A0A096N4Z3_PAPAN Loading...

Olfactory receptor

Odorant receptor.

AlphaFold DB , UniProt , Accession A0A096N4Z3, Species PAPAN (Papio anubis, Olive baboon), Gene OR5B21, Length 310 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
1M33.6Very low63Low248 Ų248125.8 Ų125.8100%1.22263%0.627SS**  095.70-83.8173.3163.700106.4
2E37.2Very low64.7Low174 Ų174115.8 Ų115.881%0.81358%0.577SS**  trans-76.3129.5173.7-82.9177141.400109R4E2-R4 VanDerWaalsContact C-N 3.31Å; E2-R4 PolarHBondContact O-N 3.2Å
3N41.3Very low65.7Low166 Ų166110.9 Ų110.989%0.88855%0.554SS**  trans-60.392.6167.4-99.5-20.3000108.5T5N3-T5 PolarHBondContact O-N 3.13Å
4R52.6Low66.4Low173 Ų173104.1 Ų104.165%0.65353%0.525SS*.  trans-80.694.1167.2-75.9-177.3173.1-171.2-5.4107.7E2 E6E2-R4 VanDerWaalsContact C-N 3.31Å; E2-R4 PolarHBondContact O-N 3.2Å; R4-E6 PolarHBondContact O-N 3.29Å
5T58.4Low66.7Low127 Ų12799.3 Ų99.378%0.77950%0.501SS*.  trans-59.2116.5161.643.20000107.9N3 V7N3-T5 PolarHBondContact O-N 3.13Å; T5-V7 PolarHBondContact O-N 3.2Å
6E65.9Low67.1Low182 Ų18295.1 Ų95.185%0.8548%0.482SS*.  trans-58.8131.7173.3-76.2-175.2153.400109.5R4 T8R4-E6 PolarHBondContact O-N 3.29Å; E6-T8 PolarHBondContact O-N 3.29Å
7V73.4Confident67.5Low26 Ų2696.8 Ų96.816%0.15849%0.493CS..  trans-69.6115178.7176.10000108.8T5 E9 F10 F166 N170T5-V7 PolarHBondContact O-N 3.2Å; V7-E9 VanDerWaalsContact CG1-O 3.27Å; V7-E9 WeakPolarHBondContact CG1-O 3.31Å; V7-F10 HydrophobicContact CG1-CD1 4.31Å; V7-F10 HydrophobicContact CG1-CE1 3.93Å; V7-F10 HydrophobicContact CG1-CZ 4.05Å; V7-F166 HydrophobicContact CG2-CB 3.9Å; V7-N170 HydrophobicContact CG1-CB 4.37Å; V7-N170 WeakPolarHBondContact CG1-OD1 3.26Å; V7-N170 VanDerWaalsContact CG2-OD1 3.3Å; V7-N170 WeakPolarHBondContact CG2-OD1 3.31Å
8T78.6Confident68.1Low104 Ų10496 Ų9664%0.63849%0.49SS*.  trans-89.5-27.2-179.5530000112.6E6 Y92E6-T8 PolarHBondContact O-N 3.29Å; T8-Y92 PolarHBondContact O-N 2.87Å
9E84.8Confident68.6Low111 Ų11195.3 Ų95.352%0.51949%0.492SS..EExtended strand (participates in β ladder)trans-146.5152.2-171.5-60.2-175.7160.100111.9V7 I90V7-E9 VanDerWaalsContact CG1-O 3.27Å; V7-E9 WeakPolarHBondContact CG1-O 3.31Å; E9-I90 CarbonylContact C-O 3.58Å; E9-I90 WeakPolarHBondContact CA-O 3.37Å
10F84.2Confident69.1Low0 Ų096.8 Ų96.80%050%0.501CS..EExtended strand (participates in β ladder)trans-120.5151.4173.1-64.5-76.8000110.5V7 A89 I90 Y92 C95 F166 N170 I172 L182 L185V7-F10 HydrophobicContact CG1-CD1 4.31Å; V7-F10 HydrophobicContact CG1-CE1 3.93Å; V7-F10 HydrophobicContact CG1-CZ 4.05Å; F10-A89 CarbonylContact O-C 3.57Å; F10-A89 WeakPolarHBondContact O-CA 3.42Å; F10-I90 HydrophobicContact CB-CG2 3.91Å; F10-I90 PolarHBondContact N-O 3.27Å; F10-I90 PolarHBondContact O-N 3.48Å; F10-Y92 AromaticContact CE2-CD2 3.55Å; F10-Y92 HydrophobicContact CE2-CD2 3.55Å; F10-Y92 HydrophobicContact CE2-CE2 4.34Å; F10-Y92 HydrophobicContact CE2-CG 4.21Å; F10-Y92 AromaticContact CZ-CD2 3.89Å; F10-Y92 HydrophobicContact CZ-CD2 3.89Å; F10-Y92 HydrophobicContact CZ-CE2 4.39Å; F10-C95 HydrophobicContact CD2-CB 3.92Å; F10-C95 HydrophobicContact CE2-CB 4.32Å; F10-F166 HydrophobicContact CE1-CD1 4.44Å; F10-F166 HydrophobicContact CE1-CG 4.26Å; F10-F166 HydrophobicContact CZ-CD2 4.04Å; F10-F166 HydrophobicContact CZ-CE2 4.21Å; F10-F166 HydrophobicContact CZ-CG 4.23Å; F10-N170 CarbonylContact C-O 3.53Å; F10-N170 WeakPolarHBondContact CA-O 3.42Å; F10-N170 HydrophobicContact CD1-CB 4.35Å; F10-I172 HydrophobicContact CB-CD1 3.65Å; F10-I172 HydrophobicContact CB-CG1 4.17Å; F10-I172 HydrophobicContact CD1-CD1 3.98Å; F10-I172 HydrophobicContact CD1-CG1 4.15Å; F10-I172 HydrophobicContact CD2-CD1 4.39Å; F10-I172 HydrophobicContact CG-CD1 3.77Å; F10-I172 HydrophobicContact CG-CG1 4.36Å; F10-L182 HydrophobicContact CE1-CD2 4.45Å; F10-L182 HydrophobicContact CZ-CD2 4.35Å; F10-L185 HydrophobicContact CD1-CD1 4.45Å
11I83.3Confident69.5Low73 Ų7395.6 Ų95.637%0.37450%0.496SS..EExtended strand (participates in β ladder)trans-110116.2176.7-57.3174.9000108.6L13 K88 N170 E171 I172I11-L13 PolarHBondContact O-N 3.28Å; I11-K88 HydrophobicContact CG2-CB 4.01Å; I11-N170 PolarHBondContact N-O 3.04Å; I11-E171 HydrophobicContact CB-CG 4.34Å; I11-E171 CarbonylContact O-C 3.58Å; I11-E171 WeakPolarHBondContact O-CA 3.41Å; I11-I172 PolarHBondContact O-N 2.95Å
12L82.8Confident71.6Confident5 Ų586.2 Ų86.23%0.02645%0.449CS..EExtended strand (participates in β ladder)trans-82.7106.5177.2-63.7169.2000109.6G14 K78 K88 I90 I172L12-G14 PolarHBondContact O-N 3.02Å; L12-K78 HydrophobicContact CD1-CG 4.42Å; L12-K88 PolarHBondContact N-O 3.41Å; L12-K88 VanDerWaalsContact O-CB 3.29Å; L12-K88 WeakPolarHBondContact O-CB 3.48Å; L12-K88 VanDerWaalsContact O-CD 3.3Å; L12-K88 WeakPolarHBondContact O-CD 3.5Å; L12-K88 WeakPolarHBondContact O-CG 3.26Å; L12-I90 HydrophobicContact CD1-CB 4.37Å; L12-I90 HydrophobicContact CD1-CG2 4.11Å; L12-I90 HydrophobicContact CD2-CG2 4.45Å; L12-I90 HydrophobicContact CG-CG2 4.02Å; L12-I172 HydrophobicContact CD2-CB 4.02Å; L12-I172 HydrophobicContact CD2-CD1 4.16Å; L12-I172 HydrophobicContact CD2-CG2 3.96Å
13L78.6Confident73.6Confident53 Ų5382.8 Ų82.828%0.27744%0.435SS..  trans-60.5-24.6-176.9-67.3179000112.9I11 K88 E171 I172 N173I11-L13 PolarHBondContact O-N 3.28Å; L13-K88 PolarHBondContact O-NZ 2.71Å; L13-E171 HydrophobicContact CD1-CB 4.26Å; L13-E171 HydrophobicContact CD2-CB 4.23Å; L13-E171 HydrophobicContact CD2-CG 4.27Å; L13-E171 HydrophobicContact CG-CB 4.19Å; L13-I172 PolarHBondContact N-O 3.44Å; L13-N173 HydrophobicContact CD1-CB 4.01Å
