondContact O-N 3.37Å
139K91.7Very high89.4Confident77 Ų7764.9 Ų64.934%0.33534%0.34SS..Hα-helixtrans-58.9-40.1176-67.1178.2-160.7152.70112.3H135 D136 V142 Y143 L807H135-K139 WeakPolarHBondContact O-CG 3.27Å; H135-K139 PolarHBondContact O-N 2.86Å; D136-K139 PolarHBondContact O-N 3.49Å; D136-K139 IonicContact OD1-NZ 2.8Å; D136-K139 PolarHBondContact OD1-NZ 3.3Å; K139-V142 PolarHBondContact O-N 3.24Å; K139-Y143 HydrophobicContact CB-CD2 4.38Å; K139-Y143 HydrophobicContact CB-CE2 4.02Å; K139-Y143 WeakPolarHBondContact O-CB 3.33Å; K139-Y143 WeakPolarHBondContact O-CD2 3.29Å; K139-Y143 PolarHBondContact O-N 3.31Å; K139-L807 HydrophobicContact CB-CD1 3.88Å
140R92Very high90.6Very high31 Ų3159.4 Ų59.412%0.11731%0.314CS..Hα-helixtrans-60-50.7177.7-170.7-178.8-70.4138.54.2109.8D132 D136 P137 C138 V142 Y143 T144 L804 L807 Y808D132-R140 IonicContact OD1-NH2 2.85Å; D132-R140 PolarHBondContact OD1-NH2 3.08Å; D132-R140 IonicContact OD2-NH2 3.16Å; D136-R140 WeakPolarHBondContact O-CB 3.43Å; D136-R140 PolarHBondContact O-N 2.95Å; P137-R140 PolarHBondContact O-N 2.98Å; C138-R140 VanDerWaalsContact C-N 3.29Å; C138-R140 PolarHBondContact O-N 3.16Å; R140-V142 PolarHBondContact O-N 3.41Å; R140-Y143 PolarHBondContact O-N 2.99Å; R140-T144 VanDerWaalsContact O-CB 3.27Å; R140-T144 WeakPolarHBondContact O-CB 3.41Å; R140-T144 PolarHBondContact O-N 3.1Å; R140-T144 PolarHBondContact O-OG1 3.37Å; R140-L804 HydrophobicContact CG-CD1 3.86Å; R140-L807 HydrophobicContact CB-CD1 4.04Å; R140-L807 PolarHBondContact NH2-O 3.37Å; R140-Y808 HydrophobicContact CG-CD1 4.26Å; R140-Y808 HydrophobicContact CG-CE1 3.74Å
141V93.5Very high91.6Very high86 Ų8653.9 Ų53.952%0.52129%0.29SS..Hα-helixtrans-58.2-49176.9174.20000111.5P137 C138 T144 I145P137-V141 WeakPolarHBondContact O-CG2 3.38Å; P137-V141 PolarHBondContact O-N 3.13Å; P137-V141 VanDerWaalsContact O-N 3.12Å; C138-V141 PolarHBondContact O-N 2.89Å; V141-T144 PolarHBondContact O-N 3.31Å; V141-I145 HydrophobicContact CG1-CD1 3.72Å; V141-I145 HydrophobicContact CG1-CG1 4.45Å; V141-I145 VanDerWaalsContact O-CG1 3.31Å; V141-I145 WeakPolarHBondContact O-CG1 3.11Å; V141-I145 PolarHBondContact O-N 2.81Å
142V95.9Very high92.4Very high67 Ų6754.7 Ų54.741%0.40630%0.295SS..Hα-helixtrans-61.3-49.7-179172.80000111.4C138 K139 R140 T144 I145 C146C138-V142 WeakPolarHBondContact O-CG2 3.44Å; C138-V142 PolarHBondContact O-N 3.37Å; K139-V142 PolarHBondContact O-N 3.24Å; R140-V142 PolarHBondContact O-N 3.41Å; V142-T144 VanDerWaalsContact C-N 3.34Å; V142-T144 PolarHBondContact O-N 3.4Å; V142-I145 PolarHBondContact O-N 2.85Å; V142-C146 WeakPolarHBondContact O-CB 3.27Å; V142-C146 PolarHBondContact O-N 3.45Å; V142-C146 PolarHBondContact O-SG 3.26Å
143Y95.8Very high93.2Very high60 Ų6061 Ų6124%0.23532%0.322CS..Hα-helixtrans-66.5-35.3-180-62.2-21.2000112.5K139 R140 L147 F800 K803 L807K139-Y143 HydrophobicContact CB-CD2 4.38Å; K139-Y143 HydrophobicContact CB-CE2 4.02Å; K139-Y143 WeakPolarHBondContact O-CB 3.33Å; K139-Y143 WeakPolarHBondContact O-CD2 3.29Å; K139-Y143 PolarHBondContact O-N 3.31Å; R140-Y143 PolarHBondContact O-N 2.99Å; Y143-L147 VanDerWaalsContact O-CB 3.24Å; Y143-L147 WeakPolarHBondContact O-CB 3.34Å; Y143-L147 PolarHBondContact O-N 3.22Å; Y143-F800 AromaticContact CD1-CD1 3.6Å; Y143-F800 HydrophobicContact CD1-CD1 3.6Å; Y143-F800 AromaticContact CD1-CE1 3.74Å; Y143-F800 HydrophobicContact CD1-CE1 3.74Å; Y143-F800 HydrophobicContact CE1-CD1 4.29Å; Y143-F800 HydrophobicContact CE1-CE1 4.16Å; Y143-F800 HydrophobicContact CG-CD1 4.12Å; Y143-K803 HydrophobicContact CD2-CB 3.89Å; Y143-K803 HydrophobicContact CE2-CB 3.78Å; Y143-L807 HydrophobicContact CD2-CD1 3.79Å; Y143-L807 HydrophobicContact CE2-CD1 4.09Å
144T96.5Very high93.8Very high20 Ų2059 Ų5912%0.12331%0.309CS..Hα-helixtrans-60.8-51.1171.9-66.70000110.7R140 V141 V142 C146 L147 V148 L447 T451 Y808R140-T144 VanDerWaalsContact O-CB 3.27Å; R140-T144 WeakPolarHBondContact O-CB 3.41Å; R140-T144 PolarHBondContact O-N 3.1Å; R140-T144 PolarHBondContact O-OG1 3.37Å; V141-T144 PolarHBondContact O-N 3.31Å; V142-T144 VanDerWaalsContact C-N 3.34Å; V142-T144 PolarHBondContact O-N 3.4Å; T144-C146 PolarHBondContact O-N 3.14Å; T144-L147 PolarHBondContact O-N 3.05Å; T144-V148 HydrophobicContact CG2-CG2 4.36Å; T144-V148 WeakPolarHBondContact O-CB 3.36Å; T144-V148 VanDerWaalsContact O-CG2 3.26Å; T144-V148 WeakPolarHBondContact O-CG2 3.37Å; T144-V148 PolarHBondContact O-N 3.35Å; T144-L447 HydrophobicContact CG2-CD2 4.11Å; T144-T451 HydrophobicContact CG2-CG2 3.55Å; T144-Y808 PolarHBondContact OG1-OH 2.86Å
145I96.6Very high94.4Very high94 Ų9455.6 Ų55.648%0.48230%0.297SS..Hα-helixtrans-60.3-47.9179.6-67.9167.9000110.4V141 V142 L147 V148 L149V141-I145 HydrophobicContact CG1-CD1 3.72Å; V141-I145 HydrophobicContact CG1-CG1 4.45Å; V141-I145 VanDerWaalsContact O-CG1 3.31Å; V141-I145 WeakPolarHBondContact O-CG1 3.11Å; V141-I145 PolarHBondContact O-N 2.81Å; V142-I145 PolarHBondContact O-N 2.85Å; I145-L147 VanDerWaalsContact C-N 3.35Å; I145-L147 PolarHBondContact O-N 2.62Å; I145-V148 PolarHBondContact O-N 3.33Å; I145-L149 HydrophobicContact CG2-CD1 4.04Å; I145-L149 HydrophobicContact CG2-CG 4.47Å; I145-L149 WeakPolarHBondContact O-CG 3.41Å; I145-L149 PolarHBondContact O-N 2.86Å
146C97.6Very high94.9Very high39 Ų3952.3 Ų52.326%0.26429%0.29SS..Hα-helixtrans-58.9-45.2177.8-68.60000112V142 T144 L149 I150 F800V142-C146 WeakPolarHBondContact O-CB 3.27Å; V142-C146 PolarHBondContact O-N 3.45Å; V142-C146 PolarHBondContact O-SG 3.26Å; T144-C146 PolarHBondContact O-N 3.14Å; C146-L149 PolarHBondContact O-N 3.37Å; C146-I150 WeakPolarHBondContact O-CD1 3.4Å; C146-I150 VanDerWaalsContact O-CG1 3.24Å; C146-I150 WeakPolarHBondContact O-CG1 3.47Å; C146-I150 PolarHBondContact O-N 3.16Å; C146-F800 HydrophobicContact CB-CD1 4.03Å; C146-F800 HydrophobicContact CB-CD2 4.1Å; C146-F800 HydrophobicContact CB-CE1 3.88Å; C146-F800 HydrophobicContact CB-CE2 3.96Å; C146-F800 HydrophobicContact CB-CG 4.15Å; C146-F800 HydrophobicContact CB-CZ 3.85Å
147L97.4Very high95.3Very high0 Ų052.8 Ų52.80%029%0.294CS..Hα-helixtrans-68.2-41.1-179.1-17360.6000111.9Y143 T144 I145 L149 I150 V151 L447 L472 A797 F800 A801 L804Y143-L147 VanDerWaalsContact O-CB 3.24Å; Y143-L147 WeakPolarHBondContact O-CB 3.34Å; Y143-L147 PolarHBondContact O-N 3.22Å; T144-L147 PolarHBondContact O-N 3.05Å; I145-L147 VanDerWaalsContact C-N 3.35Å; I145-L147 PolarHBondContact O-N 2.62Å; L147-L149 VanDerWaalsContact C-N 3.35Å; L147-L149 PolarHBondContact O-N 2.95Å; L147-I150 PolarHBondContact O-N 2.94Å; L147-V151 HydrophobicContact CD1-CG2 3.92Å; L147-V151 HydrophobicContact CG-CG2 4.2Å; L147-V151 WeakPolarHBondContact O-CB 3.39Å; L147-V151 VanDerWaalsContact O-CG2 3.25Å; L147-V151 WeakPolarHBondContact O-CG2 3.37Å; L147-V151 PolarHBondContact O-N 3.14Å; L147-L447 HydrophobicContact CB-CD2 4.43Å; L147-L447 HydrophobicContact CD2-CD1 4.45Å; L147-L447 HydrophobicContact CD2-CD2 4Å; L147-L447 HydrophobicContact CD2-CG 4.28Å; L147-L447 HydrophobicContact CG-CD1 4.35Å; L147-L447 HydrophobicContact CG-CD2 4.4Å; L147-L472 HydrophobicContact CD2-CD2 3.82Å; L147-A797 HydrophobicContact CD1-CB 4.18Å; L147-F800 HydrophobicContact CB-CB 4.19Å; L147-F800 HydrophobicContact CD1-CB 4.28Å; L147-A801 HydrophobicContact CD1-CB 4.37Å; L147-A801 HydrophobicContact CD2-CB 4.03Å; L147-L804 HydrophobicContact CD2-CD2 4.08Å
148V97.7Very high95.8Very high53 Ų5349.5 Ų49.532%0.32127%0.273SS..Hα-helixtrans-59.1-46.7174.4169.30000110.6T144 I145 I150 V151 T152 L447T144-V148 HydrophobicContact CG2-CG2 4.36Å; T144-V148 WeakPolarHBondContact O-CB 3.36Å; T144-V148 VanDerWaalsContact O-CG2 3.26Å; T144-V148 WeakPolarHBondContact O-CG2 3.37Å; T144-V148 PolarHBondContact O-N 3.35Å; I145-V148 PolarHBondContact O-N 3.33Å; V148-I150 PolarHBondContact O-N 2.64Å; V148-V151 PolarHBondContact O-N 3.22Å; V148-T152 HydrophobicContact CG1-CG2 4.28Å; V148-T152 WeakPolarHBondContact O-CB 3.34Å; V148-T152 VanDerWaalsContact O-CG2 3.24Å; V148-T152 WeakPolarHBondContact O-CG2 3.45Å; V148-T152 PolarHBondContact O-N 3.34Å; V148-T152 PolarHBondContact O-OG1 3.36Å; V148-L447 HydrophobicContact CG2-CD1 3.78Å; V148-L447 HydrophobicContact CG2-CD2 4.12Å
149L97.8Very high96Very high90 Ų9049 Ų4947%0.47127%0.268SS..Hα-helixtrans-60.9-47177.3-70.1174.7000111.4I145 C146 L147 V151 T152 F153I145-L149 HydrophobicContact CG2-CD1 4.04Å; I145-L149 HydrophobicContact CG2-CG 4.47Å; I145-L149 WeakPolarHBondContact O-CG 3.41Å; I145-L149 PolarHBondContact O-N 2.86Å; C146-L149 PolarHBondContact O-N 3.37Å; L147-L149 VanDerWaalsContact C-N 3.35Å; L147-L149 PolarHBondContact O-N 2.95Å; L149-V151 PolarHBondContact O-N 2.84Å; L149-T152 WeakPolarHBondContact CA-OG1 3.36Å; L149-T152 PolarHBondContact O-N 3.49Å; L149-T152 PolarHBondContact O-OG1 3.45Å; L149-F153 WeakPolarHBondContact O-CD2 3.46Å; L149-F153 PolarHBondContact O-N 3.11Å
150I97.8Very high96.2Very high22 Ų2247 Ų4711%0.11326%0.261CS..Hα-helixtrans-62.1-48.9179.9-67.9161.5000111.1C146 L147 V148 T152 F153 Q154 L793 P796 A797 F800C146-I150 WeakPolarHBondContact O-CD1 3.4Å; C146-I150 VanDerWaalsContact O-CG1 3.24Å; C146-I150 WeakPolarHBondContact O-CG1 3.47Å; C146-I150 PolarHBondContact O-N 3.16Å; L147-I150 PolarHBondContact O-N 2.94Å; V148-I150 PolarHBondContact O-N 2.64Å; I150-T152 VanDerWaalsContact C-N 3.34Å; I150-T152 PolarHBondContact O-N 3.28Å; I150-F153 PolarHBondContact O-N 2.66Å; I150-Q154 HydrophobicContact CG2-CG 4.35Å; I150-Q154 WeakPolarHBondContact O-CB 3.37Å; I150-Q154 VanDerWaalsContact O-CG 3.23Å; I150-Q154 WeakPolarHBondContact O-CG 3.46Å; I150-Q154 PolarHBondContact O-N 3.38Å; I150-L793 HydrophobicContact CG2-CB 4.09Å; I150-P796 HydrophobicContact CD1-CB 3.93Å; I150-P796 HydrophobicContact CD1-CG 4.36Å; I150-A797 HydrophobicContact CG2-CB 3.85Å; I150-F800 HydrophobicContact CD1-CD2 3.52Å; I150-F800 HydrophobicContact CD1-CE2 3.74Å
151V97.1Very high96.4Very high0 Ų045.6 Ų45.60%026%0.255CS..Hα-helixtrans-67.4-34.4-177.7178.50000111.5L147 V148 L149 Q154 L155 F440 L443 Y444L147-V151 HydrophobicContact CD1-CG2 3.92Å; L147-V151 HydrophobicContact CG-CG2 4.2Å; L147-V151 WeakPolarHBondContact O-CB 3.39Å; L147-V151 VanDerWaalsContact O-CG2 3.25Å; L147-V151 WeakPolarHBondContact O-CG2 3.37Å; L147-V151 PolarHBondContact O-N 3.14Å; V148-V151 PolarHBondContact O-N 3.22Å; L149-V151 PolarHBondContact O-N 2.84Å; V151-Q154 PolarHBondContact O-N 3.29Å; V151-L155 WeakPolarHBondContact O-CB 3.35Å; V151-L155 PolarHBondContact O-N 3.15Å; V151-F440 HydrophobicContact CG1-CB 4.03Å; V151-F440 HydrophobicContact CG1-CD1 4.14Å; V151-F440 HydrophobicContact CG1-CG 4.23Å; V151-L443 HydrophobicContact CG2-CB 4.3Å; V151-L443 HydrophobicContact CG2-CD1 3.77Å; V151-Y444 HydrophobicContact CG1-CD2 4.09Å; V151-Y444 HydrophobicContact CG1-CE1 4.27Å; V151-Y444 HydrophobicContact CG1-CE2 3.55Å
152T96.7Very high96.5Very high56 Ų5645 Ų4534%0.34425%0.246SC..Hα-helixtrans-66.4-44.5173.648.30000112.1V148 L149 I150 Q154 L155 A156 Y444V148-T152 HydrophobicContact CG1-CG2 4.28Å; V148-T152 WeakPolarHBondContact O-CB 3.34Å; V148-T152 VanDerWaalsContact O-CG2 3.24Å; V148-T152 WeakPolarHBondContact O-CG2 3.45Å; V148-T152 PolarHBondContact O-N 3.34Å; V148-T152 PolarHBondContact O-OG1 3.36Å; L149-T152 WeakPolarHBondContact CA-OG1 3.36Å; L149-T152 PolarHBondContact O-N 3.49Å; L149-T152 PolarHBondContact O-OG1 3.45Å; I150-T152 VanDerWaalsContact C-N 3.34Å; I150-T152 PolarHBondContact O-N 3.28Å; T152-Q154 VanDerWaalsContact C-N 3.33Å; T152-Q154 PolarHBondContact O-N 2.66Å; T152-L155 PolarHBondContact O-N 2.67Å; T152-A156 PolarHBondContact O-N 3.2Å; T152-Y444 WeakPolarHBondContact CA-OH 3.36Å; T152-Y444 WeakPolarHBondContact CG2-OH 3.45Å; T152-Y444 PolarHBondContact N-OH 2.87Å
153F96.6Very high96.5Very high138 Ų13843.5 Ų43.561%0.60524%0.235SC*.Hα-helixtrans-62.1-40.8173.8-82.8-66.3000112.2L149 I150 A156 A157 L793L149-F153 WeakPolarHBondContact O-CD2 3.46Å; L149-F153 PolarHBondContact O-N 3.11Å; I150-F153 PolarHBondContact O-N 2.66Å; F153-A156 PolarHBondContact O-N 3.47Å; F153-A157 PolarHBondContact O-N 3.37Å; F153-L793 HydrophobicContact CB-CD1 4.17Å
154Q96.4Very high96.5Very high0 Ų040.6 Ų40.60%022%0.224CC..Hα-helixtrans-64-41.6175.8-73.6175.4-4700112.6I150 V151 T152 A157 V158 F440 T790 L793 F794I150-Q154 HydrophobicContact CG2-CG 4.35Å; I150-Q154 WeakPolarHBondContact O-CB 3.37Å; I150-Q154 VanDerWaalsContact O-CG 3.23Å; I150-Q154 WeakPolarHBondContact O-CG 3.46Å; I150-Q154 PolarHBondContact O-N 3.38Å; V151-Q154 PolarHBondContact O-N 3.29Å; T152-Q154 VanDerWaalsContact C-N 3.33Å; T152-Q154 PolarHBondContact O-N 2.66Å; Q154-A157 PolarHBondContact O-N 3.24Å; Q154-V158 WeakPolarHBondContact O-CG2 3.37Å; Q154-V158 PolarHBondContact O-N 3.17Å; Q154-F440 HydrophobicContact CB-CE1 3.76Å; Q154-F440 HydrophobicContact CB-CE2 4.2Å; Q154-F440 HydrophobicContact CB-CZ 3.56Å; Q154-F440 HydrophobicContact CG-CE1 4.48Å; Q154-T790 PolarHBondContact NE2-O 2.84Å; Q154-T790 PolarHBondContact O-OG1 3.37Å; Q154-L793 HydrophobicContact CG-CB 3.53Å; Q154-L793 HydrophobicContact CG-CD1 3.77Å; Q154-L793 HydrophobicContact CG-CG 4.31Å; Q154-L793 PolarHBondContact NE2-O 3.43Å; Q154-L793 VanDerWaalsContact NE2-O 3.16Å; Q154-F794 VanDerWaalsContact NE2-CD1 3.34Å
155L96.6Very high96.4Very high60 Ų6040.2 Ų40.231%0.31422%0.22SC..Hα-helixtrans-61-46176.1-179.764.8000110.5V151 T152 A157 V158 V159 F440 Y444V151-L155 WeakPolarHBondContact O-CB 3.35Å; V151-L155 PolarHBondContact O-N 3.15Å; T152-L155 PolarHBondContact O-N 2.67Å; L155-A157 VanDerWaalsContact C-N 3.34Å; L155-A157 PolarHBondContact O-N 2.85Å; L155-V158 PolarHBondContact O-N 3.41Å; L155-V159 HydrophobicContact CD1-CG2 4.41Å; L155-V159 VanDerWaalsContact O-CG2 3.28Å; L155-V159 WeakPolarHBondContact O-CG2 3.37Å; L155-V159 PolarHBondContact O-N 2.78Å; L155-F440 HydrophobicContact CB-CD2 4.25Å; L155-F440 HydrophobicContact CD1-CD2 3.98Å; L155-Y444 HydrophobicContact CD2-CE2 4.28Å
156A95.5Very high96.3Very high51 Ų5139 Ų3942%0.42121%0.212SC..Hα-helixtrans-59.3-43.8175.900000112T152 F153 V158 V159 L160T152-A156 PolarHBondContact O-N 3.2Å; F153-A156 PolarHBondContact O-N 3.47Å; A156-V158 PolarHBondContact O-N 3.23Å; A156-V159 PolarHBondContact O-N 3.28Å; A156-L160 WeakPolarHBondContact O-CG 3.38Å; A156-L160 PolarHBondContact O-N 3.49Å
157A96.1Very high96.1Very high14 Ų1437.5 Ų37.512%0.11620%0.202CC..Hα-helixtrans-63.2-40.2177.500000113F153 Q154 L155 L160 A161 F789F153-A157 PolarHBondContact O-N 3.37Å; Q154-A157 PolarHBondContact O-N 3.24Å; L155-A157 VanDerWaalsContact C-N 3.34Å; L155-A157 PolarHBondContact O-N 2.85Å; A157-L160 PolarHBondContact O-N 3.43Å; A157-A161 PolarHBondContact O-N 3.43Å; A157-F789 HydrophobicContact CB-CB 4.28Å
158V96.2Very high96Very high0 Ų038.4 Ų38.40%021%0.206CC..Hα-helixtrans-70.2-37.9175.61730000112.1Q154 L155 A156 L160 A161 F162 L433 P436 I437 F440 T790Q154-V158 WeakPolarHBondContact O-CG2 3.37Å; Q154-V158 PolarHBondContact O-N 3.17Å; L155-V158 PolarHBondContact O-N 3.41Å; A156-V158 PolarHBondContact O-N 3.23Å; V158-L160 VanDerWaalsContact C-N 3.3Å; V158-L160 PolarHBondContact O-N 3.11Å; V158-A161 CarbonylContact O-C 3.36Å; V158-A161 WeakPolarHBondContact O-CB 3.33Å; V158-A161 PolarHBondContact O-N 3.17Å; V158-A161 VanDerWaalsContact O-N 3.14Å; V158-F162 PolarHBondContact O-N 3.38Å; V158-L433 HydrophobicContact CG1-CD2 4.37Å; V158-P436 HydrophobicContact CG1-CG 4.14Å; V158-P436 HydrophobicContact CG2-CB 4.04Å; V158-P436 HydrophobicContact CG2-CG 4.01Å; V158-I437 HydrophobicContact CG1-CD1 4.31Å; V158-I437 HydrophobicContact CG1-CG1 3.91Å; V158-F440 HydrophobicContact CB-CE2 4.11Å; V158-F440 HydrophobicContact CG2-CE2 3.61Å; V158-F440 HydrophobicContact CG2-CZ 3.94Å; V158-T790 HydrophobicContact CG2-CG2 3.65Å; V158-T790 WeakPolarHBondContact CG2-OG1 3.3Å
159V95.1Very high95.7Very high71 Ų7137 Ų3743%0.4320%0.196SC..Hα-helixtrans-60.9-42.7174.8169.30000110.4L155 A156 A161 F162 I163L155-V159 HydrophobicContact CD1-CG2 4.41Å; L155-V159 VanDerWaalsContact O-CG2 3.28Å; L155-V159 WeakPolarHBondContact O-CG2 3.37Å; L155-V159 PolarHBondContact O-N 2.78Å; A156-V159 PolarHBondContact O-N 3.28Å; V159-A161 VanDerWaalsContact C-N 3.35Å; V159-A161 PolarHBondContact O-N 3.1Å; V159-F162 WeakPolarHBondContact O-CB 3.26Å; V159-F162 PolarHBondContact O-N 3.35Å; V159-I163 HydrophobicContact CG1-CD1 4.01Å; V159-I163 WeakPolarHBondContact O-CG1 3.39Å; V159-I163 PolarHBondContact O-N 2.98Å
160L95.2Very high95.4Very high36 Ų3634.9 Ų34.919%0.18818%0.183CC..Hα-helixtrans-63.3-40.2173-67.1168.9000112V41 F43 A156 A157 V158 F162 I163 N164V41-L160 HydrophobicContact CG1-CD2 3.89Å; F43-L160 HydrophobicContact CE1-CD2 3.92Å; F43-L160 HydrophobicContact CE2-CD1 3.81Å; F43-L160 HydrophobicContact CZ-CD1 3.49Å; F43-L160 VanDerWaalsContact CZ-CD1 3.49Å; F43-L160 HydrophobicContact CZ-CD2 3.57Å; F43-L160 HydrophobicContact CZ-CG 4.16Å; A156-L160 WeakPolarHBondContact O-CG 3.38Å; A156-L160 PolarHBondContact O-N 3.49Å; A157-L160 PolarHBondContact O-N 3.43Å; V158-L160 VanDerWaalsContact C-N 3.3Å; V158-L160 PolarHBondContact O-N 3.11Å; L160-F162 VanDerWaalsContact C-N 3.27Å; L160-F162 PolarHBondContact O-N 3.44Å; L160-I163 PolarHBondContact O-N 2.89Å; L160-N164 VanDerWaalsContact O-CB 3.29Å; L160-N164 WeakPolarHBondContact O-CB 3.41Å; L160-N164 PolarHBondContact O-N 3.4Å; L160-N164 PolarHBondContact O-ND2 3Å
161A96.2Very high95.1Very high0 Ų034 Ų340%018%0.179CC..Hα-helixtrans-61.6-38.3174.600000111.5A157 V158 V159 N164 H165 L433 F783A157-A161 PolarHBondContact O-N 3.43Å; V158-A161 CarbonylContact O-C 3.36Å; V158-A161 WeakPolarHBondContact O-CB 3.33Å; V158-A161 PolarHBondContact O-N 3.17Å; V158-A161 VanDerWaalsContact O-N 3.14Å; V159-A161 VanDerWaalsContact C-N 3.35Å; V159-A161 PolarHBondContact O-N 3.1Å; A161-N164 PolarHBondContact O-N 3.49Å; A161-H165 VanDerWaalsContact O-CB 3.3Å; A161-H165 WeakPolarHBondContact O-CB 3.46Å; A161-H165 PolarHBondContact O-N 2.97Å; A161-L433 HydrophobicContact CB-CD1 4.36Å; A161-L433 HydrophobicContact CB-CD2 3.91Å; A161-F783 HydrophobicContact CB-CD2 4.25Å
162F95.4Very high94.7Very high74 Ų7434.7 Ų34.733%0.32518%0.183SC..Hα-helixtrans-65.6-47.8177.1-162-80.5000112.1V158 V159 L160 N164 H165 H166 V430 L433V158-F162 PolarHBondContact O-N 3.38Å; V159-F162 WeakPolarHBondContact O-CB 3.26Å; V159-F162 PolarHBondContact O-N 3.35Å; L160-F162 VanDerWaalsContact C-N 3.27Å; L160-F162 PolarHBondContact O-N 3.44Å; F162-N164 VanDerWaalsContact C-N 3.34Å; F162-N164 PolarHBondContact O-N 2.98Å; F162-H165 PolarHBondContact O-N 3.36Å; F162-H166 PolarHBondContact O-N 3.46Å; F162-V430 HydrophobicContact CE2-CB 4.45Å; F162-V430 HydrophobicContact CE2-CG1 4.06Å; F162-V430 HydrophobicContact CE2-CG2 4.13Å; F162-V430 HydrophobicContact CZ-CG1 4.28Å; F162-V430 HydrophobicContact CZ-CG2 4.07Å; F162-L433 VanDerWaalsContact CA-CD1 3.48Å; F162-L433 HydrophobicContact CB-CD1 3.99Å; F162-L433 HydrophobicContact CD2-CB 4.16Å; F162-L433 HydrophobicContact CD2-CD1 3.94Å; F162-L433 HydrophobicContact CG-CD1 4.32Å
163I95.2Very high94.1Very high35 Ų3534.6 Ų34.618%0.17918%0.182CC..Hα-helixtrans-60.7-45.9176.8-66166.1000110.3L37 V41 V159 L160 H165 H166 L167L37-I163 HydrophobicContact CD1-CD1 4.26Å; L37-I163 HydrophobicContact CD1-CG1 4.26Å; L37-I163 HydrophobicContact CD1-CG2 3.65Å; L37-I163 HydrophobicContact CD2-CG2 3.9Å; L37-I163 HydrophobicContact CG-CG2 3.57Å; V41-I163 HydrophobicContact CG1-CB 4.18Å; V41-I163 HydrophobicContact CG1-CD1 4.2Å; V41-I163 HydrophobicContact CG1-CG2 3.54Å; V41-I163 HydrophobicContact CG2-CG2 4.34Å; V159-I163 HydrophobicContact CG1-CD1 4.01Å; V159-I163 WeakPolarHBondContact O-CG1 3.39Å; V159-I163 PolarHBondContact O-N 2.98Å; L160-I163 PolarHBondContact O-N 2.89Å; I163-H165 PolarHBondContact O-N 3.26Å; I163-H166 WeakPolarHBondContact O-CB 3.33Å; I163-H166 PolarHBondContact O-N 2.92Å; I163-L167 HydrophobicContact CG2-CD1 3.84Å; I163-L167 HydrophobicContact CG2-CG 4.26Å; I163-L167 WeakPolarHBondContact O-CG 3.36Å; I163-L167 PolarHBondContact O-N 3.34Å
164N96Very high93.5Very high0 Ų028.7 Ų28.70%016%0.158CC..Hα-helixtrans-67.7-33.4179.8-76.8-56.3000113S44 Y45 L160 A161 F162 L167 F168 P779 A782 F783S44-N164 PolarHBondContact OG-ND2 3.28Å; S44-N164 VanDerWaalsContact OG-ND2 3.16Å; Y45-N164 WeakPolarHBondContact CE1-OD1 3.45Å; L160-N164 VanDerWaalsContact O-CB 3.29Å; L160-N164 WeakPolarHBondContact O-CB 3.41Å; L160-N164 PolarHBondContact O-N 3.4Å; L160-N164 PolarHBondContact O-ND2 3Å; A161-N164 PolarHBondContact O-N 3.49Å; F162-N164 VanDerWaalsContact C-N 3.34Å; F162-N164 PolarHBondContact O-N 2.98Å; N164-L167 PolarHBondContact O-N 2.81Å; N164-F168 VanDerWaalsContact O-CB 3.3Å; N164-F168 WeakPolarHBondContact O-CB 3.42Å; N164-F168 PolarHBondContact O-N 3.17Å; N164-P779 WeakPolarHBondContact O-CB 3.32Å; N164-A782 HydrophobicContact CB-CB 4.18Å; N164-A782 WeakPolarHBondContact ND2-CB 3.48Å; N164-F783 HydrophobicContact CB-CB 4.37Å
165H95.1Very high92.7Very high11 Ų1134.3 Ų34.35%0.05118%0.179CC..Hα-helixtrans-65.5-41.6171.8-174.762.9000111.8A161 F162 I163 F168 H169 V425 L426 G429 L433 F783A161-H165 VanDerWaalsContact O-CB 3.3Å; A161-H165 WeakPolarHBondContact O-CB 3.46Å; A161-H165 PolarHBondContact O-N 2.97Å; F162-H165 PolarHBondContact O-N 3.36Å; I163-H165 PolarHBondContact O-N 3.26Å; H165-F168 PolarHBondContact O-N 2.92Å; H165-H169 PolarHBondContact O-N 3.45Å; H165-V425 PolarHBondContact CE1-O 3.29Å; H165-V425 VanDerWaalsContact CE1-O 3.3Å; H165-V425 PolarHBondContact NE2-O 2.79Å; H165-L426 WeakPolarHBondContact NE2-CA 3.44Å; H165-L426 PolarHBondContact NE2-O 3.29Å; H165-G429 WeakPolarHBondContact NE2-CA 3.36Å; H165-L433 HydrophobicContact CB-CD1 4.31Å; H165-F783 HydrophobicContact CB-CD2 3.89Å; H165-F783 HydrophobicContact CB-CE2 4.34Å
166H94.2Very high92.1Very high68 Ų6832.6 Ų32.632%0.31517%0.17SC..Hα-helixtrans-64.2-45.6173.5-175.7-71.8000111.9F162 I163 F168 H169 E170F162-H166 PolarHBondContact O-N 3.46Å; I163-H166 WeakPolarHBondContact O-CB 3.33Å; I163-H166 PolarHBondContact O-N 2.92Å; H166-F168 VanDerWaalsContact C-N 3.28Å; H166-F168 PolarHBondContact O-N 3.2Å; H166-H169 WeakPolarHBondContact O-CB 3.49Å; H166-H169 PolarHBondContact O-N 3.34Å; H166-H169 VanDerWaalsContact O-N 3.16Å; H166-E170 VanDerWaalsContact CE1-CG 3.49Å; H166-E170 WeakPolarHBondContact CE1-CG 3.39Å; H166-E170 IonicContact CE1-OE1 3.92Å; H166-E170 WeakPolarHBondContact O-CG 3.28Å; H166-E170 PolarHBondContact O-N 3.37Å
167L94.6Very high91.7Very high9 Ų932.2 Ų32.25%0.04716%0.163CC..Hα-helixtrans-63.4-35.2176.7-71.2171.5000112T34 L37 R38 V41 I163 N164 E170 A171 P779T34-L167 HydrophobicContact CG2-CD2 3.86Å; L37-L167 HydrophobicContact CB-CD2 4.48Å; L37-L167 HydrophobicContact CD2-CD2 4.3Å; L37-L167 HydrophobicContact CG-CD2 4.4Å; R38-L167 HydrophobicContact CB-CD1 4.27Å; R38-L167 HydrophobicContact CB-CD2 4.07Å; V41-L167 HydrophobicContact CG2-CD1 3.47Å; V41-L167 VanDerWaalsContact CG2-CD1 3.47Å; I163-L167 HydrophobicContact CG2-CD1 3.84Å; I163-L167 HydrophobicContact CG2-CG 4.26Å; I163-L167 WeakPolarHBondContact O-CG 3.36Å; I163-L167 PolarHBondContact O-N 3.34Å; N164-L167 PolarHBondContact O-N 2.81Å; L167-E170 PolarHBondContact O-N 2.63Å; L167-A171 WeakPolarHBondContact O-CB 3.36Å; L167-A171 PolarHBondContact O-N 3.32Å; L167-P779 HydrophobicContact CB-CB 3.93Å
168F94.6Very high91.3Very high19 Ų1937.1 Ų37.18%0.08318%0.179CC..Hα-helixtrans-63.7-44.1172.6176.1-111.7000111.2N164 H165 H166 A171 L172 F776 P779 F780N164-F168 VanDerWaalsContact O-CB 3.3Å; N164-F168 WeakPolarHBondContact O-CB 3.42Å; N164-F168 PolarHBondContact O-N 3.17Å; H165-F168 PolarHBondContact O-N 2.92Å; H166-F168 VanDerWaalsContact C-N 3.28Å; H166-F168 PolarHBondContact O-N 3.2Å; F168-A171 WeakPolarHBondContact O-CB 3.43Å; F168-A171 PolarHBondContact O-N 2.72Å; F168-L172 HydrophobicContact CD1-CD1 4.23Å; F168-L172 HydrophobicContact CE1-CD1 3.65Å; F168-L172 HydrophobicContact CE2-CD1 4.28Å; F168-L172 HydrophobicContact CE2-CD2 4.32Å; F168-L172 HydrophobicContact CE2-CG 4.37Å; F168-L172 HydrophobicContact CZ-CD1 3.68Å; F168-L172 HydrophobicContact CZ-CD2 4.32Å; F168-L172 HydrophobicContact CZ-CG 4.25Å; F168-L172 WeakPolarHBondContact O-CG 3.33Å; F168-L172 PolarHBondContact O-N 2.9Å; F168-F776 AromaticContact CE2-CD2 3.81Å; F168-F776 HydrophobicContact CE2-CD2 3.81Å; F168-F776 HydrophobicContact CE2-CE1 4.34Å; F168-F776 AromaticContact CE2-CE2 3.58Å; F168-F776 HydrophobicContact CE2-CE2 3.58Å; F168-F776 HydrophobicContact CE2-CG 4.3Å; F168-F776 AromaticContact CE2-CZ 3.86Å; F168-F776 HydrophobicContact CE2-CZ 3.86Å; F168-F776 AromaticContact CZ-CE2 3.97Å; F168-F776 HydrophobicContact CZ-CE2 3.97Å; F168-F776 HydrophobicContact CZ-CZ 4.18Å; F168-P779 HydrophobicContact CB-CB 4.09Å; F168-P779 HydrophobicContact CB-CG 4.37Å; F168-F780 HydrophobicContact CD1-CD2 4.4Å; F168-F780 HydrophobicContact CD2-CB 3.81Å; F168-F780 HydrophobicContact CD2-CD2 4.01Å; F168-F780 HydrophobicContact CD2-CG 4.41Å; F168-F780 HydrophobicContact CE1-CD2 4.02Å; F168-F780 HydrophobicContact CE1-CE2 4.48Å; F168-F780 HydrophobicContact CE2-CB 3.96Å; F168-F780 AromaticContact CE2-CD2 3.59Å; F168-F780 HydrophobicContact CE2-CD2 3.59Å; F168-F780 HydrophobicContact CE2-CG 4.17Å; F168-F780 HydrophobicContact CG-CD2 4.4Å; F168-F780 AromaticContact CZ-CD2 3.58Å; F168-F780 HydrophobicContact CZ-CD2 3.58Å; F168-F780 HydrophobicContact CZ-CE2 4.13Å
169H92.1Very high91Very high23 Ų2337.7 Ų37.711%0.10618%0.182CC..Hα-helixtrans-60.2-47.9173.7173.9-91.4000112.3H165 H166 A171 L172 V173 L426H165-H169 PolarHBondContact O-N 3.45Å; H166-H169 WeakPolarHBondContact O-CB 3.49Å; H166-H169 PolarHBondContact O-N 3.34Å; H166-H169 VanDerWaalsContact O-N 3.16Å; H169-A171 PolarHBondContact O-N 3.39Å; H169-L172 WeakPolarHBondContact O-CB 3.32Å; H169-L172 PolarHBondContact O-N 3.11Å; H169-V173 PolarHBondContact O-N 2.98Å; H169-L426 HydrophobicContact CB-CD1 3.92Å
170E90.6Very high90.7Very high46 Ų4634.3 Ų34.322%0.21516%0.161CC..Hα-helixtrans-59.1-37.4175.4-71.4-60.1142.900111.9T34 H166 L167 L172 V173 S174 I179T34-E170 HydrophobicContact CG2-CB 4.12Å; T34-E170 HydrophobicContact CG2-CG 4.05Å; H166-E170 VanDerWaalsContact CE1-CG 3.49Å; H166-E170 WeakPolarHBondContact CE1-CG 3.39Å; H166-E170 IonicContact CE1-OE1 3.92Å; H166-E170 WeakPolarHBondContact O-CG 3.28Å; H166-E170 PolarHBondContact O-N 3.37Å; L167-E170 PolarHBondContact O-N 2.63Å; E170-L172 PolarHBondContact O-N 2.91Å; E170-V173 PolarHBondContact O-N 3.36Å; E170-S174 WeakPolarHBondContact O-CA 3.39Å; E170-S174 WeakPolarHBondContact O-CB 3.13Å; E170-S174 PolarHBondContact O-N 3.04Å; E170-I179 HydrophobicContact CB-CG2 3.83Å
171A91.5Very high90.4Very high2 Ų232.9 Ų32.92%0.01716%0.155CC..Hα-helixtrans-64-26.6174.400000113.1L167 F168 H169 I179 G180 A181 T775L167-A171 WeakPolarHBondContact O-CB 3.36Å; L167-A171 PolarHBondContact O-N 3.32Å; F168-A171 WeakPolarHBondContact O-CB 3.43Å; F168-A171 PolarHBondContact O-N 2.72Å; H169-A171 PolarHBondContact O-N 3.39Å; A171-I179 WeakPolarHBondContact CA-O 3.44Å; A171-G180 CarbonylContact O-C 3.6Å; A171-G180 WeakPolarHBondContact O-CA 3.24Å; A171-A181 WeakPolarHBondContact O-CB 3.5Å; A171-A181 PolarHBondContact O-N 3.34Å; A171-T775 HydrophobicContact CB-CG2 4.02Å; A171-T775 WeakPolarHBondContact CB-O 3.47Å
172L87.9Confident89.7Confident16 Ų1634.1 Ų34.18%0.08416%0.16CC..Hα-helixtrans-86.1-33.5177.7-62.9176.6000113F168 H169 E170 F182 V422 F776F168-L172 HydrophobicContact CD1-CD1 4.23Å; F168-L172 HydrophobicContact CE1-CD1 3.65Å; F168-L172 HydrophobicContact CE2-CD1 4.28Å; F168-L172 HydrophobicContact CE2-CD2 4.32Å; F168-L172 HydrophobicContact CE2-CG 4.37Å; F168-L172 HydrophobicContact CZ-CD1 3.68Å; F168-L172 HydrophobicContact CZ-CD2 4.32Å; F168-L172 HydrophobicContact CZ-CG 4.25Å; F168-L172 WeakPolarHBondContact O-CG 3.33Å; F168-L172 PolarHBondContact O-N 2.9Å; H169-L172 WeakPolarHBondContact O-CB 3.32Å; H169-L172 PolarHBondContact O-N 3.11Å; E170-L172 PolarHBondContact O-N 2.91Å; L172-F182 HydrophobicContact CB-CE2 4.35Å; L172-F182 HydrophobicContact CD2-CE2 3.61Å; L172-F182 HydrophobicContact CD2-CZ 4.14Å; L172-F182 WeakPolarHBondContact O-CD2 3.12Å; L172-V422 HydrophobicContact CB-CG1 3.89Å; L172-V422 HydrophobicContact CB-CG2 4.42Å; L172-V422 HydrophobicContact CD1-CG1 3.84Å; L172-V422 HydrophobicContact CD1-CG2 4.16Å; L172-F776 HydrophobicContact CD2-CD2 3.69Å; L172-F776 HydrophobicContact CD2-CE2 3.65Å
173V83.9Confident89.2Confident53 Ų5331.4 Ų31.432%0.32115%0.151SC..Hα-helixtrans-104.5-27.8-170.2-177.20000113.1H169 E170 R175 L419 V422H169-V173 PolarHBondContact O-N 2.98Å; E170-V173 PolarHBondContact O-N 3.36Å; V173-R175 PolarHBondContact O-N 3.26Å; V173-L419 HydrophobicContact CG1-CD1 3.75Å; V173-L419 HydrophobicContact CG2-CD1 3.97Å; V173-V422 HydrophobicContact CG2-CB 4.47Å; V173-V422 HydrophobicContact CG2-CG1 3.6Å
174S84.4Confident88.9Confident15 Ų1531.1 Ų31.111%0.10515%0.148CC..  trans-66.4135.2-171.5-1740000112.5E170 D176 G180 S183E170-S174 WeakPolarHBondContact O-CA 3.39Å; E170-S174 WeakPolarHBondContact O-CB 3.13Å; E170-S174 PolarHBondContact O-N 3.04Å; S174-D176 PolarHBondContact OG-N 2.94Å; S174-G180 WeakPolarHBondContact O-CA 3.48Å; S174-S183 PolarHBondContact O-OG 3.34Å; S174-S183 VanDerWaalsContact O-OG 3.09Å
175R79.3Confident88.4Confident117 Ų11732 Ų3244%0.44216%0.156SC..  trans-85.1-20178.6-62.7175.5-175.8173.6-5.2112.6C21 S23 V173 P177 S183C21-R175 VanDerWaalsContact O-CD 3.24Å; C21-R175 WeakPolarHBondContact O-CD 3.47Å; C21-R175 PolarHBondContact O-NE 3.43Å; S23-R175 PolarHBondContact O-NH1 3.45Å; S23-R175 PolarHBondContact OG-NH1 2.91Å; V173-R175 PolarHBondContact O-N 3.26Å; R175-P177 WeakPolarHBondContact O-CD 3.31Å; R175-S183 WeakPolarHBondContact O-CB 3.36Å; R175-S183 PolarHBondContact O-OG 3.4Å
176D84.5Confident87.9Confident24 Ų2432.9 Ų32.913%0.12816%0.161CC..SBendtrans-74.6119.7176.3-168.6-45.4000109.2T31 S174 R178 I179 G180 S183T31-D176 HydrophobicContact CG2-CB 4.42Å; T31-D176 WeakPolarHBondContact CG2-OD2 3.49Å; S174-D176 PolarHBondContact OG-N 2.94Å; D176-R178 PolarHBondContact O-N 3.25Å; D176-R178 WeakPolarHBondContact OD1-CB 3.49Å; D176-R178 WeakPolarHBondContact OD1-CG 3.31Å; D176-R178 PolarHBondContact OD1-N 2.86Å; D176-R178 IonicContact OD1-NE 2.83Å; D176-R178 PolarHBondContact OD1-NE 3.09Å; D176-R178 IonicContact OD2-CZ 3.28Å; D176-R178 IonicContact OD2-NE 3.38Å; D176-R178 PolarHBondContact OD2-NE 3.27Å; D176-R178 IonicContact OD2-NH2 3.28Å; D176-R178 PolarHBondContact OD2-NH2 2.66Å; D176-I179 PolarHBondContact O-N 3.19Å; D176-G180 PolarHBondContact O-N 3.01Å; D176-S183 PolarHBondContact O-OG 3.37Å
177P87.2Confident87.7Confident43 Ų4332.1 Ų32.128%0.27916%0.159SC..THydrogen-bonded Turntrans-64.1-9-179.828.2-36.3000113.7R175 I179 S183 Q184 L187R175-P177 WeakPolarHBondContact O-CD 3.31Å; P177-I179 VanDerWaalsContact C-N 3.29Å; P177-S183 WeakPolarHBondContact CA-OG 3.2Å; P177-Q184 HydrophobicContact CB-CB 4.24Å; P177-Q184 WeakPolarHBondContact O-CB 3.43Å; P177-Q184 WeakPolarHBondContact O-CG 3.35Å; P177-L187 HydrophobicContact CB-CB 4.32Å; P177-L187 HydrophobicContact CB-CD2 3.81Å; P177-L187 HydrophobicContact CG-CD2 3.86Å
178R88.3Confident87.5Confident118 Ų11832.1 Ų32.145%0.44516%0.16SC..THydrogen-bonded Turntrans-73.8-22.4170.9-59.9176.9-74.6-177.1-3.3112.1D28 L35 R38 D176D28-R178 IonicContact OD1-NH2 3.18Å; D28-R178 PolarHBondContact OD1-NH2 2.96Å; L35-R178 HydrophobicContact CD1-CB 4.41Å; L35-R178 HydrophobicContact CD2-CB 4.18Å; R38-R178 PolarHBondContact NH1-O 3.44Å; D176-R178 PolarHBondContact O-N 3.25Å; D176-R178 WeakPolarHBondContact OD1-CB 3.49Å; D176-R178 WeakPolarHBondContact OD1-CG 3.31Å; D176-R178 PolarHBondContact OD1-N 2.86Å; D176-R178 IonicContact OD1-NE 2.83Å; D176-R178 PolarHBondContact OD1-NE 3.09Å; D176-R178 IonicContact OD2-CZ 3.28Å; D176-R178 IonicContact OD2-NE 3.38Å; D176-R178 PolarHBondContact OD2-NE 3.27Å; D176-R178 IonicContact OD2-NH2 3.28Å; D176-R178 PolarHBondContact OD2-NH2 2.66Å
179I88.6Confident87.1Confident11 Ų1132.2 Ų32.26%0.05616%0.161CC..THydrogen-bonded Turntrans-121.9-44-175.7-60170000111.7T31 T34 L35 E170 A171 D176 P177 T775T31-I179 HydrophobicContact CG2-CD1 3.6Å; T31-I179 HydrophobicContact CG2-CG1 4.34Å; T34-I179 HydrophobicContact CG2-CD1 3.82Å; T34-I179 HydrophobicContact CG2-CG1 4.25Å; T34-I179 HydrophobicContact CG2-CG2 3.79Å; L35-I179 HydrophobicContact CD2-CG1 4.01Å; L35-I179 HydrophobicContact CG-CD1 4.44Å; L35-I179 HydrophobicContact CG-CG1 4.2Å; E170-I179 HydrophobicContact CB-CG2 3.83Å; A171-I179 WeakPolarHBondContact CA-O 3.44Å; D176-I179 PolarHBondContact O-N 3.19Å; P177-I179 VanDerWaalsContact C-N 3.29Å; I179-T775 WeakPolarHBondContact O-CG2 3.43Å
180G88.6Confident86.8Confident0 Ų034.3 Ų34.30%017%0.172CC..  trans-82.4127.7-174.500000113.2A171 S174 D176 S183 Q184A171-G180 CarbonylContact O-C 3.6Å; A171-G180 WeakPolarHBondContact O-CA 3.24Å; S174-G180 WeakPolarHBondContact O-CA 3.48Å; D176-G180 PolarHBondContact O-N 3.01Å; G180-S183 WeakPolarHBondContact CA-OG 3.43Å; G180-S183 PolarHBondContact O-OG 3.1Å; G180-Q184 WeakPolarHBondContact O-CB 3.43Å; G180-Q184 PolarHBondContact O-N 3.38Å
181A89.1Confident86.9Confident6 Ų634.4 Ų34.45%0.0517%0.172CC..Hα-helixtrans-65.6-41176.800000111.7A171 A185 S771 T775 F776A171-A181 WeakPolarHBondContact O-CB 3.5Å; A171-A181 PolarHBondContact O-N 3.34Å; A181-A185 VanDerWaalsContact O-CB 3.29Å; A181-A185 WeakPolarHBondContact O-CB 3.08Å; A181-A185 PolarHBondContact O-N 3.34Å; A181-S771 WeakPolarHBondContact CB-O 3.41Å; A181-S771 WeakPolarHBondContact O-CB 3.19Å; A181-T775 HydrophobicContact CB-CG2 4.02Å; A181-F776 HydrophobicContact CB-CB 3.93Å
182F83.3Confident86.8Confident27 Ų2735.7 Ų35.712%0.11818%0.178CC..Hα-helixtrans-73.7-43.1-179.7-61.7-70.9000112.6L16 I18 L172 Q184 A185 N186 Y418L16-F182 HydrophobicContact CD2-CZ 4.35Å; I18-F182 HydrophobicContact CB-CD1 4.31Å; I18-F182 HydrophobicContact CB-CE1 4.48Å; I18-F182 HydrophobicContact CD1-CD1 3.86Å; I18-F182 HydrophobicContact CD1-CE1 3.77Å; I18-F182 HydrophobicContact CG1-CD1 4.01Å; I18-F182 HydrophobicContact CG1-CE1 3.79Å; I18-F182 HydrophobicContact CG2-CB 4Å; I18-F182 HydrophobicContact CG2-CD1 3.39Å; I18-F182 HydrophobicContact CG2-CE1 4Å; I18-F182 HydrophobicContact CG2-CG 3.78Å; L172-F182 HydrophobicContact CB-CE2 4.35Å; L172-F182 HydrophobicContact CD2-CE2 3.61Å; L172-F182 HydrophobicContact CD2-CZ 4.14Å; L172-F182 WeakPolarHBondContact O-CD2 3.12Å; F182-Q184 VanDerWaalsContact C-N 3.3Å; F182-Q184 PolarHBondContact O-N 2.76Å; F182-A185 PolarHBondContact O-N 3.19Å; F182-N186 WeakPolarHBondContact O-CB 3.49Å; F182-N186 PolarHBondContact O-N 2.83Å; F182-Y418 WeakPolarHBondContact CE2-OH 3.22Å; F182-Y418 WeakPolarHBondContact CZ-OH 3.48Å
183S84.6Confident86.8Confident17 Ų1736.7 Ų36.712%0.11918%0.182CC..Hα-helixtrans-62.4-38.9174.351.60000111.4S174 R175 D176 P177 G180 N186 L187S174-S183 PolarHBondContact O-OG 3.34Å; S174-S183 VanDerWaalsContact O-OG 3.09Å; R175-S183 WeakPolarHBondContact O-CB 3.36Å; R175-S183 PolarHBondContact O-OG 3.4Å; D176-S183 PolarHBondContact O-OG 3.37Å; P177-S183 WeakPolarHBondContact CA-OG 3.2Å; G180-S183 WeakPolarHBondContact CA-OG 3.43Å; G180-S183 PolarHBondContact O-OG 3.1Å; S183-N186 PolarHBondContact O-N 3.39Å; S183-L187 WeakPolarHBondContact O-CB 3.48Å; S183-L187 PolarHBondContact O-N 3.3Å
184Q89.1Confident87.1Confident28 Ų2839.5 Ų39.513%0.13119%0.192CC..Hα-helixtrans-67.5-40.2173.7-168.5175.723.900113P177 G180 F182 L187 S188 R767 S771 T775P177-Q184 HydrophobicContact CB-CB 4.24Å; P177-Q184 WeakPolarHBondContact O-CB 3.43Å; P177-Q184 WeakPolarHBondContact O-CG 3.35Å; G180-Q184 WeakPolarHBondContact O-CB 3.43Å; G180-Q184 PolarHBondContact O-N 3.38Å; F182-Q184 VanDerWaalsContact C-N 3.3Å; F182-Q184 PolarHBondContact O-N 2.76Å; Q184-L187 PolarHBondContact O-N 3.17Å; Q184-S188 WeakPolarHBondContact O-CB 3.46Å; Q184-S188 PolarHBondContact O-N 3.19Å; Q184-R767 HydrophobicContact CG-CG 3.67Å; Q184-S771 VanDerWaalsContact OE1-CA 3.31Å; Q184-T775 PolarHBondContact OE1-OG1 3.32Å
185A85.7Confident87.4Confident19 Ų1939 Ų3916%0.15719%0.189CC..Hα-helixtrans-63.8-42.917400000111.3A181 F182 S188 L189A181-A185 VanDerWaalsContact O-CB 3.29Å; A181-A185 WeakPolarHBondContact O-CB 3.08Å; A181-A185 PolarHBondContact O-N 3.34Å; F182-A185 PolarHBondContact O-N 3.19Å; A185-S188 WeakPolarHBondContact O-CB 3.24Å; A185-S188 PolarHBondContact O-N 2.94Å; A185-L189 WeakPolarHBondContact O-CG 3.46Å; A185-L189 PolarHBondContact O-N 2.96Å
186N84.3Confident87.7Confident30 Ų3033.7 Ų33.716%0.1617%0.169CC..Hα-helixtrans-62-46.5175.8-174.740.6000111.4F182 S183 S188 L189 I190 R403 I406F182-N186 WeakPolarHBondContact O-CB 3.49Å; F182-N186 PolarHBondContact O-N 2.83Å; S183-N186 PolarHBondContact O-N 3.39Å; N186-S188 VanDerWaalsContact C-N 3.33Å; N186-S188 PolarHBondContact O-N 3.46Å; N186-L189 PolarHBondContact O-N 2.85Å; N186-L189 VanDerWaalsContact O-N 3.14Å; N186-I190 WeakPolarHBondContact O-CG1 3.41Å; N186-I190 PolarHBondContact O-N 3.16Å; N186-R403 WeakPolarHBondContact OD1-CG 3.5Å; N186-I406 HydrophobicContact CB-CG2 4.26Å
187L88.7Confident87.8Confident52 Ų5239.7 Ų39.727%0.27219%0.194SC..Hα-helixtrans-58.7-44.4174.6178.462000111.6P177 S183 Q184 L189 I190 E191P177-L187 HydrophobicContact CB-CB 4.32Å; P177-L187 HydrophobicContact CB-CD2 3.81Å; P177-L187 HydrophobicContact CG-CD2 3.86Å; S183-L187 WeakPolarHBondContact O-CB 3.48Å; S183-L187 PolarHBondContact O-N 3.3Å; Q184-L187 PolarHBondContact O-N 3.17Å; L187-L189 VanDerWaalsContact C-N 3.3Å; L187-L189 PolarHBondContact O-N 3.4Å; L187-I190 PolarHBondContact O-N 3.04Å; L187-E191 HydrophobicContact CD1-CG 4.07Å; L187-E191 HydrophobicContact CG-CG 4.41Å; L187-E191 WeakPolarHBondContact O-CG 3.35Å; L187-E191 PolarHBondContact O-N 3.43Å
188S90.6Very high87.8Confident9 Ų941.9 Ų41.96%0.06320%0.203CC..Hα-helixtrans-56.1-43.9174.61670000111.8Q184 A185 N186 F192 A764 G768Q184-S188 WeakPolarHBondContact O-CB 3.46Å; Q184-S188 PolarHBondContact O-N 3.19Å; A185-S188 WeakPolarHBondContact O-CB 3.24Å; A185-S188 PolarHBondContact O-N 2.94Å; N186-S188 VanDerWaalsContact C-N 3.33Å; N186-S188 PolarHBondContact O-N 3.46Å; S188-F192 WeakPolarHBondContact O-CB 3.21Å; S188-F192 PolarHBondContact O-N 3Å; S188-A764 WeakPolarHBondContact CB-O 3.23Å; S188-A764 PolarHBondContact OG-O 3.03Å; S188-G768 VanDerWaalsContact OG-CA 3.25Å; S188-G768 WeakPolarHBondContact OG-CA 3.18Å; S188-G768 PolarHBondContact OG-N 3.5Å; S188-G768 VanDerWaalsContact OG-N 3.13Å
189L85.8Confident87.6Confident20 Ų2036.7 Ų36.711%0.10518%0.184CC..Hα-helixtrans-67.5-36.3178-68.3171.6000112.9A185 N186 L187 E193 L399 I402 R403 I406A185-L189 WeakPolarHBondContact O-CG 3.46Å; A185-L189 PolarHBondContact O-N 2.96Å; N186-L189 PolarHBondContact O-N 2.85Å; N186-L189 VanDerWaalsContact O-N 3.14Å; L187-L189 VanDerWaalsContact C-N 3.3Å; L187-L189 PolarHBondContact O-N 3.4Å; L189-E193 WeakPolarHBondContact O-CB 3.23Å; L189-E193 PolarHBondContact O-N 2.94Å; L189-E193 VanDerWaalsContact O-N 3.08Å; L189-L399 HydrophobicContact CD2-CB 4.48Å; L189-L399 HydrophobicContact CD2-CD2 3.51Å; L189-I402 HydrophobicContact CD1-CG2 3.98Å; L189-I402 HydrophobicContact CD2-CG2 4.47Å; L189-R403 VanDerWaalsContact C-NH2 3.29Å; L189-R403 HydrophobicContact CD1-CB 4.07Å; L189-R403 PolarHBondContact O-NH2 3.08Å; L189-I406 HydrophobicContact CD1-CD1 3.28Å
190I87.4Confident87.2Confident68 Ų6836.7 Ų36.735%0.34919%0.185SC..Hα-helixtrans-62.9-54.5175.1-67.6167.1000110.2N186 L187 F192 E193 E194N186-I190 WeakPolarHBondContact O-CG1 3.41Å; N186-I190 PolarHBondContact O-N 3.16Å; L187-I190 PolarHBondContact O-N 3.04Å; I190-F192 VanDerWaalsContact C-N 3.29Å; I190-F192 PolarHBondContact O-N 3.22Å; I190-E193 PolarHBondContact O-N 2.81Å; I190-E194 PolarHBondContact O-N 2.92Å
191E91.8Very high86.8Confident47 Ų4741 Ų4122%0.2221%0.205CC..Hα-helixtrans-66.3-31.7-179.6-66.6170.916200112.2L187 E194 A195 A764 R767L187-E191 HydrophobicContact CD1-CG 4.07Å; L187-E191 HydrophobicContact CG-CG 4.41Å; L187-E191 WeakPolarHBondContact O-CG 3.35Å; L187-E191 PolarHBondContact O-N 3.43Å; E191-E194 PolarHBondContact O-N 2.76Å; E191-A195 VanDerWaalsContact O-CB 3.23Å; E191-A195 WeakPolarHBondContact O-CB 3.42Å; E191-A195 PolarHBondContact O-N 2.78Å; E191-A764 HydrophobicContact CB-CB 3.89Å; E191-R767 VanDerWaalsContact CD-CZ 3.42Å; E191-R767 VanDerWaalsContact CD-NH2 3.3Å; E191-R767 IonicContact OE1-CZ 3.67Å; E191-R767 VanDerWaalsContact OE1-CZ 3.24Å; E191-R767 IonicContact OE1-NE 3.12Å; E191-R767 IonicContact OE1-NH1 2.71Å; E191-R767 IonicContact OE1-NH2 2.97Å; E191-R767 PolarHBondContact OE1-NH2 3.2Å; E191-R767 IonicContact OE2-CZ 3.31Å; E191-R767 IonicContact OE2-NE 2.81Å; E191-R767 PolarHBondContact OE2-NE 3.34Å; E191-R767 IonicContact OE2-NH1 2.74Å; E191-R767 PolarHBondContact OE2-NH1 2.99Å; E191-R767 IonicContact OE2-NH2 3.41Å; E191-R767 PolarHBondContact OE2-NH2 3.31Å; E191-R767 VanDerWaalsContact OE2-NH2 3.07Å
192F90.2Very high86.3Confident30 Ų3044.2 Ų44.213%0.13222%0.219CC..Hα-helixtrans-67-44.6175.3-162-73.8000110.3S188 I190 E194 A195 L196 V395 L399 I572 L761 A764 A765S188-F192 WeakPolarHBondContact O-CB 3.21Å; S188-F192 PolarHBondContact O-N 3Å; I190-F192 VanDerWaalsContact C-N 3.29Å; I190-F192 PolarHBondContact O-N 3.22Å; F192-E194 VanDerWaalsContact C-N 3.34Å; F192-E194 PolarHBondContact O-N 3.13Å; F192-A195 PolarHBondContact O-N 3.07Å; F192-L196 HydrophobicContact CD1-CD1 3.91Å; F192-L196 HydrophobicContact CD1-CD2 4.45Å; F192-L196 HydrophobicContact CD1-CG 3.88Å; F192-L196 HydrophobicContact CE1-CD1 3.82Å; F192-L196 HydrophobicContact CE1-CD2 4.03Å; F192-L196 HydrophobicContact CE1-CG 3.89Å; F192-L196 VanDerWaalsContact O-CG 3.32Å; F192-L196 WeakPolarHBondContact O-CG 3.34Å; F192-L196 PolarHBondContact O-N 2.89Å; F192-V395 HydrophobicContact CE1-CG1 4.25Å; F192-L399 HydrophobicContact CB-CD1 4.48Å; F192-L399 HydrophobicContact CD1-CD1 3.23Å; F192-L399 HydrophobicContact CD1-CD2 4.5Å; F192-L399 HydrophobicContact CD1-CG 4.49Å; F192-L399 HydrophobicContact CE1-CD1 3.67Å; F192-L399 HydrophobicContact CG-CD1 4.13Å; F192-I572 HydrophobicContact CE2-CD1 4.5Å; F192-I572 HydrophobicContact CZ-CD1 4.27Å; F192-L761 HydrophobicContact CD1-CD1 3.76Å; F192-L761 HydrophobicContact CD2-CD1 3.78Å; F192-L761 HydrophobicContact CE1-CD1 3.55Å; F192-L761 HydrophobicContact CE2-CD1 3.54Å; F192-L761 HydrophobicContact CE2-CG 4.07Å; F192-L761 HydrophobicContact CG-CD1 3.91Å; F192-L761 HydrophobicContact CZ-CD1 3.44Å; F192-L761 VanDerWaalsContact CZ-CD1 3.44Å; F192-L761 HydrophobicContact CZ-CG 4.14Å; F192-A764 HydrophobicContact CB-CB 3.84Å; F192-A764 HydrophobicContact CD2-CB 4.11Å; F192-A764 HydrophobicContact CG-CB 4.39Å; F192-A765 HydrophobicContact CD2-CB 4.26Å; F192-A765 HydrophobicContact CE2-CB 4.01Å
193E87.3Confident86Confident36 Ų3643.1 Ų43.117%0.16822%0.215CC..Hα-helixtrans-60.5-44.2174.5-174.1-171.3168.100111.6L189 I190 L196 K197 K400 R403L189-E193 WeakPolarHBondContact O-CB 3.23Å; L189-E193 PolarHBondContact O-N 2.94Å; L189-E193 VanDerWaalsContact O-N 3.08Å; I190-E193 PolarHBondContact O-N 2.81Å; E193-L196 PolarHBondContact O-N 3.36Å; E193-K197 PolarHBondContact O-N 3.43Å; E193-K400 WeakPolarHBondContact OE1-CE 3.42Å; E193-K400 IonicContact OE1-NZ 3.6Å; E193-K400 PolarHBondContact OE1-NZ 3.41Å; E193-R403 IonicContact OE2-CZ 3.53Å; E193-R403 IonicContact OE2-NH1 2.75Å; E193-R403 PolarHBondContact OE2-NH1 3.21Å; E193-R403 IonicContact OE2-NH2 3.89Å; E193-R403 PolarHBondContact OE2-NH2 3.46Å
194E90.2Very high85.4Confident112 Ų11245.9 Ų45.952%0.52323%0.225SC..Hα-helixtrans-63.2-45.4177.9-170.7167.5-15900111.5I190 E191 F192 L196 K197 D198I190-E194 PolarHBondContact O-N 2.92Å; E191-E194 PolarHBondContact O-N 2.76Å; F192-E194 VanDerWaalsContact C-N 3.34Å; F192-E194 PolarHBondContact O-N 3.13Å; E194-L196 VanDerWaalsContact C-N 3.32Å; E194-L196 PolarHBondContact O-N 2.81Å; E194-K197 WeakPolarHBondContact O-CB 3.5Å; E194-K197 PolarHBondContact O-N 2.89Å; E194-K197 VanDerWaalsContact O-N 3.11Å; E194-D198 PolarHBondContact O-N 3.32Å
195A90.3Very high84.6Confident5 Ų549.2 Ų49.24%0.04124%0.244CC..Hα-helixtrans-59.1-42174.900000112E191 F192 D198 M199 L761E191-A195 VanDerWaalsContact O-CB 3.23Å; E191-A195 WeakPolarHBondContact O-CB 3.42Å; E191-A195 PolarHBondContact O-N 2.78Å; F192-A195 PolarHBondContact O-N 3.07Å; A195-D198 PolarHBondContact O-N 3.5Å; A195-M199 WeakPolarHBondContact O-CB 3.43Å; A195-M199 WeakPolarHBondContact O-CG 3.16Å; A195-M199 PolarHBondContact O-N 3.12Å; A195-L761 HydrophobicContact CB-CB 4.34Å; A195-L761 HydrophobicContact CB-CD1 4.19Å
196L87Confident83.6Confident5 Ų549.3 Ų49.33%0.02624%0.243CC..Hα-helixtrans-62.4-42.8174.7-71-173.2000112F192 E193 E194 M199 V200 M392 V395 L399 L761F192-L196 HydrophobicContact CD1-CD1 3.91Å; F192-L196 HydrophobicContact CD1-CD2 4.45Å; F192-L196 HydrophobicContact CD1-CG 3.88Å; F192-L196 HydrophobicContact CE1-CD1 3.82Å; F192-L196 HydrophobicContact CE1-CD2 4.03Å; F192-L196 HydrophobicContact CE1-CG 3.89Å; F192-L196 VanDerWaalsContact O-CG 3.32Å; F192-L196 WeakPolarHBondContact O-CG 3.34Å; F192-L196 PolarHBondContact O-N 2.89Å; E193-L196 PolarHBondContact O-N 3.36Å; E194-L196 VanDerWaalsContact C-N 3.32Å; E194-L196 PolarHBondContact O-N 2.81Å; L196-M199 PolarHBondContact O-N 3.02Å; L196-V200 WeakPolarHBondContact O-CG2 3.49Å; L196-V200 PolarHBondContact O-N 3.32Å; L196-M392 HydrophobicContact CD1-SD 4.36Å; L196-M392 HydrophobicContact CD2-CE 4.12Å; L196-M392 HydrophobicContact CD2-SD 3.53Å; L196-M392 VanDerWaalsContact CD2-SD 3.53Å; L196-M392 HydrophobicContact CG-SD 4.41Å; L196-V395 HydrophobicContact CD1-CB 4.05Å; L196-V395 HydrophobicContact CD1-CG1 3.66Å; L196-L399 HydrophobicContact CD1-CD1 3.99Å; L196-L761 HydrophobicContact CD2-CD1 3.73Å; L196-L761 HydrophobicContact CD2-CD2 4.48Å; L196-L761 HydrophobicContact CG-CD1 4.23Å
197K85.8Confident82.1Confident151 Ų15151.7 Ų51.766%0.65726%0.262SS*.Hα-helixtrans-64.2-43.6178.6-174.5-176.9176-171.80111.5E193 E194 M199 V200 Q201E193-K197 PolarHBondContact O-N 3.43Å; E194-K197 WeakPolarHBondContact O-CB 3.5Å; E194-K197 PolarHBondContact O-N 2.89Å; E194-K197 VanDerWaalsContact O-N 3.11Å; K197-M199 VanDerWaalsContact C-N 3.34Å; K197-V200 PolarHBondContact O-N 3.39Å; K197-Q201 WeakPolarHBondContact O-CB 3.43Å; K197-Q201 PolarHBondContact O-N 2.91Å
198D86.8Confident80.6Confident89 Ų8954.9 Ų54.948%0.47629%0.288SS..Hα-helixtrans-63.6-40.9177-75.1-10.2000111.6E194 A195 Q201 M202E194-D198 PolarHBondContact O-N 3.32Å; A195-D198 PolarHBondContact O-N 3.5Å; D198-Q201 PolarHBondContact O-N 3Å; D198-M202 WeakPolarHBondContact O-CB 3.15Å; D198-M202 PolarHBondContact O-N 3.34Å
199M84.3Confident79.2Confident8 Ų856.3 Ų56.34%0.03930%0.297CS..Hα-helixtrans-63.1-41.7174.3-72.9171.672.800112.2A195 L196 K197 M202 A203 F388 F581 I756 C758 L761A195-M199 WeakPolarHBondContact O-CB 3.43Å; A195-M199 WeakPolarHBondContact O-CG 3.16Å; A195-M199 PolarHBondContact O-N 3.12Å; L196-M199 PolarHBondContact O-N 3.02Å; K197-M199 VanDerWaalsContact C-N 3.34Å; M199-M202 PolarHBondContact O-N 3.26Å; M199-A203 WeakPolarHBondContact O-CB 3.43Å; M199-A203 PolarHBondContact O-N 2.96Å; M199-F388 HydrophobicContact CB-CE1 4.38Å; M199-F388 HydrophobicContact CE-CZ 4.44Å; M199-F581 HydrophobicContact CE-CB 3.78Å; M199-F581 HydrophobicContact CE-CD1 3.85Å; M199-F581 HydrophobicContact CE-CD2 3.12Å; M199-F581 HydrophobicContact CE-CE1 4.18Å; M199-F581 HydrophobicContact CE-CE2 3.44Å; M199-F581 VanDerWaalsContact CE-CE2 3.44Å; M199-F581 HydrophobicContact CE-CG 3.28Å; M199-F581 HydrophobicContact CE-CZ 3.95Å; M199-I756 HydrophobicContact CB-CG2 4.2Å; M199-I756 HydrophobicContact CE-CG2 4.11Å; M199-I756 HydrophobicContact CG-CG2 4.05Å; M199-C758 HydrophobicContact CE-CB 4.41Å; M199-L761 HydrophobicContact CE-CD2 4.45Å; M199-L761 HydrophobicContact SD-CB 4.26Å; M199-L761 HydrophobicContact SD-CD2 4.05Å
200V80.8Confident78.2Confident12 Ų1261.2 Ų61.27%0.07332%0.323CS..Hα-helixtrans-64.4-43174.3171.20000110.7L196 K197 M202 A203 K204 F388 E389 M392L196-V200 WeakPolarHBondContact O-CG2 3.49Å; L196-V200 PolarHBondContact O-N 3.32Å; K197-V200 PolarHBondContact O-N 3.39Å; V200-M202 VanDerWaalsContact C-N 3.31Å; V200-M202 PolarHBondContact O-N 3.45Å; V200-A203 PolarHBondContact O-N 2.91Å; V200-K204 HydrophobicContact CG1-CD 4.44Å; V200-K204 WeakPolarHBondContact O-CG 3.42Å; V200-K204 PolarHBondContact O-N 2.81Å; V200-F388 HydrophobicContact CB-CD1 4.48Å; V200-F388 HydrophobicContact CG2-CD1 3.84Å; V200-F388 HydrophobicContact CG2-CE1 3.88Å; V200-E389 HydrophobicContact CG1-CB 3.92Å; V200-E389 HydrophobicContact CG1-CG 4.09Å; V200-M392 HydrophobicContact CG2-CB 3.63Å; V200-M392 HydrophobicContact CG2-CG 3.71Å
201Q80.5Confident77.6Confident91 Ų9158.6 Ų58.643%0.42531%0.31SS..Hα-helixtrans-65-37.7177.8-17258.55000111.5K197 D198 K204 N205K197-Q201 WeakPolarHBondContact O-CB 3.43Å; K197-Q201 PolarHBondContact O-N 2.91Å; D198-Q201 PolarHBondContact O-N 3Å; Q201-K204 WeakPolarHBondContact O-CB 3.37Å; Q201-K204 PolarHBondContact O-N 3.18Å; Q201-N205 PolarHBondContact NE2-ND2 2.98Å; Q201-N205 PolarHBondContact NE2-OD1 2.84Å; Q201-N205 VanDerWaalsContact O-CB 3.31Å; Q201-N205 WeakPolarHBondContact O-CB 3.43Å; Q201-N205 PolarHBondContact O-N 3.39Å; Q201-N205 PolarHBondContact O-ND2 2.9Å
202M78.6Confident77Confident72 Ų7259 Ų5936%0.35532%0.318SS..Hα-helixtrans-68.4-44.3174.2-166.5170.7-6500111D198 M199 V200 K204 N205 T206 I756 P757D198-M202 WeakPolarHBondContact O-CB 3.15Å; D198-M202 PolarHBondContact O-N 3.34Å; M199-M202 PolarHBondContact O-N 3.26Å; V200-M202 VanDerWaalsContact C-N 3.31Å; V200-M202 PolarHBondContact O-N 3.45Å; M202-K204 PolarHBondContact O-N 3.44Å; M202-N205 CarbonylContact O-C 3.58Å; M202-N205 PolarHBondContact O-N 3.07Å; M202-T206 WeakPolarHBondContact CG-OG1 3.2Å; M202-T206 WeakPolarHBondContact O-CB 3.46Å; M202-T206 PolarHBondContact O-N 3.37Å; M202-T206 PolarHBondContact O-OG1 2.91Å; M202-I756 HydrophobicContact CG-CG1 4.49Å; M202-P757 HydrophobicContact CE-CG 4.03Å; M202-P757 WeakPolarHBondContact SD-CD 3.45Å; M202-P757 HydrophobicContact SD-CG 4.09Å
203A75.6Confident76.6Confident4 Ų464.7 Ų64.73%0.03334%0.343CS..Hα-helixtrans-55.7-36.8173.700000112.3M199 V200 F388 I756M199-A203 WeakPolarHBondContact O-CB 3.43Å; M199-A203 PolarHBondContact O-N 2.96Å; V200-A203 PolarHBondContact O-N 2.91Å; A203-F388 HydrophobicContact CB-CD1 3.89Å; A203-F388 HydrophobicContact CB-CE1 4.15Å; A203-I756 HydrophobicContact CB-CD1 3.85Å
204K72.4Confident76.4Confident75 Ų7565 Ų6533%0.32634%0.344SS..Hα-helixtrans-67.3-43.7171.4-70.4175-179.41790111.8V200 Q201 M202 R381 A385 E389V200-K204 HydrophobicContact CG1-CD 4.44Å; V200-K204 WeakPolarHBondContact O-CG 3.42Å; V200-K204 PolarHBondContact O-N 2.81Å; Q201-K204 WeakPolarHBondContact O-CB 3.37Å; Q201-K204 PolarHBondContact O-N 3.18Å; M202-K204 PolarHBondContact O-N 3.44Å; K204-R381 PolarHBondContact O-NH2 3.21Å; K204-A385 HydrophobicContact CG-CB 3.68Å; K204-E389 VanDerWaalsContact CE-OE2 3.23Å; K204-E389 WeakPolarHBondContact CE-OE2 3.15Å; K204-E389 IonicContact NZ-OE1 3.42Å; K204-E389 PolarHBondContact NZ-OE1 3.15Å; K204-E389 IonicContact NZ-OE2 2.67Å; K204-E389 PolarHBondContact NZ-OE2 3.3Å
205N71.2Confident76.2Confident98 Ų9862.6 Ų62.652%0.52433%0.332SS..Hα-helixtrans-86-21.6-171.6-70.5-7.1000116.1Q201 M202 S207Q201-N205 PolarHBondContact NE2-ND2 2.98Å; Q201-N205 PolarHBondContact NE2-OD1 2.84Å; Q201-N205 VanDerWaalsContact O-CB 3.31Å; Q201-N205 WeakPolarHBondContact O-CB 3.43Å; Q201-N205 PolarHBondContact O-N 3.39Å; Q201-N205 PolarHBondContact O-ND2 2.9Å; M202-N205 CarbonylContact O-C 3.58Å; M202-N205 PolarHBondContact O-N 3.07Å; N205-S207 PolarHBondContact O-N 3.22Å; N205-S207 PolarHBondContact O-OG 3.47Å
206T66.2Low76.1Confident22 Ų2267.5 Ų67.514%0.13535%0.354CS..  trans-66.177.5-175.1-60.20000110M202 R381 T752M202-T206 WeakPolarHBondContact CG-OG1 3.2Å; M202-T206 WeakPolarHBondContact O-CB 3.46Å; M202-T206 PolarHBondContact O-N 3.37Å; M202-T206 PolarHBondContact O-OG1 2.91Å; T206-R381 PolarHBondContact O-NH1 2.67Å; T206-R381 PolarHBondContact O-NH2 3.15Å; T206-T752 WeakPolarHBondContact CG2-O 3.43Å
207S53.2Low76.1Confident80 Ų8073.7 Ų73.756%0.55938%0.377SS*.  trans-102.4128.9179.953.30000107N205N205-S207 PolarHBondContact O-N 3.22Å; N205-S207 PolarHBondContact O-OG 3.47Å
208S55.3Low76.2Confident118 Ų11866.6 Ų66.683%0.82535%0.346SS*.  trans83.354.9178.978.40000118.2
209T61.5Low76.3Confident40 Ų4064.4 Ų64.425%0.24533%0.334CS..  trans-74.8131149-12.20000108L211 T752T209-L211 PolarHBondContact O-N 3.28Å; T209-T752 WeakPolarHBondContact OG1-CA 3.42Å
210D66.1Low76.7Confident123 Ų12369.7 Ų69.766%0.65835%0.353SS*.  trans-67.4104.1175.2179.221.2000109.7S212D210-S212 VanDerWaalsContact C-N 3.29Å; D210-S212 WeakPolarHBondContact OD1-CB 3.47Å; D210-S212 PolarHBondContact OD1-N 3.36Å; D210-S212 PolarHBondContact OD1-OG 3.14Å; D210-S212 PolarHBondContact OD2-OG 3.33Å
211L73.8Confident77.2Confident12 Ų1270.6 Ų70.66%0.06336%0.357CS..  trans-92.118.3176.7-61.4176.5000112.2T209 K213 Q214 K215 W371 A375 A751 T752T209-L211 PolarHBondContact O-N 3.28Å; L211-K213 VanDerWaalsContact C-N 3.3Å; L211-K213 PolarHBondContact O-N 2.9Å; L211-Q214 HydrophobicContact CB-CB 4.5Å; L211-Q214 PolarHBondContact O-N 3.25Å; L211-Q214 VanDerWaalsContact O-N 3.1Å; L211-K215 PolarHBondContact O-N 2.86Å; L211-W371 HydrophobicContact CB-CZ2 3.95Å; L211-A375 HydrophobicContact CD1-CB 3.88Å; L211-A751 HydrophobicContact CD2-CB 3.75Å; L211-T752 HydrophobicContact CD1-CG2 3.88Å; L211-T752 HydrophobicContact CD2-CG2 4.38Å
212S79.9Confident77.7Confident57 Ų5766.5 Ų66.540%0.39934%0.338SS..Hα-helixtrans-51.7-46.4-179.357.10000112.7D210 Q214 K215 E216D210-S212 VanDerWaalsContact C-N 3.29Å; D210-S212 WeakPolarHBondContact OD1-CB 3.47Å; D210-S212 PolarHBondContact OD1-N 3.36Å; D210-S212 PolarHBondContact OD1-OG 3.14Å; D210-S212 PolarHBondContact OD2-OG 3.33Å; S212-Q214 PolarHBondContact O-N 2.87Å; S212-K215 PolarHBondContact O-N 3.4Å; S212-E216 PolarHBondContact O-N 3.04Å
213K81.2Confident78.3Confident148 Ų14865.8 Ų65.864%0.64334%0.336SS*.Hα-helixtrans-62.8-40.9178.2-69.5179.9-178.8172.70112.3L211 R217L211-K213 VanDerWaalsContact C-N 3.3Å; L211-K213 PolarHBondContact O-N 2.9Å; K213-R217 WeakPolarHBondContact O-CG 3.42Å; K213-R217 PolarHBondContact O-N 3.12Å; K213-R217 VanDerWaalsContact O-N 3.16Å
214Q83.4Confident79.1Confident42 Ų4270.6 Ų70.620%0.19636%0.361CS..Hα-helixtrans-72-36.6179-6774.36.100110.3L211 S212 E216 R217 F218 W371 A748L211-Q214 HydrophobicContact CB-CB 4.5Å; L211-Q214 PolarHBondContact O-N 3.25Å; L211-Q214 VanDerWaalsContact O-N 3.1Å; S212-Q214 PolarHBondContact O-N 2.87Å; Q214-E216 VanDerWaalsContact C-N 3.34Å; Q214-E216 PolarHBondContact O-N 3.18Å; Q214-R217 PolarHBondContact O-N 3.08Å; Q214-F218 WeakPolarHBondContact O-CB 3.49Å; Q214-F218 PolarHBondContact O-N 3.25Å; Q214-W371 HydrophobicContact CB-CH2 3.7Å; Q214-W371 HydrophobicContact CB-CZ2 4.11Å; Q214-W371 WeakPolarHBondContact O-CH2 3.33Å; Q214-A748 HydrophobicContact CB-CB 4.33Å
215K85.8Confident80.1Confident62 Ų6267.7 Ų67.727%0.2735%0.353SS..Hα-helixtrans-61.1-45.6174.3-170.2175.1-177172.40110.7L211 S212 R217 F218 M219 D368 W371L211-K215 PolarHBondContact O-N 2.86Å; S212-K215 PolarHBondContact O-N 3.4Å; K215-R217 VanDerWaalsContact C-N 3.33Å; K215-R217 PolarHBondContact O-N 3.1Å; K215-F218 PolarHBondContact O-N 2.89Å; K215-M219 HydrophobicContact CG-CG 4.43Å; K215-M219 WeakPolarHBondContact O-CB 3.46Å; K215-M219 WeakPolarHBondContact O-CG 3.29Å; K215-M219 PolarHBondContact O-N 3.42Å; K215-D368 IonicContact NZ-OD1 3.76Å; K215-D368 PolarHBondContact NZ-OD1 3.12Å; K215-W371 HydrophobicContact CB-CD2 4.08Å; K215-W371 HydrophobicContact CB-CH2 4.25Å; K215-W371 HydrophobicContact CB-CZ2 3.48Å; K215-W371 VanDerWaalsContact CB-CZ2 3.48Å; K215-W371 HydrophobicContact CD-CD2 4.5Å; K215-W371 HydrophobicContact CD-CG 4.13Å; K215-W371 HydrophobicContact CG-CD2 3.86Å; K215-W371 HydrophobicContact CG-CG 3.96Å; K215-W371 HydrophobicContact CG-CZ2 4.21Å; K215-W371 VanDerWaalsContact N-CH2 3.27Å
216E87.8Confident81.1Confident109 Ų10963.2 Ų63.251%0.50933%0.329SS..Hα-helixtrans-60.6-43.5178.3-167-165.4148.400111.4S212 Q214 R220S212-E216 PolarHBondContact O-N 3.04Å; Q214-E216 VanDerWaalsContact C-N 3.34Å; Q214-E216 PolarHBondContact O-N 3.18Å; E216-R220 WeakPolarHBondContact O-CB 3.46Å; E216-R220 PolarHBondContact O-N 3.35Å; E216-R220 IonicContact OE1-CZ 3.58Å; E216-R220 IonicContact OE1-NH1 2.76Å; E216-R220 IonicContact OE1-NH2 3.1Å; E216-R220 PolarHBondContact OE1-NH2 2.89Å
217R87.6Confident82.3Confident135 Ų13565.7 Ų65.751%0.50934%0.344SS..Hα-helixtrans-64.4-44.3175.7-71.8177.8-178.3-165.30.7112.3K213 Q214 K215 R220 I221K213-R217 WeakPolarHBondContact O-CG 3.42Å; K213-R217 PolarHBondContact O-N 3.12Å; K213-R217 VanDerWaalsContact O-N 3.16Å; Q214-R217 PolarHBondContact O-N 3.08Å; K215-R217 VanDerWaalsContact C-N 3.33Å; K215-R217 PolarHBondContact O-N 3.1Å; R217-R220 PolarHBondContact O-N 3.17Å; R217-I221 WeakPolarHBondContact O-CG1 3.33Å; R217-I221 PolarHBondContact O-N 3.21Å
218F88Confident84.2Confident1 Ų163.6 Ų63.60%0.00433%0.329CS..Hα-helixtrans-58.9-49.1176.4175.2-94000111.7Q214 K215 R220 I221 I222 L367 W371 L606 L741 L745Q214-F218 WeakPolarHBondContact O-CB 3.49Å; Q214-F218 PolarHBondContact O-N 3.25Å; K215-F218 PolarHBondContact O-N 2.89Å; F218-R220 VanDerWaalsContact C-N 3.34Å; F218-R220 PolarHBondContact O-N 3.14Å; F218-I221 PolarHBondContact O-N 3.36Å; F218-I222 HydrophobicContact CE1-CG1 4.42Å; F218-I222 WeakPolarHBondContact O-CG1 3.5Å; F218-I222 PolarHBondContact O-N 3.48Å; F218-L367 HydrophobicContact CE1-CD2 4.02Å; F218-L367 HydrophobicContact CZ-CD2 4.12Å; F218-W371 HydrophobicContact CB-CE3 3.76Å; F218-W371 HydrophobicContact CB-CH2 4.21Å; F218-W371 HydrophobicContact CB-CZ3 3.39Å; F218-W371 HydrophobicContact CD1-CD2 4.48Å; F218-W371 AromaticContact CD1-CE3 3.61Å; F218-W371 HydrophobicContact CD1-CE3 3.61Å; F218-W371 HydrophobicContact CD1-CZ3 4.15Å; F218-W371 HydrophobicContact CD2-CE3 4.04Å; F218-W371 AromaticContact CD2-CZ3 3.98Å; F218-W371 HydrophobicContact CD2-CZ3 3.98Å; F218-W371 HydrophobicContact CE1-CE3 4.2Å; F218-W371 AromaticContact CG-CE3 3.53Å; F218-W371 HydrophobicContact CG-CE3 3.53Å; F218-W371 AromaticContact CG-CZ3 3.58Å; F218-W371 HydrophobicContact CG-CZ3 3.58Å; F218-L606 HydrophobicContact CE2-CD1 4.41Å; F218-L606 HydrophobicContact CZ-CD1 3.91Å; F218-L741 HydrophobicContact CD2-CD2 3.9Å; F218-L741 HydrophobicContact CE2-CD2 3.65Å; F218-L741 HydrophobicContact CZ-CD2 4.37Å; F218-L745 HydrophobicContact CD2-CD2 4.25Å; F218-L745 HydrophobicContact CE2-CD2 4.05Å; F218-L745 HydrophobicContact CE2-CG 4.37Å
219M89.7Confident86Confident43 Ų4358 Ų5821%0.21229%0.29CS..Hα-helixtrans-64.1-38.2177.9-70.7-59.2-150.500112.2K215 I222 D223 L367 D368K215-M219 HydrophobicContact CG-CG 4.43Å; K215-M219 WeakPolarHBondContact O-CB 3.46Å; K215-M219 WeakPolarHBondContact O-CG 3.29Å; K215-M219 PolarHBondContact O-N 3.42Å; M219-I222 PolarHBondContact O-N 3.19Å; M219-D223 PolarHBondContact O-N 2.87Å; M219-L367 HydrophobicContact CE-CB 4.45Å; M219-D368 WeakPolarHBondContact CE-OD1 3.36Å
220R91.5Very high87.5Confident119 Ų11958 Ų5845%0.44929%0.287SS..Hα-helixtrans-62.2-43.1175.4-173.5-176.9-71.1116.70.6112.1E216 R217 F218 I222 D223 D224E216-R220 WeakPolarHBondContact O-CB 3.46Å; E216-R220 PolarHBondContact O-N 3.35Å; E216-R220 IonicContact OE1-CZ 3.58Å; E216-R220 IonicContact OE1-NH1 2.76Å; E216-R220 IonicContact OE1-NH2 3.1Å; E216-R220 PolarHBondContact OE1-NH2 2.89Å; R217-R220 PolarHBondContact O-N 3.17Å; F218-R220 VanDerWaalsContact C-N 3.34Å; F218-R220 PolarHBondContact O-N 3.14Å; R220-I222 VanDerWaalsContact C-N 3.27Å; R220-I222 PolarHBondContact O-N 3.39Å; R220-D223 PolarHBondContact O-N 2.86Å; R220-D224 WeakPolarHBondContact O-CB 3.49Å; R220-D224 VanDerWaalsContact O-CG 3.32Å; R220-D224 PolarHBondContact O-N 3.42Å
221I91.3Very high88.7Confident31 Ų3156.9 Ų56.916%0.15928%0.278CS..Hα-helixtrans-61.3-39177.1-72.3176.2000111.5R217 F218 G225 L737 L740 L741 E744R217-I221 WeakPolarHBondContact O-CG1 3.33Å; R217-I221 PolarHBondContact O-N 3.21Å; F218-I221 PolarHBondContact O-N 3.36Å; I221-G225 PolarHBondContact O-N 3.31Å; I221-L737 HydrophobicContact CG2-CD2 4.08Å; I221-L740 HydrophobicContact CD1-CB 4.38Å; I221-L740 HydrophobicContact CG2-CB 3.74Å; I221-L740 HydrophobicContact CG2-CD1 4.27Å; I221-L741 HydrophobicContact CG2-CD2 3.85Å; I221-L741 HydrophobicContact CG2-CG 4.49Å; I221-E744 HydrophobicContact CD1-CB 4.33Å; I221-E744 HydrophobicContact CD1-CG 3.21Å