14G74.4Confident75.5Confident15 Ų1580 Ų8016%0.15542%0.42CS..  trans78.5-165.9177.600000113L12 N174 K270L12-G14 PolarHBondContact O-N 3.02Å; G14-N174 PolarHBondContact N-O 3.12Å; G14-K270 WeakPolarHBondContact O-CE 3.49Å; G14-K270 PolarHBondContact O-NZ 2.96Å
15L71.6Confident76.8Confident32 Ų3273.4 Ų73.417%0.16840%0.397CS..SBendtrans-90.6-29.3-173-72.1170000114L25 F29 F175 K270 V274L15-L25 HydrophobicContact CB-CD1 3.7Å; L15-L25 HydrophobicContact CD1-CD1 4.15Å; L15-L25 HydrophobicContact CD1-CD2 4.01Å; L15-F29 HydrophobicContact CD1-CE2 3.39Å; L15-F29 HydrophobicContact CD1-CZ 3.68Å; L15-F175 HydrophobicContact CD1-CD1 4.34Å; L15-F175 HydrophobicContact CD2-CD1 3.6Å; L15-F175 HydrophobicContact CD2-CE1 4.08Å; L15-F175 HydrophobicContact CD2-CG 4.46Å; L15-F175 HydrophobicContact CG-CB 4.22Å; L15-F175 HydrophobicContact CG-CD1 3.89Å; L15-F175 HydrophobicContact CG-CG 4.27Å; L15-K270 HydrophobicContact CD2-CB 3.85Å; L15-K270 HydrophobicContact CD2-CG 4.48Å; L15-V274 HydrophobicContact CD1-CG2 3.8Å; L15-V274 HydrophobicContact CD2-CG2 3.83Å; L15-V274 HydrophobicContact CG-CG2 4.48Å
16T73Confident77.9Confident32 Ų3269.2 Ų69.220%0.19637%0.37CS..  trans-163.3153-179.5-167.50000111.6N18 L21 Q22 L25T16-N18 PolarHBondContact OG1-N 2.76Å; T16-L21 HydrophobicContact CG2-CB 3.79Å; T16-L21 HydrophobicContact CG2-CD2 3.86Å; T16-L21 HydrophobicContact CG2-CG 3.8Å; T16-Q22 HydrophobicContact CG2-CG 3.75Å; T16-Q22 PolarHBondContact O-NE2 2.71Å; T16-L25 HydrophobicContact CG2-CD1 3.61Å
17D74.4Confident78.7Confident124 Ų12465.6 Ų65.666%0.66336%0.355SS*.SBendtrans-100.70.4170.6-60.2-47.4000112.7P19 K88D17-P19 WeakPolarHBondContact O-CD 3.43Å; D17-K88 IonicContact OD1-NZ 3.4Å; D17-K88 PolarHBondContact OD1-NZ 2.9Å
18N77.9Confident79.1Confident83 Ų8366.2 Ų66.244%0.44436%0.363SS..  trans-77.9117.8175.4-175.8-32.2000110.4T16 N20 L21 Q22T16-N18 PolarHBondContact OG1-N 2.76Å; N18-N20 VanDerWaalsContact C-N 3.33Å; N18-N20 PolarHBondContact O-N 3.16Å; N18-N20 PolarHBondContact OD1-N 3.33Å; N18-N20 VanDerWaalsContact OD1-N 3.1Å; N18-L21 HydrophobicContact CB-CB 4.09Å; N18-L21 PolarHBondContact O-N 2.9Å; N18-L21 VanDerWaalsContact O-N 3.08Å; N18-Q22 WeakPolarHBondContact O-CG 3.39Å; N18-Q22 PolarHBondContact O-N 3.07Å
19P77.4Confident79.1Confident82 Ų8261.4 Ų61.453%0.53233%0.333SS..Hα-helixtrans-62.8-34.6-173.323.6-33.5000113.5D17 L21 Q22 I23D17-P19 WeakPolarHBondContact O-CD 3.43Å; P19-L21 VanDerWaalsContact C-N 3.34Å; P19-L21 PolarHBondContact O-N 3.22Å; P19-Q22 PolarHBondContact O-N 3.27Å; P19-I23 WeakPolarHBondContact O-CG1 3.25Å; P19-I23 PolarHBondContact O-N 3.36Å
20N78.6Confident79.1Confident126 Ų12659.6 Ų59.667%0.67433%0.327SS*.Hα-helixtrans-67.9-37.2177.1-68.5-35.9000111.5N18 L24N18-N20 VanDerWaalsContact C-N 3.33Å; N18-N20 PolarHBondContact O-N 3.16Å; N18-N20 PolarHBondContact OD1-N 3.33Å; N18-N20 VanDerWaalsContact OD1-N 3.1Å; N20-L24 PolarHBondContact O-N 3.28Å
21L78Confident79.1Confident72 Ų7265.9 Ų65.938%0.37735%0.354SS..Hα-helixtrans-75.8-31.8177.9-170.961.4000111.6T16 N18 P19 I23 L24 L25T16-L21 HydrophobicContact CG2-CB 3.79Å; T16-L21 HydrophobicContact CG2-CD2 3.86Å; T16-L21 HydrophobicContact CG2-CG 3.8Å; N18-L21 HydrophobicContact CB-CB 4.09Å; N18-L21 PolarHBondContact O-N 2.9Å; N18-L21 VanDerWaalsContact O-N 3.08Å; P19-L21 VanDerWaalsContact C-N 3.34Å; P19-L21 PolarHBondContact O-N 3.22Å; L21-I23 VanDerWaalsContact C-N 3.35Å; L21-I23 PolarHBondContact O-N 2.92Å; L21-L24 HydrophobicContact CD1-CD2 4.01Å; L21-L24 PolarHBondContact O-N 2.85Å; L21-L25 HydrophobicContact CG-CD1 4.17Å; L21-L25 HydrophobicContact CG-CG 4.39Å; L21-L25 WeakPolarHBondContact O-CB 3.45Å; L21-L25 VanDerWaalsContact O-CG 3.25Å; L21-L25 WeakPolarHBondContact O-CG 3.35Å; L21-L25 PolarHBondContact O-N 3.42Å
22Q77.9Confident78.9Confident51 Ų5163.4 Ų63.424%0.23834%0.342CS..Hα-helixtrans-60.7-41.5173-74.9179.9-12.600112.3T16 N18 P19 L25 L26 L83T16-Q22 HydrophobicContact CG2-CG 3.75Å; T16-Q22 PolarHBondContact O-NE2 2.71Å; N18-Q22 WeakPolarHBondContact O-CG 3.39Å; N18-Q22 PolarHBondContact O-N 3.07Å; P19-Q22 PolarHBondContact O-N 3.27Å; Q22-L25 PolarHBondContact O-N 2.8Å; Q22-L26 VanDerWaalsContact O-CB 3.3Å; Q22-L26 WeakPolarHBondContact O-CB 3.34Å; Q22-L26 PolarHBondContact O-N 2.65Å; Q22-L83 HydrophobicContact CB-CD2 4.27Å; Q22-L83 HydrophobicContact CG-CD2 4.17Å
23I79.3Confident79Confident101 Ų10165.7 Ų65.752%0.51835%0.35SS..Hα-helixtrans-63-44.6175.5-64.6168.1000110.5P19 L21 L25 L26 L27P19-I23 WeakPolarHBondContact O-CG1 3.25Å; P19-I23 PolarHBondContact O-N 3.36Å; L21-I23 VanDerWaalsContact C-N 3.35Å; L21-I23 PolarHBondContact O-N 2.92Å; I23-L25 PolarHBondContact O-N 3.48Å; I23-L26 PolarHBondContact O-N 2.89Å; I23-L27 HydrophobicContact CG2-CD1 4.26Å; I23-L27 WeakPolarHBondContact O-CG 3.49Å; I23-L27 PolarHBondContact O-N 3.5Å
24L80.4Confident79.3Confident109 Ų10967.1 Ų67.157%0.57136%0.358SS*.Hα-helixtrans-61.3-44.7176.9-179.163000111.6N20 L21 L27 A28N20-L24 PolarHBondContact O-N 3.28Å; L21-L24 HydrophobicContact CD1-CD2 4.01Å; L21-L24 PolarHBondContact O-N 2.85Å; L24-L27 PolarHBondContact O-N 2.93Å; L24-A28 WeakPolarHBondContact O-CB 3.4Å; L24-A28 PolarHBondContact O-N 3.19Å
25L79.1Confident79.7Confident34 Ų3468.5 Ų68.518%0.17836%0.362CS..Hα-helixtrans-64.8-42177.4-71.8170.2000111.6L15 T16 L21 Q22 I23 L27 A28 F29 L83L15-L25 HydrophobicContact CB-CD1 3.7Å; L15-L25 HydrophobicContact CD1-CD1 4.15Å; L15-L25 HydrophobicContact CD1-CD2 4.01Å; T16-L25 HydrophobicContact CG2-CD1 3.61Å; L21-L25 HydrophobicContact CG-CD1 4.17Å; L21-L25 HydrophobicContact CG-CG 4.39Å; L21-L25 WeakPolarHBondContact O-CB 3.45Å; L21-L25 VanDerWaalsContact O-CG 3.25Å; L21-L25 WeakPolarHBondContact O-CG 3.35Å; L21-L25 PolarHBondContact O-N 3.42Å; Q22-L25 PolarHBondContact O-N 2.8Å; I23-L25 PolarHBondContact O-N 3.48Å; L25-L27 VanDerWaalsContact C-N 3.35Å; L25-L27 PolarHBondContact O-N 2.94Å; L25-A28 PolarHBondContact O-N 3.37Å; L25-F29 HydrophobicContact CD2-CE2 4.49Å; L25-F29 WeakPolarHBondContact O-CB 3.43Å; L25-F29 VanDerWaalsContact O-CD2 3.3Å; L25-F29 WeakPolarHBondContact O-CD2 3.43Å; L25-F29 PolarHBondContact O-N 2.83Å; L25-L83 HydrophobicContact CB-CD1 4.3Å
26L81.8Confident80.3Confident39 Ų3967.1 Ų67.120%0.20435%0.354CS..Hα-helixtrans-56.8-50175.8177.169.7000110.8Q22 I23 A28 L30 V80 L83 Q84Q22-L26 VanDerWaalsContact O-CB 3.3Å; Q22-L26 WeakPolarHBondContact O-CB 3.34Å; Q22-L26 PolarHBondContact O-N 2.65Å; I23-L26 PolarHBondContact O-N 2.89Å; L26-A28 VanDerWaalsContact C-N 3.34Å; L26-A28 PolarHBondContact O-N 2.95Å; L26-L30 VanDerWaalsContact O-CB 3.25Å; L26-L30 WeakPolarHBondContact O-CB 3.49Å; L26-L30 PolarHBondContact O-N 3.06Å; L26-V80 HydrophobicContact CD1-CB 4.44Å; L26-V80 HydrophobicContact CD1-CG1 3.85Å; L26-L83 HydrophobicContact CB-CB 4.24Å; L26-L83 HydrophobicContact CB-CD1 4.32Å; L26-L83 HydrophobicContact CD1-CB 3.84Å; L26-Q84 HydrophobicContact CD1-CB 4.47Å
27L83.4Confident81Confident105 Ų10569 Ų6955%0.5536%0.363SS..Hα-helixtrans-62.1-42.4177.5-69173.5000111.6I23 L24 L25 F31I23-L27 HydrophobicContact CG2-CD1 4.26Å; I23-L27 WeakPolarHBondContact O-CG 3.49Å; I23-L27 PolarHBondContact O-N 3.5Å; L24-L27 PolarHBondContact O-N 2.93Å; L25-L27 VanDerWaalsContact C-N 3.35Å; L25-L27 PolarHBondContact O-N 2.94Å; L27-F31 WeakPolarHBondContact O-CB 3.3Å; L27-F31 PolarHBondContact O-N 3.4Å
28A80.8Confident81.6Confident39 Ų3969 Ų6932%0.32236%0.362SS..Hα-helixtrans-63.9-50178.300000112.2L24 L25 L26 L30 F31 I32L24-A28 WeakPolarHBondContact O-CB 3.4Å; L24-A28 PolarHBondContact O-N 3.19Å; L25-A28 PolarHBondContact O-N 3.37Å; L26-A28 VanDerWaalsContact C-N 3.34Å; L26-A28 PolarHBondContact O-N 2.95Å; A28-L30 PolarHBondContact O-N 3.43Å; A28-F31 PolarHBondContact O-N 2.82Å; A28-I32 WeakPolarHBondContact O-CG1 3.48Å; A28-I32 PolarHBondContact O-N 3.2Å
29F80.4Confident81.9Confident3 Ų366.3 Ų66.31%0.01335%0.354CS..Hα-helixtrans-62.6-42.2178.8-90.4-95.9000112L15 L25 I32 Y33 T79 V80 F175 V274 V278L15-F29 HydrophobicContact CD1-CE2 3.39Å; L15-F29 HydrophobicContact CD1-CZ 3.68Å; L25-F29 HydrophobicContact CD2-CE2 4.49Å; L25-F29 WeakPolarHBondContact O-CB 3.43Å; L25-F29 VanDerWaalsContact O-CD2 3.3Å; L25-F29 WeakPolarHBondContact O-CD2 3.43Å; L25-F29 PolarHBondContact O-N 2.83Å; F29-I32 PolarHBondContact O-N 3.16Å; F29-Y33 VanDerWaalsContact O-CB 3.23Å; F29-Y33 WeakPolarHBondContact O-CB 3.35Å; F29-Y33 PolarHBondContact O-N 2.96Å; F29-T79 HydrophobicContact CD1-CG2 4Å; F29-T79 HydrophobicContact CE1-CG2 3.84Å; F29-T79 HydrophobicContact CG-CG2 4.39Å; F29-T79 HydrophobicContact CZ-CG2 4.13Å; F29-V80 HydrophobicContact CB-CG2 4.13Å; F29-F175 HydrophobicContact CE1-CD2 4.25Å; F29-F175 HydrophobicContact CE1-CE2 4.01Å; F29-F175 HydrophobicContact CZ-CD2 4.24Å; F29-F175 HydrophobicContact CZ-CE2 4.1Å; F29-F175 HydrophobicContact CZ-CZ 4.42Å; F29-V274 HydrophobicContact CE2-CG2 4.43Å; F29-V274 HydrophobicContact CZ-CG1 4.34Å; F29-V274 HydrophobicContact CZ-CG2 4.01Å; F29-V278 HydrophobicContact CD1-CG1 4.49Å; F29-V278 HydrophobicContact CD1-CG2 4.21Å; F29-V278 HydrophobicContact CE1-CG2 3.68Å; F29-V278 HydrophobicContact CZ-CG2 4.48Å
30L83.9Confident82.4Confident74 Ų7462.5 Ų62.539%0.38733%0.329SS..Hα-helixtrans-62.7-46.8176.3-177.366.8000111.1L26 A28 Y33 L34L26-L30 VanDerWaalsContact O-CB 3.25Å; L26-L30 WeakPolarHBondContact O-CB 3.49Å; L26-L30 PolarHBondContact O-N 3.06Å; A28-L30 PolarHBondContact O-N 3.43Å; L30-Y33 PolarHBondContact O-N 3.18Å; L30-L34 HydrophobicContact CG-CD1 4.23Å; L30-L34 WeakPolarHBondContact O-CB 3.45Å; L30-L34 VanDerWaalsContact O-CG 3.3Å; L30-L34 WeakPolarHBondContact O-CG 3.43Å; L30-L34 PolarHBondContact O-N 3.18Å
31F83.1Confident82.9Confident131 Ų13157.6 Ų57.658%0.57531%0.308SS*.Hα-helixtrans-60.9-46.8178.3-179.9-105.6000111.7L27 A28 L34 I35L27-F31 WeakPolarHBondContact O-CB 3.3Å; L27-F31 PolarHBondContact O-N 3.4Å; A28-F31 PolarHBondContact O-N 2.82Å; F31-L34 PolarHBondContact O-N 3.42Å; F31-I35 HydrophobicContact CD1-CD1 3.79Å; F31-I35 HydrophobicContact CD2-CD1 4.45Å; F31-I35 HydrophobicContact CE1-CD1 3.24Å; F31-I35 HydrophobicContact CE1-CG1 4.42Å; F31-I35 HydrophobicContact CE2-CD1 3.99Å; F31-I35 HydrophobicContact CG-CD1 4.38Å; F31-I35 HydrophobicContact CZ-CD1 3.38Å; F31-I35 HydrophobicContact CZ-CG1 4.37Å; F31-I35 WeakPolarHBondContact O-CG1 3.16Å; F31-I35 PolarHBondContact O-N 3.46Å
32I80.1Confident83.3Confident22 Ų2255.4 Ų55.411%0.11330%0.303CS..Hα-helixtrans-63.7-45.1178.3-61.4162.7000110.4A28 F29 L34 I35 T36 V278 M282A28-I32 WeakPolarHBondContact O-CG1 3.48Å; A28-I32 PolarHBondContact O-N 3.2Å; F29-I32 PolarHBondContact O-N 3.16Å; I32-L34 VanDerWaalsContact C-N 3.33Å; I32-L34 PolarHBondContact O-N 3.05Å; I32-I35 PolarHBondContact O-N 3.48Å; I32-T36 PolarHBondContact O-N 3.25Å; I32-T36 PolarHBondContact O-OG1 3.33Å; I32-T36 VanDerWaalsContact O-OG1 3.05Å; I32-V278 HydrophobicContact CB-CG1 3.72Å; I32-V278 HydrophobicContact CD1-CG1 3.77Å; I32-V278 HydrophobicContact CG1-CG1 4.34Å; I32-V278 HydrophobicContact CG2-CG1 3.27Å; I32-V278 VanDerWaalsContact CG2-O 3.3Å; I32-V278 WeakPolarHBondContact CG2-O 3.43Å; I32-M282 HydrophobicContact CB-SD 4.2Å; I32-M282 HydrophobicContact CG1-SD 3.91Å; I32-M282 HydrophobicContact CG2-CB 3.7Å; I32-M282 HydrophobicContact CG2-CG 3.87Å; I32-M282 HydrophobicContact CG2-SD 3.69Å