222I91Very high89.5Confident6 Ų657 Ų573%0.03128%0.278CS..Hα-helixtrans-65.1-48.9175.1-66-69.2000110.3F218 M219 R220 D224 G225 L226 L367 L737 L741F218-I222 HydrophobicContact CE1-CG1 4.42Å; F218-I222 WeakPolarHBondContact O-CG1 3.5Å; F218-I222 PolarHBondContact O-N 3.48Å; M219-I222 PolarHBondContact O-N 3.19Å; R220-I222 VanDerWaalsContact C-N 3.27Å; R220-I222 PolarHBondContact O-N 3.39Å; I222-D224 PolarHBondContact O-N 3.38Å; I222-G225 CarbonylContact O-C 3.19Å; I222-G225 PolarHBondContact O-N 3.47Å; I222-G225 VanDerWaalsContact O-N 3.15Å; I222-L226 HydrophobicContact CG2-CD1 3.93Å; I222-L226 HydrophobicContact CG2-CG 4.15Å; I222-L226 WeakPolarHBondContact O-CB 3.15Å; I222-L226 VanDerWaalsContact O-CG 3.27Å; I222-L226 WeakPolarHBondContact O-CG 3.45Å; I222-L226 PolarHBondContact O-N 2.83Å; I222-L367 HydrophobicContact CD1-CD2 3.76Å; I222-L367 HydrophobicContact CG1-CD2 3.82Å; I222-L367 HydrophobicContact CG2-CD1 3.75Å; I222-L367 HydrophobicContact CG2-CD2 4.34Å; I222-L737 HydrophobicContact CD1-CD2 4.47Å; I222-L741 HydrophobicContact CD1-CD1 3.86Å; I222-L741 HydrophobicContact CD1-CD2 3.64Å; I222-L741 HydrophobicContact CD1-CG 4.33Å; I222-L741 HydrophobicContact CG1-CD2 4.05Å
223D92Very high90.2Very high56 Ų5654.2 Ų54.230%0.29926%0.259SS..Hα-helixtrans-58.6-49.3-179.3-74.7-12.6000111.9M219 R220 G225 L226 V227 K360M219-D223 PolarHBondContact O-N 2.87Å; R220-D223 PolarHBondContact O-N 2.86Å; D223-G225 VanDerWaalsContact C-N 3.3Å; D223-G225 PolarHBondContact O-N 3.43Å; D223-L226 PolarHBondContact O-N 2.79Å; D223-V227 WeakPolarHBondContact O-CG2 3.43Å; D223-V227 PolarHBondContact O-N 3.15Å; D223-V227 VanDerWaalsContact O-N 3.08Å; D223-K360 WeakPolarHBondContact OD1-CD 3.29Å; D223-K360 WeakPolarHBondContact OD1-CE 3.29Å; D223-K360 IonicContact OD1-NZ 2.78Å; D223-K360 PolarHBondContact OD1-NZ 3.27Å; D223-K360 IonicContact OD2-NZ 3.21Å; D223-K360 PolarHBondContact OD2-NZ 3.42Å
224D92.5Very high90.7Very high105 Ų10548.1 Ų48.156%0.56123%0.234SC*.Hα-helixtrans-62.5-39.3176.6-66.5-18000111.4R220 I222 V227 S228R220-D224 WeakPolarHBondContact O-CB 3.49Å; R220-D224 VanDerWaalsContact O-CG 3.32Å; R220-D224 PolarHBondContact O-N 3.42Å; I222-D224 PolarHBondContact O-N 3.38Å; D224-V227 PolarHBondContact O-N 2.91Å; D224-S228 PolarHBondContact O-N 2.92Å
225G92.3Very high91.1Very high15 Ų1552.5 Ų52.516%0.15525%0.253CS..Hα-helixtrans-67.4-34.4177.500000113.7I221 I222 D223 S228 F229I221-G225 PolarHBondContact O-N 3.31Å; I222-G225 CarbonylContact O-C 3.19Å; I222-G225 PolarHBondContact O-N 3.47Å; I222-G225 VanDerWaalsContact O-N 3.15Å; D223-G225 VanDerWaalsContact C-N 3.3Å; D223-G225 PolarHBondContact O-N 3.43Å; G225-S228 PolarHBondContact O-N 3.31Å; G225-F229 WeakPolarHBondContact O-CB 3.36Å; G225-F229 PolarHBondContact O-N 3.12Å
226L92.5Very high91.3Very high4 Ų452.2 Ų52.22%0.02125%0.254CS..Hα-helixtrans-73.1-37176.6-69.8-176.1000112.2I222 D223 F229 E230 A356 V359 K360 F610I222-L226 HydrophobicContact CG2-CD1 3.93Å; I222-L226 HydrophobicContact CG2-CG 4.15Å; I222-L226 WeakPolarHBondContact O-CB 3.15Å; I222-L226 VanDerWaalsContact O-CG 3.27Å; I222-L226 WeakPolarHBondContact O-CG 3.45Å; I222-L226 PolarHBondContact O-N 2.83Å; D223-L226 PolarHBondContact O-N 2.79Å; L226-F229 WeakPolarHBondContact O-CB 3.36Å; L226-F229 PolarHBondContact O-N 3.44Å; L226-E230 PolarHBondContact O-N 3.08Å; L226-A356 HydrophobicContact CB-CB 4.23Å; L226-V359 HydrophobicContact CD1-CG1 4.29Å; L226-V359 HydrophobicContact CD2-CB 4.24Å; L226-V359 HydrophobicContact CD2-CG1 3.36Å; L226-V359 HydrophobicContact CG-CG1 4.45Å; L226-K360 HydrophobicContact CD1-CB 3.54Å; L226-K360 HydrophobicContact CD1-CG 4.14Å; L226-F610 HydrophobicContact CD2-CE2 4Å
227V92.8Very high91.5Very high74 Ų7447.2 Ų47.245%0.44823%0.231SC..Hα-helixtrans-62.5-47.2169.8174.60000110.1D223 D224 F229 E230 E231D223-V227 WeakPolarHBondContact O-CG2 3.43Å; D223-V227 PolarHBondContact O-N 3.15Å; D223-V227 VanDerWaalsContact O-N 3.08Å; D224-V227 PolarHBondContact O-N 2.91Å; V227-F229 PolarHBondContact O-N 2.97Å; V227-E230 PolarHBondContact O-N 2.74Å; V227-E231 PolarHBondContact O-N 3.41Å
228S92Very high91.7Very high35 Ų3545.4 Ų45.425%0.24523%0.228CC..Hα-helixtrans-61.1-34.2175.3178.60000112.6D224 G225 D232 K736D224-S228 PolarHBondContact O-N 2.92Å; G225-S228 PolarHBondContact O-N 3.31Å; S228-D232 WeakPolarHBondContact O-CB 3.38Å; S228-D232 PolarHBondContact O-N 3.37Å; S228-K736 PolarHBondContact OG-NZ 3.06Å
229F92.5Very high91.9Very high2 Ų245.4 Ų45.41%0.00923%0.228CC..Hα-helixtrans-67.4-43.1176.2168.2-97.9000111.7G225 L226 V227 D232 F233 L355 V359 F610 L615 S729G225-F229 WeakPolarHBondContact O-CB 3.36Å; G225-F229 PolarHBondContact O-N 3.12Å; L226-F229 WeakPolarHBondContact O-CB 3.36Å; L226-F229 PolarHBondContact O-N 3.44Å; V227-F229 PolarHBondContact O-N 2.97Å; F229-D232 PolarHBondContact O-N 2.95Å; F229-F233 VanDerWaalsContact O-CB 3.26Å; F229-F233 WeakPolarHBondContact O-CB 3.32Å; F229-F233 PolarHBondContact O-N 3.2Å; F229-L355 HydrophobicContact CD1-CD2 4.38Å; F229-L355 HydrophobicContact CD1-CG 4.46Å; F229-L355 HydrophobicContact CE1-CD1 4.2Å; F229-L355 HydrophobicContact CE1-CD2 3.83Å; F229-L355 HydrophobicContact CE1-CG 3.96Å; F229-V359 HydrophobicContact CE1-CG2 4.08Å; F229-F610 AromaticContact CD2-CZ 3.95Å; F229-F610 HydrophobicContact CD2-CZ 3.95Å; F229-F610 HydrophobicContact CE2-CE1 4.48Å; F229-F610 AromaticContact CE2-CZ 3.99Å; F229-F610 HydrophobicContact CE2-CZ 3.99Å; F229-F610 HydrophobicContact CG-CZ 4.26Å; F229-F610 HydrophobicContact CZ-CZ 4.36Å; F229-L615 HydrophobicContact CE1-CD1 3.96Å; F229-L615 HydrophobicContact CZ-CD1 3.56Å; F229-S729 WeakPolarHBondContact CE2-O 3.25Å
230E93.2Very high92Very high38 Ų3847.3 Ų47.318%0.17824%0.239CC..Hα-helixtrans-61-43.6175.7179.6177.1110.600111.7L226 V227 F233 T234 L355 A356L226-E230 PolarHBondContact O-N 3.08Å; V227-E230 PolarHBondContact O-N 2.74Å; E230-F233 PolarHBondContact O-N 3.14Å; E230-T234 WeakPolarHBondContact O-CB 3.42Å; E230-T234 PolarHBondContact O-N 3.44Å; E230-T234 PolarHBondContact O-OG1 3.2Å; E230-L355 HydrophobicContact CG-CB 4.15Å; E230-L355 PolarHBondContact OE2-N 2.87Å; E230-A356 HydrophobicContact CB-CB 4.18Å; E230-A356 WeakPolarHBondContact OE2-CB 3.29Å; E230-A356 PolarHBondContact OE2-N 2.74Å
231E92.1Very high92.2Very high100 Ų10045.2 Ų45.247%0.46724%0.237SC..Hα-helixtrans-62.7-46175.3-71.7-174.1-166.700112.5V227 F233 T234 K235V227-E231 PolarHBondContact O-N 3.41Å; E231-F233 VanDerWaalsContact C-N 3.33Å; E231-T234 PolarHBondContact O-N 3.09Å; E231-K235 WeakPolarHBondContact O-CB 3.33Å; E231-K235 WeakPolarHBondContact O-CG 3.11Å; E231-K235 PolarHBondContact O-N 3.44Å; E231-K235 IonicContact OE2-NZ 2.66Å
232D91.4Very high92.4Very high14 Ų1443.9 Ų43.98%0.07523%0.23CC..Hα-helixtrans-63.4-42.1178-84.7-21.9000110.9S228 F229 K235 L236 R732 K736S228-D232 WeakPolarHBondContact O-CB 3.38Å; S228-D232 PolarHBondContact O-N 3.37Å; F229-D232 PolarHBondContact O-N 2.95Å; D232-K235 PolarHBondContact O-N 3.18Å; D232-L236 VanDerWaalsContact O-CB 3.29Å; D232-L236 WeakPolarHBondContact O-CB 3.44Å; D232-L236 VanDerWaalsContact O-CG 3.29Å; D232-L236 WeakPolarHBondContact O-CG 3.26Å; D232-L236 PolarHBondContact O-N 3.28Å; D232-R732 IonicContact OD1-NH1 3.82Å; D232-R732 WeakPolarHBondContact OD2-CD 3.38Å; D232-K736 IonicContact OD1-NZ 3.75Å; D232-K736 IonicContact OD2-NZ 3.71Å; D232-K736 PolarHBondContact OD2-NZ 3.44Å
233F93.1Very high92.6Very high0 Ų044.6 Ų44.60%024%0.236CC..Hα-helixtrans-62-46.7176.8-179.5-94.8000110.9F229 E230 E231 K235 L236 S237 L355 F619 Y718 L722 V726 S729F229-F233 VanDerWaalsContact O-CB 3.26Å; F229-F233 WeakPolarHBondContact O-CB 3.32Å; F229-F233 PolarHBondContact O-N 3.2Å; E230-F233 PolarHBondContact O-N 3.14Å; E231-F233 VanDerWaalsContact C-N 3.33Å; F233-K235 VanDerWaalsContact C-N 3.3Å; F233-K235 PolarHBondContact O-N 3.13Å; F233-L236 PolarHBondContact O-N 3.37Å; F233-S237 WeakPolarHBondContact O-CB 3.27Å; F233-S237 PolarHBondContact O-N 3.45Å; F233-S237 PolarHBondContact O-OG 3.31Å; F233-L355 HydrophobicContact CB-CD2 3.81Å; F233-L355 HydrophobicContact CD1-CD2 3.41Å; F233-L355 VanDerWaalsContact CD1-CD2 3.41Å; F233-L355 HydrophobicContact CD2-CD2 4.42Å; F233-L355 HydrophobicContact CE1-CD2 4.08Å; F233-L355 HydrophobicContact CG-CD2 3.61Å; F233-F619 HydrophobicContact CD1-CZ 4.39Å; F233-F619 AromaticContact CE1-CE1 3.99Å; F233-F619 HydrophobicContact CE1-CE1 3.99Å; F233-F619 AromaticContact CE1-CE2 3.87Å; F233-F619 HydrophobicContact CE1-CE2 3.87Å; F233-F619 AromaticContact CE1-CZ 3.48Å; F233-F619 HydrophobicContact CE1-CZ 3.48Å; F233-F619 VanDerWaalsContact CE1-CZ 3.48Å; F233-F619 HydrophobicContact CZ-CD2 4.49Å; F233-F619 HydrophobicContact CZ-CE2 4.06Å; F233-F619 HydrophobicContact CZ-CZ 4.07Å; F233-Y718 WeakPolarHBondContact CE1-OH 3.48Å; F233-L722 HydrophobicContact CZ-CD1 4.1Å; F233-V726 HydrophobicContact CE2-CB 4.43Å; F233-V726 HydrophobicContact CE2-CG2 3.67Å; F233-V726 HydrophobicContact CZ-CG2 4.21Å; F233-S729 WeakPolarHBondContact CA-OG 3.28Å
234T93.2Very high92.7Very high20 Ų2046.7 Ų46.712%0.12325%0.247CC..Hα-helixtrans-59.8-42.1178.8-59.30000111.5E230 E231 S237 Q238 A239 N240 I352E230-T234 WeakPolarHBondContact O-CB 3.42Å; E230-T234 PolarHBondContact O-N 3.44Å; E230-T234 PolarHBondContact O-OG1 3.2Å; E231-T234 PolarHBondContact O-N 3.09Å; T234-S237 PolarHBondContact O-OG 2.86Å; T234-Q238 PolarHBondContact O-N 3.3Å; T234-A239 HydrophobicContact CG2-CB 4.09Å; T234-A239 PolarHBondContact O-N 3.27Å; T234-N240 WeakPolarHBondContact CG2-OD1 3.21Å; T234-I352 HydrophobicContact CG2-CG2 4.45Å; T234-I352 WeakPolarHBondContact OG1-CG2 3.24Å
235K91.8Very high92.9Very high134 Ų13442.2 Ų42.258%0.58322%0.224SC*.Hα-helixtrans-68.7-49.2177.2-72.5168.3-175.5160.40112.5E231 D232 F233 Q238E231-K235 WeakPolarHBondContact O-CB 3.33Å; E231-K235 WeakPolarHBondContact O-CG 3.11Å; E231-K235 PolarHBondContact O-N 3.44Å; E231-K235 IonicContact OE2-NZ 2.66Å; D232-K235 PolarHBondContact O-N 3.18Å; F233-K235 VanDerWaalsContact C-N 3.3Å; F233-K235 PolarHBondContact O-N 3.13Å; K235-Q238 PolarHBondContact O-N 3.11Å
236L90.1Very high93.1Very high56 Ų5641.5 Ų41.529%0.29322%0.217SC..Hα-helixtrans-70-38.3-175.6-73.6170.1000112.5D232 F233 Q238D232-L236 VanDerWaalsContact O-CB 3.29Å; D232-L236 WeakPolarHBondContact O-CB 3.44Å; D232-L236 VanDerWaalsContact O-CG 3.29Å; D232-L236 WeakPolarHBondContact O-CG 3.26Å; D232-L236 PolarHBondContact O-N 3.28Å; F233-L236 PolarHBondContact O-N 3.37Å; L236-Q238 VanDerWaalsContact C-N 3.25Å; L236-Q238 PolarHBondContact O-N 3.23Å
237S90.6Very high93.2Very high3 Ų343.3 Ų43.32%0.02123%0.23CC..Hα-helixtrans-77.1-11.2178.3680000113.5F233 T234 A239 Y718F233-S237 WeakPolarHBondContact O-CB 3.27Å; F233-S237 PolarHBondContact O-N 3.45Å; F233-S237 PolarHBondContact O-OG 3.31Å; T234-S237 PolarHBondContact O-OG 2.86Å; S237-A239 PolarHBondContact O-N 3.32Å; S237-A239 WeakPolarHBondContact OG-CB 3.46Å; S237-A239 PolarHBondContact OG-N 2.85Å; S237-Y718 VanDerWaalsContact CB-CE2 3.48Å; S237-Y718 WeakPolarHBondContact O-CD2 3.05Å; S237-Y718 VanDerWaalsContact O-CE2 3.29Å; S237-Y718 WeakPolarHBondContact O-CE2 3.46Å; S237-Y718 WeakPolarHBondContact OG-CE2 3.48Å
238Q91.6Very high93.3Very high98 Ų9841.1 Ų41.146%0.45822%0.222SC..THydrogen-bonded Turntrans55.933.1-171.4-54.2177.218.700112.6T234 K235 L236 N240 N241T234-Q238 PolarHBondContact O-N 3.3Å; K235-Q238 PolarHBondContact O-N 3.11Å; L236-Q238 VanDerWaalsContact C-N 3.25Å; L236-Q238 PolarHBondContact O-N 3.23Å; Q238-N240 PolarHBondContact O-N 3.36Å; Q238-N240 VanDerWaalsContact O-N 3.14Å; Q238-N241 WeakPolarHBondContact O-CB 3.39Å; Q238-N241 PolarHBondContact O-N 3.02Å; Q238-N241 PolarHBondContact OE1-ND2 2.86Å
239A92.8Very high93.5Very high0 Ų039.4 Ų39.40%021%0.211CC..Hα-helixtrans-53.8-33177.900000112.8T234 S237 N241 V242 S243 F348 I352 Y718T234-A239 HydrophobicContact CG2-CB 4.09Å; T234-A239 PolarHBondContact O-N 3.27Å; S237-A239 PolarHBondContact O-N 3.32Å; S237-A239 WeakPolarHBondContact OG-CB 3.46Å; S237-A239 PolarHBondContact OG-N 2.85Å; A239-N241 VanDerWaalsContact C-N 3.3Å; A239-N241 PolarHBondContact O-N 3.38Å; A239-V242 WeakPolarHBondContact O-CB 3.26Å; A239-V242 PolarHBondContact O-N 2.81Å; A239-V242 VanDerWaalsContact O-N 3.12Å; A239-S243 PolarHBondContact O-N 3.39Å; A239-F348 HydrophobicContact CB-CE1 4.5Å; A239-I352 HydrophobicContact CB-CD1 3.49Å; A239-I352 VanDerWaalsContact CB-CD1 3.49Å; A239-I352 HydrophobicContact CB-CG1 4.22Å; A239-Y718 HydrophobicContact CB-CE2 3.88Å
240N92.7Very high93.6Very high84 Ų8439.6 Ų39.645%0.44921%0.211SC..Hα-helixtrans-57.4-40.3175.8-68.1-10.2000112.5T234 Q238 V242 S243 D244T234-N240 WeakPolarHBondContact CG2-OD1 3.21Å; Q238-N240 PolarHBondContact O-N 3.36Å; Q238-N240 VanDerWaalsContact O-N 3.14Å; N240-V242 PolarHBondContact O-N 3.41Å; N240-S243 WeakPolarHBondContact O-CB 3.28Å; N240-S243 PolarHBondContact O-N 3.4Å; N240-D244 WeakPolarHBondContact O-CB 3.36Å; N240-D244 PolarHBondContact O-N 3.38Å
241N94.3Very high93.7Very high74 Ų7441.4 Ų41.440%0.39623%0.225SC..Hα-helixtrans-62.5-34.8179.4-64.9-6.7000111.8Q238 A239 A245Q238-N241 WeakPolarHBondContact O-CB 3.39Å; Q238-N241 PolarHBondContact O-N 3.02Å; Q238-N241 PolarHBondContact OE1-ND2 2.86Å; A239-N241 VanDerWaalsContact C-N 3.3Å; A239-N241 PolarHBondContact O-N 3.38Å; N241-A245 WeakPolarHBondContact O-CB 3.49Å; N241-A245 PolarHBondContact O-N 2.81Å
242V95.1Very high93.7Very high3 Ų337 Ų372%0.01821%0.205CC..Hα-helixtrans-72.8-46.4176-177.70000110.5A239 N240 D244 A245 I246 F348 N714 L715 Y718A239-V242 WeakPolarHBondContact O-CB 3.26Å; A239-V242 PolarHBondContact O-N 2.81Å; A239-V242 VanDerWaalsContact O-N 3.12Å; N240-V242 PolarHBondContact O-N 3.41Å; V242-D244 VanDerWaalsContact C-N 3.33Å; V242-D244 PolarHBondContact O-N 2.89Å; V242-A245 PolarHBondContact O-N 3.44Å; V242-I246 HydrophobicContact CG1-CD1 3.86Å; V242-I246 HydrophobicContact CG1-CG1 4.47Å; V242-I246 WeakPolarHBondContact O-CB 3.38Å; V242-I246 WeakPolarHBondContact O-CG1 3.4Å; V242-I246 PolarHBondContact O-N 3.41Å; V242-F348 HydrophobicContact CB-CD1 4.26Å; V242-F348 HydrophobicContact CB-CE1 3.48Å; V242-F348 VanDerWaalsContact CB-CE1 3.48Å; V242-F348 HydrophobicContact CB-CE2 4.48Å; V242-F348 HydrophobicContact CB-CZ 3.63Å; V242-F348 HydrophobicContact CG1-CD1 3.8Å; V242-F348 HydrophobicContact CG1-CD2 4.24Å; V242-F348 HydrophobicContact CG1-CE1 3.44Å; V242-F348 VanDerWaalsContact CG1-CE1 3.44Å; V242-F348 HydrophobicContact CG1-CE2 3.93Å; V242-F348 HydrophobicContact CG1-CG 4.19Å; V242-F348 HydrophobicContact CG1-CZ 3.52Å; V242-F348 HydrophobicContact CG2-CE1 4.37Å; V242-F348 HydrophobicContact CG2-CZ 4.05Å; V242-N714 HydrophobicContact CG2-CB 4.2Å; V242-L715 HydrophobicContact CG1-CD2 3.56Å; V242-L715 HydrophobicContact CG1-CG 3.88Å; V242-Y718 HydrophobicContact CG2-CD2 3.82Å; V242-Y718 HydrophobicContact CG2-CG 3.89Å
243S95.2Very high93.8Very high21 Ų2136.3 Ų36.315%0.14720%0.201CC..Hα-helixtrans-56.6-45.9176.1172.90000112A239 N240 I246 S247 N349A239-S243 PolarHBondContact O-N 3.39Å; N240-S243 WeakPolarHBondContact O-CB 3.28Å; N240-S243 PolarHBondContact O-N 3.4Å; S243-I246 PolarHBondContact O-N 3.35Å; S243-S247 WeakPolarHBondContact O-CB 3.49Å; S243-S247 PolarHBondContact O-N 3.01Å; S243-S247 PolarHBondContact O-OG 3.19Å; S243-N349 WeakPolarHBondContact CB-OD1 3.31Å; S243-N349 PolarHBondContact OG-ND2 2.63Å; S243-N349 PolarHBondContact OG-OD1 2.88Å; S243-N349 VanDerWaalsContact OG-OD1 3.07Å
244D95.7Very high93.9Very high101 Ų10140.3 Ų40.354%0.5422%0.217SC..Hα-helixtrans-67.1-41.3-178.6-66.1-15.4000111N240 V242 S247 G248N240-D244 WeakPolarHBondContact O-CB 3.36Å; N240-D244 PolarHBondContact O-N 3.38Å; V242-D244 VanDerWaalsContact C-N 3.33Å; V242-D244 PolarHBondContact O-N 2.89Å; D244-S247 WeakPolarHBondContact CA-OG 3.48Å; D244-S247 PolarHBondContact O-N 3.05Å; D244-S247 PolarHBondContact O-OG 3.24Å; D244-G248 PolarHBondContact O-N 3.48Å
245A96.1Very high94Very high10 Ų1040.5 Ų40.58%0.08322%0.22CC..Hα-helixtrans-65.2-42.7175.600000112.4N241 V242 F249 A711 N714N241-A245 WeakPolarHBondContact O-CB 3.49Å; N241-A245 PolarHBondContact O-N 2.81Å; V242-A245 PolarHBondContact O-N 3.44Å; A245-F249 PolarHBondContact O-N 3.22Å; A245-A711 HydrophobicContact CB-CB 4.09Å; A245-N714 HydrophobicContact CB-CB 4.45Å
246I96.3Very high94.1Very high0 Ų034.1 Ų34.10%019%0.192CC..Hα-helixtrans-63.3-49.2175.9-74.4172.9000110.7V242 S243 G248 F249 Q250 L345 F348 A711 L715V242-I246 HydrophobicContact CG1-CD1 3.86Å; V242-I246 HydrophobicContact CG1-CG1 4.47Å; V242-I246 WeakPolarHBondContact O-CB 3.38Å; V242-I246 WeakPolarHBondContact O-CG1 3.4Å; V242-I246 PolarHBondContact O-N 3.41Å; S243-I246 PolarHBondContact O-N 3.35Å; I246-G248 VanDerWaalsContact C-N 3.33Å; I246-G248 PolarHBondContact O-N 3Å; I246-F249 PolarHBondContact O-N 3.41Å; I246-Q250 HydrophobicContact CG2-CG 4.22Å; I246-Q250 WeakPolarHBondContact O-CG 2.99Å; I246-Q250 PolarHBondContact O-N 2.95Å; I246-L345 HydrophobicContact CG2-CB 3.55Å; I246-L345 HydrophobicContact CG2-CD1 4.41Å; I246-F348 HydrophobicContact CD1-CB 3.94Å; I246-F348 HydrophobicContact CD1-CD1 4.29Å; I246-F348 HydrophobicContact CD1-CG 4.16Å; I246-A711 HydrophobicContact CG1-CB 4.41Å; I246-L715 HydrophobicContact CD1-CD2 4.47Å
247S95.2Very high94.3Very high42 Ų4232.6 Ų32.629%0.29418%0.184SC..Hα-helixtrans-64.9-37.1-177.863.80000112.2S243 D244 Q250 T251S243-S247 WeakPolarHBondContact O-CB 3.49Å; S243-S247 PolarHBondContact O-N 3.01Å; S243-S247 PolarHBondContact O-OG 3.19Å; D244-S247 WeakPolarHBondContact CA-OG 3.48Å; D244-S247 PolarHBondContact O-N 3.05Å; D244-S247 PolarHBondContact O-OG 3.24Å; S247-Q250 PolarHBondContact O-N 2.96Å; S247-T251 VanDerWaalsContact O-CB 3.26Å; S247-T251 WeakPolarHBondContact O-CB 3.41Å; S247-T251 PolarHBondContact O-N 2.86Å; S247-T251 PolarHBondContact O-OG1 2.83Å
248G94.5Very high94.4Very high28 Ų2834.8 Ų34.829%0.28920%0.198SC..Hα-helixtrans-58.1-51.2172.100000112.1D244 I246 T251 S252 Q707D244-G248 PolarHBondContact O-N 3.48Å; I246-G248 VanDerWaalsContact C-N 3.33Å; I246-G248 PolarHBondContact O-N 3Å; G248-T251 PolarHBondContact O-N 2.98Å; G248-S252 PolarHBondContact O-N 3.34Å; G248-S252 VanDerWaalsContact O-N 3.11Å; G248-S252 PolarHBondContact O-OG 3.39Å; G248-Q707 PolarHBondContact O-OE1 3.47Å
249F95.6Very high94.3Very high0 Ų033.8 Ų33.80%022%0.215CC..Hα-helixtrans-59.1-50.1176168.4-100.3000112.2A245 I246 T251 S252 A253 V342 L345 F630 L633 L636 I704 Q707 M708A245-F249 PolarHBondContact O-N 3.22Å; I246-F249 PolarHBondContact O-N 3.41Å; F249-T251 VanDerWaalsContact C-N 3.3Å; F249-T251 PolarHBondContact O-N 3.36Å; F249-S252 PolarHBondContact O-N 2.81Å; F249-A253 HydrophobicContact CZ-CB 4.36Å; F249-A253 WeakPolarHBondContact O-CB 3.25Å; F249-A253 PolarHBondContact O-N 3.4Å; F249-V342 HydrophobicContact CE1-CG1 4.5Å; F249-V342 HydrophobicContact CE1-CG2 4.33Å; F249-L345 HydrophobicContact CD1-CD1 3.68Å; F249-L345 HydrophobicContact CE1-CD1 3.75Å; F249-F630 AromaticContact CD1-CE1 3.73Å; F249-F630 HydrophobicContact CD1-CE1 3.73Å; F249-F630 HydrophobicContact CD1-CZ 4.27Å; F249-F630 HydrophobicContact CE1-CD1 4.5Å; F249-F630 AromaticContact CE1-CE1 3.77Å; F249-F630 HydrophobicContact CE1-CE1 3.77Å; F249-F630 HydrophobicContact CG-CE1 4.15Å; F249-F630 HydrophobicContact CZ-CE1 4.23Å; F249-L633 HydrophobicContact CE1-CD1 3.94Å; F249-L633 HydrophobicContact CZ-CD1 3.92Å; F249-L636 HydrophobicContact CE2-CD1 3.82Å; F249-L636 HydrophobicContact CZ-CD1 3.81Å; F249-I704 HydrophobicContact CD2-CG2 4.24Å; F249-I704 HydrophobicContact CE2-CG2 3.79Å; F249-Q707 HydrophobicContact CB-CB 4.29Å; F249-M708 HydrophobicContact CD2-CB 3.72Å; F249-M708 HydrophobicContact CD2-CG 4.27Å; F249-M708 HydrophobicContact CE2-CB 3.69Å; F249-M708 HydrophobicContact CE2-CG 3.93Å; F249-M708 HydrophobicContact CE2-SD 4.29Å; F249-M708 HydrophobicContact CZ-CG 4.4Å
250Q94.9Very high94.4Very high5 Ų534.9 Ų34.92%0.02322%0.222CC..Hα-helixtrans-60.2-41.2-179.3-72.1176.4-49.200112I246 S247 S252 A253 R254 V342 L345 N346I246-Q250 HydrophobicContact CG2-CG 4.22Å; I246-Q250 WeakPolarHBondContact O-CG 2.99Å; I246-Q250 PolarHBondContact O-N 2.95Å; S247-Q250 PolarHBondContact O-N 2.96Å; Q250-S252 VanDerWaalsContact C-N 3.34Å; Q250-A253 PolarHBondContact O-N 3.41Å; Q250-R254 WeakPolarHBondContact O-CB 3.48Å; Q250-R254 WeakPolarHBondContact O-CG 3.27Å; Q250-R254 PolarHBondContact O-N 2.67Å; Q250-V342 HydrophobicContact CB-CG1 4.19Å; Q250-V342 HydrophobicContact CG-CG1 3.87Å; Q250-V342 PolarHBondContact NE2-O 3.34Å; Q250-L345 HydrophobicContact CG-CD1 4.24Å; Q250-N346 VanDerWaalsContact NE2-CG 3.3Å; Q250-N346 PolarHBondContact NE2-OD1 3.38Å; Q250-N346 PolarHBondContact OE1-OD1 3.33Å; Q250-N346 VanDerWaalsContact OE1-OD1 3.07Å
251T95Very high94.4Very high77 Ų7737.7 Ų37.747%0.47223%0.233SC..Hα-helixtrans-64.6-40.4179.8-60.50000111.2S247 G248 F249 A255 R700S247-T251 VanDerWaalsContact O-CB 3.26Å; S247-T251 WeakPolarHBondContact O-CB 3.41Å; S247-T251 PolarHBondContact O-N 2.86Å; S247-T251 PolarHBondContact O-OG1 2.83Å; G248-T251 PolarHBondContact O-N 2.98Å; F249-T251 VanDerWaalsContact C-N 3.3Å; F249-T251 PolarHBondContact O-N 3.36Å; T251-A255 WeakPolarHBondContact O-CB 3.31Å; T251-A255 PolarHBondContact O-N 3.15Å; T251-R700 PolarHBondContact O-NH2 2.9Å
252S93Very high94.4Very high6 Ų634.7 Ų34.74%0.04222%0.218CC..Hα-helixtrans-69.9-46.9174.7-60.20000111.7G248 F249 Q250 R254 A255 F256 Q707G248-S252 PolarHBondContact O-N 3.34Å; G248-S252 VanDerWaalsContact O-N 3.11Å; G248-S252 PolarHBondContact O-OG 3.39Å; F249-S252 PolarHBondContact O-N 2.81Å; Q250-S252 VanDerWaalsContact C-N 3.34Å; S252-R254 PolarHBondContact O-N 2.79Å; S252-A255 WeakPolarHBondContact O-CB 3.36Å; S252-A255 PolarHBondContact O-N 3Å; S252-F256 VanDerWaalsContact O-CD2 3.27Å; S252-F256 WeakPolarHBondContact O-CD2 3.35Å; S252-Q707 PolarHBondContact OG-NE2 3.09Å; S252-Q707 PolarHBondContact OG-OE1 3.39Å
253A93.9Very high94.3Very high0 Ų035.4 Ų35.40%022%0.222CC..Hα-helixtrans-58.8-46.417900000112.1F249 Q250 A255 F256 I335 V342F249-A253 HydrophobicContact CZ-CB 4.36Å; F249-A253 WeakPolarHBondContact O-CB 3.25Å; F249-A253 PolarHBondContact O-N 3.4Å; Q250-A253 PolarHBondContact O-N 3.41Å; A253-A255 VanDerWaalsContact C-N 3.29Å; A253-A255 PolarHBondContact O-N 2.78Å; A253-F256 PolarHBondContact O-N 2.69Å; A253-I335 HydrophobicContact CB-CG2 4.3Å; A253-V342 HydrophobicContact CB-CG1 4.29Å; A253-V342 HydrophobicContact CB-CG2 4.49Å
254R94.4Very high94.2Very high85 Ų8537.1 Ų37.132%0.32124%0.237SC..Hα-helixtrans-65.8-30.6178.5-71.2-168.3-169.4108.32.8113.1Q250 S252 F256 L257 L339 D343Q250-R254 WeakPolarHBondContact O-CB 3.48Å; Q250-R254 WeakPolarHBondContact O-CG 3.27Å; Q250-R254 PolarHBondContact O-N 2.67Å; S252-R254 PolarHBondContact O-N 2.79Å; R254-F256 PolarHBondContact O-N 3.4Å; R254-F256 VanDerWaalsContact O-N 3.16Å; R254-L257 HydrophobicContact CB-CD1 4.23Å; R254-L257 HydrophobicContact CG-CD1 4.22Å; R254-L257 PolarHBondContact O-N 3.28Å; R254-L339 HydrophobicContact CG-CD1 4.37Å; R254-D343 IonicContact CZ-OD1 3.55Å; R254-D343 IonicContact NE-OD1 3.6Å; R254-D343 PolarHBondContact NE-OD1 2.96Å; R254-D343 IonicContact NH2-OD1 2.78Å; R254-D343 PolarHBondContact NH2-OD1 2.85Å
255A94.5Very high94Very high23 Ų2335.1 Ų35.119%0.1922%0.224CC..Hα-helixtrans-63.9-17.7177.800000113.4T251 S252 A253 S260 A262T251-A255 WeakPolarHBondContact O-CB 3.31Å; T251-A255 PolarHBondContact O-N 3.15Å; S252-A255 WeakPolarHBondContact O-CB 3.36Å; S252-A255 PolarHBondContact O-N 3Å; A253-A255 VanDerWaalsContact C-N 3.29Å; A253-A255 PolarHBondContact O-N 2.78Å; A255-S260 WeakPolarHBondContact O-CB 3.34Å; A255-S260 PolarHBondContact O-OG 3.1Å; A255-S260 VanDerWaalsContact O-OG 3.05Å; A255-A262 VanDerWaalsContact O-CB 3.23Å; A255-A262 WeakPolarHBondContact O-CB 3.14Å
256F94.3Very high93.8Very high0 Ų034.7 Ų34.70%022%0.221CC..THydrogen-bonded Turntrans-114.623.1179.6-65.8-82.7000113.5S252 A253 R254 A262 I263 I266 S332 L697 R700 F701 I704S252-F256 VanDerWaalsContact O-CD2 3.27Å; S252-F256 WeakPolarHBondContact O-CD2 3.35Å; A253-F256 PolarHBondContact O-N 2.69Å; R254-F256 PolarHBondContact O-N 3.4Å; R254-F256 VanDerWaalsContact O-N 3.16Å; F256-A262 HydrophobicContact CD1-CB 3.86Å; F256-A262 HydrophobicContact CE1-CB 3.76Å; F256-A262 HydrophobicContact CZ-CB 4.42Å; F256-I263 HydrophobicContact CB-CD1 4.37Å; F256-I263 HydrophobicContact CD1-CD1 4.2Å; F256-I266 HydrophobicContact CD1-CD1 4.4Å; F256-I266 HydrophobicContact CE1-CD1 4.07Å; F256-S332 VanDerWaalsContact O-CB 3.27Å; F256-S332 WeakPolarHBondContact O-CB 3.13Å; F256-S332 PolarHBondContact O-OG 2.93Å; F256-L697 HydrophobicContact CE1-CB 4.41Å; F256-L697 WeakPolarHBondContact CZ-O 3.36Å; F256-R700 HydrophobicContact CE2-CB 4.22Å; F256-R700 HydrophobicContact CE2-CG 4Å; F256-R700 HydrophobicContact CZ-CB 4.13Å; F256-R700 HydrophobicContact CZ-CG 4.37Å; F256-F701 HydrophobicContact CB-CD2 4.1Å; F256-F701 HydrophobicContact CB-CE2 4.29Å; F256-F701 HydrophobicContact CD1-CB 4.42Å; F256-F701 AromaticContact CD1-CD2 3.67Å; F256-F701 HydrophobicContact CD1-CD2 3.67Å; F256-F701 HydrophobicContact CD1-CE2 4.43Å; F256-F701 HydrophobicContact CD1-CG 4.47Å; F256-F701 HydrophobicContact CD2-CB 4.49Å; F256-F701 AromaticContact CD2-CD2 3.88Å; F256-F701 HydrophobicContact CD2-CD2 3.88Å; F256-F701 HydrophobicContact CE1-CB 3.89Å; F256-F701 HydrophobicContact CE1-CD2 4.03Å; F256-F701 HydrophobicContact CE1-CG 4.4Å; F256-F701 HydrophobicContact CE2-CB 4Å; F256-F701 HydrophobicContact CE2-CD2 4.23Å; F256-F701 AromaticContact CG-CD2 3.61Å; F256-F701 HydrophobicContact CG-CD2 3.61Å; F256-F701 HydrophobicContact CG-CE2 4.28Å; F256-F701 HydrophobicContact CZ-CB 3.69Å; F256-F701 HydrophobicContact CZ-CD2 4.31Å; F256-I704 HydrophobicContact CD2-CD1 3.92Å; F256-I704 HydrophobicContact CE2-CD1 4.42Å
257L94.3Very high93.5Very high25 Ų2537.5 Ų37.513%0.13124%0.24CC..SBendtrans-67154.3170.6-74.3170.1000111.6R254 G259 S260 I263 I335 Q336 L339R254-L257 HydrophobicContact CB-CD1 4.23Å; R254-L257 HydrophobicContact CG-CD1 4.22Å; R254-L257 PolarHBondContact O-N 3.28Å; L257-G259 PolarHBondContact O-N 2.87Å; L257-S260 WeakPolarHBondContact O-CB 3.28Å; L257-S260 PolarHBondContact O-N 3.29Å; L257-S260 PolarHBondContact O-OG 2.56Å; L257-I263 WeakPolarHBondContact O-CG1 3.41Å; L257-I335 HydrophobicContact CD2-CB 4.39Å; L257-I335 HydrophobicContact CD2-CG2 3.7Å; L257-I335 HydrophobicContact CG-CG2 4.48Å; L257-Q336 HydrophobicContact CD2-CB 4.14Å; L257-L339 HydrophobicContact CD1-CD1 3.99Å; L257-L339 HydrophobicContact CD1-CD2 4.09Å; L257-L339 HydrophobicContact CD2-CD1 4.26Å; L257-L339 HydrophobicContact CD2-CD2 4.41Å
258P92.3Very high93.3Very high48 Ų4841 Ų4131%0.31225%0.248SC..THydrogen-bonded Turntrans-55.8132.8173.2-2535.3000111.1S260 S332 N333 Q336P258-S260 VanDerWaalsContact C-N 3.25Å; P258-S260 PolarHBondContact O-N 2.91Å; P258-S332 WeakPolarHBondContact CD-OG 3.48Å; P258-N333 WeakPolarHBondContact CG-OD1 3.22Å; P258-Q336 HydrophobicContact CG-CB 3.83Å; P258-Q336 HydrophobicContact CG-CG 4.24Å
259G90.6Very high93.1Very high78 Ų7839.9 Ų39.980%0.80424%0.235SC*.THydrogen-bonded Turntrans80.1-2.5-175.700000115.1L257L257-G259 PolarHBondContact O-N 2.87Å
260S94.2Very high92.8Very high22 Ų2241.6 Ų41.615%0.15424%0.244CC..  trans-63.5155.7168.563.90000111.5A255 L257 P258 A262 I263 A264A255-S260 WeakPolarHBondContact O-CB 3.34Å; A255-S260 PolarHBondContact O-OG 3.1Å; A255-S260 VanDerWaalsContact O-OG 3.05Å; L257-S260 WeakPolarHBondContact O-CB 3.28Å; L257-S260 PolarHBondContact O-N 3.29Å; L257-S260 PolarHBondContact O-OG 2.56Å; P258-S260 VanDerWaalsContact C-N 3.25Å; P258-S260 PolarHBondContact O-N 2.91Å; S260-A262 PolarHBondContact O-N 3.49Å; S260-I263 PolarHBondContact O-N 2.93Å; S260-I263 WeakPolarHBondContact OG-CG1 3.44Å; S260-I263 PolarHBondContact OG-N 3.41Å; S260-A264 WeakPolarHBondContact O-CB 3.17Å; S260-A264 PolarHBondContact O-N 3.08Å
261E93.5Very high92.5Very high144 Ų14447.4 Ų47.467%0.67327%0.271SS*.Hα-helixtrans-57.6-39176.1-169.1-175.816900111.9I263 A264 Q265E261-I263 PolarHBondContact O-N 3.15Å; E261-A264 PolarHBondContact O-N 3.27Å; E261-Q265 HydrophobicContact CG-CG 4.47Å; E261-Q265 WeakPolarHBondContact O-CB 3.49Å; E261-Q265 WeakPolarHBondContact O-CG 3.42Å; E261-Q265 PolarHBondContact O-N 2.96Å; E261-Q265 PolarHBondContact OE1-NE2 3.08Å
262A93.7Very high92.3Very high10 Ų1044.3 Ų44.38%0.08325%0.253CS..Hα-helixtrans-61.3-47.2178.300000112A255 F256 S260 A264 Q265 I266 L697A255-A262 VanDerWaalsContact O-CB 3.23Å; A255-A262 WeakPolarHBondContact O-CB 3.14Å; F256-A262 HydrophobicContact CD1-CB 3.86Å; F256-A262 HydrophobicContact CE1-CB 3.76Å; F256-A262 HydrophobicContact CZ-CB 4.42Å; S260-A262 PolarHBondContact O-N 3.49Å; A262-A264 VanDerWaalsContact C-N 3.34Å; A262-Q265 PolarHBondContact O-N 3.48Å; A262-I266 VanDerWaalsContact O-CG1 3.26Å; A262-I266 WeakPolarHBondContact O-CG1 3.37Å; A262-I266 PolarHBondContact O-N 3.25Å; A262-L697 HydrophobicContact CB-CD1 4.28Å; A262-L697 HydrophobicContact CB-CD2 3.75Å
263I92.8Very high92.2Very high19 Ų1944 Ų4410%0.09725%0.251CS..Hα-helixtrans-67.9-37178.4-65-64000111F256 L257 S260 E261 I266 S267 V328F256-I263 HydrophobicContact CB-CD1 4.37Å; F256-I263 HydrophobicContact CD1-CD1 4.2Å; L257-I263 WeakPolarHBondContact O-CG1 3.41Å; S260-I263 PolarHBondContact O-N 2.93Å; S260-I263 WeakPolarHBondContact OG-CG1 3.44Å; S260-I263 PolarHBondContact OG-N 3.41Å; E261-I263 PolarHBondContact O-N 3.15Å; I263-I266 PolarHBondContact O-N 2.82Å; I263-S267 VanDerWaalsContact O-CB 3.25Å; I263-S267 WeakPolarHBondContact O-CB 2.83Å; I263-S267 PolarHBondContact O-N 3.37Å; I263-V328 HydrophobicContact CD1-CG1 4.02Å
264A92.8Very high92Very high57 Ų5748.3 Ų48.347%0.47127%0.271SS..Hα-helixtrans-62.1-44.6174.900000111.8S260 E261 A262 S267 Y268S260-A264 WeakPolarHBondContact O-CB 3.17Å; S260-A264 PolarHBondContact O-N 3.08Å; E261-A264 PolarHBondContact O-N 3.27Å; A262-A264 VanDerWaalsContact C-N 3.34Å; A264-S267 PolarHBondContact O-N 2.87Å; A264-Y268 VanDerWaalsContact O-CB 3.27Å; A264-Y268 WeakPolarHBondContact O-CB 3.22Å; A264-Y268 PolarHBondContact O-N 3.23Å
265Q93Very high91.8Very high59 Ų5948.8 Ų48.828%0.27628%0.276SS..Hα-helixtrans-64.8-43.3176.8-71.8-175.930.700112.1E261 A262 Y268 F269 I694 L697E261-Q265 HydrophobicContact CG-CG 4.47Å; E261-Q265 WeakPolarHBondContact O-CB 3.49Å; E261-Q265 WeakPolarHBondContact O-CG 3.42Å; E261-Q265 PolarHBondContact O-N 2.96Å; E261-Q265 PolarHBondContact OE1-NE2 3.08Å; A262-Q265 PolarHBondContact O-N 3.48Å; Q265-Y268 PolarHBondContact O-N 3.46Å; Q265-F269 WeakPolarHBondContact O-CB 3.45Å; Q265-F269 PolarHBondContact O-N 2.91Å; Q265-I694 HydrophobicContact CB-CD1 4.3Å; Q265-L697 HydrophobicContact CB-CD1 3.88Å
266I91.1Very high91.7Very high1 Ų148 Ų481%0.00527%0.269CS..Hα-helixtrans-63.5-43.8177.1-68.8166000110.9F256 A262 I263 F269 N270 I325 V328 I694 L697 F698F256-I266 HydrophobicContact CD1-CD1 4.4Å; F256-I266 HydrophobicContact CE1-CD1 4.07Å; A262-I266 VanDerWaalsContact O-CG1 3.26Å; A262-I266 WeakPolarHBondContact O-CG1 3.37Å; A262-I266 PolarHBondContact O-N 3.25Å; I263-I266 PolarHBondContact O-N 2.82Å; I266-F269 PolarHBondContact O-N 3.45Å; I266-N270 PolarHBondContact O-N 3.21Å; I266-I325 HydrophobicContact CG2-CD1 4.12Å; I266-I325 HydrophobicContact CG2-CG1 4.11Å; I266-I325 HydrophobicContact CG2-CG2 3.91Å; I266-V328 HydrophobicContact CD1-CG1 4.17Å; I266-I694 HydrophobicContact CG1-CD1 4.48Å; I266-L697 HydrophobicContact CD1-CB 4.28Å; I266-L697 HydrophobicContact CD1-CD1 4.43Å; I266-L697 HydrophobicContact CG1-CB 4.48Å; I266-L697 HydrophobicContact CG1-CD1 4.06Å; I266-F698 HydrophobicContact CD1-CD1 4.21Å; I266-F698 HydrophobicContact CD1-CE1 3.95Å; I266-F698 HydrophobicContact CG1-CE1 4.03Å; I266-F698 HydrophobicContact CG2-CE1 4.04Å; I266-F698 HydrophobicContact CG2-CZ 4.45Å
267S90.3Very high91.5Very high59 Ų5950.5 Ų50.541%0.41328%0.282SS..Hα-helixtrans-64.8-43.8177.5-174.40000111.8I263 A264 F269 N270 H271I263-S267 VanDerWaalsContact O-CB 3.25Å; I263-S267 WeakPolarHBondContact O-CB 2.83Å; I263-S267 PolarHBondContact O-N 3.37Å; A264-S267 PolarHBondContact O-N 2.87Å; S267-F269 VanDerWaalsContact C-N 3.35Å; S267-F269 PolarHBondContact O-N 3.38Å; S267-N270 WeakPolarHBondContact O-CB 3.42Å; S267-N270 PolarHBondContact O-N 2.95Å; S267-H271 PolarHBondContact O-N 3.49Å
268Y90.4Very high91.3Very high115 Ų11553 Ų5345%0.45130%0.302SS..Hα-helixtrans-59.8-44.7175176.1-102.8000111.8A264 Q265 N270 H271 S272 K686A264-Y268 VanDerWaalsContact O-CB 3.27Å; A264-Y268 WeakPolarHBondContact O-CB 3.22Å; A264-Y268 PolarHBondContact O-N 3.23Å; Q265-Y268 PolarHBondContact O-N 3.46Å; Y268-N270 VanDerWaalsContact C-N 3.34Å; Y268-N270 PolarHBondContact O-N 2.89Å; Y268-H271 PolarHBondContact O-N 3.33Å; Y268-S272 VanDerWaalsContact O-CB 3.27Å; Y268-S272 WeakPolarHBondContact O-CB 3.4Å; Y268-S272 PolarHBondContact O-N 2.93Å; Y268-S272 PolarHBondContact O-OG 3.24Å; Y268-K686 PolarHBondContact OH-NZ 3.46Å
269F90.8Very high91.3Very high4 Ų455 Ų552%0.01831%0.307CS..Hα-helixtrans-59-45.3175.3-178.6-99000111.4Q265 I266 S267 L273 F323 L687 T690 R691 I694Q265-F269 WeakPolarHBondContact O-CB 3.45Å; Q265-F269 PolarHBondContact O-N 2.91Å; I266-F269 PolarHBondContact O-N 3.45Å; S267-F269 VanDerWaalsContact C-N 3.35Å; S267-F269 PolarHBondContact O-N 3.38Å; F269-L273 VanDerWaalsContact O-CB 3.24Å; F269-L273 WeakPolarHBondContact O-CB 3.49Å; F269-L273 PolarHBondContact O-N 3Å; F269-F323 HydrophobicContact CE1-CD1 4.28Å; F269-F323 HydrophobicContact CE1-CE1 4.09Å; F269-F323 HydrophobicContact CE1-CE2 4.35Å; F269-F323 HydrophobicContact CE1-CG 4.47Å; F269-F323 HydrophobicContact CE1-CZ 4.09Å; F269-F323 HydrophobicContact CZ-CE1 4.5Å; F269-F323 HydrophobicContact CZ-CZ 4.34Å; F269-L687 HydrophobicContact CD2-CD1 3.36Å; F269-L687 HydrophobicContact CD2-CG 4.35Å; F269-L687 HydrophobicContact CE2-CD1 3.58Å; F269-L687 HydrophobicContact CE2-CG 4.09Å; F269-L687 HydrophobicContact CG-CD1 4.17Å; F269-T690 WeakPolarHBondContact CD2-OG1 3.17Å; F269-R691 HydrophobicContact CE2-CG 4.32Å; F269-I694 HydrophobicContact CB-CD1 3.76Å; F269-I694 HydrophobicContact CB-CG1 3.88Å; F269-I694 HydrophobicContact CD1-CG1 4.31Å; F269-I694 HydrophobicContact CD1-CG2 4.2Å; F269-I694 HydrophobicContact CD2-CD1 4.43Å; F269-I694 HydrophobicContact CD2-CG1 3.63Å; F269-I694 HydrophobicContact CE1-CG2 4.41Å; F269-I694 HydrophobicContact CE2-CG1 4.21Å; F269-I694 HydrophobicContact CG-CD1 4.14Å; F269-I694 HydrophobicContact CG-CG1 3.68Å; F269-I694 HydrophobicContact CG-CG2 4.4Å
270N88.7Confident91.3Very high36 Ų3651.4 Ų51.419%0.19327%0.269CS..Hα-helixtrans-61.8-48.4178.1-162.534.8000112.7I266 S267 Y268 L273 H274 I325I266-N270 PolarHBondContact O-N 3.21Å; S267-N270 WeakPolarHBondContact O-CB 3.42Å; S267-N270 PolarHBondContact O-N 2.95Å; Y268-N270 VanDerWaalsContact C-N 3.34Å; Y268-N270 PolarHBondContact O-N 2.89Å; N270-L273 WeakPolarHBondContact O-CB 3.42Å; N270-L273 PolarHBondContact O-N 2.87Å; N270-H274 PolarHBondContact O-CD2 3.02Å; N270-H274 VanDerWaalsContact O-CD2 3.27Å; N270-H274 PolarHBondContact O-N 2.69Å; N270-I325 HydrophobicContact CB-CD1 3.42Å; N270-I325 VanDerWaalsContact CB-CD1 3.42Å; N270-I325 HydrophobicContact CB-CG2 4.14Å
271H89.5Confident91.3Very high128 Ų12853.3 Ų53.359%0.59328%0.281SS*.Hα-helixtrans-62.2-47.8-178-172.771000110.7S267 Y268 L273 H274 E275S267-H271 PolarHBondContact O-N 3.49Å; Y268-H271 PolarHBondContact O-N 3.33Å; H271-L273 VanDerWaalsContact C-N 3.28Å; H271-L273 PolarHBondContact O-N 2.66Å; H271-H274 PolarHBondContact O-N 2.94Å; H271-E275 PolarHBondContact O-N 3.38Å
272S90.7Very high91.3Very high12 Ų1249.6 Ų49.68%0.08427%0.268CS..Hα-helixtrans-61.5-37.2176.8-54.90000111.6Y268 E275 V276Y268-S272 VanDerWaalsContact O-CB 3.27Å; Y268-S272 WeakPolarHBondContact O-CB 3.4Å; Y268-S272 PolarHBondContact O-N 2.93Å; Y268-S272 PolarHBondContact O-OG 3.24Å; S272-E275 PolarHBondContact O-N 3.32Å; S272-V276 WeakPolarHBondContact O-CB 3.42Å; S272-V276 VanDerWaalsContact O-CG2 3.28Å; S272-V276 WeakPolarHBondContact O-CG2 3.46Å; S272-V276 PolarHBondContact O-N 2.65Å
273L90.1Very high91.2Very high0 Ų049.9 Ų49.90%027%0.268CS..Hα-helixtrans-63.7-45.4175.4177.966000112.1F269 N270 H271 E275 V276 I277 P320 F323 L652 L687F269-L273 VanDerWaalsContact O-CB 3.24Å; F269-L273 WeakPolarHBondContact O-CB 3.49Å; F269-L273 PolarHBondContact O-N 3Å; N270-L273 WeakPolarHBondContact O-CB 3.42Å; N270-L273 PolarHBondContact O-N 2.87Å; H271-L273 VanDerWaalsContact C-N 3.28Å; H271-L273 PolarHBondContact O-N 2.66Å; L273-E275 VanDerWaalsContact C-N 3.34Å; L273-V276 PolarHBondContact O-N 2.97Å; L273-I277 HydrophobicContact CD1-CD1 4.08Å; L273-I277 HydrophobicContact CD1-CG1 4.38Å; L273-I277 HydrophobicContact CG-CD1 3.86Å; L273-I277 WeakPolarHBondContact O-CB 3.5Å; L273-I277 WeakPolarHBondContact O-CD1 3.45Å; L273-I277 VanDerWaalsContact O-CG1 3.24Å; L273-I277 WeakPolarHBondContact O-CG1 3.41Å; L273-I277 PolarHBondContact O-N 3.46Å; L273-P320 HydrophobicContact CD2-CB 4.17Å; L273-F323 HydrophobicContact CD2-CD2 3.41Å; L273-F323 VanDerWaalsContact CD2-CD2 3.41Å; L273-F323 HydrophobicContact CD2-CE2 3.26Å; L273-F323 HydrophobicContact CD2-CZ 4.35Å; L273-L652 HydrophobicContact CD1-CD1 3.49Å; L273-L652 VanDerWaalsContact CD1-CD1 3.49Å; L273-L687 VanDerWaalsContact CA-CD2 3.43Å; L273-L687 HydrophobicContact CB-CD2 3.9Å; L273-L687 HydrophobicContact CD1-CD2 4.01Å
274H90Very high91.3Very high90 Ų9051.6 Ų51.642%0.41727%0.273SS..Hα-helixtrans-62.8-41.4176.8-84-69.8000112.3N270 H271 I277 S278N270-H274 PolarHBondContact O-CD2 3.02Å; N270-H274 VanDerWaalsContact O-CD2 3.27Å; N270-H274 PolarHBondContact O-N 2.69Å; H271-H274 PolarHBondContact O-N 2.94Å; H274-I277 PolarHBondContact O-N 3.49Å; H274-S278 PolarHBondContact O-N 2.88Å; H274-S278 VanDerWaalsContact O-N 3.14Å
275E91.2Very high91.4Very high95 Ų9553.4 Ų53.444%0.44427%0.272SS..Hα-helixtrans-59.3-52174.3-171.8172.6-15700110.6H271 S272 L273 I277 S278 E279H271-E275 PolarHBondContact O-N 3.38Å; S272-E275 PolarHBondContact O-N 3.32Å; L273-E275 VanDerWaalsContact C-N 3.34Å; E275-I277 VanDerWaalsContact C-N 3.34Å; E275-I277 PolarHBondContact O-N 3.03Å; E275-S278 PolarHBondContact O-N 3.37Å; E275-S278 PolarHBondContact O-OG 3.43Å; E275-E279 HydrophobicContact CG-CG 4.48Å; E275-E279 WeakPolarHBondContact O-CG 3.23Å; E275-E279 PolarHBondContact O-N 3.24Å
276V91Very high91.4Very high7 Ų757.8 Ų57.84%0.04229%0.286CS..Hα-helixtrans-58.8-42.4177.5171.20000112.1S272 L273 S278 E279 L280 V316 L652 P684 L687S272-V276 WeakPolarHBondContact O-CB 3.42Å; S272-V276 VanDerWaalsContact O-CG2 3.28Å; S272-V276 WeakPolarHBondContact O-CG2 3.46Å; S272-V276 PolarHBondContact O-N 2.65Å; L273-V276 PolarHBondContact O-N 2.97Å; V276-S278 PolarHBondContact O-N 3.46Å; V276-E279 PolarHBondContact O-N 3.33Å; V276-L280 HydrophobicContact CG1-CB 4.43Å; V276-L280 WeakPolarHBondContact O-CB 3.25Å; V276-L280 PolarHBondContact O-N 2.93Å; V276-V316 HydrophobicContact CG1-CG2 4.46Å; V276-L652 HydrophobicContact CG1-CD2 4.15Å; V276-P684 HydrophobicContact CG1-CB 4.04Å; V276-L687 HydrophobicContact CB-CD2 4.34Å; V276-L687 HydrophobicContact CG2-CD2 4.04Å
277I90Very high91.5Very high52 Ų5257.8 Ų57.827%0.26729%0.286SS..Hα-helixtrans-58.6-39.5176.9-73162.3000111.4L273 H274 E275 P281 V316 P320L273-I277 HydrophobicContact CD1-CD1 4.08Å; L273-I277 HydrophobicContact CD1-CG1 4.38Å; L273-I277 HydrophobicContact CG-CD1 3.86Å; L273-I277 WeakPolarHBondContact O-CB 3.5Å; L273-I277 WeakPolarHBondContact O-CD1 3.45Å; L273-I277 VanDerWaalsContact O-CG1 3.24Å; L273-I277 WeakPolarHBondContact O-CG1 3.41Å; L273-I277 PolarHBondContact O-N 3.46Å; H274-I277 PolarHBondContact O-N 3.49Å; E275-I277 VanDerWaalsContact C-N 3.34Å; E275-I277 PolarHBondContact O-N 3.03Å; I277-P281 WeakPolarHBondContact O-CD 3.31Å; I277-V316 HydrophobicContact CG1-CB 4.25Å; I277-V316 HydrophobicContact CG1-CG1 3.92Å; I277-V316 HydrophobicContact CG1-CG2 3.89Å; I277-P320 HydrophobicContact CD1-CB 3.76Å; I277-P320 HydrophobicContact CD1-CG 3.68Å
278S90.5Very high91.7Very high78 Ų7855.5 Ų55.555%0.54527%0.27SS..Hα-helixtrans-75.8-36.4-179.475.80000113.3H274 E275 V276H274-S278 PolarHBondContact O-N 2.88Å; H274-S278 VanDerWaalsContact O-N 3.14Å; E275-S278 PolarHBondContact O-N 3.37Å; E275-S278 PolarHBondContact O-OG 3.43Å; V276-S278 PolarHBondContact O-N 3.46Å
279E92Very high91.8Very high89 Ų8953.5 Ų53.542%0.41627%0.267SS..Hα-helixtrans-89.7-32.8-173.2-66.3-164.2152.900113.6E275 V276 P281 T282 I283E275-E279 HydrophobicContact CG-CG 4.48Å; E275-E279 WeakPolarHBondContact O-CG 3.23Å; E275-E279 PolarHBondContact O-N 3.24Å; V276-E279 PolarHBondContact O-N 3.33Å; E279-P281 VanDerWaalsContact C-CD 3.43Å; E279-T282 WeakPolarHBondContact O-CA 3.39Å; E279-T282 WeakPolarHBondContact O-CB 3.49Å; E279-T282 PolarHBondContact O-N 3.31Å; E279-I283 HydrophobicContact CB-CD1 4.16Å; E279-I283 WeakPolarHBondContact O-CG1 3.35Å; E279-I283 PolarHBondContact O-N 3.26Å
280L91.9Very high92Very high3 Ų354.5 Ų54.52%0.01627%0.273CS..Hα-helixtrans-56-39.3-173.9-16769.1000113.9V276 T282 I283 R284 L314 V316 T653 L680 P684V276-L280 HydrophobicContact CG1-CB 4.43Å; V276-L280 WeakPolarHBondContact O-CB 3.25Å; V276-L280 PolarHBondContact O-N 2.93Å; L280-T282 VanDerWaalsContact C-N 3.28Å; L280-T282 PolarHBondContact O-N 3.36Å; L280-I283 PolarHBondContact O-N 3Å; L280-R284 VanDerWaalsContact O-CB 3.28Å; L280-R284 WeakPolarHBondContact O-CB 3.4Å; L280-R284 PolarHBondContact O-N 2.93Å; L280-L314 HydrophobicContact CD1-CD1 4.01Å; L280-L314 HydrophobicContact CD1-CD2 4.34Å; L280-L314 HydrophobicContact CD1-CG 3.92Å; L280-L314 HydrophobicContact CG-CG 4.32Å; L280-V316 HydrophobicContact CB-CG2 4.5Å; L280-V316 HydrophobicContact CD2-CG2 3.59Å; L280-T653 HydrophobicContact CD2-CG2 4.05Å; L280-L680 HydrophobicContact CD1-CD2 4.31Å; L280-P684 HydrophobicContact CD1-CG 4.08Å
281P93.3Very high92.1Very high61 Ų6153 Ų5340%0.39627%0.265SS..Hα-helixtrans-59.7-38.4174.4-24.235000113I277 E279 Q285I277-P281 WeakPolarHBondContact O-CD 3.31Å; E279-P281 VanDerWaalsContact C-CD 3.43Å; P281-Q285 WeakPolarHBondContact O-CB 3.41Å; P281-Q285 PolarHBondContact O-N 2.81Å
282T93.4Very high92.2Very high67 Ų6752.4 Ų52.441%0.41127%0.266SS..Hα-helixtrans-72.3-42.4178.3-55.60000111E279 L280 R284 Q285 R286E279-T282 WeakPolarHBondContact O-CA 3.39Å; E279-T282 WeakPolarHBondContact O-CB 3.49Å; E279-T282 PolarHBondContact O-N 3.31Å; L280-T282 VanDerWaalsContact C-N 3.28Å; L280-T282 PolarHBondContact O-N 3.36Å; T282-R284 VanDerWaalsContact C-N 3.35Å; T282-Q285 PolarHBondContact O-N 3.35Å; T282-R286 WeakPolarHBondContact O-CB 3.47Å; T282-R286 WeakPolarHBondContact O-CG 3.33Å; T282-R286 PolarHBondContact O-N 3.19Å
283I92.6Very high92.1Very high15 Ų1557.5 Ų57.58%0.07730%0.297CS..Hα-helixtrans-60.2-47.5174.7-64.1169.2000109.7E279 L280 Q285 R286 L287 A679 L680E279-I283 HydrophobicContact CB-CD1 4.16Å; E279-I283 WeakPolarHBondContact O-CG1 3.35Å; E279-I283 PolarHBondContact O-N 3.26Å; L280-I283 PolarHBondContact O-N 3Å; I283-Q285 PolarHBondContact O-N 3.07Å; I283-R286 PolarHBondContact O-N 3.29Å; I283-L287 WeakPolarHBondContact O-CB 3.43Å; I283-L287 PolarHBondContact O-N 3Å; I283-A679 HydrophobicContact CD1-CB 3.92Å; I283-A679 HydrophobicContact CG1-CB 4.14Å; I283-L680 HydrophobicContact CG2-CD2 3.77Å; I283-L680 HydrophobicContact CG2-CG 3.94Å
284R94.1Very high91.8Very high55 Ų5559.3 Ų59.321%0.20832%0.316CS..Hα-helixtrans-56.8-52.1177-178.4-174.867.6-152.30.8111.2L280 T282 R286 L287 T288 A310 L314L280-R284 VanDerWaalsContact O-CB 3.28Å; L280-R284 WeakPolarHBondContact O-CB 3.4Å; L280-R284 PolarHBondContact O-N 2.93Å; T282-R284 VanDerWaalsContact C-N 3.35Å; R284-R286 PolarHBondContact O-N 3.42Å; R284-L287 PolarHBondContact O-N 3.33Å; R284-T288 HydrophobicContact CG-CG2 4.49Å; R284-T288 WeakPolarHBondContact O-CG2 3.47Å; R284-T288 PolarHBondContact O-N 3.42Å; R284-T288 PolarHBondContact O-OG1 3.48Å; R284-T288 VanDerWaalsContact O-OG1 3.06Å; R284-A310 WeakPolarHBondContact CD-O 3.46Å; R284-L314 HydrophobicContact CB-CD2 4.08Å; R284-L314 WeakPolarHBondContact CD-O 3.4Å; R284-L314 HydrophobicContact CG-CB 4.43Å; R284-L314 HydrophobicContact CG-CD2 4.38Å
285Q94Very high91.7Very high95 Ų9556.2 Ų56.244%0.44430%0.304SS..Hα-helixtrans-60.3-47.9-178-175.261.239.400111.8P281 T282 I283 L287 T288 D289P281-Q285 WeakPolarHBondContact O-CB 3.41Å; P281-Q285 PolarHBondContact O-N 2.81Å; T282-Q285 PolarHBondContact O-N 3.35Å; I283-Q285 PolarHBondContact O-N 3.07Å; Q285-L287 VanDerWaalsContact C-N 3.33Å; Q285-L287 PolarHBondContact O-N 3.27Å; Q285-T288 WeakPolarHBondContact CA-OG1 3.15Å; Q285-T288 PolarHBondContact O-N 3.15Å; Q285-T288 PolarHBondContact O-OG1 3.07Å; Q285-D289 PolarHBondContact NE2-OD1 3.45Å; Q285-D289 PolarHBondContact NE2-OD2 3.28Å; Q285-D289 VanDerWaalsContact NE2-OD2 3.12Å; Q285-D289 WeakPolarHBondContact O-CB 3.26Å; Q285-D289 PolarHBondContact O-N 3.16Å
286R93.4Very high91.5Very high152 Ų15254 Ų5457%0.57430%0.298SS*.Hα-helixtrans-63.9-40.1178.8-70.4176.7177.2173.21111.9T282 I283 R284 D289 T290T282-R286 WeakPolarHBondContact O-CB 3.47Å; T282-R286 WeakPolarHBondContact O-CG 3.33Å; T282-R286 PolarHBondContact O-N 3.19Å; I283-R286 PolarHBondContact O-N 3.29Å; R284-R286 PolarHBondContact O-N 3.42Å; R286-D289 PolarHBondContact O-N 3.29Å; R286-T290 WeakPolarHBondContact O-CB 3.39Å; R286-T290 PolarHBondContact O-N 3.31Å; R286-T290 PolarHBondContact O-OG1 2.94Å
287L94.1Very high91.2Very high0 Ų061 Ų610%033%0.333CS..Hα-helixtrans-62-47.8176.3179.564.6000111.1I283 R284 Q285 D289 T290 L291 A310 L314 F661 L665 L673 H676 L680I283-L287 WeakPolarHBondContact O-CB 3.43Å; I283-L287 PolarHBondContact O-N 3Å; R284-L287 PolarHBondContact O-N 3.33Å; Q285-L287 VanDerWaalsContact C-N 3.33Å; Q285-L287 PolarHBondContact O-N 3.27Å; L287-D289 PolarHBondContact O-N 2.87Å; L287-T290 PolarHBondContact O-N 3.29Å; L287-L291 HydrophobicContact CD1-CD1 4.14Å; L287-L291 HydrophobicContact CD1-CG 4.35Å; L287-L291 HydrophobicContact CG-CD1 3.99Å; L287-L291 WeakPolarHBondContact O-CB 3.38Å; L287-L291 VanDerWaalsContact O-CG 3.27Å; L287-L291 WeakPolarHBondContact O-CG 3.16Å; L287-L291 PolarHBondContact O-N 2.88Å; L287-A310 HydrophobicContact CD2-CB 4.04Å; L287-L314 HydrophobicContact CD2-CD2 4.11Å; L287-F661 HydrophobicContact CD2-CE1 4.15Å; L287-F661 HydrophobicContact CD2-CZ 3.99Å; L287-L665 HydrophobicContact CD1-CD1 4.12Å; L287-L665 HydrophobicContact CD1-CD2 3.94Å; L287-L665 HydrophobicContact CD2-CD1 4.01Å; L287-L673 HydrophobicContact CD1-CD2 3.67Å; L287-H676 HydrophobicContact CD1-CB 4.08Å; L287-L680 HydrophobicContact CD2-CD1 4.15Å
288T94.2Very high91.2Very high11 Ų1164.8 Ų64.87%0.06735%0.354CS..Hα-helixtrans-64.3-40.4178.950.40000111.9R284 Q285 L291 N292 M307 A310 N311R284-T288 HydrophobicContact CG-CG2 4.49Å; R284-T288 WeakPolarHBondContact O-CG2 3.47Å; R284-T288 PolarHBondContact O-N 3.42Å; R284-T288 PolarHBondContact O-OG1 3.48Å; R284-T288 VanDerWaalsContact O-OG1 3.06Å; Q285-T288 WeakPolarHBondContact CA-OG1 3.15Å; Q285-T288 PolarHBondContact O-N 3.15Å; Q285-T288 PolarHBondContact O-OG1 3.07Å; T288-L291 PolarHBondContact O-N 3.31Å; T288-N292 VanDerWaalsContact O-CB 3.31Å; T288-N292 WeakPolarHBondContact O-CB 3.22Å; T288-N292 PolarHBondContact O-N 2.97Å; T288-M307 HydrophobicContact CG2-CG 4.06Å; T288-A310 HydrophobicContact CG2-CB 4.13Å; T288-N311 HydrophobicContact CG2-CB 4.22Å
289D93.5Very high91.2Very high73 Ų7363.2 Ų63.239%0.3934%0.338SS..Hα-helixtrans-65.2-42178.6-67.4-21000111.5Q285 R286 L287 N292 T293Q285-D289 PolarHBondContact NE2-OD1 3.45Å; Q285-D289 PolarHBondContact NE2-OD2 3.28Å; Q285-D289 VanDerWaalsContact NE2-OD2 3.12Å; Q285-D289 WeakPolarHBondContact O-CB 3.26Å; Q285-D289 PolarHBondContact O-N 3.16Å; R286-D289 PolarHBondContact O-N 3.29Å; L287-D289 PolarHBondContact O-N 2.87Å; D289-N292 PolarHBondContact O-N 3.27Å; D289-T293 PolarHBondContact O-N 3.28Å; D289-T293 PolarHBondContact O-OG1 3.46Å
290T93Very high91.1Very high25 Ų2563.8 Ų63.815%0.15334%0.342CS..Hα-helixtrans-67.4-40.3176.5-63.20000112R286 L287 N292 G294 L673 H676R286-T290 WeakPolarHBondContact O-CB 3.39Å; R286-T290 PolarHBondContact O-N 3.31Å; R286-T290 PolarHBondContact O-OG1 2.94Å; L287-T290 PolarHBondContact O-N 3.29Å; T290-N292 VanDerWaalsContact C-N 3.31Å; T290-N292 PolarHBondContact O-N 3.45Å; T290-G294 WeakPolarHBondContact O-CA 3.46Å; T290-G294 PolarHBondContact O-N 2.98Å; T290-L673 HydrophobicContact CG2-CD2 3.7Å; T290-L673 HydrophobicContact CG2-CG 4.25Å; T290-H676 PolarHBondContact OG1-NE2 2.89Å
291L92.2Very high91Very high4 Ų469.6 Ų69.62%0.02137%0.372CS..Hα-helixtrans-66.4-34175.5-72.3171.3000112.1L287 T288 C295 C303 L306 M307 L665 L668 L673L287-L291 HydrophobicContact CD1-CD1 4.14Å; L287-L291 HydrophobicContact CD1-CG 4.35Å; L287-L291 HydrophobicContact CG-CD1 3.99Å; L287-L291 WeakPolarHBondContact O-CB 3.38Å; L287-L291 VanDerWaalsContact O-CG 3.27Å; L287-L291 WeakPolarHBondContact O-CG 3.16Å; L287-L291 PolarHBondContact O-N 2.88Å; T288-L291 PolarHBondContact O-N 3.31Å; L291-C295 WeakPolarHBondContact O-CB 3.24Å; L291-C303 HydrophobicContact CD2-CB 4.26Å; L291-L306 HydrophobicContact CD1-CB 4.22Å; L291-M307 HydrophobicContact CB-CB 4.04Å; L291-M307 HydrophobicContact CB-CG 4.44Å; L291-M307 HydrophobicContact CD1-CB 4.01Å; L291-L665 HydrophobicContact CD1-CD2 4.18Å; L291-L665 HydrophobicContact CD2-CD2 4.25Å; L291-L668 HydrophobicContact CD2-CD1 3.6Å; L291-L673 HydrophobicContact CD2-CD1 3.99Å; L291-L673 HydrophobicContact CD2-CD2 4Å; L291-L673 HydrophobicContact CG-CD2 4.19Å
292N90.2Very high91Very high116 Ų11669.7 Ų69.762%0.6237%0.367SS*.Hα-helixtrans-74.4-42.9178.8-171.135.2000112.6T288 D289 T290 M307T288-N292 VanDerWaalsContact O-CB 3.31Å; T288-N292 WeakPolarHBondContact O-CB 3.22Å; T288-N292 PolarHBondContact O-N 2.97Å; D289-N292 PolarHBondContact O-N 3.27Å; T290-N292 VanDerWaalsContact C-N 3.31Å; T290-N292 PolarHBondContact O-N 3.45Å; N292-M307 HydrophobicContact CB-SD 3.84Å
293T88.7Confident91Very high120 Ų12066.6 Ų66.674%0.73635%0.348SS*.Hα-helixtrans-96.8-28.7-171.357.70000114.3D289D289-T293 PolarHBondContact O-N 3.28Å; D289-T293 PolarHBondContact O-OG1 3.46Å
294G84.4Confident91.1Very high38 Ų3873.4 Ų73.439%0.39237%0.373SS..SBendtrans-104.1-0.8-17000000115.3T290 M670T290-G294 WeakPolarHBondContact O-CA 3.46Å; T290-G294 PolarHBondContact O-N 2.98Å; G294-M670 VanDerWaalsContact C-CE 3.48Å; G294-M670 WeakPolarHBondContact O-CE 3.41Å
295C88.5Confident91Very high24 Ų2475.5 Ų75.516%0.16239%0.385CS..  trans-74.1130.4-171.4-1700000112.4L291 C303L291-C295 WeakPolarHBondContact O-CB 3.24Å; C295-C303 HydrophobicContact CB-CB 3.61Å; C295-C303 WeakPolarHBondContact CB-SG 3.23Å; C295-C303 WeakPolarHBondContact SG-CB 3.43Å; C295-C303 CovalentContact SG-SG 2.02Å; C295-C303 PolarHBondContact SG-SG 2.88Å
296P86.9Confident91.1Very high49 Ų4971 Ų7132%0.31836%0.364SS..  trans-70.3148.6174.332.4-36.1000110.8D298 K299 I300P296-D298 WeakPolarHBondContact CB-OD1 3.29Å; P296-D298 PolarHBondContact O-N 2.9Å; P296-D298 VanDerWaalsContact O-N 3.16Å; P296-K299 HydrophobicContact CG-CB 4.26Å; P296-K299 HydrophobicContact CG-CG 4.33Å; P296-K299 PolarHBondContact O-N 3.49Å; P296-I300 PolarHBondContact O-N 2.91Å
297I85.2Confident91.1Very high154 Ų15465.8 Ų65.879%0.7935%0.347SS*.G310 helixtrans-58.2-34.9-170.2-62.6173.7000111.9K299 I300I297-K299 PolarHBondContact O-N 3.18Å; I297-I300 WeakPolarHBondContact O-CG2 3.06Å; I297-I300 PolarHBondContact O-N 3.38Å
298D89.4Confident91.1Very high131 Ų13170.1 Ų70.170%0.70137%0.367SS*.G310 helixtrans-68.3-18.8179.763.2-55.4000113.9P296P296-D298 WeakPolarHBondContact CB-OD1 3.29Å; P296-D298 PolarHBondContact O-N 2.9Å; P296-D298 VanDerWaalsContact O-N 3.16Å
299K90.2Very high91Very high46 Ų4671.5 Ų71.520%0.237%0.374CS..G310 helixtrans-115.211.1-179.4-57.3-158.4178.3176.70114.4P296 I297 I301 E302 C303 A667 L668P296-K299 HydrophobicContact CG-CB 4.26Å; P296-K299 HydrophobicContact CG-CG 4.33Å; P296-K299 PolarHBondContact O-N 3.49Å; I297-K299 PolarHBondContact O-N 3.18Å; K299-I301 VanDerWaalsContact C-N 3.25Å; K299-I301 PolarHBondContact O-N 3.09Å; K299-I301 VanDerWaalsContact O-N 3.16Å; K299-E302 PolarHBondContact O-N 3.39Å; K299-E302 VanDerWaalsContact O-N 3.1Å; K299-C303 PolarHBondContact O-N 3.27Å; K299-A667 PolarHBondContact NZ-O 3.49Å; K299-L668 HydrophobicContact CB-CD2 4.01Å; K299-L668 HydrophobicContact CD-CB 4.39Å; K299-L668 HydrophobicContact CD-CD2 3.8Å; K299-L668 PolarHBondContact NZ-O 3.31Å
300I90.2Very high91.1Very high100 Ų10068 Ų6851%0.51336%0.355SS..Hα-helixtrans-59.5-33.4-170.5-158.9158.5000113.9P296 I297 R304P296-I300 PolarHBondContact O-N 2.91Å; I297-I300 WeakPolarHBondContact O-CG2 3.06Å; I297-I300 PolarHBondContact O-N 3.38Å; I300-R304 WeakPolarHBondContact O-CB 3.45Å; I300-R304 PolarHBondContact O-N 3.46Å
301I90.5Very high91.1Very high125 Ų12570.6 Ų70.664%0.64137%0.368SS*.Hα-helixtrans-65.6-50.9177.2-59.9174.8000109.9K299 C303 R304 E305K299-I301 VanDerWaalsContact C-N 3.25Å; K299-I301 PolarHBondContact O-N 3.09Å; K299-I301 VanDerWaalsContact O-N 3.16Å; I301-C303 PolarHBondContact O-N 2.94Å; I301-R304 PolarHBondContact O-N 2.88Å; I301-E305 PolarHBondContact O-N 3.17Å
302E92.3Very high91.1Very high63 Ų6375 Ų7529%0.29439%0.391SS..Hα-helixtrans-67.4-37.8-178.4-170.7165.8-158.100111.9K299 R304 E305 L306 R664 L668K299-E302 PolarHBondContact O-N 3.39Å; K299-E302 VanDerWaalsContact O-N 3.1Å; E302-R304 VanDerWaalsContact C-N 3.31Å; E302-R304 PolarHBondContact O-N 3.46Å; E302-E305 PolarHBondContact O-N 3.38Å; E302-L306 HydrophobicContact CG-CD1 3.93Å; E302-L306 HydrophobicContact CG-CG 4.42Å; E302-L306 WeakPolarHBondContact O-CB 3.18Å; E302-L306 WeakPolarHBondContact O-CG 3.45Å; E302-L306 PolarHBondContact O-N 3.4Å; E302-R664 IonicContact OE1-NE 2.72Å; E302-L668 HydrophobicContact CB-CD2 4.11Å; E302-L668 HydrophobicContact CG-CD2 3.96Å
303C94Very high91.3Very high2 Ų273.2 Ų73.21%0.01438%0.379CS..Hα-helixtrans-59.5-42.2171.6-72.30000112.2L291 C295 K299 I301 L306 M307L291-C303 HydrophobicContact CD2-CB 4.26Å; C295-C303 HydrophobicContact CB-CB 3.61Å; C295-C303 WeakPolarHBondContact CB-SG 3.23Å; C295-C303 WeakPolarHBondContact SG-CB 3.43Å; C295-C303 CovalentContact SG-SG 2.02Å; C295-C303 PolarHBondContact SG-SG 2.88Å; K299-C303 PolarHBondContact O-N 3.27Å; I301-C303 PolarHBondContact O-N 2.94Å; C303-L306 PolarHBondContact O-N 2.95Å; C303-M307 WeakPolarHBondContact O-CB 3.26Å; C303-M307 PolarHBondContact O-N 2.96Å
304R93.3Very high91.5Very high159 Ų15967.5 Ų67.560%0.634%0.344SS*.Hα-helixtrans-65.7-45.1178.7-176.9177.6174.8173.81.4111.5I300 I301 E302 M307 E308I300-R304 WeakPolarHBondContact O-CB 3.45Å; I300-R304 PolarHBondContact O-N 3.46Å; I301-R304 PolarHBondContact O-N 2.88Å; E302-R304 VanDerWaalsContact C-N 3.31Å; E302-R304 PolarHBondContact O-N 3.46Å; R304-M307 HydrophobicContact CG-CE 4.4Å; R304-M307 PolarHBondContact O-N 3.03Å; R304-E308 IonicContact CZ-OE1 2.84Å; R304-E308 IonicContact NE-OE1 2.94Å; R304-E308 PolarHBondContact NE-OE1 3.42Å; R304-E308 IonicContact NH2-OE1 2.75Å; R304-E308 WeakPolarHBondContact O-CB 3.24Å; R304-E308 WeakPolarHBondContact O-CG 3.21Å; R304-E308 PolarHBondContact O-N 3.33Å
305E93.9Very high91.9Very high98 Ų9869.4 Ų69.446%0.45834%0.342SS..Hα-helixtrans-59.7-47.9175.4-72.9-178.3-174.700111.9I301 E302 M307 E308 L309 R664I301-E305 PolarHBondContact O-N 3.17Å; E302-E305 PolarHBondContact O-N 3.38Å; E305-M307 VanDerWaalsContact C-N 3.3Å; E305-M307 PolarHBondContact O-N 3.18Å; E305-E308 PolarHBondContact O-N 2.94Å; E305-L309 VanDerWaalsContact O-CB 3.28Å; E305-L309 WeakPolarHBondContact O-CB 3.45Å; E305-L309 PolarHBondContact O-N 3.21Å; E305-R664 IonicContact OE2-NH2 3.55Å; E305-R664 PolarHBondContact OE2-NH2 3.3Å
306L94.4Very high91.9Very high0 Ų070.1 Ų70.10%035%0.346CS..Hα-helixtrans-67.1-33179.6-70.9170.2000112L291 E302 C303 A310 F661 R664 L665 L668L291-L306 HydrophobicContact CD1-CB 4.22Å; E302-L306 HydrophobicContact CG-CD1 3.93Å; E302-L306 HydrophobicContact CG-CG 4.42Å; E302-L306 WeakPolarHBondContact O-CB 3.18Å; E302-L306 WeakPolarHBondContact O-CG 3.45Å; E302-L306 PolarHBondContact O-N 3.4Å; C303-L306 PolarHBondContact O-N 2.95Å; L306-A310 WeakPolarHBondContact O-CB 3.44Å; L306-A310 PolarHBondContact O-N 2.8Å; L306-F661 HydrophobicContact CB-CE2 4.49Å; L306-F661 HydrophobicContact CD2-CD2 3.83Å; L306-F661 HydrophobicContact CD2-CE2 3.73Å; L306-R664 HydrophobicContact CD1-CB 4.08Å; L306-R664 HydrophobicContact CD2-CB 3.78Å; L306-L665 HydrophobicContact CB-CD2 4.29Å; L306-L665 HydrophobicContact CD1-CD2 4.06Å; L306-L668 HydrophobicContact CD1-CD1 3.87Å; L306-L668 HydrophobicContact CD1-CD2 4.49Å; L306-L668 HydrophobicContact CD1-CG 4.2Å
307M94Very high92Very high44 Ų4472.9 Ų72.922%0.21735%0.35CS..Hα-helixtrans-67.4-47174.1-179.2-172.370.500111.3T288 L291 N292 C303 R304 E305 A310 N311T288-M307 HydrophobicContact CG2-CG 4.06Å; L291-M307 HydrophobicContact CB-CB 4.04Å; L291-M307 HydrophobicContact CB-CG 4.44Å; L291-M307 HydrophobicContact CD1-CB 4.01Å; N292-M307 HydrophobicContact CB-SD 3.84Å; C303-M307 WeakPolarHBondContact O-CB 3.26Å; C303-M307 PolarHBondContact O-N 2.96Å; R304-M307 HydrophobicContact CG-CE 4.4Å; R304-M307 PolarHBondContact O-N 3.03Å; E305-M307 VanDerWaalsContact C-N 3.3Å; E305-M307 PolarHBondContact O-N 3.18Å; M307-A310 PolarHBondContact O-N 3.3Å; M307-N311 VanDerWaalsContact O-CB 3.31Å; M307-N311 WeakPolarHBondContact O-CB 3.47Å; M307-N311 PolarHBondContact O-N 2.74Å
308E93.7Very high91.8Very high91 Ų9165.8 Ų65.843%0.42531%0.313SS..Hα-helixtrans-61.5-47175.9-74.8176.9-170.900110.2R304 E305 A310 N311 D312R304-E308 IonicContact CZ-OE1 2.84Å; R304-E308 IonicContact NE-OE1 2.94Å; R304-E308 PolarHBondContact NE-OE1 3.42Å; R304-E308 IonicContact NH2-OE1 2.75Å; R304-E308 WeakPolarHBondContact O-CB 3.24Å; R304-E308 WeakPolarHBondContact O-CG 3.21Å; R304-E308 PolarHBondContact O-N 3.33Å; E305-E308 PolarHBondContact O-N 2.94Å; E308-A310 PolarHBondContact O-N 2.89Å; E308-N311 PolarHBondContact O-N 3.49Å; E308-D312 WeakPolarHBondContact O-CB 3.44Å; E308-D312 PolarHBondContact O-N 2.91Å
309L93.4Very high91.3Very high40 Ų4062.7 Ų62.721%0.20930%0.3CS..Hα-helixtrans-59.2-44.6175.8-176.563.3000112.1E305 Q313 I655 F661E305-L309 VanDerWaalsContact O-CB 3.28Å; E305-L309 WeakPolarHBondContact O-CB 3.45Å; E305-L309 PolarHBondContact O-N 3.21Å; L309-Q313 HydrophobicContact CD1-CB 4.15Å; L309-Q313 VanDerWaalsContact CD1-CD 3.45Å; L309-Q313 HydrophobicContact CD1-CG 4.02Å; L309-Q313 WeakPolarHBondContact O-CA 3.37Å; L309-Q313 WeakPolarHBondContact O-CB 3.47Å; L309-Q313 PolarHBondContact O-N 2.78Å; L309-I655 HydrophobicContact CD1-CG1 4.42Å; L309-I655 HydrophobicContact CG-CD1 4.18Å; L309-I655 HydrophobicContact CG-CG1 4.41Å; L309-F661 HydrophobicContact CD2-CD2 3.62Å; L309-F661 HydrophobicContact CD2-CE2 3.94Å; L309-F661 HydrophobicContact CG-CD2 4.32Å; L309-F661 HydrophobicContact CG-CE2 4.25Å
310A93.9Very high90.6Very high0 Ų062.3 Ų62.30%030%0.303CS..Hα-helixtrans-62.4-47.7176.300000111.4R284 L287 T288 L306 M307 E308 D312 L314 F661R284-A310 WeakPolarHBondContact CD-O 3.46Å; L287-A310 HydrophobicContact CD2-CB 4.04Å; T288-A310 HydrophobicContact CG2-CB 4.13Å; L306-A310 WeakPolarHBondContact O-CB 3.44Å; L306-A310 PolarHBondContact O-N 2.8Å; M307-A310 PolarHBondContact O-N 3.3Å; E308-A310 PolarHBondContact O-N 2.89Å; A310-D312 VanDerWaalsContact C-N 3.32Å; A310-D312 PolarHBondContact O-N 3.27Å; A310-L314 HydrophobicContact CB-CB 4.42Å; A310-L314 HydrophobicContact CB-CD2 4.45Å; A310-L314 WeakPolarHBondContact O-CA 3.2Å; A310-L314 WeakPolarHBondContact O-CB 3.49Å; A310-L314 PolarHBondContact O-N 2.94Å; A310-F661 HydrophobicContact CB-CZ 3.95Å
311N93.4Very high90.1Very high78 Ų7863.5 Ų63.542%0.41731%0.31SS..Hα-helixtrans-63.6-40.5-177.5-170.855.2000112.1T288 M307 E308 K315T288-N311 HydrophobicContact CG2-CB 4.22Å; M307-N311 VanDerWaalsContact O-CB 3.31Å; M307-N311 WeakPolarHBondContact O-CB 3.47Å; M307-N311 PolarHBondContact O-N 2.74Å; E308-N311 PolarHBondContact O-N 3.49Å; N311-K315 WeakPolarHBondContact O-CE 3.35Å; N311-K315 PolarHBondContact O-NZ 2.85Å
312D93.1Very high89.6Confident96 Ų9659 Ų5951%0.51329%0.289SS..Hα-helixtrans-81.8-45.7-175.4-72-6.8000112E308 A310 K315E308-D312 WeakPolarHBondContact O-CB 3.44Å; E308-D312 PolarHBondContact O-N 2.91Å; A310-D312 VanDerWaalsContact C-N 3.32Å; A310-D312 PolarHBondContact O-N 3.27Å; D312-K315 WeakPolarHBondContact O-CD 3.32Å; D312-K315 WeakPolarHBondContact O-CE 3.35Å; D312-K315 PolarHBondContact O-NZ 3.11Å