33Y84.1Confident83.7Confident52 Ų5253.1 Ų53.120%0.20429%0.293CS..Hα-helixtrans-58.6-44178.2-178.8-117000112.2F29 L30 T36 L37 S73 A76F29-Y33 VanDerWaalsContact O-CB 3.23Å; F29-Y33 WeakPolarHBondContact O-CB 3.35Å; F29-Y33 PolarHBondContact O-N 2.96Å; L30-Y33 PolarHBondContact O-N 3.18Å; Y33-T36 PolarHBondContact O-N 3.09Å; Y33-L37 HydrophobicContact CE1-CD1 4.33Å; Y33-L37 WeakPolarHBondContact O-CB 3.27Å; Y33-L37 PolarHBondContact O-N 3.34Å; Y33-S73 PolarHBondContact OH-OG 3.39Å; Y33-A76 HydrophobicContact CD2-CB 3.61Å; Y33-A76 HydrophobicContact CE2-CB 4.29Å; Y33-A76 HydrophobicContact CG-CB 3.97Å
34L85.3Confident84.2Confident83 Ų8350.3 Ų50.344%0.43528%0.278SS..Hα-helixtrans-63.6-42.3176.5-71.8173.1000112.2L30 F31 I32 L37 L38L30-L34 HydrophobicContact CG-CD1 4.23Å; L30-L34 WeakPolarHBondContact O-CB 3.45Å; L30-L34 VanDerWaalsContact O-CG 3.3Å; L30-L34 WeakPolarHBondContact O-CG 3.43Å; L30-L34 PolarHBondContact O-N 3.18Å; F31-L34 PolarHBondContact O-N 3.42Å; I32-L34 VanDerWaalsContact C-N 3.33Å; I32-L34 PolarHBondContact O-N 3.05Å; L34-L37 PolarHBondContact O-N 3.2Å; L34-L38 WeakPolarHBondContact O-CB 3.3Å; L34-L38 VanDerWaalsContact O-CG 3.28Å; L34-L38 WeakPolarHBondContact O-CG 3.15Å; L34-L38 PolarHBondContact O-N 3.44Å
35I82.6Confident84.6Confident45 Ų4549.2 Ų49.223%0.23128%0.275CS..Hα-helixtrans-63-44.9175.4-70.6176.2000110.7F31 I32 L37 G39 M282F31-I35 HydrophobicContact CD1-CD1 3.79Å; F31-I35 HydrophobicContact CD2-CD1 4.45Å; F31-I35 HydrophobicContact CE1-CD1 3.24Å; F31-I35 HydrophobicContact CE1-CG1 4.42Å; F31-I35 HydrophobicContact CE2-CD1 3.99Å; F31-I35 HydrophobicContact CG-CD1 4.38Å; F31-I35 HydrophobicContact CZ-CD1 3.38Å; F31-I35 HydrophobicContact CZ-CG1 4.37Å; F31-I35 WeakPolarHBondContact O-CG1 3.16Å; F31-I35 PolarHBondContact O-N 3.46Å; I32-I35 PolarHBondContact O-N 3.48Å; I35-L37 VanDerWaalsContact C-N 3.32Å; I35-L37 PolarHBondContact O-N 2.96Å; I35-G39 WeakPolarHBondContact O-CA 3.22Å; I35-G39 PolarHBondContact O-N 3.44Å; I35-M282 HydrophobicContact CB-CG 4.01Å; I35-M282 HydrophobicContact CD1-SD 4.32Å; I35-M282 HydrophobicContact CG2-CG 3.49Å; I35-M282 VanDerWaalsContact CG2-CG 3.49Å; I35-M282 HydrophobicContact CG2-SD 4.34Å
36T84.8Confident84.9Confident2 Ų248.3 Ų48.31%0.01227%0.271CS..Hα-helixtrans-61.5-43.8178.1-59.20000110.7I32 Y33 N40 S72 P281 M282I32-T36 PolarHBondContact O-N 3.25Å; I32-T36 PolarHBondContact O-OG1 3.33Å; I32-T36 VanDerWaalsContact O-OG1 3.05Å; Y33-T36 PolarHBondContact O-N 3.09Å; T36-N40 VanDerWaalsContact O-CB 3.3Å; T36-N40 WeakPolarHBondContact O-CB 2.98Å; T36-N40 PolarHBondContact O-N 3.21Å; T36-N40 PolarHBondContact O-ND2 2.67Å; T36-S72 WeakPolarHBondContact CG2-OG 3.5Å; T36-P281 HydrophobicContact CG2-CB 4.04Å; T36-M282 WeakPolarHBondContact OG1-CA 3.46Å
37L87.1Confident85.1Confident73 Ų7346.7 Ų46.738%0.38226%0.262SS..Hα-helixtrans-64.1-50.5180-166.6123.7000112.1Y33 L34 I35 G41 L69Y33-L37 HydrophobicContact CE1-CD1 4.33Å; Y33-L37 WeakPolarHBondContact O-CB 3.27Å; Y33-L37 PolarHBondContact O-N 3.34Å; L34-L37 PolarHBondContact O-N 3.2Å; I35-L37 VanDerWaalsContact C-N 3.32Å; I35-L37 PolarHBondContact O-N 2.96Å; L37-G41 WeakPolarHBondContact O-CA 3.49Å; L37-G41 PolarHBondContact O-N 3.46Å; L37-L69 HydrophobicContact CB-CD2 4.46Å
38L86.8Confident85.3Confident124 Ų12447.5 Ų47.565%0.64926%0.263SS*.Hα-helixtrans-69.5-40.6179.5-67.6172.7000112.1L34 G42L34-L38 WeakPolarHBondContact O-CB 3.3Å; L34-L38 VanDerWaalsContact O-CG 3.28Å; L34-L38 WeakPolarHBondContact O-CG 3.15Å; L34-L38 PolarHBondContact O-N 3.44Å; L38-G42 VanDerWaalsContact O-CA 3.3Å; L38-G42 WeakPolarHBondContact O-CA 3.39Å; L38-G42 PolarHBondContact O-N 2.84Å
39G85.4Confident85.4Confident26 Ų2649.6 Ų49.627%0.26828%0.275SS..Hα-helixtrans-67.4-55.8-178.200000111.9I35 M43I35-G39 WeakPolarHBondContact O-CA 3.22Å; I35-G39 PolarHBondContact O-N 3.44Å; G39-M43 VanDerWaalsContact O-CB 3.31Å; G39-M43 WeakPolarHBondContact O-CB 3.45Å; G39-M43 PolarHBondContact O-N 3.09Å
40N88.6Confident85.5Confident1 Ų150.4 Ų50.41%0.00528%0.279CS..Hα-helixtrans-74.7-40.3-178.7-74.3-58.6000112.2T36 M43 M44 S65 L69 P281T36-N40 VanDerWaalsContact O-CB 3.3Å; T36-N40 WeakPolarHBondContact O-CB 2.98Å; T36-N40 PolarHBondContact O-N 3.21Å; T36-N40 PolarHBondContact O-ND2 2.67Å; N40-M43 PolarHBondContact O-N 3.09Å; N40-M44 WeakPolarHBondContact O-CG 3.06Å; N40-M44 PolarHBondContact O-N 2.93Å; N40-S65 WeakPolarHBondContact OD1-CA 3.48Å; N40-S65 WeakPolarHBondContact OD1-CB 3.45Å; N40-S65 PolarHBondContact OD1-OG 2.98Å; N40-L69 HydrophobicContact CB-CD1 4.27Å; N40-L69 HydrophobicContact CB-CD2 3.92Å; N40-L69 HydrophobicContact CB-CG 3.78Å; N40-P281 PolarHBondContact ND2-O 3.26Å; N40-P281 VanDerWaalsContact ND2-O 3.08Å
41G88.5Confident85.5Confident23 Ų2350.8 Ų50.824%0.23729%0.289CS..Hα-helixtrans-62.3-44.9173.600000112L37 M43 M44 V45L37-G41 WeakPolarHBondContact O-CA 3.49Å; L37-G41 PolarHBondContact O-N 3.46Å; G41-M43 PolarHBondContact O-N 3.29Å; G41-M44 PolarHBondContact O-N 2.94Å; G41-V45 WeakPolarHBondContact O-CG2 3.41Å; G41-V45 PolarHBondContact O-N 3.45Å