313Q94Very high89.1Confident79 Ų7956.3 Ų56.337%0.36928%0.276SS..Hα-helixtrans-114.2-16.2-165.2-58.5-17115.700115.4L309 K315 F654 I655L309-Q313 HydrophobicContact CD1-CB 4.15Å; L309-Q313 VanDerWaalsContact CD1-CD 3.45Å; L309-Q313 HydrophobicContact CD1-CG 4.02Å; L309-Q313 WeakPolarHBondContact O-CA 3.37Å; L309-Q313 WeakPolarHBondContact O-CB 3.47Å; L309-Q313 PolarHBondContact O-N 2.78Å; Q313-K315 PolarHBondContact O-N 3.43Å; Q313-F654 HydrophobicContact CB-CB 3.89Å; Q313-F654 HydrophobicContact CG-CB 4.31Å; Q313-F654 WeakPolarHBondContact O-CB 3.28Å; Q313-F654 PolarHBondContact O-N 3.1Å; Q313-F654 PolarHBondContact OE1-O 2.81Å; Q313-I655 HydrophobicContact CB-CD1 4.39Å; Q313-I655 HydrophobicContact CB-CG1 3.55Å
314L93.3Very high88.5Confident0 Ų058.4 Ų58.40%029%0.285CS..  trans-78.164.9175.4-166.668.9000110.7L280 R284 L287 A310 I655 L658 F661 L680L280-L314 HydrophobicContact CD1-CD1 4.01Å; L280-L314 HydrophobicContact CD1-CD2 4.34Å; L280-L314 HydrophobicContact CD1-CG 3.92Å; L280-L314 HydrophobicContact CG-CG 4.32Å; R284-L314 HydrophobicContact CB-CD2 4.08Å; R284-L314 WeakPolarHBondContact CD-O 3.4Å; R284-L314 HydrophobicContact CG-CB 4.43Å; R284-L314 HydrophobicContact CG-CD2 4.38Å; L287-L314 HydrophobicContact CD2-CD2 4.11Å; A310-L314 HydrophobicContact CB-CB 4.42Å; A310-L314 HydrophobicContact CB-CD2 4.45Å; A310-L314 WeakPolarHBondContact O-CA 3.2Å; A310-L314 WeakPolarHBondContact O-CB 3.49Å; A310-L314 PolarHBondContact O-N 2.94Å; L314-I655 HydrophobicContact CB-CD1 4.14Å; L314-I655 HydrophobicContact CD1-CD1 4.07Å; L314-L658 HydrophobicContact CD1-CD2 4.12Å; L314-F661 HydrophobicContact CD1-CE1 4.33Å; L314-F661 HydrophobicContact CD2-CE1 4.4Å; L314-L680 HydrophobicContact CD1-CD2 4.02Å; L314-L680 HydrophobicContact CD2-CD2 4Å
315K91.4Very high88.1Confident79 Ų7951.2 Ų51.234%0.34326%0.259SS..SBendtrans-132.1141.3178.8-72.4162-168152.60107.5N311 D312 Q313 R317 T653 F654N311-K315 WeakPolarHBondContact O-CE 3.35Å; N311-K315 PolarHBondContact O-NZ 2.85Å; D312-K315 WeakPolarHBondContact O-CD 3.32Å; D312-K315 WeakPolarHBondContact O-CE 3.35Å; D312-K315 PolarHBondContact O-NZ 3.11Å; Q313-K315 PolarHBondContact O-N 3.43Å; K315-R317 PolarHBondContact O-N 3.3Å; K315-T653 VanDerWaalsContact O-CA 3.23Å; K315-T653 WeakPolarHBondContact O-CA 3.47Å; K315-T653 WeakPolarHBondContact O-CB 3.2Å; K315-F654 HydrophobicContact CB-CD2 3.96Å; K315-F654 HydrophobicContact CB-CE2 4.13Å; K315-F654 PolarHBondContact O-N 3.43Å
316V89.7Confident87.7Confident39 Ų3954.7 Ų54.724%0.23628%0.275CS..BIsolated β-bridgetrans-63127.8174.1-177.70000108.7V276 I277 L280 V318 L652V276-V316 HydrophobicContact CG1-CG2 4.46Å; I277-V316 HydrophobicContact CG1-CB 4.25Å; I277-V316 HydrophobicContact CG1-CG1 3.92Å; I277-V316 HydrophobicContact CG1-CG2 3.89Å; L280-V316 HydrophobicContact CB-CG2 4.5Å; L280-V316 HydrophobicContact CD2-CG2 3.59Å; V316-V318 VanDerWaalsContact CG1-O 3.25Å; V316-V318 WeakPolarHBondContact CG1-O 3.2Å; V316-L652 WeakPolarHBondContact CA-O 3.29Å; V316-L652 HydrophobicContact CG1-CD1 4.32Å
317R89Confident87.3Confident107 Ų10758.7 Ų58.740%0.40429%0.294SS..  trans-88.9-27.4-177.3-174.8174.9-176.7170.21.5112.2K315 L652 F654 D656K315-R317 PolarHBondContact O-N 3.3Å; R317-L652 PolarHBondContact N-O 3.47Å; R317-F654 HydrophobicContact CB-CD2 4.36Å; R317-F654 HydrophobicContact CB-CE2 4.2Å; R317-F654 HydrophobicContact CB-CZ 4.29Å; R317-F654 HydrophobicContact CG-CD1 4.2Å; R317-F654 HydrophobicContact CG-CE1 3.89Å; R317-F654 HydrophobicContact CG-CE2 4.4Å; R317-F654 HydrophobicContact CG-CZ 4Å; R317-D656 IonicContact NH1-OD1 2.62Å; R317-D656 PolarHBondContact NH1-OD1 3.46Å
318V81.6Confident87Confident4 Ų456.6 Ų56.62%0.02428%0.283CS..SBendtrans-110.5121.4-173.4-164.10000110.7V316 F323 Q647 T650V316-V318 VanDerWaalsContact CG1-O 3.25Å; V316-V318 WeakPolarHBondContact CG1-O 3.2Å; V318-F323 HydrophobicContact CB-CE2 4.17Å; V318-F323 HydrophobicContact CB-CZ 4.12Å; V318-F323 HydrophobicContact CG1-CE1 4.35Å; V318-F323 HydrophobicContact CG1-CE2 3.54Å; V318-F323 HydrophobicContact CG1-CZ 3.47Å; V318-F323 VanDerWaalsContact CG1-CZ 3.47Å; V318-Q647 HydrophobicContact CG1-CB 4.06Å; V318-T650 WeakPolarHBondContact CG2-OG1 3.48Å
319P78.6Confident86.8Confident66 Ų6655.3 Ų55.343%0.42928%0.279SS..  trans-75.3142.7175.221.5-15.8000110.9N321 V322P319-N321 VanDerWaalsContact C-N 3.31Å; P319-N321 WeakPolarHBondContact CB-OD1 3.13Å; P319-N321 PolarHBondContact O-N 2.84Å; P319-V322 HydrophobicContact CB-CG2 4.37Å; P319-V322 HydrophobicContact CG-CG2 3.65Å; P319-V322 WeakPolarHBondContact O-CG2 3.3Å; P319-V322 PolarHBondContact O-N 2.75Å
320P75.4Confident86.6Confident38 Ų3856 Ų5625%0.24729%0.287CS..G310 helixtrans-68.5-28.9-167.525.2-32.7000113.3L273 I277 V322 F323L273-P320 HydrophobicContact CD2-CB 4.17Å; I277-P320 HydrophobicContact CD1-CB 3.76Å; I277-P320 HydrophobicContact CD1-CG 3.68Å; P320-V322 PolarHBondContact O-N 3.01Å; P320-F323 PolarHBondContact O-N 2.78Å
321N78.7Confident86.4Confident126 Ų12656.6 Ų56.667%0.67429%0.29SS*.G310 helixtrans-63.6-19.6178.962.3-24.7000113.7P319 F323P319-N321 VanDerWaalsContact C-N 3.31Å; P319-N321 WeakPolarHBondContact CB-OD1 3.13Å; P319-N321 PolarHBondContact O-N 2.84Å; N321-F323 VanDerWaalsContact C-N 3.31Å; N321-F323 PolarHBondContact O-N 3.35Å
322V80.3Confident86.4Confident31 Ų3153 Ų5319%0.18827%0.271CS..G310 helixtrans-76.5-19.1-175.8-166.50000113P319 P320 Q324 E643 Q647P319-V322 HydrophobicContact CB-CG2 4.37Å; P319-V322 HydrophobicContact CG-CG2 3.65Å; P319-V322 WeakPolarHBondContact O-CG2 3.3Å; P319-V322 PolarHBondContact O-N 2.75Å; P320-V322 PolarHBondContact O-N 3.01Å; V322-Q324 PolarHBondContact O-N 2.91Å; V322-E643 HydrophobicContact CG1-CG 3.7Å; V322-Q647 HydrophobicContact CB-CG 4.4Å; V322-Q647 HydrophobicContact CG1-CB 4.27Å; V322-Q647 HydrophobicContact CG1-CG 3.52Å
323F81.5Confident86.4Confident5 Ų551.5 Ų51.52%0.02226%0.263CS..G310 helixtrans-77.8-6.6179.5-65.2-69.1000114.1F269 L273 V318 P320 N321 I325 Q647 V648 F698F269-F323 HydrophobicContact CE1-CD1 4.28Å; F269-F323 HydrophobicContact CE1-CE1 4.09Å; F269-F323 HydrophobicContact CE1-CE2 4.35Å; F269-F323 HydrophobicContact CE1-CG 4.47Å; F269-F323 HydrophobicContact CE1-CZ 4.09Å; F269-F323 HydrophobicContact CZ-CE1 4.5Å; F269-F323 HydrophobicContact CZ-CZ 4.34Å; L273-F323 HydrophobicContact CD2-CD2 3.41Å; L273-F323 VanDerWaalsContact CD2-CD2 3.41Å; L273-F323 HydrophobicContact CD2-CE2 3.26Å; L273-F323 HydrophobicContact CD2-CZ 4.35Å; V318-F323 HydrophobicContact CB-CE2 4.17Å; V318-F323 HydrophobicContact CB-CZ 4.12Å; V318-F323 HydrophobicContact CG1-CE1 4.35Å; V318-F323 HydrophobicContact CG1-CE2 3.54Å; V318-F323 HydrophobicContact CG1-CZ 3.47Å; V318-F323 VanDerWaalsContact CG1-CZ 3.47Å; P320-F323 PolarHBondContact O-N 2.78Å; N321-F323 VanDerWaalsContact C-N 3.31Å; N321-F323 PolarHBondContact O-N 3.35Å; F323-I325 HydrophobicContact CB-CD1 3.86Å; F323-I325 HydrophobicContact CB-CG1 3.79Å; F323-I325 WeakPolarHBondContact O-CG1 2.78Å; F323-I325 PolarHBondContact O-N 2.88Å; F323-Q647 HydrophobicContact CE1-CB 4.43Å; F323-V648 HydrophobicContact CD1-CG2 3.6Å; F323-V648 HydrophobicContact CE1-CB 4.21Å; F323-V648 HydrophobicContact CE1-CG2 3.37Å; F323-F698 HydrophobicContact CD1-CE2 4.12Å
324Q82.6Confident86.3Confident46 Ų4650.2 Ų50.222%0.21526%0.257CS..  trans50.133.8174.7-63.1175.8-70.300114.1V322 E326 E327 V328V322-Q324 PolarHBondContact O-N 2.91Å; Q324-E326 VanDerWaalsContact C-N 3.28Å; Q324-E326 PolarHBondContact O-N 3.31Å; Q324-E327 HydrophobicContact CB-CB 4.34Å; Q324-E327 HydrophobicContact CB-CG 4.25Å; Q324-E327 PolarHBondContact NE2-OE1 2.83Å; Q324-E327 PolarHBondContact NE2-OE2 3.24Å; Q324-E327 VanDerWaalsContact NE2-OE2 3.08Å; Q324-E327 WeakPolarHBondContact O-CB 3.28Å; Q324-E327 PolarHBondContact O-N 3.01Å; Q324-V328 PolarHBondContact O-N 3.35Å; Q324-V328 VanDerWaalsContact O-N 3.16Å
325I84.5Confident86.3Confident8 Ų850.2 Ų50.24%0.04126%0.257CS..Hα-helixtrans-67.6-31.5-171.1-65.7-178000111.8I266 N270 F323 E327 V328 I329 F698I266-I325 HydrophobicContact CG2-CD1 4.12Å; I266-I325 HydrophobicContact CG2-CG1 4.11Å; I266-I325 HydrophobicContact CG2-CG2 3.91Å; N270-I325 HydrophobicContact CB-CD1 3.42Å; N270-I325 VanDerWaalsContact CB-CD1 3.42Å; N270-I325 HydrophobicContact CB-CG2 4.14Å; F323-I325 HydrophobicContact CB-CD1 3.86Å; F323-I325 HydrophobicContact CB-CG1 3.79Å; F323-I325 WeakPolarHBondContact O-CG1 2.78Å; F323-I325 PolarHBondContact O-N 2.88Å; I325-E327 VanDerWaalsContact C-N 3.27Å; I325-E327 PolarHBondContact O-N 3.27Å; I325-V328 PolarHBondContact O-N 3.33Å; I325-I329 HydrophobicContact CG2-CD1 3.84Å; I325-I329 HydrophobicContact CG2-CG1 4.31Å; I325-I329 WeakPolarHBondContact O-CG1 3.35Å; I325-I329 PolarHBondContact O-N 3.08Å; I325-F698 HydrophobicContact CG1-CZ 4.33Å
326E85Confident86.5Confident171 Ų17150.5 Ų50.580%0.79926%0.259SS*.Hα-helixtrans-60.7-36.9171.9-65.2-175.117300112.1Q324 S330Q324-E326 VanDerWaalsContact C-N 3.28Å; Q324-E326 PolarHBondContact O-N 3.31Å; E326-S330 VanDerWaalsContact O-CB 3.26Å; E326-S330 WeakPolarHBondContact O-CB 3.38Å; E326-S330 PolarHBondContact O-N 3.44Å
327E85.6Confident86.8Confident85 Ų8556.2 Ų56.240%0.39728%0.277SS..Hα-helixtrans-67.1-47175.3-60.2177.6-162.800110.4Q324 I325 I329 S330 I331Q324-E327 HydrophobicContact CB-CB 4.34Å; Q324-E327 HydrophobicContact CB-CG 4.25Å; Q324-E327 PolarHBondContact NE2-OE1 2.83Å; Q324-E327 PolarHBondContact NE2-OE2 3.24Å; Q324-E327 VanDerWaalsContact NE2-OE2 3.08Å; Q324-E327 WeakPolarHBondContact O-CB 3.28Å; Q324-E327 PolarHBondContact O-N 3.01Å; I325-E327 VanDerWaalsContact C-N 3.27Å; I325-E327 PolarHBondContact O-N 3.27Å; E327-I329 VanDerWaalsContact C-N 3.32Å; E327-I329 PolarHBondContact O-N 2.95Å; E327-S330 WeakPolarHBondContact O-CB 3.44Å; E327-S330 PolarHBondContact O-N 3.39Å; E327-S330 VanDerWaalsContact O-N 3.14Å; E327-I331 WeakPolarHBondContact O-CB 2.93Å; E327-I331 VanDerWaalsContact O-CD1 3.24Å; E327-I331 WeakPolarHBondContact O-CD1 3.2Å; E327-I331 VanDerWaalsContact O-CG1 3.23Å; E327-I331 WeakPolarHBondContact O-CG1 2.84Å; E327-I331 PolarHBondContact O-N 2.93Å
328V88.4Confident87.1Confident0 Ų053.8 Ų53.80%027%0.27CS..Hα-helixtrans-57.5-44.6177.1177.80000111.3I263 I266 Q324 I325 I331 S332 I641 F698 F701I263-V328 HydrophobicContact CD1-CG1 4.02Å; I266-V328 HydrophobicContact CD1-CG1 4.17Å; Q324-V328 PolarHBondContact O-N 3.35Å; Q324-V328 VanDerWaalsContact O-N 3.16Å; I325-V328 PolarHBondContact O-N 3.33Å; V328-I331 PolarHBondContact O-N 2.85Å; V328-S332 VanDerWaalsContact O-CB 3.29Å; V328-S332 WeakPolarHBondContact O-CB 3.21Å; V328-S332 PolarHBondContact O-N 2.61Å; V328-I641 HydrophobicContact CG2-CG2 4.49Å; V328-F698 HydrophobicContact CG2-CE1 4.35Å; V328-F701 HydrophobicContact CB-CE1 4.49Å; V328-F701 HydrophobicContact CB-CZ 4.34Å; V328-F701 HydrophobicContact CG1-CD2 4.43Å; V328-F701 HydrophobicContact CG1-CE1 4.42Å; V328-F701 HydrophobicContact CG1-CE2 4.07Å; V328-F701 HydrophobicContact CG1-CZ 4.04Å; V328-F701 HydrophobicContact CG2-CD1 4.4Å; V328-F701 HydrophobicContact CG2-CE1 3.98Å; V328-F701 HydrophobicContact CG2-CZ 4.33Å
329I88.5Confident87.7Confident64 Ų6455 Ų5533%0.32828%0.276SS..Hα-helixtrans-66.8-40.9177.1-67.1168.6000111I325 E327 I331 S332 N333I325-I329 HydrophobicContact CG2-CD1 3.84Å; I325-I329 HydrophobicContact CG2-CG1 4.31Å; I325-I329 WeakPolarHBondContact O-CG1 3.35Å; I325-I329 PolarHBondContact O-N 3.08Å; E327-I329 VanDerWaalsContact C-N 3.32Å; E327-I329 PolarHBondContact O-N 2.95Å; I329-I331 VanDerWaalsContact C-N 3.35Å; I329-I331 PolarHBondContact O-N 3.02Å; I329-S332 WeakPolarHBondContact O-CB 3.29Å; I329-S332 PolarHBondContact O-N 3.38Å; I329-N333 PolarHBondContact O-N 3.45Å; I329-N333 PolarHBondContact O-ND2 3.1Å; I329-N333 VanDerWaalsContact O-ND2 3.11Å
330S90.4Very high88.5Confident55 Ų5556.1 Ų56.139%0.38528%0.284SS..Hα-helixtrans-59.5-46.6176-179.10000111.4E326 E327 N333 Q334E326-S330 VanDerWaalsContact O-CB 3.26Å; E326-S330 WeakPolarHBondContact O-CB 3.38Å; E326-S330 PolarHBondContact O-N 3.44Å; E327-S330 WeakPolarHBondContact O-CB 3.44Å; E327-S330 PolarHBondContact O-N 3.39Å; E327-S330 VanDerWaalsContact O-N 3.14Å; S330-N333 PolarHBondContact O-N 3.46Å; S330-Q334 WeakPolarHBondContact O-CG 3.27Å; S330-Q334 PolarHBondContact O-N 3.31Å
331I90.2Very high89.5Confident12 Ų1255.4 Ų55.46%0.06228%0.277CS..Hα-helixtrans-66.7-42.2177.4-65153000110.7E327 V328 I329 N333 Q334 I335 L636 V639 F701E327-I331 WeakPolarHBondContact O-CB 2.93Å; E327-I331 VanDerWaalsContact O-CD1 3.24Å; E327-I331 WeakPolarHBondContact O-CD1 3.2Å; E327-I331 VanDerWaalsContact O-CG1 3.23Å; E327-I331 WeakPolarHBondContact O-CG1 2.84Å; E327-I331 PolarHBondContact O-N 2.93Å; V328-I331 PolarHBondContact O-N 2.85Å; I329-I331 VanDerWaalsContact C-N 3.35Å; I329-I331 PolarHBondContact O-N 3.02Å; I331-N333 VanDerWaalsContact C-N 3.28Å; I331-N333 PolarHBondContact O-N 2.99Å; I331-Q334 CarbonylContact O-C 3.59Å; I331-Q334 WeakPolarHBondContact O-CA 3.37Å; I331-Q334 WeakPolarHBondContact O-CB 3.2Å; I331-Q334 PolarHBondContact O-N 3.28Å; I331-I335 HydrophobicContact CG2-CD1 4.08Å; I331-I335 HydrophobicContact CG2-CG1 4.31Å; I331-I335 WeakPolarHBondContact O-CG1 3.44Å; I331-I335 PolarHBondContact O-N 3.33Å; I331-L636 HydrophobicContact CG2-CD2 3.7Å; I331-V639 HydrophobicContact CD1-CB 3.96Å; I331-V639 HydrophobicContact CD1-CG1 3.44Å; I331-V639 VanDerWaalsContact CD1-CG1 3.44Å; I331-V639 HydrophobicContact CD1-CG2 3.25Å; I331-V639 HydrophobicContact CG1-CG2 3.77Å; I331-V639 HydrophobicContact CG2-CG2 4.43Å; I331-F701 HydrophobicContact CB-CE2 4.47Å; I331-F701 HydrophobicContact CB-CZ 3.79Å; I331-F701 HydrophobicContact CD1-CE1 3.87Å; I331-F701 HydrophobicContact CD1-CZ 3.65Å; I331-F701 HydrophobicContact CG1-CZ 4.35Å; I331-F701 HydrophobicContact CG2-CE2 4Å; I331-F701 HydrophobicContact CG2-CZ 3.58Å
332S92.1Very high90.3Very high1 Ų149.4 Ų49.41%0.00725%0.246CC..Hα-helixtrans-54.2-46.6173.9179.90000111.5F256 P258 V328 I329 Q334 I335 Q336F256-S332 VanDerWaalsContact O-CB 3.27Å; F256-S332 WeakPolarHBondContact O-CB 3.13Å; F256-S332 PolarHBondContact O-OG 2.93Å; P258-S332 WeakPolarHBondContact CD-OG 3.48Å; V328-S332 VanDerWaalsContact O-CB 3.29Å; V328-S332 WeakPolarHBondContact O-CB 3.21Å; V328-S332 PolarHBondContact O-N 2.61Å; I329-S332 WeakPolarHBondContact O-CB 3.29Å; I329-S332 PolarHBondContact O-N 3.38Å; S332-Q334 VanDerWaalsContact C-N 3.32Å; S332-Q334 PolarHBondContact O-N 3.17Å; S332-I335 PolarHBondContact O-N 3.06Å; S332-Q336 PolarHBondContact O-N 3.1Å
333N93.2Very high91Very high66 Ų6651.1 Ų51.135%0.35325%0.253SS..Hα-helixtrans-65.7-33.5174.6-71.9-41.4000112.7P258 I329 S330 I331 Q336 R337P258-N333 WeakPolarHBondContact CG-OD1 3.22Å; I329-N333 PolarHBondContact O-N 3.45Å; I329-N333 PolarHBondContact O-ND2 3.1Å; I329-N333 VanDerWaalsContact O-ND2 3.11Å; S330-N333 PolarHBondContact O-N 3.46Å; I331-N333 VanDerWaalsContact C-N 3.28Å; I331-N333 PolarHBondContact O-N 2.99Å; N333-Q336 PolarHBondContact O-N 3.28Å; N333-R337 WeakPolarHBondContact O-CG 3.14Å; N333-R337 PolarHBondContact O-N 3.13Å; N333-R337 VanDerWaalsContact O-N 3.1Å
334Q93.2Very high91.6Very high51 Ų5155 Ų5524%0.23827%0.269CS..Hα-helixtrans-67.6-42.7172.8-72.6-1791900111.9S330 I331 S332 Q336 R337 H338 F635S330-Q334 WeakPolarHBondContact O-CG 3.27Å; S330-Q334 PolarHBondContact O-N 3.31Å; I331-Q334 CarbonylContact O-C 3.59Å; I331-Q334 WeakPolarHBondContact O-CA 3.37Å; I331-Q334 WeakPolarHBondContact O-CB 3.2Å; I331-Q334 PolarHBondContact O-N 3.28Å; S332-Q334 VanDerWaalsContact C-N 3.32Å; S332-Q334 PolarHBondContact O-N 3.17Å; Q334-Q336 VanDerWaalsContact C-N 3.28Å; Q334-Q336 PolarHBondContact O-N 3.45Å; Q334-R337 PolarHBondContact O-N 2.79Å; Q334-R337 VanDerWaalsContact O-N 3.17Å; Q334-H338 PolarHBondContact O-CD2 3.34Å; Q334-H338 PolarHBondContact O-N 3.45Å; Q334-F635 HydrophobicContact CB-CD2 3.85Å; Q334-F635 HydrophobicContact CB-CE1 4.44Å; Q334-F635 HydrophobicContact CB-CE2 3.39Å; Q334-F635 HydrophobicContact CB-CZ 3.74Å; Q334-F635 HydrophobicContact CG-CD2 4.5Å; Q334-F635 HydrophobicContact CG-CE2 4.47Å
335I93.3Very high92.2Very high1 Ų152.9 Ų52.91%0.00526%0.259CS..Hα-helixtrans-58.5-43.8173.9-64.2168.8000109.6A253 L257 I331 S332 R337 H338 L339 F635 L636A253-I335 HydrophobicContact CB-CG2 4.3Å; L257-I335 HydrophobicContact CD2-CB 4.39Å; L257-I335 HydrophobicContact CD2-CG2 3.7Å; L257-I335 HydrophobicContact CG-CG2 4.48Å; I331-I335 HydrophobicContact CG2-CD1 4.08Å; I331-I335 HydrophobicContact CG2-CG1 4.31Å; I331-I335 WeakPolarHBondContact O-CG1 3.44Å; I331-I335 PolarHBondContact O-N 3.33Å; S332-I335 PolarHBondContact O-N 3.06Å; I335-R337 VanDerWaalsContact C-N 3.35Å; I335-R337 PolarHBondContact O-N 2.99Å; I335-H338 CarbonylContact O-C 3.51Å; I335-H338 VanDerWaalsContact O-C 3.25Å; I335-H338 PolarHBondContact O-N 2.69Å; I335-L339 WeakPolarHBondContact O-CA 3.3Å; I335-L339 PolarHBondContact O-N 3.23Å; I335-F635 HydrophobicContact CG1-CE2 4.35Å; I335-L636 HydrophobicContact CD1-CD2 4.07Å; I335-L636 HydrophobicContact CG1-CD2 3.87Å
336Q95.5Very high92.7Very high84 Ų8455 Ų5539%0.39327%0.27SS..Hα-helixtrans-60.8-41.8176.9-178.260.463.500112.8L257 P258 S332 N333 Q334 H338 L339L257-Q336 HydrophobicContact CD2-CB 4.14Å; P258-Q336 HydrophobicContact CG-CB 3.83Å; P258-Q336 HydrophobicContact CG-CG 4.24Å; S332-Q336 PolarHBondContact O-N 3.1Å; N333-Q336 PolarHBondContact O-N 3.28Å; Q334-Q336 VanDerWaalsContact C-N 3.28Å; Q334-Q336 PolarHBondContact O-N 3.45Å; Q336-H338 VanDerWaalsContact C-N 3.28Å; Q336-H338 PolarHBondContact O-N 2.84Å; Q336-L339 WeakPolarHBondContact O-CB 3Å; Q336-L339 PolarHBondContact O-N 3.43Å
337R95Very high93.1Very high159 Ų15949.7 Ų49.760%0.625%0.245SC*.Hα-helixtrans-64.5-34.6176.5-75.4-169.7-68.1-92.69.7112.2N333 Q334 I335N333-R337 WeakPolarHBondContact O-CG 3.14Å; N333-R337 PolarHBondContact O-N 3.13Å; N333-R337 VanDerWaalsContact O-N 3.1Å; Q334-R337 PolarHBondContact O-N 2.79Å; Q334-R337 VanDerWaalsContact O-N 3.17Å; I335-R337 VanDerWaalsContact C-N 3.35Å; I335-R337 PolarHBondContact O-N 2.99Å
338H95.2Very high93.6Very high56 Ų5645.6 Ų45.626%0.25923%0.226SC..THydrogen-bonded Turntrans-10016.8178.7-69.7-80.9000113.5Q334 I335 Q336 P340 D341 V342 L633 F635Q334-H338 PolarHBondContact O-CD2 3.34Å; Q334-H338 PolarHBondContact O-N 3.45Å; I335-H338 CarbonylContact O-C 3.51Å; I335-H338 VanDerWaalsContact O-C 3.25Å; I335-H338 PolarHBondContact O-N 2.69Å; Q336-H338 VanDerWaalsContact C-N 3.28Å; Q336-H338 PolarHBondContact O-N 2.84Å; H338-P340 VanDerWaalsContact C-CD 3.41Å; H338-P340 VanDerWaalsContact C-N 3.3Å; H338-D341 IonicContact CG-OD2 2.81Å; H338-D341 IonicContact ND1-OD2 3.68Å; H338-D341 PolarHBondContact ND1-OD2 3.35Å; H338-D341 WeakPolarHBondContact O-CA 3.33Å; H338-D341 WeakPolarHBondContact O-CB 3.46Å; H338-D341 PolarHBondContact O-N 3.12Å; H338-V342 PolarHBondContact O-N 2.83Å; H338-L633 HydrophobicContact CB-CD2 3.59Å; H338-F635 HydrophobicContact CB-CE1 4.21Å; H338-F635 HydrophobicContact CB-CZ 4.43Å; H338-F635 AromaticContact CD2-CE1 3.51Å; H338-F635 AromaticContact CG-CE1 3.9Å
339L94.7Very high93.8Very high29 Ų2947.5 Ų47.515%0.15224%0.236CC..Hα-helixtrans-57.8-38.1178-17760000112.5R254 L257 I335 Q336 D341 V342 D343R254-L339 HydrophobicContact CG-CD1 4.37Å; L257-L339 HydrophobicContact CD1-CD1 3.99Å; L257-L339 HydrophobicContact CD1-CD2 4.09Å; L257-L339 HydrophobicContact CD2-CD1 4.26Å; L257-L339 HydrophobicContact CD2-CD2 4.41Å; I335-L339 WeakPolarHBondContact O-CA 3.3Å; I335-L339 PolarHBondContact O-N 3.23Å; Q336-L339 WeakPolarHBondContact O-CB 3Å; Q336-L339 PolarHBondContact O-N 3.43Å; L339-D341 PolarHBondContact O-N 3.47Å; L339-V342 HydrophobicContact CD1-CB 4.35Å; L339-V342 WeakPolarHBondContact O-CB 3.37Å; L339-V342 PolarHBondContact O-N 3.31Å; L339-V342 VanDerWaalsContact O-N 3.09Å; L339-D343 PolarHBondContact O-N 2.77Å
340P95.6Very high94.1Very high91 Ų9149.6 Ų49.659%0.59124%0.243SC*.Hα-helixtrans-57.5-35172.4-26.436.4000113.6H338 Y344H338-P340 VanDerWaalsContact C-CD 3.41Å; H338-P340 VanDerWaalsContact C-N 3.3Å; P340-Y344 VanDerWaalsContact O-CB 3.24Å; P340-Y344 WeakPolarHBondContact O-CB 3.35Å; P340-Y344 PolarHBondContact O-N 3.06Å
341D95.5Very high94.2Very high22 Ų2247.6 Ų47.612%0.11823%0.228CC..Hα-helixtrans-68.5-40.5175.8-69-58.2000111.1H338 L339 Y344 A629 R632 L633H338-D341 IonicContact CG-OD2 2.81Å; H338-D341 IonicContact ND1-OD2 3.68Å; H338-D341 PolarHBondContact ND1-OD2 3.35Å; H338-D341 WeakPolarHBondContact O-CA 3.33Å; H338-D341 WeakPolarHBondContact O-CB 3.46Å; H338-D341 PolarHBondContact O-N 3.12Å; L339-D341 PolarHBondContact O-N 3.47Å; D341-Y344 PolarHBondContact O-N 3.34Å; D341-A629 HydrophobicContact CB-CB 4.14Å; D341-R632 IonicContact OD1-CZ 2.75Å; D341-R632 IonicContact OD1-NE 3.14Å; D341-R632 PolarHBondContact OD1-NE 2.88Å; D341-R632 IonicContact OD1-NH2 2.56Å; D341-R632 PolarHBondContact OD1-NH2 3.2Å; D341-R632 IonicContact OD2-NE 2.66Å; D341-L633 HydrophobicContact CB-CD1 4.26Å; D341-L633 HydrophobicContact CB-CD2 4.48Å; D341-L633 HydrophobicContact CB-CG 4.29Å
342V95.4Very high94.3Very high1 Ų147.3 Ų47.31%0.00623%0.227CC..Hα-helixtrans-63.8-43.9175178.70000111F249 Q250 A253 H338 L339 L345 L633F249-V342 HydrophobicContact CE1-CG1 4.5Å; F249-V342 HydrophobicContact CE1-CG2 4.33Å; Q250-V342 HydrophobicContact CB-CG1 4.19Å; Q250-V342 HydrophobicContact CG-CG1 3.87Å; Q250-V342 PolarHBondContact NE2-O 3.34Å; A253-V342 HydrophobicContact CB-CG1 4.29Å; A253-V342 HydrophobicContact CB-CG2 4.49Å; H338-V342 PolarHBondContact O-N 2.83Å; L339-V342 HydrophobicContact CD1-CB 4.35Å; L339-V342 WeakPolarHBondContact O-CB 3.37Å; L339-V342 PolarHBondContact O-N 3.31Å; L339-V342 VanDerWaalsContact O-N 3.09Å; V342-L345 WeakPolarHBondContact O-CB 3.4Å; V342-L345 PolarHBondContact O-N 3.48Å; V342-L633 HydrophobicContact CG2-CD1 4.07Å; V342-L633 HydrophobicContact CG2-CD2 4.04Å
343D95.1Very high94.2Very high66 Ų6652.4 Ų52.435%0.35325%0.254SS..Hα-helixtrans-68.4-36.1179.5-70.9-18.7000112.1R254 L339 L345 N346R254-D343 IonicContact CZ-OD1 3.55Å; R254-D343 IonicContact NE-OD1 3.6Å; R254-D343 PolarHBondContact NE-OD1 2.96Å; R254-D343 IonicContact NH2-OD1 2.78Å; R254-D343 PolarHBondContact NH2-OD1 2.85Å; L339-D343 PolarHBondContact O-N 2.77Å; D343-L345 PolarHBondContact O-N 3.19Å; D343-N346 VanDerWaalsContact O-CB 3.31Å; D343-N346 WeakPolarHBondContact O-CB 3.15Å; D343-N346 PolarHBondContact O-N 3.48Å; D343-N346 VanDerWaalsContact O-N 3.12Å; D343-N346 PolarHBondContact O-ND2 3.18Å
344Y94.9Very high94.2Very high88 Ų8852.8 Ų52.835%0.34526%0.256SS..Hα-helixtrans-60.5-27178.4-174.2-89000112.6P340 D341 N346 E347 S625P340-Y344 VanDerWaalsContact O-CB 3.24Å; P340-Y344 WeakPolarHBondContact O-CB 3.35Å; P340-Y344 PolarHBondContact O-N 3.06Å; D341-Y344 PolarHBondContact O-N 3.34Å; Y344-N346 PolarHBondContact O-N 2.74Å; Y344-E347 HydrophobicContact CE1-CB 4.23Å; Y344-E347 HydrophobicContact CE2-CB 4.46Å; Y344-E347 HydrophobicContact CE2-CG 4.4Å; Y344-E347 WeakPolarHBondContact O-CB 3.21Å; Y344-E347 PolarHBondContact O-N 2.67Å; Y344-S625 WeakPolarHBondContact OH-CB 3.4Å; Y344-S625 PolarHBondContact OH-OG 3.22Å
345L95.1Very high94.1Very high0 Ų050.6 Ų50.60%025%0.246CC..THydrogen-bonded Turntrans-59-21.9177-58174.7000113.3I246 F249 Q250 V342 D343 E347 F348 C626 A629 F630I246-L345 HydrophobicContact CG2-CB 3.55Å; I246-L345 HydrophobicContact CG2-CD1 4.41Å; F249-L345 HydrophobicContact CD1-CD1 3.68Å; F249-L345 HydrophobicContact CE1-CD1 3.75Å; Q250-L345 HydrophobicContact CG-CD1 4.24Å; V342-L345 WeakPolarHBondContact O-CB 3.4Å; V342-L345 PolarHBondContact O-N 3.48Å; D343-L345 PolarHBondContact O-N 3.19Å; L345-E347 PolarHBondContact O-N 2.82Å; L345-F348 PolarHBondContact O-N 2.74Å; L345-C626 HydrophobicContact CD2-CB 3.97Å; L345-A629 HydrophobicContact CD2-CB 4.1Å; L345-F630 HydrophobicContact CD1-CE1 3.69Å; L345-F630 HydrophobicContact CD1-CE2 4.18Å; L345-F630 HydrophobicContact CD1-CZ 3.49Å; L345-F630 VanDerWaalsContact CD1-CZ 3.49Å; L345-F630 HydrophobicContact CD2-CD2 4.05Å; L345-F630 HydrophobicContact CD2-CE1 4.41Å; L345-F630 HydrophobicContact CD2-CE2 3.64Å; L345-F630 HydrophobicContact CD2-CZ 3.85Å; L345-F630 HydrophobicContact CG-CZ 4.31Å
346N94Very high94Very high53 Ų5351.1 Ų51.128%0.28325%0.251SS..THydrogen-bonded Turntrans-62.9-17.7172.1-71.4-29.9000113.4Q250 D343 Y344 F348 N349 K350Q250-N346 VanDerWaalsContact NE2-CG 3.3Å; Q250-N346 PolarHBondContact NE2-OD1 3.38Å; Q250-N346 PolarHBondContact OE1-OD1 3.33Å; Q250-N346 VanDerWaalsContact OE1-OD1 3.07Å; D343-N346 VanDerWaalsContact O-CB 3.31Å; D343-N346 WeakPolarHBondContact O-CB 3.15Å; D343-N346 PolarHBondContact O-N 3.48Å; D343-N346 VanDerWaalsContact O-N 3.12Å; D343-N346 PolarHBondContact O-ND2 3.18Å; Y344-N346 PolarHBondContact O-N 2.74Å; N346-F348 PolarHBondContact O-N 3.03Å; N346-N349 PolarHBondContact O-N 3.45Å; N346-N349 VanDerWaalsContact O-N 3.14Å; N346-K350 PolarHBondContact O-N 3.17Å; N346-K350 VanDerWaalsContact O-N 3.08Å
347E94.8Very high93.8Very high59 Ų5950.5 Ų50.528%0.27625%0.253SS..Hα-helixtrans-61.1-28.3179.1-161.261-154.700111.8Y344 L345 K350 T351 T622Y344-E347 HydrophobicContact CE1-CB 4.23Å; Y344-E347 HydrophobicContact CE2-CB 4.46Å; Y344-E347 HydrophobicContact CE2-CG 4.4Å; Y344-E347 WeakPolarHBondContact O-CB 3.21Å; Y344-E347 PolarHBondContact O-N 2.67Å; L345-E347 PolarHBondContact O-N 2.82Å; E347-K350 PolarHBondContact O-N 2.79Å; E347-K350 WeakPolarHBondContact OE2-CD 3.46Å; E347-K350 IonicContact OE2-NZ 3.37Å; E347-K350 PolarHBondContact OE2-NZ 3.31Å; E347-K350 VanDerWaalsContact OE2-NZ 3.1Å; E347-T351 WeakPolarHBondContact O-CB 3.35Å; E347-T351 PolarHBondContact O-N 3.41Å; E347-T351 PolarHBondContact O-OG1 3.28Å; E347-T622 HydrophobicContact CB-CG2 4.22Å; E347-T622 HydrophobicContact CG-CG2 4.22Å
348F94.7Very high93.5Very high0 Ų045.7 Ų45.70%024%0.239CC..Hα-helixtrans-59.1-51.5172.2-174.9-97.1000111.7A239 V242 I246 L345 N346 K350 T351 I352 T622 I623 L715 Y718A239-F348 HydrophobicContact CB-CE1 4.5Å; V242-F348 HydrophobicContact CB-CD1 4.26Å; V242-F348 HydrophobicContact CB-CE1 3.48Å; V242-F348 VanDerWaalsContact CB-CE1 3.48Å; V242-F348 HydrophobicContact CB-CE2 4.48Å; V242-F348 HydrophobicContact CB-CZ 3.63Å; V242-F348 HydrophobicContact CG1-CD1 3.8Å; V242-F348 HydrophobicContact CG1-CD2 4.24Å; V242-F348 HydrophobicContact CG1-CE1 3.44Å; V242-F348 VanDerWaalsContact CG1-CE1 3.44Å; V242-F348 HydrophobicContact CG1-CE2 3.93Å; V242-F348 HydrophobicContact CG1-CG 4.19Å; V242-F348 HydrophobicContact CG1-CZ 3.52Å; V242-F348 HydrophobicContact CG2-CE1 4.37Å; V242-F348 HydrophobicContact CG2-CZ 4.05Å; I246-F348 HydrophobicContact CD1-CB 3.94Å; I246-F348 HydrophobicContact CD1-CD1 4.29Å; I246-F348 HydrophobicContact CD1-CG 4.16Å; L345-F348 PolarHBondContact O-N 2.74Å; N346-F348 PolarHBondContact O-N 3.03Å; F348-K350 VanDerWaalsContact C-N 3.34Å; F348-K350 PolarHBondContact O-N 3.34Å; F348-T351 WeakPolarHBondContact O-CB 2.91Å; F348-T351 PolarHBondContact O-N 2.71Å; F348-T351 VanDerWaalsContact O-N 3.12Å; F348-I352 HydrophobicContact CD1-CD1 3.66Å; F348-I352 HydrophobicContact CE1-CD1 3.21Å; F348-I352 HydrophobicContact CE1-CG1 4.37Å; F348-I352 HydrophobicContact CZ-CD1 3.75Å; F348-I352 PolarHBondContact O-N 3.25Å; F348-I352 VanDerWaalsContact O-N 3.15Å; F348-T622 HydrophobicContact CB-CG2 4.23Å; F348-I623 HydrophobicContact CE2-CG1 4.4Å; F348-L715 HydrophobicContact CD2-CD2 4.13Å; F348-L715 HydrophobicContact CE2-CD2 4.28Å; F348-Y718 HydrophobicContact CE2-CD1 4.07Å; F348-Y718 AromaticContact CE2-CE1 3.87Å; F348-Y718 HydrophobicContact CE2-CE1 3.87Å; F348-Y718 HydrophobicContact CZ-CD1 4.23Å; F348-Y718 HydrophobicContact CZ-CD2 4.4Å; F348-Y718 HydrophobicContact CZ-CE1 4Å; F348-Y718 HydrophobicContact CZ-CE2 4.16Å; F348-Y718 HydrophobicContact CZ-CG 4.43Å; F348-Y718 AromaticContact CZ-CZ 3.98Å
349N93.7Very high93.3Very high39 Ų3943 Ų4321%0.20923%0.227CC..Hα-helixtrans-65.3-37.8178.5-74-2.5000112.2S243 N346 T351 I352 N353S243-N349 WeakPolarHBondContact CB-OD1 3.31Å; S243-N349 PolarHBondContact OG-ND2 2.63Å; S243-N349 PolarHBondContact OG-OD1 2.88Å; S243-N349 VanDerWaalsContact OG-OD1 3.07Å; N346-N349 PolarHBondContact O-N 3.45Å; N346-N349 VanDerWaalsContact O-N 3.14Å; N349-T351 VanDerWaalsContact C-N 3.3Å; N349-T351 PolarHBondContact O-N 3.23Å; N349-I352 PolarHBondContact O-N 3.44Å; N349-N353 WeakPolarHBondContact O-CB 3.09Å; N349-N353 VanDerWaalsContact O-CG 3.27Å; N349-N353 PolarHBondContact O-N 3.36Å
350K93.6Very high93.1Very high108 Ų10845.4 Ų45.447%0.4724%0.236SC..Hα-helixtrans-63.6-36173.2-66.9-177.7-162.3159.20112.5N346 E347 F348 I352 N354N346-K350 PolarHBondContact O-N 3.17Å; N346-K350 VanDerWaalsContact O-N 3.08Å; E347-K350 PolarHBondContact O-N 2.79Å; E347-K350 WeakPolarHBondContact OE2-CD 3.46Å; E347-K350 IonicContact OE2-NZ 3.37Å; E347-K350 PolarHBondContact OE2-NZ 3.31Å; E347-K350 VanDerWaalsContact OE2-NZ 3.1Å; F348-K350 VanDerWaalsContact C-N 3.34Å; F348-K350 PolarHBondContact O-N 3.34Å; K350-I352 VanDerWaalsContact C-N 3.32Å; K350-N354 WeakPolarHBondContact O-CB 3.3Å; K350-N354 PolarHBondContact O-N 2.64Å; K350-N354 PolarHBondContact O-ND2 3.07Å
351T93.2Very high92.8Very high13 Ų1348.7 Ų48.78%0.0824%0.236CC..Hα-helixtrans-65.8-38.8178.2-56.70000110.6E347 F348 N349 F619 T622E347-T351 WeakPolarHBondContact O-CB 3.35Å; E347-T351 PolarHBondContact O-N 3.41Å; E347-T351 PolarHBondContact O-OG1 3.28Å; F348-T351 WeakPolarHBondContact O-CB 2.91Å; F348-T351 PolarHBondContact O-N 2.71Å; F348-T351 VanDerWaalsContact O-N 3.12Å; N349-T351 VanDerWaalsContact C-N 3.3Å; N349-T351 PolarHBondContact O-N 3.23Å; T351-F619 HydrophobicContact CG2-CD1 4.03Å; T351-F619 HydrophobicContact CG2-CD2 4.12Å; T351-F619 HydrophobicContact CG2-CE1 3.98Å; T351-F619 HydrophobicContact CG2-CE2 4.08Å; T351-F619 HydrophobicContact CG2-CG 4.12Å; T351-F619 HydrophobicContact CG2-CZ 4Å; T351-T622 PolarHBondContact OG1-OG1 3.17Å
352I91.8Very high92.5Very high6 Ų651.2 Ų51.23%0.03126%0.256CS..Hα-helixtrans-68.4-53.1176.2-65.5160000111.5T234 A239 F348 N349 K350 N354 L355 F619T234-I352 HydrophobicContact CG2-CG2 4.45Å; T234-I352 WeakPolarHBondContact OG1-CG2 3.24Å; A239-I352 HydrophobicContact CB-CD1 3.49Å; A239-I352 VanDerWaalsContact CB-CD1 3.49Å; A239-I352 HydrophobicContact CB-CG1 4.22Å; F348-I352 HydrophobicContact CD1-CD1 3.66Å; F348-I352 HydrophobicContact CE1-CD1 3.21Å; F348-I352 HydrophobicContact CE1-CG1 4.37Å; F348-I352 HydrophobicContact CZ-CD1 3.75Å; F348-I352 PolarHBondContact O-N 3.25Å; F348-I352 VanDerWaalsContact O-N 3.15Å; N349-I352 PolarHBondContact O-N 3.44Å; K350-I352 VanDerWaalsContact C-N 3.32Å; I352-N354 PolarHBondContact O-N 2.98Å; I352-N354 VanDerWaalsContact O-N 3.14Å; I352-L355 WeakPolarHBondContact O-CB 3.26Å; I352-L355 PolarHBondContact O-N 3.24Å; I352-F619 HydrophobicContact CG1-CE1 3.63Å; I352-F619 HydrophobicContact CG1-CZ 4Å
353N91.3Very high92.3Very high108 Ų10851.7 Ų51.758%0.57826%0.258SS*.Hα-helixtrans-70.6-10.8-173.8-64.7-12.1000113.9N349N349-N353 WeakPolarHBondContact O-CB 3.09Å; N349-N353 VanDerWaalsContact O-CG 3.27Å; N349-N353 PolarHBondContact O-N 3.36Å
354N91.8Very high92Very high74 Ų7450.4 Ų50.440%0.39625%0.254SS..THydrogen-bonded Turntrans-101.96173.4-72.1-52000112.3K350 I352 V357 N358K350-N354 WeakPolarHBondContact O-CB 3.3Å; K350-N354 PolarHBondContact O-N 2.64Å; K350-N354 PolarHBondContact O-ND2 3.07Å; I352-N354 PolarHBondContact O-N 2.98Å; I352-N354 VanDerWaalsContact O-N 3.14Å; N354-V357 PolarHBondContact O-N 3.48Å; N354-N358 VanDerWaalsContact O-CB 3.27Å; N354-N358 WeakPolarHBondContact O-CB 3.49Å; N354-N358 PolarHBondContact O-N 2.9Å; N354-N358 PolarHBondContact O-ND2 2.74Å; N354-N358 VanDerWaalsContact O-ND2 3.15Å
355L91.6Very high91.8Very high5 Ų551.5 Ų51.53%0.02627%0.266CS..Hα-helixtrans-61.3-50.4-175.6176.759.4000111.2F229 E230 F233 I352 V357 N358 V359 L615 F619F229-L355 HydrophobicContact CD1-CD2 4.38Å; F229-L355 HydrophobicContact CD1-CG 4.46Å; F229-L355 HydrophobicContact CE1-CD1 4.2Å; F229-L355 HydrophobicContact CE1-CD2 3.83Å; F229-L355 HydrophobicContact CE1-CG 3.96Å; E230-L355 HydrophobicContact CG-CB 4.15Å; E230-L355 PolarHBondContact OE2-N 2.87Å; F233-L355 HydrophobicContact CB-CD2 3.81Å; F233-L355 HydrophobicContact CD1-CD2 3.41Å; F233-L355 VanDerWaalsContact CD1-CD2 3.41Å; F233-L355 HydrophobicContact CD2-CD2 4.42Å; F233-L355 HydrophobicContact CE1-CD2 4.08Å; F233-L355 HydrophobicContact CG-CD2 3.61Å; I352-L355 WeakPolarHBondContact O-CB 3.26Å; I352-L355 PolarHBondContact O-N 3.24Å; L355-V357 VanDerWaalsContact C-N 3.3Å; L355-V357 PolarHBondContact O-N 3.1Å; L355-N358 PolarHBondContact O-N 3.41Å; L355-V359 HydrophobicContact CD1-CG2 3.92Å; L355-V359 HydrophobicContact CG-CG2 4.44Å; L355-V359 WeakPolarHBondContact O-CB 3.18Å; L355-V359 VanDerWaalsContact O-CG2 3.25Å; L355-V359 WeakPolarHBondContact O-CG2 3.18Å; L355-V359 PolarHBondContact O-N 2.97Å; L355-L615 HydrophobicContact CD1-CD1 4.3Å; L355-L615 HydrophobicContact CD1-CD2 3.53Å; L355-L615 HydrophobicContact CD1-CG 4.48Å; L355-F619 HydrophobicContact CD1-CE2 4.34Å
356A91.8Very high91.5Very high13 Ų1353.4 Ų53.411%0.10728%0.276CS..Hα-helixtrans-58.4-43.7178.400000111.6L226 E230 K360L226-A356 HydrophobicContact CB-CB 4.23Å; E230-A356 HydrophobicContact CB-CB 4.18Å; E230-A356 WeakPolarHBondContact OE2-CB 3.29Å; E230-A356 PolarHBondContact OE2-N 2.74Å; A356-K360 VanDerWaalsContact O-CB 3.31Å; A356-K360 WeakPolarHBondContact O-CB 3.49Å; A356-K360 PolarHBondContact O-N 2.84Å
357V91.3Very high91.2Very high70 Ų7051 Ų5142%0.42426%0.264SS..Hα-helixtrans-65.1-42.5178.7178.20000111.6N354 L355 K360 R361N354-V357 PolarHBondContact O-N 3.48Å; L355-V357 VanDerWaalsContact C-N 3.3Å; L355-V357 PolarHBondContact O-N 3.1Å; V357-K360 PolarHBondContact O-N 3.3Å; V357-R361 WeakPolarHBondContact O-CB 3.38Å; V357-R361 PolarHBondContact O-N 3.2Å
358N88.3Confident90.8Very high59 Ų5950.6 Ų50.632%0.31626%0.263SS..Hα-helixtrans-69-43.3-179.6-71.2-24.6000111.3N354 L355 R361 S362N354-N358 VanDerWaalsContact O-CB 3.27Å; N354-N358 WeakPolarHBondContact O-CB 3.49Å; N354-N358 PolarHBondContact O-N 2.9Å; N354-N358 PolarHBondContact O-ND2 2.74Å; N354-N358 VanDerWaalsContact O-ND2 3.15Å; L355-N358 PolarHBondContact O-N 3.41Å; N358-R361 PolarHBondContact O-N 3Å; N358-R361 PolarHBondContact OD1-NH1 2.71Å; N358-S362 PolarHBondContact O-N 3Å; N358-S362 PolarHBondContact O-OG 3.03Å
359V90.7Very high90.3Very high0 Ų056.4 Ų56.40%029%0.285CS..Hα-helixtrans-59-51.5173.3170.90000110L226 F229 L355 R361 S362 I363 F610 I613 L615L226-V359 HydrophobicContact CD1-CG1 4.29Å; L226-V359 HydrophobicContact CD2-CB 4.24Å; L226-V359 HydrophobicContact CD2-CG1 3.36Å; L226-V359 HydrophobicContact CG-CG1 4.45Å; F229-V359 HydrophobicContact CE1-CG2 4.08Å; L355-V359 HydrophobicContact CD1-CG2 3.92Å; L355-V359 HydrophobicContact CG-CG2 4.44Å; L355-V359 WeakPolarHBondContact O-CB 3.18Å; L355-V359 VanDerWaalsContact O-CG2 3.25Å; L355-V359 WeakPolarHBondContact O-CG2 3.18Å; L355-V359 PolarHBondContact O-N 2.97Å; V359-R361 VanDerWaalsContact C-N 3.29Å; V359-R361 PolarHBondContact O-N 3.42Å; V359-S362 WeakPolarHBondContact O-CB 3.26Å; V359-S362 PolarHBondContact O-N 3.37Å; V359-S362 VanDerWaalsContact O-N 3.07Å; V359-I363 WeakPolarHBondContact O-CG1 3.37Å; V359-I363 PolarHBondContact O-N 3.34Å; V359-I363 VanDerWaalsContact O-N 3.15Å; V359-F610 HydrophobicContact CG1-CD2 4.17Å; V359-F610 HydrophobicContact CG1-CE2 3.72Å; V359-I613 HydrophobicContact CB-CD1 4.38Å; V359-I613 HydrophobicContact CG1-CD1 3.67Å; V359-I613 HydrophobicContact CG2-CD1 4.47Å; V359-L615 HydrophobicContact CG2-CD1 4.5Å; V359-L615 HydrophobicContact CG2-CD2 3.77Å
360K91Very high89.8Confident79 Ų7955 Ų5534%0.34328%0.279SS..Hα-helixtrans-53.9-47.1177.4-174.4171.9178.4169.90111.4D223 L226 A356 V357 S362 I363 S364D223-K360 WeakPolarHBondContact OD1-CD 3.29Å; D223-K360 WeakPolarHBondContact OD1-CE 3.29Å; D223-K360 IonicContact OD1-NZ 2.78Å; D223-K360 PolarHBondContact OD1-NZ 3.27Å; D223-K360 IonicContact OD2-NZ 3.21Å; D223-K360 PolarHBondContact OD2-NZ 3.42Å; L226-K360 HydrophobicContact CD1-CB 3.54Å; L226-K360 HydrophobicContact CD1-CG 4.14Å; A356-K360 VanDerWaalsContact O-CB 3.31Å; A356-K360 WeakPolarHBondContact O-CB 3.49Å; A356-K360 PolarHBondContact O-N 2.84Å; V357-K360 PolarHBondContact O-N 3.3Å; K360-S362 VanDerWaalsContact C-N 3.32Å; K360-S362 PolarHBondContact O-N 3.31Å; K360-I363 PolarHBondContact O-N 3.43Å; K360-S364 WeakPolarHBondContact O-CA 3.48Å; K360-S364 WeakPolarHBondContact O-CB 3.23Å; K360-S364 PolarHBondContact O-N 3.32Å
361R90.3Very high89.2Confident159 Ų15950.3 Ų50.360%0.626%0.258SS*.Hα-helixtrans-61.1-40.5179.2-168.6-176.5-60.4113.40.1111.9V357 N358 V359 I363V357-R361 WeakPolarHBondContact O-CB 3.38Å; V357-R361 PolarHBondContact O-N 3.2Å; N358-R361 PolarHBondContact O-N 3Å; N358-R361 PolarHBondContact OD1-NH1 2.71Å; V359-R361 VanDerWaalsContact C-N 3.29Å; V359-R361 PolarHBondContact O-N 3.42Å; R361-I363 VanDerWaalsContact C-N 3.33Å; R361-I363 PolarHBondContact O-N 3.43Å
362S89Confident88.5Confident75 Ų7552.5 Ų52.552%0.52427%0.269SS..Hα-helixtrans-67.6-30.5179.5-70.50000113.8N358 V359 K360N358-S362 PolarHBondContact O-N 3Å; N358-S362 PolarHBondContact O-OG 3.03Å; V359-S362 WeakPolarHBondContact O-CB 3.26Å; V359-S362 PolarHBondContact O-N 3.37Å; V359-S362 VanDerWaalsContact O-N 3.07Å; K360-S362 VanDerWaalsContact C-N 3.32Å; K360-S362 PolarHBondContact O-N 3.31Å
363I89.8Confident87.7Confident11 Ų1156 Ų566%0.05629%0.288CS..Hα-helixtrans-106.60.8-178.965.5173.8000113.8V359 K360 R361 D365 D366 L367 F610 I613V359-I363 WeakPolarHBondContact O-CG1 3.37Å; V359-I363 PolarHBondContact O-N 3.34Å; V359-I363 VanDerWaalsContact O-N 3.15Å; K360-I363 PolarHBondContact O-N 3.43Å; R361-I363 VanDerWaalsContact C-N 3.33Å; R361-I363 PolarHBondContact O-N 3.43Å; I363-D365 VanDerWaalsContact C-N 3.3Å; I363-D365 PolarHBondContact O-N 2.91Å; I363-D366 CarbonylContact O-C 3.25Å; I363-D366 WeakPolarHBondContact O-CA 3.25Å; I363-D366 WeakPolarHBondContact O-CB 3.46Å; I363-D366 PolarHBondContact O-N 3.01Å; I363-L367 HydrophobicContact CD1-CD1 3.86Å; I363-L367 HydrophobicContact CD1-CD2 4.49Å; I363-L367 HydrophobicContact CD1-CG 4.19Å; I363-L367 HydrophobicContact CG1-CD1 3.73Å; I363-L367 HydrophobicContact CG1-CG 4.12Å; I363-L367 WeakPolarHBondContact O-CG 3.47Å; I363-L367 PolarHBondContact O-N 2.85Å; I363-F610 HydrophobicContact CD1-CD2 4.45Å; I363-I613 HydrophobicContact CG2-CD1 3.51Å; I363-I613 HydrophobicContact CG2-CG1 3.99Å
364S90.2Very high86.9Confident40 Ų4051.3 Ų51.328%0.2826%0.263SS..Hα-helixtrans-56.2-46.4-174.7-167.40000111.7K360 D366 L367 D368K360-S364 WeakPolarHBondContact O-CA 3.48Å; K360-S364 WeakPolarHBondContact O-CB 3.23Å; K360-S364 PolarHBondContact O-N 3.32Å; S364-D366 VanDerWaalsContact C-N 3.3Å; S364-D366 PolarHBondContact O-N 3.3Å; S364-L367 PolarHBondContact O-N 3.48Å; S364-D368 PolarHBondContact O-N 3.5Å
365D90.4Very high85.9Confident110 Ų11048.9 Ų48.959%0.58825%0.253SS*.Hα-helixtrans-67.6-33.3179.3-62.2-13.9000111.7I363 R369I363-D365 VanDerWaalsContact C-N 3.3Å; I363-D365 PolarHBondContact O-N 2.91Å; D365-R369 VanDerWaalsContact O-CB 3.24Å; D365-R369 WeakPolarHBondContact O-CB 3.39Å; D365-R369 VanDerWaalsContact O-CG 3.22Å; D365-R369 WeakPolarHBondContact O-CG 3.21Å; D365-R369 PolarHBondContact O-N 2.96Å
366D88.4Confident84.7Confident40 Ų4055.4 Ų55.421%0.21428%0.284CS..Hα-helixtrans-70.2-37.6174.6-77.5-46.7000112.2I363 S364 R369 A370 S609I363-D366 CarbonylContact O-C 3.25Å; I363-D366 WeakPolarHBondContact O-CA 3.25Å; I363-D366 WeakPolarHBondContact O-CB 3.46Å; I363-D366 PolarHBondContact O-N 3.01Å; S364-D366 VanDerWaalsContact C-N 3.3Å; S364-D366 PolarHBondContact O-N 3.3Å; D366-R369 VanDerWaalsContact CG-NH2 3.3Å; D366-R369 IonicContact OD1-CZ 3.74Å; D366-R369 IonicContact OD1-NE 3.18Å; D366-R369 IonicContact OD1-NH2 2.69Å; D366-R369 PolarHBondContact OD1-NH2 3.42Å; D366-R369 IonicContact OD2-NH2 3.4Å; D366-A370 WeakPolarHBondContact O-CB 3.22Å; D366-A370 PolarHBondContact O-N 3.33Å; D366-S609 PolarHBondContact OD1-OG 3.49Å; D366-S609 WeakPolarHBondContact OD2-CB 3.42Å; D366-S609 PolarHBondContact OD2-OG 3.39Å
367L88.3Confident83.4Confident4 Ų455.7 Ų55.72%0.02128%0.284CS..Hα-helixtrans-66-46.4175.3-71.6167.8000111.2F218 M219 I222 I363 S364 A370 W371 L606F218-L367 HydrophobicContact CE1-CD2 4.02Å; F218-L367 HydrophobicContact CZ-CD2 4.12Å; M219-L367 HydrophobicContact CE-CB 4.45Å; I222-L367 HydrophobicContact CD1-CD2 3.76Å; I222-L367 HydrophobicContact CG1-CD2 3.82Å; I222-L367 HydrophobicContact CG2-CD1 3.75Å; I222-L367 HydrophobicContact CG2-CD2 4.34Å; I363-L367 HydrophobicContact CD1-CD1 3.86Å; I363-L367 HydrophobicContact CD1-CD2 4.49Å; I363-L367 HydrophobicContact CD1-CG 4.19Å; I363-L367 HydrophobicContact CG1-CD1 3.73Å; I363-L367 HydrophobicContact CG1-CG 4.12Å; I363-L367 WeakPolarHBondContact O-CG 3.47Å; I363-L367 PolarHBondContact O-N 2.85Å; S364-L367 PolarHBondContact O-N 3.48Å; L367-A370 PolarHBondContact O-N 2.87Å; L367-W371 WeakPolarHBondContact O-CB 3.34Å; L367-W371 PolarHBondContact O-N 3.36Å; L367-L606 HydrophobicContact CD2-CD2 3.82Å; L367-L606 HydrophobicContact CG-CD2 4.41Å
368D86.3Confident82.2Confident49 Ų4956.5 Ų56.526%0.26229%0.291SS..Hα-helixtrans-66.7-40.1176.2-85.6-44.3000111.3K215 M219 S364 W371 N372K215-D368 IonicContact NZ-OD1 3.76Å; K215-D368 PolarHBondContact NZ-OD1 3.12Å; M219-D368 WeakPolarHBondContact CE-OD1 3.36Å; S364-D368 PolarHBondContact O-N 3.5Å; D368-W371 PolarHBondContact O-N 2.93Å; D368-N372 VanDerWaalsContact O-CB 3.23Å; D368-N372 WeakPolarHBondContact O-CB 3.44Å; D368-N372 PolarHBondContact O-N 2.99Å; D368-N372 PolarHBondContact O-ND2 3.36Å; D368-N372 VanDerWaalsContact O-ND2 3.11Å
369R84.1Confident81Confident123 Ų12361.3 Ų61.346%0.46431%0.309SS..Hα-helixtrans-60.1-50.8171.5-82.3-169.4-64.7-88.98.3111.6D365 D366 W371 N372 D373D365-R369 VanDerWaalsContact O-CB 3.24Å; D365-R369 WeakPolarHBondContact O-CB 3.39Å; D365-R369 VanDerWaalsContact O-CG 3.22Å; D365-R369 WeakPolarHBondContact O-CG 3.21Å; D365-R369 PolarHBondContact O-N 2.96Å; D366-R369 VanDerWaalsContact CG-NH2 3.3Å; D366-R369 IonicContact OD1-CZ 3.74Å; D366-R369 IonicContact OD1-NE 3.18Å; D366-R369 IonicContact OD1-NH2 2.69Å; D366-R369 PolarHBondContact OD1-NH2 3.42Å; D366-R369 IonicContact OD2-NH2 3.4Å; R369-W371 VanDerWaalsContact C-N 3.28Å; R369-W371 PolarHBondContact O-N 2.91Å; R369-N372 CarbonylContact O-C 3.43Å; R369-N372 PolarHBondContact O-N 2.03Å; R369-D373 WeakPolarHBondContact O-CA 3.23Å; R369-D373 WeakPolarHBondContact O-CB 3.43Å; R369-D373 VanDerWaalsContact O-CG 3.24Å; R369-D373 PolarHBondContact O-N 3.36Å
370A81.7Confident79.8Confident9 Ų962.6 Ų62.67%0.07432%0.317CS..Hα-helixtrans-58-41.8179.200000112D366 L367 L374 I602 L606D366-A370 WeakPolarHBondContact O-CB 3.22Å; D366-A370 PolarHBondContact O-N 3.33Å; L367-A370 PolarHBondContact O-N 2.87Å; A370-L374 PolarHBondContact O-N 3.4Å; A370-I602 HydrophobicContact CB-CG2 3.8Å; A370-L606 HydrophobicContact CB-CD1 3.91Å; A370-L606 HydrophobicContact CB-CD2 3.63Å; A370-L606 HydrophobicContact CB-CG 3.78Å
371W82.1Confident78.6Confident9 Ų960.8 Ų60.83%0.03431%0.308CS..Hα-helixtrans-67.8-46.7176.4-172.7-90.6000112.4L211 Q214 K215 F218 L367 D368 R369 D373 L374 A375 A748L211-W371 HydrophobicContact CB-CZ2 3.95Å; Q214-W371 HydrophobicContact CB-CH2 3.7Å; Q214-W371 HydrophobicContact CB-CZ2 4.11Å; Q214-W371 WeakPolarHBondContact O-CH2 3.33Å; K215-W371 HydrophobicContact CB-CD2 4.08Å; K215-W371 HydrophobicContact CB-CH2 4.25Å; K215-W371 HydrophobicContact CB-CZ2 3.48Å; K215-W371 VanDerWaalsContact CB-CZ2 3.48Å; K215-W371 HydrophobicContact CD-CD2 4.5Å; K215-W371 HydrophobicContact CD-CG 4.13Å; K215-W371 HydrophobicContact CG-CD2 3.86Å; K215-W371 HydrophobicContact CG-CG 3.96Å; K215-W371 HydrophobicContact CG-CZ2 4.21Å; K215-W371 VanDerWaalsContact N-CH2 3.27Å; F218-W371 HydrophobicContact CB-CE3 3.76Å; F218-W371 HydrophobicContact CB-CH2 4.21Å; F218-W371 HydrophobicContact CB-CZ3 3.39Å; F218-W371 HydrophobicContact CD1-CD2 4.48Å; F218-W371 AromaticContact CD1-CE3 3.61Å; F218-W371 HydrophobicContact CD1-CE3 3.61Å; F218-W371 HydrophobicContact CD1-CZ3 4.15Å; F218-W371 HydrophobicContact CD2-CE3 4.04Å; F218-W371 AromaticContact CD2-CZ3 3.98Å; F218-W371 HydrophobicContact CD2-CZ3 3.98Å; F218-W371 HydrophobicContact CE1-CE3 4.2Å; F218-W371 AromaticContact CG-CE3 3.53Å; F218-W371 HydrophobicContact CG-CE3 3.53Å; F218-W371 AromaticContact CG-CZ3 3.58Å; F218-W371 HydrophobicContact CG-CZ3 3.58Å; L367-W371 WeakPolarHBondContact O-CB 3.34Å; L367-W371 PolarHBondContact O-N 3.36Å; D368-W371 PolarHBondContact O-N 2.93Å; R369-W371 VanDerWaalsContact C-N 3.28Å; R369-W371 PolarHBondContact O-N 2.91Å; W371-D373 VanDerWaalsContact C-N 3.26Å; W371-D373 PolarHBondContact O-N 3.3Å; W371-L374 HydrophobicContact CZ3-CD2 4.45Å; W371-L374 WeakPolarHBondContact O-CB 3.21Å; W371-L374 PolarHBondContact O-N 3.27Å; W371-L374 VanDerWaalsContact O-N 3.17Å; W371-A375 VanDerWaalsContact O-CB 3.32Å; W371-A375 WeakPolarHBondContact O-CB 3.28Å; W371-A375 PolarHBondContact O-N 3.2Å; W371-A748 HydrophobicContact CH2-CB 4.11Å
372N78.5Confident77.5Confident59 Ų5959.5 Ų59.532%0.31631%0.309SS..Hα-helixtrans-66-33.3177.6-67-22.6000111D368 R369 L374 A375 Q376 S377D368-N372 VanDerWaalsContact O-CB 3.23Å; D368-N372 WeakPolarHBondContact O-CB 3.44Å; D368-N372 PolarHBondContact O-N 2.99Å; D368-N372 PolarHBondContact O-ND2 3.36Å; D368-N372 VanDerWaalsContact O-ND2 3.11Å; R369-N372 CarbonylContact O-C 3.43Å; R369-N372 PolarHBondContact O-N 2.03Å; N372-L374 VanDerWaalsContact C-N 3.29Å; N372-L374 PolarHBondContact O-N 3.4Å; N372-A375 PolarHBondContact O-N 3.29Å; N372-Q376 CarbonylContact O-C 3.57Å; N372-Q376 WeakPolarHBondContact O-CA 3.27Å; N372-Q376 WeakPolarHBondContact O-CB 3.35Å; N372-Q376 PolarHBondContact O-N 3.19Å; N372-S377 PolarHBondContact O-N 2.91Å; N372-S377 VanDerWaalsContact O-N 3.13Å
373D75.8Confident76.5Confident80 Ų8059.6 Ų59.643%0.42830%0.3SS..Hα-helixtrans-66.4-33.2174.6-80-18.4000111.4R369 W371 S377 T380R369-D373 WeakPolarHBondContact O-CA 3.23Å; R369-D373 WeakPolarHBondContact O-CB 3.43Å; R369-D373 VanDerWaalsContact O-CG 3.24Å; R369-D373 PolarHBondContact O-N 3.36Å; W371-D373 VanDerWaalsContact C-N 3.26Å; W371-D373 PolarHBondContact O-N 3.3Å; D373-S377 WeakPolarHBondContact O-CB 3.38Å; D373-T380 WeakPolarHBondContact O-CB 3.41Å; D373-T380 PolarHBondContact O-OG1 2.79Å
374L74.2Confident75.5Confident10 Ų1059.5 Ų59.55%0.05230%0.3CS..Hα-helixtrans-74-52.1171.6-17274.2000112A370 W371 N372 I602 L745 A748 V749A370-L374 PolarHBondContact O-N 3.4Å; W371-L374 HydrophobicContact CZ3-CD2 4.45Å; W371-L374 WeakPolarHBondContact O-CB 3.21Å; W371-L374 PolarHBondContact O-N 3.27Å; W371-L374 VanDerWaalsContact O-N 3.17Å; N372-L374 VanDerWaalsContact C-N 3.29Å; N372-L374 PolarHBondContact O-N 3.4Å; L374-I602 HydrophobicContact CB-CD1 3.92Å; L374-I602 HydrophobicContact CD1-CD1 3.58Å; L374-I602 HydrophobicContact CG-CD1 4.37Å; L374-L745 HydrophobicContact CD2-CD2 3.48Å; L374-L745 VanDerWaalsContact CD2-CD2 3.48Å; L374-A748 HydrophobicContact CD2-CB 3.66Å; L374-V749 HydrophobicContact CD1-CG2 3.72Å; L374-V749 HydrophobicContact CG-CG2 4.43Å
375A69.2Low74.6Confident22 Ų2257.7 Ų57.718%0.18229%0.287CS..Hα-helixtrans-78.7-33.1-167.300000113.1L211 W371 N372L211-A375 HydrophobicContact CD1-CB 3.88Å; W371-A375 VanDerWaalsContact O-CB 3.32Å; W371-A375 WeakPolarHBondContact O-CB 3.28Å; W371-A375 PolarHBondContact O-N 3.2Å; N372-A375 PolarHBondContact O-N 3.29Å
376Q66.9Low73.6Confident143 Ų14354.3 Ų54.367%0.66827%0.272SS*.THydrogen-bonded Turntrans-125.9-18.1-168.1-60.1179.9200113.9N372 P378N372-Q376 CarbonylContact O-C 3.57Å; N372-Q376 WeakPolarHBondContact O-CA 3.27Å; N372-Q376 WeakPolarHBondContact O-CB 3.35Å; N372-Q376 PolarHBondContact O-N 3.19Å; Q376-P378 WeakPolarHBondContact O-CD 3.38Å
377S64.9Low72.7Confident18 Ų1854 Ų5413%0.12627%0.271CS..  trans-65.7122-176.2-174.90000111.9N372 D373 K379 T380 R381N372-S377 PolarHBondContact O-N 2.91Å; N372-S377 VanDerWaalsContact O-N 3.13Å; D373-S377 WeakPolarHBondContact O-CB 3.38Å; S377-K379 PolarHBondContact O-N 2.75Å; S377-K379 PolarHBondContact OG-N 2.81Å; S377-T380 PolarHBondContact O-N 2.94Å; S377-T380 PolarHBondContact OG-N 2.86Å; S377-R381 WeakPolarHBondContact O-CD 3.41Å; S377-R381 VanDerWaalsContact O-CG 3.24Å; S377-R381 WeakPolarHBondContact O-CG 2.96Å; S377-R381 PolarHBondContact O-N 2.84Å
378P65.1Low71.8Confident87 Ų8753.8 Ų53.857%0.56527%0.27SS*.Hα-helixtrans-56.6-35.9167.9-23.334.9000111.7Q376 R381 E382Q376-P378 WeakPolarHBondContact O-CD 3.38Å; P378-R381 PolarHBondContact O-N 2.67Å; P378-E382 VanDerWaalsContact O-CB 3.29Å; P378-E382 WeakPolarHBondContact O-CB 3.42Å; P378-E382 VanDerWaalsContact O-CG 3.26Å; P378-E382 WeakPolarHBondContact O-CG 3.16Å; P378-E382 PolarHBondContact O-N 3.17Å
379K64.5Low71.4Confident161 Ų16154.8 Ų54.870%0.727%0.273SS*.Hα-helixtrans-66.6-45.1-178.5-68.2-176.4179178.70112.9S377 R381 E382 K383S377-K379 PolarHBondContact O-N 2.75Å; S377-K379 PolarHBondContact OG-N 2.81Å; K379-R381 VanDerWaalsContact C-N 3.3Å; K379-R381 PolarHBondContact O-N 2.8Å; K379-E382 PolarHBondContact O-N 3.1Å; K379-K383 WeakPolarHBondContact O-CB 3.29Å; K379-K383 PolarHBondContact O-N 2.89Å
380T65.3Low70.7Confident26 Ų2655.1 Ų55.116%0.1628%0.28CS..Hα-helixtrans-65.1-40.1178.5-50.80000110.3D373 S377 K383 L384 A598 I602D373-T380 WeakPolarHBondContact O-CB 3.41Å; D373-T380 PolarHBondContact O-OG1 2.79Å; S377-T380 PolarHBondContact O-N 2.94Å; S377-T380 PolarHBondContact OG-N 2.86Å; T380-K383 PolarHBondContact O-N 2.75Å; T380-L384 WeakPolarHBondContact O-CB 3.34Å; T380-L384 PolarHBondContact O-N 3.01Å; T380-A598 HydrophobicContact CG2-CB 4.32Å; T380-I602 HydrophobicContact CG2-CD1 4.25Å
381R64.9Low70.1Confident42 Ų4257.4 Ų57.416%0.15829%0.29CS..Hα-helixtrans-65.3-43.7174.4-65.2164.260.886.711.7112.2K204 T206 S377 P378 K379 K383 L384 A385K204-R381 PolarHBondContact O-NH2 3.21Å; T206-R381 PolarHBondContact O-NH1 2.67Å; T206-R381 PolarHBondContact O-NH2 3.15Å; S377-R381 WeakPolarHBondContact O-CD 3.41Å; S377-R381 VanDerWaalsContact O-CG 3.24Å; S377-R381 WeakPolarHBondContact O-CG 2.96Å; S377-R381 PolarHBondContact O-N 2.84Å; P378-R381 PolarHBondContact O-N 2.67Å; K379-R381 VanDerWaalsContact C-N 3.3Å; K379-R381 PolarHBondContact O-N 2.8Å; R381-K383 VanDerWaalsContact C-N 3.28Å; R381-K383 PolarHBondContact O-N 2.83Å; R381-L384 PolarHBondContact O-N 3.34Å; R381-A385 WeakPolarHBondContact O-CA 3.12Å; R381-A385 WeakPolarHBondContact O-CB 3.42Å; R381-A385 PolarHBondContact O-N 3.07Å
382E68.1Low69.7Low131 Ų13157.7 Ų57.761%0.61229%0.292SS*.Hα-helixtrans-60.1-40.9174.2-82.8173.1-176.600110.6P378 K379 S386P378-E382 VanDerWaalsContact O-CB 3.29Å; P378-E382 WeakPolarHBondContact O-CB 3.42Å; P378-E382 VanDerWaalsContact O-CG 3.26Å; P378-E382 WeakPolarHBondContact O-CG 3.16Å; P378-E382 PolarHBondContact O-N 3.17Å; K379-E382 PolarHBondContact O-N 3.1Å; E382-S386 WeakPolarHBondContact O-CA 3.37Å; E382-S386 WeakPolarHBondContact O-CB 3.05Å; E382-S386 PolarHBondContact O-N 3.45Å; E382-S386 PolarHBondContact O-OG 3.06Å
383K67.7Low69.5Low78 Ų7858 Ų5834%0.33930%0.296SS..Hα-helixtrans-67.3-42.6176.2-165.5173.9-173.9-177.40112K379 T380 R381 S386 V387 E597K379-K383 WeakPolarHBondContact O-CB 3.29Å; K379-K383 PolarHBondContact O-N 2.89Å; T380-K383 PolarHBondContact O-N 2.75Å; R381-K383 VanDerWaalsContact C-N 3.28Å; R381-K383 PolarHBondContact O-N 2.83Å; K383-S386 WeakPolarHBondContact CA-OG 3.19Å; K383-S386 PolarHBondContact O-N 3.48Å; K383-S386 PolarHBondContact O-OG 3.42Å; K383-V387 WeakPolarHBondContact O-CG2 3.48Å; K383-V387 PolarHBondContact O-N 2.99Å; K383-V387 VanDerWaalsContact O-N 3.14Å; K383-E597 WeakPolarHBondContact CE-OE1 3.09Å; K383-E597 VanDerWaalsContact NZ-CD 3.3Å; K383-E597 IonicContact NZ-OE1 3.52Å; K383-E597 PolarHBondContact NZ-OE1 3Å
384L68.1Low69.1Low9 Ų959.3 Ų59.35%0.04730%0.303CS..Hα-helixtrans-67-44.1177.1-172.175.3000111.3T380 R381 S386 V387 F388 V594 L595 V749 W753T380-L384 WeakPolarHBondContact O-CB 3.34Å; T380-L384 PolarHBondContact O-N 3.01Å; R381-L384 PolarHBondContact O-N 3.34Å; L384-S386 VanDerWaalsContact C-N 3.33Å; L384-V387 PolarHBondContact O-N 2.95Å; L384-F388 PolarHBondContact O-N 3.28Å; L384-V594 HydrophobicContact CD1-CG1 4.31Å; L384-L595 HydrophobicContact CD1-CD1 3.75Å; L384-V749 HydrophobicContact CD1-CG1 3.85Å; L384-V749 HydrophobicContact CD2-CG1 3.28Å; L384-V749 HydrophobicContact CG-CG1 4.19Å; L384-W753 HydrophobicContact CB-CZ2 4.4Å; L384-W753 HydrophobicContact CD1-CH2 4.11Å; L384-W753 HydrophobicContact CD1-CZ2 4.16Å; L384-W753 HydrophobicContact CD2-CD2 4.3Å; L384-W753 VanDerWaalsContact CD2-CE2 3.42Å; L384-W753 HydrophobicContact CD2-CH2 4.09Å; L384-W753 HydrophobicContact CD2-CZ2 3.36Å; L384-W753 HydrophobicContact CG-CH2 3.76Å; L384-W753 HydrophobicContact CG-CZ2 3.32Å
385A71.1Confident69Low1 Ų161.5 Ų61.51%0.00832%0.317CS..Hα-helixtrans-67.8-31.317600000111.8K204 R381 F388 E389K204-A385 HydrophobicContact CG-CB 3.68Å; R381-A385 WeakPolarHBondContact O-CA 3.12Å; R381-A385 WeakPolarHBondContact O-CB 3.42Å; R381-A385 PolarHBondContact O-N 3.07Å; A385-F388 PolarHBondContact O-N 2.83Å; A385-E389 WeakPolarHBondContact O-CA 3.33Å; A385-E389 WeakPolarHBondContact O-CB 3.45Å; A385-E389 PolarHBondContact O-N 2.85Å
386S71Confident69.3Low40 Ų4061.3 Ų61.328%0.2831%0.314SS..Hα-helixtrans-71.6-37.4176.771.40000111.7E382 K383 L384 E389 H390E382-S386 WeakPolarHBondContact O-CA 3.37Å; E382-S386 WeakPolarHBondContact O-CB 3.05Å; E382-S386 PolarHBondContact O-N 3.45Å; E382-S386 PolarHBondContact O-OG 3.06Å; K383-S386 WeakPolarHBondContact CA-OG 3.19Å; K383-S386 PolarHBondContact O-N 3.48Å; K383-S386 PolarHBondContact O-OG 3.42Å; L384-S386 VanDerWaalsContact C-N 3.33Å; S386-E389 PolarHBondContact O-N 3.24Å; S386-H390 WeakPolarHBondContact O-CB 3.47Å; S386-H390 PolarHBondContact O-CD2 3.25Å; S386-H390 PolarHBondContact O-N 3.07Å
387V68Low69.6Low33 Ų3358.3 Ų58.320%0.231%0.306CS..Hα-helixtrans-66.3-43.2172.6-179.20000110.4K383 L384 H390 I391 V594K383-V387 WeakPolarHBondContact O-CG2 3.48Å; K383-V387 PolarHBondContact O-N 2.99Å; K383-V387 VanDerWaalsContact O-N 3.14Å; L384-V387 PolarHBondContact O-N 2.95Å; V387-H390 PolarHBondContact O-N 3.23Å; V387-I391 WeakPolarHBondContact O-CG1 3.34Å; V387-I391 PolarHBondContact O-N 3.17Å; V387-I391 VanDerWaalsContact O-N 3.11Å; V387-V594 HydrophobicContact CB-CG1 4.25Å; V387-V594 HydrophobicContact CG1-CB 4.2Å; V387-V594 HydrophobicContact CG1-CG1 3.87Å; V387-V594 HydrophobicContact CG1-CG2 4.34Å
388F71Confident69.8Low0 Ų061.1 Ų61.10%032%0.322CS..Hα-helixtrans-60.3-45.2173.3-171-115.1000111.9M199 V200 A203 L384 A385 H390 I391 M392 F581 W753M199-F388 HydrophobicContact CB-CE1 4.38Å; M199-F388 HydrophobicContact CE-CZ 4.44Å; V200-F388 HydrophobicContact CB-CD1 4.48Å; V200-F388 HydrophobicContact CG2-CD1 3.84Å; V200-F388 HydrophobicContact CG2-CE1 3.88Å; A203-F388 HydrophobicContact CB-CD1 3.89Å; A203-F388 HydrophobicContact CB-CE1 4.15Å; L384-F388 PolarHBondContact O-N 3.28Å; A385-F388 PolarHBondContact O-N 2.83Å; F388-H390 PolarHBondContact O-N 3.14Å; F388-I391 PolarHBondContact O-N 2.89Å; F388-M392 HydrophobicContact CD1-CG 4.31Å; F388-M392 HydrophobicContact CD2-CE 4.27Å; F388-M392 HydrophobicContact CE1-CE 4.18Å; F388-M392 HydrophobicContact CE1-CG 4.05Å; F388-M392 HydrophobicContact CE2-CE 3.33Å; F388-M392 HydrophobicContact CE2-CG 4.33Å; F388-M392 HydrophobicContact CZ-CE 3.29Å; F388-M392 HydrophobicContact CZ-CG 4.08Å; F388-M392 WeakPolarHBondContact O-CB 3.14Å; F388-M392 WeakPolarHBondContact O-CG 3.45Å; F388-M392 PolarHBondContact O-N 3.13Å; F388-F581 HydrophobicContact CE2-CD1 4.42Å; F388-F581 AromaticContact CE2-CE1 3.6Å; F388-F581 HydrophobicContact CE2-CE1 3.6Å; F388-F581 HydrophobicContact CE2-CZ 4.1Å; F388-F581 HydrophobicContact CZ-CD1 4.43Å; F388-F581 AromaticContact CZ-CE1 3.91Å; F388-F581 HydrophobicContact CZ-CE1 3.91Å; F388-F581 HydrophobicContact CZ-CZ 4.33Å; F388-W753 HydrophobicContact CB-CH2 3.83Å; F388-W753 HydrophobicContact CB-CZ2 4.11Å; F388-W753 HydrophobicContact CD2-CH2 4.02Å; F388-W753 HydrophobicContact CD2-CZ3 4.21Å; F388-W753 HydrophobicContact CG-CH2 4.06Å; F388-W753 HydrophobicContact CG-CZ2 4.39Å
389E76.2Confident70.1Confident70 Ų7058 Ų5833%0.32730%0.301SS..Hα-helixtrans-62.1-41.2176.1-179.7168.7-149.700111.2V200 K204 A385 S386 I391 M392 V393V200-E389 HydrophobicContact CG1-CB 3.92Å; V200-E389 HydrophobicContact CG1-CG 4.09Å; K204-E389 VanDerWaalsContact CE-OE2 3.23Å; K204-E389 WeakPolarHBondContact CE-OE2 3.15Å; K204-E389 IonicContact NZ-OE1 3.42Å; K204-E389 PolarHBondContact NZ-OE1 3.15Å; K204-E389 IonicContact NZ-OE2 2.67Å; K204-E389 PolarHBondContact NZ-OE2 3.3Å; A385-E389 WeakPolarHBondContact O-CA 3.33Å; A385-E389 WeakPolarHBondContact O-CB 3.45Å; A385-E389 PolarHBondContact O-N 2.85Å; S386-E389 PolarHBondContact O-N 3.24Å; E389-I391 VanDerWaalsContact C-N 3.34Å; E389-I391 PolarHBondContact O-N 2.93Å; E389-M392 CarbonylContact O-C 3.59Å; E389-M392 PolarHBondContact O-N 3.39Å; E389-V393 HydrophobicContact CG-CG2 3.96Å; E389-V393 VanDerWaalsContact O-CB 3.22Å; E389-V393 WeakPolarHBondContact O-CB 3.38Å; E389-V393 WeakPolarHBondContact O-CG2 3.48Å; E389-V393 PolarHBondContact O-N 2.81Å
390H70.1Confident70.5Confident129 Ų12954.6 Ų54.660%0.59729%0.286SS*.Hα-helixtrans-60.8-42.7175.3-85.3-59.5000112.2S386 V387 F388 N394S386-H390 WeakPolarHBondContact O-CB 3.47Å; S386-H390 PolarHBondContact O-CD2 3.25Å; S386-H390 PolarHBondContact O-N 3.07Å; V387-H390 PolarHBondContact O-N 3.23Å; F388-H390 PolarHBondContact O-N 3.14Å; H390-N394 PolarHBondContact O-N 2.99Å; H390-N394 VanDerWaalsContact O-N 3.09Å
391I68.5Low70.8Confident57 Ų5758.6 Ų58.629%0.29230%0.301SS..Hα-helixtrans-63.3-47.6174.8-66.4169.9000109.9V387 F388 E389 V393 N394 V395 V594V387-I391 WeakPolarHBondContact O-CG1 3.34Å; V387-I391 PolarHBondContact O-N 3.17Å; V387-I391 VanDerWaalsContact O-N 3.11Å; F388-I391 PolarHBondContact O-N 2.89Å; E389-I391 VanDerWaalsContact C-N 3.34Å; E389-I391 PolarHBondContact O-N 2.93Å; I391-V393 PolarHBondContact O-N 3.24Å; I391-N394 PolarHBondContact O-N 3.13Å; I391-V395 WeakPolarHBondContact O-CG2 3.49Å; I391-V395 PolarHBondContact O-N 3.31Å; I391-V395 VanDerWaalsContact O-N 3.09Å; I391-V594 HydrophobicContact CD1-CG2 3.49Å; I391-V594 VanDerWaalsContact CD1-CG2 3.49Å
392M73.8Confident70.9Confident15 Ų1559.9 Ų59.97%0.07431%0.31CS..Hα-helixtrans-70.4-30.8-178-66.6-48.2-17800113.4L196 V200 F388 E389 V395 S396 F581L196-M392 HydrophobicContact CD1-SD 4.36Å; L196-M392 HydrophobicContact CD2-CE 4.12Å; L196-M392 HydrophobicContact CD2-SD 3.53Å; L196-M392 VanDerWaalsContact CD2-SD 3.53Å; L196-M392 HydrophobicContact CG-SD 4.41Å; V200-M392 HydrophobicContact CG2-CB 3.63Å; V200-M392 HydrophobicContact CG2-CG 3.71Å; F388-M392 HydrophobicContact CD1-CG 4.31Å; F388-M392 HydrophobicContact CD2-CE 4.27Å; F388-M392 HydrophobicContact CE1-CE 4.18Å; F388-M392 HydrophobicContact CE1-CG 4.05Å; F388-M392 HydrophobicContact CE2-CE 3.33Å; F388-M392 HydrophobicContact CE2-CG 4.33Å; F388-M392 HydrophobicContact CZ-CE 3.29Å; F388-M392 HydrophobicContact CZ-CG 4.08Å; F388-M392 WeakPolarHBondContact O-CB 3.14Å; F388-M392 WeakPolarHBondContact O-CG 3.45Å; F388-M392 PolarHBondContact O-N 3.13Å; E389-M392 CarbonylContact O-C 3.59Å; E389-M392 PolarHBondContact O-N 3.39Å; M392-V395 PolarHBondContact O-N 3.5Å; M392-S396 WeakPolarHBondContact O-CB 3.2Å; M392-S396 PolarHBondContact O-N 3.43Å; M392-F581 HydrophobicContact CE-CE1 4.37Å; M392-F581 HydrophobicContact CE-CE2 4.39Å; M392-F581 HydrophobicContact CE-CZ 3.71Å
393V74.3Confident71.1Confident66 Ų6655.6 Ų55.640%0.429%0.289SS..Hα-helixtrans-68.8-37.5173166.50000110.4E389 I391 S396 T397E389-V393 HydrophobicContact CG-CG2 3.96Å; E389-V393 VanDerWaalsContact O-CB 3.22Å; E389-V393 WeakPolarHBondContact O-CB 3.38Å; E389-V393 WeakPolarHBondContact O-CG2 3.48Å; E389-V393 PolarHBondContact O-N 2.81Å; I391-V393 PolarHBondContact O-N 3.24Å; V393-S396 PolarHBondContact O-N 3.26Å; V393-T397 WeakPolarHBondContact O-CB 3.16Å; V393-T397 PolarHBondContact O-N 3.18Å; V393-T397 PolarHBondContact O-OG1 2.95Å
394N68.3Low71Confident108 Ų10855.2 Ų55.258%0.57829%0.29SS*.Hα-helixtrans-65.4-43174-74.8-11.1000111.4H390 I391 T398H390-N394 PolarHBondContact O-N 2.99Å; H390-N394 VanDerWaalsContact O-N 3.09Å; I391-N394 PolarHBondContact O-N 3.13Å; N394-T398 WeakPolarHBondContact O-CB 3.09Å; N394-T398 PolarHBondContact O-N 3.35Å; N394-T398 PolarHBondContact O-OG1 3.37Å
395V71.7Confident70.8Confident56 Ų5659.3 Ų59.334%0.33931%0.305SS..Hα-helixtrans-64.7-48174.9179.10000110.4F192 L196 I391 M392 T397 T398 L399F192-V395 HydrophobicContact CE1-CG1 4.25Å; L196-V395 HydrophobicContact CD1-CB 4.05Å; L196-V395 HydrophobicContact CD1-CG1 3.66Å; I391-V395 WeakPolarHBondContact O-CG2 3.49Å; I391-V395 PolarHBondContact O-N 3.31Å; I391-V395 VanDerWaalsContact O-N 3.09Å; M392-V395 PolarHBondContact O-N 3.5Å; V395-T397 PolarHBondContact O-N 2.79Å; V395-T398 WeakPolarHBondContact O-CB 3.43Å; V395-T398 PolarHBondContact O-N 3.21Å; V395-T398 VanDerWaalsContact O-N 3.12Å; V395-L399 HydrophobicContact CG1-CD1 3.87Å; V395-L399 HydrophobicContact CG1-CG 4.3Å; V395-L399 VanDerWaalsContact O-CG 3.28Å; V395-L399 WeakPolarHBondContact O-CG 3.36Å; V395-L399 PolarHBondContact O-N 3.28Å
396S75.9Confident70.3Confident18 Ų1860 Ų6013%0.12631%0.309CS..Hα-helixtrans-59.4-43.6177.4175.60000111.9M392 V393 T398 L399 K400M392-S396 WeakPolarHBondContact O-CB 3.2Å; M392-S396 PolarHBondContact O-N 3.43Å; V393-S396 PolarHBondContact O-N 3.26Å; S396-T398 VanDerWaalsContact C-N 3.31Å; S396-T398 PolarHBondContact O-N 3.11Å; S396-L399 CarbonylContact O-C 3.55Å; S396-L399 PolarHBondContact O-N 2.99Å; S396-K400 WeakPolarHBondContact O-CB 2.97Å; S396-K400 WeakPolarHBondContact O-CG 3.35Å; S396-K400 PolarHBondContact O-N 3.33Å
397T73.9Confident69.8Low80 Ų8059.5 Ų59.549%0.49131%0.305SS..Hα-helixtrans-63.7-38.4175.7-57.30000111.1V393 V395 K400 F401V393-T397 WeakPolarHBondContact O-CB 3.16Å; V393-T397 PolarHBondContact O-N 3.18Å; V393-T397 PolarHBondContact O-OG1 2.95Å; V395-T397 PolarHBondContact O-N 2.79Å; T397-K400 PolarHBondContact O-N 2.82Å; T397-F401 WeakPolarHBondContact O-CB 3.38Å; T397-F401 PolarHBondContact O-N 3.36Å
398T67.3Low68.8Low77 Ų7764 Ų6447%0.47233%0.327SS..Hα-helixtrans-67-42.1175-54.60000111.2N394 V395 S396 K400 F401 I402N394-T398 WeakPolarHBondContact O-CB 3.09Å; N394-T398 PolarHBondContact O-N 3.35Å; N394-T398 PolarHBondContact O-OG1 3.37Å; V395-T398 WeakPolarHBondContact O-CB 3.43Å; V395-T398 PolarHBondContact O-N 3.21Å; V395-T398 VanDerWaalsContact O-N 3.12Å; S396-T398 VanDerWaalsContact C-N 3.31Å; S396-T398 PolarHBondContact O-N 3.11Å; T398-K400 VanDerWaalsContact C-N 3.35Å; T398-F401 PolarHBondContact O-N 3.37Å; T398-I402 HydrophobicContact CG2-CD1 4.03Å; T398-I402 VanDerWaalsContact O-CG1 3.23Å; T398-I402 WeakPolarHBondContact O-CG1 3.4Å; T398-I402 PolarHBondContact O-N 3.14Å
399L71.6Confident67.6Low22 Ų2266.9 Ų66.912%0.11534%0.341CS..Hα-helixtrans-66.6-37175.5-67.5167.5000111.8L189 F192 L196 V395 S396 I402 R403L189-L399 HydrophobicContact CD2-CB 4.48Å; L189-L399 HydrophobicContact CD2-CD2 3.51Å; F192-L399 HydrophobicContact CB-CD1 4.48Å; F192-L399 HydrophobicContact CD1-CD1 3.23Å; F192-L399 HydrophobicContact CD1-CD2 4.5Å; F192-L399 HydrophobicContact CD1-CG 4.49Å; F192-L399 HydrophobicContact CE1-CD1 3.67Å; F192-L399 HydrophobicContact CG-CD1 4.13Å; L196-L399 HydrophobicContact CD1-CD1 3.99Å; V395-L399 HydrophobicContact CG1-CD1 3.87Å; V395-L399 HydrophobicContact CG1-CG 4.3Å; V395-L399 VanDerWaalsContact O-CG 3.28Å; V395-L399 WeakPolarHBondContact O-CG 3.36Å; V395-L399 PolarHBondContact O-N 3.28Å; S396-L399 CarbonylContact O-C 3.55Å; S396-L399 PolarHBondContact O-N 2.99Å; L399-I402 PolarHBondContact O-N 3.49Å; L399-R403 VanDerWaalsContact O-CB 3.25Å; L399-R403 WeakPolarHBondContact O-CB 3.41Å; L399-R403 PolarHBondContact O-N 3.32Å
400K73.8Confident66.1Low88 Ų8866.5 Ų66.538%0.38334%0.34SS..Hα-helixtrans-63.1-46.7170.5-79.2179.4-175.1174.80110.5E193 S396 T397 T398 I402 R403 D404E193-K400 WeakPolarHBondContact OE1-CE 3.42Å; E193-K400 IonicContact OE1-NZ 3.6Å; E193-K400 PolarHBondContact OE1-NZ 3.41Å; S396-K400 WeakPolarHBondContact O-CB 2.97Å; S396-K400 WeakPolarHBondContact O-CG 3.35Å; S396-K400 PolarHBondContact O-N 3.33Å; T397-K400 PolarHBondContact O-N 2.82Å; T398-K400 VanDerWaalsContact C-N 3.35Å; K400-I402 VanDerWaalsContact C-N 3.28Å; K400-I402 PolarHBondContact O-N 3.16Å; K400-R403 CarbonylContact O-C 3.56Å; K400-R403 PolarHBondContact O-N 2.94Å; K400-D404 WeakPolarHBondContact O-CA 3.36Å; K400-D404 WeakPolarHBondContact O-CB 3.17Å; K400-D404 PolarHBondContact O-N 3.37Å
401F71.3Confident65Low111 Ų11165 Ų6549%0.48734%0.337SS..Hα-helixtrans-60.4-38.6175.5176.9-100.7000112.4T397 T398 R405T397-F401 WeakPolarHBondContact O-CB 3.38Å; T397-F401 PolarHBondContact O-N 3.36Å; T398-F401 PolarHBondContact O-N 3.37Å; F401-R405 HydrophobicContact CZ-CG 4.42Å; F401-R405 PolarHBondContact O-N 2.85Å
402I67.3Low64.3Low68 Ų6871 Ų7135%0.34936%0.363SS..Hα-helixtrans-69.4-43.4174.7-67.5164.3000110.7L189 T398 L399 K400 R405 I406L189-I402 HydrophobicContact CD1-CG2 3.98Å; L189-I402 HydrophobicContact CD2-CG2 4.47Å; T398-I402 HydrophobicContact CG2-CD1 4.03Å; T398-I402 VanDerWaalsContact O-CG1 3.23Å; T398-I402 WeakPolarHBondContact O-CG1 3.4Å; T398-I402 PolarHBondContact O-N 3.14Å; L399-I402 PolarHBondContact O-N 3.49Å; K400-I402 VanDerWaalsContact C-N 3.28Å; K400-I402 PolarHBondContact O-N 3.16Å; I402-R405 CarbonylContact O-C 3.53Å; I402-R405 PolarHBondContact O-N 2.95Å; I402-I406 HydrophobicContact CG2-CD1 3.65Å; I402-I406 WeakPolarHBondContact O-CB 3.34Å; I402-I406 WeakPolarHBondContact O-CD1 3.49Å; I402-I406 VanDerWaalsContact O-CG1 3.25Å; I402-I406 WeakPolarHBondContact O-CG1 3.31Å; I402-I406 PolarHBondContact O-N 3.42Å
403R71.5Confident63.2Low41 Ų4177.3 Ų77.316%0.15539%0.393CS..Hα-helixtrans-63.5-44.7176.3-173.9-170.6-62.2149.914111N186 L189 E193 L399 K400 R405 I406 S407N186-R403 WeakPolarHBondContact OD1-CG 3.5Å; L189-R403 VanDerWaalsContact C-NH2 3.29Å; L189-R403 HydrophobicContact CD1-CB 4.07Å; L189-R403 PolarHBondContact O-NH2 3.08Å; E193-R403 IonicContact OE2-CZ 3.53Å; E193-R403 IonicContact OE2-NH1 2.75Å; E193-R403 PolarHBondContact OE2-NH1 3.21Å; E193-R403 IonicContact OE2-NH2 3.89Å; E193-R403 PolarHBondContact OE2-NH2 3.46Å; L399-R403 VanDerWaalsContact O-CB 3.25Å; L399-R403 WeakPolarHBondContact O-CB 3.41Å; L399-R403 PolarHBondContact O-N 3.32Å; K400-R403 CarbonylContact O-C 3.56Å; K400-R403 PolarHBondContact O-N 2.94Å; R403-R405 VanDerWaalsContact C-N 3.34Å; R403-I406 CarbonylContact O-C 3.38Å; R403-I406 WeakPolarHBondContact O-CA 3.39Å; R403-I406 WeakPolarHBondContact O-CB 3.45Å; R403-I406 PolarHBondContact O-N 3.34Å; R403-I406 VanDerWaalsContact O-N 3.09Å; R403-S407 VanDerWaalsContact O-CB 3.3Å; R403-S407 WeakPolarHBondContact O-CB 3.07Å; R403-S407 PolarHBondContact O-N 3.17Å; R403-S407 PolarHBondContact O-OG 2.98Å
404D66.3Low62.2Low70 Ų7076.9 Ų76.937%0.37439%0.387SS..Hα-helixtrans-58.5-49.1173.5-75.2-5.6000107.3K400 I406 S407 L408K400-D404 WeakPolarHBondContact O-CA 3.36Å; K400-D404 WeakPolarHBondContact O-CB 3.17Å; K400-D404 PolarHBondContact O-N 3.37Å; D404-I406 VanDerWaalsContact C-N 3.29Å; D404-I406 PolarHBondContact O-N 3.35Å; D404-S407 VanDerWaalsContact CA-OG 3.31Å; D404-S407 WeakPolarHBondContact CA-OG 3.32Å; D404-S407 CarbonylContact O-C 3.52Å; D404-S407 VanDerWaalsContact O-C 3.31Å; D404-S407 WeakPolarHBondContact O-CA 3.21Å; D404-S407 PolarHBondContact O-N 2.87Å; D404-S407 PolarHBondContact O-OG 3Å; D404-L408 HydrophobicContact CB-CD1 3.64Å; D404-L408 WeakPolarHBondContact O-CA 3.47Å; D404-L408 WeakPolarHBondContact O-CB 3.42Å; D404-L408 PolarHBondContact O-N 3.41Å
405R63.5Low61.9Low96 Ų9673.2 Ų73.236%0.36237%0.368SS..Hα-helixtrans-63.4-31.8172.1-81.5-142.8-84.8-157.5-4.5115.5F401 I402 R403 S407F401-R405 HydrophobicContact CZ-CG 4.42Å; F401-R405 PolarHBondContact O-N 2.85Å; I402-R405 CarbonylContact O-C 3.53Å; I402-R405 PolarHBondContact O-N 2.95Å; R403-R405 VanDerWaalsContact C-N 3.34Å; R405-S407 PolarHBondContact O-N 2.62Å
406I61.9Low61.8Low16 Ų1673.5 Ų73.58%0.08237%0.367CS..Hα-helixtrans-70.3-21.1172.2-73.4160000111.7I18 N186 L189 I402 R403 D404I18-I406 HydrophobicContact CD1-CB 4.41Å; I18-I406 HydrophobicContact CD1-CG1 3.66Å; I18-I406 HydrophobicContact CG2-CG2 4.04Å; I18-I406 WeakPolarHBondContact CG2-O 3.15Å; N186-I406 HydrophobicContact CB-CG2 4.26Å; L189-I406 HydrophobicContact CD1-CD1 3.28Å; I402-I406 HydrophobicContact CG2-CD1 3.65Å; I402-I406 WeakPolarHBondContact O-CB 3.34Å; I402-I406 WeakPolarHBondContact O-CD1 3.49Å; I402-I406 VanDerWaalsContact O-CG1 3.25Å; I402-I406 WeakPolarHBondContact O-CG1 3.31Å; I402-I406 PolarHBondContact O-N 3.42Å; R403-I406 CarbonylContact O-C 3.38Å; R403-I406 WeakPolarHBondContact O-CA 3.39Å; R403-I406 WeakPolarHBondContact O-CB 3.45Å; R403-I406 PolarHBondContact O-N 3.34Å; R403-I406 VanDerWaalsContact O-N 3.09Å; D404-I406 VanDerWaalsContact C-N 3.29Å; D404-I406 PolarHBondContact O-N 3.35Å
407S59.6Low61.7Low29 Ų2978.4 Ų78.420%0.20339%0.388CS..Hα-helixtrans-113.1-60.4-176.857.30000113R403 D404 R405 E409 I410R403-S407 VanDerWaalsContact O-CB 3.3Å; R403-S407 WeakPolarHBondContact O-CB 3.07Å; R403-S407 PolarHBondContact O-N 3.17Å; R403-S407 PolarHBondContact O-OG 2.98Å; D404-S407 VanDerWaalsContact CA-OG 3.31Å; D404-S407 WeakPolarHBondContact CA-OG 3.32Å; D404-S407 CarbonylContact O-C 3.52Å; D404-S407 VanDerWaalsContact O-C 3.31Å; D404-S407 WeakPolarHBondContact O-CA 3.21Å; D404-S407 PolarHBondContact O-N 2.87Å; D404-S407 PolarHBondContact O-OG 3Å; R405-S407 PolarHBondContact O-N 2.62Å; S407-E409 PolarHBondContact O-N 3.38Å; S407-I410 VanDerWaalsContact O-CB 3.24Å; S407-I410 WeakPolarHBondContact O-CB 3.47Å; S407-I410 WeakPolarHBondContact O-CD1 3.47Å; S407-I410 WeakPolarHBondContact O-CG1 3.36Å; S407-I410 PolarHBondContact O-N 3.38Å
408L46Very low61.8Low126 Ų12676 Ų7666%0.6637%0.37SS*.Hα-helixtrans-54.4-10.9178.1-89.8148.8000118.4D404 I410D404-L408 HydrophobicContact CB-CD1 3.64Å; D404-L408 WeakPolarHBondContact O-CA 3.47Å; D404-L408 WeakPolarHBondContact O-CB 3.42Å; D404-L408 PolarHBondContact O-N 3.41Å; L408-I410 PolarHBondContact O-N 2.98Å
409E46.9Very low62.3Low62 Ų6275.1 Ų75.129%0.2936%0.362SS..THydrogen-bonded Turntrans-73.52.8163.7-123.491.8-146.700112.1D17 S407 N411 I414D17-E409 HydrophobicContact CB-CG 4.27Å; S407-E409 PolarHBondContact O-N 3.38Å; E409-N411 PolarHBondContact O-N 2.98Å; E409-I414 HydrophobicContact CB-CG2 4.49Å; E409-I414 HydrophobicContact CG-CD1 4.22Å; E409-I414 HydrophobicContact CG-CG2 4.05Å; E409-I414 VanDerWaalsContact O-CB 3.31Å; E409-I414 WeakPolarHBondContact O-CB 3.46Å; E409-I414 WeakPolarHBondContact O-CG2 3.08Å
410I44.9Very low62.8Low62 Ų6279.5 Ų79.532%0.31838%0.378SS..  trans-67.669.2157.1-54.2150.4000109.8V20 S407 L408V20-I410 HydrophobicContact CB-CD1 4.12Å; V20-I410 WeakPolarHBondContact O-CD1 3.49Å; V20-I410 WeakPolarHBondContact O-CG1 2.77Å; S407-I410 VanDerWaalsContact O-CB 3.24Å; S407-I410 WeakPolarHBondContact O-CB 3.47Å; S407-I410 WeakPolarHBondContact O-CD1 3.47Å; S407-I410 WeakPolarHBondContact O-CG1 3.36Å; S407-I410 PolarHBondContact O-N 3.38Å; L408-I410 PolarHBondContact O-N 2.98Å
411N46.9Very low63.2Low98 Ų9877.8 Ų77.852%0.52438%0.379SS..  trans-79.7139135.6-86.8-19.1000106.3E409 E413 I414 N415E409-N411 PolarHBondContact O-N 2.98Å; N411-E413 PolarHBondContact O-N 2.85Å; N411-I414 HydrophobicContact CB-CB 4.34Å; N411-I414 HydrophobicContact CB-CD1 4.17Å; N411-I414 HydrophobicContact CB-CG1 4.09Å; N411-I414 PolarHBondContact O-N 3.43Å; N411-N415 PolarHBondContact O-N 3.07Å
412E52.7Low63.9Low182 Ų18272.9 Ų72.985%0.8536%0.359SS*.Hα-helixtrans-49.6-32.3173.7-146.3171.8-164.200110.8D416E412-D416 PolarHBondContact O-N 2.83Å
413E51.7Low64.8Low148 Ų14873.1 Ų73.169%0.69236%0.358SS*.Hα-helixtrans-69.7-45.3173.1-113.4178.1171.200115.3N411 D416 H417N411-E413 PolarHBondContact O-N 2.85Å; E413-D416 PolarHBondContact O-N 3.28Å; E413-H417 PolarHBondContact O-CD2 2.87Å; E413-H417 VanDerWaalsContact O-CD2 3.23Å; E413-H417 PolarHBondContact O-N 3.06Å
414I53.1Low65.7Low56 Ų5679.3 Ų79.329%0.28738%0.383SS..Hα-helixtrans-73.4-36.9-177.2-65.1172.8000110.3E409 N411 D416 H417 Y418E409-I414 HydrophobicContact CB-CG2 4.49Å; E409-I414 HydrophobicContact CG-CD1 4.22Å; E409-I414 HydrophobicContact CG-CG2 4.05Å; E409-I414 VanDerWaalsContact O-CB 3.31Å; E409-I414 WeakPolarHBondContact O-CB 3.46Å; E409-I414 WeakPolarHBondContact O-CG2 3.08Å; N411-I414 HydrophobicContact CB-CB 4.34Å; N411-I414 HydrophobicContact CB-CD1 4.17Å; N411-I414 HydrophobicContact CB-CG1 4.09Å; N411-I414 PolarHBondContact O-N 3.43Å; I414-D416 VanDerWaalsContact C-N 3.3Å; I414-D416 PolarHBondContact O-N 2.9Å; I414-H417 WeakPolarHBondContact O-CB 3.27Å; I414-H417 PolarHBondContact O-N 3.46Å; I414-H417 VanDerWaalsContact O-N 3.13Å; I414-Y418 PolarHBondContact O-N 3.28Å
415N62.8Low66.9Low31 Ų3179.6 Ų79.617%0.16639%0.387CS..Hα-helixtrans-60.5-41.6175.2-171.210.6000111.3A19 C21 N411 H417 Y418 L419A19-N415 HydrophobicContact CB-CB 4.12Å; A19-N415 VanDerWaalsContact CB-CG 3.47Å; A19-N415 WeakPolarHBondContact CB-OD1 3.33Å; C21-N415 PolarHBondContact SG-ND2 3.4Å; N411-N415 PolarHBondContact O-N 3.07Å; N415-H417 VanDerWaalsContact C-N 3.34Å; N415-H417 PolarHBondContact O-N 3.44Å; N415-Y418 PolarHBondContact O-N 3.41Å; N415-L419 VanDerWaalsContact O-CB 3.24Å; N415-L419 WeakPolarHBondContact O-CB 3.05Å; N415-L419 PolarHBondContact O-N 3.45Å
416D69.2Low68.2Low62 Ų6276.5 Ų76.533%0.33238%0.377SS..Hα-helixtrans-62.7-39.9174.5-177.348.4000111.5E412 E413 I414 R420E412-D416 PolarHBondContact O-N 2.83Å; E413-D416 PolarHBondContact O-N 3.28Å; I414-D416 VanDerWaalsContact C-N 3.3Å; I414-D416 PolarHBondContact O-N 2.9Å; D416-R420 VanDerWaalsContact CG-CZ 3.41Å; D416-R420 VanDerWaalsContact CG-NE 3.29Å; D416-R420 VanDerWaalsContact CG-NH2 3.29Å; D416-R420 WeakPolarHBondContact O-CB 3.08Å; D416-R420 WeakPolarHBondContact O-CD 3.31Å; D416-R420 WeakPolarHBondContact O-CG 3.04Å; D416-R420 PolarHBondContact O-N 3.47Å; D416-R420 IonicContact OD1-CZ 3.96Å; D416-R420 VanDerWaalsContact OD1-CZ 3.28Å; D416-R420 IonicContact OD1-NE 3.99Å; D416-R420 PolarHBondContact OD1-NE 3.44Å; D416-R420 IonicContact OD1-NH2 3.16Å; D416-R420 PolarHBondContact OD1-NH2 3.46Å; D416-R420 VanDerWaalsContact OD1-NH2 3.12Å; D416-R420 IonicContact OD2-CZ 3.13Å; D416-R420 IonicContact OD2-NE 3.17Å; D416-R420 PolarHBondContact OD2-NE 2.94Å; D416-R420 VanDerWaalsContact OD2-NE 3.16Å; D416-R420 IonicContact OD2-NH1 3.97Å; D416-R420 PolarHBondContact OD2-NH1 2.76Å; D416-R420 IonicContact OD2-NH2 2.82Å; D416-R420 PolarHBondContact OD2-NH2 3.24Å
417H74.4Confident69.7Low122 Ų12282.8 Ų82.857%0.56540%0.401SS*.Hα-helixtrans-64.7-44.7173.9-79.1-61000113.5E413 I414 N415 A421E413-H417 PolarHBondContact O-CD2 2.87Å; E413-H417 VanDerWaalsContact O-CD2 3.23Å; E413-H417 PolarHBondContact O-N 3.06Å; I414-H417 WeakPolarHBondContact O-CB 3.27Å; I414-H417 PolarHBondContact O-N 3.46Å; I414-H417 VanDerWaalsContact O-N 3.13Å; N415-H417 VanDerWaalsContact C-N 3.34Å; N415-H417 PolarHBondContact O-N 3.44Å; H417-A421 WeakPolarHBondContact O-CB 3.45Å; H417-A421 PolarHBondContact O-N 3.14Å
418Y75.1Confident71.3Confident29 Ų2983.4 Ų83.411%0.11441%0.412CS..Hα-helixtrans-64.4-51.3178.3172.7-99.1000111.5D17 A19 F182 I414 N415 R420 A421 V422D17-Y418 WeakPolarHBondContact O-CD2 3.42Å; D17-Y418 WeakPolarHBondContact O-CE2 3.39Å; A19-Y418 HydrophobicContact CB-CD1 4.18Å; F182-Y418 WeakPolarHBondContact CE2-OH 3.22Å; F182-Y418 WeakPolarHBondContact CZ-OH 3.48Å; I414-Y418 PolarHBondContact O-N 3.28Å; N415-Y418 PolarHBondContact O-N 3.41Å; Y418-R420 VanDerWaalsContact C-N 3.28Å; Y418-R420 PolarHBondContact O-N 2.74Å; Y418-A421 WeakPolarHBondContact O-CA 3.41Å; Y418-A421 WeakPolarHBondContact O-CB 3.48Å; Y418-A421 PolarHBondContact O-N 2.73Å; Y418-V422 HydrophobicContact CD1-CG2 4.26Å; Y418-V422 HydrophobicContact CD2-CG2 4.29Å; Y418-V422 HydrophobicContact CE1-CG2 3.72Å; Y418-V422 HydrophobicContact CE2-CG2 3.77Å; Y418-V422 VanDerWaalsContact CZ-CG2 3.45Å; Y418-V422 WeakPolarHBondContact O-CG2 3.43Å; Y418-V422 PolarHBondContact O-N 3.46Å
419L77.4Confident73.5Confident58 Ų5877.8 Ų77.830%0.30439%0.385SS..Hα-helixtrans-59.5-43.2179.9-17464.7000110.3V173 N415 A421 V422 E423V173-L419 HydrophobicContact CG1-CD1 3.75Å; V173-L419 HydrophobicContact CG2-CD1 3.97Å; N415-L419 VanDerWaalsContact O-CB 3.24Å; N415-L419 WeakPolarHBondContact O-CB 3.05Å; N415-L419 PolarHBondContact O-N 3.45Å; L419-A421 PolarHBondContact O-N 3.18Å; L419-V422 PolarHBondContact O-N 2.94Å; L419-E423 WeakPolarHBondContact O-CB 3.48Å; L419-E423 VanDerWaalsContact O-CG 3.31Å; L419-E423 WeakPolarHBondContact O-CG 3.43Å; L419-E423 PolarHBondContact O-N 3.4Å
420R82.5Confident75.8Confident115 Ų11576.8 Ų76.843%0.43438%0.383SS..Hα-helixtrans-61-41.6172.8-74.8173.1-172.1-174.73112.7D416 Y418 V422 E423 Y424D416-R420 VanDerWaalsContact CG-CZ 3.41Å; D416-R420 VanDerWaalsContact CG-NE 3.29Å; D416-R420 VanDerWaalsContact CG-NH2 3.29Å; D416-R420 WeakPolarHBondContact O-CB 3.08Å; D416-R420 WeakPolarHBondContact O-CD 3.31Å; D416-R420 WeakPolarHBondContact O-CG 3.04Å; D416-R420 PolarHBondContact O-N 3.47Å; D416-R420 IonicContact OD1-CZ 3.96Å; D416-R420 VanDerWaalsContact OD1-CZ 3.28Å; D416-R420 IonicContact OD1-NE 3.99Å; D416-R420 PolarHBondContact OD1-NE 3.44Å; D416-R420 IonicContact OD1-NH2 3.16Å; D416-R420 PolarHBondContact OD1-NH2 3.46Å; D416-R420 VanDerWaalsContact OD1-NH2 3.12Å; D416-R420 IonicContact OD2-CZ 3.13Å; D416-R420 IonicContact OD2-NE 3.17Å; D416-R420 PolarHBondContact OD2-NE 2.94Å; D416-R420 VanDerWaalsContact OD2-NE 3.16Å; D416-R420 IonicContact OD2-NH1 3.97Å; D416-R420 PolarHBondContact OD2-NH1 2.76Å; D416-R420 IonicContact OD2-NH2 2.82Å; D416-R420 PolarHBondContact OD2-NH2 3.24Å; Y418-R420 VanDerWaalsContact C-N 3.28Å; Y418-R420 PolarHBondContact O-N 2.74Å; R420-V422 VanDerWaalsContact C-N 3.35Å; R420-E423 PolarHBondContact O-N 3.48Å; R420-Y424 HydrophobicContact CB-CE2 4.21Å; R420-Y424 WeakPolarHBondContact O-CB 3.32Å; R420-Y424 WeakPolarHBondContact O-CD2 3.24Å; R420-Y424 PolarHBondContact O-N 2.99Å
421A82.7Confident78.1Confident51 Ų5176.7 Ų76.742%0.42139%0.391SS..Hα-helixtrans-62.5-43.7177.200000111.3H417 Y418 L419 Y424 V425H417-A421 WeakPolarHBondContact O-CB 3.45Å; H417-A421 PolarHBondContact O-N 3.14Å; Y418-A421 WeakPolarHBondContact O-CA 3.41Å; Y418-A421 WeakPolarHBondContact O-CB 3.48Å; Y418-A421 PolarHBondContact O-N 2.73Å; L419-A421 PolarHBondContact O-N 3.18Å; A421-Y424 PolarHBondContact O-N 3.21Å; A421-V425 WeakPolarHBondContact O-CG2 3.21Å; A421-V425 PolarHBondContact O-N 2.83Å
422V85.3Confident80.4Confident9 Ų973.2 Ų73.26%0.05537%0.372CS..Hα-helixtrans-65.2-40.9175.91750000111.5L172 V173 Y418 L419 R420 V425 L426L172-V422 HydrophobicContact CB-CG1 3.89Å; L172-V422 HydrophobicContact CB-CG2 4.42Å; L172-V422 HydrophobicContact CD1-CG1 3.84Å; L172-V422 HydrophobicContact CD1-CG2 4.16Å; V173-V422 HydrophobicContact CG2-CB 4.47Å; V173-V422 HydrophobicContact CG2-CG1 3.6Å; Y418-V422 HydrophobicContact CD1-CG2 4.26Å; Y418-V422 HydrophobicContact CD2-CG2 4.29Å; Y418-V422 HydrophobicContact CE1-CG2 3.72Å; Y418-V422 HydrophobicContact CE2-CG2 3.77Å; Y418-V422 VanDerWaalsContact CZ-CG2 3.45Å; Y418-V422 WeakPolarHBondContact O-CG2 3.43Å; Y418-V422 PolarHBondContact O-N 3.46Å; L419-V422 PolarHBondContact O-N 2.94Å; R420-V422 VanDerWaalsContact C-N 3.35Å; V422-V425 WeakPolarHBondContact O-CB 3.16Å; V422-V425 PolarHBondContact O-N 3.2Å; V422-L426 PolarHBondContact O-N 3.19Å
423E87.6Confident82.5Confident73 Ų7364.5 Ų64.534%0.34133%0.332SS..Hα-helixtrans-62.4-42.1173.1-77179.3-17800112L419 R420 V425 L426 Y427L419-E423 WeakPolarHBondContact O-CB 3.48Å; L419-E423 VanDerWaalsContact O-CG 3.31Å; L419-E423 WeakPolarHBondContact O-CG 3.43Å; L419-E423 PolarHBondContact O-N 3.4Å; R420-E423 PolarHBondContact O-N 3.48Å; E423-V425 VanDerWaalsContact C-N 3.3Å; E423-V425 PolarHBondContact O-N 3.4Å; E423-L426 WeakPolarHBondContact O-CA 3.43Å; E423-L426 WeakPolarHBondContact O-CB 3.45Å; E423-L426 PolarHBondContact O-N 3.38Å; E423-L426 VanDerWaalsContact O-N 3.12Å; E423-Y427 HydrophobicContact CB-CD2 4.43Å; E423-Y427 HydrophobicContact CB-CE2 4.14Å; E423-Y427 WeakPolarHBondContact O-CD2 3.32Å; E423-Y427 PolarHBondContact O-N 2.99Å
424Y90.3Very high84.6Confident170 Ų17060.3 Ų60.367%0.66732%0.318SS*.Hα-helixtrans-63.5-36.9174.6-72.9-49.8000112R420 A421 L426 G428R420-Y424 HydrophobicContact CB-CE2 4.21Å; R420-Y424 WeakPolarHBondContact O-CB 3.32Å; R420-Y424 WeakPolarHBondContact O-CD2 3.24Å; R420-Y424 PolarHBondContact O-N 2.99Å; A421-Y424 PolarHBondContact O-N 3.21Å; Y424-L426 VanDerWaalsContact C-N 3.34Å; Y424-G428 WeakPolarHBondContact O-CA 3.43Å; Y424-G428 PolarHBondContact O-N 3.31Å
425V89.9Confident86.6Confident77 Ų7759.3 Ų59.347%0.46731%0.313SS..Hα-helixtrans-64.4-40.2172.3171.60000110.7H165 A421 V422 E423 G429H165-V425 PolarHBondContact CE1-O 3.29Å; H165-V425 VanDerWaalsContact CE1-O 3.3Å; H165-V425 PolarHBondContact NE2-O 2.79Å; A421-V425 WeakPolarHBondContact O-CG2 3.21Å; A421-V425 PolarHBondContact O-N 2.83Å; V422-V425 WeakPolarHBondContact O-CB 3.16Å; V422-V425 PolarHBondContact O-N 3.2Å; E423-V425 VanDerWaalsContact C-N 3.3Å; E423-V425 PolarHBondContact O-N 3.4Å; V425-G429 PolarHBondContact O-N 3.46Å
426L92.1Very high88.2Confident30 Ų3057.8 Ų57.816%0.15731%0.305CS..Hα-helixtrans-59.1-59.4174.1176.165.5000111H165 H169 V422 E423 Y424 G428 G429 V430H165-L426 WeakPolarHBondContact NE2-CA 3.44Å; H165-L426 PolarHBondContact NE2-O 3.29Å; H169-L426 HydrophobicContact CB-CD1 3.92Å; V422-L426 PolarHBondContact O-N 3.19Å; E423-L426 WeakPolarHBondContact O-CA 3.43Å; E423-L426 WeakPolarHBondContact O-CB 3.45Å; E423-L426 PolarHBondContact O-N 3.38Å; E423-L426 VanDerWaalsContact O-N 3.12Å; Y424-L426 VanDerWaalsContact C-N 3.34Å; L426-G428 VanDerWaalsContact C-N 3.31Å; L426-G428 PolarHBondContact O-N 2.91Å; L426-G429 PolarHBondContact O-N 3.48Å; L426-V430 HydrophobicContact CD1-CG2 4.25Å; L426-V430 WeakPolarHBondContact O-CG2 3.43Å; L426-V430 PolarHBondContact O-N 3.03Å
427Y93.7Very high89.5Confident148 Ų14858 Ų5858%0.5831%0.306SS*.Hα-helixtrans-61.9-39-177.9-66.2-55.8000112.2E423 V430 A431E423-Y427 HydrophobicContact CB-CD2 4.43Å; E423-Y427 HydrophobicContact CB-CE2 4.14Å; E423-Y427 WeakPolarHBondContact O-CD2 3.32Å; E423-Y427 PolarHBondContact O-N 2.99Å; Y427-V430 PolarHBondContact O-N 3.28Å; Y427-A431 WeakPolarHBondContact O-CB 3.45Å; Y427-A431 PolarHBondContact O-N 3.07Å
428G92.4Very high90.6Very high42 Ų4256.2 Ų56.243%0.43330%0.3SS..Hα-helixtrans-61.4-45.3175.400000112.4Y424 L426 A431 L432Y424-G428 WeakPolarHBondContact O-CA 3.43Å; Y424-G428 PolarHBondContact O-N 3.31Å; L426-G428 VanDerWaalsContact C-N 3.31Å; L426-G428 PolarHBondContact O-N 2.91Å; G428-A431 PolarHBondContact O-N 2.88Å; G428-L432 VanDerWaalsContact O-CB 3.32Å; G428-L432 WeakPolarHBondContact O-CB 3.32Å; G428-L432 PolarHBondContact O-N 3.46Å
429G93Very high91.6Very high8 Ų854.9 Ų54.98%0.08230%0.295CS..Hα-helixtrans-69.1-37.2176.300000113.3H165 V425 L426 L432 L433H165-G429 WeakPolarHBondContact NE2-CA 3.36Å; V425-G429 PolarHBondContact O-N 3.46Å; L426-G429 PolarHBondContact O-N 3.48Å; G429-L432 WeakPolarHBondContact O-CB 3.35Å; G429-L432 PolarHBondContact O-N 2.93Å; G429-L433 WeakPolarHBondContact O-CB 3.27Å; G429-L433 WeakPolarHBondContact O-CG 3.3Å; G429-L433 PolarHBondContact O-N 3.18Å
430V94.3Very high92.6Very high42 Ų4252.2 Ų52.226%0.25528%0.28SS..Hα-helixtrans-61.1-49.7172.5169.80000110.5F162 L426 Y427 L432 L433 C434F162-V430 HydrophobicContact CE2-CB 4.45Å; F162-V430 HydrophobicContact CE2-CG1 4.06Å; F162-V430 HydrophobicContact CE2-CG2 4.13Å; F162-V430 HydrophobicContact CZ-CG1 4.28Å; F162-V430 HydrophobicContact CZ-CG2 4.07Å; L426-V430 HydrophobicContact CD1-CG2 4.25Å; L426-V430 WeakPolarHBondContact O-CG2 3.43Å; L426-V430 PolarHBondContact O-N 3.03Å; Y427-V430 PolarHBondContact O-N 3.28Å; V430-L432 VanDerWaalsContact C-N 3.3Å; V430-L432 PolarHBondContact O-N 2.71Å; V430-L433 PolarHBondContact O-N 3.07Å; V430-L433 VanDerWaalsContact O-N 3.16Å; V430-C434 PolarHBondContact O-N 2.95Å; V430-C434 PolarHBondContact O-SG 3.23Å
431A93.9Very high93.3Very high60 Ų6051.4 Ų51.450%0.49628%0.284SS..Hα-helixtrans-58.9-42.5177.900000111.9Y427 G428 C434Y427-A431 WeakPolarHBondContact O-CB 3.45Å; Y427-A431 PolarHBondContact O-N 3.07Å; G428-A431 PolarHBondContact O-N 2.88Å; A431-C434 PolarHBondContact O-N 3.38Å
432L94.6Very high94Very high24 Ų2449.8 Ų49.813%0.12627%0.268CS..Hα-helixtrans-60.6-43.9175.6-178.184.4000112G428 G429 V430 I435 P436 I485 L486 S489 F783 L787G428-L432 VanDerWaalsContact O-CB 3.32Å; G428-L432 WeakPolarHBondContact O-CB 3.32Å; G428-L432 PolarHBondContact O-N 3.46Å; G429-L432 WeakPolarHBondContact O-CB 3.35Å; G429-L432 PolarHBondContact O-N 2.93Å; V430-L432 VanDerWaalsContact C-N 3.3Å; V430-L432 PolarHBondContact O-N 2.71Å; L432-I435 WeakPolarHBondContact O-CB 3.49Å; L432-I435 PolarHBondContact O-N 3.38Å; L432-P436 WeakPolarHBondContact O-CD 3.5Å; L432-I485 HydrophobicContact CD1-CG2 4Å; L432-L486 HydrophobicContact CD1-CD2 3.81Å; L432-L486 HydrophobicContact CG-CD2 3.92Å; L432-S489 VanDerWaalsContact CD2-CB 3.47Å; L432-S489 WeakPolarHBondContact CD2-OG 3.46Å; L432-F783 HydrophobicContact CD2-CZ 4.07Å; L432-L787 HydrophobicContact CD2-CD2 4.22Å
433L96Very high94.6Very high0 Ų049.4 Ų49.40%027%0.266CS..Hα-helixtrans-75.9-22.1179.7-68.4176.8000113.5V158 A161 F162 H165 G429 V430 I435 P436 I437 F783 L787V158-L433 HydrophobicContact CG1-CD2 4.37Å; A161-L433 HydrophobicContact CB-CD1 4.36Å; A161-L433 HydrophobicContact CB-CD2 3.91Å; F162-L433 VanDerWaalsContact CA-CD1 3.48Å; F162-L433 HydrophobicContact CB-CD1 3.99Å; F162-L433 HydrophobicContact CD2-CB 4.16Å; F162-L433 HydrophobicContact CD2-CD1 3.94Å; F162-L433 HydrophobicContact CG-CD1 4.32Å; H165-L433 HydrophobicContact CB-CD1 4.31Å; G429-L433 WeakPolarHBondContact O-CB 3.27Å; G429-L433 WeakPolarHBondContact O-CG 3.3Å; G429-L433 PolarHBondContact O-N 3.18Å; V430-L433 PolarHBondContact O-N 3.07Å; V430-L433 VanDerWaalsContact O-N 3.16Å; L433-I435 PolarHBondContact O-N 3.41Å; L433-P436 WeakPolarHBondContact O-CD 3.37Å; L433-P436 VanDerWaalsContact O-CG 3.25Å; L433-P436 WeakPolarHBondContact O-CG 3.25Å; L433-I437 WeakPolarHBondContact O-CG1 3.19Å; L433-I437 PolarHBondContact O-N 3.15Å; L433-F783 HydrophobicContact CD1-CD2 4.43Å; L433-F783 HydrophobicContact CD1-CE2 4.01Å; L433-F783 HydrophobicContact CD2-CE2 4.04Å; L433-F783 HydrophobicContact CG-CE2 4.14Å; L433-L787 HydrophobicContact CD2-CD1 4.45Å
434C96.1Very high95Very high60 Ų6049 Ų4941%0.40526%0.261SS..Hα-helixtrans-66-26.7170.8-72.60000112.7V430 A431 I437 L438V430-C434 PolarHBondContact O-N 2.95Å; V430-C434 PolarHBondContact O-SG 3.23Å; A431-C434 PolarHBondContact O-N 3.38Å; C434-I437 PolarHBondContact O-N 3.49Å; C434-L438 WeakPolarHBondContact O-CB 3.5Å; C434-L438 PolarHBondContact O-N 3.08Å
435I96.4Very high95.3Very high34 Ų3443.8 Ų43.817%0.17425%0.245CC..Hα-helixtrans-59.4-56.7177.4-61.4169.8000111.7L432 L433 I437 L438 I439 F482 L486L432-I435 WeakPolarHBondContact O-CB 3.49Å; L432-I435 PolarHBondContact O-N 3.38Å; L433-I435 PolarHBondContact O-N 3.41Å; I435-I437 VanDerWaalsContact C-N 3.3Å; I435-I437 PolarHBondContact O-N 3.05Å; I435-L438 WeakPolarHBondContact O-CB 3.31Å; I435-L438 PolarHBondContact O-N 3.26Å; I435-I439 HydrophobicContact CG2-CD1 4.22Å; I435-I439 WeakPolarHBondContact O-CG1 3.41Å; I435-I439 PolarHBondContact O-N 3.39Å; I435-F482 HydrophobicContact CD1-CD1 4.1Å; I435-F482 HydrophobicContact CD1-CE1 4.47Å; I435-F482 HydrophobicContact CD1-CG 4.48Å; I435-F482 HydrophobicContact CG2-CB 3.61Å; I435-F482 HydrophobicContact CG2-CD1 4.17Å; I435-F482 HydrophobicContact CG2-CD2 3.55Å; I435-F482 HydrophobicContact CG2-CE2 4.22Å; I435-F482 HydrophobicContact CG2-CG 3.52Å; I435-L486 HydrophobicContact CB-CD2 4.49Å; I435-L486 HydrophobicContact CG2-CD1 4.25Å
436P96.4Very high95.6Very high0 Ų040.1 Ų40.10%022%0.223CC..Hα-helixtrans-64.6-32.7176.924.6-33.8000112.7V158 L432 L433 L438 I439 F440 T790V158-P436 HydrophobicContact CG1-CG 4.14Å; V158-P436 HydrophobicContact CG2-CB 4.04Å; V158-P436 HydrophobicContact CG2-CG 4.01Å; L432-P436 WeakPolarHBondContact O-CD 3.5Å; L433-P436 WeakPolarHBondContact O-CD 3.37Å; L433-P436 VanDerWaalsContact O-CG 3.25Å; L433-P436 WeakPolarHBondContact O-CG 3.25Å; P436-L438 VanDerWaalsContact C-N 3.35Å; P436-L438 PolarHBondContact O-N 3.35Å; P436-I439 WeakPolarHBondContact O-CB 3.46Å; P436-I439 PolarHBondContact O-N 3.3Å; P436-F440 HydrophobicContact CB-CE2 4.05Å; P436-F440 HydrophobicContact CB-CZ 3.85Å; P436-F440 WeakPolarHBondContact O-CD1 3.17Å; P436-F440 WeakPolarHBondContact O-CD2 3.34Å; P436-F440 WeakPolarHBondContact O-CG 3.43Å; P436-F440 PolarHBondContact O-N 2.9Å; P436-T790 HydrophobicContact CB-CG2 4.33Å
437I96.6Very high95.8Very high67 Ų6739 Ų3934%0.34422%0.217SC..Hα-helixtrans-60.3-44.9173.8-66.9173000111V158 L433 C434 I435 I439 F440 L441V158-I437 HydrophobicContact CG1-CD1 4.31Å; V158-I437 HydrophobicContact CG1-CG1 3.91Å; L433-I437 WeakPolarHBondContact O-CG1 3.19Å; L433-I437 PolarHBondContact O-N 3.15Å; C434-I437 PolarHBondContact O-N 3.49Å; I435-I437 VanDerWaalsContact C-N 3.3Å; I435-I437 PolarHBondContact O-N 3.05Å; I437-I439 VanDerWaalsContact C-N 3.33Å; I437-I439 PolarHBondContact O-N 3.27Å; I437-F440 PolarHBondContact O-N 2.96Å; I437-L441 PolarHBondContact O-N 2.88Å
438L96.4Very high95.7Very high84 Ų8435.1 Ų35.144%0.4421%0.211SC..Hα-helixtrans-61.4-42.3175.6178.464.9000111.4C434 I435 P436 F440 L441 I442C434-L438 WeakPolarHBondContact O-CB 3.5Å; C434-L438 PolarHBondContact O-N 3.08Å; I435-L438 WeakPolarHBondContact O-CB 3.31Å; I435-L438 PolarHBondContact O-N 3.26Å; P436-L438 VanDerWaalsContact C-N 3.35Å; P436-L438 PolarHBondContact O-N 3.35Å; L438-F440 VanDerWaalsContact C-N 3.33Å; L438-F440 PolarHBondContact O-N 2.93Å; L438-L441 PolarHBondContact O-N 3.1Å; L438-I442 HydrophobicContact CD1-CD1 4.26Å; L438-I442 HydrophobicContact CG-CD1 4.11Å; L438-I442 WeakPolarHBondContact O-CG1 3.43Å; L438-I442 PolarHBondContact O-N 3.24Å
439I97.2Very high95.7Very high1 Ų135.7 Ų35.71%0.00520%0.201CC..Hα-helixtrans-58.3-46.9174.8-68169.5000110.3I435 P436 I437 I442 L443 F478 M479 F794I435-I439 HydrophobicContact CG2-CD1 4.22Å; I435-I439 WeakPolarHBondContact O-CG1 3.41Å; I435-I439 PolarHBondContact O-N 3.39Å; P436-I439 WeakPolarHBondContact O-CB 3.46Å; P436-I439 PolarHBondContact O-N 3.3Å; I437-I439 VanDerWaalsContact C-N 3.33Å; I437-I439 PolarHBondContact O-N 3.27Å; I439-I442 PolarHBondContact O-N 3.48Å; I439-L443 HydrophobicContact CG2-CD1 4.12Å; I439-L443 HydrophobicContact CG2-CG 4.47Å; I439-L443 WeakPolarHBondContact O-CG 3.3Å; I439-L443 PolarHBondContact O-N 2.78Å; I439-F478 HydrophobicContact CD1-CB 4.11Å; I439-F478 HydrophobicContact CG1-CB 3.71Å; I439-M479 HydrophobicContact CD1-CG 4.18Å; I439-M479 HydrophobicContact CG2-CG 3.55Å; I439-M479 HydrophobicContact CG2-SD 4.26Å; I439-F794 HydrophobicContact CD1-CZ 4.16Å
440F97Very high95.6Very high2 Ų235.3 Ų35.31%0.00920%0.197CC..Hα-helixtrans-66.5-39.8180-54.4-29.3000112.4V151 Q154 L155 V158 P436 I437 L438 I442 L443 Y444 T790 F794V151-F440 HydrophobicContact CG1-CB 4.03Å; V151-F440 HydrophobicContact CG1-CD1 4.14Å; V151-F440 HydrophobicContact CG1-CG 4.23Å; Q154-F440 HydrophobicContact CB-CE1 3.76Å; Q154-F440 HydrophobicContact CB-CE2 4.2Å; Q154-F440 HydrophobicContact CB-CZ 3.56Å; Q154-F440 HydrophobicContact CG-CE1 4.48Å; L155-F440 HydrophobicContact CB-CD2 4.25Å; L155-F440 HydrophobicContact CD1-CD2 3.98Å; V158-F440 HydrophobicContact CB-CE2 4.11Å; V158-F440 HydrophobicContact CG2-CE2 3.61Å; V158-F440 HydrophobicContact CG2-CZ 3.94Å; P436-F440 HydrophobicContact CB-CE2 4.05Å; P436-F440 HydrophobicContact CB-CZ 3.85Å; P436-F440 WeakPolarHBondContact O-CD1 3.17Å; P436-F440 WeakPolarHBondContact O-CD2 3.34Å; P436-F440 WeakPolarHBondContact O-CG 3.43Å; P436-F440 PolarHBondContact O-N 2.9Å; I437-F440 PolarHBondContact O-N 2.96Å; L438-F440 VanDerWaalsContact C-N 3.33Å; L438-F440 PolarHBondContact O-N 2.93Å; F440-I442 VanDerWaalsContact C-N 3.29Å; F440-I442 PolarHBondContact O-N 2.84Å; F440-L443 PolarHBondContact O-N 3.49Å; F440-L443 VanDerWaalsContact O-N 3.17Å; F440-Y444 HydrophobicContact CB-CD2 4.46Å; F440-Y444 HydrophobicContact CB-CE2 4.46Å; F440-Y444 WeakPolarHBondContact O-CD2 3.3Å; F440-Y444 PolarHBondContact O-N 3.43Å; F440-T790 HydrophobicContact CE1-CG2 4.43Å; F440-T790 HydrophobicContact CZ-CG2 3.64Å; F440-F794 HydrophobicContact CE1-CE1 4.12Å
441L96.9Very high95.4Very high97 Ų9736.4 Ų36.451%0.50820%0.204SC..Hα-helixtrans-56.7-46.8174.2178.665.1000110.7I437 L438 L443 Y444 L445I437-L441 PolarHBondContact O-N 2.88Å; L438-L441 PolarHBondContact O-N 3.1Å; L441-L443 PolarHBondContact O-N 2.94Å; L441-Y444 PolarHBondContact O-N 3.34Å; L441-L445 HydrophobicContact CG-CD1 4.31Å; L441-L445 VanDerWaalsContact O-CG 3.32Å; L441-L445 WeakPolarHBondContact O-CG 3.15Å; L441-L445 PolarHBondContact O-N 3.04Å
442I97.7Very high95Very high18 Ų1838.8 Ų38.89%0.09222%0.216CC..Hα-helixtrans-62.6-42176.9-70.3167.6000111.3L438 I439 F440 L445 G446 F471 A474 F478L438-I442 HydrophobicContact CD1-CD1 4.26Å; L438-I442 HydrophobicContact CG-CD1 4.11Å; L438-I442 WeakPolarHBondContact O-CG1 3.43Å; L438-I442 PolarHBondContact O-N 3.24Å; I439-I442 PolarHBondContact O-N 3.48Å; F440-I442 VanDerWaalsContact C-N 3.29Å; F440-I442 PolarHBondContact O-N 2.84Å; I442-L445 PolarHBondContact O-N 3.01Å; I442-G446 PolarHBondContact O-N 2.94Å; I442-F471 HydrophobicContact CG2-CB 4.34Å; I442-F471 HydrophobicContact CG2-CD1 4.25Å; I442-F471 WeakPolarHBondContact CG2-O 3.42Å; I442-A474 HydrophobicContact CG2-CB 4.09Å; I442-F478 HydrophobicContact CD1-CD2 3.54Å; I442-F478 HydrophobicContact CD1-CE2 3.5Å; I442-F478 VanDerWaalsContact CD1-CE2 3.5Å
443L97.7Very high94.5Very high0 Ų037.9 Ų37.90%021%0.213CC..Hα-helixtrans-65.1-41.2176.5-68.9176000112.2V151 I439 F440 L441 G446 L447 L472 M479 A801V151-L443 HydrophobicContact CG2-CB 4.3Å; V151-L443 HydrophobicContact CG2-CD1 3.77Å; I439-L443 HydrophobicContact CG2-CD1 4.12Å; I439-L443 HydrophobicContact CG2-CG 4.47Å; I439-L443 WeakPolarHBondContact O-CG 3.3Å; I439-L443 PolarHBondContact O-N 2.78Å; F440-L443 PolarHBondContact O-N 3.49Å; F440-L443 VanDerWaalsContact O-N 3.17Å; L441-L443 PolarHBondContact O-N 2.94Å; L443-G446 PolarHBondContact O-N 2.95Å; L443-L447 WeakPolarHBondContact O-CG 3.32Å; L443-L447 PolarHBondContact O-N 3.23Å; L443-L472 HydrophobicContact CD2-CD2 3.92Å; L443-M479 HydrophobicContact CD1-CE 4.09Å; L443-M479 HydrophobicContact CD2-CE 4.25Å; L443-A801 HydrophobicContact CD2-CB 4.31Å
444Y97Very high93.8Very high64 Ų6442.6 Ų42.625%0.25124%0.238SC..Hα-helixtrans-65.9-42.4175.7-81.2-59.9000112.3V151 T152 L155 F440 L441 G446 L447 C448V151-Y444 HydrophobicContact CG1-CD2 4.09Å; V151-Y444 HydrophobicContact CG1-CE1 4.27Å; V151-Y444 HydrophobicContact CG1-CE2 3.55Å; T152-Y444 WeakPolarHBondContact CA-OH 3.36Å; T152-Y444 WeakPolarHBondContact CG2-OH 3.45Å; T152-Y444 PolarHBondContact N-OH 2.87Å; L155-Y444 HydrophobicContact CD2-CE2 4.28Å; F440-Y444 HydrophobicContact CB-CD2 4.46Å; F440-Y444 HydrophobicContact CB-CE2 4.46Å; F440-Y444 WeakPolarHBondContact O-CD2 3.3Å; F440-Y444 PolarHBondContact O-N 3.43Å; L441-Y444 PolarHBondContact O-N 3.34Å; Y444-G446 VanDerWaalsContact C-N 3.27Å; Y444-G446 PolarHBondContact O-N 2.92Å; Y444-L447 HydrophobicContact CD1-CD1 4.19Å; Y444-L447 WeakPolarHBondContact O-CB 3.22Å; Y444-L447 PolarHBondContact O-N 3.4Å; Y444-C448 WeakPolarHBondContact O-CB 3.44Å; Y444-C448 PolarHBondContact O-N 3.08Å; Y444-C448 PolarHBondContact O-SG 3.39Å
445L95.6Very high93.2Very high61 Ų6140.5 Ų40.532%0.31922%0.222SC..Hα-helixtrans-60.1-40.8172.5-70.4173.2000111.1L441 I442 C448 F449 F471L441-L445 HydrophobicContact CG-CD1 4.31Å; L441-L445 VanDerWaalsContact O-CG 3.32Å; L441-L445 WeakPolarHBondContact O-CG 3.15Å; L441-L445 PolarHBondContact O-N 3.04Å; I442-L445 PolarHBondContact O-N 3.01Å; L445-C448 PolarHBondContact O-N 2.81Å; L445-F449 HydrophobicContact CB-CE2 4.28Å; L445-F449 HydrophobicContact CD2-CE2 4.29Å; L445-F449 HydrophobicContact CD2-CZ 4.46Å; L445-F449 WeakPolarHBondContact O-CD2 3.5Å; L445-F449 WeakPolarHBondContact O-CG 3.32Å; L445-F449 PolarHBondContact O-N 3.25Å; L445-F471 HydrophobicContact CB-CD1 4.4Å; L445-F471 HydrophobicContact CB-CD2 4.47Å; L445-F471 HydrophobicContact CB-CG 4.29Å; L445-F471 HydrophobicContact CD1-CE1 4.36Å
446G96Very high92.1Very high0 Ų040.5 Ų40.50%022%0.224CC..Hα-helixtrans-61.8-40.5173.700000113.6I442 L443 Y444 G450 G468I442-G446 PolarHBondContact O-N 2.94Å; L443-G446 PolarHBondContact O-N 2.95Å; Y444-G446 VanDerWaalsContact C-N 3.27Å; Y444-G446 PolarHBondContact O-N 2.92Å; G446-G450 PolarHBondContact O-N 3.06Å; G446-G468 VanDerWaalsContact CA-O 3.3Å; G446-G468 WeakPolarHBondContact CA-O 3.46Å; G446-G468 WeakPolarHBondContact O-CA 3.46Å
447L96Very high90.8Very high6 Ų649 Ų493%0.03126%0.257CS..Hα-helixtrans-64.9-51.3173.4-76.5164000111T144 L147 V148 L443 Y444 G450 T451 L472 L804T144-L447 HydrophobicContact CG2-CD2 4.11Å; L147-L447 HydrophobicContact CB-CD2 4.43Å; L147-L447 HydrophobicContact CD2-CD1 4.45Å; L147-L447 HydrophobicContact CD2-CD2 4Å; L147-L447 HydrophobicContact CD2-CG 4.28Å; L147-L447 HydrophobicContact CG-CD1 4.35Å; L147-L447 HydrophobicContact CG-CD2 4.4Å; V148-L447 HydrophobicContact CG2-CD1 3.78Å; V148-L447 HydrophobicContact CG2-CD2 4.12Å; L443-L447 WeakPolarHBondContact O-CG 3.32Å; L443-L447 PolarHBondContact O-N 3.23Å; Y444-L447 HydrophobicContact CD1-CD1 4.19Å; Y444-L447 WeakPolarHBondContact O-CB 3.22Å; Y444-L447 PolarHBondContact O-N 3.4Å; L447-G450 PolarHBondContact O-N 2.85Å; L447-T451 WeakPolarHBondContact O-CG2 3.37Å; L447-T451 PolarHBondContact O-N 3.18Å; L447-T451 PolarHBondContact O-OG1 2.88Å; L447-L472 HydrophobicContact CG-CD2 4.45Å; L447-L804 HydrophobicContact CD2-CD2 3.88Å
448C93.5Very high89Confident67 Ų6750.1 Ų50.145%0.45326%0.261SS..Hα-helixtrans-58.3-53.5-178.6-70.80000112.5Y444 L445 G450 T451 C452Y444-C448 WeakPolarHBondContact O-CB 3.44Å; Y444-C448 PolarHBondContact O-N 3.08Å; Y444-C448 PolarHBondContact O-SG 3.39Å; L445-C448 PolarHBondContact O-N 2.81Å; C448-G450 VanDerWaalsContact C-N 3.25Å; C448-G450 PolarHBondContact O-N 3.31Å; C448-T451 PolarHBondContact O-OG1 3.43Å; C448-C452 VanDerWaalsContact O-CB 3.26Å; C448-C452 WeakPolarHBondContact O-CB 3.32Å; C448-C452 PolarHBondContact O-N 3.36Å
449F91.4Very high87.2Confident54 Ų5455.8 Ų55.824%0.23729%0.285CS..Hα-helixtrans-68.8-27.1178.9-62.2-42.9000112.5L445 G453 C463 V467 F471L445-F449 HydrophobicContact CB-CE2 4.28Å; L445-F449 HydrophobicContact CD2-CE2 4.29Å; L445-F449 HydrophobicContact CD2-CZ 4.46Å; L445-F449 WeakPolarHBondContact O-CD2 3.5Å; L445-F449 WeakPolarHBondContact O-CG 3.32Å; L445-F449 PolarHBondContact O-N 3.25Å; F449-G453 VanDerWaalsContact O-CA 3.27Å; F449-G453 WeakPolarHBondContact O-CA 3.49Å; F449-G453 PolarHBondContact O-N 2.83Å; F449-G453 VanDerWaalsContact O-N 3.08Å; F449-C463 HydrophobicContact CD1-CB 4.06Å; F449-C463 HydrophobicContact CE1-CB 4.27Å; F449-V467 HydrophobicContact CD2-CG1 4.08Å; F449-F471 AromaticContact CD2-CD2 3.65Å; F449-F471 HydrophobicContact CD2-CD2 3.65Å; F449-F471 AromaticContact CD2-CE2 3.59Å; F449-F471 HydrophobicContact CD2-CE2 3.59Å; F449-F471 AromaticContact CE2-CD2 3.97Å; F449-F471 HydrophobicContact CE2-CD2 3.97Å; F449-F471 AromaticContact CE2-CE2 3.46Å; F449-F471 HydrophobicContact CE2-CE2 3.46Å; F449-F471 VanDerWaalsContact CE2-CE2 3.46Å; F449-F471 HydrophobicContact CE2-CZ 4.22Å
450G90.5Very high85.3Confident0 Ų057.3 Ų57.30%030%0.298CS..Hα-helixtrans-77.2-36.217800000115.1G446 L447 C448 R465 Y808G446-G450 PolarHBondContact O-N 3.06Å; L447-G450 PolarHBondContact O-N 2.85Å; C448-G450 VanDerWaalsContact C-N 3.25Å; C448-G450 PolarHBondContact O-N 3.31Å; G450-R465 WeakPolarHBondContact O-CG 3.23Å; G450-Y808 VanDerWaalsContact C-CZ 3.42Å; G450-Y808 VanDerWaalsContact CA-CZ 3.42Å; G450-Y808 VanDerWaalsContact O-CE1 3.23Å; G450-Y808 WeakPolarHBondContact O-CE1 3.27Å
451T89.8Confident84Confident65 Ų6559.6 Ų59.640%0.39932%0.322SS..Hα-helixtrans-85.2-41.3178.554.30000112.1T144 L447 C448 Y808T144-T451 HydrophobicContact CG2-CG2 3.55Å; L447-T451 WeakPolarHBondContact O-CG2 3.37Å; L447-T451 PolarHBondContact O-N 3.18Å; L447-T451 PolarHBondContact O-OG1 2.88Å; C448-T451 PolarHBondContact O-OG1 3.43Å; T451-Y808 WeakPolarHBondContact CG2-OH 3.21Å
452C85.7Confident82.8Confident111 Ų11162.6 Ų62.675%0.7534%0.337SS*.Hα-helixtrans-94.4-17-173.7-55.30000113.2C448C448-C452 VanDerWaalsContact O-CB 3.26Å; C448-C452 WeakPolarHBondContact O-CB 3.32Å; C448-C452 PolarHBondContact O-N 3.36Å
453G84Confident81.9Confident5 Ų565.1 Ų65.15%0.05236%0.356CS..SBendtrans-80.3155.1-178.400000113.6F449 R465F449-G453 VanDerWaalsContact O-CA 3.27Å; F449-G453 WeakPolarHBondContact O-CA 3.49Å; F449-G453 PolarHBondContact O-N 2.83Å; F449-G453 VanDerWaalsContact O-N 3.08Å; G453-R465 WeakPolarHBondContact O-CG 3.4Å; G453-R465 PolarHBondContact O-NE 3.04Å
454D82.8Confident81.4Confident99 Ų9966.2 Ų66.253%0.52936%0.362SS..BIsolated β-bridgetrans-75.4169.9168.6-66.4-40.9000111.4N464 R465D454-N464 WeakPolarHBondContact O-CA 3.35Å; D454-N464 WeakPolarHBondContact O-CB 3.23Å; D454-R465 WeakPolarHBondContact O-CG 3.48Å; D454-R465 PolarHBondContact O-N 3.07Å
455R82.1Confident81Confident16 Ų1665.5 Ų65.56%0.0636%0.359CS..PPolyproline II helixtrans-69.7155.4-178.7-72.9167.5163.2-167.7-10111.5D132 Y457 E458 A460 T811 E812 K813D132-R455 IonicContact OD2-CZ 3.12Å; D132-R455 IonicContact OD2-NH2 3.36Å; D132-R455 PolarHBondContact OD2-NH2 3.05Å; R455-Y457 PolarHBondContact O-N 3.35Å; R455-E458 HydrophobicContact CB-CG 4.35Å; R455-E458 PolarHBondContact O-N 3.12Å; R455-A460 WeakPolarHBondContact O-CB 3.4Å; R455-T811 WeakPolarHBondContact CD-O 3.33Å; R455-T811 PolarHBondContact NH1-O 2.91Å; R455-E812 VanDerWaalsContact CZ-C 3.48Å; R455-E812 VanDerWaalsContact NH2-C 3.26Å; R455-E812 PolarHBondContact NH2-O 3.23Å; R455-K813 VanDerWaalsContact CZ-CG 3.41Å; R455-K813 VanDerWaalsContact NH2-CG 3.26Å
456P73.9Confident80.7Confident34 Ų3463.1 Ų63.122%0.22135%0.349CS..THydrogen-bonded Turntrans-57.8-20-172-23.732.1000116.3
457Y68.9Low80.4Confident179 Ų17965.1 Ų65.170%0.70236%0.361SS*.THydrogen-bonded Turntrans-115.6-4.9-175.3-71.1-89.8000114.7R455 E459 T811R455-Y457 PolarHBondContact O-N 3.35Å; Y457-E459 PolarHBondContact O-N 3.3Å; Y457-E459 VanDerWaalsContact O-N 3.12Å; Y457-T811 HydrophobicContact CD2-CG2 3.23Å; Y457-T811 HydrophobicContact CE2-CG2 3.31Å; Y457-T811 HydrophobicContact CG-CG2 4.49Å
458E58.4Low80.2Confident89 Ų8964.8 Ų64.842%0.41636%0.359SS..SBendtrans-80.589.3175.6-76173.9169.200108.4R455 A460R455-E458 HydrophobicContact CB-CG 4.35Å; R455-E458 PolarHBondContact O-N 3.12Å; E458-A460 WeakPolarHBondContact O-CA 3.29Å; E458-A460 WeakPolarHBondContact O-CB 3.19Å; E458-A460 PolarHBondContact O-N 3.12Å
459E58.7Low80.2Confident204 Ų20461.6 Ų61.695%0.95334%0.338SS*.SBendtrans30.344.5179.5-68.8-172178.800113.9Y457 G461Y457-E459 PolarHBondContact O-N 3.3Å; Y457-E459 VanDerWaalsContact O-N 3.12Å; E459-G461 PolarHBondContact O-N 3.44Å
460A57.8Low80.2Confident33 Ų3363.1 Ų63.127%0.27335%0.348SS..  trans-78.4120.6-148.500000110.3R455 E458 N464R455-A460 WeakPolarHBondContact O-CB 3.4Å; E458-A460 WeakPolarHBondContact O-CA 3.29Å; E458-A460 WeakPolarHBondContact O-CB 3.19Å; E458-A460 PolarHBondContact O-N 3.12Å; A460-N464 HydrophobicContact CB-CB 3.9Å
461G68.9Low80.4Confident50 Ų5066.2 Ų66.252%0.51536%0.362SS..  trans-59.4179.2170.700000112.5E459 C463 N464E459-G461 PolarHBondContact O-N 3.44Å; G461-C463 PolarHBondContact O-N 2.88Å; G461-N464 PolarHBondContact O-ND2 3.38Å
462L71.9Confident80.7Confident159 Ų15963.1 Ų63.183%0.83234%0.343SS*.SBendtrans-52.5-32.9179-171.770000112.9N464L462-N464 PolarHBondContact O-N 3.1Å
463C78.8Confident81.1Confident71 Ų7159 Ų5948%0.4831%0.313SS..SBendtrans-96.585.1-178.8-620000111.6F449 G461F449-C463 HydrophobicContact CD1-CB 4.06Å; F449-C463 HydrophobicContact CE1-CB 4.27Å; G461-C463 PolarHBondContact O-N 2.88Å
464N88.2Confident81.7Confident23 Ų2360.8 Ų60.812%0.12333%0.328CS..BIsolated β-bridgetrans-125.8166.3177.170.152.5000112.9D454 A460 G461 L462 G466 V467 G468D454-N464 WeakPolarHBondContact O-CA 3.35Å; D454-N464 WeakPolarHBondContact O-CB 3.23Å; A460-N464 HydrophobicContact CB-CB 3.9Å; G461-N464 PolarHBondContact O-ND2 3.38Å; L462-N464 PolarHBondContact O-N 3.1Å; N464-G466 PolarHBondContact O-N 2.56Å; N464-G466 WeakPolarHBondContact OD1-CA 3.23Å; N464-G466 PolarHBondContact OD1-N 3.41Å; N464-V467 WeakPolarHBondContact O-CB 3.44Å; N464-V467 PolarHBondContact O-N 2.6Å; N464-V467 VanDerWaalsContact O-N 3.15Å; N464-V467 PolarHBondContact OD1-N 2.92Å; N464-G468 PolarHBondContact O-N 3.02Å; N464-G468 VanDerWaalsContact O-N 3.16Å
465R88.8Confident82.3Confident49 Ų4956.1 Ų56.119%0.18530%0.303CS..Hα-helixtrans-62.3-30.5-178.6-63.8-174.6-173.3167.32.1113.3G450 G453 D454 V467 G468 A469 Y808G450-R465 WeakPolarHBondContact O-CG 3.23Å; G453-R465 WeakPolarHBondContact O-CG 3.4Å; G453-R465 PolarHBondContact O-NE 3.04Å; D454-R465 WeakPolarHBondContact O-CG 3.48Å; D454-R465 PolarHBondContact O-N 3.07Å; R465-V467 VanDerWaalsContact C-N 3.33Å; R465-G468 PolarHBondContact O-N 3.41Å; R465-A469 PolarHBondContact O-N 2.96Å; R465-Y808 VanDerWaalsContact CB-O 3.29Å; R465-Y808 WeakPolarHBondContact CB-O 3.48Å; R465-Y808 WeakPolarHBondContact O-CB 3.47Å
466G87.6Confident83Confident11 Ų1155.4 Ų55.411%0.11330%0.3CS..Hα-helixtrans-62.1-42.5176.200000111.7N464 A469 N470N464-G466 PolarHBondContact O-N 2.56Å; N464-G466 WeakPolarHBondContact OD1-CA 3.23Å; N464-G466 PolarHBondContact OD1-N 3.41Å; G466-A469 WeakPolarHBondContact O-CB 3.26Å; G466-A469 PolarHBondContact O-N 2.82Å; G466-N470 PolarHBondContact O-N 2.86Å; G466-N470 VanDerWaalsContact O-N 3.12Å
467V90.3Very high84Confident42 Ų4255.6 Ų55.626%0.25531%0.308SS..Hα-helixtrans-63-44.1172.7175.10000110.6F449 N464 R465 A469 N470 F471F449-V467 HydrophobicContact CD2-CG1 4.08Å; N464-V467 WeakPolarHBondContact O-CB 3.44Å; N464-V467 PolarHBondContact O-N 2.6Å; N464-V467 VanDerWaalsContact O-N 3.15Å; N464-V467 PolarHBondContact OD1-N 2.92Å; R465-V467 VanDerWaalsContact C-N 3.33Å; V467-A469 VanDerWaalsContact C-N 3.31Å; V467-A469 PolarHBondContact O-N 3.16Å; V467-N470 WeakPolarHBondContact O-CB 3.44Å; V467-N470 PolarHBondContact O-N 2.99Å; V467-F471 HydrophobicContact CG1-CD2 3.76Å; V467-F471 HydrophobicContact CG1-CE2 3.47Å; V467-F471 VanDerWaalsContact CG1-CE2 3.47Å; V467-F471 WeakPolarHBondContact O-CD2 3.41Å; V467-F471 PolarHBondContact O-N 2.94Å
468G92.5Very high85.3Confident0 Ų050.4 Ų50.40%029%0.29CS..Hα-helixtrans-56.5-42.817400000113.3G446 N464 R465 N470 F471 L472G446-G468 VanDerWaalsContact CA-O 3.3Å; G446-G468 WeakPolarHBondContact CA-O 3.46Å; G446-G468 WeakPolarHBondContact O-CA 3.46Å; N464-G468 PolarHBondContact O-N 3.02Å; N464-G468 VanDerWaalsContact O-N 3.16Å; R465-G468 PolarHBondContact O-N 3.41Å; G468-N470 VanDerWaalsContact C-N 3.32Å; G468-N470 PolarHBondContact O-N 3.47Å; G468-F471 PolarHBondContact O-N 3.07Å; G468-L472 WeakPolarHBondContact O-CG 3.46Å; G468-L472 PolarHBondContact O-N 3.33Å
469A92.1Very high87.1Confident0 Ų046.2 Ų46.20%027%0.27CS..Hα-helixtrans-61.9-37.7174.800000112.8R465 G466 V467 L473 A805 R809R465-A469 PolarHBondContact O-N 2.96Å; G466-A469 WeakPolarHBondContact O-CB 3.26Å; G466-A469 PolarHBondContact O-N 2.82Å; V467-A469 VanDerWaalsContact C-N 3.31Å; V467-A469 PolarHBondContact O-N 3.16Å; A469-L473 VanDerWaalsContact O-CG 3.3Å; A469-L473 WeakPolarHBondContact O-CG 3.25Å; A469-L473 PolarHBondContact O-N 3.25Å; A469-L473 VanDerWaalsContact O-N 3.11Å; A469-A805 HydrophobicContact CB-CB 4.08Å; A469-A805 WeakPolarHBondContact CB-O 3.44Å; A469-R809 HydrophobicContact CB-CG 3.72Å
470N91.5Very high88.9Confident85 Ų8537.2 Ų37.246%0.45523%0.227SC..Hα-helixtrans-67.7-42.4178.3-69.2-16.1000111.5G466 V467 G468 L473 A474 R809G466-N470 PolarHBondContact O-N 2.86Å; G466-N470 VanDerWaalsContact O-N 3.12Å; V467-N470 WeakPolarHBondContact O-CB 3.44Å; V467-N470 PolarHBondContact O-N 2.99Å; G468-N470 VanDerWaalsContact C-N 3.32Å; G468-N470 PolarHBondContact O-N 3.47Å; N470-L473 PolarHBondContact O-N 3.48Å; N470-A474 WeakPolarHBondContact O-CB 3.49Å; N470-A474 PolarHBondContact O-N 3.36Å; N470-R809 PolarHBondContact OD1-NH2 2.98Å
471F96.1Very high90.6Very high65 Ų6541 Ų4129%0.28524%0.242SC..Hα-helixtrans-61.8-45.7173.9-79.9-66.5000112.1I442 L445 F449 V467 G468 L473 A474 G475I442-F471 HydrophobicContact CG2-CB 4.34Å; I442-F471 HydrophobicContact CG2-CD1 4.25Å; I442-F471 WeakPolarHBondContact CG2-O 3.42Å; L445-F471 HydrophobicContact CB-CD1 4.4Å; L445-F471 HydrophobicContact CB-CD2 4.47Å; L445-F471 HydrophobicContact CB-CG 4.29Å; L445-F471 HydrophobicContact CD1-CE1 4.36Å; F449-F471 AromaticContact CD2-CD2 3.65Å; F449-F471 HydrophobicContact CD2-CD2 3.65Å; F449-F471 AromaticContact CD2-CE2 3.59Å; F449-F471 HydrophobicContact CD2-CE2 3.59Å; F449-F471 AromaticContact CE2-CD2 3.97Å; F449-F471 HydrophobicContact CE2-CD2 3.97Å; F449-F471 AromaticContact CE2-CE2 3.46Å; F449-F471 HydrophobicContact CE2-CE2 3.46Å; F449-F471 VanDerWaalsContact CE2-CE2 3.46Å; F449-F471 HydrophobicContact CE2-CZ 4.22Å; V467-F471 HydrophobicContact CG1-CD2 3.76Å; V467-F471 HydrophobicContact CG1-CE2 3.47Å; V467-F471 VanDerWaalsContact CG1-CE2 3.47Å; V467-F471 WeakPolarHBondContact O-CD2 3.41Å; V467-F471 PolarHBondContact O-N 2.94Å; G468-F471 PolarHBondContact O-N 3.07Å; F471-L473 VanDerWaalsContact C-N 3.28Å; F471-L473 PolarHBondContact O-N 3.17Å; F471-A474 WeakPolarHBondContact O-CB 3.34Å; F471-A474 PolarHBondContact O-N 3.41Å; F471-A474 VanDerWaalsContact O-N 3.14Å; F471-G475 PolarHBondContact O-N 3.2Å
472L96.3Very high91.9Very high0 Ų041.2 Ų41.20%023%0.229CC..Hα-helixtrans-56.3-43.2175.8-72.1-177.2000112.3L147 L443 L447 G468 G475 V476 A801 L804 A805 Y808L147-L472 HydrophobicContact CD2-CD2 3.82Å; L443-L472 HydrophobicContact CD2-CD2 3.92Å; L447-L472 HydrophobicContact CG-CD2 4.45Å; G468-L472 WeakPolarHBondContact O-CG 3.46Å; G468-L472 PolarHBondContact O-N 3.33Å; L472-G475 PolarHBondContact O-N 3.07Å; L472-V476 WeakPolarHBondContact O-CG2 3.2Å; L472-V476 PolarHBondContact O-N 2.95Å; L472-A801 HydrophobicContact CB-CB 4.47Å; L472-L804 HydrophobicContact CD1-CB 4.12Å; L472-L804 HydrophobicContact CD1-CD2 3.96Å; L472-L804 HydrophobicContact CD1-CG 3.98Å; L472-A805 HydrophobicContact CB-CB 4.27Å; L472-A805 HydrophobicContact CD1-CB 4.41Å; L472-Y808 HydrophobicContact CD1-CD2 3.9Å; L472-Y808 HydrophobicContact CD1-CE2 3.68Å
473L93.9Very high93Very high25 Ų2533.6 Ų33.613%0.13119%0.19CC..Hα-helixtrans-71.8-33178.6-68.6168.9000112.9F115 R119 A469 N470 F471 V476 G477 V802 A805F115-L473 HydrophobicContact CZ-CD2 4.49Å; R119-L473 VanDerWaalsContact NH2-CD1 3.32Å; A469-L473 VanDerWaalsContact O-CG 3.3Å; A469-L473 WeakPolarHBondContact O-CG 3.25Å; A469-L473 PolarHBondContact O-N 3.25Å; A469-L473 VanDerWaalsContact O-N 3.11Å; N470-L473 PolarHBondContact O-N 3.48Å; F471-L473 VanDerWaalsContact C-N 3.28Å; F471-L473 PolarHBondContact O-N 3.17Å; L473-V476 PolarHBondContact O-N 2.85Å; L473-G477 PolarHBondContact O-N 3.5Å; L473-V802 HydrophobicContact CD2-CG2 4.34Å; L473-A805 HydrophobicContact CD1-CB 4.21Å; L473-A805 HydrophobicContact CD2-CB 4.14Å; L473-A805 HydrophobicContact CG-CB 3.86Å
474A95.4Very high93.8Very high43 Ų4333 Ų3336%0.35518%0.184SC..Hα-helixtrans-63.7-43.8172.300000111I442 N470 F471 V476 G477 F478I442-A474 HydrophobicContact CG2-CB 4.09Å; N470-A474 WeakPolarHBondContact O-CB 3.49Å; N470-A474 PolarHBondContact O-N 3.36Å; F471-A474 WeakPolarHBondContact O-CB 3.34Å; F471-A474 PolarHBondContact O-N 3.41Å; F471-A474 VanDerWaalsContact O-N 3.14Å; A474-V476 VanDerWaalsContact C-N 3.33Å; A474-V476 PolarHBondContact O-N 3.07Å; A474-G477 PolarHBondContact O-N 2.59Å; A474-G477 VanDerWaalsContact O-N 3.13Å; A474-F478 WeakPolarHBondContact O-CD2 3Å; A474-F478 PolarHBondContact O-N 3.35Å
475G96.5Very high94.1Very high0 Ų036.5 Ų36.50%020%0.202CC..Hα-helixtrans-59-43.4173.700000112F471 L472 G477 F478 M479F471-G475 PolarHBondContact O-N 3.2Å; L472-G475 PolarHBondContact O-N 3.07Å; G475-G477 PolarHBondContact O-N 2.9Å; G475-F478 PolarHBondContact O-N 3.16Å; G475-M479 WeakPolarHBondContact O-CG 3.5Å; G475-M479 PolarHBondContact O-N 3.22Å
476V96.1Very high94.5Very high1 Ų134.2 Ų34.21%0.00619%0.193CC..Hα-helixtrans-60.6-42.5172.9170.80000112.3F115 L472 L473 A474 F478 M479 F480 I798 A801 V802F115-V476 HydrophobicContact CE1-CG1 4.26Å; L472-V476 WeakPolarHBondContact O-CG2 3.2Å; L472-V476 PolarHBondContact O-N 2.95Å; L473-V476 PolarHBondContact O-N 2.85Å; A474-V476 VanDerWaalsContact C-N 3.33Å; A474-V476 PolarHBondContact O-N 3.07Å; V476-F478 PolarHBondContact O-N 3.24Å; V476-M479 HydrophobicContact CB-CE 4.28Å; V476-M479 HydrophobicContact CG2-CE 3.75Å; V476-M479 PolarHBondContact O-N 3.27Å; V476-F480 HydrophobicContact CG1-CD2 3.9Å; V476-F480 HydrophobicContact CG1-CE2 3.51Å; V476-F480 HydrophobicContact CG1-CZ 4.44Å; V476-F480 VanDerWaalsContact O-CD2 3.25Å; V476-F480 WeakPolarHBondContact O-CD2 3.46Å; V476-F480 PolarHBondContact O-N 2.89Å; V476-F480 VanDerWaalsContact O-N 3.11Å; V476-I798 HydrophobicContact CG1-CG1 4.38Å; V476-I798 HydrophobicContact CG1-CG2 3.96Å; V476-I798 HydrophobicContact CG2-CG1 4.46Å; V476-A801 HydrophobicContact CG2-CB 3.71Å; V476-V802 HydrophobicContact CG1-CG2 4.13Å; V476-V802 HydrophobicContact CG2-CG2 4.09Å
477G94.9Very high94.9Very high38 Ų3834.5 Ų34.539%0.39219%0.192SC..Hα-helixtrans-58.2-47174.900000112.2L473 A474 G475 F480 L481L473-G477 PolarHBondContact O-N 3.5Å; A474-G477 PolarHBondContact O-N 2.59Å; A474-G477 VanDerWaalsContact O-N 3.13Å; G475-G477 PolarHBondContact O-N 2.9Å; G477-F480 PolarHBondContact O-N 3.09Å; G477-L481 WeakPolarHBondContact O-CB 3.22Å; G477-L481 PolarHBondContact O-N 3.43Å
478F96.1Very high95.1Very high71 Ų7134.9 Ų34.931%0.31120%0.199SC..Hα-helixtrans-68.3-35.4177.2-72-47.3000113.5I439 I442 A474 G475 V476 F480 L481 F482I439-F478 HydrophobicContact CD1-CB 4.11Å; I439-F478 HydrophobicContact CG1-CB 3.71Å; I442-F478 HydrophobicContact CD1-CD2 3.54Å; I442-F478 HydrophobicContact CD1-CE2 3.5Å; I442-F478 VanDerWaalsContact CD1-CE2 3.5Å; A474-F478 WeakPolarHBondContact O-CD2 3Å; A474-F478 PolarHBondContact O-N 3.35Å; G475-F478 PolarHBondContact O-N 3.16Å; V476-F478 PolarHBondContact O-N 3.24Å; F478-F480 VanDerWaalsContact C-N 3.3Å; F478-F480 PolarHBondContact O-N 3.26Å; F478-L481 HydrophobicContact CD1-CD2 4.09Å; F478-L481 HydrophobicContact CE1-CD2 4.4Å; F478-L481 PolarHBondContact O-N 3.26Å; F478-F482 HydrophobicContact CB-CD2 4.23Å; F478-F482 HydrophobicContact CB-CE2 4.44Å; F478-F482 HydrophobicContact CD1-CD2 4.17Å; F478-F482 AromaticContact CD1-CE2 3.6Å; F478-F482 HydrophobicContact CD1-CE2 3.6Å; F478-F482 HydrophobicContact CE1-CE2 4.22Å; F478-F482 HydrophobicContact CG-CE2 4.32Å; F478-F482 WeakPolarHBondContact O-CD2 3.43Å; F478-F482 PolarHBondContact O-N 3.11Å
479M96.7Very high95.1Very high0 Ų036 Ų360%021%0.207CC..Hα-helixtrans-57-45.5172.3-77-172.1-81.900111I439 L443 G475 V476 S483 F794 A797 I798I439-M479 HydrophobicContact CD1-CG 4.18Å; I439-M479 HydrophobicContact CG2-CG 3.55Å; I439-M479 HydrophobicContact CG2-SD 4.26Å; L443-M479 HydrophobicContact CD1-CE 4.09Å; L443-M479 HydrophobicContact CD2-CE 4.25Å; G475-M479 WeakPolarHBondContact O-CG 3.5Å; G475-M479 PolarHBondContact O-N 3.22Å; V476-M479 HydrophobicContact CB-CE 4.28Å; V476-M479 HydrophobicContact CG2-CE 3.75Å; V476-M479 PolarHBondContact O-N 3.27Å; M479-S483 WeakPolarHBondContact O-CB 3.4Å; M479-S483 PolarHBondContact O-N 2.9Å; M479-F794 HydrophobicContact CB-CD2 4.05Å; M479-F794 HydrophobicContact CB-CE2 4.28Å; M479-F794 HydrophobicContact CB-CG 4.45Å; M479-F794 HydrophobicContact CG-CD1 4.2Å; M479-F794 HydrophobicContact CG-CD2 4.02Å; M479-F794 HydrophobicContact CG-CE1 4.27Å; M479-F794 HydrophobicContact CG-CE2 4.06Å; M479-F794 HydrophobicContact CG-CG 4.1Å; M479-F794 HydrophobicContact CG-CZ 4.2Å; M479-F794 HydrophobicContact SD-CB 4.16Å; M479-F794 HydrophobicContact SD-CD1 3.85Å; M479-F794 HydrophobicContact SD-CD2 4.43Å; M479-F794 HydrophobicContact SD-CE1 4.35Å; M479-F794 HydrophobicContact SD-CG 3.92Å; M479-A797 HydrophobicContact SD-CB 4.31Å; M479-I798 HydrophobicContact CB-CD1 4.17Å; M479-I798 HydrophobicContact CB-CG1 4.28Å; M479-I798 HydrophobicContact CE-CG1 3.63Å; M479-I798 HydrophobicContact SD-CD1 4.43Å; M479-I798 HydrophobicContact SD-CG1 3.83Å
480F96.7Very high95.3Very high15 Ų1536.6 Ų36.67%0.06621%0.211CC..Hα-helixtrans-67.5-45.2175.4-69.6-53.3000112.5M108 V111 F115 V476 G477 F478 F482 S483 I798M108-F480 WeakPolarHBondContact O-CD1 3.31Å; M108-F480 HydrophobicContact SD-CD1 3.86Å; M108-F480 HydrophobicContact SD-CE1 3.75Å; V111-F480 HydrophobicContact CB-CE1 4.38Å; V111-F480 HydrophobicContact CG1-CE1 4.01Å; V111-F480 HydrophobicContact CG1-CZ 4.09Å; F115-F480 HydrophobicContact CB-CE2 4.37Å; F115-F480 HydrophobicContact CD1-CE2 4.08Å; F115-F480 HydrophobicContact CG-CE2 4.24Å; V476-F480 HydrophobicContact CG1-CD2 3.9Å; V476-F480 HydrophobicContact CG1-CE2 3.51Å; V476-F480 HydrophobicContact CG1-CZ 4.44Å; V476-F480 VanDerWaalsContact O-CD2 3.25Å; V476-F480 WeakPolarHBondContact O-CD2 3.46Å; V476-F480 PolarHBondContact O-N 2.89Å; V476-F480 VanDerWaalsContact O-N 3.11Å; G477-F480 PolarHBondContact O-N 3.09Å; F478-F480 VanDerWaalsContact C-N 3.3Å; F478-F480 PolarHBondContact O-N 3.26Å; F480-F482 PolarHBondContact O-N 3.48Å; F480-S483 PolarHBondContact O-OG 3.49Å; F480-I798 HydrophobicContact CD1-CD1 4.27Å; F480-I798 HydrophobicContact CE1-CD1 3.79Å; F480-I798 HydrophobicContact CE2-CG2 4.27Å; F480-I798 HydrophobicContact CZ-CD1 3.98Å; F480-I798 HydrophobicContact CZ-CG2 3.85Å
481L94.3Very high95.5Very high112 Ų11233.5 Ų33.559%0.58619%0.194SC*.Hα-helixtrans-60.3-45.7-175.2-176.865000112.9G477 F478G477-L481 WeakPolarHBondContact O-CB 3.22Å; G477-L481 PolarHBondContact O-N 3.43Å; F478-L481 HydrophobicContact CD1-CD2 4.09Å; F478-L481 HydrophobicContact CE1-CD2 4.4Å; F478-L481 PolarHBondContact O-N 3.26Å
482F95.8Very high95.3Very high55 Ų5535.3 Ų35.324%0.24121%0.21CC..Hα-helixtrans-97-4.7-174.2-64.4-68.8000114I435 F478 F480 T484 I485 L486I435-F482 HydrophobicContact CD1-CD1 4.1Å; I435-F482 HydrophobicContact CD1-CE1 4.47Å; I435-F482 HydrophobicContact CD1-CG 4.48Å; I435-F482 HydrophobicContact CG2-CB 3.61Å; I435-F482 HydrophobicContact CG2-CD1 4.17Å; I435-F482 HydrophobicContact CG2-CD2 3.55Å; I435-F482 HydrophobicContact CG2-CE2 4.22Å; I435-F482 HydrophobicContact CG2-CG 3.52Å; F478-F482 HydrophobicContact CB-CD2 4.23Å; F478-F482 HydrophobicContact CB-CE2 4.44Å; F478-F482 HydrophobicContact CD1-CD2 4.17Å; F478-F482 AromaticContact CD1-CE2 3.6Å; F478-F482 HydrophobicContact CD1-CE2 3.6Å; F478-F482 HydrophobicContact CE1-CE2 4.22Å; F478-F482 HydrophobicContact CG-CE2 4.32Å; F478-F482 WeakPolarHBondContact O-CD2 3.43Å; F478-F482 PolarHBondContact O-N 3.11Å; F480-F482 PolarHBondContact O-N 3.48Å; F482-T484 VanDerWaalsContact C-N 3.31Å; F482-T484 PolarHBondContact O-N 3.32Å; F482-I485 PolarHBondContact O-N 2.78Å; F482-L486 HydrophobicContact CB-CD1 4.22Å; F482-L486 HydrophobicContact CB-CG 4.49Å; F482-L486 WeakPolarHBondContact O-CG 3.27Å; F482-L486 PolarHBondContact O-N 3.09Å
483S95.2Very high95.2Very high0 Ų036.1 Ų36.10%022%0.216CC..Hα-helixtrans-51.7-44.1-178.457.30000113.8M108 M479 F480 M487M108-S483 WeakPolarHBondContact CB-OG 3.29Å; M479-S483 WeakPolarHBondContact O-CB 3.4Å; M479-S483 PolarHBondContact O-N 2.9Å; F480-S483 PolarHBondContact O-OG 3.49Å; S483-M487 VanDerWaalsContact O-CB 3.23Å; S483-M487 WeakPolarHBondContact O-CB 3.41Å; S483-M487 PolarHBondContact O-N 3.39Å
484T95.2Very high95.3Very high57 Ų5735.5 Ų35.535%0.3521%0.212SC..Hα-helixtrans-65.4-45.6-177.9-52.70000111.8A105 P109 F482 M487 A488A105-T484 HydrophobicContact CB-CG2 4.33Å; A105-T484 PolarHBondContact O-OG1 3.27Å; P109-T484 WeakPolarHBondContact CG-OG1 3.44Å; F482-T484 VanDerWaalsContact C-N 3.31Å; F482-T484 PolarHBondContact O-N 3.32Å; T484-M487 PolarHBondContact O-N 2.84Å; T484-A488 WeakPolarHBondContact O-CB 3.12Å; T484-A488 PolarHBondContact O-N 3.4Å
485I95.2Very high95.2Very high98 Ų9836.4 Ų36.450%0.50321%0.21SC..Hα-helixtrans-66.5-45.6-179.4-64.4172.3000110.2L432 F482 M487 A488 S489L432-I485 HydrophobicContact CD1-CG2 4Å; F482-I485 PolarHBondContact O-N 2.78Å; I485-M487 VanDerWaalsContact C-N 3.33Å; I485-M487 PolarHBondContact O-N 3.36Å; I485-A488 PolarHBondContact O-N 2.75Å; I485-S489 PolarHBondContact O-N 2.72Å; I485-S489 VanDerWaalsContact O-N 3.09Å; I485-S489 PolarHBondContact O-OG 2.69Å