42G86.9Confident85.5Confident27 Ų2751.1 Ų51.128%0.27829%0.291SS..Hα-helixtrans-60.9-41.9173.900000112.5L38 M44 V45 I46L38-G42 VanDerWaalsContact O-CA 3.3Å; L38-G42 WeakPolarHBondContact O-CA 3.39Å; L38-G42 PolarHBondContact O-N 2.84Å; G42-M44 PolarHBondContact O-N 3.3Å; G42-V45 PolarHBondContact O-N 3.23Å; G42-I46 WeakPolarHBondContact O-CB 3.18Å; G42-I46 WeakPolarHBondContact O-CD1 3.31Å; G42-I46 WeakPolarHBondContact O-CG1 3.49Å; G42-I46 PolarHBondContact O-N 3.14Å
43M86.3Confident85.6Confident3 Ų350.2 Ų50.22%0.01529%0.287CS..Hα-helixtrans-60-45.7176.9-168.668.9-160.600111.9G39 N40 G41 I46 I47 Y58 L61 V295G39-M43 VanDerWaalsContact O-CB 3.31Å; G39-M43 WeakPolarHBondContact O-CB 3.45Å; G39-M43 PolarHBondContact O-N 3.09Å; N40-M43 PolarHBondContact O-N 3.09Å; G41-M43 PolarHBondContact O-N 3.29Å; M43-I46 PolarHBondContact O-N 2.88Å; M43-I47 HydrophobicContact CE-CD1 3.65Å; M43-I47 HydrophobicContact CE-CG1 3.87Å; M43-I47 HydrophobicContact CG-CD1 3.92Å; M43-I47 WeakPolarHBondContact O-CD1 3.48Å; M43-I47 VanDerWaalsContact O-CG1 3.27Å; M43-I47 WeakPolarHBondContact O-CG1 3.29Å; M43-I47 PolarHBondContact O-N 3.09Å; M43-Y58 HydrophobicContact CE-CD1 4.12Å; M43-Y58 HydrophobicContact CE-CE1 4.24Å; M43-L61 HydrophobicContact CE-CD2 3.32Å; M43-L61 HydrophobicContact CE-CG 4Å; M43-L61 HydrophobicContact CG-CG 4.4Å; M43-L61 HydrophobicContact SD-CD2 4.49Å; M43-V295 HydrophobicContact CE-CG1 4.05Å; M43-V295 HydrophobicContact CE-CG2 3.59Å; M43-V295 HydrophobicContact SD-CG1 3.76Å; M43-V295 HydrophobicContact SD-CG2 4.36Å
44M89.7Confident85.7Confident41 Ų4153.5 Ų53.520%0.20230%0.304CS..Hα-helixtrans-59.9-48.4175.4-68.1177.370.500111.1N40 G41 G42 I46 I47 H48 F66 L69N40-M44 WeakPolarHBondContact O-CG 3.06Å; N40-M44 PolarHBondContact O-N 2.93Å; G41-M44 PolarHBondContact O-N 2.94Å; G42-M44 PolarHBondContact O-N 3.3Å; M44-I46 VanDerWaalsContact C-N 3.33Å; M44-I46 PolarHBondContact O-N 3.29Å; M44-I47 PolarHBondContact O-N 2.88Å; M44-H48 WeakPolarHBondContact O-CB 3.43Å; M44-H48 PolarHBondContact O-CD2 3.24Å; M44-H48 PolarHBondContact O-N 3.43Å; M44-F66 HydrophobicContact CE-CB 4.02Å; M44-F66 HydrophobicContact CE-CD2 4.25Å; M44-F66 HydrophobicContact SD-CB 4.03Å; M44-L69 HydrophobicContact SD-CD1 4.03Å
45V87.5Confident85.8Confident86 Ų8652.1 Ų52.152%0.52130%0.299SS..Hα-helixtrans-58.1-45.3178.31710000111.1G41 G42 H48 S49G41-V45 WeakPolarHBondContact O-CG2 3.41Å; G41-V45 PolarHBondContact O-N 3.45Å; G42-V45 PolarHBondContact O-N 3.23Å; V45-H48 PolarHBondContact O-N 2.57Å; V45-S49 WeakPolarHBondContact O-CB 3.36Å; V45-S49 PolarHBondContact O-N 3.44Å; V45-S49 PolarHBondContact O-OG 3.41Å
46I85.2Confident86.2Confident16 Ų1651.1 Ų51.18%0.08230%0.295CS..Hα-helixtrans-60.8-48178.5-69.3162.7000110.8G42 M43 M44 S49 D50 L53 A298 L299 I302G42-I46 WeakPolarHBondContact O-CB 3.18Å; G42-I46 WeakPolarHBondContact O-CD1 3.31Å; G42-I46 WeakPolarHBondContact O-CG1 3.49Å; G42-I46 PolarHBondContact O-N 3.14Å; M43-I46 PolarHBondContact O-N 2.88Å; M44-I46 VanDerWaalsContact C-N 3.33Å; M44-I46 PolarHBondContact O-N 3.29Å; I46-S49 PolarHBondContact O-N 3.09Å; I46-D50 PolarHBondContact O-N 2.72Å; I46-D50 VanDerWaalsContact O-N 3.12Å; I46-L53 HydrophobicContact CG2-CD1 3.6Å; I46-A298 HydrophobicContact CG2-CB 3.65Å; I46-L299 HydrophobicContact CD1-CB 4.24Å; I46-L299 HydrophobicContact CD1-CD1 3.98Å; I46-I302 HydrophobicContact CB-CD1 4.37Å; I46-I302 HydrophobicContact CG1-CD1 3.95Å
47I86.7Confident86.5Confident5 Ų551.2 Ų51.23%0.02630%0.296CS..Hα-helixtrans-62.5-44.9-179.4-68163.2000111M43 M44 S49 H54 Y58 L61M43-I47 HydrophobicContact CE-CD1 3.65Å; M43-I47 HydrophobicContact CE-CG1 3.87Å; M43-I47 HydrophobicContact CG-CD1 3.92Å; M43-I47 WeakPolarHBondContact O-CD1 3.48Å; M43-I47 VanDerWaalsContact O-CG1 3.27Å; M43-I47 WeakPolarHBondContact O-CG1 3.29Å; M43-I47 PolarHBondContact O-N 3.09Å; M44-I47 PolarHBondContact O-N 2.88Å; I47-S49 VanDerWaalsContact C-N 3.3Å; I47-S49 PolarHBondContact O-N 3.05Å; I47-H54 PolarHBondContact O-CD2 3.19Å; I47-H54 VanDerWaalsContact O-CD2 3.27Å; I47-H54 PolarHBondContact O-NE2 3.03Å; I47-Y58 HydrophobicContact CD1-CD1 4.44Å; I47-Y58 HydrophobicContact CG1-CD1 4.31Å; I47-L61 HydrophobicContact CD1-CB 4.38Å; I47-L61 HydrophobicContact CD1-CG 4.39Å
48H87.6Confident86.6Confident122 Ų12248 Ų4857%0.56528%0.279SS*.Hα-helixtrans-73.6-21.3-178.8-73.9-62.8000113.6M44 V45 S62M44-H48 WeakPolarHBondContact O-CB 3.43Å; M44-H48 PolarHBondContact O-CD2 3.24Å; M44-H48 PolarHBondContact O-N 3.43Å; V45-H48 PolarHBondContact O-N 2.57Å; H48-S62 PolarHBondContact NE2-OG 3.4Å
49S82.5Confident86.9Confident82 Ų8245.9 Ų45.957%0.57326%0.264SS*.Hα-helixtrans-92.1-25-177.8-58.10000113.9V45 I46 I47V45-S49 WeakPolarHBondContact O-CB 3.36Å; V45-S49 PolarHBondContact O-N 3.44Å; V45-S49 PolarHBondContact O-OG 3.41Å; I46-S49 PolarHBondContact O-N 3.09Å; I47-S49 VanDerWaalsContact C-N 3.3Å; I47-S49 PolarHBondContact O-N 3.05Å
50D83.7Confident87.2Confident20 Ų2044.6 Ų44.611%0.10725%0.251CS..  trans-110.5107.9178.4-165.4-22.2000111.1I46 H52 L53 A298 K301I46-D50 PolarHBondContact O-N 2.72Å; I46-D50 VanDerWaalsContact O-N 3.12Å; D50-H52 PolarHBondContact O-N 2.9Å; D50-H52 VanDerWaalsContact OD1-CB 3.31Å; D50-H52 WeakPolarHBondContact OD1-CB 3.26Å; D50-H52 IonicContact OD1-CE1 2.76Å; D50-H52 IonicContact OD1-CG 3.94Å; D50-H52 PolarHBondContact OD1-N 2.96Å; D50-H52 IonicContact OD1-ND1 3.44Å; D50-H52 PolarHBondContact OD1-ND1 3.38Å; D50-L53 HydrophobicContact CB-CD1 4.16Å; D50-L53 HydrophobicContact CB-CG 4.2Å; D50-L53 WeakPolarHBondContact O-CB 3.48Å; D50-L53 PolarHBondContact O-N 3.44Å; D50-A298 HydrophobicContact CB-CB 4.23Å; D50-K301 IonicContact OD2-NZ 3.04Å; D50-K301 PolarHBondContact OD2-NZ 2.9Å