486L96.3Very high95Very high0 Ų040 Ų400%023%0.226CC..Hα-helixtrans-65.2-35.4178.3-65.6171.6000112.4L432 I435 F482 S489 C490 L787 L791 F794L432-L486 HydrophobicContact CD1-CD2 3.81Å; L432-L486 HydrophobicContact CG-CD2 3.92Å; I435-L486 HydrophobicContact CB-CD2 4.49Å; I435-L486 HydrophobicContact CG2-CD1 4.25Å; F482-L486 HydrophobicContact CB-CD1 4.22Å; F482-L486 HydrophobicContact CB-CG 4.49Å; F482-L486 WeakPolarHBondContact O-CG 3.27Å; F482-L486 PolarHBondContact O-N 3.09Å; L486-S489 WeakPolarHBondContact CA-OG 2.97Å; L486-S489 PolarHBondContact O-OG 2.73Å; L486-C490 PolarHBondContact O-N 2.79Å; L486-L787 HydrophobicContact CD2-CD1 4.28Å; L486-L791 HydrophobicContact CB-CD1 4.09Å; L486-L791 HydrophobicContact CB-CD2 3.69Å; L486-L791 HydrophobicContact CB-CG 4.4Å; L486-L791 HydrophobicContact CD1-CD2 4.11Å; L486-L791 WeakPolarHBondContact O-CD1 3Å; L486-F794 HydrophobicContact CD1-CE2 4.13Å; L486-F794 HydrophobicContact CD1-CZ 4.26Å
487M96.7Very high94.8Very high18 Ų1839.9 Ų39.99%0.08923%0.226CC..Hα-helixtrans-72.6-38176.2-175.454.874.100111.5G101 F104 A105 S483 T484 I485 S489 C490 I491 L791G101-M487 WeakPolarHBondContact O-CG 3.39Å; F104-M487 HydrophobicContact CB-CE 4Å; F104-M487 HydrophobicContact CD1-CB 3.98Å; F104-M487 HydrophobicContact CD1-CE 3.29Å; F104-M487 HydrophobicContact CD1-CG 3.95Å; F104-M487 HydrophobicContact CD1-SD 4.46Å; F104-M487 HydrophobicContact CD2-CE 4.2Å; F104-M487 HydrophobicContact CE1-CB 4.31Å; F104-M487 HydrophobicContact CE1-CE 3.68Å; F104-M487 HydrophobicContact CG-CE 3.58Å; F104-M487 HydrophobicContact CZ-CE 4.28Å; A105-M487 HydrophobicContact CB-CB 4.2Å; A105-M487 HydrophobicContact CB-CG 4.04Å; S483-M487 VanDerWaalsContact O-CB 3.23Å; S483-M487 WeakPolarHBondContact O-CB 3.41Å; S483-M487 PolarHBondContact O-N 3.39Å; T484-M487 PolarHBondContact O-N 2.84Å; I485-M487 VanDerWaalsContact C-N 3.33Å; I485-M487 PolarHBondContact O-N 3.36Å; M487-S489 VanDerWaalsContact C-N 3.34Å; M487-S489 PolarHBondContact O-N 3.48Å; M487-C490 WeakPolarHBondContact O-CB 3.46Å; M487-C490 PolarHBondContact O-N 2.98Å; M487-C490 VanDerWaalsContact O-N 3.08Å; M487-C490 HydrophobicContact SD-CB 4.36Å; M487-I491 HydrophobicContact CG-CD1 3.85Å; M487-I491 HydrophobicContact CG-CG1 4.27Å; M487-I491 WeakPolarHBondContact O-CG1 3.35Å; M487-I491 PolarHBondContact O-N 3.48Å; M487-I491 HydrophobicContact SD-CD1 4.28Å; M487-I491 HydrophobicContact SD-CG1 4.13Å; M487-L791 HydrophobicContact CB-CD1 4.25Å; M487-L791 HydrophobicContact CE-CB 4Å; M487-L791 HydrophobicContact CE-CD1 3.85Å; M487-L791 HydrophobicContact SD-CD1 4.26Å
488A93.5Very high94.8Very high49 Ų4938.1 Ų38.141%0.40521%0.207SC..Hα-helixtrans-61-42.2175.400000112.1T484 I485 C490 I491 V492T484-A488 WeakPolarHBondContact O-CB 3.12Å; T484-A488 PolarHBondContact O-N 3.4Å; I485-A488 PolarHBondContact O-N 2.75Å; A488-C490 PolarHBondContact O-N 2.94Å; A488-I491 PolarHBondContact O-N 3.02Å; A488-V492 PolarHBondContact O-N 3.3Å; A488-V492 VanDerWaalsContact O-N 3.14Å
489S93.1Very high94.5Very high25 Ų2537 Ų3718%0.17521%0.206CC..Hα-helixtrans-72.4-10.5175.160.50000114.2L432 I485 L486 M487 P493 L787L432-S489 VanDerWaalsContact CD2-CB 3.47Å; L432-S489 WeakPolarHBondContact CD2-OG 3.46Å; I485-S489 PolarHBondContact O-N 2.72Å; I485-S489 VanDerWaalsContact O-N 3.09Å; I485-S489 PolarHBondContact O-OG 2.69Å; L486-S489 WeakPolarHBondContact CA-OG 2.97Å; L486-S489 PolarHBondContact O-OG 2.73Å; M487-S489 VanDerWaalsContact C-N 3.34Å; M487-S489 PolarHBondContact O-N 3.48Å; S489-P493 WeakPolarHBondContact O-CD 3.38Å; S489-P493 WeakPolarHBondContact O-CG 2.94Å; S489-L787 WeakPolarHBondContact OG-CD2 3.31Å
490C95.6Very high94.1Very high11 Ų1137.9 Ų37.97%0.07421%0.211CC..Hα-helixtrans-87.4-46.5167.2-175.50000111.2L486 M487 A488 F494 W784 L787 L791L486-C490 PolarHBondContact O-N 2.79Å; M487-C490 WeakPolarHBondContact O-CB 3.46Å; M487-C490 PolarHBondContact O-N 2.98Å; M487-C490 VanDerWaalsContact O-N 3.08Å; M487-C490 HydrophobicContact SD-CB 4.36Å; A488-C490 PolarHBondContact O-N 2.94Å; C490-F494 WeakPolarHBondContact O-CB 3.28Å; C490-F494 PolarHBondContact O-N 2.96Å; C490-W784 PolarHBondContact SG-O 3.32Å; C490-L787 HydrophobicContact CB-CD2 4.22Å; C490-L787 HydrophobicContact CB-CG 4.42Å; C490-L791 HydrophobicContact CB-CD1 4.33Å
491I95.8Very high93.9Very high20 Ų2037.4 Ų37.410%0.10321%0.209CC..Hα-helixtrans-63.3-46-175.6-69.1168.7000112.3L98 L102 M487 A488 F494 L495L98-I491 HydrophobicContact CD1-CG2 3.66Å; L102-I491 HydrophobicContact CD2-CD1 4.4Å; M487-I491 HydrophobicContact CG-CD1 3.85Å; M487-I491 HydrophobicContact CG-CG1 4.27Å; M487-I491 WeakPolarHBondContact O-CG1 3.35Å; M487-I491 PolarHBondContact O-N 3.48Å; M487-I491 HydrophobicContact SD-CD1 4.28Å; M487-I491 HydrophobicContact SD-CG1 4.13Å; A488-I491 PolarHBondContact O-N 3.02Å; I491-F494 WeakPolarHBondContact O-CB 3.2Å; I491-F494 PolarHBondContact O-N 3.05Å; I491-L495 HydrophobicContact CG2-CD1 3.94Å; I491-L495 HydrophobicContact CG2-CG 4.26Å; I491-L495 WeakPolarHBondContact O-CG 3.34Å; I491-L495 PolarHBondContact O-N 2.99Å
492V92.7Very high93.7Very high103 Ų10332 Ų3262%0.62418%0.181SC*.Hα-helixtrans-64.3-52.2-174.4171.50000111.3A488 F494 L495 F496A488-V492 PolarHBondContact O-N 3.3Å; A488-V492 VanDerWaalsContact O-N 3.14Å; V492-F494 VanDerWaalsContact C-N 3.33Å; V492-F494 PolarHBondContact O-N 3.47Å; V492-L495 PolarHBondContact O-N 3.31Å; V492-F496 PolarHBondContact O-N 2.97Å; V492-F496 VanDerWaalsContact O-N 3.15Å
493P93.1Very high93.2Very high18 Ų1830.6 Ų30.612%0.11718%0.175CC..Hα-helixtrans-61.6-36.4172.3-26.938.6000113.6S489 L495 F496 G497 F780 F783 W784S489-P493 WeakPolarHBondContact O-CD 3.38Å; S489-P493 WeakPolarHBondContact O-CG 2.94Å; P493-L495 PolarHBondContact O-N 3.27Å; P493-F496 PolarHBondContact O-N 3.46Å; P493-G497 WeakPolarHBondContact O-CA 3.42Å; P493-G497 PolarHBondContact O-N 3.11Å; P493-F780 HydrophobicContact CB-CE1 3.7Å; P493-F780 HydrophobicContact CB-CE2 4.32Å; P493-F780 HydrophobicContact CB-CZ 3.56Å; P493-F780 HydrophobicContact CG-CZ 4.24Å; P493-F780 WeakPolarHBondContact O-CE1 3.42Å; P493-F783 HydrophobicContact CG-CE1 4.42Å; P493-W784 HydrophobicContact CB-CB 4.02Å; P493-W784 HydrophobicContact CB-CG 4.15Å
494F96.1Very high92.7Very high11 Ų1131.4 Ų31.45%0.04818%0.18CC..Hα-helixtrans-58.9-48.3176.3161.9-109000112.4F51 L52 I55 Y94 C97 C490 I491 V492 G498 W784F51-F494 AromaticContact CE1-CE2 3.94Å; F51-F494 HydrophobicContact CE1-CE2 3.94Å; L52-F494 HydrophobicContact CD2-CD2 4.49Å; L52-F494 HydrophobicContact CD2-CE2 4.19Å; I55-F494 HydrophobicContact CD1-CE2 3.54Å; I55-F494 HydrophobicContact CD1-CZ 3.67Å; Y94-F494 AromaticContact CD1-CE1 3.86Å; Y94-F494 HydrophobicContact CD1-CE1 3.86Å; Y94-F494 HydrophobicContact CD1-CE2 4.05Å; Y94-F494 AromaticContact CD1-CZ 3.4Å; Y94-F494 HydrophobicContact CD1-CZ 3.4Å; Y94-F494 VanDerWaalsContact CD1-CZ 3.4Å; Y94-F494 HydrophobicContact CE1-CE1 4.38Å; Y94-F494 AromaticContact CE1-CE2 3.84Å; Y94-F494 HydrophobicContact CE1-CE2 3.84Å; Y94-F494 AromaticContact CE1-CZ 3.69Å; Y94-F494 HydrophobicContact CE1-CZ 3.69Å; Y94-F494 HydrophobicContact CG-CZ 4.33Å; C97-F494 HydrophobicContact CB-CE1 3.91Å; C97-F494 HydrophobicContact CB-CZ 3.74Å; C490-F494 WeakPolarHBondContact O-CB 3.28Å; C490-F494 PolarHBondContact O-N 2.96Å; I491-F494 WeakPolarHBondContact O-CB 3.2Å; I491-F494 PolarHBondContact O-N 3.05Å; V492-F494 VanDerWaalsContact C-N 3.33Å; V492-F494 PolarHBondContact O-N 3.47Å; F494-G498 WeakPolarHBondContact O-CA 3.13Å; F494-G498 PolarHBondContact O-N 3.48Å; F494-W784 HydrophobicContact CB-CD2 3.83Å; F494-W784 HydrophobicContact CB-CE3 3.92Å; F494-W784 HydrophobicContact CB-CG 4.27Å; F494-W784 HydrophobicContact CB-CZ3 4.39Å; F494-W784 HydrophobicContact CD2-CD2 4.35Å; F494-W784 HydrophobicContact CD2-CE3 4.05Å; F494-W784 AromaticContact CD2-CH2 3.52Å; F494-W784 HydrophobicContact CD2-CH2 3.52Å; F494-W784 AromaticContact CD2-CZ2 3.79Å; F494-W784 HydrophobicContact CD2-CZ2 3.79Å; F494-W784 AromaticContact CD2-CZ3 3.63Å; F494-W784 HydrophobicContact CD2-CZ3 3.63Å; F494-W784 HydrophobicContact CE2-CH2 4.12Å; F494-W784 HydrophobicContact CE2-CZ3 4.39Å; F494-W784 HydrophobicContact CG-CE3 4.4Å; F494-W784 HydrophobicContact CG-CZ3 4.38Å
495L94.2Very high92.6Very high63 Ų6328.7 Ų28.733%0.3316%0.163SC..Hα-helixtrans-65.7-44.4-179.8-70.1177.2000110.9L98 I491 V492 P493 T499L98-L495 HydrophobicContact CD1-CD1 4.06Å; L98-L495 HydrophobicContact CD1-CD2 4.5Å; I491-L495 HydrophobicContact CG2-CD1 3.94Å; I491-L495 HydrophobicContact CG2-CG 4.26Å; I491-L495 WeakPolarHBondContact O-CG 3.34Å; I491-L495 PolarHBondContact O-N 2.99Å; V492-L495 PolarHBondContact O-N 3.31Å; P493-L495 PolarHBondContact O-N 3.27Å; L495-T499 WeakPolarHBondContact O-CB 3.46Å; L495-T499 WeakPolarHBondContact O-CG2 3.2Å; L495-T499 PolarHBondContact O-N 3.32Å; L495-T499 PolarHBondContact O-OG1 3.25Å
496F91.2Very high92.3Very high74 Ų7424.4 Ų24.433%0.32514%0.14SC..Hα-helixtrans-70.7-62-178.6178.5-99.2000112.4L12 V492 P493 G498 T499 L500 F776 F780L12-F496 HydrophobicContact CD1-CE2 3.56Å; L12-F496 HydrophobicContact CD1-CZ 3.44Å; L12-F496 VanDerWaalsContact CD1-CZ 3.44Å; L12-F496 HydrophobicContact CD2-CE2 3.86Å; L12-F496 HydrophobicContact CD2-CZ 3.55Å; L12-F496 HydrophobicContact CG-CE2 4.28Å; L12-F496 HydrophobicContact CG-CZ 4.14Å; V492-F496 PolarHBondContact O-N 2.97Å; V492-F496 VanDerWaalsContact O-N 3.15Å; P493-F496 PolarHBondContact O-N 3.46Å; F496-G498 PolarHBondContact O-N 2.87Å; F496-T499 PolarHBondContact O-OG1 2.95Å; F496-L500 PolarHBondContact O-N 3.19Å; F496-L500 VanDerWaalsContact O-N 3.15Å; F496-F776 HydrophobicContact CE1-CE1 4.44Å; F496-F780 AromaticContact CD1-CE1 3.81Å; F496-F780 HydrophobicContact CD1-CE1 3.81Å; F496-F780 AromaticContact CD1-CZ 3.9Å; F496-F780 HydrophobicContact CD1-CZ 3.9Å
497G93.1Very high92Very high0 Ų024.4 Ų24.40%014%0.141CC..Hα-helixtrans-68.5-36.5-176.200000112.4P493 Q501 N781P493-G497 WeakPolarHBondContact O-CA 3.42Å; P493-G497 PolarHBondContact O-N 3.11Å; G497-Q501 WeakPolarHBondContact O-CB 3.38Å; G497-Q501 PolarHBondContact O-N 2.71Å; G497-N781 VanDerWaalsContact CA-OD1 3.23Å; G497-N781 WeakPolarHBondContact CA-OD1 2.99Å; G497-N781 PolarHBondContact O-ND2 3.13Å; G497-N781 PolarHBondContact O-OD1 3Å
498G93.7Very high91.6Very high0 Ų025 Ų250%014%0.144CC..Hα-helixtrans-65.8-46.1178.100000112.4Y94 F494 F496 Q501 T502 N781Y94-G498 PolarHBondContact OH-O 3.41Å; F494-G498 WeakPolarHBondContact O-CA 3.13Å; F494-G498 PolarHBondContact O-N 3.48Å; F496-G498 PolarHBondContact O-N 2.87Å; G498-Q501 PolarHBondContact O-N 2.98Å; G498-T502 WeakPolarHBondContact O-CG2 3.18Å; G498-T502 PolarHBondContact O-N 3.37Å; G498-T502 PolarHBondContact O-OG1 3.18Å; G498-N781 PolarHBondContact N-OD1 2.92Å
499T90.1Very high91.4Very high49 Ų4924.5 Ų24.530%0.30114%0.136SC..Hα-helixtrans-67.2-42179.256.30000111.6Y94 L495 F496 Q501 T502 E503Y94-T499 HydrophobicContact CD1-CG2 4.39Å; Y94-T499 HydrophobicContact CE1-CG2 4.09Å; L495-T499 WeakPolarHBondContact O-CB 3.46Å; L495-T499 WeakPolarHBondContact O-CG2 3.2Å; L495-T499 PolarHBondContact O-N 3.32Å; L495-T499 PolarHBondContact O-OG1 3.25Å; F496-T499 PolarHBondContact O-OG1 2.95Å; T499-Q501 VanDerWaalsContact C-N 3.28Å; T499-Q501 PolarHBondContact O-N 2.86Å; T499-T502 PolarHBondContact O-N 3.05Å; T499-T502 PolarHBondContact O-OG1 3.27Å; T499-E503 VanDerWaalsContact O-CB 3.31Å; T499-E503 WeakPolarHBondContact O-CB 3.25Å; T499-E503 WeakPolarHBondContact O-CG 3.15Å; T499-E503 PolarHBondContact O-N 2.93Å
500L88.9Confident91Very high18 Ų1825.8 Ų25.89%0.09415%0.153CC..Hα-helixtrans-62.3-39.6176.3-166.461000111.4V9 L12 F496 T502 V504 C505 L777V9-L500 HydrophobicContact CG2-CD1 3.99Å; L12-L500 HydrophobicContact CD1-CD2 4.5Å; F496-L500 PolarHBondContact O-N 3.19Å; F496-L500 VanDerWaalsContact O-N 3.15Å; L500-T502 PolarHBondContact O-N 3.23Å; L500-V504 HydrophobicContact CD1-CB 4.08Å; L500-V504 HydrophobicContact CD1-CG2 3.82Å; L500-V504 WeakPolarHBondContact O-CB 3.44Å; L500-V504 PolarHBondContact O-N 2.93Å; L500-V504 VanDerWaalsContact O-N 3.11Å; L500-C505 PolarHBondContact O-N 3.27Å; L500-C505 VanDerWaalsContact O-N 3.16Å; L500-L777 HydrophobicContact CB-CD1 4.02Å; L500-L777 HydrophobicContact CB-CD2 4.41Å; L500-L777 HydrophobicContact CD2-CD1 3.8Å; L500-L777 HydrophobicContact CD2-CD2 4.06Å; L500-L777 HydrophobicContact CD2-CG 4.22Å; L500-L777 HydrophobicContact CG-CD1 3.72Å
501Q92.6Very high90.5Very high4 Ų428.8 Ų28.82%0.01916%0.162CC..Iπ-helixtrans-67.2-37.2179.3-172.562.66.300113.1N49 L52 G497 G498 T499 R506 R511 L777 N781N49-Q501 PolarHBondContact OD1-NE2 2.91Å; L52-Q501 HydrophobicContact CD1-CB 3.89Å; L52-Q501 HydrophobicContact CD1-CG 3.72Å; G497-Q501 WeakPolarHBondContact O-CB 3.38Å; G497-Q501 PolarHBondContact O-N 2.71Å; G498-Q501 PolarHBondContact O-N 2.98Å; T499-Q501 VanDerWaalsContact C-N 3.28Å; T499-Q501 PolarHBondContact O-N 2.86Å; Q501-R506 WeakPolarHBondContact O-CB 3.39Å; Q501-R506 PolarHBondContact O-N 3.48Å; Q501-R511 PolarHBondContact O-NH2 3.38Å; Q501-L777 HydrophobicContact CB-CD1 4.47Å; Q501-N781 WeakPolarHBondContact CB-ND2 3.43Å
502T90Very high90Very high0 Ų029.3 Ų29.30%016%0.163CC..Iπ-helixtrans-90.2-30.2-176.155.40000114.5L52 R56 Y94 G498 T499 L500 R506L52-T502 HydrophobicContact CB-CG2 3.74Å; R56-T502 HydrophobicContact CB-CG2 3.98Å; R56-T502 HydrophobicContact CG-CG2 4.33Å; Y94-T502 WeakPolarHBondContact OH-CG2 3.27Å; Y94-T502 PolarHBondContact OH-OG1 3.35Å; G498-T502 WeakPolarHBondContact O-CG2 3.18Å; G498-T502 PolarHBondContact O-N 3.37Å; G498-T502 PolarHBondContact O-OG1 3.18Å; T499-T502 PolarHBondContact O-N 3.05Å; T499-T502 PolarHBondContact O-OG1 3.27Å; L500-T502 PolarHBondContact O-N 3.23Å; T502-R506 WeakPolarHBondContact O-CB 3.35Å; T502-R506 PolarHBondContact O-NE 2.97Å
503E84.3Confident89.5Confident25 Ų2528.6 Ų28.612%0.11716%0.161CC..Iπ-helixtrans-94.4-23.8-178.1-62.4-57.8169.500114.5R56 Y91 T499 Y507R56-E503 IonicContact CZ-OE1 2.79Å; R56-E503 IonicContact CZ-OE2 3.41Å; R56-E503 IonicContact NE-OE1 2.68Å; R56-E503 PolarHBondContact NE-OE1 3.13Å; R56-E503 IonicContact NE-OE2 3.89Å; R56-E503 IonicContact NH2-OE1 3.88Å; R56-E503 PolarHBondContact NH2-OE1 3.44Å; R56-E503 IonicContact NH2-OE2 2.9Å; R56-E503 PolarHBondContact NH2-OE2 2.76Å; R56-E503 VanDerWaalsContact NH2-OE2 3.16Å; Y91-E503 WeakPolarHBondContact CE1-OE1 3.45Å; Y91-E503 PolarHBondContact OH-OE1 3.25Å; T499-E503 VanDerWaalsContact O-CB 3.31Å; T499-E503 WeakPolarHBondContact O-CB 3.25Å; T499-E503 WeakPolarHBondContact O-CG 3.15Å; T499-E503 PolarHBondContact O-N 2.93Å; E503-Y507 WeakPolarHBondContact O-CD2 3.22Å; E503-Y507 WeakPolarHBondContact O-CE2 3.33Å
504V86.2Confident89Confident17 Ų1732.5 Ų32.510%0.10318%0.181CC..Iπ-helixtrans-117-65.7-178.8178.30000109.3V9 L500 R506 Y507 L508 M519V9-V504 HydrophobicContact CG2-CG2 4.35Å; L500-V504 HydrophobicContact CD1-CB 4.08Å; L500-V504 HydrophobicContact CD1-CG2 3.82Å; L500-V504 WeakPolarHBondContact O-CB 3.44Å; L500-V504 PolarHBondContact O-N 2.93Å; L500-V504 VanDerWaalsContact O-N 3.11Å; V504-R506 VanDerWaalsContact C-N 3.34Å; V504-R506 PolarHBondContact O-N 3.28Å; V504-Y507 PolarHBondContact O-N 3.13Å; V504-Y507 VanDerWaalsContact O-N 3.07Å; V504-L508 HydrophobicContact CG1-CD1 3.7Å; V504-L508 HydrophobicContact CG1-CG 4.46Å; V504-L508 PolarHBondContact O-N 3.25Å; V504-L508 VanDerWaalsContact O-N 3.16Å; V504-M519 HydrophobicContact CG1-CE 4.14Å
505C91.7Very high88.5Confident0 Ų032 Ų320%018%0.179CC..Iπ-helixtrans-65.8-34.9-169.1-69.70000113.7L500 Y507 L508 T509 C773 L777L500-C505 PolarHBondContact O-N 3.27Å; L500-C505 VanDerWaalsContact O-N 3.16Å; C505-Y507 PolarHBondContact O-N 2.95Å; C505-L508 PolarHBondContact O-N 3.07Å; C505-T509 VanDerWaalsContact O-CB 3.3Å; C505-T509 WeakPolarHBondContact O-CB 3.31Å; C505-T509 WeakPolarHBondContact O-CG2 3.25Å; C505-T509 PolarHBondContact O-N 3.32Å; C505-T509 PolarHBondContact O-OG1 2.89Å; C505-C773 WeakPolarHBondContact CA-SG 3.45Å; C505-C773 HydrophobicContact CB-CB 3.5Å; C505-C773 VanDerWaalsContact CB-CB 3.5Å; C505-C773 WeakPolarHBondContact CB-SG 3.46Å; C505-C773 WeakPolarHBondContact SG-CA 3.42Å; C505-C773 WeakPolarHBondContact SG-CB 3.28Å; C505-C773 CovalentContact SG-SG 2.03Å; C505-C773 PolarHBondContact SG-SG 3.49Å; C505-L777 HydrophobicContact CB-CD1 4.48Å; C505-L777 WeakPolarHBondContact SG-CD1 2.85Å
506R90.4Very high88.1Confident7 Ų729.4 Ų29.43%0.02617%0.166CC..Hα-helixtrans-56.9-33.1176.1-167.2179.167.9165.92.8113D53 G57 Q501 T502 V504 R511 Y512D53-R506 WeakPolarHBondContact OD1-CD 3.44Å; G57-R506 PolarHBondContact O-NH1 2.91Å; Q501-R506 WeakPolarHBondContact O-CB 3.39Å; Q501-R506 PolarHBondContact O-N 3.48Å; T502-R506 WeakPolarHBondContact O-CB 3.35Å; T502-R506 PolarHBondContact O-NE 2.97Å; V504-R506 VanDerWaalsContact C-N 3.34Å; V504-R506 PolarHBondContact O-N 3.28Å; R506-R511 HydrophobicContact CG-CB 3.96Å; R506-R511 PolarHBondContact O-N 2.97Å; R506-Y512 PolarHBondContact O-N 2.76Å
507Y88.5Confident87.8Confident1 Ų131.6 Ų31.60%0.00417%0.172CC..Hα-helixtrans-83.7-47178.1-59.7-77.1000111.6P61 E503 V504 C505 T509 G510 Y512 G515 P516 M519P61-Y507 VanDerWaalsContact CD-OH 3.27Å; P61-Y507 WeakPolarHBondContact CD-OH 3.3Å; P61-Y507 HydrophobicContact CG-CE1 4.02Å; P61-Y507 HydrophobicContact CG-CE2 4.26Å; E503-Y507 WeakPolarHBondContact O-CD2 3.22Å; E503-Y507 WeakPolarHBondContact O-CE2 3.33Å; V504-Y507 PolarHBondContact O-N 3.13Å; V504-Y507 VanDerWaalsContact O-N 3.07Å; C505-Y507 PolarHBondContact O-N 2.95Å; Y507-T509 VanDerWaalsContact C-N 3.34Å; Y507-T509 PolarHBondContact O-N 3.32Å; Y507-G510 PolarHBondContact O-N 3.23Å; Y507-Y512 HydrophobicContact CD1-CD1 4.06Å; Y507-Y512 HydrophobicContact CD1-CG 4.15Å; Y507-Y512 AromaticContact CE1-CD1 3.81Å; Y507-Y512 HydrophobicContact CE1-CD1 3.81Å; Y507-Y512 HydrophobicContact CE1-CD2 4.44Å; Y507-Y512 HydrophobicContact CE1-CE1 4.29Å; Y507-Y512 AromaticContact CE1-CG 3.88Å; Y507-Y512 HydrophobicContact CE1-CG 3.88Å; Y507-G515 CarbonylContact O-C 3.56Å; Y507-G515 WeakPolarHBondContact O-CA 3.16Å; Y507-P516 WeakPolarHBondContact O-CD 3.11Å; Y507-M519 HydrophobicContact CG-CB 4.48Å
508L89.9Confident87.2Confident31 Ų3134 Ų3416%0.16218%0.182CC..Hα-helixtrans-70.7-26.9-176.6-62179.2000113.9V504 C505 M519 L573 V769V504-L508 HydrophobicContact CG1-CD1 3.7Å; V504-L508 HydrophobicContact CG1-CG 4.46Å; V504-L508 PolarHBondContact O-N 3.25Å; V504-L508 VanDerWaalsContact O-N 3.16Å; C505-L508 PolarHBondContact O-N 3.07Å; L508-M519 HydrophobicContact CD1-CE 4.48Å; L508-M519 HydrophobicContact CD1-SD 4.28Å; L508-M519 HydrophobicContact CD2-SD 3.5Å; L508-M519 WeakPolarHBondContact CD2-SD 3.37Å; L508-M519 HydrophobicContact CG-SD 3.7Å; L508-L573 HydrophobicContact CB-CD1 4.41Å; L508-L573 HydrophobicContact CD2-CD1 3.82Å; L508-V769 HydrophobicContact CB-CG1 3.6Å; L508-V769 HydrophobicContact CB-CG2 4.1Å; L508-V769 HydrophobicContact CD1-CG2 4.26Å
509T88.8Confident86.4Confident38 Ų3835.3 Ų35.323%0.23319%0.189CC..THydrogen-bonded Turntrans-88.5-1.4179.360.20000113.8C505 Y507 R511 V769 C773C505-T509 VanDerWaalsContact O-CB 3.3Å; C505-T509 WeakPolarHBondContact O-CB 3.31Å; C505-T509 WeakPolarHBondContact O-CG2 3.25Å; C505-T509 PolarHBondContact O-N 3.32Å; C505-T509 PolarHBondContact O-OG1 2.89Å; Y507-T509 VanDerWaalsContact C-N 3.34Å; Y507-T509 PolarHBondContact O-N 3.32Å; T509-R511 VanDerWaalsContact C-N 3.31Å; T509-R511 PolarHBondContact O-N 2.65Å; T509-V769 HydrophobicContact CG2-CG1 3.94Å; T509-C773 HydrophobicContact CG2-CB 3.66Å
510G84.1Confident85.8Confident51 Ų5133.5 Ų33.553%0.52618%0.178SC..SBendtrans77.58.3-178.400000115.1Y507 Y512Y507-G510 PolarHBondContact O-N 3.23Å; G510-Y512 PolarHBondContact O-N 2.9Å
511R85.7Confident85.2Confident74 Ų7436.2 Ų36.228%0.27919%0.19SC..SBendtrans-65.8-27.1174.5-71.8-162.5-65.2135.6-2.3112.9N49 D53 Q501 R506 T509N49-R511 PolarHBondContact OD1-NH1 2.62Å; N49-R511 PolarHBondContact OD1-NH2 2.96Å; D53-R511 VanDerWaalsContact CG-NH1 3.32Å; D53-R511 IonicContact OD1-NH1 3.17Å; D53-R511 PolarHBondContact OD1-NH1 2.89Å; D53-R511 VanDerWaalsContact OD1-NH1 3.17Å; D53-R511 IonicContact OD2-CZ 2.89Å; D53-R511 IonicContact OD2-NH1 3.05Å; D53-R511 PolarHBondContact OD2-NH1 3.42Å; Q501-R511 PolarHBondContact O-NH2 3.38Å; R506-R511 HydrophobicContact CG-CB 3.96Å; R506-R511 PolarHBondContact O-N 2.97Å; T509-R511 VanDerWaalsContact C-N 3.31Å; T509-R511 PolarHBondContact O-N 2.65Å
512Y84.5Confident84.2Confident31 Ų3137.8 Ų37.812%0.12220%0.196CC..SBendtrans-98.4134168.9-160.8-96.6000110.6K58 R506 Y507 G510 D514 G515 K518K58-Y512 PolarHBondContact O-OH 3.4Å; R506-Y512 PolarHBondContact O-N 2.76Å; Y507-Y512 HydrophobicContact CD1-CD1 4.06Å; Y507-Y512 HydrophobicContact CD1-CG 4.15Å; Y507-Y512 AromaticContact CE1-CD1 3.81Å; Y507-Y512 HydrophobicContact CE1-CD1 3.81Å; Y507-Y512 HydrophobicContact CE1-CD2 4.44Å; Y507-Y512 HydrophobicContact CE1-CE1 4.29Å; Y507-Y512 AromaticContact CE1-CG 3.88Å; Y507-Y512 HydrophobicContact CE1-CG 3.88Å; G510-Y512 PolarHBondContact O-N 2.9Å; Y512-D514 PolarHBondContact O-N 3.32Å; Y512-G515 WeakPolarHBondContact O-CA 3.27Å; Y512-G515 PolarHBondContact O-N 3.04Å; Y512-K518 HydrophobicContact CD1-CD 3.85Å; Y512-K518 HydrophobicContact CE1-CD 3.42Å; Y512-K518 VanDerWaalsContact CE1-CD 3.42Å; Y512-K518 VanDerWaalsContact CE1-NZ 3.3Å
513P82.3Confident83.2Confident89 Ų8938.7 Ų38.758%0.57820%0.201SC*.THydrogen-bonded Turntrans-58.7130.6176.8-2332.2000111.9G515 K518P513-G515 PolarHBondContact O-N 2.95Å; P513-K518 PolarHBondContact O-NZ 3.49Å
514D82.4Confident82.5Confident100 Ų10039 Ų3954%0.53520%0.202SC..THydrogen-bonded Turntrans54.836.7-173.6-44.3-51.6000112.3Y512 R517 K518Y512-D514 PolarHBondContact O-N 3.32Å; D514-R517 PolarHBondContact O-N 3.39Å; D514-K518 WeakPolarHBondContact O-CG 3.31Å; D514-K518 PolarHBondContact O-N 3.11Å
515G85.9Confident81.6Confident1 Ų142 Ų421%0.0122%0.215CC..Hα-helixtrans-54.1-58.9-17200000113.6Y507 Y512 P513 R517 K518 M519Y507-G515 CarbonylContact O-C 3.56Å; Y507-G515 WeakPolarHBondContact O-CA 3.16Å; Y512-G515 WeakPolarHBondContact O-CA 3.27Å; Y512-G515 PolarHBondContact O-N 3.04Å; P513-G515 PolarHBondContact O-N 2.95Å; G515-R517 VanDerWaalsContact C-N 3.34Å; G515-R517 PolarHBondContact O-N 3.38Å; G515-K518 PolarHBondContact O-N 3.33Å; G515-K518 VanDerWaalsContact O-N 3.17Å; G515-M519 PolarHBondContact O-N 3.31Å
516P87Confident80.4Confident8 Ų842.1 Ų42.15%0.05222%0.216CC..Hα-helixtrans-58.1-43.8-178.7-26.437.1000112.5Y507 K518 M519 D520 D570 L573Y507-P516 WeakPolarHBondContact O-CD 3.11Å; P516-K518 PolarHBondContact O-N 2.91Å; P516-M519 WeakPolarHBondContact O-CB 3.12Å; P516-M519 PolarHBondContact O-N 2.93Å; P516-M519 VanDerWaalsContact O-N 3.16Å; P516-D520 PolarHBondContact O-N 3.16Å; P516-D570 HydrophobicContact CB-CB 4.48Å; P516-L573 HydrophobicContact CB-CB 4.48Å; P516-L573 HydrophobicContact CG-CB 4.17Å; P516-L573 HydrophobicContact CG-CD1 4.36Å
517R84.2Confident79.1Confident119 Ų11944.5 Ų44.545%0.44923%0.229SC..Hα-helixtrans-59.1-44.4175.4-175176143.8177.3-5.3113.3D514 G515 M519 D520 Q521 D570D514-R517 PolarHBondContact O-N 3.39Å; G515-R517 VanDerWaalsContact C-N 3.34Å; G515-R517 PolarHBondContact O-N 3.38Å; R517-M519 VanDerWaalsContact C-N 3.29Å; R517-M519 PolarHBondContact O-N 2.03Å; R517-D520 PolarHBondContact O-N 2.82Å; R517-Q521 WeakPolarHBondContact O-CB 3.43Å; R517-Q521 VanDerWaalsContact O-CG 3.29Å; R517-Q521 WeakPolarHBondContact O-CG 3.48Å; R517-Q521 PolarHBondContact O-N 2.77Å; R517-D570 HydrophobicContact CB-CB 3.9Å
518K79.4Confident78.1Confident50 Ų5047 Ų4722%0.21724%0.24CC..Hα-helixtrans-68.7-31.8178.1-74.7175.6-177151.30112.1Y512 P513 D514 G515 P516 Y522Y512-K518 HydrophobicContact CD1-CD 3.85Å; Y512-K518 HydrophobicContact CE1-CD 3.42Å; Y512-K518 VanDerWaalsContact CE1-CD 3.42Å; Y512-K518 VanDerWaalsContact CE1-NZ 3.3Å; P513-K518 PolarHBondContact O-NZ 3.49Å; D514-K518 WeakPolarHBondContact O-CG 3.31Å; D514-K518 PolarHBondContact O-N 3.11Å; G515-K518 PolarHBondContact O-N 3.33Å; G515-K518 VanDerWaalsContact O-N 3.17Å; P516-K518 PolarHBondContact O-N 2.91Å; K518-Y522 WeakPolarHBondContact O-CB 3.23Å; K518-Y522 PolarHBondContact O-N 2.98Å
519M77.9Confident76.8Confident29 Ų2946.6 Ų46.614%0.14324%0.239CC..Hα-helixtrans-68.1-44.4172.9-171.6171.3-17800111.1V504 Y507 L508 G515 P516 R517 Y522 V523V504-M519 HydrophobicContact CG1-CE 4.14Å; Y507-M519 HydrophobicContact CG-CB 4.48Å; L508-M519 HydrophobicContact CD1-CE 4.48Å; L508-M519 HydrophobicContact CD1-SD 4.28Å; L508-M519 HydrophobicContact CD2-SD 3.5Å; L508-M519 WeakPolarHBondContact CD2-SD 3.37Å; L508-M519 HydrophobicContact CG-SD 3.7Å; G515-M519 PolarHBondContact O-N 3.31Å; P516-M519 WeakPolarHBondContact O-CB 3.12Å; P516-M519 PolarHBondContact O-N 2.93Å; P516-M519 VanDerWaalsContact O-N 3.16Å; R517-M519 VanDerWaalsContact C-N 3.29Å; R517-M519 PolarHBondContact O-N 2.03Å; M519-Y522 WeakPolarHBondContact O-CB 3.46Å; M519-Y522 PolarHBondContact O-N 3.48Å; M519-V523 WeakPolarHBondContact O-CG2 3.23Å; M519-V523 PolarHBondContact O-N 3.39Å
520D78Confident75.5Confident11 Ų1148.4 Ų48.46%0.05925%0.247CC..Hα-helixtrans-60.9-46.9175.1-71.7-32.3000111.7P516 R517 Y522 V523 F524 N567 L568 S569 D570P516-D520 PolarHBondContact O-N 3.16Å; R517-D520 PolarHBondContact O-N 2.82Å; D520-Y522 VanDerWaalsContact C-N 3.27Å; D520-Y522 PolarHBondContact O-N 3.27Å; D520-V523 PolarHBondContact O-N 3.12Å; D520-F524 VanDerWaalsContact O-CB 3.28Å; D520-F524 WeakPolarHBondContact O-CB 3.39Å; D520-F524 PolarHBondContact O-N 3.45Å; D520-N567 HydrophobicContact CB-CB 3.99Å; D520-N567 WeakPolarHBondContact OD2-CA 3.27Å; D520-N567 VanDerWaalsContact OD2-O 3.12Å; D520-L568 PolarHBondContact OD2-N 2.74Å; D520-S569 WeakPolarHBondContact OD1-CB 3.18Å; D520-S569 PolarHBondContact OD1-N 3.43Å; D520-S569 PolarHBondContact OD1-OG 3.48Å; D520-S569 WeakPolarHBondContact OD2-CA 3.14Å; D520-S569 VanDerWaalsContact OD2-CB 3.29Å; D520-S569 WeakPolarHBondContact OD2-CB 3.32Å; D520-S569 PolarHBondContact OD2-N 3.43Å; D520-D570 PolarHBondContact OD2-N 2.99Å
521Q74.8Confident74.6Confident75 Ų7546.8 Ų46.835%0.3523%0.225SC..Hα-helixtrans-58.3-41.2174.3-73.6179.6-16.100111.9R517 F524 E525R517-Q521 WeakPolarHBondContact O-CB 3.43Å; R517-Q521 VanDerWaalsContact O-CG 3.29Å; R517-Q521 WeakPolarHBondContact O-CG 3.48Å; R517-Q521 PolarHBondContact O-N 2.77Å; Q521-F524 PolarHBondContact O-N 2.69Å; Q521-E525 WeakPolarHBondContact O-CB 3.41Å; Q521-E525 WeakPolarHBondContact O-CG 3.35Å; Q521-E525 PolarHBondContact O-N 2.88Å
522Y71.5Confident73.7Confident37 Ų3749.9 Ų49.915%0.14524%0.238CC..Hα-helixtrans-62.6-47.5175.8171.5-101000111.8M2 P61 F65 K518 M519 D520 S526M2-Y522 HydrophobicContact CE-CD1 3.97Å; M2-Y522 HydrophobicContact CE-CE1 3.21Å; M2-Y522 HydrophobicContact CE-CE2 4.48Å; M2-Y522 HydrophobicContact SD-CE1 4.39Å; P61-Y522 HydrophobicContact CB-CD2 3.69Å; P61-Y522 HydrophobicContact CB-CE2 3.92Å; P61-Y522 HydrophobicContact CB-CG 4.08Å; P61-Y522 HydrophobicContact CG-CD2 4.12Å; P61-Y522 HydrophobicContact CG-CG 4.17Å; P61-Y522 VanDerWaalsContact O-CE2 3.32Å; P61-Y522 WeakPolarHBondContact O-CE2 3.4Å; F65-Y522 HydrophobicContact CB-CD2 4.14Å; F65-Y522 HydrophobicContact CB-CE2 3.48Å; F65-Y522 VanDerWaalsContact CB-CE2 3.48Å; F65-Y522 HydrophobicContact CG-CE2 4.28Å; K518-Y522 WeakPolarHBondContact O-CB 3.23Å; K518-Y522 PolarHBondContact O-N 2.98Å; M519-Y522 WeakPolarHBondContact O-CB 3.46Å; M519-Y522 PolarHBondContact O-N 3.48Å; D520-Y522 VanDerWaalsContact C-N 3.27Å; D520-Y522 PolarHBondContact O-N 3.27Å; Y522-S526 WeakPolarHBondContact O-CB 3.22Å; Y522-S526 PolarHBondContact O-N 3.02Å; Y522-S526 PolarHBondContact O-OG 2.84Å
523V69.4Low72.6Confident18 Ų1850.2 Ų50.211%0.10925%0.247CC..Hα-helixtrans-64.9-41.7177.6176.20000111.2F6 M519 D520 S526 L527 I564F6-V523 HydrophobicContact CE2-CG2 3.73Å; F6-V523 HydrophobicContact CZ-CG1 4.12Å; F6-V523 HydrophobicContact CZ-CG2 3.82Å; M519-V523 WeakPolarHBondContact O-CG2 3.23Å; M519-V523 PolarHBondContact O-N 3.39Å; D520-V523 PolarHBondContact O-N 3.12Å; V523-S526 WeakPolarHBondContact O-CB 3.38Å; V523-S526 PolarHBondContact O-N 3.3Å; V523-L527 HydrophobicContact CG1-CD1 3.88Å; V523-L527 PolarHBondContact O-N 3.27Å; V523-I564 HydrophobicContact CB-CG2 4.46Å; V523-I564 HydrophobicContact CG1-CD1 4.29Å; V523-I564 HydrophobicContact CG1-CG2 4Å
524F71Confident71.6Confident31 Ų3147.1 Ų47.114%0.13623%0.227CC..Hα-helixtrans-62.3-56.6178.5179-103.3000112.3D520 Q521 S526 L527 K528 L561 I564 R565D520-F524 VanDerWaalsContact O-CB 3.28Å; D520-F524 WeakPolarHBondContact O-CB 3.39Å; D520-F524 PolarHBondContact O-N 3.45Å; Q521-F524 PolarHBondContact O-N 2.69Å; F524-S526 PolarHBondContact O-N 3.39Å; F524-L527 PolarHBondContact O-N 2.87Å; F524-K528 HydrophobicContact CE1-CD 3.82Å; F524-K528 HydrophobicContact CZ-CD 4.14Å; F524-K528 VanDerWaalsContact O-CB 3.23Å; F524-K528 WeakPolarHBondContact O-CB 3.36Å; F524-K528 PolarHBondContact O-N 3.41Å; F524-L561 HydrophobicContact CD2-CD1 4.31Å; F524-L561 HydrophobicContact CE2-CD1 4.16Å; F524-L561 HydrophobicContact CE2-CG 4.13Å; F524-I564 HydrophobicContact CB-CG2 3.84Å; F524-I564 HydrophobicContact CD2-CG2 4.17Å; F524-R565 HydrophobicContact CD2-CB 4.32Å; F524-R565 HydrophobicContact CD2-CG 4.4Å; F524-R565 HydrophobicContact CE2-CB 3.94Å; F524-R565 HydrophobicContact CE2-CG 3.76Å; F524-R565 HydrophobicContact CZ-CG 4.03Å
525E67.1Low70.8Confident81 Ų8146.2 Ų46.238%0.37922%0.219SC..Hα-helixtrans-61.4-28177.2-69.9-58.3147.400110.6Q521 K528 S529Q521-E525 WeakPolarHBondContact O-CB 3.41Å; Q521-E525 WeakPolarHBondContact O-CG 3.35Å; Q521-E525 PolarHBondContact O-N 2.88Å; E525-K528 IonicContact OE1-NZ 2.87Å; E525-K528 PolarHBondContact OE1-NZ 3.35Å; E525-K528 VanDerWaalsContact OE1-NZ 3.1Å; E525-K528 IonicContact OE2-NZ 3.84Å; E525-K528 PolarHBondContact OE2-NZ 3.44Å; E525-S529 WeakPolarHBondContact O-CB 3.25Å; E525-S529 PolarHBondContact O-N 2.85Å; E525-S529 PolarHBondContact O-OG 3.42Å
526S64.7Low69.6Low2 Ų248.3 Ų48.31%0.01424%0.24CC..Hα-helixtrans-65.3-52.2173.9-57.50000115M2 F65 Y522 V523 F524 K528 S529 I530M2-S526 VanDerWaalsContact CE-CB 3.44Å; M2-S526 WeakPolarHBondContact CE-OG 3.36Å; F65-S526 WeakPolarHBondContact CD1-OG 3.24Å; F65-S526 WeakPolarHBondContact CD2-OG 3.38Å; F65-S526 WeakPolarHBondContact CE1-OG 3.33Å; F65-S526 WeakPolarHBondContact CE2-OG 3.44Å; F65-S526 VanDerWaalsContact CG-OG 3.24Å; F65-S526 WeakPolarHBondContact CG-OG 3.45Å; F65-S526 VanDerWaalsContact CZ-CB 3.41Å; F65-S526 WeakPolarHBondContact CZ-O 3.35Å; F65-S526 WeakPolarHBondContact CZ-OG 3.39Å; Y522-S526 WeakPolarHBondContact O-CB 3.22Å; Y522-S526 PolarHBondContact O-N 3.02Å; Y522-S526 PolarHBondContact O-OG 2.84Å; V523-S526 WeakPolarHBondContact O-CB 3.38Å; V523-S526 PolarHBondContact O-N 3.3Å; F524-S526 PolarHBondContact O-N 3.39Å; S526-K528 VanDerWaalsContact C-N 3.35Å; S526-S529 PolarHBondContact O-N 2.95Å; S526-S529 PolarHBondContact O-OG 3.13Å; S526-I530 VanDerWaalsContact O-CG1 3.31Å; S526-I530 WeakPolarHBondContact O-CG1 3.4Å; S526-I530 PolarHBondContact O-N 2.64Å
527L64Low68.3Low57 Ų5750.3 Ų50.330%0.29826%0.255SS..Hα-helixtrans-69.8-35.8178.7-71.7163.4000112.2V523 F524 S529 I530 F531 L561 I564V523-L527 HydrophobicContact CG1-CD1 3.88Å; V523-L527 PolarHBondContact O-N 3.27Å; F524-L527 PolarHBondContact O-N 2.87Å; L527-S529 PolarHBondContact O-N 3.2Å; L527-I530 PolarHBondContact O-N 3.41Å; L527-F531 VanDerWaalsContact O-CB 3.27Å; L527-F531 WeakPolarHBondContact O-CB 3.29Å; L527-F531 PolarHBondContact O-N 3.49Å; L527-L561 HydrophobicContact CB-CD1 3.81Å; L527-I564 HydrophobicContact CD1-CD1 3.02Å; L527-I564 HydrophobicContact CD1-CG1 4.41Å; L527-I564 HydrophobicContact CG-CD1 4.47Å
528K66.6Low66.9Low55 Ų5547 Ų4724%0.23925%0.246CC..Hα-helixtrans-59-45.3175.7178173.9158.3-146.60111.9F524 E525 S526 F531 Y532 L561F524-K528 HydrophobicContact CE1-CD 3.82Å; F524-K528 HydrophobicContact CZ-CD 4.14Å; F524-K528 VanDerWaalsContact O-CB 3.23Å; F524-K528 WeakPolarHBondContact O-CB 3.36Å; F524-K528 PolarHBondContact O-N 3.41Å; E525-K528 IonicContact OE1-NZ 2.87Å; E525-K528 PolarHBondContact OE1-NZ 3.35Å; E525-K528 VanDerWaalsContact OE1-NZ 3.1Å; E525-K528 IonicContact OE2-NZ 3.84Å; E525-K528 PolarHBondContact OE2-NZ 3.44Å; S526-K528 VanDerWaalsContact C-N 3.35Å; K528-F531 WeakPolarHBondContact O-CB 3.37Å; K528-F531 PolarHBondContact O-N 2.83Å; K528-Y532 HydrophobicContact CD-CE2 4.22Å; K528-Y532 HydrophobicContact CG-CD2 3.88Å; K528-Y532 HydrophobicContact CG-CE2 3.49Å; K528-Y532 VanDerWaalsContact CG-CE2 3.49Å; K528-Y532 WeakPolarHBondContact O-CD2 3.27Å; K528-Y532 PolarHBondContact O-N 3.42Å; K528-L561 HydrophobicContact CB-CD1 4.1Å
529S63.1Low65.7Low21 Ų2149.7 Ų49.715%0.14727%0.271CS..Hα-helixtrans-68.4-38.9178.170.70000113.3F65 V69 E525 S526 L527 F531 Y532 A533F65-S529 WeakPolarHBondContact CE1-OG 3.5Å; F65-S529 WeakPolarHBondContact CZ-OG 2.74Å; V69-S529 WeakPolarHBondContact CG2-OG 3.11Å; E525-S529 WeakPolarHBondContact O-CB 3.25Å; E525-S529 PolarHBondContact O-N 2.85Å; E525-S529 PolarHBondContact O-OG 3.42Å; S526-S529 PolarHBondContact O-N 2.95Å; S526-S529 PolarHBondContact O-OG 3.13Å; L527-S529 PolarHBondContact O-N 3.2Å; S529-F531 VanDerWaalsContact C-N 3.32Å; S529-Y532 PolarHBondContact O-N 3.1Å; S529-A533 VanDerWaalsContact O-CB 3.32Å; S529-A533 WeakPolarHBondContact O-CB 3.45Å; S529-A533 PolarHBondContact O-N 2.96Å
530I62.4Low64.5Low77 Ų7754 Ų5440%0.39529%0.294SS..Hα-helixtrans-63.3-43.6174.9-68.4166.9000109.2S526 L527 A533 V534S526-I530 VanDerWaalsContact O-CG1 3.31Å; S526-I530 WeakPolarHBondContact O-CG1 3.4Å; S526-I530 PolarHBondContact O-N 2.64Å; L527-I530 PolarHBondContact O-N 3.41Å; I530-A533 PolarHBondContact O-N 3.01Å; I530-V534 HydrophobicContact CG2-CG2 4.42Å; I530-V534 VanDerWaalsContact O-CG2 3.26Å; I530-V534 WeakPolarHBondContact O-CG2 3.32Å; I530-V534 PolarHBondContact O-N 3.47Å
531F65.2Low63Low16 Ų1656.5 Ų56.57%0.0731%0.313CS..Hα-helixtrans-57.4-52.6175.6-177.2-89.7000111.7L527 K528 S529 A533 V534 E535 L554 I557L527-F531 VanDerWaalsContact O-CB 3.27Å; L527-F531 WeakPolarHBondContact O-CB 3.29Å; L527-F531 PolarHBondContact O-N 3.49Å; K528-F531 WeakPolarHBondContact O-CB 3.37Å; K528-F531 PolarHBondContact O-N 2.83Å; S529-F531 VanDerWaalsContact C-N 3.32Å; F531-A533 VanDerWaalsContact C-N 3.33Å; F531-A533 PolarHBondContact O-N 3.38Å; F531-V534 PolarHBondContact O-N 3.29Å; F531-E535 WeakPolarHBondContact CE1-OE2 3.3Å; F531-E535 WeakPolarHBondContact O-CB 3.19Å; F531-E535 PolarHBondContact O-N 3.49Å; F531-L554 HydrophobicContact CD2-CD1 3.49Å; F531-L554 VanDerWaalsContact CD2-CD1 3.49Å; F531-L554 HydrophobicContact CD2-CG 4.23Å; F531-L554 HydrophobicContact CE2-CD1 3.45Å; F531-L554 VanDerWaalsContact CE2-CD1 3.45Å; F531-L554 HydrophobicContact CE2-CD2 4.37Å; F531-L554 HydrophobicContact CE2-CG 3.65Å; F531-L554 HydrophobicContact CG-CD1 4.35Å; F531-L554 HydrophobicContact CZ-CD1 4.27Å; F531-L554 HydrophobicContact CZ-CD2 4.47Å; F531-L554 HydrophobicContact CZ-CG 4.19Å; F531-I557 HydrophobicContact CD2-CG2 4.12Å
532Y65.8Low62Low139 Ų13958 Ų5855%0.54533%0.332SS..Hα-helixtrans-64.6-34.6178.5-72.2-49.4000113.5K528 S529 G536K528-Y532 HydrophobicContact CD-CE2 4.22Å; K528-Y532 HydrophobicContact CG-CD2 3.88Å; K528-Y532 HydrophobicContact CG-CE2 3.49Å; K528-Y532 VanDerWaalsContact CG-CE2 3.49Å; K528-Y532 WeakPolarHBondContact O-CD2 3.27Å; K528-Y532 PolarHBondContact O-N 3.42Å; S529-Y532 PolarHBondContact O-N 3.1Å; Y532-G536 PolarHBondContact O-N 3.12Å
533A61.8Low60.8Low39 Ų3965.7 Ų65.732%0.32237%0.366SS..Hα-helixtrans-63.8-44.3174.600000111.7T73 S529 I530 F531 S537T73-A533 HydrophobicContact CG2-CB 3.55Å; S529-A533 VanDerWaalsContact O-CB 3.32Å; S529-A533 WeakPolarHBondContact O-CB 3.45Å; S529-A533 PolarHBondContact O-N 2.96Å; I530-A533 PolarHBondContact O-N 3.01Å; F531-A533 VanDerWaalsContact C-N 3.33Å; F531-A533 PolarHBondContact O-N 3.38Å; A533-S537 WeakPolarHBondContact O-CB 3.33Å; A533-S537 PolarHBondContact O-N 3.19Å; A533-S537 VanDerWaalsContact O-N 3.08Å; A533-S537 PolarHBondContact O-OG 2.85Å
534V61.1Low59.4Low24 Ų2468.6 Ų68.615%0.14539%0.387CS..Hα-helixtrans-66.6-45.6177.1174.30000110.7I530 F531 G536 S537 L538 V549 L554I530-V534 HydrophobicContact CG2-CG2 4.42Å; I530-V534 VanDerWaalsContact O-CG2 3.26Å; I530-V534 WeakPolarHBondContact O-CG2 3.32Å; I530-V534 PolarHBondContact O-N 3.47Å; F531-V534 PolarHBondContact O-N 3.29Å; V534-G536 PolarHBondContact O-N 3.43Å; V534-S537 PolarHBondContact O-N 2.95Å; V534-S537 PolarHBondContact O-OG 2.83Å; V534-L538 HydrophobicContact CG1-CD1 4.36Å; V534-L538 PolarHBondContact O-N 3.46Å; V534-L538 VanDerWaalsContact O-N 3.15Å; V534-V549 HydrophobicContact CG1-CB 4.2Å; V534-V549 HydrophobicContact CG1-CG1 3.96Å; V534-V549 HydrophobicContact CG1-CG2 4.23Å; V534-L554 HydrophobicContact CB-CD1 4.24Å; V534-L554 HydrophobicContact CG1-CD1 3.85Å; V534-L554 HydrophobicContact CG1-CD2 4.48Å
535E66.3Low57.9Low81 Ų8179.3 Ų79.338%0.37943%0.426SS..Hα-helixtrans-61.7-43.7178.1-171.9172.8-155.400112.4F531 S537 L538 S539 L554F531-E535 WeakPolarHBondContact CE1-OE2 3.3Å; F531-E535 WeakPolarHBondContact O-CB 3.19Å; F531-E535 PolarHBondContact O-N 3.49Å; E535-S537 PolarHBondContact O-N 3.35Å; E535-L538 PolarHBondContact O-N 2.95Å; E535-S539 PolarHBondContact O-N 3.07Å; E535-L554 HydrophobicContact CB-CD2 4.13Å; E535-L554 HydrophobicContact CG-CD2 4.46Å
536G60.5Low56.7Low44 Ų4481.7 Ų81.745%0.45445%0.447SS..Hα-helixtrans-62-42.2175.400000112.7Y532 V534 L538 S539 D540Y532-G536 PolarHBondContact O-N 3.12Å; V534-G536 PolarHBondContact O-N 3.43Å; G536-L538 VanDerWaalsContact C-N 3.27Å; G536-L538 PolarHBondContact O-N 3.22Å; G536-S539 PolarHBondContact O-N 2.75Å; G536-D540 PolarHBondContact O-N 2.56Å
537S59.3Low55.7Low50 Ų5087.7 Ų87.735%0.3547%0.473SS..Hα-helixtrans-65.3-28.6178.470.20000113.5A533 V534 E535 S541A533-S537 WeakPolarHBondContact O-CB 3.33Å; A533-S537 PolarHBondContact O-N 3.19Å; A533-S537 VanDerWaalsContact O-N 3.08Å; A533-S537 PolarHBondContact O-OG 2.85Å; V534-S537 PolarHBondContact O-N 2.95Å; V534-S537 PolarHBondContact O-OG 2.83Å; E535-S537 PolarHBondContact O-N 3.35Å; S537-S541 PolarHBondContact O-N 3.45Å
538L54.7Low54.7Low50 Ų5094.5 Ų94.526%0.26250%0.503SS..Hα-helixtrans-70.4-38.2175.4-76.2163.8000112.4V534 E535 G536 D540 S541 V549 L554V534-L538 HydrophobicContact CG1-CD1 4.36Å; V534-L538 PolarHBondContact O-N 3.46Å; V534-L538 VanDerWaalsContact O-N 3.15Å; E535-L538 PolarHBondContact O-N 2.95Å; G536-L538 VanDerWaalsContact C-N 3.27Å; G536-L538 PolarHBondContact O-N 3.22Å; L538-D540 VanDerWaalsContact C-N 3.31Å; L538-D540 PolarHBondContact O-N 3.4Å; L538-S541 WeakPolarHBondContact O-CB 3.46Å; L538-S541 PolarHBondContact O-N 3.36Å; L538-S541 PolarHBondContact O-OG 3.14Å; L538-V549 WeakPolarHBondContact CD2-O 3.39Å; L538-L554 HydrophobicContact CD1-CD2 3.78Å
539S54.2Low53.9Low107 Ų10792.9 Ų92.975%0.74850%0.498SS*.Hα-helixtrans-66.6-32.1176.2-78.80000112.8E535 G536E535-S539 PolarHBondContact O-N 3.07Å; G536-S539 PolarHBondContact O-N 2.75Å
540D52.2Low53.6Low118 Ų11895.8 Ų95.863%0.63151%0.511SS*.Hα-helixtrans-88.8-5.5-179.6-120.51.6000113.7G536 L538 S542 K543G536-D540 PolarHBondContact O-N 2.56Å; L538-D540 VanDerWaalsContact C-N 3.31Å; L538-D540 PolarHBondContact O-N 3.4Å; D540-S542 PolarHBondContact O-N 3.35Å; D540-K543 PolarHBondContact O-N 2.71Å
541S46.7Very low53.4Low65 Ų6599 Ų9946%0.45552%0.523SS..THydrogen-bonded Turntrans-63.1-2.5-173.3700000115.6S537 L538 K543S537-S541 PolarHBondContact O-N 3.45Å; L538-S541 WeakPolarHBondContact O-CB 3.46Å; L538-S541 PolarHBondContact O-N 3.36Å; L538-S541 PolarHBondContact O-OG 3.14Å; S541-K543 PolarHBondContact O-N 2.98Å
542S53.5Low52.9Low107 Ų107103.8 Ų103.875%0.74855%0.549SS*.THydrogen-bonded Turntrans-59.3-14167.371.30000113.5D540D540-S542 PolarHBondContact O-N 3.35Å
543K46.4Very low52.6Low198 Ų198102.8 Ų102.886%0.86155%0.549SS*.SBendtrans-131.4-3.5-176.6-75.9-178.5-179.6172.10118.9D540 S541D540-K543 PolarHBondContact O-N 2.71Å; S541-K543 PolarHBondContact O-N 2.98Å
544S41.3Very low52.2Low79 Ų79101.3 Ų101.355%0.55254%0.536SS*.  trans-126.7121.2-179.776.10000114.5T546S544-T546 PolarHBondContact O-N 3.21Å
545R39.2Very low52.1Low255 Ų255103.3 Ų103.396%0.96255%0.546SS*.THydrogen-bonded Turntrans-84.421.1-169.2-93.7-174.3-169.8169.43.8117.2
546T42.7Very low51.6Low131 Ų131102.5 Ų102.580%0.80455%0.553SS**THydrogen-bonded Turntrans-127.55.6-168.547.50000117.9S544S544-T546 PolarHBondContact O-N 3.21Å
547F43Very low51.2Low129 Ų129103.7 Ų103.757%0.56655%0.548SS*.  trans-148.792.9174.1-156.3-121.6000111.3V549F547-V549 HydrophobicContact CD1-CG2 3.46Å; F547-V549 VanDerWaalsContact CD1-CG2 3.46Å; F547-V549 HydrophobicContact CE1-CB 4.47Å; F547-V549 HydrophobicContact CE1-CG2 3.04Å; F547-V549 HydrophobicContact CE2-CG2 4.38Å; F547-V549 HydrophobicContact CG-CG2 4.29Å; F547-V549 HydrophobicContact CZ-CG2 3.56Å; F547-V549 PolarHBondContact O-N 2.79Å
548H43.4Very low51.2Low199 Ų199106.7 Ų106.792%0.92155%0.552SS**  trans-83.6101166.6-96-79.9000107.7
549V49.9Very low51.1Low22 Ų22107.7 Ų107.713%0.13356%0.561CS.*  trans-98.1125.8160.1178.10000106.4V534 L538 F547 E553V534-V549 HydrophobicContact CG1-CB 4.2Å; V534-V549 HydrophobicContact CG1-CG1 3.96Å; V534-V549 HydrophobicContact CG1-CG2 4.23Å; L538-V549 WeakPolarHBondContact CD2-O 3.39Å; F547-V549 HydrophobicContact CD1-CG2 3.46Å; F547-V549 VanDerWaalsContact CD1-CG2 3.46Å; F547-V549 HydrophobicContact CE1-CB 4.47Å; F547-V549 HydrophobicContact CE1-CG2 3.04Å; F547-V549 HydrophobicContact CE2-CG2 4.38Å; F547-V549 HydrophobicContact CG-CG2 4.29Å; F547-V549 HydrophobicContact CZ-CG2 3.56Å; F547-V549 PolarHBondContact O-N 2.79Å; V549-E553 HydrophobicContact CG1-CB 4.4Å
550D55.7Low50.9Low81 Ų81105.8 Ų105.843%0.43355%0.545SS..  trans-66.7135.8175.8-172.8-1.5000108.8N552 E553 L554D550-N552 PolarHBondContact O-N 3.4Å; D550-N552 PolarHBondContact OD1-N 2.97Å; D550-N552 VanDerWaalsContact OD1-N 3.13Å; D550-N552 PolarHBondContact OD1-ND2 3.41Å; D550-N552 WeakPolarHBondContact OD2-CB 3.38Å; D550-N552 PolarHBondContact OD2-ND2 2.89Å; D550-E553 HydrophobicContact CB-CG 4.18Å; D550-E553 WeakPolarHBondContact O-CB 3.08Å; D550-E553 PolarHBondContact O-N 2.93Å; D550-L554 PolarHBondContact O-N 3.39Å
551K58.1Low51.1Low146 Ų146101.3 Ų101.364%0.63552%0.521SS*.Hα-helixtrans-57.8-30.5174.8-162175.4-178.2179.30110.8L554 D555K551-L554 PolarHBondContact O-N 3.29Å; K551-D555 PolarHBondContact O-N 3.43Å
552N55.2Low51.5Low115 Ų115102.1 Ų102.162%0.61552%0.52SS*.Hα-helixtrans-64.1-37.1174.2-58.6-38.6000112.7D550 L554 A556D550-N552 PolarHBondContact O-N 3.4Å; D550-N552 PolarHBondContact OD1-N 2.97Å; D550-N552 VanDerWaalsContact OD1-N 3.13Å; D550-N552 PolarHBondContact OD1-ND2 3.41Å; D550-N552 WeakPolarHBondContact OD2-CB 3.38Å; D550-N552 PolarHBondContact OD2-ND2 2.89Å; N552-L554 VanDerWaalsContact C-N 3.35Å; N552-A556 WeakPolarHBondContact O-CB 3.41Å; N552-A556 PolarHBondContact O-N 3.33Å
553E58.5Low51.5Low118 Ų118101.7 Ų101.755%0.55151%0.509SS*.Hα-helixtrans-68.3-37.1174.9-71.5-179.5160.500111V549 D550 A556 I557V549-E553 HydrophobicContact CG1-CB 4.4Å; D550-E553 HydrophobicContact CB-CG 4.18Å; D550-E553 WeakPolarHBondContact O-CB 3.08Å; D550-E553 PolarHBondContact O-N 2.93Å; E553-A556 WeakPolarHBondContact O-CB 3.39Å; E553-A556 PolarHBondContact O-N 3.37Å; E553-I557 WeakPolarHBondContact O-CG1 3.5Å; E553-I557 PolarHBondContact O-N 3.06Å
554L54.1Low51.9Low8 Ų893.8 Ų93.84%0.04248%0.476CS..Hα-helixtrans-69.4-42.1177.5-170.565.7000112.1F531 V534 E535 L538 D550 K551 N552 A556 I557 R558F531-L554 HydrophobicContact CD2-CD1 3.49Å; F531-L554 VanDerWaalsContact CD2-CD1 3.49Å; F531-L554 HydrophobicContact CD2-CG 4.23Å; F531-L554 HydrophobicContact CE2-CD1 3.45Å; F531-L554 VanDerWaalsContact CE2-CD1 3.45Å; F531-L554 HydrophobicContact CE2-CD2 4.37Å; F531-L554 HydrophobicContact CE2-CG 3.65Å; F531-L554 HydrophobicContact CG-CD1 4.35Å; F531-L554 HydrophobicContact CZ-CD1 4.27Å; F531-L554 HydrophobicContact CZ-CD2 4.47Å; F531-L554 HydrophobicContact CZ-CG 4.19Å; V534-L554 HydrophobicContact CB-CD1 4.24Å; V534-L554 HydrophobicContact CG1-CD1 3.85Å; V534-L554 HydrophobicContact CG1-CD2 4.48Å; E535-L554 HydrophobicContact CB-CD2 4.13Å; E535-L554 HydrophobicContact CG-CD2 4.46Å; L538-L554 HydrophobicContact CD1-CD2 3.78Å; D550-L554 PolarHBondContact O-N 3.39Å; K551-L554 PolarHBondContact O-N 3.29Å; N552-L554 VanDerWaalsContact C-N 3.35Å; L554-A556 PolarHBondContact O-N 2.71Å; L554-I557 PolarHBondContact O-N 3.36Å; L554-I557 VanDerWaalsContact O-N 3.07Å; L554-R558 PolarHBondContact O-N 2.57Å
555D60.1Low52.8Low67 Ų6795.3 Ų95.336%0.35847%0.469SS..Hα-helixtrans-65.3-25.4173.7-77.4-39.3000111.7K551 R558 P559K551-D555 PolarHBondContact O-N 3.43Å; D555-R558 IonicContact OD1-CZ 3.12Å; D555-R558 IonicContact OD1-NH1 3.06Å; D555-R558 PolarHBondContact OD1-NH1 2.92Å; D555-R558 IonicContact OD1-NH2 2.61Å; D555-R558 PolarHBondContact OD1-NH2 3.38Å; D555-P559 WeakPolarHBondContact O-CD 3.3Å
556A55.7Low54.1Low64 Ų6484.2 Ų84.253%0.52943%0.428SS..Hα-helixtrans-72.9-22.8171.200000114N552 E553 L554 P559N552-A556 WeakPolarHBondContact O-CB 3.41Å; N552-A556 PolarHBondContact O-N 3.33Å; E553-A556 WeakPolarHBondContact O-CB 3.39Å; E553-A556 PolarHBondContact O-N 3.37Å; L554-A556 PolarHBondContact O-N 2.71Å; A556-P559 WeakPolarHBondContact O-CD 3.13Å
557I51.7Low55.6Low69 Ų6979.5 Ų79.535%0.35440%0.398SS..Hα-helixtrans-81.5-29.2177-66.4166.3000111.8F531 E553 L554 T560 L561F531-I557 HydrophobicContact CD2-CG2 4.12Å; E553-I557 WeakPolarHBondContact O-CG1 3.5Å; E553-I557 PolarHBondContact O-N 3.06Å; L554-I557 PolarHBondContact O-N 3.36Å; L554-I557 VanDerWaalsContact O-N 3.07Å; I557-T560 WeakPolarHBondContact O-CA 3.5Å; I557-T560 VanDerWaalsContact O-CB 3.27Å; I557-T560 WeakPolarHBondContact O-CB 3.44Å; I557-T560 PolarHBondContact O-N 2.9Å; I557-T560 PolarHBondContact O-OG1 3.15Å; I557-L561 PolarHBondContact O-N 3.14Å
558R58.7Low57.2Low112 Ų11276.9 Ų76.942%0.42339%0.389SS..Hα-helixtrans-54.3-46.5-178-173.2-179.5-67.1128.56113L554 D555 T560 L561 D562L554-R558 PolarHBondContact O-N 2.57Å; D555-R558 IonicContact OD1-CZ 3.12Å; D555-R558 IonicContact OD1-NH1 3.06Å; D555-R558 PolarHBondContact OD1-NH1 2.92Å; D555-R558 IonicContact OD1-NH2 2.61Å; D555-R558 PolarHBondContact OD1-NH2 3.38Å; R558-T560 VanDerWaalsContact C-N 3.26Å; R558-T560 PolarHBondContact O-N 3.32Å; R558-L561 WeakPolarHBondContact O-CB 3.1Å; R558-L561 PolarHBondContact O-N 3.36Å; R558-L561 VanDerWaalsContact O-N 3.13Å; R558-D562 PolarHBondContact O-N 2.75Å; R558-D562 VanDerWaalsContact O-N 3.13Å
559P52.5Low59.1Low71 Ų7169 Ų6946%0.46136%0.357SS..Hα-helixtrans-59.7-35.6174.1-20.930.6000113.1D555 A556 L561 D562 I563D555-P559 WeakPolarHBondContact O-CD 3.3Å; A556-P559 WeakPolarHBondContact O-CD 3.13Å; P559-L561 VanDerWaalsContact C-N 3.33Å; P559-D562 PolarHBondContact O-N 2.66Å; P559-I563 VanDerWaalsContact O-CG1 3.31Å; P559-I563 WeakPolarHBondContact O-CG1 3.33Å; P559-I563 PolarHBondContact O-N 3.3Å
560T51.4Low60.8Low68 Ų6869.1 Ų69.142%0.41736%0.356SS..Hα-helixtrans-66.7-37.5177.6-35.40000111.3I557 R558 D562 I563 I564I557-T560 WeakPolarHBondContact O-CA 3.5Å; I557-T560 VanDerWaalsContact O-CB 3.27Å; I557-T560 WeakPolarHBondContact O-CB 3.44Å; I557-T560 PolarHBondContact O-N 2.9Å; I557-T560 PolarHBondContact O-OG1 3.15Å; R558-T560 VanDerWaalsContact C-N 3.26Å; R558-T560 PolarHBondContact O-N 3.32Å; T560-D562 VanDerWaalsContact C-N 3.33Å; T560-I563 PolarHBondContact O-N 3.47Å; T560-I564 HydrophobicContact CG2-CD1 4.26Å; T560-I564 WeakPolarHBondContact O-CD1 3.31Å; T560-I564 VanDerWaalsContact O-CG1 3.3Å; T560-I564 WeakPolarHBondContact O-CG1 3.28Å; T560-I564 PolarHBondContact O-N 3.12Å; T560-I564 VanDerWaalsContact O-N 3.14Å
561L55.2Low62.3Low24 Ų2465.3 Ų65.313%0.12634%0.336CS..Hα-helixtrans-65.4-38.8175.5-16670.6000111.5F524 L527 K528 I557 R558 P559 I564 R565F524-L561 HydrophobicContact CD2-CD1 4.31Å; F524-L561 HydrophobicContact CE2-CD1 4.16Å; F524-L561 HydrophobicContact CE2-CG 4.13Å; L527-L561 HydrophobicContact CB-CD1 3.81Å; K528-L561 HydrophobicContact CB-CD1 4.1Å; I557-L561 PolarHBondContact O-N 3.14Å; R558-L561 WeakPolarHBondContact O-CB 3.1Å; R558-L561 PolarHBondContact O-N 3.36Å; R558-L561 VanDerWaalsContact O-N 3.13Å; P559-L561 VanDerWaalsContact C-N 3.33Å; L561-I564 PolarHBondContact O-N 3.39Å; L561-R565 PolarHBondContact O-N 2.89Å
562D55.1Low63.7Low82 Ų8259 Ų5944%0.43931%0.31SS..Hα-helixtrans-64.3-41.2174.3-67.5-28.9000111.4R558 P559 T560 I564 R565 F566R558-D562 PolarHBondContact O-N 2.75Å; R558-D562 VanDerWaalsContact O-N 3.13Å; P559-D562 PolarHBondContact O-N 2.66Å; T560-D562 VanDerWaalsContact C-N 3.33Å; D562-I564 VanDerWaalsContact C-N 3.3Å; D562-I564 PolarHBondContact O-N 2.8Å; D562-R565 WeakPolarHBondContact O-CB 3.39Å; D562-R565 PolarHBondContact O-N 3.2Å; D562-F566 WeakPolarHBondContact O-CE2 3.22Å; D562-F566 WeakPolarHBondContact O-CZ 3.38Å
563I53.6Low65.4Low97 Ų9754.5 Ų54.550%0.49729%0.285SS..Hα-helixtrans-60.2-39.2176.2-68.3165.2000112.2P559 T560 R565 F566P559-I563 VanDerWaalsContact O-CG1 3.31Å; P559-I563 WeakPolarHBondContact O-CG1 3.33Å; P559-I563 PolarHBondContact O-N 3.3Å; T560-I563 PolarHBondContact O-N 3.47Å; I563-R565 VanDerWaalsContact C-N 3.27Å; I563-R565 PolarHBondContact O-N 3.09Å; I563-F566 VanDerWaalsContact CA-CD2 3.47Å; I563-F566 VanDerWaalsContact CA-CE2 3.43Å; I563-F566 HydrophobicContact CB-CD2 4.45Å; I563-F566 HydrophobicContact CB-CE2 4.39Å; I563-F566 HydrophobicContact CG1-CE2 4.36Å; I563-F566 HydrophobicContact CG2-CD2 4.48Å; I563-F566 WeakPolarHBondContact O-CB 3.05Å; I563-F566 WeakPolarHBondContact O-CD2 3.37Å; I563-F566 WeakPolarHBondContact O-CG 3.47Å; I563-F566 PolarHBondContact O-N 3.28Å
564I54.6Low66.8Low33 Ų3351.6 Ų51.617%0.16928%0.275CS..Hα-helixtrans-77.4-20.4-175.1-67.7169.7000111.6V523 F524 L527 T560 L561 D562 F566 N567V523-I564 HydrophobicContact CB-CG2 4.46Å; V523-I564 HydrophobicContact CG1-CD1 4.29Å; V523-I564 HydrophobicContact CG1-CG2 4Å; F524-I564 HydrophobicContact CB-CG2 3.84Å; F524-I564 HydrophobicContact CD2-CG2 4.17Å; L527-I564 HydrophobicContact CD1-CD1 3.02Å; L527-I564 HydrophobicContact CD1-CG1 4.41Å; L527-I564 HydrophobicContact CG-CD1 4.47Å; T560-I564 HydrophobicContact CG2-CD1 4.26Å; T560-I564 WeakPolarHBondContact O-CD1 3.31Å; T560-I564 VanDerWaalsContact O-CG1 3.3Å; T560-I564 WeakPolarHBondContact O-CG1 3.28Å; T560-I564 PolarHBondContact O-N 3.12Å; T560-I564 VanDerWaalsContact O-N 3.14Å; L561-I564 PolarHBondContact O-N 3.39Å; D562-I564 VanDerWaalsContact C-N 3.3Å; D562-I564 PolarHBondContact O-N 2.8Å; I564-F566 PolarHBondContact O-N 3.31Å; I564-F566 VanDerWaalsContact O-N 3.11Å; I564-N567 PolarHBondContact O-N 3.37Å
565R61.5Low68.5Low110 Ų11053.9 Ų53.942%0.41528%0.284SS..THydrogen-bonded Turntrans-62-17.3173.6-146.9163.3-171.2-143.3-2113.3F524 L561 D562 I563 N567 E589F524-R565 HydrophobicContact CD2-CB 4.32Å; F524-R565 HydrophobicContact CD2-CG 4.4Å; F524-R565 HydrophobicContact CE2-CB 3.94Å; F524-R565 HydrophobicContact CE2-CG 3.76Å; F524-R565 HydrophobicContact CZ-CG 4.03Å; L561-R565 PolarHBondContact O-N 2.89Å; D562-R565 WeakPolarHBondContact O-CB 3.39Å; D562-R565 PolarHBondContact O-N 3.2Å; I563-R565 VanDerWaalsContact C-N 3.27Å; I563-R565 PolarHBondContact O-N 3.09Å; R565-N567 PolarHBondContact O-N 3.41Å; R565-E589 WeakPolarHBondContact CD-OE2 3.27Å; R565-E589 IonicContact CZ-OE1 2.69Å; R565-E589 VanDerWaalsContact CZ-OE1 3.31Å; R565-E589 IonicContact CZ-OE2 2.66Å; R565-E589 IonicContact NE-OE2 2.85Å; R565-E589 PolarHBondContact NE-OE2 2.74Å; R565-E589 IonicContact NH1-OE1 3.41Å; R565-E589 PolarHBondContact NH1-OE1 3.26Å; R565-E589 IonicContact NH1-OE2 3.01Å; R565-E589 PolarHBondContact NH1-OE2 2.86Å; R565-E589 IonicContact NH2-OE1 3.88Å
566F64.5Low70Confident22 Ų2250.8 Ų50.810%0.09627%0.267CS..THydrogen-bonded Turntrans-76.9-2.8-178.1-55.6-42.6000114.9D562 I563 I564 L568 E589 F590D562-F566 WeakPolarHBondContact O-CE2 3.22Å; D562-F566 WeakPolarHBondContact O-CZ 3.38Å; I563-F566 VanDerWaalsContact CA-CD2 3.47Å; I563-F566 VanDerWaalsContact CA-CE2 3.43Å; I563-F566 HydrophobicContact CB-CD2 4.45Å; I563-F566 HydrophobicContact CB-CE2 4.39Å; I563-F566 HydrophobicContact CG1-CE2 4.36Å; I563-F566 HydrophobicContact CG2-CD2 4.48Å; I563-F566 WeakPolarHBondContact O-CB 3.05Å; I563-F566 WeakPolarHBondContact O-CD2 3.37Å; I563-F566 WeakPolarHBondContact O-CG 3.47Å; I563-F566 PolarHBondContact O-N 3.28Å; I564-F566 PolarHBondContact O-N 3.31Å; I564-F566 VanDerWaalsContact O-N 3.11Å; F566-L568 PolarHBondContact O-N 3.45Å; F566-E589 HydrophobicContact CE1-CB 4.23Å; F566-F590 HydrophobicContact CD1-CB 3.78Å; F566-F590 AromaticContact CD1-CD2 3.92Å; F566-F590 HydrophobicContact CD1-CD2 3.92Å; F566-F590 HydrophobicContact CD1-CG 4.38Å; F566-F590 AromaticContact CD2-CD2 3.39Å; F566-F590 HydrophobicContact CD2-CD2 3.39Å; F566-F590 AromaticContact CD2-CE2 3.89Å; F566-F590 HydrophobicContact CD2-CE2 3.89Å; F566-F590 HydrophobicContact CE1-CB 3.63Å; F566-F590 AromaticContact CE1-CD2 3.88Å; F566-F590 HydrophobicContact CE1-CD2 3.88Å; F566-F590 HydrophobicContact CE1-CG 4.26Å; F566-F590 AromaticContact CE2-CD2 3.28Å; F566-F590 HydrophobicContact CE2-CD2 3.28Å; F566-F590 AromaticContact CE2-CE2 3.78Å; F566-F590 HydrophobicContact CE2-CE2 3.78Å; F566-F590 HydrophobicContact CE2-CG 4.34Å; F566-F590 HydrophobicContact CG-CB 4.38Å; F566-F590 AromaticContact CG-CD2 3.72Å; F566-F590 HydrophobicContact CG-CD2 3.72Å; F566-F590 HydrophobicContact CZ-CB 4.06Å; F566-F590 AromaticContact CZ-CD2 3.56Å; F566-F590 HydrophobicContact CZ-CD2 3.56Å; F566-F590 HydrophobicContact CZ-CE2 4.4Å; F566-F590 HydrophobicContact CZ-CG 4.23Å
567N74.7Confident71.6Confident33 Ų3352.2 Ų52.218%0.17626%0.263CS..  trans4653.2-174.6-57.5-42.1000111.1D520 I564 R565 S569 D570 A571D520-N567 HydrophobicContact CB-CB 3.99Å; D520-N567 WeakPolarHBondContact OD2-CA 3.27Å; D520-N567 VanDerWaalsContact OD2-O 3.12Å; I564-N567 PolarHBondContact O-N 3.37Å; R565-N567 PolarHBondContact O-N 3.41Å; N567-S569 PolarHBondContact O-N 2.69Å; N567-D570 HydrophobicContact CB-CB 4.13Å; N567-D570 WeakPolarHBondContact O-CB 3.05Å; N567-D570 PolarHBondContact O-N 3.34Å; N567-D570 VanDerWaalsContact O-N 3.07Å; N567-A571 PolarHBondContact O-N 3.5Å
568L77.5Confident73.3Confident73 Ų7355.8 Ų55.838%0.38228%0.283SS..Hα-helixtrans-61.9-35-168.9-169.869000112.1D520 F566 D570 A571 I572 I585D520-L568 PolarHBondContact OD2-N 2.74Å; F566-L568 PolarHBondContact O-N 3.45Å; L568-D570 VanDerWaalsContact C-N 3.34Å; L568-A571 PolarHBondContact O-N 3.14Å; L568-I572 HydrophobicContact CD1-CD1 3.76Å; L568-I572 HydrophobicContact CD1-CG1 4.08Å; L568-I572 HydrophobicContact CD2-CD1 4.18Å; L568-I572 HydrophobicContact CG-CD1 3.65Å; L568-I572 HydrophobicContact CG-CG1 4.21Å; L568-I572 WeakPolarHBondContact O-CB 2.8Å; L568-I572 WeakPolarHBondContact O-CG1 3.13Å; L568-I572 PolarHBondContact O-N 2.82Å; L568-I585 HydrophobicContact CD1-CD1 4.17Å
569S82.2Confident74.6Confident34 Ų3453.2 Ų53.224%0.23828%0.276CS..Hα-helixtrans-64.7-42.3176.7-45.10000110.3D520 N567 L573D520-S569 WeakPolarHBondContact OD1-CB 3.18Å; D520-S569 PolarHBondContact OD1-N 3.43Å; D520-S569 PolarHBondContact OD1-OG 3.48Å; D520-S569 WeakPolarHBondContact OD2-CA 3.14Å; D520-S569 VanDerWaalsContact OD2-CB 3.29Å; D520-S569 WeakPolarHBondContact OD2-CB 3.32Å; D520-S569 PolarHBondContact OD2-N 3.43Å; N567-S569 PolarHBondContact O-N 2.69Å; S569-L573 WeakPolarHBondContact O-CA 3.36Å; S569-L573 WeakPolarHBondContact O-CB 3.46Å; S569-L573 WeakPolarHBondContact O-CG 3.13Å; S569-L573 PolarHBondContact O-N 2.89Å
570D86.6Confident76Confident24 Ų2451 Ų5113%0.12826%0.261CS..Hα-helixtrans-67-44.6174.5-167.751000112.7P516 R517 D520 N567 L568 I572 T574 R575P516-D570 HydrophobicContact CB-CB 4.48Å; R517-D570 HydrophobicContact CB-CB 3.9Å; D520-D570 PolarHBondContact OD2-N 2.99Å; N567-D570 HydrophobicContact CB-CB 4.13Å; N567-D570 WeakPolarHBondContact O-CB 3.05Å; N567-D570 PolarHBondContact O-N 3.34Å; N567-D570 VanDerWaalsContact O-N 3.07Å; L568-D570 VanDerWaalsContact C-N 3.34Å; D570-I572 PolarHBondContact O-N 2.88Å; D570-T574 WeakPolarHBondContact O-CA 3Å; D570-T574 WeakPolarHBondContact O-CB 3.21Å; D570-T574 PolarHBondContact O-N 3.42Å; D570-T574 PolarHBondContact O-OG1 2.86Å; D570-T574 WeakPolarHBondContact OD1-CB 2.88Å; D570-T574 PolarHBondContact OD1-OG1 3.36Å; D570-R575 PolarHBondContact O-N 3Å
571A86.1Confident77.4Confident1 Ų148.1 Ų48.11%0.00824%0.243CC..Hα-helixtrans-57.9-51178.400000110.8N567 L568 R575 C576 A584 I585N567-A571 PolarHBondContact O-N 3.5Å; L568-A571 PolarHBondContact O-N 3.14Å; A571-R575 PolarHBondContact O-N 3.02Å; A571-C576 WeakPolarHBondContact O-CB 3.34Å; A571-C576 PolarHBondContact O-N 3.28Å; A571-C576 PolarHBondContact O-SG 2.73Å; A571-A584 WeakPolarHBondContact CB-O 3.32Å; A571-I585 HydrophobicContact CB-CG1 3.85Å
572I88.4Confident78.4Confident15 Ų1547.4 Ų47.48%0.07724%0.24CC..Hα-helixtrans-77.7-50.3-176.3-61.9177.6000111.9F192 L568 D570 C576 L761 R762 A765F192-I572 HydrophobicContact CE2-CD1 4.5Å; F192-I572 HydrophobicContact CZ-CD1 4.27Å; L568-I572 HydrophobicContact CD1-CD1 3.76Å; L568-I572 HydrophobicContact CD1-CG1 4.08Å; L568-I572 HydrophobicContact CD2-CD1 4.18Å; L568-I572 HydrophobicContact CG-CD1 3.65Å; L568-I572 HydrophobicContact CG-CG1 4.21Å; L568-I572 WeakPolarHBondContact O-CB 2.8Å; L568-I572 WeakPolarHBondContact O-CG1 3.13Å; L568-I572 PolarHBondContact O-N 2.82Å; D570-I572 PolarHBondContact O-N 2.88Å; I572-C576 WeakPolarHBondContact O-CB 2.91Å; I572-L761 HydrophobicContact CD1-CD2 4.11Å; I572-L761 HydrophobicContact CG1-CD2 4.15Å; I572-L761 HydrophobicContact CG2-CG 4.32Å; I572-R762 WeakPolarHBondContact O-CB 3.31Å; I572-R762 WeakPolarHBondContact O-CG 3.2Å; I572-A765 HydrophobicContact CG2-CB 3.49Å; I572-A765 VanDerWaalsContact CG2-CB 3.49Å
573L90Very high79.3Confident19 Ų1948 Ų4810%0.09924%0.239CC..Hα-helixtrans-82.6-19.1-172.2-62.2172.4000113.4L508 P516 S569 R762 A765 K766 V769L508-L573 HydrophobicContact CB-CD1 4.41Å; L508-L573 HydrophobicContact CD2-CD1 3.82Å; P516-L573 HydrophobicContact CB-CB 4.48Å; P516-L573 HydrophobicContact CG-CB 4.17Å; P516-L573 HydrophobicContact CG-CD1 4.36Å; S569-L573 WeakPolarHBondContact O-CA 3.36Å; S569-L573 WeakPolarHBondContact O-CB 3.46Å; S569-L573 WeakPolarHBondContact O-CG 3.13Å; S569-L573 PolarHBondContact O-N 2.89Å; L573-R762 PolarHBondContact O-NH1 3.22Å; L573-A765 HydrophobicContact CD2-CB 3.9Å; L573-K766 HydrophobicContact CD2-CB 4.4Å; L573-V769 HydrophobicContact CD1-CG2 4.07Å; L573-V769 HydrophobicContact CD2-CG2 4.15Å
574T89.4Confident80.6Confident57 Ų5743.4 Ų43.435%0.3522%0.217SC..THydrogen-bonded Turntrans-115.3-63.8-177.8-41.30000111.3D570 R762D570-T574 WeakPolarHBondContact O-CA 3Å; D570-T574 WeakPolarHBondContact O-CB 3.21Å; D570-T574 PolarHBondContact O-N 3.42Å; D570-T574 PolarHBondContact O-OG1 2.86Å; D570-T574 WeakPolarHBondContact OD1-CB 2.88Å; D570-T574 PolarHBondContact OD1-OG1 3.36Å; T574-R762 PolarHBondContact O-NH1 3.39Å
575R89.1Confident81.4Confident57 Ų5742.1 Ų42.122%0.21521%0.21CC..G310 helixtrans-72.5-37.5-166.9-62.1-178.669.2-167.20.8113.3D570 A571 E577 N578 E579 E583 A584D570-R575 PolarHBondContact O-N 3Å; A571-R575 PolarHBondContact O-N 3.02Å; R575-E577 PolarHBondContact O-N 2.84Å; R575-N578 PolarHBondContact O-N 2.82Å; R575-N578 VanDerWaalsContact O-N 3.1Å; R575-E579 IonicContact CZ-OE2 3.61Å; R575-E579 IonicContact NE-OE1 3.65Å; R575-E579 PolarHBondContact NE-OE1 2.83Å; R575-E579 IonicContact NE-OE2 2.69Å; R575-E579 PolarHBondContact NE-OE2 3.37Å; R575-E579 IonicContact NH2-OE1 3.1Å; R575-E579 IonicContact NH2-OE2 3.38Å; R575-E579 PolarHBondContact NH2-OE2 2.97Å; R575-E579 WeakPolarHBondContact O-CB 3.4Å; R575-E579 PolarHBondContact O-N 3.05Å; R575-E583 PolarHBondContact NH1-O 3.26Å; R575-E583 PolarHBondContact NH2-O 2.92Å; R575-A584 HydrophobicContact CB-CB 3.74Å; R575-A584 PolarHBondContact NH1-O 2.98Å
576C91Very high81.2Confident2 Ų238.8 Ų38.81%0.01420%0.203CC..G310 helixtrans-63.41.3179-83.50000116.4A571 I572 C758 Q759 R762A571-C576 WeakPolarHBondContact O-CB 3.34Å; A571-C576 PolarHBondContact O-N 3.28Å; A571-C576 PolarHBondContact O-SG 2.73Å; I572-C576 WeakPolarHBondContact O-CB 2.91Å; C576-C758 WeakPolarHBondContact CA-SG 2.82Å; C576-C758 HydrophobicContact CB-CB 3.83Å; C576-C758 WeakPolarHBondContact CB-SG 3.13Å; C576-C758 WeakPolarHBondContact SG-CB 3.08Å; C576-C758 CovalentContact SG-SG 2.03Å; C576-C758 PolarHBondContact SG-SG 3.36Å; C576-Q759 WeakPolarHBondContact O-CA 3.24Å; C576-Q759 PolarHBondContact O-N 3.47Å; C576-R762 HydrophobicContact CB-CB 4.02Å
577E89.9Confident80.7Confident93 Ų9341.3 Ų41.344%0.43522%0.221SC..G310 helixtrans-74.6-39168.7179.3165.9-145.100112.9R575 R762R575-E577 PolarHBondContact O-N 2.84Å; E577-R762 VanDerWaalsContact CD-CZ 3.47Å; E577-R762 IonicContact OE1-CZ 3.84Å; E577-R762 IonicContact OE1-NH2 2.67Å; E577-R762 PolarHBondContact OE1-NH2 2.8Å; E577-R762 IonicContact OE2-CZ 3.99Å; E577-R762 IonicContact OE2-NH1 2.89Å; E577-R762 PolarHBondContact OE2-NH1 3.08Å; E577-R762 IonicContact OE2-NH2 3.05Å; E577-R762 PolarHBondContact OE2-NH2 2.69Å
578N86.8Confident79.5Confident145 Ų14542 Ų4278%0.77524%0.235SC*.THydrogen-bonded Turntrans-127.3-11-173-60.6-53000113.2R575R575-N578 PolarHBondContact O-N 2.82Å; R575-N578 VanDerWaalsContact O-N 3.1Å
579E86.1Confident78.2Confident58 Ų5842.3 Ų42.327%0.27124%0.235SC..SBendtrans-112.3145-177.6-61.4177.2-155.100110.9R575 E583 A584 C758R575-E579 IonicContact CZ-OE2 3.61Å; R575-E579 IonicContact NE-OE1 3.65Å; R575-E579 PolarHBondContact NE-OE1 2.83Å; R575-E579 IonicContact NE-OE2 2.69Å; R575-E579 PolarHBondContact NE-OE2 3.37Å; R575-E579 IonicContact NH2-OE1 3.1Å; R575-E579 IonicContact NH2-OE2 3.38Å; R575-E579 PolarHBondContact NH2-OE2 2.97Å; R575-E579 WeakPolarHBondContact O-CB 3.4Å; R575-E579 PolarHBondContact O-N 3.05Å; E579-E583 HydrophobicContact CB-CB 4.42Å; E579-A584 HydrophobicContact CB-CB 4.32Å; E579-C758 PolarHBondContact O-SG 3.48Å; E579-C758 VanDerWaalsContact O-SG 3.36Å
580P83Confident76.7Confident25 Ų2542.1 Ų42.116%0.16223%0.23CC..  trans-67160.4170.228.4-33000111.3V582 E583 A584 H754P580-V582 VanDerWaalsContact C-N 3.31Å; P580-V582 PolarHBondContact O-N 3.16Å; P580-E583 HydrophobicContact CG-CB 3.91Å; P580-E583 PolarHBondContact O-N 2.83Å; P580-A584 WeakPolarHBondContact O-CB 3.46Å; P580-A584 PolarHBondContact O-N 3.25Å; P580-H754 WeakPolarHBondContact CB-O 3.49Å; P580-H754 WeakPolarHBondContact CG-O 3.3Å
581F80.7Confident75.1Confident7 Ų741.4 Ų41.43%0.03123%0.227CC..Hα-helixtrans-52.2-47.2-172.1178.8-108.3000113.7M199 F388 M392 A584 I585 I756 C758 L761M199-F581 HydrophobicContact CE-CB 3.78Å; M199-F581 HydrophobicContact CE-CD1 3.85Å; M199-F581 HydrophobicContact CE-CD2 3.12Å; M199-F581 HydrophobicContact CE-CE1 4.18Å; M199-F581 HydrophobicContact CE-CE2 3.44Å; M199-F581 VanDerWaalsContact CE-CE2 3.44Å; M199-F581 HydrophobicContact CE-CG 3.28Å; M199-F581 HydrophobicContact CE-CZ 3.95Å; F388-F581 HydrophobicContact CE2-CD1 4.42Å; F388-F581 AromaticContact CE2-CE1 3.6Å; F388-F581 HydrophobicContact CE2-CE1 3.6Å; F388-F581 HydrophobicContact CE2-CZ 4.1Å; F388-F581 HydrophobicContact CZ-CD1 4.43Å; F388-F581 AromaticContact CZ-CE1 3.91Å; F388-F581 HydrophobicContact CZ-CE1 3.91Å; F388-F581 HydrophobicContact CZ-CZ 4.33Å; M392-F581 HydrophobicContact CE-CE1 4.37Å; M392-F581 HydrophobicContact CE-CE2 4.39Å; M392-F581 HydrophobicContact CE-CZ 3.71Å; F581-A584 PolarHBondContact O-N 2.88Å; F581-I585 HydrophobicContact CD2-CD1 3.85Å; F581-I585 HydrophobicContact CD2-CG1 4.36Å; F581-I585 HydrophobicContact CE1-CD1 3.95Å; F581-I585 HydrophobicContact CE2-CD1 3.13Å; F581-I585 HydrophobicContact CE2-CG1 4.09Å; F581-I585 HydrophobicContact CZ-CD1 3.21Å; F581-I585 HydrophobicContact CZ-CG1 4.36Å; F581-I585 PolarHBondContact O-N 2.91Å; F581-I756 HydrophobicContact CB-CB 4.4Å; F581-I756 HydrophobicContact CB-CG2 4.17Å; F581-I756 PolarHBondContact N-O 3.13Å; F581-C758 VanDerWaalsContact CA-SG 3.54Å; F581-C758 HydrophobicContact CB-CB 3.93Å; F581-C758 HydrophobicContact CD2-CB 3.99Å; F581-C758 HydrophobicContact CG-CB 4.46Å; F581-L761 HydrophobicContact CE2-CD2 4.34Å
582V74.7Confident73.6Confident9 Ų944.1 Ų44.16%0.05525%0.245CC..Hα-helixtrans-67.7-39.2-177.1177.90000110.9P580 S586 V591 I750 W753P580-V582 VanDerWaalsContact C-N 3.31Å; P580-V582 PolarHBondContact O-N 3.16Å; V582-S586 VanDerWaalsContact O-CA 3.28Å; V582-S586 WeakPolarHBondContact O-CA 3.45Å; V582-S586 WeakPolarHBondContact O-CB 3.42Å; V582-S586 PolarHBondContact O-N 2.64Å; V582-V591 HydrophobicContact CG1-CG2 4.48Å; V582-I750 HydrophobicContact CG1-CB 4.43Å; V582-I750 HydrophobicContact CG1-CG1 4.4Å; V582-I750 HydrophobicContact CG1-CG2 3.82Å; V582-W753 HydrophobicContact CG2-CB 3.45Å; V582-W753 VanDerWaalsContact CG2-CB 3.45Å; V582-W753 HydrophobicContact CG2-CE3 4.05Å; V582-W753 HydrophobicContact CG2-CG 4.43Å
583E75.5Confident72Confident93 Ų9347.6 Ų47.644%0.43527%0.269SS..Hα-helixtrans-68.2-42.2177.5-169.6164.2-173.500111.2R575 E579 P580 I585 S586 H754R575-E583 PolarHBondContact NH1-O 3.26Å; R575-E583 PolarHBondContact NH2-O 2.92Å; E579-E583 HydrophobicContact CB-CB 4.42Å; P580-E583 HydrophobicContact CG-CB 3.91Å; P580-E583 PolarHBondContact O-N 2.83Å; E583-I585 VanDerWaalsContact C-N 3.34Å; E583-I585 PolarHBondContact O-N 3.5Å; E583-S586 PolarHBondContact O-N 2.68Å; E583-H754 IonicContact OE2-CE1 2.82Å
584A80.6Confident70.5Confident2 Ų247 Ų472%0.01727%0.266CS..Hα-helixtrans-59-40.6177.600000112.8A571 R575 E579 P580 F581A571-A584 WeakPolarHBondContact CB-O 3.32Å; R575-A584 HydrophobicContact CB-CB 3.74Å; R575-A584 PolarHBondContact NH1-O 2.98Å; E579-A584 HydrophobicContact CB-CB 4.32Å; P580-A584 WeakPolarHBondContact O-CB 3.46Å; P580-A584 PolarHBondContact O-N 3.25Å; F581-A584 PolarHBondContact O-N 2.88Å
585I71.8Confident69.2Low6 Ų644.2 Ų44.23%0.03125%0.249CC..Hα-helixtrans-90.4-25.3179-67-169.6000112.8L568 A571 F581 E583 T587 F590L568-I585 HydrophobicContact CD1-CD1 4.17Å; A571-I585 HydrophobicContact CB-CG1 3.85Å; F581-I585 HydrophobicContact CD2-CD1 3.85Å; F581-I585 HydrophobicContact CD2-CG1 4.36Å; F581-I585 HydrophobicContact CE1-CD1 3.95Å; F581-I585 HydrophobicContact CE2-CD1 3.13Å; F581-I585 HydrophobicContact CE2-CG1 4.09Å; F581-I585 HydrophobicContact CZ-CD1 3.21Å; F581-I585 HydrophobicContact CZ-CG1 4.36Å; F581-I585 PolarHBondContact O-N 2.91Å; E583-I585 VanDerWaalsContact C-N 3.34Å; E583-I585 PolarHBondContact O-N 3.5Å; I585-T587 VanDerWaalsContact C-N 3.27Å; I585-T587 PolarHBondContact O-N 3.46Å; I585-F590 HydrophobicContact CG2-CB 3.49Å; I585-F590 VanDerWaalsContact CG2-CB 3.49Å; I585-F590 HydrophobicContact CG2-CD1 3.89Å; I585-F590 HydrophobicContact CG2-CD2 3.68Å; I585-F590 HydrophobicContact CG2-CE2 4.41Å; I585-F590 HydrophobicContact CG2-CG 3.4Å; I585-F590 VanDerWaalsContact CG2-CG 3.4Å
586S56.3Low68Low39 Ų3944.5 Ų44.527%0.27326%0.259SS..  trans-72.581.5-176.4174.50000111.3V582 E583 G588V582-S586 VanDerWaalsContact O-CA 3.28Å; V582-S586 WeakPolarHBondContact O-CA 3.45Å; V582-S586 WeakPolarHBondContact O-CB 3.42Å; V582-S586 PolarHBondContact O-N 2.64Å; E583-S586 PolarHBondContact O-N 2.68Å; S586-G588 PolarHBondContact O-N 3.38Å; S586-G588 PolarHBondContact OG-N 3.14Å
587T54Low66.8Low76 Ų7649.5 Ų49.547%0.46628%0.283SS..SBendtrans-78.820.8141.648.70000111.4I585 E589I585-T587 VanDerWaalsContact C-N 3.27Å; I585-T587 PolarHBondContact O-N 3.46Å; T587-E589 VanDerWaalsContact C-N 3.25Å; T587-E589 PolarHBondContact O-N 3.43Å
588G49Very low65.7Low47 Ų4745.6 Ų45.649%0.48527%0.266SS..SBendtrans81-23.717700000115.8S586S586-G588 PolarHBondContact O-N 3.38Å; S586-G588 PolarHBondContact OG-N 3.14Å
589E52Low65.1Low79 Ų7938.9 Ų38.937%0.36923%0.23SC..SBendtrans-84.4-32.5-173.3-69.6-174.7157.500114.3R565 F566 T587 V591 S592R565-E589 WeakPolarHBondContact CD-OE2 3.27Å; R565-E589 IonicContact CZ-OE1 2.69Å; R565-E589 VanDerWaalsContact CZ-OE1 3.31Å; R565-E589 IonicContact CZ-OE2 2.66Å; R565-E589 IonicContact NE-OE2 2.85Å; R565-E589 PolarHBondContact NE-OE2 2.74Å; R565-E589 IonicContact NH1-OE1 3.41Å; R565-E589 PolarHBondContact NH1-OE1 3.26Å; R565-E589 IonicContact NH1-OE2 3.01Å; R565-E589 PolarHBondContact NH1-OE2 2.86Å; R565-E589 IonicContact NH2-OE1 3.88Å; F566-E589 HydrophobicContact CE1-CB 4.23Å; T587-E589 VanDerWaalsContact C-N 3.25Å; T587-E589 PolarHBondContact O-N 3.43Å; E589-V591 VanDerWaalsContact C-N 3.3Å; E589-V591 PolarHBondContact O-N 2.95Å; E589-S592 PolarHBondContact O-N 3.19Å
590F50.2Low64.8Low31 Ų3139.3 Ų39.314%0.13623%0.234CC..THydrogen-bonded Turntrans-60.6-36.6-175.4-174.1-94.4000113.9F566 I585 S592 P593 V594F566-F590 HydrophobicContact CD1-CB 3.78Å; F566-F590 AromaticContact CD1-CD2 3.92Å; F566-F590 HydrophobicContact CD1-CD2 3.92Å; F566-F590 HydrophobicContact CD1-CG 4.38Å; F566-F590 AromaticContact CD2-CD2 3.39Å; F566-F590 HydrophobicContact CD2-CD2 3.39Å; F566-F590 AromaticContact CD2-CE2 3.89Å; F566-F590 HydrophobicContact CD2-CE2 3.89Å; F566-F590 HydrophobicContact CE1-CB 3.63Å; F566-F590 AromaticContact CE1-CD2 3.88Å; F566-F590 HydrophobicContact CE1-CD2 3.88Å; F566-F590 HydrophobicContact CE1-CG 4.26Å; F566-F590 AromaticContact CE2-CD2 3.28Å; F566-F590 HydrophobicContact CE2-CD2 3.28Å; F566-F590 AromaticContact CE2-CE2 3.78Å; F566-F590 HydrophobicContact CE2-CE2 3.78Å; F566-F590 HydrophobicContact CE2-CG 4.34Å; F566-F590 HydrophobicContact CG-CB 4.38Å; F566-F590 AromaticContact CG-CD2 3.72Å; F566-F590 HydrophobicContact CG-CD2 3.72Å; F566-F590 HydrophobicContact CZ-CB 4.06Å; F566-F590 AromaticContact CZ-CD2 3.56Å; F566-F590 HydrophobicContact CZ-CD2 3.56Å; F566-F590 HydrophobicContact CZ-CE2 4.4Å; F566-F590 HydrophobicContact CZ-CG 4.23Å; I585-F590 HydrophobicContact CG2-CB 3.49Å; I585-F590 VanDerWaalsContact CG2-CB 3.49Å; I585-F590 HydrophobicContact CG2-CD1 3.89Å; I585-F590 HydrophobicContact CG2-CD2 3.68Å; I585-F590 HydrophobicContact CG2-CE2 4.41Å; I585-F590 HydrophobicContact CG2-CG 3.4Å; I585-F590 VanDerWaalsContact CG2-CG 3.4Å; F590-S592 VanDerWaalsContact C-N 3.29Å; F590-S592 PolarHBondContact O-N 2.93Å; F590-P593 WeakPolarHBondContact O-CD 3.4Å; F590-V594 HydrophobicContact CE1-CG2 4.38Å
591V52.1Low64.6Low9 Ų940.4 Ų40.46%0.05525%0.25CS..Hα-helixtrans-77.1-22.3-171.1-171.50000110.8V582 E589 V594 L595 I750V582-V591 HydrophobicContact CG1-CG2 4.48Å; E589-V591 VanDerWaalsContact C-N 3.3Å; E589-V591 PolarHBondContact O-N 2.95Å; V591-V594 PolarHBondContact O-N 3.29Å; V591-L595 HydrophobicContact CG1-CB 3.94Å; V591-L595 HydrophobicContact CG1-CD2 3.55Å; V591-L595 HydrophobicContact CG1-CG 4.41Å; V591-L595 WeakPolarHBondContact O-CB 3.25Å; V591-L595 PolarHBondContact O-N 3.37Å; V591-I750 HydrophobicContact CB-CD1 4.46Å; V591-I750 HydrophobicContact CB-CG1 4.36Å; V591-I750 HydrophobicContact CG1-CD1 4.43Å; V591-I750 HydrophobicContact CG1-CG1 3.94Å; V591-I750 HydrophobicContact CG2-CD1 4.33Å; V591-I750 HydrophobicContact CG2-CG1 4.08Å
592S54.9Low64.5Low57 Ų5741 Ų4140%0.39925%0.253SS..Hα-helixtrans-60.6-48.9-171.7-169.30000114E589 F590 S596E589-S592 PolarHBondContact O-N 3.19Å; F590-S592 VanDerWaalsContact C-N 3.29Å; F590-S592 PolarHBondContact O-N 2.93Å; S592-S596 VanDerWaalsContact O-CB 3.3Å; S592-S596 WeakPolarHBondContact O-CB 3.4Å; S592-S596 PolarHBondContact O-N 2.99Å
593P55Low64.9Low88 Ų8840.7 Ų40.757%0.57125%0.251SS*.Hα-helixtrans-66.8-46.7179.1-17.431.2000111.9F590 L595 S596F590-P593 WeakPolarHBondContact O-CD 3.4Å; P593-L595 PolarHBondContact O-N 3.21Å; P593-S596 PolarHBondContact O-N 3.41Å; P593-S596 PolarHBondContact O-OG 2.76Å
594V57.3Low65.4Low6 Ų639.7 Ų39.74%0.03625%0.247CC..Hα-helixtrans-56.6-37.2-178177.70000111.6L384 V387 I391 F590 V591 W753L384-V594 HydrophobicContact CD1-CG1 4.31Å; V387-V594 HydrophobicContact CB-CG1 4.25Å; V387-V594 HydrophobicContact CG1-CB 4.2Å; V387-V594 HydrophobicContact CG1-CG1 3.87Å; V387-V594 HydrophobicContact CG1-CG2 4.34Å; I391-V594 HydrophobicContact CD1-CG2 3.49Å; I391-V594 VanDerWaalsContact CD1-CG2 3.49Å; F590-V594 HydrophobicContact CE1-CG2 4.38Å; V591-V594 PolarHBondContact O-N 3.29Å; V594-W753 HydrophobicContact CG1-CH2 3.85Å; V594-W753 HydrophobicContact CG1-CZ3 4.19Å
595L62.4Low65.6Low0 Ų041.2 Ų41.20%026%0.263CS..Hα-helixtrans-99.1-19.8-168.7-174.949.6000113.9L384 V591 P593 E597 A598 I599 Q746 V749L384-L595 HydrophobicContact CD1-CD1 3.75Å; V591-L595 HydrophobicContact CG1-CB 3.94Å; V591-L595 HydrophobicContact CG1-CD2 3.55Å; V591-L595 HydrophobicContact CG1-CG 4.41Å; V591-L595 WeakPolarHBondContact O-CB 3.25Å; V591-L595 PolarHBondContact O-N 3.37Å; P593-L595 PolarHBondContact O-N 3.21Å; L595-E597 VanDerWaalsContact C-N 3.26Å; L595-E597 PolarHBondContact O-N 3.42Å; L595-A598 PolarHBondContact O-N 3.21Å; L595-I599 HydrophobicContact CD1-CD1 3.71Å; L595-I599 HydrophobicContact CD1-CG1 3.62Å; L595-I599 HydrophobicContact CD2-CD1 3.67Å; L595-I599 HydrophobicContact CG-CD1 3.34Å; L595-I599 HydrophobicContact CG-CG1 3.75Å; L595-I599 PolarHBondContact O-N 3.27Å; L595-Q746 HydrophobicContact CD2-CB 4.06Å; L595-Q746 HydrophobicContact CD2-CG 3.88Å; L595-Q746 HydrophobicContact CG-CG 4.41Å; L595-V749 HydrophobicContact CD1-CB 3.66Å; L595-V749 HydrophobicContact CD1-CG1 3.67Å; L595-V749 HydrophobicContact CD1-CG2 3.5Å; L595-V749 VanDerWaalsContact CD1-CG2 3.5Å; L595-V749 HydrophobicContact CD2-CB 3.67Å; L595-V749 HydrophobicContact CD2-CG1 4Å; L595-V749 HydrophobicContact CD2-CG2 4.25Å; L595-V749 HydrophobicContact CG-CB 4.35Å; L595-V749 HydrophobicContact CG-CG1 4.48Å
596S64.4Low66.2Low62 Ų6241.6 Ų41.643%0.43427%0.265SS..Hα-helixtrans-55.1-41.4-175.165.40000112.7S592 P593 D600S592-S596 VanDerWaalsContact O-CB 3.3Å; S592-S596 WeakPolarHBondContact O-CB 3.4Å; S592-S596 PolarHBondContact O-N 2.99Å; P593-S596 PolarHBondContact O-N 3.41Å; P593-S596 PolarHBondContact O-OG 2.76Å; S596-D600 WeakPolarHBondContact O-CB 3.43Å; S596-D600 PolarHBondContact O-N 3.02Å
597E65.9Low67.7Low108 Ų10840.4 Ų40.451%0.50526%0.255SS..Hα-helixtrans-74.3-37.9-174-155.7-164.3151.300113K383 L595 G601K383-E597 WeakPolarHBondContact CE-OE1 3.09Å; K383-E597 VanDerWaalsContact NZ-CD 3.3Å; K383-E597 IonicContact NZ-OE1 3.52Å; K383-E597 PolarHBondContact NZ-OE1 3Å; L595-E597 VanDerWaalsContact C-N 3.26Å; L595-E597 PolarHBondContact O-N 3.42Å; E597-G601 PolarHBondContact O-N 3.5Å
598A66Low69.3Low10 Ų1041.7 Ų41.78%0.08326%0.256CS..Hα-helixtrans-70.3-42.217700000111T380 L595 I602T380-A598 HydrophobicContact CG2-CB 4.32Å; L595-A598 PolarHBondContact O-N 3.21Å; A598-I602 PolarHBondContact O-N 3.37Å
599I75.9Confident71.1Confident4 Ų440.3 Ų40.32%0.02124%0.239CC..Hα-helixtrans-70.1-43.2178-69.9-174.8000111.8L595 G601 I602 L603 T742 L745 Q746L595-I599 HydrophobicContact CD1-CD1 3.71Å; L595-I599 HydrophobicContact CD1-CG1 3.62Å; L595-I599 HydrophobicContact CD2-CD1 3.67Å; L595-I599 HydrophobicContact CG-CD1 3.34Å; L595-I599 HydrophobicContact CG-CG1 3.75Å; L595-I599 PolarHBondContact O-N 3.27Å; I599-G601 VanDerWaalsContact C-N 3.25Å; I599-G601 PolarHBondContact O-N 3.19Å; I599-I602 PolarHBondContact O-N 3.45Å; I599-L603 VanDerWaalsContact O-CB 3.26Å; I599-L603 WeakPolarHBondContact O-CB 3.36Å; I599-L603 PolarHBondContact O-N 2.86Å; I599-T742 HydrophobicContact CG2-CG2 4.39Å; I599-L745 VanDerWaalsContact CD1-C 3.46Å; I599-L745 HydrophobicContact CD1-CB 3.66Å; I599-L745 HydrophobicContact CG1-CB 3.99Å; I599-L745 HydrophobicContact CG2-CB 4.01Å; I599-L745 HydrophobicContact CG2-CD1 3.86Å; I599-Q746 HydrophobicContact CD1-CB 4.16Å; I599-Q746 HydrophobicContact CD1-CG 3.48Å; I599-Q746 VanDerWaalsContact CD1-CG 3.48Å
600D78.9Confident72.8Confident67 Ų6737.1 Ų37.136%0.35822%0.224SC..Hα-helixtrans-63.4-36.1-177.9-166.162.1000110.6S596 I602 L603 Q604 R738S596-D600 WeakPolarHBondContact O-CB 3.43Å; S596-D600 PolarHBondContact O-N 3.02Å; D600-I602 PolarHBondContact O-N 3.43Å; D600-L603 PolarHBondContact O-N 2.97Å; D600-Q604 VanDerWaalsContact O-CB 3.3Å; D600-Q604 WeakPolarHBondContact O-CB 3.15Å; D600-Q604 WeakPolarHBondContact O-CG 3.49Å; D600-Q604 PolarHBondContact O-N 3.29Å; D600-R738 IonicContact OD1-NH2 3.94Å; D600-R738 PolarHBondContact OD1-NH2 2.91Å; D600-R738 VanDerWaalsContact OD1-NH2 3.12Å
601G78.5Confident74.4Confident48 Ų4841 Ų4150%0.49524%0.24SC..Hα-helixtrans-57.7-48.6172.700000113.4E597 I599 G605E597-G601 PolarHBondContact O-N 3.5Å; I599-G601 VanDerWaalsContact C-N 3.25Å; I599-G601 PolarHBondContact O-N 3.19Å; G601-G605 PolarHBondContact O-N 2.89Å; G601-G605 VanDerWaalsContact O-N 3.08Å
602I78.5Confident76.1Confident19 Ų1947.6 Ų47.610%0.09727%0.268CS..Hα-helixtrans-64.6-43.5177.7-65.9168.5000110.6A370 L374 T380 A598 I599 D600 G605 L606 L745A370-I602 HydrophobicContact CB-CG2 3.8Å; L374-I602 HydrophobicContact CB-CD1 3.92Å; L374-I602 HydrophobicContact CD1-CD1 3.58Å; L374-I602 HydrophobicContact CG-CD1 4.37Å; T380-I602 HydrophobicContact CG2-CD1 4.25Å; A598-I602 PolarHBondContact O-N 3.37Å; I599-I602 PolarHBondContact O-N 3.45Å; D600-I602 PolarHBondContact O-N 3.43Å; I602-G605 PolarHBondContact O-N 3.4Å; I602-L606 HydrophobicContact CG2-CD1 4.42Å; I602-L606 PolarHBondContact O-N 3.35Å; I602-L745 HydrophobicContact CG2-CD1 4.36Å
603L83.6Confident77.6Confident3 Ų345.8 Ų45.82%0.01625%0.254CS..Hα-helixtrans-66.4-41-178.5-172.160000111.9I599 D600 L606 I607 R738 L741 T742I599-L603 VanDerWaalsContact O-CB 3.26Å; I599-L603 WeakPolarHBondContact O-CB 3.36Å; I599-L603 PolarHBondContact O-N 2.86Å; D600-L603 PolarHBondContact O-N 2.97Å; L603-L606 PolarHBondContact O-N 3.49Å; L603-I607 HydrophobicContact CD1-CD1 4.44Å; L603-I607 HydrophobicContact CG-CD1 4Å; L603-I607 WeakPolarHBondContact O-CB 3.27Å; L603-I607 WeakPolarHBondContact O-CG1 3.39Å; L603-I607 PolarHBondContact O-N 2.85Å; L603-R738 HydrophobicContact CD1-CG 4.35Å; L603-R738 HydrophobicContact CD2-CG 3.59Å; L603-R738 HydrophobicContact CG-CG 4.17Å; L603-L741 HydrophobicContact CD1-CB 3.97Å; L603-L741 HydrophobicContact CD1-CD1 4.13Å; L603-T742 VanDerWaalsContact CD2-OG1 3.29Å; L603-T742 WeakPolarHBondContact CD2-OG1 3.37Å
604Q85.2Confident79.3Confident72 Ų7245.9 Ų45.934%0.33625%0.25SS..Hα-helixtrans-64.2-41.9174.6-70.7-69.96.500111.2D600 L606 I607 E608D600-Q604 VanDerWaalsContact O-CB 3.3Å; D600-Q604 WeakPolarHBondContact O-CB 3.15Å; D600-Q604 WeakPolarHBondContact O-CG 3.49Å; D600-Q604 PolarHBondContact O-N 3.29Å; Q604-L606 VanDerWaalsContact C-N 3.35Å; Q604-L606 PolarHBondContact O-N 2.9Å; Q604-I607 PolarHBondContact O-N 2.64Å; Q604-E608 WeakPolarHBondContact O-CB 3.41Å; Q604-E608 WeakPolarHBondContact O-CG 3.47Å; Q604-E608 PolarHBondContact O-N 2.9Å
605G85.1Confident80.7Confident34 Ų3446 Ų4635%0.35125%0.251SS..Hα-helixtrans-55.7-48.5173.100000112.1G601 I602 E608 S609G601-G605 PolarHBondContact O-N 2.89Å; G601-G605 VanDerWaalsContact O-N 3.08Å; I602-G605 PolarHBondContact O-N 3.4Å; G605-E608 PolarHBondContact O-N 3.33Å; G605-S609 PolarHBondContact O-N 2.94Å; G605-S609 PolarHBondContact O-OG 2.88Å
606L85.7Confident82Confident15 Ų1548.3 Ų48.38%0.07926%0.261CS..Hα-helixtrans-64.1-41.1176.5-72.1175.4000113.1F218 L367 A370 I602 L603 Q604 E608 S609 F610F218-L606 HydrophobicContact CE2-CD1 4.41Å; F218-L606 HydrophobicContact CZ-CD1 3.91Å; L367-L606 HydrophobicContact CD2-CD2 3.82Å; L367-L606 HydrophobicContact CG-CD2 4.41Å; A370-L606 HydrophobicContact CB-CD1 3.91Å; A370-L606 HydrophobicContact CB-CD2 3.63Å; A370-L606 HydrophobicContact CB-CG 3.78Å; I602-L606 HydrophobicContact CG2-CD1 4.42Å; I602-L606 PolarHBondContact O-N 3.35Å; L603-L606 PolarHBondContact O-N 3.49Å; Q604-L606 VanDerWaalsContact C-N 3.35Å; Q604-L606 PolarHBondContact O-N 2.9Å; L606-E608 VanDerWaalsContact C-N 3.34Å; L606-S609 PolarHBondContact O-N 3.32Å; L606-F610 WeakPolarHBondContact O-CB 3.41Å; L606-F610 PolarHBondContact O-N 3.3Å
607I87.3Confident83.3Confident14 Ų1447.7 Ų47.77%0.07226%0.257CS..Hα-helixtrans-64.2-41.4177.4-71.5168.5000110.6L603 Q604 F610 K611 V734 R738L603-I607 HydrophobicContact CD1-CD1 4.44Å; L603-I607 HydrophobicContact CG-CD1 4Å; L603-I607 WeakPolarHBondContact O-CB 3.27Å; L603-I607 WeakPolarHBondContact O-CG1 3.39Å; L603-I607 PolarHBondContact O-N 2.85Å; Q604-I607 PolarHBondContact O-N 2.64Å; I607-F610 PolarHBondContact O-N 3.15Å; I607-K611 HydrophobicContact CG2-CD 4.06Å; I607-K611 WeakPolarHBondContact O-CB 3.33Å; I607-K611 VanDerWaalsContact O-CG 3.31Å; I607-K611 WeakPolarHBondContact O-CG 3.3Å; I607-K611 PolarHBondContact O-N 3.43Å; I607-V734 HydrophobicContact CD1-CG1 4.02Å; I607-V734 HydrophobicContact CG1-CG1 3.9Å; I607-V734 HydrophobicContact CG2-CG1 3.95Å; I607-V734 HydrophobicContact CG2-CG2 4.36Å; I607-R738 HydrophobicContact CD1-CG 4.28Å
608E87.7Confident84.5Confident102 Ų10244.5 Ų44.548%0.47725%0.245SC..Hα-helixtrans-64.5-45.1175-79.2-169.7-164.700112Q604 G605 L606 F610 K611 K612Q604-E608 WeakPolarHBondContact O-CB 3.41Å; Q604-E608 WeakPolarHBondContact O-CG 3.47Å; Q604-E608 PolarHBondContact O-N 2.9Å; G605-E608 PolarHBondContact O-N 3.33Å; L606-E608 VanDerWaalsContact C-N 3.34Å; E608-F610 VanDerWaalsContact C-N 3.31Å; E608-F610 PolarHBondContact O-N 3.42Å; E608-K611 PolarHBondContact O-N 2.65Å; E608-K612 WeakPolarHBondContact O-CB 3.4Å; E608-K612 VanDerWaalsContact O-CG 3.26Å; E608-K612 WeakPolarHBondContact O-CG 3.5Å; E608-K612 PolarHBondContact O-N 3.01Å; E608-K612 IonicContact OE2-NZ 2.78Å; E608-K612 PolarHBondContact OE2-NZ 2.53Å
609S87.5Confident85.8Confident18 Ų1844.2 Ų44.213%0.12624%0.242CC..Hα-helixtrans-59.6-43.7175.7-74.30000111.5D366 G605 L606 K611 K612 I613D366-S609 PolarHBondContact OD1-OG 3.49Å; D366-S609 WeakPolarHBondContact OD2-CB 3.42Å; D366-S609 PolarHBondContact OD2-OG 3.39Å; G605-S609 PolarHBondContact O-N 2.94Å; G605-S609 PolarHBondContact O-OG 2.88Å; L606-S609 PolarHBondContact O-N 3.32Å; S609-K611 PolarHBondContact O-N 2.77Å; S609-K612 PolarHBondContact O-N 3.24Å; S609-I613 WeakPolarHBondContact O-CG1 3.36Å
610F86.4Confident86.6Confident12 Ų1248 Ų485%0.05326%0.256CS..Hα-helixtrans-59-49.1173.4-169.3-104.2000110.7L226 F229 V359 I363 L606 I607 E608 K612 I613 M730 V734L226-F610 HydrophobicContact CD2-CE2 4Å; F229-F610 AromaticContact CD2-CZ 3.95Å; F229-F610 HydrophobicContact CD2-CZ 3.95Å; F229-F610 HydrophobicContact CE2-CE1 4.48Å; F229-F610 AromaticContact CE2-CZ 3.99Å; F229-F610 HydrophobicContact CE2-CZ 3.99Å; F229-F610 HydrophobicContact CG-CZ 4.26Å; F229-F610 HydrophobicContact CZ-CZ 4.36Å; V359-F610 HydrophobicContact CG1-CD2 4.17Å; V359-F610 HydrophobicContact CG1-CE2 3.72Å; I363-F610 HydrophobicContact CD1-CD2 4.45Å; L606-F610 WeakPolarHBondContact O-CB 3.41Å; L606-F610 PolarHBondContact O-N 3.3Å; I607-F610 PolarHBondContact O-N 3.15Å; E608-F610 VanDerWaalsContact C-N 3.31Å; E608-F610 PolarHBondContact O-N 3.42Å; F610-K612 VanDerWaalsContact C-N 3.27Å; F610-K612 PolarHBondContact O-N 3.47Å; F610-I613 HydrophobicContact CD2-CD1 4.06Å; F610-I613 WeakPolarHBondContact O-CB 3.46Å; F610-I613 VanDerWaalsContact O-CG1 3.22Å; F610-I613 WeakPolarHBondContact O-CG1 3.36Å; F610-I613 PolarHBondContact O-N 2.76Å; F610-M730 HydrophobicContact CD1-CE 4.02Å; F610-M730 HydrophobicContact CD1-CG 3.76Å; F610-M730 HydrophobicContact CE1-CB 4.24Å; F610-M730 HydrophobicContact CE1-CE 4.19Å; F610-M730 HydrophobicContact CE1-CG 3.61Å; F610-M730 WeakPolarHBondContact O-CE 3.18Å; F610-V734 HydrophobicContact CD1-CG2 3.45Å; F610-V734 VanDerWaalsContact CD1-CG2 3.45Å; F610-V734 HydrophobicContact CE1-CG2 3.88Å; F610-V734 HydrophobicContact CG-CG2 4.38Å
611K84.2Confident87.4Confident112 Ų11252.4 Ų52.449%0.48727%0.268SS..Hα-helixtrans-64.1-25180-75.8176.2179.3176.70115.1I607 E608 S609 I613 M730I607-K611 HydrophobicContact CG2-CD 4.06Å; I607-K611 WeakPolarHBondContact O-CB 3.33Å; I607-K611 VanDerWaalsContact O-CG 3.31Å; I607-K611 WeakPolarHBondContact O-CG 3.3Å; I607-K611 PolarHBondContact O-N 3.43Å; E608-K611 PolarHBondContact O-N 2.65Å; S609-K611 PolarHBondContact O-N 2.77Å; K611-I613 VanDerWaalsContact C-N 3.3Å; K611-M730 HydrophobicContact CB-SD 4.31Å; K611-M730 HydrophobicContact CG-CG 4.44Å; K611-M730 HydrophobicContact CG-SD 4.15Å
612K87.4Confident88.1Confident148 Ų14850.7 Ų50.764%0.64325%0.248SC*.THydrogen-bonded Turntrans-79.9-9.5178.5-74.7166.6-170.8160.30113.1E608 S609 F610 D614E608-K612 WeakPolarHBondContact O-CB 3.4Å; E608-K612 VanDerWaalsContact O-CG 3.26Å; E608-K612 WeakPolarHBondContact O-CG 3.5Å; E608-K612 PolarHBondContact O-N 3.01Å; E608-K612 IonicContact OE2-NZ 2.78Å; E608-K612 PolarHBondContact OE2-NZ 2.53Å; S609-K612 PolarHBondContact O-N 3.24Å; F610-K612 VanDerWaalsContact C-N 3.27Å; F610-K612 PolarHBondContact O-N 3.47Å; K612-D614 PolarHBondContact O-N 3.46Å
613I87.8Confident89Confident20 Ų2049.8 Ų49.810%0.10324%0.243CC..  trans-66.7121.9179.9-56.7172.1000110V359 I363 S609 F610 K611 L615 M730V359-I613 HydrophobicContact CB-CD1 4.38Å; V359-I613 HydrophobicContact CG1-CD1 3.67Å; V359-I613 HydrophobicContact CG2-CD1 4.47Å; I363-I613 HydrophobicContact CG2-CD1 3.51Å; I363-I613 HydrophobicContact CG2-CG1 3.99Å; S609-I613 WeakPolarHBondContact O-CG1 3.36Å; F610-I613 HydrophobicContact CD2-CD1 4.06Å; F610-I613 WeakPolarHBondContact O-CB 3.46Å; F610-I613 VanDerWaalsContact O-CG1 3.22Å; F610-I613 WeakPolarHBondContact O-CG1 3.36Å; F610-I613 PolarHBondContact O-N 2.76Å; K611-I613 VanDerWaalsContact C-N 3.3Å; I613-L615 HydrophobicContact CG2-CD2 3.65Å; I613-L615 HydrophobicContact CG2-CG 3.93Å; I613-L615 PolarHBondContact O-N 3.41Å; I613-L615 VanDerWaalsContact O-N 3.07Å; I613-M730 HydrophobicContact CB-CE 4.47Å
614D88.9Confident89.5Confident90 Ų9055.6 Ų55.648%0.48127%0.27SS..  trans-77.893.1171.9-179.211000110.9K612 E616 S617 P618K612-D614 PolarHBondContact O-N 3.46Å; D614-E616 PolarHBondContact OD1-N 3.45Å; D614-E616 VanDerWaalsContact OD1-N 3.08Å; D614-S617 VanDerWaalsContact CG-OG 3.3Å; D614-S617 PolarHBondContact OD1-N 2.94Å; D614-S617 PolarHBondContact OD1-OG 3.32Å; D614-S617 WeakPolarHBondContact OD2-CB 3.49Å; D614-S617 PolarHBondContact OD2-OG 3.29Å; D614-P618 WeakPolarHBondContact O-CD 3.24Å
615L86.7Confident90Very high9 Ų954.1 Ų54.15%0.04727%0.268CS..  trans-87.8-16.5171.7-63.8-177.6000112.6F229 L355 V359 I613 F619 V726 M730F229-L615 HydrophobicContact CE1-CD1 3.96Å; F229-L615 HydrophobicContact CZ-CD1 3.56Å; L355-L615 HydrophobicContact CD1-CD1 4.3Å; L355-L615 HydrophobicContact CD1-CD2 3.53Å; L355-L615 HydrophobicContact CD1-CG 4.48Å; V359-L615 HydrophobicContact CG2-CD1 4.5Å; V359-L615 HydrophobicContact CG2-CD2 3.77Å; I613-L615 HydrophobicContact CG2-CD2 3.65Å; I613-L615 HydrophobicContact CG2-CG 3.93Å; I613-L615 PolarHBondContact O-N 3.41Å; I613-L615 VanDerWaalsContact O-N 3.07Å; L615-F619 VanDerWaalsContact O-CD2 3.28Å; L615-F619 WeakPolarHBondContact O-CD2 3.23Å; L615-V726 HydrophobicContact CB-CG1 3.96Å; L615-V726 HydrophobicContact CB-CG2 4.15Å; L615-V726 HydrophobicContact CD1-CG1 4.36Å; L615-M730 HydrophobicContact CD1-CE 4.49Å
616E90.7Very high90.6Very high48 Ų4852.5 Ų52.522%0.22425%0.251CS..Hα-helixtrans-77.3-46.7-176.4-71.3-164.1-160.300111.7D614 F619 R620 S723 V726D614-E616 PolarHBondContact OD1-N 3.45Å; D614-E616 VanDerWaalsContact OD1-N 3.08Å; E616-F619 PolarHBondContact O-N 2.81Å; E616-R620 WeakPolarHBondContact O-CB 3.47Å; E616-R620 VanDerWaalsContact O-CG 3.31Å; E616-R620 WeakPolarHBondContact O-CG 3.24Å; E616-R620 PolarHBondContact O-N 2.8Å; E616-R620 IonicContact OE2-CZ 3.01Å; E616-R620 IonicContact OE2-NE 2.76Å; E616-R620 PolarHBondContact OE2-NE 3.34Å; E616-R620 VanDerWaalsContact OE2-NE 3.1Å; E616-R620 IonicContact OE2-NH2 3.25Å; E616-R620 PolarHBondContact OE2-NH2 3.37Å; E616-S723 VanDerWaalsContact OE1-CA 3.28Å; E616-S723 WeakPolarHBondContact OE1-CA 3.2Å; E616-S723 WeakPolarHBondContact OE1-CB 3.34Å; E616-S723 PolarHBondContact OE1-OG 3.17Å; E616-V726 HydrophobicContact CG-CB 4.48Å; E616-V726 HydrophobicContact CG-CG2 4.13Å
617S91.7Very high91.1Very high48 Ų4853.7 Ų53.734%0.33626%0.258SS..Hα-helixtrans-62-42-172.8-59.70000114.5D614 F619 R620 R621D614-S617 VanDerWaalsContact CG-OG 3.3Å; D614-S617 PolarHBondContact OD1-N 2.94Å; D614-S617 PolarHBondContact OD1-OG 3.32Å; D614-S617 WeakPolarHBondContact OD2-CB 3.49Å; D614-S617 PolarHBondContact OD2-OG 3.29Å; S617-F619 PolarHBondContact O-N 3.33Å; S617-R620 PolarHBondContact O-N 3.24Å; S617-R621 WeakPolarHBondContact O-CB 3.38Å; S617-R621 WeakPolarHBondContact O-CG 3.3Å; S617-R621 PolarHBondContact O-N 2.86Å; S617-R621 PolarHBondContact O-NE 3.06Å
618P91Very high91.5Very high41 Ų4155 Ų5527%0.26627%0.27SS..Hα-helixtrans-57.2-48.4174.4-24.134.7000111.9D614 R621 T622D614-P618 WeakPolarHBondContact O-CD 3.24Å; P618-R621 PolarHBondContact O-N 3.46Å; P618-T622 PolarHBondContact O-N 3.29Å; P618-T622 PolarHBondContact O-OG1 2.64Å; P618-T622 VanDerWaalsContact O-OG1 3.08Å
619F92.6Very high91.9Very high4 Ų450.1 Ų50.12%0.01825%0.248CC..Hα-helixtrans-66.1-43.5178.6-82.4-86.3000112.4F233 T351 I352 L355 L615 E616 S617 R621 T622 I623 Y718 L722F233-F619 HydrophobicContact CD1-CZ 4.39Å; F233-F619 AromaticContact CE1-CE1 3.99Å; F233-F619 HydrophobicContact CE1-CE1 3.99Å; F233-F619 AromaticContact CE1-CE2 3.87Å; F233-F619 HydrophobicContact CE1-CE2 3.87Å; F233-F619 AromaticContact CE1-CZ 3.48Å; F233-F619 HydrophobicContact CE1-CZ 3.48Å; F233-F619 VanDerWaalsContact CE1-CZ 3.48Å; F233-F619 HydrophobicContact CZ-CD2 4.49Å; F233-F619 HydrophobicContact CZ-CE2 4.06Å; F233-F619 HydrophobicContact CZ-CZ 4.07Å; T351-F619 HydrophobicContact CG2-CD1 4.03Å; T351-F619 HydrophobicContact CG2-CD2 4.12Å; T351-F619 HydrophobicContact CG2-CE1 3.98Å; T351-F619 HydrophobicContact CG2-CE2 4.08Å; T351-F619 HydrophobicContact CG2-CG 4.12Å; T351-F619 HydrophobicContact CG2-CZ 4Å; I352-F619 HydrophobicContact CG1-CE1 3.63Å; I352-F619 HydrophobicContact CG1-CZ 4Å; L355-F619 HydrophobicContact CD1-CE2 4.34Å; L615-F619 VanDerWaalsContact O-CD2 3.28Å; L615-F619 WeakPolarHBondContact O-CD2 3.23Å; E616-F619 PolarHBondContact O-N 2.81Å; S617-F619 PolarHBondContact O-N 3.33Å; F619-R621 VanDerWaalsContact C-N 3.32Å; F619-R621 PolarHBondContact O-N 3Å; F619-T622 PolarHBondContact O-N 2.76Å; F619-I623 WeakPolarHBondContact O-CB 3.35Å; F619-I623 WeakPolarHBondContact O-CD1 3.43Å; F619-I623 WeakPolarHBondContact O-CG1 3.34Å; F619-I623 PolarHBondContact O-N 2.89Å; F619-Y718 AromaticContact CD1-CE1 3.98Å; F619-Y718 HydrophobicContact CD1-CE1 3.98Å; F619-Y718 WeakPolarHBondContact CE1-OH 3.34Å; F619-L722 HydrophobicContact CB-CD1 4.01Å; F619-L722 HydrophobicContact CB-CD2 3.7Å; F619-L722 HydrophobicContact CG-CD1 4.22Å
620R93.8Very high92.3Very high83 Ų8349.6 Ų49.631%0.31324%0.243SC..Hα-helixtrans-59.7-42.7177.3-73.1-177.6-174.7-76.45.9111.6E616 S617 I623 Q624 N719 L722E616-R620 WeakPolarHBondContact O-CB 3.47Å; E616-R620 VanDerWaalsContact O-CG 3.31Å; E616-R620 WeakPolarHBondContact O-CG 3.24Å; E616-R620 PolarHBondContact O-N 2.8Å; E616-R620 IonicContact OE2-CZ 3.01Å; E616-R620 IonicContact OE2-NE 2.76Å; E616-R620 PolarHBondContact OE2-NE 3.34Å; E616-R620 VanDerWaalsContact OE2-NE 3.1Å; E616-R620 IonicContact OE2-NH2 3.25Å; E616-R620 PolarHBondContact OE2-NH2 3.37Å; S617-R620 PolarHBondContact O-N 3.24Å; R620-I623 PolarHBondContact O-N 3.02Å; R620-Q624 WeakPolarHBondContact O-CB 3.29Å; R620-Q624 VanDerWaalsContact O-CG 3.25Å; R620-Q624 WeakPolarHBondContact O-CG 3.42Å; R620-Q624 PolarHBondContact O-N 3.14Å; R620-N719 PolarHBondContact NH1-OD1 3.4Å; R620-L722 HydrophobicContact CG-CD2 3.78Å
621R94.5Very high92.7Very high160 Ų16054.5 Ų54.560%0.60427%0.266SS*.Hα-helixtrans-62.1-48.2174.5-74.6-175.1-64.9-171.60.2111.4S617 P618 F619 I623 Q624 S625S617-R621 WeakPolarHBondContact O-CB 3.38Å; S617-R621 WeakPolarHBondContact O-CG 3.3Å; S617-R621 PolarHBondContact O-N 2.86Å; S617-R621 PolarHBondContact O-NE 3.06Å; P618-R621 PolarHBondContact O-N 3.46Å; F619-R621 VanDerWaalsContact C-N 3.32Å; F619-R621 PolarHBondContact O-N 3Å; R621-I623 VanDerWaalsContact C-N 3.35Å; R621-I623 PolarHBondContact O-N 3.42Å; R621-Q624 PolarHBondContact O-N 3.16Å; R621-S625 WeakPolarHBondContact O-CB 2.9Å; R621-S625 PolarHBondContact O-N 3.29Å; R621-S625 PolarHBondContact O-OG 2.66Å; R621-S625 VanDerWaalsContact O-OG 3.09Å
622T95Very high93.2Very high12 Ų1254.8 Ų54.87%0.07426%0.264CS..Hα-helixtrans-61.6-43178.9-580000111.8E347 F348 T351 P618 F619 S625 C626E347-T622 HydrophobicContact CB-CG2 4.22Å; E347-T622 HydrophobicContact CG-CG2 4.22Å; F348-T622 HydrophobicContact CB-CG2 4.23Å; T351-T622 PolarHBondContact OG1-OG1 3.17Å; P618-T622 PolarHBondContact O-N 3.29Å; P618-T622 PolarHBondContact O-OG1 2.64Å; P618-T622 VanDerWaalsContact O-OG1 3.08Å; F619-T622 PolarHBondContact O-N 2.76Å; T622-S625 PolarHBondContact O-N 3.19Å; T622-C626 WeakPolarHBondContact O-CB 3.44Å; T622-C626 PolarHBondContact O-N 3.03Å; T622-C626 PolarHBondContact O-SG 3.22Å
623I95.4Very high93.5Very high0 Ų047.7 Ų47.70%023%0.233CC..Hα-helixtrans-61.9-48.5176.5-67.5160000110.7F348 F619 R620 R621 S625 C626 L627 L715 Y718 N719 L722F348-I623 HydrophobicContact CE2-CG1 4.4Å; F619-I623 WeakPolarHBondContact O-CB 3.35Å; F619-I623 WeakPolarHBondContact O-CD1 3.43Å; F619-I623 WeakPolarHBondContact O-CG1 3.34Å; F619-I623 PolarHBondContact O-N 2.89Å; R620-I623 PolarHBondContact O-N 3.02Å; R621-I623 VanDerWaalsContact C-N 3.35Å; R621-I623 PolarHBondContact O-N 3.42Å; I623-S625 VanDerWaalsContact C-N 3.31Å; I623-S625 PolarHBondContact O-N 3.48Å; I623-C626 PolarHBondContact O-N 3.3Å; I623-L627 HydrophobicContact CG2-CD1 3.89Å; I623-L627 HydrophobicContact CG2-CG 4.3Å; I623-L627 WeakPolarHBondContact O-CB 3.38Å; I623-L627 WeakPolarHBondContact O-CG 3.38Å; I623-L627 PolarHBondContact O-N 3.41Å; I623-L715 HydrophobicContact CG1-CD2 4.22Å; I623-L715 HydrophobicContact CG2-CD2 4.36Å; I623-Y718 HydrophobicContact CD1-CD1 3.67Å; I623-Y718 HydrophobicContact CD1-CE1 4.04Å; I623-Y718 HydrophobicContact CG1-CD1 4.39Å; I623-N719 HydrophobicContact CD1-CB 4.16Å; I623-N719 HydrophobicContact CG2-CB 4.1Å; I623-L722 HydrophobicContact CD1-CD2 4.24Å
624Q95.6Very high93.7Very high125 Ų12551.8 Ų51.858%0.58425%0.25SS*.Hα-helixtrans-59.7-43.4178.5-76.7174.3-12.200111.6R620 R621 L627 A628R620-Q624 WeakPolarHBondContact O-CB 3.29Å; R620-Q624 VanDerWaalsContact O-CG 3.25Å; R620-Q624 WeakPolarHBondContact O-CG 3.42Å; R620-Q624 PolarHBondContact O-N 3.14Å; R621-Q624 PolarHBondContact O-N 3.16Å; Q624-L627 PolarHBondContact O-N 3.29Å; Q624-A628 WeakPolarHBondContact O-CB 3.43Å; Q624-A628 PolarHBondContact O-N 3.09Å
625S95.3Very high93.7Very high42 Ų4249.5 Ų49.529%0.29424%0.236SC..Hα-helixtrans-65.7-38.2176.4-62.20000112.3Y344 R621 T622 I623 A628 A629Y344-S625 WeakPolarHBondContact OH-CB 3.4Å; Y344-S625 PolarHBondContact OH-OG 3.22Å; R621-S625 WeakPolarHBondContact O-CB 2.9Å; R621-S625 PolarHBondContact O-N 3.29Å; R621-S625 PolarHBondContact O-OG 2.66Å; R621-S625 VanDerWaalsContact O-OG 3.09Å; T622-S625 PolarHBondContact O-N 3.19Å; I623-S625 VanDerWaalsContact C-N 3.31Å; I623-S625 PolarHBondContact O-N 3.48Å; S625-A628 PolarHBondContact O-N 3.32Å; S625-A629 WeakPolarHBondContact O-CB 3.13Å; S625-A629 PolarHBondContact O-N 3.36Å
626C96.7Very high93.8Very high0 Ų049.2 Ų49.20%024%0.235CC..Hα-helixtrans-65.5-43.6174.1-68.40000111.7L345 T622 I623 A628 A629 F630 L715L345-C626 HydrophobicContact CD2-CB 3.97Å; T622-C626 WeakPolarHBondContact O-CB 3.44Å; T622-C626 PolarHBondContact O-N 3.03Å; T622-C626 PolarHBondContact O-SG 3.22Å; I623-C626 PolarHBondContact O-N 3.3Å; C626-A628 VanDerWaalsContact C-N 3.32Å; C626-A628 PolarHBondContact O-N 3.11Å; C626-A629 WeakPolarHBondContact O-CB 3.48Å; C626-A629 PolarHBondContact O-N 3.33Å; C626-F630 WeakPolarHBondContact O-CD2 3.44Å; C626-F630 PolarHBondContact O-N 3.03Å; C626-L715 HydrophobicContact CB-CD1 3.74Å; C626-L715 HydrophobicContact CB-CD2 4.37Å
627L96.1Very high93.5Very high40 Ų4049.6 Ų49.621%0.20924%0.243CC..Hα-helixtrans-63.4-39.2175.4-70.6173000111.5I623 Q624 F630 E631 V712 L715 N716I623-L627 HydrophobicContact CG2-CD1 3.89Å; I623-L627 HydrophobicContact CG2-CG 4.3Å; I623-L627 WeakPolarHBondContact O-CB 3.38Å; I623-L627 WeakPolarHBondContact O-CG 3.38Å; I623-L627 PolarHBondContact O-N 3.41Å; Q624-L627 PolarHBondContact O-N 3.29Å; L627-F630 PolarHBondContact O-N 3.38Å; L627-E631 PolarHBondContact O-N 2.71Å; L627-V712 HydrophobicContact CD2-CG1 4.01Å; L627-L715 HydrophobicContact CD2-CB 4.09Å; L627-L715 HydrophobicContact CD2-CD1 4.25Å; L627-N716 WeakPolarHBondContact CD1-OD1 3.43Å
628A96Very high92.9Very high41 Ų4153.1 Ų53.134%0.33926%0.262SS..Hα-helixtrans-66.1-37.1174.500000112.3Q624 S625 C626 E631 R632Q624-A628 WeakPolarHBondContact O-CB 3.43Å; Q624-A628 PolarHBondContact O-N 3.09Å; S625-A628 PolarHBondContact O-N 3.32Å; C626-A628 VanDerWaalsContact C-N 3.32Å; C626-A628 PolarHBondContact O-N 3.11Å; A628-E631 PolarHBondContact O-N 2.75Å; A628-R632 PolarHBondContact O-N 3Å; A628-R632 VanDerWaalsContact O-N 3.13Å; A628-R632 PolarHBondContact O-NH1 2.92Å
629A96.1Very high92Very high0 Ų052.2 Ų52.20%026%0.256CS..Hα-helixtrans-62.6-44171.800000111D341 L345 S625 C626 E631 R632 L633D341-A629 HydrophobicContact CB-CB 4.14Å; L345-A629 HydrophobicContact CD2-CB 4.1Å; S625-A629 WeakPolarHBondContact O-CB 3.13Å; S625-A629 PolarHBondContact O-N 3.36Å; C626-A629 WeakPolarHBondContact O-CB 3.48Å; C626-A629 PolarHBondContact O-N 3.33Å; A629-E631 PolarHBondContact O-N 2.98Å; A629-R632 PolarHBondContact O-N 3.4Å; A629-L633 VanDerWaalsContact O-CG 3.31Å; A629-L633 WeakPolarHBondContact O-CG 3.31Å; A629-L633 PolarHBondContact O-N 3.32Å; A629-L633 VanDerWaalsContact O-N 3.08Å
630F95.9Very high91.4Very high6 Ų655.3 Ų55.33%0.02627%0.272CS..Hα-helixtrans-63.1-37.5174.5-78.2-57000113.6F249 L345 C626 L627 R632 L633 K634 M708 A711 V712 L715F249-F630 AromaticContact CD1-CE1 3.73Å; F249-F630 HydrophobicContact CD1-CE1 3.73Å; F249-F630 HydrophobicContact CD1-CZ 4.27Å; F249-F630 HydrophobicContact CE1-CD1 4.5Å; F249-F630 AromaticContact CE1-CE1 3.77Å; F249-F630 HydrophobicContact CE1-CE1 3.77Å; F249-F630 HydrophobicContact CG-CE1 4.15Å; F249-F630 HydrophobicContact CZ-CE1 4.23Å; L345-F630 HydrophobicContact CD1-CE1 3.69Å; L345-F630 HydrophobicContact CD1-CE2 4.18Å; L345-F630 HydrophobicContact CD1-CZ 3.49Å; L345-F630 VanDerWaalsContact CD1-CZ 3.49Å; L345-F630 HydrophobicContact CD2-CD2 4.05Å; L345-F630 HydrophobicContact CD2-CE1 4.41Å; L345-F630 HydrophobicContact CD2-CE2 3.64Å; L345-F630 HydrophobicContact CD2-CZ 3.85Å; L345-F630 HydrophobicContact CG-CZ 4.31Å; C626-F630 WeakPolarHBondContact O-CD2 3.44Å; C626-F630 PolarHBondContact O-N 3.03Å; L627-F630 PolarHBondContact O-N 3.38Å; F630-R632 VanDerWaalsContact C-N 3.3Å; F630-R632 PolarHBondContact O-N 2.93Å; F630-L633 HydrophobicContact CD1-CD1 4.38Å; F630-L633 CarbonylContact O-C 3.59Å; F630-L633 WeakPolarHBondContact O-CA 3.38Å; F630-L633 PolarHBondContact O-N 3.34Å; F630-K634 PolarHBondContact O-N 3.34Å; F630-K634 VanDerWaalsContact O-N 3.16Å; F630-M708 HydrophobicContact CD1-CG 3.46Å; F630-M708 VanDerWaalsContact CD1-CG 3.46Å; F630-M708 HydrophobicContact CD1-SD 4.2Å; F630-M708 HydrophobicContact CE1-CG 3.78Å; F630-M708 HydrophobicContact CG-CG 4.45Å; F630-A711 HydrophobicContact CE1-CB 4.28Å; F630-A711 HydrophobicContact CE2-CB 4Å; F630-A711 HydrophobicContact CZ-CB 3.52Å; F630-V712 HydrophobicContact CB-CG2 3.69Å; F630-V712 HydrophobicContact CD1-CG2 4.22Å; F630-V712 HydrophobicContact CD2-CG2 3.71Å; F630-V712 HydrophobicContact CE2-CG2 4.38Å; F630-V712 HydrophobicContact CG-CG2 3.61Å; F630-L715 HydrophobicContact CD2-CD1 3.85Å; F630-L715 HydrophobicContact CE2-CD1 3.55Å
631E94.9Very high91Very high115 Ų11551.3 Ų51.354%0.53726%0.257SS..Hα-helixtrans-65.7-34.5175.7-169.463.8-169.300111.8L627 A628 A629 L633 K634L627-E631 PolarHBondContact O-N 2.71Å; A628-E631 PolarHBondContact O-N 2.75Å; A629-E631 PolarHBondContact O-N 2.98Å; E631-L633 VanDerWaalsContact C-N 3.26Å; E631-L633 PolarHBondContact O-N 3.22Å; E631-K634 WeakPolarHBondContact O-CB 3.33Å; E631-K634 PolarHBondContact O-N 3.23Å; E631-K634 WeakPolarHBondContact OE1-CD 3.35Å; E631-K634 IonicContact OE1-NZ 3.3Å; E631-K634 PolarHBondContact OE1-NZ 2.93Å; E631-K634 IonicContact OE2-NZ 3.8Å
632R94.4Very high90.6Very high118 Ų11851.5 Ų51.545%0.44526%0.258SS..Hα-helixtrans-68.7-26.5171.4-70.3-173.3-67.3-86.42.7112.7D341 A628 A629 F630 K634 F635D341-R632 IonicContact OD1-CZ 2.75Å; D341-R632 IonicContact OD1-NE 3.14Å; D341-R632 PolarHBondContact OD1-NE 2.88Å; D341-R632 IonicContact OD1-NH2 2.56Å; D341-R632 PolarHBondContact OD1-NH2 3.2Å; D341-R632 IonicContact OD2-NE 2.66Å; A628-R632 PolarHBondContact O-N 3Å; A628-R632 VanDerWaalsContact O-N 3.13Å; A628-R632 PolarHBondContact O-NH1 2.92Å; A629-R632 PolarHBondContact O-N 3.4Å; F630-R632 VanDerWaalsContact C-N 3.3Å; F630-R632 PolarHBondContact O-N 2.93Å; R632-K634 VanDerWaalsContact C-N 3.31Å; R632-F635 WeakPolarHBondContact O-CD1 3.24Å
633L94.1Very high90.2Very high0 Ų055 Ų550%027%0.273CS..THydrogen-bonded Turntrans-86.74.2176.2-66.3166.6000113.5F249 H338 D341 V342 A629 F630 E631 F635 L636 M708F249-L633 HydrophobicContact CE1-CD1 3.94Å; F249-L633 HydrophobicContact CZ-CD1 3.92Å; H338-L633 HydrophobicContact CB-CD2 3.59Å; D341-L633 HydrophobicContact CB-CD1 4.26Å; D341-L633 HydrophobicContact CB-CD2 4.48Å; D341-L633 HydrophobicContact CB-CG 4.29Å; V342-L633 HydrophobicContact CG2-CD1 4.07Å; V342-L633 HydrophobicContact CG2-CD2 4.04Å; A629-L633 VanDerWaalsContact O-CG 3.31Å; A629-L633 WeakPolarHBondContact O-CG 3.31Å; A629-L633 PolarHBondContact O-N 3.32Å; A629-L633 VanDerWaalsContact O-N 3.08Å; F630-L633 HydrophobicContact CD1-CD1 4.38Å; F630-L633 CarbonylContact O-C 3.59Å; F630-L633 WeakPolarHBondContact O-CA 3.38Å; F630-L633 PolarHBondContact O-N 3.34Å; E631-L633 VanDerWaalsContact C-N 3.26Å; E631-L633 PolarHBondContact O-N 3.22Å; L633-F635 HydrophobicContact CD2-CE1 3.94Å; L633-F635 HydrophobicContact CD2-CZ 4.07Å; L633-F635 PolarHBondContact O-N 3.45Å; L633-L636 HydrophobicContact CB-CD1 4.24Å; L633-L636 HydrophobicContact CD2-CD1 4.45Å; L633-L636 WeakPolarHBondContact O-CB 3.06Å; L633-L636 WeakPolarHBondContact O-CG 3.43Å; L633-L636 PolarHBondContact O-N 3.45Å; L633-M708 HydrophobicContact CB-SD 4.03Å
634K91.3Very high89.8Confident106 Ų10655 Ų5546%0.46127%0.273SS..G310 helixtrans-59.8-20.8-176.4-169.4177.4-163.7166.60114.5F630 E631 R632 L636 S637F630-K634 PolarHBondContact O-N 3.34Å; F630-K634 VanDerWaalsContact O-N 3.16Å; E631-K634 WeakPolarHBondContact O-CB 3.33Å; E631-K634 PolarHBondContact O-N 3.23Å; E631-K634 WeakPolarHBondContact OE1-CD 3.35Å; E631-K634 IonicContact OE1-NZ 3.3Å; E631-K634 PolarHBondContact OE1-NZ 2.93Å; E631-K634 IonicContact OE2-NZ 3.8Å; R632-K634 VanDerWaalsContact C-N 3.31Å; K634-L636 PolarHBondContact O-N 3.29Å; K634-L636 VanDerWaalsContact O-N 3.11Å; K634-S637 WeakPolarHBondContact O-CB 3.37Å; K634-S637 PolarHBondContact O-N 3.28Å; K634-S637 PolarHBondContact O-OG 2.91Å
635F90.1Very high89.5Confident41 Ų4149.8 Ų49.818%0.1825%0.249CC..G310 helixtrans-54.4-28.4171.766.2-96.2000112.5Q334 I335 H338 R632 L633 S637 V638Q334-F635 HydrophobicContact CB-CD2 3.85Å; Q334-F635 HydrophobicContact CB-CE1 4.44Å; Q334-F635 HydrophobicContact CB-CE2 3.39Å; Q334-F635 HydrophobicContact CB-CZ 3.74Å; Q334-F635 HydrophobicContact CG-CD2 4.5Å; Q334-F635 HydrophobicContact CG-CE2 4.47Å; I335-F635 HydrophobicContact CG1-CE2 4.35Å; H338-F635 HydrophobicContact CB-CE1 4.21Å; H338-F635 HydrophobicContact CB-CZ 4.43Å; H338-F635 AromaticContact CD2-CE1 3.51Å; H338-F635 AromaticContact CG-CE1 3.9Å; R632-F635 WeakPolarHBondContact O-CD1 3.24Å; L633-F635 HydrophobicContact CD2-CE1 3.94Å; L633-F635 HydrophobicContact CD2-CZ 4.07Å; L633-F635 PolarHBondContact O-N 3.45Å; F635-S637 PolarHBondContact O-N 2.93Å; F635-V638 PolarHBondContact O-N 3.29Å
636L89Confident89Confident4 Ų454.1 Ų54.12%0.02126%0.263CS..G310 helixtrans-63.7-27.7175.5-64.4173.3000112.6F249 I331 I335 L633 K634 V638 V639 I704 P705 M708F249-L636 HydrophobicContact CE2-CD1 3.82Å; F249-L636 HydrophobicContact CZ-CD1 3.81Å; I331-L636 HydrophobicContact CG2-CD2 3.7Å; I335-L636 HydrophobicContact CD1-CD2 4.07Å; I335-L636 HydrophobicContact CG1-CD2 3.87Å; L633-L636 HydrophobicContact CB-CD1 4.24Å; L633-L636 HydrophobicContact CD2-CD1 4.45Å; L633-L636 WeakPolarHBondContact O-CB 3.06Å; L633-L636 WeakPolarHBondContact O-CG 3.43Å; L633-L636 PolarHBondContact O-N 3.45Å; K634-L636 PolarHBondContact O-N 3.29Å; K634-L636 VanDerWaalsContact O-N 3.11Å; L636-V638 VanDerWaalsContact C-N 3.27Å; L636-V638 PolarHBondContact O-N 3.42Å; L636-V639 WeakPolarHBondContact O-CG2 3.36Å; L636-V639 PolarHBondContact O-N 3.42Å; L636-I704 HydrophobicContact CB-CG2 4.44Å; L636-I704 HydrophobicContact CD1-CG2 3.88Å; L636-I704 HydrophobicContact CD2-CG2 4.33Å; L636-I704 HydrophobicContact CG-CG2 4.45Å; L636-P705 WeakPolarHBondContact O-CG 2.99Å; L636-M708 HydrophobicContact CB-CE 4.35Å; L636-M708 HydrophobicContact CB-SD 4.29Å; L636-M708 HydrophobicContact CD1-SD 4.26Å
637S83.6Confident88.6Confident56 Ų5656.1 Ų56.139%0.39227%0.272SS..G310 helixtrans-72-18.4-179.368.30000114.5K634 F635 V639K634-S637 WeakPolarHBondContact O-CB 3.37Å; K634-S637 PolarHBondContact O-N 3.28Å; K634-S637 PolarHBondContact O-OG 2.91Å; F635-S637 PolarHBondContact O-N 2.93Å; S637-V639 VanDerWaalsContact C-N 3.29Å
638V79.5Confident88.2Confident122 Ų12254.2 Ų54.274%0.73926%0.262SS*.G310 helixtrans-83-12.4-177.4-176.80000111.7F635 L636 D640F635-V638 PolarHBondContact O-N 3.29Å; L636-V638 VanDerWaalsContact C-N 3.27Å; L636-V638 PolarHBondContact O-N 3.42Å; V638-D640 PolarHBondContact O-N 2.97Å
639V72.6Confident87.6Confident22 Ų2256 Ų5613%0.13327%0.266CS..  trans-76.6116.9-172.6-177.40000110.4I331 L636 S637 I641 F701I331-V639 HydrophobicContact CD1-CB 3.96Å; I331-V639 HydrophobicContact CD1-CG1 3.44Å; I331-V639 VanDerWaalsContact CD1-CG1 3.44Å; I331-V639 HydrophobicContact CD1-CG2 3.25Å; I331-V639 HydrophobicContact CG1-CG2 3.77Å; I331-V639 HydrophobicContact CG2-CG2 4.43Å; L636-V639 WeakPolarHBondContact O-CG2 3.36Å; L636-V639 PolarHBondContact O-N 3.42Å; S637-V639 VanDerWaalsContact C-N 3.29Å; V639-I641 HydrophobicContact CG1-CG2 4.13Å; V639-F701 HydrophobicContact CG1-CD1 4.32Å; V639-F701 HydrophobicContact CG1-CE1 3.6Å; V639-F701 HydrophobicContact CG1-CZ 4.39Å
640D79Confident87.2Confident68 Ų6857.5 Ų57.536%0.36428%0.275SS..  trans-127.497.9173.7-175.22.9000110V638 R642V638-D640 PolarHBondContact O-N 2.97Å; D640-R642 VanDerWaalsContact CG-NE 3.33Å; D640-R642 WeakPolarHBondContact OD1-CB 3.48Å; D640-R642 WeakPolarHBondContact OD1-CG 3.44Å; D640-R642 IonicContact OD1-CZ 3.97Å; D640-R642 PolarHBondContact OD1-N 3.32Å; D640-R642 VanDerWaalsContact OD1-N 3.13Å; D640-R642 IonicContact OD1-NE 3.07Å; D640-R642 PolarHBondContact OD1-NE 3.47Å; D640-R642 IonicContact OD1-NH2 3.21Å; D640-R642 IonicContact OD2-CZ 3.38Å; D640-R642 VanDerWaalsContact OD2-CZ 3.3Å; D640-R642 IonicContact OD2-NE 3.43Å; D640-R642 PolarHBondContact OD2-NE 3.49Å; D640-R642 VanDerWaalsContact OD2-NE 3.14Å; D640-R642 IonicContact OD2-NH2 2.79Å; D640-R642 PolarHBondContact OD2-NH2 3.49Å
641I86.2Confident86.9Confident0 Ų058.4 Ų58.40%028%0.282CS..  trans-104.924.5177.660.3154.3000111.9V328 V639 E643 A644 I645 F698 F701 N702V328-I641 HydrophobicContact CG2-CG2 4.49Å; V639-I641 HydrophobicContact CG1-CG2 4.13Å; I641-E643 PolarHBondContact O-N 2.82Å; I641-A644 HydrophobicContact CB-CB 4.26Å; I641-A644 PolarHBondContact O-N 3.42Å; I641-I645 HydrophobicContact CD1-CD1 4.33Å; I641-I645 HydrophobicContact CD1-CG1 4.4Å; I641-I645 HydrophobicContact CG1-CD1 4.23Å; I641-I645 WeakPolarHBondContact O-CG1 3.32Å; I641-I645 PolarHBondContact O-N 3.01Å; I641-F698 HydrophobicContact CD1-CB 3.93Å; I641-F698 HydrophobicContact CD1-CD1 4.29Å; I641-F698 HydrophobicContact CD1-CG 4.21Å; I641-F698 WeakPolarHBondContact CD1-O 3.27Å; I641-F701 HydrophobicContact CD1-CB 4.2Å; I641-F701 HydrophobicContact CD1-CD1 3.53Å; I641-F701 HydrophobicContact CD1-CE1 4.38Å; I641-F701 HydrophobicContact CD1-CG 4.32Å; I641-F701 HydrophobicContact CG1-CD1 4.16Å; I641-F701 HydrophobicContact CG2-CE1 4.45Å; I641-N702 HydrophobicContact CD1-CB 4.08Å; I641-N702 HydrophobicContact CG1-CB 3.85Å
642R86.8Confident86.6Confident164 Ų16453.2 Ų53.262%0.61926%0.258SS*.Hα-helixtrans-59.8-35.5-179.3-75.4-179.4-71.7-163-0.4112.7D640 I645 K646D640-R642 VanDerWaalsContact CG-NE 3.33Å; D640-R642 WeakPolarHBondContact OD1-CB 3.48Å; D640-R642 WeakPolarHBondContact OD1-CG 3.44Å; D640-R642 IonicContact OD1-CZ 3.97Å; D640-R642 PolarHBondContact OD1-N 3.32Å; D640-R642 VanDerWaalsContact OD1-N 3.13Å; D640-R642 IonicContact OD1-NE 3.07Å; D640-R642 PolarHBondContact OD1-NE 3.47Å; D640-R642 IonicContact OD1-NH2 3.21Å; D640-R642 IonicContact OD2-CZ 3.38Å; D640-R642 VanDerWaalsContact OD2-CZ 3.3Å; D640-R642 IonicContact OD2-NE 3.43Å; D640-R642 PolarHBondContact OD2-NE 3.49Å; D640-R642 VanDerWaalsContact OD2-NE 3.14Å; D640-R642 IonicContact OD2-NH2 2.79Å; D640-R642 PolarHBondContact OD2-NH2 3.49Å; R642-I645 PolarHBondContact O-N 2.91Å; R642-K646 PolarHBondContact O-N 3.47Å
643E86.1Confident86.5Confident84 Ų8447.6 Ų47.639%0.39324%0.237SC..Hα-helixtrans-69.1-43.3176.9-17058.3-15400111.2V322 I641 I645 K646 Q647V322-E643 HydrophobicContact CG1-CG 3.7Å; I641-E643 PolarHBondContact O-N 2.82Å; E643-I645 VanDerWaalsContact C-N 3.31Å; E643-I645 PolarHBondContact O-N 3.45Å; E643-K646 WeakPolarHBondContact O-CB 3.32Å; E643-K646 PolarHBondContact O-N 3.44Å; E643-K646 VanDerWaalsContact O-N 3.15Å; E643-Q647 HydrophobicContact CG-CG 4.49Å; E643-Q647 WeakPolarHBondContact O-CG 3.39Å; E643-Q647 PolarHBondContact O-N 3.01Å; E643-Q647 PolarHBondContact OE1-NE2 3.38Å
644A86.4Confident86.4Confident0 Ų052.2 Ų52.20%026%0.257CS..Hα-helixtrans-58.5-42.3174.300000112.1I641 K646 Q647 V648 F698I641-A644 HydrophobicContact CB-CB 4.26Å; I641-A644 PolarHBondContact O-N 3.42Å; A644-K646 PolarHBondContact O-N 3.31Å; A644-Q647 PolarHBondContact O-N 3.31Å; A644-V648 WeakPolarHBondContact O-CG2 3.39Å; A644-V648 PolarHBondContact O-N 2.99Å; A644-F698 HydrophobicContact CB-CD2 4.21Å; A644-F698 HydrophobicContact CB-CE2 4.09Å
645I88.8Confident86.4Confident16 Ų1647.6 Ų47.68%0.08224%0.237CC..Hα-helixtrans-59.1-46.7174.9-71.3167000111.2I641 R642 E643 Q647 Y695 F698 M699 N702I641-I645 HydrophobicContact CD1-CD1 4.33Å; I641-I645 HydrophobicContact CD1-CG1 4.4Å; I641-I645 HydrophobicContact CG1-CD1 4.23Å; I641-I645 WeakPolarHBondContact O-CG1 3.32Å; I641-I645 PolarHBondContact O-N 3.01Å; R642-I645 PolarHBondContact O-N 2.91Å; E643-I645 VanDerWaalsContact C-N 3.31Å; E643-I645 PolarHBondContact O-N 3.45Å; I645-Q647 VanDerWaalsContact C-N 3.34Å; I645-Q647 PolarHBondContact O-N 3.43Å; I645-Y695 HydrophobicContact CG2-CD2 4.15Å; I645-Y695 HydrophobicContact CG2-CE2 3.55Å; I645-F698 HydrophobicContact CG1-CB 3.72Å; I645-M699 HydrophobicContact CD1-SD 3.92Å; I645-M699 HydrophobicContact CG1-SD 4.4Å; I645-M699 HydrophobicContact CG2-CG 4.32Å; I645-M699 HydrophobicContact CG2-SD 3.61Å; I645-N702 HydrophobicContact CD1-CB 3.5Å
646K86.2Confident86.2Confident133 Ų13350.9 Ų50.958%0.57826%0.257SS*.Hα-helixtrans-62.9-42.4-179.8-176.4-176.6174.2-168.60111.4R642 E643 A644R642-K646 PolarHBondContact O-N 3.47Å; E643-K646 WeakPolarHBondContact O-CB 3.32Å; E643-K646 PolarHBondContact O-N 3.44Å; E643-K646 VanDerWaalsContact O-N 3.15Å; A644-K646 PolarHBondContact O-N 3.31Å
647Q87Confident86.3Confident43 Ų4354.3 Ų54.320%0.20128%0.275CS..Hα-helixtrans-76.8-31.9-176.8-64-57.2-23.900113.6V318 V322 F323 E643 A644 I645 N649 T650V318-Q647 HydrophobicContact CG1-CB 4.06Å; V322-Q647 HydrophobicContact CB-CG 4.4Å; V322-Q647 HydrophobicContact CG1-CB 4.27Å; V322-Q647 HydrophobicContact CG1-CG 3.52Å; F323-Q647 HydrophobicContact CE1-CB 4.43Å; E643-Q647 HydrophobicContact CG-CG 4.49Å; E643-Q647 WeakPolarHBondContact O-CG 3.39Å; E643-Q647 PolarHBondContact O-N 3.01Å; E643-Q647 PolarHBondContact OE1-NE2 3.38Å; A644-Q647 PolarHBondContact O-N 3.31Å; I645-Q647 VanDerWaalsContact C-N 3.34Å; I645-Q647 PolarHBondContact O-N 3.43Å; Q647-N649 PolarHBondContact O-N 3.14Å; Q647-N649 VanDerWaalsContact O-N 3.17Å; Q647-T650 WeakPolarHBondContact O-CB 3.5Å; Q647-T650 PolarHBondContact O-N 3.49Å; Q647-T650 PolarHBondContact O-OG1 2.82Å
648V88.1Confident86.7Confident0 Ų051.7 Ų51.70%026%0.257CS..Hα-helixtrans-56.3-33.1175.41570000112.9F323 A644 T650 R691 I694 Y695 F698F323-V648 HydrophobicContact CD1-CG2 3.6Å; F323-V648 HydrophobicContact CE1-CB 4.21Å; F323-V648 HydrophobicContact CE1-CG2 3.37Å; A644-V648 WeakPolarHBondContact O-CG2 3.39Å; A644-V648 PolarHBondContact O-N 2.99Å; V648-T650 PolarHBondContact O-N 3.46Å; V648-R691 HydrophobicContact CG1-CB 4.48Å; V648-R691 VanDerWaalsContact CG1-O 3.26Å; V648-R691 WeakPolarHBondContact CG1-O 3.5Å; V648-R691 WeakPolarHBondContact O-CD 3.19Å; V648-I694 HydrophobicContact CG1-CB 4.43Å; V648-I694 HydrophobicContact CG1-CG2 4.44Å; V648-I694 HydrophobicContact CG2-CG2 3.89Å; V648-Y695 HydrophobicContact CG1-CD2 4.37Å; V648-F698 HydrophobicContact CB-CD2 4.46Å; V648-F698 HydrophobicContact CG2-CD2 3.53Å; V648-F698 HydrophobicContact CG2-CE2 3.44Å; V648-F698 VanDerWaalsContact CG2-CE2 3.44Å
649N84.4Confident87.3Confident78 Ų7850.1 Ų50.142%0.41724%0.244SC..THydrogen-bonded Turntrans-76-11.3178.2-80.7-18.1000113.8Q647 R691 Y695Q647-N649 PolarHBondContact O-N 3.14Å; Q647-N649 VanDerWaalsContact O-N 3.17Å; N649-R691 PolarHBondContact O-NH1 2.76Å; N649-Y695 VanDerWaalsContact CG-CD2 3.47Å; N649-Y695 VanDerWaalsContact ND2-CD2 3.29Å; N649-Y695 WeakPolarHBondContact ND2-CD2 3.31Å; N649-Y695 WeakPolarHBondContact ND2-CE2 3.46Å; N649-Y695 WeakPolarHBondContact OD1-CD2 3.31Å
650T88Confident88.3Confident32 Ų3254.3 Ų54.320%0.19626%0.262CS..SBendtrans-76.6140.2176.866.10000110.6V318 Q647 V648 R691V318-T650 WeakPolarHBondContact CG2-OG1 3.48Å; Q647-T650 WeakPolarHBondContact O-CB 3.5Å; Q647-T650 PolarHBondContact O-N 3.49Å; Q647-T650 PolarHBondContact O-OG1 2.82Å; V648-T650 PolarHBondContact O-N 3.46Å; T650-R691 WeakPolarHBondContact O-CD 3.46Å
651P88.9Confident89Confident25 Ų2551.2 Ų51.216%0.16225%0.245CC..  trans-56.6142.7173.1-24.534.2000111T653P651-T653 PolarHBondContact O-N 3.5Å
652L88.5Confident89.4Confident6 Ų651.4 Ų51.43%0.03125%0.247CC..SBendtrans-60.1-31.8-175.7-179.762.5000112.9L273 V276 V316 R317 P684 L687 D688L273-L652 HydrophobicContact CD1-CD1 3.49Å; L273-L652 VanDerWaalsContact CD1-CD1 3.49Å; V276-L652 HydrophobicContact CG1-CD2 4.15Å; V316-L652 WeakPolarHBondContact CA-O 3.29Å; V316-L652 HydrophobicContact CG1-CD1 4.32Å; R317-L652 PolarHBondContact N-O 3.47Å; L652-P684 HydrophobicContact CD2-CB 3.88Å; L652-P684 WeakPolarHBondContact CD2-O 3.36Å; L652-L687 HydrophobicContact CD1-CD2 4.27Å; L652-L687 HydrophobicContact CD2-CB 4.15Å; L652-L687 HydrophobicContact CD2-CD2 3.88Å; L652-L687 HydrophobicContact CD2-CG 4.21Å; L652-D688 HydrophobicContact CB-CB 4.27Å; L652-D688 VanDerWaalsContact CB-OD1 3.26Å; L652-D688 WeakPolarHBondContact CB-OD1 3.14Å; L652-D688 PolarHBondContact N-OD1 2.92Å
653T91.3Very high89.8Confident0 Ų047 Ų470%024%0.241CC..BIsolated β-bridgetrans-121.8175.8179.373.70000111.7L280 K315 P651 I655 L658L280-T653 HydrophobicContact CD2-CG2 4.05Å; K315-T653 VanDerWaalsContact O-CA 3.23Å; K315-T653 WeakPolarHBondContact O-CA 3.47Å; K315-T653 WeakPolarHBondContact O-CB 3.2Å; P651-T653 PolarHBondContact O-N 3.5Å; T653-I655 PolarHBondContact O-N 2.86Å; T653-I655 WeakPolarHBondContact OG1-CB 3.24Å; T653-I655 PolarHBondContact OG1-N 3.47Å; T653-I655 PolarHBondContact OG1-O 3.43Å; T653-I655 VanDerWaalsContact OG1-O 3.12Å; T653-L658 HydrophobicContact CG2-CD1 4.08Å; T653-L658 HydrophobicContact CG2-CD2 4.29Å
654F92.3Very high90.3Very high97 Ų9746.5 Ų46.543%0.42524%0.235SC..SBendtrans-74.9-11170.8-64.4-86.2000112.8Q313 K315 R317 D656Q313-F654 HydrophobicContact CB-CB 3.89Å; Q313-F654 HydrophobicContact CG-CB 4.31Å; Q313-F654 WeakPolarHBondContact O-CB 3.28Å; Q313-F654 PolarHBondContact O-N 3.1Å; Q313-F654 PolarHBondContact OE1-O 2.81Å; K315-F654 HydrophobicContact CB-CD2 3.96Å; K315-F654 HydrophobicContact CB-CE2 4.13Å; K315-F654 PolarHBondContact O-N 3.43Å; R317-F654 HydrophobicContact CB-CD2 4.36Å; R317-F654 HydrophobicContact CB-CE2 4.2Å; R317-F654 HydrophobicContact CB-CZ 4.29Å; R317-F654 HydrophobicContact CG-CD1 4.2Å; R317-F654 HydrophobicContact CG-CE1 3.89Å; R317-F654 HydrophobicContact CG-CE2 4.4Å; R317-F654 HydrophobicContact CG-CZ 4Å; F654-D656 PolarHBondContact O-N 2.87Å
655I91.7Very high90.6Very high9 Ų946.5 Ų46.55%0.04624%0.235CC..SBendtrans-81.4106.4166.3-56.9177.9000107.2L309 Q313 L314 T653 N657 F661L309-I655 HydrophobicContact CD1-CG1 4.42Å; L309-I655 HydrophobicContact CG-CD1 4.18Å; L309-I655 HydrophobicContact CG-CG1 4.41Å; Q313-I655 HydrophobicContact CB-CD1 4.39Å; Q313-I655 HydrophobicContact CB-CG1 3.55Å; L314-I655 HydrophobicContact CB-CD1 4.14Å; L314-I655 HydrophobicContact CD1-CD1 4.07Å; T653-I655 PolarHBondContact O-N 2.86Å; T653-I655 WeakPolarHBondContact OG1-CB 3.24Å; T653-I655 PolarHBondContact OG1-N 3.47Å; T653-I655 PolarHBondContact OG1-O 3.43Å; T653-I655 VanDerWaalsContact OG1-O 3.12Å; I655-N657 VanDerWaalsContact C-N 3.29Å; I655-N657 PolarHBondContact O-N 2.74Å; I655-F661 HydrophobicContact CD1-CB 4.49Å; I655-F661 HydrophobicContact CD1-CD1 3.89Å; I655-F661 HydrophobicContact CD1-CD2 4.03Å; I655-F661 HydrophobicContact CD1-CE1 4.07Å; I655-F661 HydrophobicContact CD1-CE2 4.2Å; I655-F661 HydrophobicContact CD1-CG 3.87Å; I655-F661 HydrophobicContact CD1-CZ 4.23Å; I655-F661 HydrophobicContact CG2-CB 3.85Å; I655-F661 HydrophobicContact CG2-CG 4.34Å
656D86.3Confident90.9Very high110 Ų11050.8 Ų50.859%0.58825%0.253SS*.SBendtrans-63.4-33.7-175.5-68.5-34.4000112.7R317 F654R317-D656 IonicContact NH1-OD1 2.62Å; R317-D656 PolarHBondContact NH1-OD1 3.46Å; F654-D656 PolarHBondContact O-N 2.87Å
657N90.5Very high91.2Very high75 Ų7546.9 Ų46.940%0.40125%0.246SC..  trans-119.684.1178.9-168.1-9.3000111.4I655 D659 E660 F661I655-N657 VanDerWaalsContact C-N 3.29Å; I655-N657 PolarHBondContact O-N 2.74Å; N657-D659 VanDerWaalsContact C-N 3.29Å; N657-D659 PolarHBondContact O-N 3.03Å; N657-D659 PolarHBondContact OD1-N 2.97Å; N657-E660 HydrophobicContact CB-CB 3.96Å; N657-E660 VanDerWaalsContact ND2-CB 3.33Å; N657-E660 WeakPolarHBondContact ND2-CB 3.42Å; N657-E660 PolarHBondContact ND2-OE2 2.98Å; N657-E660 PolarHBondContact O-N 3.45Å; N657-E660 PolarHBondContact OD1-N 3.45Å; N657-E660 VanDerWaalsContact OD1-N 3.13Å; N657-F661 PolarHBondContact O-N 2.77Å; N657-F661 VanDerWaalsContact O-N 3.11Å
658L91.7Very high91.4Very high2 Ų245 Ų451%0.0124%0.237CC..Hα-helixtrans-61.1-35.6178.8-86.2151.3000112.7L314 T653 F661 V662 P684 V685 D688L314-L658 HydrophobicContact CD1-CD2 4.12Å; T653-L658 HydrophobicContact CG2-CD1 4.08Å; T653-L658 HydrophobicContact CG2-CD2 4.29Å; L658-F661 PolarHBondContact O-N 2.9Å; L658-V662 WeakPolarHBondContact O-CG2 3.17Å; L658-V662 PolarHBondContact O-N 3.02Å; L658-P684 HydrophobicContact CD2-CB 4.48Å; L658-V685 HydrophobicContact CB-CG2 4.02Å; L658-D688 HydrophobicContact CD1-CB 4.13Å
659D92.5Very high91.4Very high89 Ų8951.5 Ų51.548%0.47627%0.272SS..Hα-helixtrans-63.7-42.1177.4-75.1-73.9000112.2N657 V662 S663 V685N657-D659 VanDerWaalsContact C-N 3.29Å; N657-D659 PolarHBondContact O-N 3.03Å; N657-D659 PolarHBondContact OD1-N 2.97Å; D659-V662 PolarHBondContact O-N 2.8Å; D659-S663 WeakPolarHBondContact O-CB 3.44Å; D659-S663 PolarHBondContact O-N 2.92Å; D659-S663 PolarHBondContact O-OG 3.02Å; D659-V685 VanDerWaalsContact OD1-CG1 3.3Å; D659-V685 WeakPolarHBondContact OD1-CG1 3.24Å
660E93.4Very high91.7Very high109 Ų10948.6 Ų48.651%0.50926%0.256SS..Hα-helixtrans-65.4-42.6174.8179.4176.9176.100111.3N657 V662 S663 R664N657-E660 HydrophobicContact CB-CB 3.96Å; N657-E660 VanDerWaalsContact ND2-CB 3.33Å; N657-E660 WeakPolarHBondContact ND2-CB 3.42Å; N657-E660 PolarHBondContact ND2-OE2 2.98Å; N657-E660 PolarHBondContact O-N 3.45Å; N657-E660 PolarHBondContact OD1-N 3.45Å; N657-E660 VanDerWaalsContact OD1-N 3.13Å; E660-V662 PolarHBondContact O-N 2.83Å; E660-S663 WeakPolarHBondContact O-CB 3.26Å; E660-S663 PolarHBondContact O-N 2.93Å; E660-S663 VanDerWaalsContact O-N 3.14Å; E660-R664 WeakPolarHBondContact O-CG 3.23Å; E660-R664 PolarHBondContact O-N 2.8Å