51S83.7Confident87.3Confident83 Ų8344.8 Ų44.858%0.5825%0.252SS*.G310 helixtrans-58.9-22.3178.560.20000113.9L53 H54S51-L53 PolarHBondContact O-N 3.38Å; S51-H54 WeakPolarHBondContact O-CB 3.37Å; S51-H54 PolarHBondContact O-N 3.39Å; S51-H54 VanDerWaalsContact O-N 3.16Å
52H82.6Confident87.5Confident137 Ų13744.1 Ų44.163%0.63424%0.244SC*.G310 helixtrans-68.4-20175.5-59.283.6000112.1D50D50-H52 PolarHBondContact O-N 2.9Å; D50-H52 VanDerWaalsContact OD1-CB 3.31Å; D50-H52 WeakPolarHBondContact OD1-CB 3.26Å; D50-H52 IonicContact OD1-CE1 2.76Å; D50-H52 IonicContact OD1-CG 3.94Å; D50-H52 PolarHBondContact OD1-N 2.96Å; D50-H52 IonicContact OD1-ND1 3.44Å; D50-H52 PolarHBondContact OD1-ND1 3.38Å
53L81.8Confident87.9Confident4 Ų444.1 Ų44.12%0.02124%0.238CC..G310 helixtrans-90.72.4175.4-59.6178.4000112.4I46 D50 S51 T55 Y58 E294 A298I46-L53 HydrophobicContact CG2-CD1 3.6Å; D50-L53 HydrophobicContact CB-CD1 4.16Å; D50-L53 HydrophobicContact CB-CG 4.2Å; D50-L53 WeakPolarHBondContact O-CB 3.48Å; D50-L53 PolarHBondContact O-N 3.44Å; S51-L53 PolarHBondContact O-N 3.38Å; L53-T55 PolarHBondContact O-N 3.5Å; L53-Y58 HydrophobicContact CB-CD2 3.99Å; L53-Y58 HydrophobicContact CB-CE2 4.44Å; L53-Y58 HydrophobicContact CB-CG 4.2Å; L53-Y58 HydrophobicContact CD2-CD2 3.95Å; L53-Y58 HydrophobicContact CD2-CE1 4.16Å; L53-Y58 HydrophobicContact CD2-CE2 3.52Å; L53-Y58 HydrophobicContact CD2-CG 4.48Å; L53-Y58 WeakPolarHBondContact O-CB 3.43Å; L53-Y58 VanDerWaalsContact O-CD2 3.22Å; L53-Y58 WeakPolarHBondContact O-CD2 3.19Å; L53-E294 HydrophobicContact CD2-CB 4.04Å; L53-A298 HydrophobicContact CD1-CB 3.73Å; L53-A298 HydrophobicContact CG-CB 4.49Å
54H86.3Confident88.2Confident120 Ų12044 Ų4456%0.55624%0.237SC*.  trans-77.558.1177.4-66.1178.7000112.3I47 S51I47-H54 PolarHBondContact O-CD2 3.19Å; I47-H54 VanDerWaalsContact O-CD2 3.27Å; I47-H54 PolarHBondContact O-NE2 3.03Å; S51-H54 WeakPolarHBondContact O-CB 3.37Å; S51-H54 PolarHBondContact O-N 3.39Å; S51-H54 VanDerWaalsContact O-N 3.16Å
55T88.4Confident88.2Confident55 Ų5542.1 Ų42.134%0.33723%0.228SC..SBendtrans-107.9158.5174.373.50000110.8L53 M57 Y58 F59L53-T55 PolarHBondContact O-N 3.5Å; T55-M57 VanDerWaalsContact C-N 3.29Å; T55-M57 PolarHBondContact O-N 3.34Å; T55-Y58 HydrophobicContact CG2-CD2 4.47Å; T55-Y58 PolarHBondContact O-N 3.23Å; T55-Y58 VanDerWaalsContact O-N 3.09Å; T55-Y58 WeakPolarHBondContact OG1-CD2 3.47Å; T55-F59 PolarHBondContact O-N 3.04Å
56P90.9Very high88.5Confident23 Ų2342.6 Ų42.615%0.14922%0.223CC..Hα-helixtrans-49.5-44.1178-34.340000114.7Y58 F59 F60 D119 Y130 M134 C139P56-Y58 PolarHBondContact O-N 2.89Å; P56-F59 WeakPolarHBondContact O-CB 3.36Å; P56-F59 PolarHBondContact O-N 3.11Å; P56-F60 WeakPolarHBondContact O-CD2 3.31Å; P56-F60 PolarHBondContact O-N 2.83Å; P56-F60 VanDerWaalsContact O-N 3.09Å; P56-D119 WeakPolarHBondContact CB-OD1 3.37Å; P56-Y130 WeakPolarHBondContact CG-OH 3.3Å; P56-M134 HydrophobicContact CB-CB 4.34Å; P56-M134 HydrophobicContact CB-CE 4Å; P56-M134 HydrophobicContact CG-CB 4.03Å; P56-C139 VanDerWaalsContact CB-SG 3.56Å
57M90.3Very high88.8Confident5 Ų541.8 Ų41.83%0.02522%0.219CC..Hα-helixtrans-58.4-48.6177.3179.779.4179.500112.2T55 F59 F60 L61 M116 R120 Y288T55-M57 VanDerWaalsContact C-N 3.29Å; T55-M57 PolarHBondContact O-N 3.34Å; M57-F59 VanDerWaalsContact C-N 3.31Å; M57-F60 PolarHBondContact O-N 2.91Å; M57-L61 WeakPolarHBondContact O-CB 3.41Å; M57-L61 PolarHBondContact O-N 3.45Å; M57-M116 HydrophobicContact CE-CE 3.29Å; M57-M116 HydrophobicContact SD-CB 4.19Å; M57-M116 HydrophobicContact SD-CE 4.04Å; M57-M116 HydrophobicContact SD-CG 4.29Å; M57-R120 HydrophobicContact SD-CG 4.38Å; M57-R120 PolarHBondContact SD-NE 3.27Å; M57-R120 PolarHBondContact SD-NH2 2.89Å; M57-Y288 HydrophobicContact CE-CD1 4.42Å; M57-Y288 HydrophobicContact CE-CE1 3.93Å
58Y89.3Confident89Confident5 Ų541.6 Ų41.62%0.0222%0.218CC..Hα-helixtrans-72-28.3-178.4-71.5-61.8000111.9M43 I47 L53 T55 P56 L61 S62 N292 E294 V295M43-Y58 HydrophobicContact CE-CD1 4.12Å; M43-Y58 HydrophobicContact CE-CE1 4.24Å; I47-Y58 HydrophobicContact CD1-CD1 4.44Å; I47-Y58 HydrophobicContact CG1-CD1 4.31Å; L53-Y58 HydrophobicContact CB-CD2 3.99Å; L53-Y58 HydrophobicContact CB-CE2 4.44Å; L53-Y58 HydrophobicContact CB-CG 4.2Å; L53-Y58 HydrophobicContact CD2-CD2 3.95Å; L53-Y58 HydrophobicContact CD2-CE1 4.16Å; L53-Y58 HydrophobicContact CD2-CE2 3.52Å; L53-Y58 HydrophobicContact CD2-CG 4.48Å; L53-Y58 WeakPolarHBondContact O-CB 3.43Å; L53-Y58 VanDerWaalsContact O-CD2 3.22Å; L53-Y58 WeakPolarHBondContact O-CD2 3.19Å; T55-Y58 HydrophobicContact CG2-CD2 4.47Å; T55-Y58 PolarHBondContact O-N 3.23Å; T55-Y58 VanDerWaalsContact O-N 3.09Å; T55-Y58 WeakPolarHBondContact OG1-CD2 3.47Å; P56-Y58 PolarHBondContact O-N 2.89Å; Y58-L61 HydrophobicContact CD1-CD2 4.08Å; Y58-L61 HydrophobicContact CE1-CD2 4.39Å; Y58-L61 PolarHBondContact O-N 3.12Å; Y58-S62 WeakPolarHBondContact O-CB 3.39Å; Y58-S62 PolarHBondContact O-N 2.82Å; Y58-N292 PolarHBondContact OH-ND2 2.8Å; Y58-N292 PolarHBondContact OH-OD1 3.41Å; Y58-E294 VanDerWaalsContact CE2-OE2 3.3Å; Y58-E294 WeakPolarHBondContact CE2-OE2 3.4Å; Y58-E294 WeakPolarHBondContact OH-CB 3.35Å; Y58-E294 PolarHBondContact OH-OE2 2.9Å; Y58-V295 HydrophobicContact CE1-CG2 3.76Å