661F94.9Very high91.8Very high4 Ų454.3 Ų54.32%0.01829%0.286CS..Hα-helixtrans-59.4-46.1175.1176.6-112000112.2L287 L306 L309 A310 L314 I655 N657 L658 S663 R664 L665 L680L287-F661 HydrophobicContact CD2-CE1 4.15Å; L287-F661 HydrophobicContact CD2-CZ 3.99Å; L306-F661 HydrophobicContact CB-CE2 4.49Å; L306-F661 HydrophobicContact CD2-CD2 3.83Å; L306-F661 HydrophobicContact CD2-CE2 3.73Å; L309-F661 HydrophobicContact CD2-CD2 3.62Å; L309-F661 HydrophobicContact CD2-CE2 3.94Å; L309-F661 HydrophobicContact CG-CD2 4.32Å; L309-F661 HydrophobicContact CG-CE2 4.25Å; A310-F661 HydrophobicContact CB-CZ 3.95Å; L314-F661 HydrophobicContact CD1-CE1 4.33Å; L314-F661 HydrophobicContact CD2-CE1 4.4Å; I655-F661 HydrophobicContact CD1-CB 4.49Å; I655-F661 HydrophobicContact CD1-CD1 3.89Å; I655-F661 HydrophobicContact CD1-CD2 4.03Å; I655-F661 HydrophobicContact CD1-CE1 4.07Å; I655-F661 HydrophobicContact CD1-CE2 4.2Å; I655-F661 HydrophobicContact CD1-CG 3.87Å; I655-F661 HydrophobicContact CD1-CZ 4.23Å; I655-F661 HydrophobicContact CG2-CB 3.85Å; I655-F661 HydrophobicContact CG2-CG 4.34Å; N657-F661 PolarHBondContact O-N 2.77Å; N657-F661 VanDerWaalsContact O-N 3.11Å; L658-F661 PolarHBondContact O-N 2.9Å; F661-S663 VanDerWaalsContact C-N 3.31Å; F661-S663 PolarHBondContact O-N 3.01Å; F661-R664 PolarHBondContact O-N 3.34Å; F661-L665 HydrophobicContact CD1-CD1 4.13Å; F661-L665 HydrophobicContact CE1-CD1 3.63Å; F661-L665 HydrophobicContact CE1-CG 4.49Å; F661-L665 HydrophobicContact CE2-CD1 4.48Å; F661-L665 HydrophobicContact CZ-CD1 3.83Å; F661-L665 HydrophobicContact CZ-CG 4.31Å; F661-L665 PolarHBondContact O-N 2.9Å; F661-L665 VanDerWaalsContact O-N 3.07Å; F661-L680 HydrophobicContact CD1-CD1 4.46Å; F661-L680 HydrophobicContact CE1-CD1 4Å
662V94.8Very high91.9Very high4 Ų455.8 Ų55.82%0.02430%0.297CS..Hα-helixtrans-63.2-37.4174.7165.50000111.8L658 D659 E660 L665 K666 I677 L680 V681 V685L658-V662 WeakPolarHBondContact O-CG2 3.17Å; L658-V662 PolarHBondContact O-N 3.02Å; D659-V662 PolarHBondContact O-N 2.8Å; E660-V662 PolarHBondContact O-N 2.83Å; V662-L665 PolarHBondContact O-N 3.32Å; V662-K666 HydrophobicContact CG1-CD 4.2Å; V662-K666 WeakPolarHBondContact O-CG 3.41Å; V662-K666 PolarHBondContact O-N 2.91Å; V662-I677 HydrophobicContact CG1-CG2 4.09Å; V662-L680 HydrophobicContact CG2-CB 3.89Å; V662-L680 HydrophobicContact CG2-CD1 4.19Å; V662-V681 HydrophobicContact CG1-CG2 3.73Å; V662-V685 HydrophobicContact CG2-CG2 3.85Å
663S95Very high92.1Very high71 Ų7155.6 Ų55.650%0.49730%0.295SS..Hα-helixtrans-64.9-40.8177.7-62.10000112D659 E660 F661 K666 A667D659-S663 WeakPolarHBondContact O-CB 3.44Å; D659-S663 PolarHBondContact O-N 2.92Å; D659-S663 PolarHBondContact O-OG 3.02Å; E660-S663 WeakPolarHBondContact O-CB 3.26Å; E660-S663 PolarHBondContact O-N 2.93Å; E660-S663 VanDerWaalsContact O-N 3.14Å; F661-S663 VanDerWaalsContact C-N 3.31Å; F661-S663 PolarHBondContact O-N 3.01Å; S663-K666 PolarHBondContact O-N 3.37Å; S663-A667 PolarHBondContact O-N 3Å
664R94.9Very high92.2Very high74 Ų7459.5 Ų59.528%0.27932%0.319SS..Hα-helixtrans-64.2-41.7173.8-68.5-179.765.9-174.8-0.1112E302 E305 L306 E660 F661 K666 A667 L668E302-R664 IonicContact OE1-NE 2.72Å; E305-R664 IonicContact OE2-NH2 3.55Å; E305-R664 PolarHBondContact OE2-NH2 3.3Å; L306-R664 HydrophobicContact CD1-CB 4.08Å; L306-R664 HydrophobicContact CD2-CB 3.78Å; E660-R664 WeakPolarHBondContact O-CG 3.23Å; E660-R664 PolarHBondContact O-N 2.8Å; F661-R664 PolarHBondContact O-N 3.34Å; R664-K666 VanDerWaalsContact C-N 3.34Å; R664-K666 PolarHBondContact O-N 3.44Å; R664-A667 WeakPolarHBondContact O-CB 3.23Å; R664-A667 PolarHBondContact O-N 3.09Å; R664-L668 PolarHBondContact O-N 2.66Å
665L94.5Very high92.2Very high0 Ų058.5 Ų58.50%033%0.325CS..Hα-helixtrans-61-41.9173.4-72.5171.7000112.3L287 L291 L306 F661 V662 A667 L668 I677 L680L287-L665 HydrophobicContact CD1-CD1 4.12Å; L287-L665 HydrophobicContact CD1-CD2 3.94Å; L287-L665 HydrophobicContact CD2-CD1 4.01Å; L291-L665 HydrophobicContact CD1-CD2 4.18Å; L291-L665 HydrophobicContact CD2-CD2 4.25Å; L306-L665 HydrophobicContact CB-CD2 4.29Å; L306-L665 HydrophobicContact CD1-CD2 4.06Å; F661-L665 HydrophobicContact CD1-CD1 4.13Å; F661-L665 HydrophobicContact CE1-CD1 3.63Å; F661-L665 HydrophobicContact CE1-CG 4.49Å; F661-L665 HydrophobicContact CE2-CD1 4.48Å; F661-L665 HydrophobicContact CZ-CD1 3.83Å; F661-L665 HydrophobicContact CZ-CG 4.31Å; F661-L665 PolarHBondContact O-N 2.9Å; F661-L665 VanDerWaalsContact O-N 3.07Å; V662-L665 PolarHBondContact O-N 3.32Å; L665-A667 VanDerWaalsContact C-N 3.32Å; L665-A667 PolarHBondContact O-N 2.92Å; L665-L668 HydrophobicContact CD2-CD1 4.43Å; L665-L668 WeakPolarHBondContact O-CB 3.23Å; L665-L668 PolarHBondContact O-N 2.95Å; L665-I677 HydrophobicContact CB-CD1 4.02Å; L665-I677 HydrophobicContact CB-CG1 3.92Å; L665-L680 HydrophobicContact CD1-CD1 3.66Å
666K93.5Very high92.3Very high105 Ų10559.3 Ų59.346%0.45733%0.328SS..Hα-helixtrans-62.7-38.8175.2-74.3173.9-179.6174.60111.7V662 S663 R664 L668 N669 I677V662-K666 HydrophobicContact CG1-CD 4.2Å; V662-K666 WeakPolarHBondContact O-CG 3.41Å; V662-K666 PolarHBondContact O-N 2.91Å; S663-K666 PolarHBondContact O-N 3.37Å; R664-K666 VanDerWaalsContact C-N 3.34Å; R664-K666 PolarHBondContact O-N 3.44Å; K666-L668 PolarHBondContact O-N 3.33Å; K666-L668 VanDerWaalsContact O-N 3.14Å; K666-N669 PolarHBondContact O-N 2.89Å; K666-N669 PolarHBondContact O-OD1 3.05Å; K666-I677 HydrophobicContact CD-CG2 4.27Å; K666-I677 VanDerWaalsContact CE-CG2 3.44Å; K666-I677 HydrophobicContact CG-CD1 3.96Å; K666-I677 HydrophobicContact CG-CG2 3.82Å
667A92.2Very high92.7Very high52 Ų5254.7 Ų54.743%0.4330%0.303SS..Hα-helixtrans-62.5-19.517900000113.5K299 S663 R664 L665 N669K299-A667 PolarHBondContact NZ-O 3.49Å; S663-A667 PolarHBondContact O-N 3Å; R664-A667 WeakPolarHBondContact O-CB 3.23Å; R664-A667 PolarHBondContact O-N 3.09Å; L665-A667 VanDerWaalsContact C-N 3.32Å; L665-A667 PolarHBondContact O-N 2.92Å; A667-N669 PolarHBondContact O-N 3.27Å
668L91.4Very high92.8Very high3 Ų355.7 Ų55.72%0.01631%0.306CS..THydrogen-bonded Turntrans-65-23.3171.1-62.5177.8000112.5L291 K299 E302 L306 R664 L665 K666 M670 L673L291-L668 HydrophobicContact CD2-CD1 3.6Å; K299-L668 HydrophobicContact CB-CD2 4.01Å; K299-L668 HydrophobicContact CD-CB 4.39Å; K299-L668 HydrophobicContact CD-CD2 3.8Å; K299-L668 PolarHBondContact NZ-O 3.31Å; E302-L668 HydrophobicContact CB-CD2 4.11Å; E302-L668 HydrophobicContact CG-CD2 3.96Å; L306-L668 HydrophobicContact CD1-CD1 3.87Å; L306-L668 HydrophobicContact CD1-CD2 4.49Å; L306-L668 HydrophobicContact CD1-CG 4.2Å; R664-L668 PolarHBondContact O-N 2.66Å; L665-L668 HydrophobicContact CD2-CD1 4.43Å; L665-L668 WeakPolarHBondContact O-CB 3.23Å; L665-L668 PolarHBondContact O-N 2.95Å; K666-L668 PolarHBondContact O-N 3.33Å; K666-L668 VanDerWaalsContact O-N 3.14Å; L668-M670 VanDerWaalsContact C-N 3.27Å; L668-M670 HydrophobicContact CB-CG 4.15Å; L668-M670 HydrophobicContact CB-SD 4.04Å; L668-M670 HydrophobicContact CD1-SD 4.25Å; L668-M670 PolarHBondContact O-N 2.67Å; L668-L673 HydrophobicContact CB-CD1 4.04Å; L668-L673 HydrophobicContact CD1-CD1 3.58Å; L668-L673 HydrophobicContact CG-CD1 4.43Å
669N89.7Confident93Very high136 Ų13657.2 Ų57.273%0.72732%0.319SS*.  trans53.938.6-179.8-73.3-21.8000113.7K666 A667K666-N669 PolarHBondContact O-N 2.89Å; K666-N669 PolarHBondContact O-OD1 3.05Å; A667-N669 PolarHBondContact O-N 3.27Å
670M90.9Very high93Very high18 Ų1853 Ų539%0.08930%0.296CS..  trans-99.2121179.2-65.116953.900110.9G294 L668 S672 L673G294-M670 VanDerWaalsContact C-CE 3.48Å; G294-M670 WeakPolarHBondContact O-CE 3.41Å; L668-M670 VanDerWaalsContact C-N 3.27Å; L668-M670 HydrophobicContact CB-CG 4.15Å; L668-M670 HydrophobicContact CB-SD 4.04Å; L668-M670 HydrophobicContact CD1-SD 4.25Å; L668-M670 PolarHBondContact O-N 2.67Å; M670-S672 PolarHBondContact O-N 3.14Å; M670-L673 HydrophobicContact CB-CB 4.33Å; M670-L673 HydrophobicContact CB-CD1 3.91Å; M670-L673 HydrophobicContact CB-CG 3.97Å; M670-L673 HydrophobicContact CE-CD1 4.24Å; M670-L673 HydrophobicContact CE-CG 4.17Å; M670-L673 HydrophobicContact CG-CD1 4.31Å; M670-L673 PolarHBondContact O-N 3.08Å; M670-L673 HydrophobicContact SD-CD1 3.78Å; M670-L673 HydrophobicContact SD-CG 4.34Å
671N88.8Confident93.1Very high152 Ų15249.7 Ų49.781%0.81328%0.283SS*.G310 helixtrans-59.2-29.4177.1-70-17.3000113.1L673 T674N671-L673 VanDerWaalsContact C-N 3.28Å; N671-L673 PolarHBondContact O-N 3.42Å; N671-T674 WeakPolarHBondContact O-CB 3.38Å; N671-T674 PolarHBondContact O-N 3.28Å; N671-T674 PolarHBondContact O-OG1 2.8Å; N671-T674 VanDerWaalsContact O-OG1 3.13Å
672S91.2Very high93Very high56 Ų5654 Ų5439%0.39231%0.306SS..G310 helixtrans-68.3-24.7177.152.10000113.3M670M670-S672 PolarHBondContact O-N 3.14Å
673L92.6Very high92.9Very high1 Ų154.5 Ų54.51%0.00531%0.312CS..G310 helixtrans-83-17.5178.6-69.7176000113.2L287 T290 L291 L668 M670 N671 S675 H676 I677L287-L673 HydrophobicContact CD1-CD2 3.67Å; T290-L673 HydrophobicContact CG2-CD2 3.7Å; T290-L673 HydrophobicContact CG2-CG 4.25Å; L291-L673 HydrophobicContact CD2-CD1 3.99Å; L291-L673 HydrophobicContact CD2-CD2 4Å; L291-L673 HydrophobicContact CG-CD2 4.19Å; L668-L673 HydrophobicContact CB-CD1 4.04Å; L668-L673 HydrophobicContact CD1-CD1 3.58Å; L668-L673 HydrophobicContact CG-CD1 4.43Å; M670-L673 HydrophobicContact CB-CB 4.33Å; M670-L673 HydrophobicContact CB-CD1 3.91Å; M670-L673 HydrophobicContact CB-CG 3.97Å; M670-L673 HydrophobicContact CE-CD1 4.24Å; M670-L673 HydrophobicContact CE-CG 4.17Å; M670-L673 HydrophobicContact CG-CD1 4.31Å; M670-L673 PolarHBondContact O-N 3.08Å; M670-L673 HydrophobicContact SD-CD1 3.78Å; M670-L673 HydrophobicContact SD-CG 4.34Å; N671-L673 VanDerWaalsContact C-N 3.28Å; N671-L673 PolarHBondContact O-N 3.42Å; L673-S675 VanDerWaalsContact C-N 3.32Å; L673-S675 PolarHBondContact O-N 3.45Å; L673-H676 PolarHBondContact O-N 2.77Å; L673-I677 HydrophobicContact CB-CD1 3.79Å; L673-I677 HydrophobicContact CB-CG1 4.28Å; L673-I677 WeakPolarHBondContact O-CG1 3.45Å; L673-I677 PolarHBondContact O-N 3.32Å
674T93Very high92.8Very high82 Ų8251.2 Ų51.250%0.50329%0.289SS..Hα-helixtrans-53-45.6-171-56.50000113.1N671 Q678N671-T674 WeakPolarHBondContact O-CB 3.38Å; N671-T674 PolarHBondContact O-N 3.28Å; N671-T674 PolarHBondContact O-OG1 2.8Å; N671-T674 VanDerWaalsContact O-OG1 3.13Å; T674-Q678 WeakPolarHBondContact O-CB 3.16Å; T674-Q678 PolarHBondContact O-N 2.97Å
675S93.2Very high92.7Very high77 Ų7748.2 Ų48.254%0.53828%0.279SS..Hα-helixtrans-68.1-36.3179.859.80000112.7L673 A679L673-S675 VanDerWaalsContact C-N 3.32Å; L673-S675 PolarHBondContact O-N 3.45Å; S675-A679 WeakPolarHBondContact O-CB 3.4Å; S675-A679 PolarHBondContact O-N 2.97Å
676H93Very high92.6Very high25 Ų2553.3 Ų53.312%0.11630%0.301CS..Hα-helixtrans-71-42.4177.8-51.4-42.6000111.6L287 T290 L673 Q678 A679 L680L287-H676 HydrophobicContact CD1-CB 4.08Å; T290-H676 PolarHBondContact OG1-NE2 2.89Å; L673-H676 PolarHBondContact O-N 2.77Å; H676-Q678 VanDerWaalsContact C-N 3.32Å; H676-A679 PolarHBondContact O-N 3.42Å; H676-L680 WeakPolarHBondContact O-CG 3.1Å; H676-L680 PolarHBondContact O-N 3.14Å
677I94.2Very high92.5Very high14 Ų1448.6 Ų48.67%0.07228%0.281CS..Hα-helixtrans-59.5-46.3174.1-71.8167.2000109.9V662 L665 K666 L673 A679 L680 V681V662-I677 HydrophobicContact CG1-CG2 4.09Å; L665-I677 HydrophobicContact CB-CD1 4.02Å; L665-I677 HydrophobicContact CB-CG1 3.92Å; K666-I677 HydrophobicContact CD-CG2 4.27Å; K666-I677 VanDerWaalsContact CE-CG2 3.44Å; K666-I677 HydrophobicContact CG-CD1 3.96Å; K666-I677 HydrophobicContact CG-CG2 3.82Å; L673-I677 HydrophobicContact CB-CD1 3.79Å; L673-I677 HydrophobicContact CB-CG1 4.28Å; L673-I677 WeakPolarHBondContact O-CG1 3.45Å; L673-I677 PolarHBondContact O-N 3.32Å; I677-A679 PolarHBondContact O-N 3.25Å; I677-L680 WeakPolarHBondContact O-CB 3.48Å; I677-L680 PolarHBondContact O-N 3.45Å; I677-V681 HydrophobicContact CG2-CG2 4.47Å; I677-V681 WeakPolarHBondContact O-CG2 2.97Å; I677-V681 PolarHBondContact O-N 3.09Å
678Q94.3Very high92.4Very high96 Ų9647 Ų4745%0.44927%0.265SS..Hα-helixtrans-62.7-42.7179-168.76037.400111.6T674 H676 L680 V681 D682T674-Q678 WeakPolarHBondContact O-CB 3.16Å; T674-Q678 PolarHBondContact O-N 2.97Å; H676-Q678 VanDerWaalsContact C-N 3.32Å; Q678-L680 VanDerWaalsContact C-N 3.32Å; Q678-L680 PolarHBondContact O-N 3.31Å; Q678-V681 PolarHBondContact O-N 2.94Å; Q678-D682 WeakPolarHBondContact CG-OD2 3.21Å; Q678-D682 PolarHBondContact NE2-OD1 3.45Å; Q678-D682 PolarHBondContact NE2-OD2 3.45Å; Q678-D682 WeakPolarHBondContact O-CB 3.34Å; Q678-D682 PolarHBondContact O-N 3.08Å
679A94.2Very high92.3Very high34 Ų3450.5 Ų50.528%0.28130%0.295SS..Hα-helixtrans-61.5-37.3175.300000113I283 S675 H676 I677 G683I283-A679 HydrophobicContact CD1-CB 3.92Å; I283-A679 HydrophobicContact CG1-CB 4.14Å; S675-A679 WeakPolarHBondContact O-CB 3.4Å; S675-A679 PolarHBondContact O-N 2.97Å; H676-A679 PolarHBondContact O-N 3.42Å; I677-A679 PolarHBondContact O-N 3.25Å; A679-G683 PolarHBondContact O-N 2.91Å; A679-G683 VanDerWaalsContact O-N 3.14Å
680L94.4Very high92.4Very high0 Ų045.7 Ų45.70%027%0.271CS..Hα-helixtrans-66.2-41.7173.1-73172.5000112.4L280 I283 L287 L314 F661 V662 L665 H676 I677 Q678 P684 V685L280-L680 HydrophobicContact CD1-CD2 4.31Å; I283-L680 HydrophobicContact CG2-CD2 3.77Å; I283-L680 HydrophobicContact CG2-CG 3.94Å; L287-L680 HydrophobicContact CD2-CD1 4.15Å; L314-L680 HydrophobicContact CD1-CD2 4.02Å; L314-L680 HydrophobicContact CD2-CD2 4Å; F661-L680 HydrophobicContact CD1-CD1 4.46Å; F661-L680 HydrophobicContact CE1-CD1 4Å; V662-L680 HydrophobicContact CG2-CB 3.89Å; V662-L680 HydrophobicContact CG2-CD1 4.19Å; L665-L680 HydrophobicContact CD1-CD1 3.66Å; H676-L680 WeakPolarHBondContact O-CG 3.1Å; H676-L680 PolarHBondContact O-N 3.14Å; I677-L680 WeakPolarHBondContact O-CB 3.48Å; I677-L680 PolarHBondContact O-N 3.45Å; Q678-L680 VanDerWaalsContact C-N 3.32Å; Q678-L680 PolarHBondContact O-N 3.31Å; L680-P684 HydrophobicContact CD2-CG 3.9Å; L680-P684 WeakPolarHBondContact O-CD 3.39Å; L680-P684 VanDerWaalsContact O-CG 3.29Å; L680-P684 WeakPolarHBondContact O-CG 3.46Å; L680-V685 WeakPolarHBondContact O-CB 3.46Å; L680-V685 VanDerWaalsContact O-CG2 3.3Å; L680-V685 WeakPolarHBondContact O-CG2 3.46Å; L680-V685 PolarHBondContact O-N 3.22Å
681V94.8Very high92.3Very high39 Ų3947.3 Ų47.324%0.23628%0.276CS..Iπ-helixtrans-65.6-49179171.20000111V662 I677 Q678 G683 K686V662-V681 HydrophobicContact CG1-CG2 3.73Å; I677-V681 HydrophobicContact CG2-CG2 4.47Å; I677-V681 WeakPolarHBondContact O-CG2 2.97Å; I677-V681 PolarHBondContact O-N 3.09Å; Q678-V681 PolarHBondContact O-N 2.94Å; V681-G683 PolarHBondContact O-N 3.33Å; V681-K686 WeakPolarHBondContact O-CB 3.22Å; V681-K686 PolarHBondContact O-N 3.34Å; V681-K686 VanDerWaalsContact O-N 3.17Å
682D93Very high92.3Very high94 Ų9442.1 Ų42.150%0.50326%0.258SS..Iπ-helixtrans-73.9-26-173.7-70.5-24000113.4Q678Q678-D682 WeakPolarHBondContact CG-OD2 3.21Å; Q678-D682 PolarHBondContact NE2-OD1 3.45Å; Q678-D682 PolarHBondContact NE2-OD2 3.45Å; Q678-D682 WeakPolarHBondContact O-CB 3.34Å; Q678-D682 PolarHBondContact O-N 3.08Å
683G92.3Very high92.4Very high15 Ų1544.3 Ų44.316%0.15527%0.265CS..Iπ-helixtrans-99-9717800000112.9A679 V681 V685 K686 L687A679-G683 PolarHBondContact O-N 2.91Å; A679-G683 VanDerWaalsContact O-N 3.14Å; V681-G683 PolarHBondContact O-N 3.33Å; G683-V685 PolarHBondContact O-N 2.95Å; G683-K686 PolarHBondContact O-N 3.37Å; G683-L687 WeakPolarHBondContact O-CB 3.45Å; G683-L687 PolarHBondContact O-N 2.83Å
684P92.1Very high92.4Very high2 Ų244.4 Ų44.41%0.01327%0.266CS..Iπ-helixtrans-62.3-39.4-168.222.4-33.2000114.3V276 L280 L652 L658 L680 L687 D688V276-P684 HydrophobicContact CG1-CB 4.04Å; L280-P684 HydrophobicContact CD1-CG 4.08Å; L652-P684 HydrophobicContact CD2-CB 3.88Å; L652-P684 WeakPolarHBondContact CD2-O 3.36Å; L658-P684 HydrophobicContact CD2-CB 4.48Å; L680-P684 HydrophobicContact CD2-CG 3.9Å; L680-P684 WeakPolarHBondContact O-CD 3.39Å; L680-P684 VanDerWaalsContact O-CG 3.29Å; L680-P684 WeakPolarHBondContact O-CG 3.46Å; P684-L687 PolarHBondContact O-N 3.21Å; P684-D688 VanDerWaalsContact O-CB 3.25Å; P684-D688 WeakPolarHBondContact O-CB 3.11Å; P684-D688 PolarHBondContact O-N 3.3Å
685V93.2Very high92.3Very high11 Ų1144 Ų447%0.06726%0.255CS..Iπ-helixtrans-64.6-51.7179.1173.30000110.6L658 D659 V662 L680 G683 L687 D688 A689L658-V685 HydrophobicContact CB-CG2 4.02Å; D659-V685 VanDerWaalsContact OD1-CG1 3.3Å; D659-V685 WeakPolarHBondContact OD1-CG1 3.24Å; V662-V685 HydrophobicContact CG2-CG2 3.85Å; L680-V685 WeakPolarHBondContact O-CB 3.46Å; L680-V685 VanDerWaalsContact O-CG2 3.3Å; L680-V685 WeakPolarHBondContact O-CG2 3.46Å; L680-V685 PolarHBondContact O-N 3.22Å; G683-V685 PolarHBondContact O-N 2.95Å; V685-L687 VanDerWaalsContact C-N 3.28Å; V685-L687 PolarHBondContact O-N 3.45Å; V685-D688 PolarHBondContact O-N 3.25Å; V685-A689 PolarHBondContact O-N 3.26Å
686K92.5Very high92.4Very high108 Ų10844.6 Ų44.647%0.4726%0.256SS..Hα-helixtrans-58.5-42.1178.7-176.9179.7178-1750111.6Y268 V681 G683 A689Y268-K686 PolarHBondContact OH-NZ 3.46Å; V681-K686 WeakPolarHBondContact O-CB 3.22Å; V681-K686 PolarHBondContact O-N 3.34Å; V681-K686 VanDerWaalsContact O-N 3.17Å; G683-K686 PolarHBondContact O-N 3.37Å; K686-A689 PolarHBondContact O-N 3.43Å
687L90.9Very high92.4Very high6 Ų644.4 Ų44.43%0.03126%0.256CS..Hα-helixtrans-65.9-44.9177.1-175.860.8000111.9F269 L273 V276 L652 G683 P684 V685 A689 T690F269-L687 HydrophobicContact CD2-CD1 3.36Å; F269-L687 HydrophobicContact CD2-CG 4.35Å; F269-L687 HydrophobicContact CE2-CD1 3.58Å; F269-L687 HydrophobicContact CE2-CG 4.09Å; F269-L687 HydrophobicContact CG-CD1 4.17Å; L273-L687 VanDerWaalsContact CA-CD2 3.43Å; L273-L687 HydrophobicContact CB-CD2 3.9Å; L273-L687 HydrophobicContact CD1-CD2 4.01Å; V276-L687 HydrophobicContact CB-CD2 4.34Å; V276-L687 HydrophobicContact CG2-CD2 4.04Å; L652-L687 HydrophobicContact CD1-CD2 4.27Å; L652-L687 HydrophobicContact CD2-CB 4.15Å; L652-L687 HydrophobicContact CD2-CD2 3.88Å; L652-L687 HydrophobicContact CD2-CG 4.21Å; G683-L687 WeakPolarHBondContact O-CB 3.45Å; G683-L687 PolarHBondContact O-N 2.83Å; P684-L687 PolarHBondContact O-N 3.21Å; V685-L687 VanDerWaalsContact C-N 3.28Å; V685-L687 PolarHBondContact O-N 3.45Å; L687-A689 PolarHBondContact O-N 2.55Å; L687-T690 PolarHBondContact O-N 3.25Å; L687-T690 PolarHBondContact O-OG1 2.92Å
688D90.2Very high92.3Very high17 Ų1743.8 Ų43.89%0.09125%0.253CS..Hα-helixtrans-59-37.7178.7-16276.4000111.7L652 L658 P684 V685 T690 R691L652-D688 HydrophobicContact CB-CB 4.27Å; L652-D688 VanDerWaalsContact CB-OD1 3.26Å; L652-D688 WeakPolarHBondContact CB-OD1 3.14Å; L652-D688 PolarHBondContact N-OD1 2.92Å; L658-D688 HydrophobicContact CD1-CB 4.13Å; P684-D688 VanDerWaalsContact O-CB 3.25Å; P684-D688 WeakPolarHBondContact O-CB 3.11Å; P684-D688 PolarHBondContact O-N 3.3Å; V685-D688 PolarHBondContact O-N 3.25Å; D688-T690 PolarHBondContact O-N 2.92Å; D688-R691 WeakPolarHBondContact O-CB 3.39Å; D688-R691 VanDerWaalsContact O-CG 3.27Å; D688-R691 WeakPolarHBondContact O-CG 3.34Å; D688-R691 PolarHBondContact O-N 2.8Å; D688-R691 PolarHBondContact O-NE 2.68Å; D688-R691 VanDerWaalsContact O-NE 3.15Å; D688-R691 WeakPolarHBondContact OD1-CD 3.34Å; D688-R691 IonicContact OD1-CZ 3.57Å; D688-R691 IonicContact OD1-NE 3.24Å; D688-R691 PolarHBondContact OD1-NE 3.5Å; D688-R691 IonicContact OD1-NH2 2.99Å; D688-R691 IonicContact OD2-CZ 3.75Å; D688-R691 IonicContact OD2-NE 2.77Å; D688-R691 PolarHBondContact OD2-NE 3.09Å; D688-R691 IonicContact OD2-NH2 3.01Å; D688-R691 PolarHBondContact OD2-NH2 2.83Å
689A89.9Confident92.1Very high78 Ų7843.1 Ų43.165%0.64525%0.25SS*.Hα-helixtrans-63.9-22.8176.200000114.1V685 K686 L687V685-A689 PolarHBondContact O-N 3.26Å; K686-A689 PolarHBondContact O-N 3.43Å; L687-A689 PolarHBondContact O-N 2.55Å
690T90.8Very high92Very high35 Ų3546.2 Ų46.222%0.21526%0.255CS..THydrogen-bonded Turntrans-84.8-10179.765.30000114F269 L687 D688 G692 N693 I694F269-T690 WeakPolarHBondContact CD2-OG1 3.17Å; L687-T690 PolarHBondContact O-N 3.25Å; L687-T690 PolarHBondContact O-OG1 2.92Å; D688-T690 PolarHBondContact O-N 2.92Å; T690-G692 VanDerWaalsContact C-N 3.29Å; T690-G692 PolarHBondContact O-N 2.84Å; T690-N693 PolarHBondContact O-N 3.5Å; T690-N693 VanDerWaalsContact O-N 3.08Å; T690-I694 PolarHBondContact O-N 3.3Å
691R89.2Confident91.9Very high52 Ų5246.4 Ų46.420%0.19626%0.256CS..Hα-helixtrans-53.7-41.5-175.3-72.1-176.6-59.8106.2-1.2113.2F269 V648 N649 T650 D688 N693 I694 Y695F269-R691 HydrophobicContact CE2-CG 4.32Å; V648-R691 HydrophobicContact CG1-CB 4.48Å; V648-R691 VanDerWaalsContact CG1-O 3.26Å; V648-R691 WeakPolarHBondContact CG1-O 3.5Å; V648-R691 WeakPolarHBondContact O-CD 3.19Å; N649-R691 PolarHBondContact O-NH1 2.76Å; T650-R691 WeakPolarHBondContact O-CD 3.46Å; D688-R691 WeakPolarHBondContact O-CB 3.39Å; D688-R691 VanDerWaalsContact O-CG 3.27Å; D688-R691 WeakPolarHBondContact O-CG 3.34Å; D688-R691 PolarHBondContact O-N 2.8Å; D688-R691 PolarHBondContact O-NE 2.68Å; D688-R691 VanDerWaalsContact O-NE 3.15Å; D688-R691 WeakPolarHBondContact OD1-CD 3.34Å; D688-R691 IonicContact OD1-CZ 3.57Å; D688-R691 IonicContact OD1-NE 3.24Å; D688-R691 PolarHBondContact OD1-NE 3.5Å; D688-R691 IonicContact OD1-NH2 2.99Å; D688-R691 IonicContact OD2-CZ 3.75Å; D688-R691 IonicContact OD2-NE 2.77Å; D688-R691 PolarHBondContact OD2-NE 3.09Å; D688-R691 IonicContact OD2-NH2 3.01Å; D688-R691 PolarHBondContact OD2-NH2 2.83Å; R691-N693 VanDerWaalsContact C-N 3.35Å; R691-N693 PolarHBondContact O-N 3.27Å; R691-I694 PolarHBondContact O-N 3.02Å; R691-Y695 WeakPolarHBondContact O-CB 2.97Å; R691-Y695 PolarHBondContact O-N 2.89Å
692G90Very high91.7Very high43 Ų4346.3 Ų46.344%0.44325%0.254SS..Hα-helixtrans-63.2-36.7-179.800000114T690 T696T690-G692 VanDerWaalsContact C-N 3.29Å; T690-G692 PolarHBondContact O-N 2.84Å; G692-T696 PolarHBondContact O-N 2.84Å; G692-T696 VanDerWaalsContact O-N 3.17Å; G692-T696 PolarHBondContact O-OG1 3.07Å
693N92.3Very high91.6Very high101 Ų10143.3 Ų43.354%0.5424%0.241SC..Hα-helixtrans-69.2-46175.6-69.9-8000110.3T690 R691 Y695 T696 L697T690-N693 PolarHBondContact O-N 3.5Å; T690-N693 VanDerWaalsContact O-N 3.08Å; R691-N693 VanDerWaalsContact C-N 3.35Å; R691-N693 PolarHBondContact O-N 3.27Å; N693-Y695 VanDerWaalsContact C-N 3.3Å; N693-Y695 PolarHBondContact O-N 3.31Å; N693-T696 WeakPolarHBondContact O-CB 3.28Å; N693-T696 PolarHBondContact O-N 3.44Å; N693-L697 WeakPolarHBondContact O-CG 3.38Å; N693-L697 PolarHBondContact O-N 3.39Å
694I92.4Very high91.7Very high3 Ų342.8 Ų42.82%0.01523%0.234CC..Hα-helixtrans-63.3-37.9177.7-58.2-55.7000111.5Q265 I266 F269 V648 T690 R691 T696 L697 F698Q265-I694 HydrophobicContact CB-CD1 4.3Å; I266-I694 HydrophobicContact CG1-CD1 4.48Å; F269-I694 HydrophobicContact CB-CD1 3.76Å; F269-I694 HydrophobicContact CB-CG1 3.88Å; F269-I694 HydrophobicContact CD1-CG1 4.31Å; F269-I694 HydrophobicContact CD1-CG2 4.2Å; F269-I694 HydrophobicContact CD2-CD1 4.43Å; F269-I694 HydrophobicContact CD2-CG1 3.63Å; F269-I694 HydrophobicContact CE1-CG2 4.41Å; F269-I694 HydrophobicContact CE2-CG1 4.21Å; F269-I694 HydrophobicContact CG-CD1 4.14Å; F269-I694 HydrophobicContact CG-CG1 3.68Å; F269-I694 HydrophobicContact CG-CG2 4.4Å; V648-I694 HydrophobicContact CG1-CB 4.43Å; V648-I694 HydrophobicContact CG1-CG2 4.44Å; V648-I694 HydrophobicContact CG2-CG2 3.89Å; T690-I694 PolarHBondContact O-N 3.3Å; R691-I694 PolarHBondContact O-N 3.02Å; I694-T696 VanDerWaalsContact C-N 3.32Å; I694-T696 PolarHBondContact O-N 3.29Å; I694-L697 HydrophobicContact CD1-CD1 4.29Å; I694-L697 PolarHBondContact O-N 3.04Å; I694-F698 HydrophobicContact CG2-CD2 4.06Å; I694-F698 HydrophobicContact CG2-CE1 4.33Å; I694-F698 HydrophobicContact CG2-CE2 3.79Å; I694-F698 HydrophobicContact CG2-CG 4.44Å; I694-F698 HydrophobicContact CG2-CZ 3.94Å; I694-F698 PolarHBondContact O-N 2.99Å
695Y92.5Very high91.7Very high73 Ų7343.5 Ų43.529%0.28624%0.238SC..Hα-helixtrans-57.4-48.2174.2177.5-102.4000111I645 V648 N649 R691 N693 L697 F698 M699I645-Y695 HydrophobicContact CG2-CD2 4.15Å; I645-Y695 HydrophobicContact CG2-CE2 3.55Å; V648-Y695 HydrophobicContact CG1-CD2 4.37Å; N649-Y695 VanDerWaalsContact CG-CD2 3.47Å; N649-Y695 VanDerWaalsContact ND2-CD2 3.29Å; N649-Y695 WeakPolarHBondContact ND2-CD2 3.31Å; N649-Y695 WeakPolarHBondContact ND2-CE2 3.46Å; N649-Y695 WeakPolarHBondContact OD1-CD2 3.31Å; R691-Y695 WeakPolarHBondContact O-CB 2.97Å; R691-Y695 PolarHBondContact O-N 2.89Å; N693-Y695 VanDerWaalsContact C-N 3.3Å; N693-Y695 PolarHBondContact O-N 3.31Å; Y695-L697 VanDerWaalsContact C-N 3.32Å; Y695-L697 PolarHBondContact O-N 3.38Å; Y695-F698 PolarHBondContact O-N 3.06Å; Y695-M699 HydrophobicContact CD1-CG 4.18Å; Y695-M699 HydrophobicContact CD2-CG 4.41Å; Y695-M699 HydrophobicContact CE1-CG 3.74Å; Y695-M699 HydrophobicContact CE2-CG 3.99Å; Y695-M699 HydrophobicContact CE2-SD 4.32Å; Y695-M699 WeakPolarHBondContact O-CB 3.5Å; Y695-M699 WeakPolarHBondContact O-CG 3.33Å; Y695-M699 PolarHBondContact O-N 3.48Å
696T93.3Very high91.6Very high90 Ų9048.2 Ų48.255%0.55226%0.263SS*.Hα-helixtrans-62.4-40.6179.2-56.90000111.4G692 N693 I694 R700G692-T696 PolarHBondContact O-N 2.84Å; G692-T696 VanDerWaalsContact O-N 3.17Å; G692-T696 PolarHBondContact O-OG1 3.07Å; N693-T696 WeakPolarHBondContact O-CB 3.28Å; N693-T696 PolarHBondContact O-N 3.44Å; I694-T696 VanDerWaalsContact C-N 3.32Å; I694-T696 PolarHBondContact O-N 3.29Å; T696-R700 WeakPolarHBondContact O-CB 3.24Å; T696-R700 PolarHBondContact O-N 3.44Å
697L93.1Very high91.7Very high22 Ų2245.8 Ų45.812%0.11525%0.254CS..Hα-helixtrans-65-46.2175.7-67.7-180000111.9F256 A262 Q265 I266 N693 I694 Y695 R700 F701F256-L697 HydrophobicContact CE1-CB 4.41Å; F256-L697 WeakPolarHBondContact CZ-O 3.36Å; A262-L697 HydrophobicContact CB-CD1 4.28Å; A262-L697 HydrophobicContact CB-CD2 3.75Å; Q265-L697 HydrophobicContact CB-CD1 3.88Å; I266-L697 HydrophobicContact CD1-CB 4.28Å; I266-L697 HydrophobicContact CD1-CD1 4.43Å; I266-L697 HydrophobicContact CG1-CB 4.48Å; I266-L697 HydrophobicContact CG1-CD1 4.06Å; N693-L697 WeakPolarHBondContact O-CG 3.38Å; N693-L697 PolarHBondContact O-N 3.39Å; I694-L697 HydrophobicContact CD1-CD1 4.29Å; I694-L697 PolarHBondContact O-N 3.04Å; Y695-L697 VanDerWaalsContact C-N 3.32Å; Y695-L697 PolarHBondContact O-N 3.38Å; L697-R700 PolarHBondContact O-N 2.9Å; L697-F701 WeakPolarHBondContact O-CB 3.25Å; L697-F701 PolarHBondContact O-N 3.46Å
698F92.2Very high91.9Very high0 Ų045.8 Ų45.80%025%0.254CS..Hα-helixtrans-64.6-40.4176.9-74.6-11.6000112.5I266 F323 I325 V328 I641 A644 I645 V648 I694 Y695 R700 F701 N702I266-F698 HydrophobicContact CD1-CD1 4.21Å; I266-F698 HydrophobicContact CD1-CE1 3.95Å; I266-F698 HydrophobicContact CG1-CE1 4.03Å; I266-F698 HydrophobicContact CG2-CE1 4.04Å; I266-F698 HydrophobicContact CG2-CZ 4.45Å; F323-F698 HydrophobicContact CD1-CE2 4.12Å; I325-F698 HydrophobicContact CG1-CZ 4.33Å; V328-F698 HydrophobicContact CG2-CE1 4.35Å; I641-F698 HydrophobicContact CD1-CB 3.93Å; I641-F698 HydrophobicContact CD1-CD1 4.29Å; I641-F698 HydrophobicContact CD1-CG 4.21Å; I641-F698 WeakPolarHBondContact CD1-O 3.27Å; A644-F698 HydrophobicContact CB-CD2 4.21Å; A644-F698 HydrophobicContact CB-CE2 4.09Å; I645-F698 HydrophobicContact CG1-CB 3.72Å; V648-F698 HydrophobicContact CB-CD2 4.46Å; V648-F698 HydrophobicContact CG2-CD2 3.53Å; V648-F698 HydrophobicContact CG2-CE2 3.44Å; V648-F698 VanDerWaalsContact CG2-CE2 3.44Å; I694-F698 HydrophobicContact CG2-CD2 4.06Å; I694-F698 HydrophobicContact CG2-CE1 4.33Å; I694-F698 HydrophobicContact CG2-CE2 3.79Å; I694-F698 HydrophobicContact CG2-CG 4.44Å; I694-F698 HydrophobicContact CG2-CZ 3.94Å; I694-F698 PolarHBondContact O-N 2.99Å; Y695-F698 PolarHBondContact O-N 3.06Å; F698-R700 VanDerWaalsContact C-N 3.34Å; F698-R700 PolarHBondContact O-N 3.36Å; F698-F701 PolarHBondContact O-N 2.84Å; F698-N702 VanDerWaalsContact O-CB 3.26Å; F698-N702 WeakPolarHBondContact O-CB 3.43Å; F698-N702 PolarHBondContact O-N 2.88Å
699M91.4Very high92Very high82 Ų8248.7 Ų48.740%0.40427%0.269SS..Hα-helixtrans-59.7-44.5172.9-75.7-65.1-66.900111.9I645 Y695 N702 S703I645-M699 HydrophobicContact CD1-SD 3.92Å; I645-M699 HydrophobicContact CG1-SD 4.4Å; I645-M699 HydrophobicContact CG2-CG 4.32Å; I645-M699 HydrophobicContact CG2-SD 3.61Å; Y695-M699 HydrophobicContact CD1-CG 4.18Å; Y695-M699 HydrophobicContact CD2-CG 4.41Å; Y695-M699 HydrophobicContact CE1-CG 3.74Å; Y695-M699 HydrophobicContact CE2-CG 3.99Å; Y695-M699 HydrophobicContact CE2-SD 4.32Å; Y695-M699 WeakPolarHBondContact O-CB 3.5Å; Y695-M699 WeakPolarHBondContact O-CG 3.33Å; Y695-M699 PolarHBondContact O-N 3.48Å; M699-N702 PolarHBondContact O-N 3.38Å; M699-S703 PolarHBondContact O-N 3.36Å; M699-S703 VanDerWaalsContact O-N 3.1Å
700R91.9Very high92.3Very high99 Ų9949.9 Ų49.937%0.37426%0.261SS..Hα-helixtrans-65.2-41.9177.5-170.5-178.6178.5178-2.9111.6T251 F256 T696 L697 F698 S703T251-R700 PolarHBondContact O-NH2 2.9Å; F256-R700 HydrophobicContact CE2-CB 4.22Å; F256-R700 HydrophobicContact CE2-CG 4Å; F256-R700 HydrophobicContact CZ-CB 4.13Å; F256-R700 HydrophobicContact CZ-CG 4.37Å; T696-R700 WeakPolarHBondContact O-CB 3.24Å; T696-R700 PolarHBondContact O-N 3.44Å; L697-R700 PolarHBondContact O-N 2.9Å; F698-R700 VanDerWaalsContact C-N 3.34Å; F698-R700 PolarHBondContact O-N 3.36Å; R700-S703 PolarHBondContact O-N 2.88Å; R700-S703 PolarHBondContact O-OG 3.48Å
701F91.8Very high92.6Very high4 Ų448.2 Ų48.22%0.01825%0.251CS..Hα-helixtrans-61.9-45.3175.7-172.7-100.6000111.7F256 V328 I331 V639 I641 L697 F698 S703 I704F256-F701 HydrophobicContact CB-CD2 4.1Å; F256-F701 HydrophobicContact CB-CE2 4.29Å; F256-F701 HydrophobicContact CD1-CB 4.42Å; F256-F701 AromaticContact CD1-CD2 3.67Å; F256-F701 HydrophobicContact CD1-CD2 3.67Å; F256-F701 HydrophobicContact CD1-CE2 4.43Å; F256-F701 HydrophobicContact CD1-CG 4.47Å; F256-F701 HydrophobicContact CD2-CB 4.49Å; F256-F701 AromaticContact CD2-CD2 3.88Å; F256-F701 HydrophobicContact CD2-CD2 3.88Å; F256-F701 HydrophobicContact CE1-CB 3.89Å; F256-F701 HydrophobicContact CE1-CD2 4.03Å; F256-F701 HydrophobicContact CE1-CG 4.4Å; F256-F701 HydrophobicContact CE2-CB 4Å; F256-F701 HydrophobicContact CE2-CD2 4.23Å; F256-F701 AromaticContact CG-CD2 3.61Å; F256-F701 HydrophobicContact CG-CD2 3.61Å; F256-F701 HydrophobicContact CG-CE2 4.28Å; F256-F701 HydrophobicContact CZ-CB 3.69Å; F256-F701 HydrophobicContact CZ-CD2 4.31Å; V328-F701 HydrophobicContact CB-CE1 4.49Å; V328-F701 HydrophobicContact CB-CZ 4.34Å; V328-F701 HydrophobicContact CG1-CD2 4.43Å; V328-F701 HydrophobicContact CG1-CE1 4.42Å; V328-F701 HydrophobicContact CG1-CE2 4.07Å; V328-F701 HydrophobicContact CG1-CZ 4.04Å; V328-F701 HydrophobicContact CG2-CD1 4.4Å; V328-F701 HydrophobicContact CG2-CE1 3.98Å; V328-F701 HydrophobicContact CG2-CZ 4.33Å; I331-F701 HydrophobicContact CB-CE2 4.47Å; I331-F701 HydrophobicContact CB-CZ 3.79Å; I331-F701 HydrophobicContact CD1-CE1 3.87Å; I331-F701 HydrophobicContact CD1-CZ 3.65Å; I331-F701 HydrophobicContact CG1-CZ 4.35Å; I331-F701 HydrophobicContact CG2-CE2 4Å; I331-F701 HydrophobicContact CG2-CZ 3.58Å; V639-F701 HydrophobicContact CG1-CD1 4.32Å; V639-F701 HydrophobicContact CG1-CE1 3.6Å; V639-F701 HydrophobicContact CG1-CZ 4.39Å; I641-F701 HydrophobicContact CD1-CB 4.2Å; I641-F701 HydrophobicContact CD1-CD1 3.53Å; I641-F701 HydrophobicContact CD1-CE1 4.38Å; I641-F701 HydrophobicContact CD1-CG 4.32Å; I641-F701 HydrophobicContact CG1-CD1 4.16Å; I641-F701 HydrophobicContact CG2-CE1 4.45Å; L697-F701 WeakPolarHBondContact O-CB 3.25Å; L697-F701 PolarHBondContact O-N 3.46Å; F698-F701 PolarHBondContact O-N 2.84Å; F701-S703 PolarHBondContact O-N 3.47Å; F701-I704 HydrophobicContact CD2-CD1 3.98Å; F701-I704 HydrophobicContact CE2-CD1 4.44Å; F701-I704 WeakPolarHBondContact O-CB 3.42Å; F701-I704 WeakPolarHBondContact O-CG1 3.3Å; F701-I704 PolarHBondContact O-N 3.31Å; F701-I704 VanDerWaalsContact O-N 3.15Å
702N90.8Very high92.9Very high37 Ų3747.4 Ų47.420%0.19825%0.252CS..Hα-helixtrans-67.1-15.9177.9-167.478.5000113.5I641 I645 F698 M699 P705I641-N702 HydrophobicContact CD1-CB 4.08Å; I641-N702 HydrophobicContact CG1-CB 3.85Å; I645-N702 HydrophobicContact CD1-CB 3.5Å; F698-N702 VanDerWaalsContact O-CB 3.26Å; F698-N702 WeakPolarHBondContact O-CB 3.43Å; F698-N702 PolarHBondContact O-N 2.88Å; M699-N702 PolarHBondContact O-N 3.38Å; N702-P705 WeakPolarHBondContact O-CD 3.33Å
703S91.2Very high93.2Very high32 Ų3250.6 Ų50.622%0.22426%0.257CS..THydrogen-bonded Turntrans-83.1-14.1175.277.80000114M699 R700 F701 P705 D706 Q707M699-S703 PolarHBondContact O-N 3.36Å; M699-S703 VanDerWaalsContact O-N 3.1Å; R700-S703 PolarHBondContact O-N 2.88Å; R700-S703 PolarHBondContact O-OG 3.48Å; F701-S703 PolarHBondContact O-N 3.47Å; S703-P705 VanDerWaalsContact C-CD 3.48Å; S703-D706 PolarHBondContact O-N 3.34Å; S703-Q707 WeakPolarHBondContact O-CG 3.46Å; S703-Q707 PolarHBondContact O-N 3.32Å; S703-Q707 PolarHBondContact OG-NE2 2.88Å
704I93Very high93.3Very high4 Ų446.8 Ų46.82%0.02124%0.237CC..Hα-helixtrans-56.5-45.3-178.5-66.4172.1000112.5F249 F256 L636 F701 D706 Q707 M708F249-I704 HydrophobicContact CD2-CG2 4.24Å; F249-I704 HydrophobicContact CE2-CG2 3.79Å; F256-I704 HydrophobicContact CD2-CD1 3.92Å; F256-I704 HydrophobicContact CE2-CD1 4.42Å; L636-I704 HydrophobicContact CB-CG2 4.44Å; L636-I704 HydrophobicContact CD1-CG2 3.88Å; L636-I704 HydrophobicContact CD2-CG2 4.33Å; L636-I704 HydrophobicContact CG-CG2 4.45Å; F701-I704 HydrophobicContact CD2-CD1 3.98Å; F701-I704 HydrophobicContact CE2-CD1 4.44Å; F701-I704 WeakPolarHBondContact O-CB 3.42Å; F701-I704 WeakPolarHBondContact O-CG1 3.3Å; F701-I704 PolarHBondContact O-N 3.31Å; F701-I704 VanDerWaalsContact O-N 3.15Å; I704-D706 PolarHBondContact O-N 3.46Å; I704-Q707 PolarHBondContact O-N 2.88Å; I704-M708 WeakPolarHBondContact O-CB 3.44Å; I704-M708 PolarHBondContact O-N 2.97Å
705P92.5Very high93.5Very high16 Ų1646.6 Ų46.610%0.10424%0.236CC..Hα-helixtrans-61-43.2178.8-22.134.3000112.6L636 N702 S703 M708 N709L636-P705 WeakPolarHBondContact O-CG 2.99Å; N702-P705 WeakPolarHBondContact O-CD 3.33Å; S703-P705 VanDerWaalsContact C-CD 3.48Å; P705-M708 WeakPolarHBondContact O-CB 3.41Å; P705-M708 PolarHBondContact O-N 3.29Å; P705-N709 WeakPolarHBondContact O-CB 3.45Å; P705-N709 VanDerWaalsContact O-CG 3.3Å; P705-N709 PolarHBondContact O-N 3.49Å; P705-N709 PolarHBondContact O-ND2 2.9Å
706D92.4Very high93.6Very high110 Ų11046.2 Ų46.259%0.58824%0.239SC*.Hα-helixtrans-67.2-40.8179.5-70.8-24.7000111.5S703 I704 N709 H710S703-D706 PolarHBondContact O-N 3.34Å; I704-D706 PolarHBondContact O-N 3.46Å; D706-N709 PolarHBondContact O-N 2.85Å; D706-H710 VanDerWaalsContact O-CB 3.28Å; D706-H710 WeakPolarHBondContact O-CB 3.26Å; D706-H710 PolarHBondContact O-N 3.39Å
707Q93.9Very high93.7Very high57 Ų5747.1 Ų47.127%0.26624%0.235SC..Hα-helixtrans-63.9-41.2174.6-71.3179.1-1.600111.9G248 F249 S252 S703 I704 H710 A711G248-Q707 PolarHBondContact O-OE1 3.47Å; F249-Q707 HydrophobicContact CB-CB 4.29Å; S252-Q707 PolarHBondContact OG-NE2 3.09Å; S252-Q707 PolarHBondContact OG-OE1 3.39Å; S703-Q707 WeakPolarHBondContact O-CG 3.46Å; S703-Q707 PolarHBondContact O-N 3.32Å; S703-Q707 PolarHBondContact OG-NE2 2.88Å; I704-Q707 PolarHBondContact O-N 2.88Å; Q707-H710 PolarHBondContact O-N 2.83Å; Q707-A711 PolarHBondContact O-N 3.33Å
708M94.3Very high93.8Very high7 Ų746.3 Ų46.33%0.03423%0.231CC..Hα-helixtrans-60.7-50174.9-170.8178.566.800111F249 F630 L633 L636 I704 P705 H710 A711 V712F249-M708 HydrophobicContact CD2-CB 3.72Å; F249-M708 HydrophobicContact CD2-CG 4.27Å; F249-M708 HydrophobicContact CE2-CB 3.69Å; F249-M708 HydrophobicContact CE2-CG 3.93Å; F249-M708 HydrophobicContact CE2-SD 4.29Å; F249-M708 HydrophobicContact CZ-CG 4.4Å; F630-M708 HydrophobicContact CD1-CG 3.46Å; F630-M708 VanDerWaalsContact CD1-CG 3.46Å; F630-M708 HydrophobicContact CD1-SD 4.2Å; F630-M708 HydrophobicContact CE1-CG 3.78Å; F630-M708 HydrophobicContact CG-CG 4.45Å; L633-M708 HydrophobicContact CB-SD 4.03Å; L636-M708 HydrophobicContact CB-CE 4.35Å; L636-M708 HydrophobicContact CB-SD 4.29Å; L636-M708 HydrophobicContact CD1-SD 4.26Å; I704-M708 WeakPolarHBondContact O-CB 3.44Å; I704-M708 PolarHBondContact O-N 2.97Å; P705-M708 WeakPolarHBondContact O-CB 3.41Å; P705-M708 PolarHBondContact O-N 3.29Å; M708-H710 VanDerWaalsContact C-N 3.3Å; M708-H710 PolarHBondContact O-N 2.89Å; M708-A711 PolarHBondContact O-N 3.24Å; M708-V712 WeakPolarHBondContact O-CG2 3.47Å; M708-V712 PolarHBondContact O-N 2.98Å
709N93.9Very high93.9Very high77 Ų7748.3 Ų48.341%0.41224%0.242SC..Hα-helixtrans-60.7-40.4177-73.5-27.8000111.5P705 D706 A711 V712 I713P705-N709 WeakPolarHBondContact O-CB 3.45Å; P705-N709 VanDerWaalsContact O-CG 3.3Å; P705-N709 PolarHBondContact O-N 3.49Å; P705-N709 PolarHBondContact O-ND2 2.9Å; D706-N709 PolarHBondContact O-N 2.85Å; N709-A711 PolarHBondContact O-N 3.19Å; N709-V712 PolarHBondContact O-N 3.4Å; N709-I713 WeakPolarHBondContact O-CB 3.28Å; N709-I713 VanDerWaalsContact O-CG1 3.24Å; N709-I713 WeakPolarHBondContact O-CG1 3.38Å; N709-I713 PolarHBondContact O-N 3.47Å
710H95.3Very high94Very high104 Ų10451.9 Ų51.948%0.48126%0.257SS..Hα-helixtrans-61.3-43.7175.7-169.568.4000111.8D706 Q707 M708 I713 N714D706-H710 VanDerWaalsContact O-CB 3.28Å; D706-H710 WeakPolarHBondContact O-CB 3.26Å; D706-H710 PolarHBondContact O-N 3.39Å; Q707-H710 PolarHBondContact O-N 2.83Å; M708-H710 VanDerWaalsContact C-N 3.3Å; M708-H710 PolarHBondContact O-N 2.89Å; H710-I713 PolarHBondContact O-N 3.4Å; H710-N714 PolarHBondContact CD2-ND2 3.16Å; H710-N714 VanDerWaalsContact CD2-ND2 3.34Å; H710-N714 PolarHBondContact CE1-ND2 3.23Å; H710-N714 PolarHBondContact NE2-ND2 3.01Å; H710-N714 PolarHBondContact O-N 2.85Å; H710-N714 PolarHBondContact O-ND2 3.38Å
711A96.1Very high94Very high0 Ų049.9 Ų49.90%026%0.256CS..Hα-helixtrans-63.5-43.1175.400000112.2A245 I246 F630 Q707 M708 N709 N714 L715A245-A711 HydrophobicContact CB-CB 4.09Å; I246-A711 HydrophobicContact CG1-CB 4.41Å; F630-A711 HydrophobicContact CE1-CB 4.28Å; F630-A711 HydrophobicContact CE2-CB 4Å; F630-A711 HydrophobicContact CZ-CB 3.52Å; Q707-A711 PolarHBondContact O-N 3.33Å; M708-A711 PolarHBondContact O-N 3.24Å; N709-A711 PolarHBondContact O-N 3.19Å; A711-N714 PolarHBondContact O-N 3.12Å; A711-L715 WeakPolarHBondContact O-CB 3.47Å; A711-L715 PolarHBondContact O-N 3.04Å
712V96.2Very high94.1Very high35 Ų3549.7 Ų49.721%0.21226%0.255CS..Hα-helixtrans-61.9-43.8176.2170.40000111.7L627 F630 M708 N709 L715 N716L627-V712 HydrophobicContact CD2-CG1 4.01Å; F630-V712 HydrophobicContact CB-CG2 3.69Å; F630-V712 HydrophobicContact CD1-CG2 4.22Å; F630-V712 HydrophobicContact CD2-CG2 3.71Å; F630-V712 HydrophobicContact CE2-CG2 4.38Å; F630-V712 HydrophobicContact CG-CG2 3.61Å; M708-V712 WeakPolarHBondContact O-CG2 3.47Å; M708-V712 PolarHBondContact O-N 2.98Å; N709-V712 PolarHBondContact O-N 3.4Å; V712-L715 PolarHBondContact O-N 2.96Å; V712-N716 WeakPolarHBondContact O-CB 3.48Å; V712-N716 PolarHBondContact O-N 3.18Å; V712-N716 PolarHBondContact O-ND2 3.16Å; V712-N716 VanDerWaalsContact O-ND2 3.17Å
713I96.2Very high94.2Very high109 Ų10950 Ų5056%0.55926%0.26SS*.Hα-helixtrans-61.6-46176.8-70.8165.1000110.5N709 H710 N716 K717N709-I713 WeakPolarHBondContact O-CB 3.28Å; N709-I713 VanDerWaalsContact O-CG1 3.24Å; N709-I713 WeakPolarHBondContact O-CG1 3.38Å; N709-I713 PolarHBondContact O-N 3.47Å; H710-I713 PolarHBondContact O-N 3.4Å; I713-N716 PolarHBondContact O-N 3.3Å; I713-K717 WeakPolarHBondContact O-CB 3.28Å; I713-K717 PolarHBondContact O-N 3.05Å
714N95.5Very high94.3Very high21 Ų2153.2 Ų53.211%0.11228%0.279CS..Hα-helixtrans-64.1-41.6178.5-79.5-68.3000112.1V242 A245 H710 A711 K717 Y718V242-N714 HydrophobicContact CG2-CB 4.2Å; A245-N714 HydrophobicContact CB-CB 4.45Å; H710-N714 PolarHBondContact CD2-ND2 3.16Å; H710-N714 VanDerWaalsContact CD2-ND2 3.34Å; H710-N714 PolarHBondContact CE1-ND2 3.23Å; H710-N714 PolarHBondContact NE2-ND2 3.01Å; H710-N714 PolarHBondContact O-N 2.85Å; H710-N714 PolarHBondContact O-ND2 3.38Å; A711-N714 PolarHBondContact O-N 3.12Å; N714-K717 PolarHBondContact O-N 3.1Å; N714-Y718 VanDerWaalsContact O-CB 3.23Å; N714-Y718 WeakPolarHBondContact O-CB 3.35Å; N714-Y718 PolarHBondContact O-N 2.78Å
715L95.8Very high94.2Very high0 Ų053.6 Ų53.60%028%0.282CS..Hα-helixtrans-60.7-45.2174.2-82.7169.4000112.3V242 I246 F348 I623 C626 L627 F630 A711 V712 Y718 N719V242-L715 HydrophobicContact CG1-CD2 3.56Å; V242-L715 HydrophobicContact CG1-CG 3.88Å; I246-L715 HydrophobicContact CD1-CD2 4.47Å; F348-L715 HydrophobicContact CD2-CD2 4.13Å; F348-L715 HydrophobicContact CE2-CD2 4.28Å; I623-L715 HydrophobicContact CG1-CD2 4.22Å; I623-L715 HydrophobicContact CG2-CD2 4.36Å; C626-L715 HydrophobicContact CB-CD1 3.74Å; C626-L715 HydrophobicContact CB-CD2 4.37Å; L627-L715 HydrophobicContact CD2-CB 4.09Å; L627-L715 HydrophobicContact CD2-CD1 4.25Å; F630-L715 HydrophobicContact CD2-CD1 3.85Å; F630-L715 HydrophobicContact CE2-CD1 3.55Å; A711-L715 WeakPolarHBondContact O-CB 3.47Å; A711-L715 PolarHBondContact O-N 3.04Å; V712-L715 PolarHBondContact O-N 2.96Å; L715-Y718 PolarHBondContact O-N 2.74Å; L715-N719 WeakPolarHBondContact O-CB 3.49Å; L715-N719 PolarHBondContact O-N 3.43Å
716N95.6Very high94.2Very high65 Ų6553.4 Ų53.435%0.34828%0.28SS..Hα-helixtrans-65.1-43.7178.4-78.7-40000111.9L627 V712 I713 Y718 N719 Q720L627-N716 WeakPolarHBondContact CD1-OD1 3.43Å; V712-N716 WeakPolarHBondContact O-CB 3.48Å; V712-N716 PolarHBondContact O-N 3.18Å; V712-N716 PolarHBondContact O-ND2 3.16Å; V712-N716 VanDerWaalsContact O-ND2 3.17Å; I713-N716 PolarHBondContact O-N 3.3Å; N716-Y718 VanDerWaalsContact C-N 3.35Å; N716-N719 WeakPolarHBondContact O-CB 3.46Å; N716-N719 PolarHBondContact O-N 2.96Å; N716-Q720 WeakPolarHBondContact O-CG 3.37Å; N716-Q720 PolarHBondContact O-N 3.42Å; N716-Q720 VanDerWaalsContact O-N 3.11Å
717K94.6Very high94.1Very high108 Ų10854.1 Ų54.147%0.4728%0.28SS..Hα-helixtrans-60.3-46.3175.1-175.1-178.7178.4-172.60110.9I713 N714 N719 Q720 T721I713-K717 WeakPolarHBondContact O-CB 3.28Å; I713-K717 PolarHBondContact O-N 3.05Å; N714-K717 PolarHBondContact O-N 3.1Å; K717-N719 VanDerWaalsContact C-N 3.34Å; K717-N719 PolarHBondContact O-N 3.38Å; K717-Q720 WeakPolarHBondContact O-CB 3.45Å; K717-Q720 PolarHBondContact O-N 2.71Å; K717-T721 PolarHBondContact O-N 2.82Å; K717-T721 VanDerWaalsContact O-N 3.13Å; K717-T721 PolarHBondContact O-OG1 2.81Å
718Y94.7Very high93.9Very high6 Ų654 Ų542%0.02429%0.286CS..Hα-helixtrans-60.3-42.1176.6-174.4-88.3000111.8F233 S237 A239 V242 F348 F619 I623 N714 L715 N716 Q720 T721 L722F233-Y718 WeakPolarHBondContact CE1-OH 3.48Å; S237-Y718 VanDerWaalsContact CB-CE2 3.48Å; S237-Y718 WeakPolarHBondContact O-CD2 3.05Å; S237-Y718 VanDerWaalsContact O-CE2 3.29Å; S237-Y718 WeakPolarHBondContact O-CE2 3.46Å; S237-Y718 WeakPolarHBondContact OG-CE2 3.48Å; A239-Y718 HydrophobicContact CB-CE2 3.88Å; V242-Y718 HydrophobicContact CG2-CD2 3.82Å; V242-Y718 HydrophobicContact CG2-CG 3.89Å; F348-Y718 HydrophobicContact CE2-CD1 4.07Å; F348-Y718 AromaticContact CE2-CE1 3.87Å; F348-Y718 HydrophobicContact CE2-CE1 3.87Å; F348-Y718 HydrophobicContact CZ-CD1 4.23Å; F348-Y718 HydrophobicContact CZ-CD2 4.4Å; F348-Y718 HydrophobicContact CZ-CE1 4Å; F348-Y718 HydrophobicContact CZ-CE2 4.16Å; F348-Y718 HydrophobicContact CZ-CG 4.43Å; F348-Y718 AromaticContact CZ-CZ 3.98Å; F619-Y718 AromaticContact CD1-CE1 3.98Å; F619-Y718 HydrophobicContact CD1-CE1 3.98Å; F619-Y718 WeakPolarHBondContact CE1-OH 3.34Å; I623-Y718 HydrophobicContact CD1-CD1 3.67Å; I623-Y718 HydrophobicContact CD1-CE1 4.04Å; I623-Y718 HydrophobicContact CG1-CD1 4.39Å; N714-Y718 VanDerWaalsContact O-CB 3.23Å; N714-Y718 WeakPolarHBondContact O-CB 3.35Å; N714-Y718 PolarHBondContact O-N 2.78Å; L715-Y718 PolarHBondContact O-N 2.74Å; N716-Y718 VanDerWaalsContact C-N 3.35Å; Y718-Q720 VanDerWaalsContact C-N 3.29Å; Y718-Q720 PolarHBondContact O-N 3.42Å; Y718-T721 PolarHBondContact O-N 3.48Å; Y718-T721 PolarHBondContact O-OG1 3.26Å; Y718-L722 HydrophobicContact CE1-CD1 3.87Å; Y718-L722 WeakPolarHBondContact O-CA 3.14Å; Y718-L722 WeakPolarHBondContact O-CB 3.37Å; Y718-L722 PolarHBondContact O-N 3.42Å
719N94Very high93.8Very high42 Ų4253.7 Ų53.723%0.22528%0.284CS..Hα-helixtrans-61.2-36.4176.6-167.327000113R620 I623 L715 N716 K717R620-N719 PolarHBondContact NH1-OD1 3.4Å; I623-N719 HydrophobicContact CD1-CB 4.16Å; I623-N719 HydrophobicContact CG2-CB 4.1Å; L715-N719 WeakPolarHBondContact O-CB 3.49Å; L715-N719 PolarHBondContact O-N 3.43Å; N716-N719 WeakPolarHBondContact O-CB 3.46Å; N716-N719 PolarHBondContact O-N 2.96Å; K717-N719 VanDerWaalsContact C-N 3.34Å; K717-N719 PolarHBondContact O-N 3.38Å
720Q93.3Very high93.5Very high157 Ų15750.8 Ų50.873%0.73427%0.268SS*.Hα-helixtrans-69.9-38.6176.8-70.4173.8-6.300111.9N716 K717 Y718N716-Q720 WeakPolarHBondContact O-CG 3.37Å; N716-Q720 PolarHBondContact O-N 3.42Å; N716-Q720 VanDerWaalsContact O-N 3.11Å; K717-Q720 WeakPolarHBondContact O-CB 3.45Å; K717-Q720 PolarHBondContact O-N 2.71Å; Y718-Q720 VanDerWaalsContact C-N 3.29Å; Y718-Q720 PolarHBondContact O-N 3.42Å
721T93.4Very high93.2Very high57 Ų5749.2 Ų49.235%0.3526%0.263SS..Hα-helixtrans-90.8-6.4-177.657.10000114.1K717 Y718 S723 T724 S725K717-T721 PolarHBondContact O-N 2.82Å; K717-T721 VanDerWaalsContact O-N 3.13Å; K717-T721 PolarHBondContact O-OG1 2.81Å; Y718-T721 PolarHBondContact O-N 3.48Å; Y718-T721 PolarHBondContact O-OG1 3.26Å; T721-S723 PolarHBondContact O-N 3.45Å; T721-T724 PolarHBondContact O-N 3.5Å; T721-S725 WeakPolarHBondContact O-CB 3.48Å; T721-S725 PolarHBondContact O-N 2.75Å; T721-S725 PolarHBondContact O-OG 3.25Å
722L93.3Very high93Very high0 Ų054.4 Ų54.40%028%0.283CS..Hα-helixtrans-55.7-51.2-173.2176.861000112.2F233 F619 R620 I623 Y718 T724 S725 V726F233-L722 HydrophobicContact CZ-CD1 4.1Å; F619-L722 HydrophobicContact CB-CD1 4.01Å; F619-L722 HydrophobicContact CB-CD2 3.7Å; F619-L722 HydrophobicContact CG-CD1 4.22Å; R620-L722 HydrophobicContact CG-CD2 3.78Å; I623-L722 HydrophobicContact CD1-CD2 4.24Å; Y718-L722 HydrophobicContact CE1-CD1 3.87Å; Y718-L722 WeakPolarHBondContact O-CA 3.14Å; Y718-L722 WeakPolarHBondContact O-CB 3.37Å; Y718-L722 PolarHBondContact O-N 3.42Å; L722-T724 PolarHBondContact O-N 2.9Å; L722-S725 WeakPolarHBondContact O-CB 3.36Å; L722-S725 PolarHBondContact O-N 3.45Å; L722-S725 VanDerWaalsContact O-N 3.09Å; L722-V726 HydrophobicContact CD1-CG2 3.97Å; L722-V726 HydrophobicContact CG-CG2 4.37Å; L722-V726 WeakPolarHBondContact O-CG2 3.1Å; L722-V726 PolarHBondContact O-N 2.89Å
723S92.8Very high92.7Very high43 Ų4352.9 Ų52.930%0.30127%0.274SS..Hα-helixtrans-60.4-45.6-175.8-172.60000112E616 T721 S725 V726 Q727E616-S723 VanDerWaalsContact OE1-CA 3.28Å; E616-S723 WeakPolarHBondContact OE1-CA 3.2Å; E616-S723 WeakPolarHBondContact OE1-CB 3.34Å; E616-S723 PolarHBondContact OE1-OG 3.17Å; T721-S723 PolarHBondContact O-N 3.45Å; S723-S725 VanDerWaalsContact C-N 3.31Å; S723-S725 PolarHBondContact O-N 3.23Å; S723-V726 PolarHBondContact O-N 2.94Å; S723-Q727 PolarHBondContact O-N 2.86Å
724T93.1Very high92.4Very high100 Ų10048.4 Ų48.461%0.61325%0.252SS*.Hα-helixtrans-62.5-39.1175.6-47.20000112T721 L722 S728T721-T724 PolarHBondContact O-N 3.5Å; L722-T724 PolarHBondContact O-N 2.9Å; T724-S728 VanDerWaalsContact O-CB 3.28Å; T724-S728 WeakPolarHBondContact O-CB 3.41Å; T724-S728 PolarHBondContact O-N 2.87Å
725S91.8Very high92Very high12 Ų1252.8 Ų52.88%0.08428%0.275CS..Hα-helixtrans-68.9-41.8-180-54.50000111.8T721 L722 S723 S729T721-S725 WeakPolarHBondContact O-CB 3.48Å; T721-S725 PolarHBondContact O-N 2.75Å; T721-S725 PolarHBondContact O-OG 3.25Å; L722-S725 WeakPolarHBondContact O-CB 3.36Å; L722-S725 PolarHBondContact O-N 3.45Å; L722-S725 VanDerWaalsContact O-N 3.09Å; S723-S725 VanDerWaalsContact C-N 3.31Å; S723-S725 PolarHBondContact O-N 3.23Å; S725-S729 VanDerWaalsContact O-CB 3.26Å; S725-S729 WeakPolarHBondContact O-CB 3.38Å; S725-S729 PolarHBondContact O-N 3.24Å; S725-S729 PolarHBondContact O-OG 3.21Å
726V91.2Very high91.8Very high12 Ų1257.2 Ų57.27%0.07330%0.295CS..Hα-helixtrans-58.4-53173.3168.50000109.8F233 L615 E616 L722 S723 S728 S729 M730F233-V726 HydrophobicContact CE2-CB 4.43Å; F233-V726 HydrophobicContact CE2-CG2 3.67Å; F233-V726 HydrophobicContact CZ-CG2 4.21Å; L615-V726 HydrophobicContact CB-CG1 3.96Å; L615-V726 HydrophobicContact CB-CG2 4.15Å; L615-V726 HydrophobicContact CD1-CG1 4.36Å; E616-V726 HydrophobicContact CG-CB 4.48Å; E616-V726 HydrophobicContact CG-CG2 4.13Å; L722-V726 HydrophobicContact CD1-CG2 3.97Å; L722-V726 HydrophobicContact CG-CG2 4.37Å; L722-V726 WeakPolarHBondContact O-CG2 3.1Å; L722-V726 PolarHBondContact O-N 2.89Å; S723-V726 PolarHBondContact O-N 2.94Å; V726-S728 PolarHBondContact O-N 3.11Å; V726-S729 PolarHBondContact O-N 3.33Å; V726-M730 WeakPolarHBondContact O-CB 3.25Å; V726-M730 PolarHBondContact O-N 2.87Å
727Q90.2Very high91.5Very high125 Ų12554.9 Ų54.958%0.58428%0.282SS*.Hα-helixtrans-64.4-41.3-176.9-169.8165.19.500112.6S723 N731S723-Q727 PolarHBondContact O-N 2.86Å; Q727-N731 WeakPolarHBondContact O-CB 3.21Å; Q727-N731 VanDerWaalsContact O-CG 3.31Å; Q727-N731 PolarHBondContact O-N 3.04Å; Q727-N731 PolarHBondContact O-ND2 3.49Å
728S91.2Very high91.1Very high55 Ų5554.1 Ų54.139%0.38528%0.276SS..Hα-helixtrans-64.3-46.4177.4-170.70000112T724 V726 M730 N731 R732T724-S728 VanDerWaalsContact O-CB 3.28Å; T724-S728 WeakPolarHBondContact O-CB 3.41Å; T724-S728 PolarHBondContact O-N 2.87Å; V726-S728 PolarHBondContact O-N 3.11Å; S728-M730 VanDerWaalsContact C-N 3.34Å; S728-M730 PolarHBondContact O-N 3.32Å; S728-N731 PolarHBondContact O-N 3.43Å; S728-R732 WeakPolarHBondContact O-CB 3.36Å; S728-R732 PolarHBondContact O-N 3.22Å
729S90.7Very high90.7Very high0 Ų057.6 Ų57.60%030%0.3CS..Hα-helixtrans-66.2-39.7179.9-52.90000111.1F229 F233 S725 V726 R732 G733F229-S729 WeakPolarHBondContact CE2-O 3.25Å; F233-S729 WeakPolarHBondContact CA-OG 3.28Å; S725-S729 VanDerWaalsContact O-CB 3.26Å; S725-S729 WeakPolarHBondContact O-CB 3.38Å; S725-S729 PolarHBondContact O-N 3.24Å; S725-S729 PolarHBondContact O-OG 3.21Å; V726-S729 PolarHBondContact O-N 3.33Å; S729-R732 PolarHBondContact O-N 2.85Å; S729-G733 PolarHBondContact O-N 2.9Å
730M88.8Confident90.3Very high16 Ų1660 Ų608%0.07931%0.312CS..Hα-helixtrans-64.9-46.1178.9179168.8-99.700111.5F610 K611 I613 L615 V726 S728 R732 G733 V734F610-M730 HydrophobicContact CD1-CE 4.02Å; F610-M730 HydrophobicContact CD1-CG 3.76Å; F610-M730 HydrophobicContact CE1-CB 4.24Å; F610-M730 HydrophobicContact CE1-CE 4.19Å; F610-M730 HydrophobicContact CE1-CG 3.61Å; F610-M730 WeakPolarHBondContact O-CE 3.18Å; K611-M730 HydrophobicContact CB-SD 4.31Å; K611-M730 HydrophobicContact CG-CG 4.44Å; K611-M730 HydrophobicContact CG-SD 4.15Å; I613-M730 HydrophobicContact CB-CE 4.47Å; L615-M730 HydrophobicContact CD1-CE 4.49Å; V726-M730 WeakPolarHBondContact O-CB 3.25Å; V726-M730 PolarHBondContact O-N 2.87Å; S728-M730 VanDerWaalsContact C-N 3.34Å; S728-M730 PolarHBondContact O-N 3.32Å; M730-R732 VanDerWaalsContact C-N 3.34Å; M730-R732 PolarHBondContact O-N 2.83Å; M730-G733 PolarHBondContact O-N 2.9Å; M730-V734 WeakPolarHBondContact O-CG2 3.48Å; M730-V734 PolarHBondContact O-N 3.17Å
731N89.5Confident89.8Confident70 Ų7052.9 Ų52.937%0.37428%0.279SS..Hα-helixtrans-62.4-41.3174.8-74.1-27.7000111.9Q727 S728 N735Q727-N731 WeakPolarHBondContact O-CB 3.21Å; Q727-N731 VanDerWaalsContact O-CG 3.31Å; Q727-N731 PolarHBondContact O-N 3.04Å; Q727-N731 PolarHBondContact O-ND2 3.49Å; S728-N731 PolarHBondContact O-N 3.43Å; N731-N735 WeakPolarHBondContact O-CB 3.05Å; N731-N735 PolarHBondContact O-N 3.02Å; N731-N735 PolarHBondContact O-ND2 3.3Å
732R90.5Very high89.3Confident110 Ų11052 Ų5242%0.41527%0.273SS..Hα-helixtrans-63.4-44.7175.8-179.4175.9-78-173.7-2.5111.7D232 S728 S729 M730 N735 K736D232-R732 IonicContact OD1-NH1 3.82Å; D232-R732 WeakPolarHBondContact OD2-CD 3.38Å; S728-R732 WeakPolarHBondContact O-CB 3.36Å; S728-R732 PolarHBondContact O-N 3.22Å; S729-R732 PolarHBondContact O-N 2.85Å; M730-R732 VanDerWaalsContact C-N 3.34Å; M730-R732 PolarHBondContact O-N 2.83Å; R732-N735 PolarHBondContact O-N 2.9Å; R732-K736 HydrophobicContact CG-CD 4.43Å; R732-K736 PolarHBondContact O-N 3.41Å
733G90.2Very high88.6Confident3 Ų358 Ų583%0.03130%0.3CS..Hα-helixtrans-59.9-49.8177.100000112S729 M730 N735 K736 L737S729-G733 PolarHBondContact O-N 2.9Å; M730-G733 PolarHBondContact O-N 2.9Å; G733-N735 PolarHBondContact O-N 3Å; G733-K736 PolarHBondContact O-N 2.86Å; G733-L737 WeakPolarHBondContact O-CB 2.96Å; G733-L737 PolarHBondContact O-N 3.16Å
734V89.3Confident88Confident14 Ų1457.1 Ų57.19%0.08529%0.291CS..Hα-helixtrans-56.9-48.5175.2167.90000111.1I607 F610 M730 K736 L737 R738I607-V734 HydrophobicContact CD1-CG1 4.02Å; I607-V734 HydrophobicContact CG1-CG1 3.9Å; I607-V734 HydrophobicContact CG2-CG1 3.95Å; I607-V734 HydrophobicContact CG2-CG2 4.36Å; F610-V734 HydrophobicContact CD1-CG2 3.45Å; F610-V734 VanDerWaalsContact CD1-CG2 3.45Å; F610-V734 HydrophobicContact CE1-CG2 3.88Å; F610-V734 HydrophobicContact CG-CG2 4.38Å; M730-V734 WeakPolarHBondContact O-CG2 3.48Å; M730-V734 PolarHBondContact O-N 3.17Å; V734-K736 VanDerWaalsContact C-N 3.3Å; V734-K736 PolarHBondContact O-N 3.44Å; V734-L737 PolarHBondContact O-N 2.95Å; V734-R738 VanDerWaalsContact O-CB 3.25Å; V734-R738 WeakPolarHBondContact O-CB 3.45Å; V734-R738 PolarHBondContact O-N 3.28Å
735N89Confident87.3Confident113 Ų11352.4 Ų52.460%0.60426%0.261SS*.Hα-helixtrans-65.1-32.4-177.8-72.5-18.6000113.1N731 R732 G733 P739N731-N735 WeakPolarHBondContact O-CB 3.05Å; N731-N735 PolarHBondContact O-N 3.02Å; N731-N735 PolarHBondContact O-ND2 3.3Å; R732-N735 PolarHBondContact O-N 2.9Å; G733-N735 PolarHBondContact O-N 3Å; N735-P739 VanDerWaalsContact O-CD 3.23Å; N735-P739 WeakPolarHBondContact O-CD 3.22Å
736K90.5Very high86.5Confident94 Ų9454.3 Ų54.341%0.40927%0.269SS..Hα-helixtrans-73.3-44174.2-79.3-179.9170.71800112.3S228 D232 R732 G733 V734 P739S228-K736 PolarHBondContact OG-NZ 3.06Å; D232-K736 IonicContact OD1-NZ 3.75Å; D232-K736 IonicContact OD2-NZ 3.71Å; D232-K736 PolarHBondContact OD2-NZ 3.44Å; R732-K736 HydrophobicContact CG-CD 4.43Å; R732-K736 PolarHBondContact O-N 3.41Å; G733-K736 PolarHBondContact O-N 2.86Å; V734-K736 VanDerWaalsContact C-N 3.3Å; V734-K736 PolarHBondContact O-N 3.44Å; K736-P739 WeakPolarHBondContact O-CD 3.43Å
737L88.8Confident85.7Confident16 Ų1657 Ų578%0.08428%0.283CS..Hα-helixtrans-72.3-38.6-177.1-83.6171.9000112.8I221 I222 G733 V734 L740 L741I221-L737 HydrophobicContact CG2-CD2 4.08Å; I222-L737 HydrophobicContact CD1-CD2 4.47Å; G733-L737 WeakPolarHBondContact O-CB 2.96Å; G733-L737 PolarHBondContact O-N 3.16Å; V734-L737 PolarHBondContact O-N 2.95Å; L737-L740 PolarHBondContact O-N 3.21Å; L737-L740 VanDerWaalsContact O-N 3.09Å; L737-L741 HydrophobicContact CB-CD1 4.22Å; L737-L741 WeakPolarHBondContact O-CG 3.48Å; L737-L741 PolarHBondContact O-N 2.89Å
738R87.8Confident85Confident91 Ų9151 Ų5134%0.34326%0.255SS..Hα-helixtrans-47.7-57.2-173.9-165.4179-157.5-164.40.1113.9D600 L603 I607 V734 L740 L741 T742D600-R738 IonicContact OD1-NH2 3.94Å; D600-R738 PolarHBondContact OD1-NH2 2.91Å; D600-R738 VanDerWaalsContact OD1-NH2 3.12Å; L603-R738 HydrophobicContact CD1-CG 4.35Å; L603-R738 HydrophobicContact CD2-CG 3.59Å; L603-R738 HydrophobicContact CG-CG 4.17Å; I607-R738 HydrophobicContact CD1-CG 4.28Å; V734-R738 VanDerWaalsContact O-CB 3.25Å; V734-R738 WeakPolarHBondContact O-CB 3.45Å; V734-R738 PolarHBondContact O-N 3.28Å; R738-L740 VanDerWaalsContact C-N 3.32Å; R738-L740 PolarHBondContact O-N 2.96Å; R738-L741 PolarHBondContact O-N 3.33Å; R738-T742 PolarHBondContact O-N 3.38Å; R738-T742 PolarHBondContact O-OG1 3.4Å
739P85.2Confident84.1Confident80 Ų8048.7 Ų48.752%0.51924%0.238SC..Hα-helixtrans-65.6-33.1-178.326.5-35.7000113.4N735 K736 K743N735-P739 VanDerWaalsContact O-CD 3.23Å; N735-P739 WeakPolarHBondContact O-CD 3.22Å; K736-P739 WeakPolarHBondContact O-CD 3.43Å; P739-K743 PolarHBondContact O-N 3.38Å
740L85Confident83.1Confident92 Ų9250.8 Ų50.848%0.48225%0.249SC..Hα-helixtrans-68-45.1178.8-62.2176.6000111I221 L737 R738 K743 E744I221-L740 HydrophobicContact CD1-CB 4.38Å; I221-L740 HydrophobicContact CG2-CB 3.74Å; I221-L740 HydrophobicContact CG2-CD1 4.27Å; L737-L740 PolarHBondContact O-N 3.21Å; L737-L740 VanDerWaalsContact O-N 3.09Å; R738-L740 VanDerWaalsContact C-N 3.32Å; R738-L740 PolarHBondContact O-N 2.96Å; L740-K743 PolarHBondContact O-N 3.12Å; L740-E744 PolarHBondContact O-N 3.22Å
741L84.6Confident82.2Confident7 Ų751 Ų514%0.03725%0.253CS..Hα-helixtrans-66.9-42.8177-63.2176.7000111.6F218 I221 I222 L603 L737 R738 K743 E744 L745F218-L741 HydrophobicContact CD2-CD2 3.9Å; F218-L741 HydrophobicContact CE2-CD2 3.65Å; F218-L741 HydrophobicContact CZ-CD2 4.37Å; I221-L741 HydrophobicContact CG2-CD2 3.85Å; I221-L741 HydrophobicContact CG2-CG 4.49Å; I222-L741 HydrophobicContact CD1-CD1 3.86Å; I222-L741 HydrophobicContact CD1-CD2 3.64Å; I222-L741 HydrophobicContact CD1-CG 4.33Å; I222-L741 HydrophobicContact CG1-CD2 4.05Å; L603-L741 HydrophobicContact CD1-CB 3.97Å; L603-L741 HydrophobicContact CD1-CD1 4.13Å; L737-L741 HydrophobicContact CB-CD1 4.22Å; L737-L741 WeakPolarHBondContact O-CG 3.48Å; L737-L741 PolarHBondContact O-N 2.89Å; R738-L741 PolarHBondContact O-N 3.33Å; L741-K743 VanDerWaalsContact C-N 3.26Å; L741-K743 PolarHBondContact O-N 3.3Å; L741-E744 PolarHBondContact O-N 3.28Å; L741-L745 WeakPolarHBondContact O-CB 3.42Å; L741-L745 WeakPolarHBondContact O-CG 3.19Å; L741-L745 PolarHBondContact O-N 2.88Å
742T81.5Confident81.3Confident38 Ų3848.3 Ų48.323%0.23324%0.239CC..Hα-helixtrans-54-46.3175.3-59.70000111I599 L603 R738 Q746I599-T742 HydrophobicContact CG2-CG2 4.39Å; L603-T742 VanDerWaalsContact CD2-OG1 3.29Å; L603-T742 WeakPolarHBondContact CD2-OG1 3.37Å; R738-T742 PolarHBondContact O-N 3.38Å; R738-T742 PolarHBondContact O-OG1 3.4Å; T742-Q746 WeakPolarHBondContact O-CB 3.18Å; T742-Q746 VanDerWaalsContact O-CG 3.24Å; T742-Q746 WeakPolarHBondContact O-CG 3.34Å; T742-Q746 PolarHBondContact O-N 3.36Å
743K79.6Confident80.4Confident128 Ų12843.6 Ų43.656%0.55722%0.222SC*.Hα-helixtrans-63.6-46.1-179.3-174.7-177.9176.9-175.70112.9P739 L740 L741 Q746 L747P739-K743 PolarHBondContact O-N 3.38Å; L740-K743 PolarHBondContact O-N 3.12Å; L741-K743 VanDerWaalsContact C-N 3.26Å; L741-K743 PolarHBondContact O-N 3.3Å; K743-Q746 WeakPolarHBondContact O-CB 3.25Å; K743-Q746 PolarHBondContact O-N 2.88Å; K743-L747 WeakPolarHBondContact O-CG 3.39Å; K743-L747 PolarHBondContact O-N 2.98Å; K743-L747 VanDerWaalsContact O-N 3.1Å
744E80.3Confident79.7Confident24 Ų2447.9 Ų47.911%0.11224%0.241CC..Hα-helixtrans-69.8-37.9179.7-71.9-53.7133.800112.6I221 L740 L741 Q746 L747 A748I221-E744 HydrophobicContact CD1-CB 4.33Å; I221-E744 HydrophobicContact CD1-CG 3.21Å; L740-E744 PolarHBondContact O-N 3.22Å; L741-E744 PolarHBondContact O-N 3.28Å; E744-Q746 PolarHBondContact O-N 2.91Å; E744-L747 PolarHBondContact O-N 3.33Å; E744-A748 PolarHBondContact O-N 3.12Å
745L78.5Confident79Confident0 Ų051.7 Ų51.70%026%0.261CS..Hα-helixtrans-62.2-35.8173-67.2172.4000110.8F218 L374 I599 I602 L741 A748 V749F218-L745 HydrophobicContact CD2-CD2 4.25Å; F218-L745 HydrophobicContact CE2-CD2 4.05Å; F218-L745 HydrophobicContact CE2-CG 4.37Å; L374-L745 HydrophobicContact CD2-CD2 3.48Å; L374-L745 VanDerWaalsContact CD2-CD2 3.48Å; I599-L745 VanDerWaalsContact CD1-C 3.46Å; I599-L745 HydrophobicContact CD1-CB 3.66Å; I599-L745 HydrophobicContact CG1-CB 3.99Å; I599-L745 HydrophobicContact CG2-CB 4.01Å; I599-L745 HydrophobicContact CG2-CD1 3.86Å; I602-L745 HydrophobicContact CG2-CD1 4.36Å; L741-L745 WeakPolarHBondContact O-CB 3.42Å; L741-L745 WeakPolarHBondContact O-CG 3.19Å; L741-L745 PolarHBondContact O-N 2.88Å; L745-A748 PolarHBondContact O-N 3.12Å; L745-V749 PolarHBondContact O-N 3.01Å
746Q75.1Confident78.6Confident52 Ų5246.3 Ų46.324%0.24323%0.232CC..Hα-helixtrans-62.7-47174.7-77.4178-21.600112.4L595 I599 T742 K743 E744 A748 V749 I750L595-Q746 HydrophobicContact CD2-CB 4.06Å; L595-Q746 HydrophobicContact CD2-CG 3.88Å; L595-Q746 HydrophobicContact CG-CG 4.41Å; I599-Q746 HydrophobicContact CD1-CB 4.16Å; I599-Q746 HydrophobicContact CD1-CG 3.48Å; I599-Q746 VanDerWaalsContact CD1-CG 3.48Å; T742-Q746 WeakPolarHBondContact O-CB 3.18Å; T742-Q746 VanDerWaalsContact O-CG 3.24Å; T742-Q746 WeakPolarHBondContact O-CG 3.34Å; T742-Q746 PolarHBondContact O-N 3.36Å; K743-Q746 WeakPolarHBondContact O-CB 3.25Å; K743-Q746 PolarHBondContact O-N 2.88Å; E744-Q746 PolarHBondContact O-N 2.91Å; Q746-A748 VanDerWaalsContact C-N 3.31Å; Q746-A748 PolarHBondContact O-N 3.04Å; Q746-V749 PolarHBondContact O-N 2.97Å; Q746-I750 WeakPolarHBondContact O-CG1 3.32Å; Q746-I750 PolarHBondContact O-N 2.84Å
747L74.4Confident78.3Confident69 Ų6945 Ų4536%0.36123%0.233SC..Hα-helixtrans-64.5-35.5177.3-69.1172.4000112.5K743 E744 I750 A751K743-L747 WeakPolarHBondContact O-CG 3.39Å; K743-L747 PolarHBondContact O-N 2.98Å; K743-L747 VanDerWaalsContact O-N 3.1Å; E744-L747 PolarHBondContact O-N 3.33Å; L747-I750 PolarHBondContact O-N 2.75Å; L747-A751 WeakPolarHBondContact O-CB 3.33Å; L747-A751 PolarHBondContact O-N 3.32Å
748A74.7Confident78.3Confident0 Ų044.4 Ų44.40%023%0.23CC..Hα-helixtrans-62.7-44.4176.200000111.5Q214 W371 L374 E744 L745 Q746 A751 T752Q214-A748 HydrophobicContact CB-CB 4.33Å; W371-A748 HydrophobicContact CH2-CB 4.11Å; L374-A748 HydrophobicContact CD2-CB 3.66Å; E744-A748 PolarHBondContact O-N 3.12Å; L745-A748 PolarHBondContact O-N 3.12Å; Q746-A748 VanDerWaalsContact C-N 3.31Å; Q746-A748 PolarHBondContact O-N 3.04Å; A748-A751 WeakPolarHBondContact O-CB 3.49Å; A748-A751 PolarHBondContact O-N 2.75Å; A748-T752 WeakPolarHBondContact O-CG2 3.42Å; A748-T752 PolarHBondContact O-N 3.18Å; A748-T752 VanDerWaalsContact O-N 3.1Å
749V71.9Confident78.5Confident6 Ų645.5 Ų45.54%0.03624%0.239CC..Hα-helixtrans-70.4-38.4177174.90000112.7L374 L384 L595 L745 Q746 A751 T752 W753L374-V749 HydrophobicContact CD1-CG2 3.72Å; L374-V749 HydrophobicContact CG-CG2 4.43Å; L384-V749 HydrophobicContact CD1-CG1 3.85Å; L384-V749 HydrophobicContact CD2-CG1 3.28Å; L384-V749 HydrophobicContact CG-CG1 4.19Å; L595-V749 HydrophobicContact CD1-CB 3.66Å; L595-V749 HydrophobicContact CD1-CG1 3.67Å; L595-V749 HydrophobicContact CD1-CG2 3.5Å; L595-V749 VanDerWaalsContact CD1-CG2 3.5Å; L595-V749 HydrophobicContact CD2-CB 3.67Å; L595-V749 HydrophobicContact CD2-CG1 4Å; L595-V749 HydrophobicContact CD2-CG2 4.25Å; L595-V749 HydrophobicContact CG-CB 4.35Å; L595-V749 HydrophobicContact CG-CG1 4.48Å; L745-V749 PolarHBondContact O-N 3.01Å; Q746-V749 PolarHBondContact O-N 2.97Å; V749-A751 PolarHBondContact O-N 3.48Å; V749-T752 PolarHBondContact O-N 3.17Å; V749-T752 PolarHBondContact O-OG1 2.94Å; V749-W753 PolarHBondContact O-N 2.89Å
750I69.4Low78.8Confident43 Ų4345.2 Ų45.222%0.22124%0.239CC..Hα-helixtrans-54.5-43.1171.7-72.9168.2000110.5V582 V591 Q746 L747 T752 W753 H754V582-I750 HydrophobicContact CG1-CB 4.43Å; V582-I750 HydrophobicContact CG1-CG1 4.4Å; V582-I750 HydrophobicContact CG1-CG2 3.82Å; V591-I750 HydrophobicContact CB-CD1 4.46Å; V591-I750 HydrophobicContact CB-CG1 4.36Å; V591-I750 HydrophobicContact CG1-CD1 4.43Å; V591-I750 HydrophobicContact CG1-CG1 3.94Å; V591-I750 HydrophobicContact CG2-CD1 4.33Å; V591-I750 HydrophobicContact CG2-CG1 4.08Å; Q746-I750 WeakPolarHBondContact O-CG1 3.32Å; Q746-I750 PolarHBondContact O-N 2.84Å; L747-I750 PolarHBondContact O-N 2.75Å; I750-T752 VanDerWaalsContact C-N 3.33Å; I750-T752 PolarHBondContact O-N 3.26Å; I750-W753 PolarHBondContact O-N 2.84Å; I750-H754 PolarHBondContact O-N 3.22Å
751A71.4Confident79.1Confident20 Ų2041 Ų4117%0.16522%0.217CC..Hα-helixtrans-64.4-34.5176.200000112.7L211 L747 A748 V749 W753 H754L211-A751 HydrophobicContact CD2-CB 3.75Å; L747-A751 WeakPolarHBondContact O-CB 3.33Å; L747-A751 PolarHBondContact O-N 3.32Å; A748-A751 WeakPolarHBondContact O-CB 3.49Å; A748-A751 PolarHBondContact O-N 2.75Å; V749-A751 PolarHBondContact O-N 3.48Å; A751-W753 PolarHBondContact O-N 3.36Å; A751-H754 VanDerWaalsContact O-CB 3.27Å; A751-H754 WeakPolarHBondContact O-CB 3.49Å; A751-H754 PolarHBondContact O-N 3.47Å
752T70.5Confident79.5Confident15 Ų1542.9 Ų42.99%0.09222%0.223CC..Hα-helixtrans-64.8-22.3176.963.60000114.4T206 T209 L211 A748 V749 I750T206-T752 WeakPolarHBondContact CG2-O 3.43Å; T209-T752 WeakPolarHBondContact OG1-CA 3.42Å; L211-T752 HydrophobicContact CD1-CG2 3.88Å; L211-T752 HydrophobicContact CD2-CG2 4.38Å; A748-T752 WeakPolarHBondContact O-CG2 3.42Å; A748-T752 PolarHBondContact O-N 3.18Å; A748-T752 VanDerWaalsContact O-N 3.1Å; V749-T752 PolarHBondContact O-N 3.17Å; V749-T752 PolarHBondContact O-OG1 2.94Å; I750-T752 VanDerWaalsContact C-N 3.33Å; I750-T752 PolarHBondContact O-N 3.26Å
753W71.7Confident80.2Confident11 Ų1145.6 Ų45.64%0.04224%0.236CC..THydrogen-bonded Turntrans-107.29.3-179.4-72.5-2.4000113L384 F388 V582 V594 V749 I750 A751 D755 I756L384-W753 HydrophobicContact CB-CZ2 4.4Å; L384-W753 HydrophobicContact CD1-CH2 4.11Å; L384-W753 HydrophobicContact CD1-CZ2 4.16Å; L384-W753 HydrophobicContact CD2-CD2 4.3Å; L384-W753 VanDerWaalsContact CD2-CE2 3.42Å; L384-W753 HydrophobicContact CD2-CH2 4.09Å; L384-W753 HydrophobicContact CD2-CZ2 3.36Å; L384-W753 HydrophobicContact CG-CH2 3.76Å; L384-W753 HydrophobicContact CG-CZ2 3.32Å; F388-W753 HydrophobicContact CB-CH2 3.83Å; F388-W753 HydrophobicContact CB-CZ2 4.11Å; F388-W753 HydrophobicContact CD2-CH2 4.02Å; F388-W753 HydrophobicContact CD2-CZ3 4.21Å; F388-W753 HydrophobicContact CG-CH2 4.06Å; F388-W753 HydrophobicContact CG-CZ2 4.39Å; V582-W753 HydrophobicContact CG2-CB 3.45Å; V582-W753 VanDerWaalsContact CG2-CB 3.45Å; V582-W753 HydrophobicContact CG2-CE3 4.05Å; V582-W753 HydrophobicContact CG2-CG 4.43Å; V594-W753 HydrophobicContact CG1-CH2 3.85Å; V594-W753 HydrophobicContact CG1-CZ3 4.19Å; V749-W753 PolarHBondContact O-N 2.89Å; I750-W753 PolarHBondContact O-N 2.84Å; A751-W753 PolarHBondContact O-N 3.36Å; W753-D755 PolarHBondContact O-N 3.41Å; W753-I756 HydrophobicContact CB-CD1 3.83Å; W753-I756 HydrophobicContact CB-CG1 4.44Å; W753-I756 HydrophobicContact CD2-CD1 4.33Å; W753-I756 HydrophobicContact CG-CD1 3.79Å; W753-I756 PolarHBondContact O-N 2.81Å
754H73.7Confident80.9Confident92 Ų9239.5 Ų39.543%0.42621%0.21SC..THydrogen-bonded Turntrans-60.2-32.5-178.8-175.564.7000112.5P580 E583 I750 A751 I756P580-H754 WeakPolarHBondContact CB-O 3.49Å; P580-H754 WeakPolarHBondContact CG-O 3.3Å; E583-H754 IonicContact OE2-CE1 2.82Å; I750-H754 PolarHBondContact O-N 3.22Å; A751-H754 VanDerWaalsContact O-CB 3.27Å; A751-H754 WeakPolarHBondContact O-CB 3.49Å; A751-H754 PolarHBondContact O-N 3.47Å; H754-I756 PolarHBondContact O-N 2.89Å
755D75.7Confident81.4Confident95 Ų9539.3 Ų39.351%0.50821%0.212SC..THydrogen-bonded Turntrans-90.76.2-174.9-58.4-42.2000114W753 P757W753-D755 PolarHBondContact O-N 3.41Å; D755-P757 WeakPolarHBondContact O-CD 3.44Å
756I80.2Confident82.2Confident0 Ų042.2 Ų42.20%022%0.224CC..  trans-75.3110.3178.8-59.1177.2000109.1M199 M202 A203 F581 W753 H754M199-I756 HydrophobicContact CB-CG2 4.2Å; M199-I756 HydrophobicContact CE-CG2 4.11Å; M199-I756 HydrophobicContact CG-CG2 4.05Å; M202-I756 HydrophobicContact CG-CG1 4.49Å; A203-I756 HydrophobicContact CB-CD1 3.85Å; F581-I756 HydrophobicContact CB-CB 4.4Å; F581-I756 HydrophobicContact CB-CG2 4.17Å; F581-I756 PolarHBondContact N-O 3.13Å; W753-I756 HydrophobicContact CB-CD1 3.83Å; W753-I756 HydrophobicContact CB-CG1 4.44Å; W753-I756 HydrophobicContact CD2-CD1 4.33Å; W753-I756 HydrophobicContact CG-CD1 3.79Å; W753-I756 PolarHBondContact O-N 2.81Å; H754-I756 PolarHBondContact O-N 2.89Å
757P83.9Confident83.1Confident67 Ų6743 Ų4344%0.43523%0.225SC..  trans-72.6146.8179.132.8-33.5000109.8M202 D755M202-P757 HydrophobicContact CE-CG 4.03Å; M202-P757 WeakPolarHBondContact SD-CD 3.45Å; M202-P757 HydrophobicContact SD-CG 4.09Å; D755-P757 WeakPolarHBondContact O-CD 3.44Å
758C88.7Confident83.9Confident2 Ų240.6 Ų40.61%0.01422%0.218CC..  trans-123.814.4171.8590000113.7M199 C576 E579 F581 S760 L761 R762M199-C758 HydrophobicContact CE-CB 4.41Å; C576-C758 WeakPolarHBondContact CA-SG 2.82Å; C576-C758 HydrophobicContact CB-CB 3.83Å; C576-C758 WeakPolarHBondContact CB-SG 3.13Å; C576-C758 WeakPolarHBondContact SG-CB 3.08Å; C576-C758 CovalentContact SG-SG 2.03Å; C576-C758 PolarHBondContact SG-SG 3.36Å; E579-C758 PolarHBondContact O-SG 3.48Å; E579-C758 VanDerWaalsContact O-SG 3.36Å; F581-C758 VanDerWaalsContact CA-SG 3.54Å; F581-C758 HydrophobicContact CB-CB 3.93Å; F581-C758 HydrophobicContact CD2-CB 3.99Å; F581-C758 HydrophobicContact CG-CB 4.46Å; C758-S760 PolarHBondContact O-N 2.84Å; C758-L761 HydrophobicContact CB-CB 4.45Å; C758-L761 WeakPolarHBondContact O-CB 2.96Å; C758-L761 PolarHBondContact O-N 3.29Å; C758-R762 PolarHBondContact O-N 3.47Å
759Q91.9Very high84.8Confident114 Ų11441.5 Ų41.553%0.53322%0.223SC..Hα-helixtrans-62.7-41.9178.3-168.9178.11700112.3C576 L761 R762 L763C576-Q759 WeakPolarHBondContact O-CA 3.24Å; C576-Q759 PolarHBondContact O-N 3.47Å; Q759-L761 VanDerWaalsContact C-N 3.29Å; Q759-L761 PolarHBondContact O-N 3.21Å; Q759-R762 WeakPolarHBondContact O-CB 3.47Å; Q759-R762 PolarHBondContact O-N 2.91Å; Q759-L763 WeakPolarHBondContact O-CG 2.84Å; Q759-L763 PolarHBondContact O-N 3.26Å
760S92.8Very high85.8Confident74 Ų7443 Ų4352%0.51723%0.231SC..Hα-helixtrans-61.1-39.7175.6-53.60000111.7C758 L763 A764C758-S760 PolarHBondContact O-N 2.84Å; S760-L763 PolarHBondContact O-N 3.2Å; S760-A764 WeakPolarHBondContact O-CB 3.27Å; S760-A764 PolarHBondContact O-N 3.07Å
761L91.1Very high86.9Confident3 Ų341.2 Ų41.22%0.01622%0.222CC..Hα-helixtrans-62.9-43.3175.8-168.567.3000111.3F192 A195 L196 M199 I572 F581 C758 Q759 A764 A765F192-L761 HydrophobicContact CD1-CD1 3.76Å; F192-L761 HydrophobicContact CD2-CD1 3.78Å; F192-L761 HydrophobicContact CE1-CD1 3.55Å; F192-L761 HydrophobicContact CE2-CD1 3.54Å; F192-L761 HydrophobicContact CE2-CG 4.07Å; F192-L761 HydrophobicContact CG-CD1 3.91Å; F192-L761 HydrophobicContact CZ-CD1 3.44Å; F192-L761 VanDerWaalsContact CZ-CD1 3.44Å; F192-L761 HydrophobicContact CZ-CG 4.14Å; A195-L761 HydrophobicContact CB-CB 4.34Å; A195-L761 HydrophobicContact CB-CD1 4.19Å; L196-L761 HydrophobicContact CD2-CD1 3.73Å; L196-L761 HydrophobicContact CD2-CD2 4.48Å; L196-L761 HydrophobicContact CG-CD1 4.23Å; M199-L761 HydrophobicContact CE-CD2 4.45Å; M199-L761 HydrophobicContact SD-CB 4.26Å; M199-L761 HydrophobicContact SD-CD2 4.05Å; I572-L761 HydrophobicContact CD1-CD2 4.11Å; I572-L761 HydrophobicContact CG1-CD2 4.15Å; I572-L761 HydrophobicContact CG2-CG 4.32Å; F581-L761 HydrophobicContact CE2-CD2 4.34Å; C758-L761 HydrophobicContact CB-CB 4.45Å; C758-L761 WeakPolarHBondContact O-CB 2.96Å; C758-L761 PolarHBondContact O-N 3.29Å; Q759-L761 VanDerWaalsContact C-N 3.29Å; Q759-L761 PolarHBondContact O-N 3.21Å; L761-A764 PolarHBondContact O-N 3.41Å; L761-A765 WeakPolarHBondContact O-CB 3.46Å; L761-A765 PolarHBondContact O-N 3.25Å
762R93.6Very high87.8Confident47 Ų4743.2 Ų43.218%0.17723%0.232CC..Hα-helixtrans-59-48.8173.6174.6173.7161.5148.1-14111.6I572 L573 T574 C576 E577 C758 Q759 A764 A765 K766I572-R762 WeakPolarHBondContact O-CB 3.31Å; I572-R762 WeakPolarHBondContact O-CG 3.2Å; L573-R762 PolarHBondContact O-NH1 3.22Å; T574-R762 PolarHBondContact O-NH1 3.39Å; C576-R762 HydrophobicContact CB-CB 4.02Å; E577-R762 VanDerWaalsContact CD-CZ 3.47Å; E577-R762 IonicContact OE1-CZ 3.84Å; E577-R762 IonicContact OE1-NH2 2.67Å; E577-R762 PolarHBondContact OE1-NH2 2.8Å; E577-R762 IonicContact OE2-CZ 3.99Å; E577-R762 IonicContact OE2-NH1 2.89Å; E577-R762 PolarHBondContact OE2-NH1 3.08Å; E577-R762 IonicContact OE2-NH2 3.05Å; E577-R762 PolarHBondContact OE2-NH2 2.69Å; C758-R762 PolarHBondContact O-N 3.47Å; Q759-R762 WeakPolarHBondContact O-CB 3.47Å; Q759-R762 PolarHBondContact O-N 2.91Å; R762-A764 VanDerWaalsContact C-N 3.33Å; R762-A764 PolarHBondContact O-N 2.83Å; R762-A765 PolarHBondContact O-N 3.4Å; R762-K766 WeakPolarHBondContact O-CB 3.49Å; R762-K766 PolarHBondContact O-N 2.96Å
763L95Very high88.9Confident96 Ų9642.7 Ų42.750%0.50323%0.229SC..Hα-helixtrans-61.4-43.7-178-70.7172.3000111.3Q759 S760 K766 R767Q759-L763 WeakPolarHBondContact O-CG 2.84Å; Q759-L763 PolarHBondContact O-N 3.26Å; S760-L763 PolarHBondContact O-N 3.2Å; L763-K766 PolarHBondContact O-N 3.01Å; L763-R767 WeakPolarHBondContact O-CB 3.48Å; L763-R767 PolarHBondContact O-N 2.96Å; L763-R767 PolarHBondContact O-NH1 3.17Å
764A93.9Very high90Very high0 Ų045.4 Ų45.40%024%0.24CC..Hα-helixtrans-60.7-49.6174.900000111.4S188 E191 F192 S760 L761 R762 K766 R767 G768S188-A764 WeakPolarHBondContact CB-O 3.23Å; S188-A764 PolarHBondContact OG-O 3.03Å; E191-A764 HydrophobicContact CB-CB 3.89Å; F192-A764 HydrophobicContact CB-CB 3.84Å; F192-A764 HydrophobicContact CD2-CB 4.11Å; F192-A764 HydrophobicContact CG-CB 4.39Å; S760-A764 WeakPolarHBondContact O-CB 3.27Å; S760-A764 PolarHBondContact O-N 3.07Å; L761-A764 PolarHBondContact O-N 3.41Å; R762-A764 VanDerWaalsContact C-N 3.33Å; R762-A764 PolarHBondContact O-N 2.83Å; A764-K766 PolarHBondContact O-N 2.98Å; A764-R767 PolarHBondContact O-N 3.46Å; A764-G768 PolarHBondContact O-N 3.33Å
765A92.3Very high90.9Very high19 Ų1941.5 Ų41.516%0.15722%0.222CC..Hα-helixtrans-62-44.1178.500000112.7F192 I572 L573 L761 R762 R767 G768 V769F192-A765 HydrophobicContact CD2-CB 4.26Å; F192-A765 HydrophobicContact CE2-CB 4.01Å; I572-A765 HydrophobicContact CG2-CB 3.49Å; I572-A765 VanDerWaalsContact CG2-CB 3.49Å; L573-A765 HydrophobicContact CD2-CB 3.9Å; L761-A765 WeakPolarHBondContact O-CB 3.46Å; L761-A765 PolarHBondContact O-N 3.25Å; R762-A765 PolarHBondContact O-N 3.4Å; A765-R767 VanDerWaalsContact C-N 3.31Å; A765-R767 PolarHBondContact O-N 3.33Å; A765-G768 PolarHBondContact O-N 2.77Å; A765-G768 VanDerWaalsContact O-N 3.1Å; A765-V769 PolarHBondContact O-N 3.45Å
766K94.2Very high91.7Very high61 Ų6138.2 Ų38.227%0.26520%0.204SC..Hα-helixtrans-61.3-40.617917955.4176.5153.20111.4L573 R762 L763 A764 G768 V769 D770L573-K766 HydrophobicContact CD2-CB 4.4Å; R762-K766 WeakPolarHBondContact O-CB 3.49Å; R762-K766 PolarHBondContact O-N 2.96Å; L763-K766 PolarHBondContact O-N 3.01Å; A764-K766 PolarHBondContact O-N 2.98Å; K766-G768 VanDerWaalsContact C-N 3.31Å; K766-G768 PolarHBondContact O-N 3.45Å; K766-V769 WeakPolarHBondContact O-CB 3.4Å; K766-V769 PolarHBondContact O-N 2.9Å; K766-D770 WeakPolarHBondContact CE-OD1 3.35Å; K766-D770 VanDerWaalsContact CE-OD2 3.29Å; K766-D770 WeakPolarHBondContact CE-OD2 3.39Å; K766-D770 IonicContact NZ-OD1 3.33Å; K766-D770 PolarHBondContact NZ-OD1 3.35Å; K766-D770 IonicContact NZ-OD2 3.1Å; K766-D770 WeakPolarHBondContact O-CB 3.1Å; K766-D770 VanDerWaalsContact O-CG 3.25Å; K766-D770 PolarHBondContact O-N 3.32Å
767R94.4Very high92.4Very high68 Ų6838.2 Ų38.226%0.25720%0.204SC..Hα-helixtrans-63.1-35.8174.3-176.1-176.2-72.298.5-29.6112.6Q184 E191 L763 A764 A765 D770 S771Q184-R767 HydrophobicContact CG-CG 3.67Å; E191-R767 VanDerWaalsContact CD-CZ 3.42Å; E191-R767 VanDerWaalsContact CD-NH2 3.3Å; E191-R767 IonicContact OE1-CZ 3.67Å; E191-R767 VanDerWaalsContact OE1-CZ 3.24Å; E191-R767 IonicContact OE1-NE 3.12Å; E191-R767 IonicContact OE1-NH1 2.71Å; E191-R767 IonicContact OE1-NH2 2.97Å; E191-R767 PolarHBondContact OE1-NH2 3.2Å; E191-R767 IonicContact OE2-CZ 3.31Å; E191-R767 IonicContact OE2-NE 2.81Å; E191-R767 PolarHBondContact OE2-NE 3.34Å; E191-R767 IonicContact OE2-NH1 2.74Å; E191-R767 PolarHBondContact OE2-NH1 2.99Å; E191-R767 IonicContact OE2-NH2 3.41Å; E191-R767 PolarHBondContact OE2-NH2 3.31Å; E191-R767 VanDerWaalsContact OE2-NH2 3.07Å; L763-R767 WeakPolarHBondContact O-CB 3.48Å; L763-R767 PolarHBondContact O-N 2.96Å; L763-R767 PolarHBondContact O-NH1 3.17Å; A764-R767 PolarHBondContact O-N 3.46Å; A765-R767 VanDerWaalsContact C-N 3.31Å; A765-R767 PolarHBondContact O-N 3.33Å; R767-D770 PolarHBondContact O-N 3.01Å; R767-S771 PolarHBondContact O-N 2.8Å
768G90.9Very high93Very high20 Ų2035.9 Ų35.921%0.20619%0.187CC..Hα-helixtrans-68.3-38.6173.200000112.6S188 A764 A765 K766 S771S188-G768 VanDerWaalsContact OG-CA 3.25Å; S188-G768 WeakPolarHBondContact OG-CA 3.18Å; S188-G768 PolarHBondContact OG-N 3.5Å; S188-G768 VanDerWaalsContact OG-N 3.13Å; A764-G768 PolarHBondContact O-N 3.33Å; A765-G768 PolarHBondContact O-N 2.77Å; A765-G768 VanDerWaalsContact O-N 3.1Å; K766-G768 VanDerWaalsContact C-N 3.31Å; K766-G768 PolarHBondContact O-N 3.45Å; G768-S771 PolarHBondContact O-OG 3.34Å
769V93.3Very high93.3Very high18 Ų1835.9 Ų35.911%0.10919%0.187CC..Hα-helixtrans-63.2-46.1171.4171.80000110.7L508 T509 L573 A765 K766 S771 V772 C773L508-V769 HydrophobicContact CB-CG1 3.6Å; L508-V769 HydrophobicContact CB-CG2 4.1Å; L508-V769 HydrophobicContact CD1-CG2 4.26Å; T509-V769 HydrophobicContact CG2-CG1 3.94Å; L573-V769 HydrophobicContact CD1-CG2 4.07Å; L573-V769 HydrophobicContact CD2-CG2 4.15Å; A765-V769 PolarHBondContact O-N 3.45Å; K766-V769 WeakPolarHBondContact O-CB 3.4Å; K766-V769 PolarHBondContact O-N 2.9Å; V769-S771 VanDerWaalsContact C-N 3.32Å; V769-S771 PolarHBondContact O-N 3.24Å; V769-V772 PolarHBondContact O-N 2.8Å; V769-C773 HydrophobicContact CG1-CB 4.37Å; V769-C773 WeakPolarHBondContact O-CB 2.84Å; V769-C773 PolarHBondContact O-N 2.97Å; V769-C773 PolarHBondContact O-SG 3.18Å; V769-C773 VanDerWaalsContact O-SG 3.41Å
770D94Very high93.5Very high39 Ų3931.9 Ų31.921%0.20917%0.168CC..Hα-helixtrans-68.9-30.5-176.7-68.2-19.4000111.9K766 R767 V772 Y774 T775K766-D770 WeakPolarHBondContact CE-OD1 3.35Å; K766-D770 VanDerWaalsContact CE-OD2 3.29Å; K766-D770 WeakPolarHBondContact CE-OD2 3.39Å; K766-D770 IonicContact NZ-OD1 3.33Å; K766-D770 PolarHBondContact NZ-OD1 3.35Å; K766-D770 IonicContact NZ-OD2 3.1Å; K766-D770 WeakPolarHBondContact O-CB 3.1Å; K766-D770 VanDerWaalsContact O-CG 3.25Å; K766-D770 PolarHBondContact O-N 3.32Å; R767-D770 PolarHBondContact O-N 3.01Å; D770-V772 VanDerWaalsContact C-N 3.31Å; D770-V772 PolarHBondContact O-N 2.95Å; D770-Y774 CarbonylContact O-C 3.31Å; D770-Y774 VanDerWaalsContact O-CA 3.3Å; D770-Y774 WeakPolarHBondContact O-CA 3.43Å; D770-Y774 WeakPolarHBondContact O-CB 3.37Å; D770-Y774 PolarHBondContact O-N 3.19Å; D770-T775 PolarHBondContact O-N 2.94Å; D770-T775 PolarHBondContact O-OG1 2.95Å
771S91.7Very high93.7Very high4 Ų428.5 Ų28.53%0.02814%0.144CC..Iπ-helixtrans-60.3-41.6175.1810000112.6A181 Q184 R767 G768 V769 T775 F776A181-S771 WeakPolarHBondContact CB-O 3.41Å; A181-S771 WeakPolarHBondContact O-CB 3.19Å; Q184-S771 VanDerWaalsContact OE1-CA 3.31Å; R767-S771 PolarHBondContact O-N 2.8Å; G768-S771 PolarHBondContact O-OG 3.34Å; V769-S771 VanDerWaalsContact C-N 3.32Å; V769-S771 PolarHBondContact O-N 3.24Å; S771-T775 WeakPolarHBondContact O-CB 3.38Å; S771-F776 PolarHBondContact O-N 2.84Å
772V90Very high94Very high62 Ų6228.5 Ų28.538%0.37614%0.144SC..Iπ-helixtrans-80.6-49.8177.9-178.60000110.8V769 D770 L777V769-V772 PolarHBondContact O-N 2.8Å; D770-V772 VanDerWaalsContact C-N 3.31Å; D770-V772 PolarHBondContact O-N 2.95Å; V772-L777 WeakPolarHBondContact O-CB 3.24Å; V772-L777 WeakPolarHBondContact O-CG 3.45Å; V772-L777 PolarHBondContact O-N 3.27Å
773C94.3Very high94.1Very high5 Ų527.1 Ų27.13%0.03414%0.14CC..Iπ-helixtrans-84.3-31.2-167.3-65.90000114.5C505 T509 V769 M778C505-C773 WeakPolarHBondContact CA-SG 3.45Å; C505-C773 HydrophobicContact CB-CB 3.5Å; C505-C773 VanDerWaalsContact CB-CB 3.5Å; C505-C773 WeakPolarHBondContact CB-SG 3.46Å; C505-C773 WeakPolarHBondContact SG-CA 3.42Å; C505-C773 WeakPolarHBondContact SG-CB 3.28Å; C505-C773 CovalentContact SG-SG 2.03Å; C505-C773 PolarHBondContact SG-SG 3.49Å; T509-C773 HydrophobicContact CG2-CB 3.66Å; V769-C773 HydrophobicContact CG1-CB 4.37Å; V769-C773 WeakPolarHBondContact O-CB 2.84Å; V769-C773 PolarHBondContact O-N 2.97Å; V769-C773 PolarHBondContact O-SG 3.18Å; V769-C773 VanDerWaalsContact O-SG 3.41Å; C773-M778 WeakPolarHBondContact O-CG 3.4Å
774Y93.6Very high94.1Very high67 Ų6723 Ų2326%0.26312%0.118SC..Iπ-helixtrans-99.4-60.6180-167.3-74.2000109.6D770 M778D770-Y774 CarbonylContact O-C 3.31Å; D770-Y774 VanDerWaalsContact O-CA 3.3Å; D770-Y774 WeakPolarHBondContact O-CA 3.43Å; D770-Y774 WeakPolarHBondContact O-CB 3.37Å; D770-Y774 PolarHBondContact O-N 3.19Å; Y774-M778 HydrophobicContact CD1-CE 3.74Å; Y774-M778 HydrophobicContact CD2-CE 2.89Å; Y774-M778 HydrophobicContact CE1-CE 3.89Å; Y774-M778 HydrophobicContact CE2-CE 3.05Å; Y774-M778 HydrophobicContact CG-CE 3.2Å; Y774-M778 VanDerWaalsContact O-CB 3.32Å; Y774-M778 WeakPolarHBondContact O-CB 3.48Å; Y774-M778 PolarHBondContact O-N 3.45Å
775T92.9Very high94.2Very high10 Ų1023.5 Ų23.56%0.06112%0.121CC..Iπ-helixtrans-72.2-46.2-168.3-54.80000112.5A171 I179 A181 Q184 D770 S771 P779A171-T775 HydrophobicContact CB-CG2 4.02Å; A171-T775 WeakPolarHBondContact CB-O 3.47Å; I179-T775 WeakPolarHBondContact O-CG2 3.43Å; A181-T775 HydrophobicContact CB-CG2 4.02Å; Q184-T775 PolarHBondContact OE1-OG1 3.32Å; D770-T775 PolarHBondContact O-N 2.94Å; D770-T775 PolarHBondContact O-OG1 2.95Å; S771-T775 WeakPolarHBondContact O-CB 3.38Å; T775-P779 WeakPolarHBondContact O-CD 3.23Å; T775-P779 VanDerWaalsContact O-CG 3.24Å; T775-P779 WeakPolarHBondContact O-CG 3.37Å
776F93.5Very high94.4Very high27 Ų2722.9 Ų22.912%0.11812%0.116CC..Iπ-helixtrans-81.7-55.4177175.9-83.8000112.6F168 L172 A181 F496 S771 F780F168-F776 AromaticContact CE2-CD2 3.81Å; F168-F776 HydrophobicContact CE2-CD2 3.81Å; F168-F776 HydrophobicContact CE2-CE1 4.34Å; F168-F776 AromaticContact CE2-CE2 3.58Å; F168-F776 HydrophobicContact CE2-CE2 3.58Å; F168-F776 HydrophobicContact CE2-CG 4.3Å; F168-F776 AromaticContact CE2-CZ 3.86Å; F168-F776 HydrophobicContact CE2-CZ 3.86Å; F168-F776 AromaticContact CZ-CE2 3.97Å; F168-F776 HydrophobicContact CZ-CE2 3.97Å; F168-F776 HydrophobicContact CZ-CZ 4.18Å; L172-F776 HydrophobicContact CD2-CD2 3.69Å; L172-F776 HydrophobicContact CD2-CE2 3.65Å; A181-F776 HydrophobicContact CB-CB 3.93Å; F496-F776 HydrophobicContact CE1-CE1 4.44Å; S771-F776 PolarHBondContact O-N 2.84Å; F776-F780 WeakPolarHBondContact O-CB 3.33Å
777L95.2Very high94.5Very high0 Ų020 Ų200%010%0.104CC..Hα-helixtrans-76.8-30.2-165.8-87.3-178.1000115.4L500 Q501 C505 V772 F780 N781L500-L777 HydrophobicContact CB-CD1 4.02Å; L500-L777 HydrophobicContact CB-CD2 4.41Å; L500-L777 HydrophobicContact CD2-CD1 3.8Å; L500-L777 HydrophobicContact CD2-CD2 4.06Å; L500-L777 HydrophobicContact CD2-CG 4.22Å; L500-L777 HydrophobicContact CG-CD1 3.72Å; Q501-L777 HydrophobicContact CB-CD1 4.47Å; C505-L777 HydrophobicContact CB-CD1 4.48Å; C505-L777 WeakPolarHBondContact SG-CD1 2.85Å; V772-L777 WeakPolarHBondContact O-CB 3.24Å; V772-L777 WeakPolarHBondContact O-CG 3.45Å; V772-L777 PolarHBondContact O-N 3.27Å; L777-F780 HydrophobicContact CD2-CD1 4.47Å; L777-N781 VanDerWaalsContact O-CB 3.24Å; L777-N781 WeakPolarHBondContact O-CB 3.47Å; L777-N781 VanDerWaalsContact O-CG 3.3Å; L777-N781 PolarHBondContact O-N 2.95Å; L777-N781 PolarHBondContact O-ND2 3.49Å; L777-N781 VanDerWaalsContact O-ND2 3.09Å
778M95.1Very high94.5Very high17 Ų1717.7 Ų17.78%0.08410%0.101CC..Hα-helixtrans-70.3-49.5-176.3-67.6-148.7-82.500114.1Y45 C773 Y774 F780 N781 A782Y45-M778 HydrophobicContact CD1-CB 3.71Å; Y45-M778 HydrophobicContact CD2-CB 3.94Å; Y45-M778 HydrophobicContact CD2-CE 4.06Å; Y45-M778 HydrophobicContact CD2-SD 4.05Å; Y45-M778 VanDerWaalsContact CE1-C 3.5Å; Y45-M778 HydrophobicContact CE1-CB 3.93Å; Y45-M778 HydrophobicContact CE2-CB 4.15Å; Y45-M778 HydrophobicContact CG-CB 3.73Å; Y45-M778 HydrophobicContact CG-CG 4.45Å; Y45-M778 HydrophobicContact CG-SD 3.97Å; C773-M778 WeakPolarHBondContact O-CG 3.4Å; Y774-M778 HydrophobicContact CD1-CE 3.74Å; Y774-M778 HydrophobicContact CD2-CE 2.89Å; Y774-M778 HydrophobicContact CE1-CE 3.89Å; Y774-M778 HydrophobicContact CE2-CE 3.05Å; Y774-M778 HydrophobicContact CG-CE 3.2Å; Y774-M778 VanDerWaalsContact O-CB 3.32Å; Y774-M778 WeakPolarHBondContact O-CB 3.48Å; Y774-M778 PolarHBondContact O-N 3.45Å; M778-F780 VanDerWaalsContact C-N 3.29Å; M778-F780 PolarHBondContact O-N 3.06Å; M778-N781 PolarHBondContact O-N 2.86Å; M778-A782 WeakPolarHBondContact O-CB 3.28Å; M778-A782 PolarHBondContact O-N 3.24Å
779P96.1Very high94.7Very high3 Ų321.5 Ų21.52%0.01911%0.112CC..Hα-helixtrans-60.6-40.5172.223.1-32.5000111.7Y45 N164 L167 F168 T775 N781 A782 F783Y45-P779 HydrophobicContact CE1-CB 4.34Å; N164-P779 WeakPolarHBondContact O-CB 3.32Å; L167-P779 HydrophobicContact CB-CB 3.93Å; F168-P779 HydrophobicContact CB-CB 4.09Å; F168-P779 HydrophobicContact CB-CG 4.37Å; T775-P779 WeakPolarHBondContact O-CD 3.23Å; T775-P779 VanDerWaalsContact O-CG 3.24Å; T775-P779 WeakPolarHBondContact O-CG 3.37Å; P779-N781 VanDerWaalsContact C-N 3.31Å; P779-N781 PolarHBondContact O-N 3.37Å; P779-A782 PolarHBondContact O-N 2.87Å; P779-F783 WeakPolarHBondContact O-CB 3.39Å; P779-F783 PolarHBondContact O-N 3.14Å
780F96.2Very high94.8Very high30 Ų3020.6 Ų20.613%0.13211%0.107CC..Hα-helixtrans-57.4-43.5175.3-173.7-95.5000112.6F168 P493 F496 F776 L777 M778F168-F780 HydrophobicContact CD1-CD2 4.4Å; F168-F780 HydrophobicContact CD2-CB 3.81Å; F168-F780 HydrophobicContact CD2-CD2 4.01Å; F168-F780 HydrophobicContact CD2-CG 4.41Å; F168-F780 HydrophobicContact CE1-CD2 4.02Å; F168-F780 HydrophobicContact CE1-CE2 4.48Å; F168-F780 HydrophobicContact CE2-CB 3.96Å; F168-F780 AromaticContact CE2-CD2 3.59Å; F168-F780 HydrophobicContact CE2-CD2 3.59Å; F168-F780 HydrophobicContact CE2-CG 4.17Å; F168-F780 HydrophobicContact CG-CD2 4.4Å; F168-F780 AromaticContact CZ-CD2 3.58Å; F168-F780 HydrophobicContact CZ-CD2 3.58Å; F168-F780 HydrophobicContact CZ-CE2 4.13Å; P493-F780 HydrophobicContact CB-CE1 3.7Å; P493-F780 HydrophobicContact CB-CE2 4.32Å; P493-F780 HydrophobicContact CB-CZ 3.56Å; P493-F780 HydrophobicContact CG-CZ 4.24Å; P493-F780 WeakPolarHBondContact O-CE1 3.42Å; F496-F780 AromaticContact CD1-CE1 3.81Å; F496-F780 HydrophobicContact CD1-CE1 3.81Å; F496-F780 AromaticContact CD1-CZ 3.9Å; F496-F780 HydrophobicContact CD1-CZ 3.9Å; F776-F780 WeakPolarHBondContact O-CB 3.33Å; L777-F780 HydrophobicContact CD2-CD1 4.47Å; M778-F780 VanDerWaalsContact C-N 3.29Å; M778-F780 PolarHBondContact O-N 3.06Å
781N96.5Very high94.9Very high2 Ų218.8 Ų18.81%0.01110%0.097CC..Hα-helixtrans-75.6-36.7-179.4-78.2-40.3000113.3S48 G497 G498 Q501 L777 M778 P779 F783 W784 T785S48-N781 WeakPolarHBondContact OG-CB 3.48Å; S48-N781 PolarHBondContact OG-O 2.9Å; G497-N781 VanDerWaalsContact CA-OD1 3.23Å; G497-N781 WeakPolarHBondContact CA-OD1 2.99Å; G497-N781 PolarHBondContact O-ND2 3.13Å; G497-N781 PolarHBondContact O-OD1 3Å; G498-N781 PolarHBondContact N-OD1 2.92Å; Q501-N781 WeakPolarHBondContact CB-ND2 3.43Å; L777-N781 VanDerWaalsContact O-CB 3.24Å; L777-N781 WeakPolarHBondContact O-CB 3.47Å; L777-N781 VanDerWaalsContact O-CG 3.3Å; L777-N781 PolarHBondContact O-N 2.95Å; L777-N781 PolarHBondContact O-ND2 3.49Å; L777-N781 VanDerWaalsContact O-ND2 3.09Å; M778-N781 PolarHBondContact O-N 2.86Å; P779-N781 VanDerWaalsContact C-N 3.31Å; P779-N781 PolarHBondContact O-N 3.37Å; N781-F783 VanDerWaalsContact C-N 3.32Å; N781-F783 PolarHBondContact O-N 2.96Å; N781-W784 VanDerWaalsContact CA-NE1 3.3Å; N781-W784 HydrophobicContact CB-CZ2 4.44Å; N781-W784 VanDerWaalsContact O-CE2 3.3Å; N781-W784 PolarHBondContact O-NE1 3.29Å; N781-W784 PolarHBondContact OD1-NE1 3.25Å; N781-T785 WeakPolarHBondContact O-CB 3.4Å; N781-T785 PolarHBondContact O-N 3.3Å; N781-T785 VanDerWaalsContact O-N 3.14Å; N781-T785 PolarHBondContact O-OG1 3.06Å
782A96.7Very high95.1Very high3 Ų324 Ų243%0.02512%0.124CC..Hα-helixtrans-69.5-29.7176.300000112.8Y45 N164 M778 P779 T785 G786Y45-A782 HydrophobicContact CD1-CB 3.74Å; Y45-A782 HydrophobicContact CE1-CB 3.98Å; N164-A782 HydrophobicContact CB-CB 4.18Å; N164-A782 WeakPolarHBondContact ND2-CB 3.48Å; M778-A782 WeakPolarHBondContact O-CB 3.28Å; M778-A782 PolarHBondContact O-N 3.24Å; P779-A782 PolarHBondContact O-N 2.87Å; A782-T785 PolarHBondContact O-N 2.93Å; A782-G786 PolarHBondContact O-N 3.41Å
783F96.3Very high95.4Very high18 Ų1823 Ų238%0.07912%0.117CC..Hα-helixtrans-54.9-59.1172.1162-102.2000112.1A161 N164 H165 L432 L433 P493 P779 N781 T785 G786 L787A161-F783 HydrophobicContact CB-CD2 4.25Å; N164-F783 HydrophobicContact CB-CB 4.37Å; H165-F783 HydrophobicContact CB-CD2 3.89Å; H165-F783 HydrophobicContact CB-CE2 4.34Å; L432-F783 HydrophobicContact CD2-CZ 4.07Å; L433-F783 HydrophobicContact CD1-CD2 4.43Å; L433-F783 HydrophobicContact CD1-CE2 4.01Å; L433-F783 HydrophobicContact CD2-CE2 4.04Å; L433-F783 HydrophobicContact CG-CE2 4.14Å; P493-F783 HydrophobicContact CG-CE1 4.42Å; P779-F783 WeakPolarHBondContact O-CB 3.39Å; P779-F783 PolarHBondContact O-N 3.14Å; N781-F783 VanDerWaalsContact C-N 3.32Å; N781-F783 PolarHBondContact O-N 2.96Å; F783-T785 VanDerWaalsContact C-N 3.26Å; F783-T785 PolarHBondContact O-N 3.25Å; F783-G786 PolarHBondContact O-N 3.37Å; F783-L787 HydrophobicContact CZ-CD2 4.33Å; F783-L787 PolarHBondContact O-N 3.48Å; F783-L787 VanDerWaalsContact O-N 3.09Å
784W95.9Very high95.5Very high10 Ų1022.8 Ų22.84%0.03812%0.115CC..Hα-helixtrans-71-26.3-177.968-105.1000111.8F51 L52 C490 P493 F494 N781 G788F51-W784 AromaticContact CD1-CH2 3.74Å; F51-W784 HydrophobicContact CD1-CH2 3.74Å; F51-W784 HydrophobicContact CD1-CZ3 4.14Å; F51-W784 AromaticContact CE1-CH2 3.88Å; F51-W784 HydrophobicContact CE1-CH2 3.88Å; F51-W784 AromaticContact CE1-CZ3 3.96Å; F51-W784 HydrophobicContact CE1-CZ3 3.96Å; L52-W784 HydrophobicContact CD1-CZ2 4.24Å; L52-W784 HydrophobicContact CD2-CH2 3.99Å; L52-W784 HydrophobicContact CD2-CZ2 3.85Å; L52-W784 HydrophobicContact CG-CH2 4.33Å; L52-W784 HydrophobicContact CG-CZ2 4.15Å; C490-W784 PolarHBondContact SG-O 3.32Å; P493-W784 HydrophobicContact CB-CB 4.02Å; P493-W784 HydrophobicContact CB-CG 4.15Å; F494-W784 HydrophobicContact CB-CD2 3.83Å; F494-W784 HydrophobicContact CB-CE3 3.92Å; F494-W784 HydrophobicContact CB-CG 4.27Å; F494-W784 HydrophobicContact CB-CZ3 4.39Å; F494-W784 HydrophobicContact CD2-CD2 4.35Å; F494-W784 HydrophobicContact CD2-CE3 4.05Å; F494-W784 AromaticContact CD2-CH2 3.52Å; F494-W784 HydrophobicContact CD2-CH2 3.52Å; F494-W784 AromaticContact CD2-CZ2 3.79Å; F494-W784 HydrophobicContact CD2-CZ2 3.79Å; F494-W784 AromaticContact CD2-CZ3 3.63Å; F494-W784 HydrophobicContact CD2-CZ3 3.63Å; F494-W784 HydrophobicContact CE2-CH2 4.12Å; F494-W784 HydrophobicContact CE2-CZ3 4.39Å; F494-W784 HydrophobicContact CG-CE3 4.4Å; F494-W784 HydrophobicContact CG-CZ3 4.38Å; N781-W784 VanDerWaalsContact CA-NE1 3.3Å; N781-W784 HydrophobicContact CB-CZ2 4.44Å; N781-W784 VanDerWaalsContact O-CE2 3.3Å; N781-W784 PolarHBondContact O-NE1 3.29Å; N781-W784 PolarHBondContact OD1-NE1 3.25Å; W784-G788 PolarHBondContact O-N 3.11Å
785T96Very high95.6Very high10 Ų1023.6 Ų23.66%0.06112%0.123CC..Hα-helixtrans-62.9-49.4174.1-59.50000110.3I47 S48 N781 A782 F783 G788 F789I47-T785 HydrophobicContact CG2-CG2 4.11Å; S48-T785 WeakPolarHBondContact CB-OG1 3.47Å; S48-T785 PolarHBondContact OG-OG1 3.41Å; N781-T785 WeakPolarHBondContact O-CB 3.4Å; N781-T785 PolarHBondContact O-N 3.3Å; N781-T785 VanDerWaalsContact O-N 3.14Å; N781-T785 PolarHBondContact O-OG1 3.06Å; A782-T785 PolarHBondContact O-N 2.93Å; F783-T785 VanDerWaalsContact C-N 3.26Å; F783-T785 PolarHBondContact O-N 3.25Å; T785-G788 PolarHBondContact O-N 2.88Å; T785-F789 HydrophobicContact CG2-CD2 3.92Å; T785-F789 HydrophobicContact CG2-CE2 3.69Å; T785-F789 WeakPolarHBondContact O-CD2 3.38Å; T785-F789 PolarHBondContact O-N 2.87Å
786G95.2Very high95.8Very high7 Ų724.9 Ų24.97%0.07213%0.132CC..Hα-helixtrans-60.3-47.2176.300000112.3A782 F783 G788 F789 T790A782-G786 PolarHBondContact O-N 3.41Å; F783-G786 PolarHBondContact O-N 3.37Å; G786-G788 VanDerWaalsContact C-N 3.33Å; G786-G788 PolarHBondContact O-N 2.97Å; G786-F789 PolarHBondContact O-N 3.42Å; G786-T790 PolarHBondContact O-N 2.99Å; G786-T790 VanDerWaalsContact O-N 3.11Å; G786-T790 PolarHBondContact O-OG1 3.36Å
787L95.9Very high96Very high0 Ų023.6 Ų23.60%013%0.126CC..Hα-helixtrans-61.2-40.6176.3-176.759.4000112.4L432 L433 L486 S489 C490 F783 T790 L791L432-L787 HydrophobicContact CD2-CD2 4.22Å; L433-L787 HydrophobicContact CD2-CD1 4.45Å; L486-L787 HydrophobicContact CD2-CD1 4.28Å; S489-L787 WeakPolarHBondContact OG-CD2 3.31Å; C490-L787 HydrophobicContact CB-CD2 4.22Å; C490-L787 HydrophobicContact CB-CG 4.42Å; F783-L787 HydrophobicContact CZ-CD2 4.33Å; F783-L787 PolarHBondContact O-N 3.48Å; F783-L787 VanDerWaalsContact O-N 3.09Å; L787-T790 WeakPolarHBondContact O-CB 3.36Å; L787-T790 PolarHBondContact O-N 3.33Å; L787-L791 HydrophobicContact CD1-CD1 4.48Å; L787-L791 HydrophobicContact CG-CD1 4.18Å; L787-L791 WeakPolarHBondContact O-CG 3.5Å; L787-L791 PolarHBondContact O-N 2.81Å
788G95.6Very high96Very high20 Ų2024.4 Ų24.421%0.20613%0.13CC..Hα-helixtrans-62.5-44.1177.400000112.7W784 T785 G786 T790 L791 L792W784-G788 PolarHBondContact O-N 3.11Å; T785-G788 PolarHBondContact O-N 2.88Å; G786-G788 VanDerWaalsContact C-N 3.33Å; G786-G788 PolarHBondContact O-N 2.97Å; G788-T790 VanDerWaalsContact C-N 3.33Å; G788-T790 PolarHBondContact O-N 2.84Å; G788-L791 PolarHBondContact O-N 3.38Å; G788-L792 WeakPolarHBondContact O-CB 3.49Å; G788-L792 PolarHBondContact O-N 3.34Å
789F94.8Very high96Very high99 Ų9928 Ų2843%0.43415%0.149SC..Hα-helixtrans-61.4-41.5174.6-85-67000112.2I47 A157 T785 G786 L791 L792 L793I47-F789 HydrophobicContact CG2-CE2 3.76Å; I47-F789 HydrophobicContact CG2-CZ 4.22Å; A157-F789 HydrophobicContact CB-CB 4.28Å; T785-F789 HydrophobicContact CG2-CD2 3.92Å; T785-F789 HydrophobicContact CG2-CE2 3.69Å; T785-F789 WeakPolarHBondContact O-CD2 3.38Å; T785-F789 PolarHBondContact O-N 2.87Å; G786-F789 PolarHBondContact O-N 3.42Å; F789-L791 PolarHBondContact O-N 3.44Å; F789-L792 PolarHBondContact O-N 2.88Å; F789-L793 WeakPolarHBondContact O-CG 3.48Å; F789-L793 PolarHBondContact O-N 3.13Å
790T96Very high96Very high0 Ų030.2 Ų30.20%016%0.158CC..Hα-helixtrans-58-47.9175-65.70000112.1Q154 V158 P436 F440 G786 L787 G788 L793 F794Q154-T790 PolarHBondContact NE2-O 2.84Å; Q154-T790 PolarHBondContact O-OG1 3.37Å; V158-T790 HydrophobicContact CG2-CG2 3.65Å; V158-T790 WeakPolarHBondContact CG2-OG1 3.3Å; P436-T790 HydrophobicContact CB-CG2 4.33Å; F440-T790 HydrophobicContact CE1-CG2 4.43Å; F440-T790 HydrophobicContact CZ-CG2 3.64Å; G786-T790 PolarHBondContact O-N 2.99Å; G786-T790 VanDerWaalsContact O-N 3.11Å; G786-T790 PolarHBondContact O-OG1 3.36Å; L787-T790 WeakPolarHBondContact O-CB 3.36Å; L787-T790 PolarHBondContact O-N 3.33Å; G788-T790 VanDerWaalsContact C-N 3.33Å; G788-T790 PolarHBondContact O-N 2.84Å; T790-L793 PolarHBondContact O-N 3.22Å; T790-F794 HydrophobicContact CG2-CD1 4.49Å; T790-F794 HydrophobicContact CG2-CE1 3.76Å; T790-F794 HydrophobicContact CG2-CZ 4.29Å; T790-F794 WeakPolarHBondContact O-CD1 3.07Å; T790-F794 PolarHBondContact O-N 3.4Å
791L96.4Very high96Very high0 Ų028.8 Ų28.80%015%0.152CC..Hα-helixtrans-67.4-39.3-178.8-69.6169.4000112.6F104 L486 M487 C490 L787 G788 F789 L793 F794F104-L791 HydrophobicContact CE1-CB 4.34Å; F104-L791 HydrophobicContact CE1-CD2 4.22Å; F104-L791 WeakPolarHBondContact CE2-O 3.33Å; F104-L791 HydrophobicContact CZ-CB 4.05Å; F104-L791 HydrophobicContact CZ-CD2 4.32Å; F104-L791 WeakPolarHBondContact CZ-O 3.44Å; L486-L791 HydrophobicContact CB-CD1 4.09Å; L486-L791 HydrophobicContact CB-CD2 3.69Å; L486-L791 HydrophobicContact CB-CG 4.4Å; L486-L791 HydrophobicContact CD1-CD2 4.11Å; L486-L791 WeakPolarHBondContact O-CD1 3Å; M487-L791 HydrophobicContact CB-CD1 4.25Å; M487-L791 HydrophobicContact CE-CB 4Å; M487-L791 HydrophobicContact CE-CD1 3.85Å; M487-L791 HydrophobicContact SD-CD1 4.26Å; C490-L791 HydrophobicContact CB-CD1 4.33Å; L787-L791 HydrophobicContact CD1-CD1 4.48Å; L787-L791 HydrophobicContact CG-CD1 4.18Å; L787-L791 WeakPolarHBondContact O-CG 3.5Å; L787-L791 PolarHBondContact O-N 2.81Å; G788-L791 PolarHBondContact O-N 3.38Å; F789-L791 PolarHBondContact O-N 3.44Å; L791-L793 PolarHBondContact O-N 2.99Å; L791-F794 HydrophobicContact CD2-CD2 3.87Å; L791-F794 HydrophobicContact CD2-CE2 3.62Å; L791-F794 HydrophobicContact CD2-CZ 4.19Å; L791-F794 WeakPolarHBondContact O-CB 3.43Å; L791-F794 PolarHBondContact O-N 2.84Å
792L94.7Very high95.9Very high113 Ų11329.9 Ų29.959%0.59216%0.159SC*.Hα-helixtrans-59.5-38.1175.5-175.9138.3000111.4G788 F789 F794G788-L792 WeakPolarHBondContact O-CB 3.49Å; G788-L792 PolarHBondContact O-N 3.34Å; F789-L792 PolarHBondContact O-N 2.88Å; L792-F794 VanDerWaalsContact C-N 3.32Å; L792-F794 PolarHBondContact O-N 3.47Å
793L96.8Very high95.6Very high42 Ų4235.7 Ų35.722%0.2218%0.183CC..THydrogen-bonded Turntrans-78.2-7.8177.6-70.6178.2000114.2I150 F153 Q154 F789 T790 L791 I795 P796 A797I150-L793 HydrophobicContact CG2-CB 4.09Å; F153-L793 HydrophobicContact CB-CD1 4.17Å; Q154-L793 HydrophobicContact CG-CB 3.53Å; Q154-L793 HydrophobicContact CG-CD1 3.77Å; Q154-L793 HydrophobicContact CG-CG 4.31Å; Q154-L793 PolarHBondContact NE2-O 3.43Å; Q154-L793 VanDerWaalsContact NE2-O 3.16Å; F789-L793 WeakPolarHBondContact O-CG 3.48Å; F789-L793 PolarHBondContact O-N 3.13Å; T790-L793 PolarHBondContact O-N 3.22Å; L791-L793 PolarHBondContact O-N 2.99Å; L793-I795 VanDerWaalsContact C-N 3.29Å; L793-I795 PolarHBondContact O-N 3.01Å; L793-P796 HydrophobicContact CD2-CG 4.2Å; L793-P796 VanDerWaalsContact O-CD 3.3Å; L793-P796 WeakPolarHBondContact O-CD 3.49Å; L793-P796 WeakPolarHBondContact O-CG 3.34Å; L793-A797 VanDerWaalsContact O-CB 3.27Å; L793-A797 WeakPolarHBondContact O-CB 3.34Å; L793-A797 PolarHBondContact O-N 3.47Å; L793-A797 VanDerWaalsContact O-N 3.14Å
794F97Very high95.5Very high0 Ų034.9 Ų34.90%018%0.18CC..Hα-helixtrans-60.9-39172.9-79.33.1000111.5M108 Q154 I439 F440 M479 L486 T790 L791 L792 A797 I798M108-F794 HydrophobicContact CE-CB 4.36Å; Q154-F794 VanDerWaalsContact NE2-CD1 3.34Å; I439-F794 HydrophobicContact CD1-CZ 4.16Å; F440-F794 HydrophobicContact CE1-CE1 4.12Å; M479-F794 HydrophobicContact CB-CD2 4.05Å; M479-F794 HydrophobicContact CB-CE2 4.28Å; M479-F794 HydrophobicContact CB-CG 4.45Å; M479-F794 HydrophobicContact CG-CD1 4.2Å; M479-F794 HydrophobicContact CG-CD2 4.02Å; M479-F794 HydrophobicContact CG-CE1 4.27Å; M479-F794 HydrophobicContact CG-CE2 4.06Å; M479-F794 HydrophobicContact CG-CG 4.1Å; M479-F794 HydrophobicContact CG-CZ 4.2Å; M479-F794 HydrophobicContact SD-CB 4.16Å; M479-F794 HydrophobicContact SD-CD1 3.85Å; M479-F794 HydrophobicContact SD-CD2 4.43Å; M479-F794 HydrophobicContact SD-CE1 4.35Å; M479-F794 HydrophobicContact SD-CG 3.92Å; L486-F794 HydrophobicContact CD1-CE2 4.13Å; L486-F794 HydrophobicContact CD1-CZ 4.26Å; T790-F794 HydrophobicContact CG2-CD1 4.49Å; T790-F794 HydrophobicContact CG2-CE1 3.76Å; T790-F794 HydrophobicContact CG2-CZ 4.29Å; T790-F794 WeakPolarHBondContact O-CD1 3.07Å; T790-F794 PolarHBondContact O-N 3.4Å; L791-F794 HydrophobicContact CD2-CD2 3.87Å; L791-F794 HydrophobicContact CD2-CE2 3.62Å; L791-F794 HydrophobicContact CD2-CZ 4.19Å; L791-F794 WeakPolarHBondContact O-CB 3.43Å; L791-F794 PolarHBondContact O-N 2.84Å; L792-F794 VanDerWaalsContact C-N 3.32Å; L792-F794 PolarHBondContact O-N 3.47Å; F794-A797 PolarHBondContact O-N 3.02Å; F794-I798 HydrophobicContact CB-CD1 4.38Å; F794-I798 WeakPolarHBondContact O-CB 3.31Å; F794-I798 WeakPolarHBondContact O-CD1 3.24Å; F794-I798 WeakPolarHBondContact O-CG1 3.07Å; F794-I798 PolarHBondContact O-N 2.95Å
795I95.6Very high95.3Very high85 Ų8534.4 Ų34.444%0.43618%0.178SC..Hα-helixtrans-57.8-58.2-178.2-61.8167.8000111.6F104 M108 L793 A797 I798 I799F104-I795 HydrophobicContact CD2-CD1 4.34Å; F104-I795 HydrophobicContact CE2-CD1 4.24Å; F104-I795 HydrophobicContact CE2-CG1 4.23Å; M108-I795 HydrophobicContact CE-CB 4.39Å; M108-I795 HydrophobicContact CE-CD1 4.22Å; M108-I795 HydrophobicContact CE-CG1 3.28Å; L793-I795 VanDerWaalsContact C-N 3.29Å; L793-I795 PolarHBondContact O-N 3.01Å; I795-A797 VanDerWaalsContact C-N 3.33Å; I795-A797 PolarHBondContact O-N 2.75Å; I795-I798 PolarHBondContact O-N 2.9Å; I795-I799 HydrophobicContact CG2-CD1 4.28Å; I795-I799 WeakPolarHBondContact O-CG1 3.46Å; I795-I799 PolarHBondContact O-N 3.26Å
796P96.7Very high94.9Very high37 Ų3735.3 Ų35.324%0.2419%0.189CC..Hα-helixtrans-65.7-35.717826.7-35.6000112.2I150 L793 I798 I799 F800I150-P796 HydrophobicContact CD1-CB 3.93Å; I150-P796 HydrophobicContact CD1-CG 4.36Å; L793-P796 HydrophobicContact CD2-CG 4.2Å; L793-P796 VanDerWaalsContact O-CD 3.3Å; L793-P796 WeakPolarHBondContact O-CD 3.49Å; L793-P796 WeakPolarHBondContact O-CG 3.34Å; P796-I798 VanDerWaalsContact C-N 3.34Å; P796-I798 PolarHBondContact O-N 3.2Å; P796-I799 PolarHBondContact O-N 3.12Å; P796-F800 HydrophobicContact CB-CE2 4.44Å; P796-F800 WeakPolarHBondContact O-CD2 3.43Å; P796-F800 PolarHBondContact O-N 2.86Å
797A97.5Very high94.6Very high0 Ų035.6 Ų35.60%019%0.189CC..Hα-helixtrans-58.3-45.2175.800000111.9L147 I150 M479 L793 F794 I795 I799 F800 A801L147-A797 HydrophobicContact CD1-CB 4.18Å; I150-A797 HydrophobicContact CG2-CB 3.85Å; M479-A797 HydrophobicContact SD-CB 4.31Å; L793-A797 VanDerWaalsContact O-CB 3.27Å; L793-A797 WeakPolarHBondContact O-CB 3.34Å; L793-A797 PolarHBondContact O-N 3.47Å; L793-A797 VanDerWaalsContact O-N 3.14Å; F794-A797 PolarHBondContact O-N 3.02Å; I795-A797 VanDerWaalsContact C-N 3.33Å; I795-A797 PolarHBondContact O-N 2.75Å; A797-I799 VanDerWaalsContact C-N 3.35Å; A797-I799 PolarHBondContact O-N 3.05Å; A797-F800 PolarHBondContact O-N 3.41Å; A797-A801 WeakPolarHBondContact O-CB 3.19Å; A797-A801 PolarHBondContact O-N 3.32Å
798I95.8Very high94.4Very high16 Ų1635.6 Ų35.68%0.08219%0.189CC..Hα-helixtrans-59.1-46.4176.3-71.2161.2000110.5M108 V476 M479 F480 F794 I795 P796 A801 V802M108-I798 HydrophobicContact CE-CD1 4.12Å; M108-I798 HydrophobicContact SD-CD1 4.21Å; V476-I798 HydrophobicContact CG1-CG1 4.38Å; V476-I798 HydrophobicContact CG1-CG2 3.96Å; V476-I798 HydrophobicContact CG2-CG1 4.46Å; M479-I798 HydrophobicContact CB-CD1 4.17Å; M479-I798 HydrophobicContact CB-CG1 4.28Å; M479-I798 HydrophobicContact CE-CG1 3.63Å; M479-I798 HydrophobicContact SD-CD1 4.43Å; M479-I798 HydrophobicContact SD-CG1 3.83Å; F480-I798 HydrophobicContact CD1-CD1 4.27Å; F480-I798 HydrophobicContact CE1-CD1 3.79Å; F480-I798 HydrophobicContact CE2-CG2 4.27Å; F480-I798 HydrophobicContact CZ-CD1 3.98Å; F480-I798 HydrophobicContact CZ-CG2 3.85Å; F794-I798 HydrophobicContact CB-CD1 4.38Å; F794-I798 WeakPolarHBondContact O-CB 3.31Å; F794-I798 WeakPolarHBondContact O-CD1 3.24Å; F794-I798 WeakPolarHBondContact O-CG1 3.07Å; F794-I798 PolarHBondContact O-N 2.95Å; I795-I798 PolarHBondContact O-N 2.9Å; P796-I798 VanDerWaalsContact C-N 3.34Å; P796-I798 PolarHBondContact O-N 3.2Å; I798-A801 PolarHBondContact O-N 3.43Å; I798-V802 HydrophobicContact CG2-CG2 4.32Å; I798-V802 WeakPolarHBondContact O-CB 3.4Å; I798-V802 VanDerWaalsContact O-CG2 3.23Å; I798-V802 WeakPolarHBondContact O-CG2 3.36Å; I798-V802 PolarHBondContact O-N 2.96Å
799I94.6Very high94Very high93 Ų9337.5 Ų37.548%0.47719%0.19SC..Hα-helixtrans-60.3-51.3-178.9-64.9166.8000110.6I795 P796 A797 K803I795-I799 HydrophobicContact CG2-CD1 4.28Å; I795-I799 WeakPolarHBondContact O-CG1 3.46Å; I795-I799 PolarHBondContact O-N 3.26Å; P796-I799 PolarHBondContact O-N 3.12Å; A797-I799 VanDerWaalsContact C-N 3.35Å; A797-I799 PolarHBondContact O-N 3.05Å; I799-K803 WeakPolarHBondContact O-CB 3.46Å; I799-K803 VanDerWaalsContact O-CG 3.23Å; I799-K803 WeakPolarHBondContact O-CG 3.3Å; I799-K803 PolarHBondContact O-N 3.35Å
800F96.6Very high93.6Very high50 Ų5033.2 Ų33.222%0.21917%0.171CC..Hα-helixtrans-67.6-40.9-179.3-71.3-64.9000112Y143 C146 L147 I150 P796 A797 V802 K803 L804Y143-F800 AromaticContact CD1-CD1 3.6Å; Y143-F800 HydrophobicContact CD1-CD1 3.6Å; Y143-F800 AromaticContact CD1-CE1 3.74Å; Y143-F800 HydrophobicContact CD1-CE1 3.74Å; Y143-F800 HydrophobicContact CE1-CD1 4.29Å; Y143-F800 HydrophobicContact CE1-CE1 4.16Å; Y143-F800 HydrophobicContact CG-CD1 4.12Å; C146-F800 HydrophobicContact CB-CD1 4.03Å; C146-F800 HydrophobicContact CB-CD2 4.1Å; C146-F800 HydrophobicContact CB-CE1 3.88Å; C146-F800 HydrophobicContact CB-CE2 3.96Å; C146-F800 HydrophobicContact CB-CG 4.15Å; C146-F800 HydrophobicContact CB-CZ 3.85Å; L147-F800 HydrophobicContact CB-CB 4.19Å; L147-F800 HydrophobicContact CD1-CB 4.28Å; I150-F800 HydrophobicContact CD1-CD2 3.52Å; I150-F800 HydrophobicContact CD1-CE2 3.74Å; P796-F800 HydrophobicContact CB-CE2 4.44Å; P796-F800 WeakPolarHBondContact O-CD2 3.43Å; P796-F800 PolarHBondContact O-N 2.86Å; A797-F800 PolarHBondContact O-N 3.41Å; F800-V802 PolarHBondContact O-N 2.89Å; F800-K803 PolarHBondContact O-N 3.21Å; F800-L804 WeakPolarHBondContact O-CB 3.29Å; F800-L804 PolarHBondContact O-N 3.35Å
801A96Very high92.8Very high0 Ų034 Ų340%018%0.176CC..Hα-helixtrans-61.1-44.8177.500000112L147 L443 L472 V476 A797 I798 L804 A805L147-A801 HydrophobicContact CD1-CB 4.37Å; L147-A801 HydrophobicContact CD2-CB 4.03Å; L443-A801 HydrophobicContact CD2-CB 4.31Å; L472-A801 HydrophobicContact CB-CB 4.47Å; V476-A801 HydrophobicContact CG2-CB 3.71Å; A797-A801 WeakPolarHBondContact O-CB 3.19Å; A797-A801 PolarHBondContact O-N 3.32Å; I798-A801 PolarHBondContact O-N 3.43Å; A801-L804 PolarHBondContact O-N 3.05Å; A801-A805 WeakPolarHBondContact O-CB 3.32Å; A801-A805 PolarHBondContact O-N 3.47Å
802V93Very high92.1Very high25 Ų2537.8 Ų37.815%0.15219%0.194CC..Hα-helixtrans-66.7-43.8178.3172.50000111.5F115 L473 V476 I798 F800 G806F115-V802 HydrophobicContact CE1-CG2 4.43Å; F115-V802 HydrophobicContact CE2-CG1 3.9Å; F115-V802 HydrophobicContact CE2-CG2 3.91Å; F115-V802 HydrophobicContact CZ-CB 4.43Å; F115-V802 HydrophobicContact CZ-CG1 3.93Å; F115-V802 HydrophobicContact CZ-CG2 3.53Å; L473-V802 HydrophobicContact CD2-CG2 4.34Å; V476-V802 HydrophobicContact CG1-CG2 4.13Å; V476-V802 HydrophobicContact CG2-CG2 4.09Å; I798-V802 HydrophobicContact CG2-CG2 4.32Å; I798-V802 WeakPolarHBondContact O-CB 3.4Å; I798-V802 VanDerWaalsContact O-CG2 3.23Å; I798-V802 WeakPolarHBondContact O-CG2 3.36Å; I798-V802 PolarHBondContact O-N 2.96Å; F800-V802 PolarHBondContact O-N 2.89Å; V802-G806 PolarHBondContact O-N 2.89Å
803K91.7Very high91.3Very high125 Ų12539.4 Ų39.454%0.54320%0.196SC..Hα-helixtrans-63.7-43.7177.6-70.9-71.9-176.4176.70111.5Y143 I799 F800 G806 L807Y143-K803 HydrophobicContact CD2-CB 3.89Å; Y143-K803 HydrophobicContact CE2-CB 3.78Å; I799-K803 WeakPolarHBondContact O-CB 3.46Å; I799-K803 VanDerWaalsContact O-CG 3.23Å; I799-K803 WeakPolarHBondContact O-CG 3.3Å; I799-K803 PolarHBondContact O-N 3.35Å; F800-K803 PolarHBondContact O-N 3.21Å; K803-G806 PolarHBondContact O-N 3.16Å; K803-L807 PolarHBondContact O-N 3.04Å
804L93.4Very high90.5Very high0 Ų040.7 Ų40.70%020%0.198CC..Hα-helixtrans-67.4-41.5179.3-173.558.9000111.8R140 L147 L447 L472 F800 A801 G806 L807 Y808R140-L804 HydrophobicContact CG-CD1 3.86Å; L147-L804 HydrophobicContact CD2-CD2 4.08Å; L447-L804 HydrophobicContact CD2-CD2 3.88Å; L472-L804 HydrophobicContact CD1-CB 4.12Å; L472-L804 HydrophobicContact CD1-CD2 3.96Å; L472-L804 HydrophobicContact CD1-CG 3.98Å; F800-L804 WeakPolarHBondContact O-CB 3.29Å; F800-L804 PolarHBondContact O-N 3.35Å; A801-L804 PolarHBondContact O-N 3.05Å; L804-G806 PolarHBondContact O-N 3.28Å; L804-L807 WeakPolarHBondContact O-CB 3.2Å; L804-L807 PolarHBondContact O-N 2.86Å; L804-Y808 HydrophobicContact CD1-CD1 4.22Å; L804-Y808 HydrophobicContact CD1-CE1 3.62Å; L804-Y808 HydrophobicContact CD1-CE2 4.21Å; L804-Y808 HydrophobicContact CD2-CE2 3.95Å; L804-Y808 HydrophobicContact CG-CD2 4.21Å; L804-Y808 HydrophobicContact CG-CE1 4.01Å; L804-Y808 HydrophobicContact CG-CE2 3.65Å; L804-Y808 PolarHBondContact O-N 3.08Å
805A92.1Very high89.4Confident0 Ų042.5 Ų42.50%021%0.211CC..Hα-helixtrans-58.4-36.517400000112.3A469 L472 L473 A801 Y808 R809A469-A805 HydrophobicContact CB-CB 4.08Å; A469-A805 WeakPolarHBondContact CB-O 3.44Å; L472-A805 HydrophobicContact CB-CB 4.27Å; L472-A805 HydrophobicContact CD1-CB 4.41Å; L473-A805 HydrophobicContact CD1-CB 4.21Å; L473-A805 HydrophobicContact CD2-CB 4.14Å; L473-A805 HydrophobicContact CG-CB 3.86Å; A801-A805 WeakPolarHBondContact O-CB 3.32Å; A801-A805 PolarHBondContact O-N 3.47Å; A805-Y808 PolarHBondContact O-N 2.94Å; A805-R809 WeakPolarHBondContact O-CG 3.36Å; A805-R809 PolarHBondContact O-N 3.03Å
806G88.3Confident88.1Confident29 Ų2946.2 Ų46.230%0.29922%0.22SC..Hα-helixtrans-61.8-40.8172.500000113.1V802 K803 L804V802-G806 PolarHBondContact O-N 2.89Å; K803-G806 PolarHBondContact O-N 3.16Å; L804-G806 PolarHBondContact O-N 3.28Å
807L89.1Confident86.7Confident13 Ų1349.7 Ų49.77%0.06824%0.236CC..Hα-helixtrans-72.7-29178.1-64.2177000113.1D136 K139 R140 Y143 K803 L804 K810D136-L807 HydrophobicContact CB-CD2 3.93Å; K139-L807 HydrophobicContact CB-CD1 3.88Å; R140-L807 HydrophobicContact CB-CD1 4.04Å; R140-L807 PolarHBondContact NH2-O 3.37Å; Y143-L807 HydrophobicContact CD2-CD1 3.79Å; Y143-L807 HydrophobicContact CE2-CD1 4.09Å; K803-L807 PolarHBondContact O-N 3.04Å; L804-L807 WeakPolarHBondContact O-CB 3.2Å; L804-L807 PolarHBondContact O-N 2.86Å; L807-K810 HydrophobicContact CD2-CD 4.49Å
808Y90.1Very high85Confident0 Ų056.3 Ų56.30%026%0.262CS..Hα-helixtrans-75.9-22.8178.2-74-13.7000113.6R140 T144 G450 T451 R465 L472 L804 A805 K810R140-Y808 HydrophobicContact CG-CD1 4.26Å; R140-Y808 HydrophobicContact CG-CE1 3.74Å; T144-Y808 PolarHBondContact OG1-OH 2.86Å; G450-Y808 VanDerWaalsContact C-CZ 3.42Å; G450-Y808 VanDerWaalsContact CA-CZ 3.42Å; G450-Y808 VanDerWaalsContact O-CE1 3.23Å; G450-Y808 WeakPolarHBondContact O-CE1 3.27Å; T451-Y808 WeakPolarHBondContact CG2-OH 3.21Å; R465-Y808 VanDerWaalsContact CB-O 3.29Å; R465-Y808 WeakPolarHBondContact CB-O 3.48Å; R465-Y808 WeakPolarHBondContact O-CB 3.47Å; L472-Y808 HydrophobicContact CD1-CD2 3.9Å; L472-Y808 HydrophobicContact CD1-CE2 3.68Å; L804-Y808 HydrophobicContact CD1-CD1 4.22Å; L804-Y808 HydrophobicContact CD1-CE1 3.62Å; L804-Y808 HydrophobicContact CD1-CE2 4.21Å; L804-Y808 HydrophobicContact CD2-CE2 3.95Å; L804-Y808 HydrophobicContact CG-CD2 4.21Å; L804-Y808 HydrophobicContact CG-CE1 4.01Å; L804-Y808 HydrophobicContact CG-CE2 3.65Å; L804-Y808 PolarHBondContact O-N 3.08Å; A805-Y808 PolarHBondContact O-N 2.94Å; Y808-K810 VanDerWaalsContact C-N 3.3Å
809R87.1Confident83.3Confident60 Ų6061 Ų6123%0.22628%0.284CS..THydrogen-bonded Turntrans-81.4-6.5176.4-71.4-179.6170.4-158.8-6.2114.1V128 A469 N470 A805V128-R809 HydrophobicContact CG1-CB 3.88Å; V128-R809 WeakPolarHBondContact CG1-O 3.49Å; V128-R809 HydrophobicContact CG2-CB 4.41Å; A469-R809 HydrophobicContact CB-CG 3.72Å; N470-R809 PolarHBondContact OD1-NH2 2.98Å; A805-R809 WeakPolarHBondContact O-CG 3.36Å; A805-R809 PolarHBondContact O-N 3.03Å
810K86.3Confident81.6Confident10 Ų1062 Ų624%0.04329%0.287CS..  trans-70.9136.5177.9-58.4-162.8159.8-155.40110.8Q129 V131 D132 D136 L807 Y808Q129-K810 WeakPolarHBondContact O-CG 3.26Å; V131-K810 PolarHBondContact O-NZ 3.41Å; D132-K810 WeakPolarHBondContact OD1-CB 3.32Å; D132-K810 WeakPolarHBondContact OD1-CD 3.45Å; D136-K810 IonicContact OD2-NZ 2.64Å; D136-K810 PolarHBondContact OD2-NZ 2.92Å; L807-K810 HydrophobicContact CD2-CD 4.49Å; Y808-K810 VanDerWaalsContact C-N 3.3Å
811T81Confident79.4Confident17 Ų1763.1 Ų63.110%0.10430%0.299CS..  trans-106.3-29.2-166.861.20000111.6F130 R455 Y457F130-T811 HydrophobicContact CD1-CG2 4.31Å; F130-T811 PolarHBondContact O-N 2.87Å; F130-T811 PolarHBondContact O-OG1 3.31Å; R455-T811 WeakPolarHBondContact CD-O 3.33Å; R455-T811 PolarHBondContact NH1-O 2.91Å; Y457-T811 HydrophobicContact CD2-CG2 3.23Å; Y457-T811 HydrophobicContact CE2-CG2 3.31Å; Y457-T811 HydrophobicContact CG-CG2 4.49Å
812E80.1Confident77.3Confident78 Ų7868.9 Ų68.936%0.36433%0.33SS..BIsolated β-bridgetrans-116.6149.8-172.9-69.4178.6-154.400113F130 V131 D132 R455 Y818F130-E812 PolarHBondContact O-N 3.39Å; V131-E812 HydrophobicContact CG1-CB 4.48Å; V131-E812 HydrophobicContact CG2-CB 4.2Å; D132-E812 PolarHBondContact N-O 3.27Å; D132-E812 VanDerWaalsContact N-O 3.12Å; R455-E812 VanDerWaalsContact CZ-C 3.48Å; R455-E812 VanDerWaalsContact NH2-C 3.26Å; R455-E812 PolarHBondContact NH2-O 3.23Å; E812-Y818 PolarHBondContact OE2-OH 2.85Å
813K79.5Confident75.5Confident147 Ų14776.8 Ų76.864%0.63936%0.358SS*.  trans-74.2151.3175.5-64.8-171.9-179.8165.10107.8R455 S815R455-K813 VanDerWaalsContact CZ-CG 3.41Å; R455-K813 VanDerWaalsContact NH2-CG 3.26Å; K813-S815 PolarHBondContact O-N 2.83Å; K813-S815 VanDerWaalsContact O-N 3.12Å
814Y78.9Confident73.8Confident69 Ų6978.4 Ų78.427%0.27137%0.371SS..  trans-54.9120.1165.2173-105.1000108.2D132 K134 E819D132-Y814 VanDerWaalsContact O-CA 3.27Å; D132-Y814 WeakPolarHBondContact O-CA 3.35Å; D132-Y814 VanDerWaalsContact O-CB 3.28Å; D132-Y814 WeakPolarHBondContact O-CB 3.41Å; D132-Y814 WeakPolarHBondContact O-CD2 3.41Å; K134-Y814 HydrophobicContact CB-CD2 4.33Å; K134-Y814 HydrophobicContact CB-CE1 4.23Å; K134-Y814 HydrophobicContact CB-CE2 3.94Å; K134-Y814 HydrophobicContact CG-CE1 4.27Å; Y814-E819 HydrophobicContact CE2-CG 4.16Å; Y814-E819 WeakPolarHBondContact CE2-OE1 3.44Å; Y814-E819 PolarHBondContact OH-OE2 3.15Å
815S74.3Confident72.1Confident39 Ų3981.7 Ų81.727%0.27339%0.394SS..  trans-114.2140.6163.6-169.60000108.3K813 D817 Y818K813-S815 PolarHBondContact O-N 2.83Å; K813-S815 VanDerWaalsContact O-N 3.12Å; S815-D817 PolarHBondContact O-N 3.12Å; S815-D817 PolarHBondContact OG-OD2 3.36Å; S815-Y818 PolarHBondContact O-N 3.16Å
816R68.6Low70.1Confident162 Ų16288.7 Ų88.761%0.61142%0.422SS*.G310 helixtrans-64-28.6179.7-159.1177.5179.4170.7-1.3111.7Y818 E819 E820R816-Y818 PolarHBondContact O-N 2.64Å; R816-E819 PolarHBondContact O-N 2.96Å; R816-E820 IonicContact NE-OE2 2.82Å; R816-E820 IonicContact NH2-OE1 3.18Å; R816-E820 PolarHBondContact O-N 3.27Å
817D67.4Low68.3Low111 Ų11194.2 Ų94.259%0.59444%0.439SS*.G310 helixtrans-57.4-21.2179.1-41.8-36.1000113.5S815 E820S815-D817 PolarHBondContact O-N 3.12Å; S815-D817 PolarHBondContact OG-OD2 3.36Å; D817-E820 CarbonylContact O-C 3.58Å
818Y61.3Low66.7Low139 Ų13996.7 Ų96.755%0.54547%0.468SS..G310 helixtrans-83.7-24.6178.3-72.8-67.6000114V131 E812 S815 R816V131-Y818 HydrophobicContact CG1-CD2 3.82Å; V131-Y818 HydrophobicContact CG1-CE2 3.94Å; V131-Y818 HydrophobicContact CG1-CG 4.49Å; V131-Y818 HydrophobicContact CG2-CD2 4.44Å; V131-Y818 HydrophobicContact CG2-CE1 4.46Å; V131-Y818 HydrophobicContact CG2-CE2 4.07Å; E812-Y818 PolarHBondContact OE2-OH 2.85Å; S815-Y818 PolarHBondContact O-N 3.16Å; R816-Y818 PolarHBondContact O-N 2.64Å
819E59.5Low64.8Low113 Ų113105.5 Ų105.553%0.52851%0.507SS..THydrogen-bonded Turntrans-90-34.5178-76.2180170.600111.7Y814 R816 P821Y814-E819 HydrophobicContact CE2-CG 4.16Å; Y814-E819 WeakPolarHBondContact CE2-OE1 3.44Å; Y814-E819 PolarHBondContact OH-OE2 3.15Å; R816-E819 PolarHBondContact O-N 2.96Å; E819-P821 WeakPolarHBondContact O-CD 3Å
820E58.4Low62.6Low115 Ų115111.6 Ų111.654%0.53753%0.531SS..SBendtrans-115.581.8173.5-70.7164.4-165.900107R816 D817 D822R816-E820 IonicContact NE-OE2 2.82Å; R816-E820 IonicContact NH2-OE1 3.18Å; R816-E820 PolarHBondContact O-N 3.27Å; D817-E820 CarbonylContact O-C 3.58Å; E820-D822 VanDerWaalsContact C-N 3.33Å; E820-D822 PolarHBondContact O-N 3.12Å
821P51.9Low60.3Low73 Ų73119.4 Ų119.447%0.47457%0.57SS.*  trans-63101.7175.825.5-31.7000107.5E819 Y823 Y826E819-P821 WeakPolarHBondContact O-CD 3Å; P821-Y823 VanDerWaalsContact C-N 3.31Å; P821-Y823 PolarHBondContact O-N 3.49Å; P821-Y826 HydrophobicContact CB-CD2 4.18Å; P821-Y826 HydrophobicContact CB-CE2 4.05Å
822D52.4Low58.3Low122 Ų122129.7 Ų129.765%0.65261%0.606SS**  trans-57.6103.4167.3-95-19.9000106.1E820 I824 S825E820-D822 VanDerWaalsContact C-N 3.33Å; E820-D822 PolarHBondContact O-N 3.12Å; D822-I824 PolarHBondContact O-N 3.29Å; D822-S825 PolarHBondContact O-N 2.94Å; D822-S825 PolarHBondContact O-OG 3.37Å
823Y55.1Low56.5Low190 Ų190130.9 Ų130.975%0.74562%0.621SS**THydrogen-bonded Turntrans-49.9-24.5-171.7-178.7-92.8000112.8P821P821-Y823 VanDerWaalsContact C-N 3.31Å; P821-Y823 PolarHBondContact O-N 3.49Å
824I54.5Low54.7Low160 Ų160129.9 Ų129.982%0.82163%0.63SS**THydrogen-bonded Turntrans-74.5-30.2-178.2-53.8175.5000112.3D822D822-I824 PolarHBondContact O-N 3.29Å
825S58Low52.9Low68 Ų68132.2 Ų132.248%0.47665%0.651SS.*THydrogen-bonded Turntrans-79.4-24.2-177.8660000113.6D822 H827 G828D822-S825 PolarHBondContact O-N 2.94Å; D822-S825 PolarHBondContact O-OG 3.37Å; S825-H827 VanDerWaalsContact C-N 3.29Å; S825-H827 PolarHBondContact O-N 3.07Å; S825-G828 PolarHBondContact O-N 2.72Å
826Y50.5Low51.2Low148 Ų148138.2 Ų138.258%0.5868%0.68SS**THydrogen-bonded Turntrans-65.8-27.5-172.6-122.5-91.9000113.9P821 Y830P821-Y826 HydrophobicContact CB-CD2 4.18Å; P821-Y826 HydrophobicContact CB-CE2 4.05Å; Y826-Y830 HydrophobicContact CE1-CE2 4.5Å
827H49.5Very low49.7Very low145 Ų145141 Ų14167%0.67169%0.692SS**THydrogen-bonded Turntrans-83.2-16.3180-94.2-68000114.5S825S825-H827 VanDerWaalsContact C-N 3.29Å; S825-H827 PolarHBondContact O-N 3.07Å
828G55.8Low48.2Very low65 Ų65144.1 Ų144.167%0.6770%0.703SS**THydrogen-bonded Turntrans-78.4-26.8-17600000114.7S825S825-G828 PolarHBondContact O-N 2.72Å
829F50.2Low47Very low185 Ų185144 Ų14481%0.81171%0.712SS**SBendtrans-101-16.6-165.4-93.5-84.9000116.2
830Y42.5Very low45.8Very low188 Ų188145.7 Ų145.774%0.73773%0.725SS**  trans-103.310.1-172.2-72.2-74.2000116.4Y826 R832Y826-Y830 HydrophobicContact CE1-CE2 4.5Å; Y830-R832 VanDerWaalsContact C-N 3.35Å; Y830-R832 PolarHBondContact O-N 3.22Å
831M37.3Very low44.6Very low174 Ų174144.5 Ų144.586%0.85773%0.729SS**  trans-91.568.9164.9-71.9-172.2-17700110.9
832R39.1Very low43.7Very low232 Ų232149.2 Ų149.288%0.87574%0.744SS**  trans-105.7109.2156.6-143.3177.5-153.1150.84.9106.9Y830Y830-R832 VanDerWaalsContact C-N 3.35Å; Y830-R832 PolarHBondContact O-N 3.22Å
833P41.3Very low42.8Very low103 Ų103152.8 Ų152.867%0.66975%0.754SS**  trans-65144.9-173.425.8-32000110.3T835P833-T835 PolarHBondContact O-N 3.09Å; P833-T835 VanDerWaalsContact O-N 3.09Å
834P43.2Very low41.9Very low127 Ų127151.8 Ų151.883%0.82576%0.758SS**  trans-67.4111.2-179.427.9-31.1000108.6D836P834-D836 PolarHBondContact O-N 2.99Å
835T41.2Very low40.9Very low118 Ų118149 Ų14972%0.72475%0.753SS**  trans-70.3117.5166.645.80000108.3P833 Y837P833-T835 PolarHBondContact O-N 3.09Å; P833-T835 VanDerWaalsContact O-N 3.09Å; T835-Y837 PolarHBondContact O-N 3.35Å
836D38.5Very low40Very low164 Ų164152.6 Ų152.688%0.87777%0.765SS**  trans-42.4102.5172.1-82.6-41.6000111.8P834 Q838P834-D836 PolarHBondContact O-N 2.99Å; D836-Q838 PolarHBondContact O-N 3.33Å
837Y36.3Very low39.3Very low222 Ų222153.9 Ų153.987%0.87178%0.776SS**  trans-88.294.5159.9-106.7-92.2000107T835 D839T835-Y837 PolarHBondContact O-N 3.35Å; Y837-D839 PolarHBondContact O-N 3.43Å
838Q36.1Very low38.4Very low175 Ų175158.7 Ų158.782%0.81879%0.789SS**  trans-57.6125.9169.5-95.3179.2-30.900110.3D836 N840D836-Q838 PolarHBondContact O-N 3.33Å; Q838-N840 PolarHBondContact O-N 3.02Å
839D35.7Very low37.8Very low137 Ų137166.9 Ų166.973%0.73382%0.815SS**  trans-62.586.8179.3-163.57.4000111.4Y837 S841Y837-D839 PolarHBondContact O-N 3.43Å; D839-S841 VanDerWaalsContact C-N 3.28Å; D839-S841 PolarHBondContact O-N 3.09Å
840N33.6Very low37.1Very low149 Ų149166 Ų16680%0.79782%0.815SS**  trans-90.373164.8-88-13.8000109.2Q838 H842Q838-N840 PolarHBondContact O-N 3.02Å; N840-H842 PolarHBondContact O-N 3.2Å
841S33.9Very low36.9Very low89 Ų89164.8 Ų164.862%0.62282%0.819SS**  trans-68.668.716966.70000111.1D839 K843D839-S841 VanDerWaalsContact C-N 3.28Å; D839-S841 PolarHBondContact O-N 3.09Å; S841-K843 PolarHBondContact O-N 3.04Å
842H33.7Very low36.8Very low172 Ų172164.3 Ų164.380%0.79682%0.817SS**  trans-82.392.1161.4-94.7-64.6000108.7N840 M844N840-H842 PolarHBondContact O-N 3.2Å; H842-M844 VanDerWaalsContact C-N 3.31Å; H842-M844 PolarHBondContact O-N 3Å
843K33.9Very low36.7Very low198 Ų198160.3 Ų160.386%0.86181%0.813SS**  trans-51.693.2161.2-80.1173.6173.41720109.1S841 S845S841-K843 PolarHBondContact O-N 3.04Å; K843-S845 VanDerWaalsContact C-N 3.28Å; K843-S845 PolarHBondContact O-N 3.29Å; K843-S845 VanDerWaalsContact O-N 3.09Å
844M34.5Very low36.4Very low168 Ų168163.9 Ų163.983%0.82882%0.822SS**  trans-7590.4158.6-82.6179.673.300107.4H842 I846H842-M844 VanDerWaalsContact C-N 3.31Å; H842-M844 PolarHBondContact O-N 3Å; M844-I846 VanDerWaalsContact C-N 3.32Å; M844-I846 PolarHBondContact O-N 3.22Å
845S35Very low36Very low101 Ų101166.3 Ų166.371%0.70682%0.822SS**  trans-60.796.8159.749.70000108.2K843 Q847K843-S845 VanDerWaalsContact C-N 3.28Å; K843-S845 PolarHBondContact O-N 3.29Å; K843-S845 VanDerWaalsContact O-N 3.09Å; S845-Q847 VanDerWaalsContact C-N 3.33Å; S845-Q847 PolarHBondContact O-N 2.86Å
846I38.7Very low35.6Very low145 Ų145169.8 Ų169.874%0.74483%0.829SS**  trans-7297.2167.2-65.2173.5000105.9M844M844-I846 VanDerWaalsContact C-N 3.32Å; M844-I846 PolarHBondContact O-N 3.22Å
847Q36.2Very low35.4Very low174 Ų174170.2 Ų170.281%0.81383%0.826SS**  trans-76.2123172.8-130.9171.6-14.400107.5S845 I849S845-Q847 VanDerWaalsContact C-N 3.33Å; S845-Q847 PolarHBondContact O-N 2.86Å; Q847-I849 PolarHBondContact O-N 2.86Å
848W30.8Very low35.3Very low247 Ų247165.9 Ų165.994%0.93682%0.822SS**  trans-59113.5174.3-71.877.1000110.9
849I41.6Very low35.2Very low236 Ų236165.1 Ų165.1100%1.2182%0.822SS**  trans-132.40143.7-59.8179000104.1Q847Q847-I849 PolarHBondContact O-N 2.86Å

Retrieved 849 of 849 residues in 2067.7 ms (Link to these results)

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