59F92.6Very high89.1Confident79 Ų7937.3 Ų37.335%0.34620%0.199SC..Hα-helixtrans-59.5-47.4168.9171.2-95.1000111.5T55 P56 M57 L61 S62 N63 C139 A143T55-F59 PolarHBondContact O-N 3.04Å; P56-F59 WeakPolarHBondContact O-CB 3.36Å; P56-F59 PolarHBondContact O-N 3.11Å; M57-F59 VanDerWaalsContact C-N 3.31Å; F59-L61 VanDerWaalsContact C-N 3.35Å; F59-S62 PolarHBondContact O-N 3.41Å; F59-N63 PolarHBondContact O-N 3.34Å; F59-N63 PolarHBondContact O-ND2 3Å; F59-C139 HydrophobicContact CD1-CB 3.77Å; F59-C139 HydrophobicContact CE1-CB 3.87Å; F59-C139 WeakPolarHBondContact CE1-O 3.42Å; F59-A143 HydrophobicContact CE1-CB 3.71Å; F59-A143 HydrophobicContact CZ-CB 4.01Å
60F92.9Very high89.3Confident0 Ų034.3 Ų34.30%018%0.181CC..Hα-helixtrans-66.2-37.5174.4-66.4-60.5000112.4P56 M57 S62 N63 L64 L112 M116 D119 M134 C139 L142 A143P56-F60 WeakPolarHBondContact O-CD2 3.31Å; P56-F60 PolarHBondContact O-N 2.83Å; P56-F60 VanDerWaalsContact O-N 3.09Å; M57-F60 PolarHBondContact O-N 2.91Å; F60-S62 VanDerWaalsContact C-N 3.34Å; F60-S62 PolarHBondContact O-N 3.01Å; F60-N63 WeakPolarHBondContact O-CB 3.4Å; F60-N63 PolarHBondContact O-N 3.42Å; F60-L64 WeakPolarHBondContact O-CB 3.48Å; F60-L64 PolarHBondContact O-N 3.27Å; F60-L112 HydrophobicContact CD1-CD2 3.95Å; F60-M116 HydrophobicContact CB-CG 3.44Å; F60-M116 VanDerWaalsContact CB-CG 3.44Å; F60-M116 HydrophobicContact CB-SD 4.07Å; F60-M116 HydrophobicContact CD2-CG 4.3Å; F60-M116 HydrophobicContact CG-CG 4.09Å; F60-D119 HydrophobicContact CE2-CB 4.49Å; F60-M134 HydrophobicContact CE2-CE 3.66Å; F60-M134 HydrophobicContact CZ-CE 4.17Å; F60-C139 HydrophobicContact CZ-CB 4.2Å; F60-L142 HydrophobicContact CE1-CB 3.84Å; F60-L142 HydrophobicContact CZ-CB 3.89Å; F60-L142 HydrophobicContact CZ-CD1 3.86Å; F60-A143 HydrophobicContact CE1-CB 4.49Å
61L90.9Very high89.2Confident4 Ų433.4 Ų33.42%0.02118%0.176CC..Hα-helixtrans-65.5-36.1177.6-173.853.5000112.4M43 I47 M57 Y58 F59 L64 S65 M116 Y288M43-L61 HydrophobicContact CE-CD2 3.32Å; M43-L61 HydrophobicContact CE-CG 4Å; M43-L61 HydrophobicContact CG-CG 4.4Å; M43-L61 HydrophobicContact SD-CD2 4.49Å; I47-L61 HydrophobicContact CD1-CB 4.38Å; I47-L61 HydrophobicContact CD1-CG 4.39Å; M57-L61 WeakPolarHBondContact O-CB 3.41Å; M57-L61 PolarHBondContact O-N 3.45Å; Y58-L61 HydrophobicContact CD1-CD2 4.08Å; Y58-L61 HydrophobicContact CE1-CD2 4.39Å; Y58-L61 PolarHBondContact O-N 3.12Å; F59-L61 VanDerWaalsContact C-N 3.35Å; L61-L64 HydrophobicContact CD1-CD2 4.1Å; L61-L64 PolarHBondContact O-N 3.46Å; L61-S65 PolarHBondContact O-N 3.35Å; L61-S65 PolarHBondContact O-OG 2.91Å; L61-M116 HydrophobicContact CB-CE 4.37Å; L61-M116 HydrophobicContact CD1-CE 4.29Å; L61-Y288 HydrophobicContact CD1-CD1 4.21Å; L61-Y288 HydrophobicContact CD1-CD2 3.43Å; L61-Y288 VanDerWaalsContact CD1-CD2 3.43Å; L61-Y288 HydrophobicContact CD1-CE2 3.94Å; L61-Y288 HydrophobicContact CD1-CG 3.62Å; L61-Y288 HydrophobicContact CD2-CD1 4.25Å; L61-Y288 HydrophobicContact CD2-CG 3.99Å
62S92.5Very high89.3Confident9 Ų929.8 Ų29.86%0.06315%0.151CC..Hα-helixtrans-63.7-42.6173-171.20000111.4H48 Y58 F59 F60 S65 F66H48-S62 PolarHBondContact NE2-OG 3.4Å; Y58-S62 WeakPolarHBondContact O-CB 3.39Å; Y58-S62 PolarHBondContact O-N 2.82Å; F59-S62 PolarHBondContact O-N 3.41Å; F60-S62 VanDerWaalsContact C-N 3.34Å; F60-S62 PolarHBondContact O-N 3.01Å; S62-S65 PolarHBondContact O-N 3.47Å; S62-F66 PolarHBondContact O-N 3.36Å
63N94.8Very high89.4Confident28 Ų2825.5 Ų25.515%0.1514%0.136CC..Hα-helixtrans-64-41.4173.4-78-85.3000112.3F59 F60 S65 F66 V67 L112 Y147F59-N63 PolarHBondContact O-N 3.34Å; F59-N63 PolarHBondContact O-ND2 3Å; F60-N63 WeakPolarHBondContact O-CB 3.4Å; F60-N63 PolarHBondContact O-N 3.42Å; N63-S65 VanDerWaalsContact C-N 3.34Å; N63-S65 PolarHBondContact O-N 2.88Å; N63-F66 WeakPolarHBondContact O-CB 3.46Å; N63-F66 PolarHBondContact O-N 3.39Å; N63-V67 VanDerWaalsContact O-CG2 3.32Å; N63-V67 WeakPolarHBondContact O-CG2 3.46Å; N63-V67 PolarHBondContact O-N 2.91Å; N63-L112 HydrophobicContact CB-CD1 3.85Å; N63-L112 HydrophobicContact CB-CD2 4.06Å; N63-Y147 WeakPolarHBondContact OD1-CE2 3.28Å; N63-Y147 PolarHBondContact OD1-OH 3.03Å
64L91.5Very high89.5Confident0 Ų026.5 Ų26.50%015%0.145CC..Hα-helixtrans-60.1-46.4176.1-176.366.3000110.5F60 L61 F66 V67 D68 E109 L112 L113 M116 Y288F60-L64 WeakPolarHBondContact O-CB 3.48Å; F60-L64 PolarHBondContact O-N 3.27Å; L61-L64 HydrophobicContact CD1-CD2 4.1Å; L61-L64 PolarHBondContact O-N 3.46Å; L64-F66 VanDerWaalsContact C-N 3.33Å; L64-F66 PolarHBondContact O-N 3.47Å; L64-V67 PolarHBondContact O-N 3.45Å; L64-D68 VanDerWaalsContact O-CG 3.32Å; L64-D68 PolarHBondContact O-N 3.37Å; L64-E109 HydrophobicContact CD1-CB 4.15Å; L64-E109 HydrophobicContact CD1-CG 3.67Å; L64-L112 HydrophobicContact CB-CD1 4.38Å; L64-L113 HydrophobicContact CD2-CD2 4.23Å; L64-M116 HydrophobicContact CD2-CE 4.41Å; L64-M116 HydrophobicContact CD2-SD 4.18Å; L64-Y288 HydrophobicContact CD2-CD2 4.48Å; L64-Y288 HydrophobicContact CD2-CE2 3.75Å
65S91.6Very high89.2Confident1 Ų120.8 Ų20.81%0.00712%0.119CC..Hα-helixtrans-60.6-38.8174.9-73.40000113.1N40 L61 S62 N63 L69N40-S65 WeakPolarHBondContact OD1-CA 3.48Å; N40-S65 WeakPolarHBondContact OD1-CB 3.45Å; N40-S65 PolarHBondContact OD1-OG 2.98Å; L61-S65 PolarHBondContact O-N 3.35Å; L61-S65 PolarHBondContact O-OG 2.91Å; S62-S65 PolarHBondContact O-N 3.47Å; N63-S65 VanDerWaalsContact C-N 3.34Å; N63-S65 PolarHBondContact O-N 2.88Å; S65-L69 VanDerWaalsContact O-CG 3.28Å; S65-L69 WeakPolarHBondContact O-CG 3.4Å; S65-L69 PolarHBondContact O-N 2.95Å; S65-L69 VanDerWaalsContact O-N 3.11Å
66F93.1Very high88.9Confident96 Ų9618.3 Ų18.342%0.42110%0.104SC..Hα-helixtrans-63.1-44.7174.4175.1-98.7000112.2M44 S62 N63 L64 L69 G70 F105 Y147M44-F66 HydrophobicContact CE-CB 4.02Å; M44-F66 HydrophobicContact CE-CD2 4.25Å; M44-F66 HydrophobicContact SD-CB 4.03Å; S62-F66 PolarHBondContact O-N 3.36Å; N63-F66 WeakPolarHBondContact O-CB 3.46Å; N63-F66 PolarHBondContact O-N 3.39Å; L64-F66 VanDerWaalsContact C-N 3.33Å; L64-F66 PolarHBondContact O-N 3.47Å; F66-L69 PolarHBondContact O-N 3.49Å; F66-G70 PolarHBondContact O-N 3.28Å; F66-F105 HydrophobicContact CE1-CE1 4.19Å; F66-F105 HydrophobicContact CE1-CZ 4.46Å; F66-Y147 HydrophobicContact CD1-CE1 4.45Å; F66-Y147 WeakPolarHBondContact CD1-OH 3.32Å; F66-Y147 HydrophobicContact CE1-CE1 4.47Å
67V92.1Very high88.4Confident0 Ų020 Ų200%011%0.114CC..Hα-helixtrans-63.9-43.6178.5170.80000110.9N63 L64 L69 G70 Y71 F105 V108 E109 L112 Y147N63-V67 VanDerWaalsContact O-CG2 3.32Å; N63-V67 WeakPolarHBondContact O-CG2 3.46Å; N63-V67 PolarHBondContact O-N 2.91Å; L64-V67 PolarHBondContact O-N 3.45Å; V67-L69 VanDerWaalsContact C-N 3.33Å; V67-L69 PolarHBondContact O-N 3.15Å; V67-G70 WeakPolarHBondContact O-CA 3.14Å; V67-G70 PolarHBondContact O-N 2.93Å; V67-Y71 HydrophobicContact CG1-CD1 4.32Å; V67-Y71 HydrophobicContact CG1-CE1 4.45Å; V67-Y71 WeakPolarHBondContact O-CD1 3.5Å; V67-Y71 PolarHBondContact O-N 3.38Å; V67-Y71 VanDerWaalsContact O-N 3.13Å; V67-F105 HydrophobicContact CB-CD1 4.32Å; V67-F105 HydrophobicContact CG1-CB 3.61Å; V67-F105 HydrophobicContact CG1-CD1 4.05Å; V67-F105 HydrophobicContact CG1-CG 4.18Å; V67-F105 WeakPolarHBondContact CG1-O 3.24Å; V67-F105 HydrophobicContact CG2-CD1 4Å; V67-V108 HydrophobicContact CG1-CB 4.32Å; V67-V108 HydrophobicContact CG2-CB 4.13Å; V67-V108 HydrophobicContact CG2-CG1 3.75Å; V67-E109 HydrophobicContact CG1-CB 4.17Å; V67-L112 HydrophobicContact CG2-CD1 4.14Å; V67-Y147 HydrophobicContact CG2-CE1 3.9Å
68D89.4Confident88Confident0 Ų022.1 Ų22.10%012%0.123CC..Hα-helixtrans-58.2-42.5176-74.5-11.3000112.2L64 G70 Y71 S72 P281 N284L64-D68 VanDerWaalsContact O-CG 3.32Å; L64-D68 PolarHBondContact O-N 3.37Å; D68-G70 VanDerWaalsContact C-N 3.32Å; D68-Y71 HydrophobicContact CB-CE1 4.49Å; D68-Y71 PolarHBondContact OD1-OH 3.45Å; D68-S72 WeakPolarHBondContact O-CB 3.36Å; D68-S72 PolarHBondContact O-N 3.41Å; D68-S72 PolarHBondContact O-OG 3.39Å; D68-P281 HydrophobicContact CB-CB 3.8Å; D68-N284 PolarHBondContact OD1-ND2 2.93Å; D68-N284 WeakPolarHBondContact OD2-CB 3.47Å; D68-N284 PolarHBondContact OD2-ND2 3.24Å
69L89.6Confident87.6Confident32 Ų3222.1 Ų22.117%0.16812%0.124CC..Hα-helixtrans-64-39.1173.4-69.3172.6000111.8L37 N40 M44 S65 F66 V67 S73L37-L69 HydrophobicContact CB-CD2 4.46Å; N40-L69 HydrophobicContact CB-CD1 4.27Å; N40-L69 HydrophobicContact CB-CD2 3.92Å; N40-L69 HydrophobicContact CB-CG 3.78Å; M44-L69 HydrophobicContact SD-CD1 4.03Å; S65-L69 VanDerWaalsContact O-CG 3.28Å; S65-L69 WeakPolarHBondContact O-CG 3.4Å; S65-L69 PolarHBondContact O-N 2.95Å; S65-L69 VanDerWaalsContact O-N 3.11Å; F66-L69 PolarHBondContact O-N 3.49Å; V67-L69 VanDerWaalsContact C-N 3.33Å; V67-L69 PolarHBondContact O-N 3.15Å; L69-S73 WeakPolarHBondContact O-CB 3.45Å; L69-S73 PolarHBondContact O-N 3.03Å; L69-S73 PolarHBondContact O-OG 3.49Å
70G87.5Confident87.1Confident19 Ų1919.4 Ų19.420%0.19611%0.114CC..Hα-helixtrans-60.5-59.7-177.700000112.8F66 V67 D68 S73 A74F66-G70 PolarHBondContact O-N 3.28Å; V67-G70 WeakPolarHBondContact O-CA 3.14Å; V67-G70 PolarHBondContact O-N 2.93Å; D68-G70 VanDerWaalsContact C-N 3.32Å; G70-S73 PolarHBondContact O-N 3.47Å; G70-A74 PolarHBondContact O-N 2.96Å
71Y81.7Confident86.6Confident2 Ų221.4 Ų21.41%0.00813%0.13CC..Hα-helixtrans-73-31.2-178.570.1-99.1000113V67 D68 S73 A74 V75 F102 F105 E109 T277 P281V67-Y71 HydrophobicContact CG1-CD1 4.32Å; V67-Y71 HydrophobicContact CG1-CE1 4.45Å; V67-Y71 WeakPolarHBondContact O-CD1 3.5Å; V67-Y71 PolarHBondContact O-N 3.38Å; V67-Y71 VanDerWaalsContact O-N 3.13Å; D68-Y71 HydrophobicContact CB-CE1 4.49Å; D68-Y71 PolarHBondContact OD1-OH 3.45Å; Y71-S73 VanDerWaalsContact C-N 3.33Å; Y71-S73 PolarHBondContact O-N 3.22Å; Y71-A74 PolarHBondContact O-N 2.9Å; Y71-V75 PolarHBondContact O-N 3.24Å; Y71-F102 HydrophobicContact CD2-CD2 4.28Å; Y71-F102 AromaticContact CD2-CE2 4Å; Y71-F102 HydrophobicContact CD2-CE2 4Å; Y71-F102 HydrophobicContact CG-CD2 4.5Å; Y71-F105 HydrophobicContact CD1-CB 3.97Å; Y71-F105 HydrophobicContact CG-CB 4.49Å; Y71-E109 WeakPolarHBondContact CE1-OE2 3.33Å; Y71-E109 PolarHBondContact OH-OE2 2.94Å; Y71-T277 WeakPolarHBondContact CE2-O 3.42Å; Y71-P281 HydrophobicContact CD2-CG 4.48Å; Y71-P281 HydrophobicContact CE1-CB 4.45Å; Y71-P281 HydrophobicContact CE2-CB 3.92Å; Y71-P281 HydrophobicContact CE2-CG 3.44Å; Y71-P281 VanDerWaalsContact CE2-CG 3.44Å; Y71-P281 VanDerWaalsContact OH-CB 3.26Å; Y71-P281 WeakPolarHBondContact OH-CB 3.47Å; Y71-P281 WeakPolarHBondContact OH-CD 3.46Å; Y71-P281 WeakPolarHBondContact OH-CG 2.92Å
72S85.1Confident86.2Confident7 Ų721.9 Ų21.95%0.04914%0.135CC..Hα-helixtrans-62.9-40.5172.7-61.10000111.7T36 D68 A74 V75 A76 P281T36-S72 WeakPolarHBondContact CG2-OG 3.5Å; D68-S72 WeakPolarHBondContact O-CB 3.36Å; D68-S72 PolarHBondContact O-N 3.41Å; D68-S72 PolarHBondContact O-OG 3.39Å; S72-A74 VanDerWaalsContact C-N 3.34Å; S72-V75 PolarHBondContact O-N 3.23Å; S72-A76 WeakPolarHBondContact O-CB 3.5Å; S72-A76 PolarHBondContact O-N 2.99Å; S72-P281 WeakPolarHBondContact OG-CG 3.36Å
73S86.1Confident85.6Confident47 Ų4723.1 Ų23.133%0.32914%0.141SC..Hα-helixtrans-76-21.4177.1-57.90000113.3Y33 L69 G70 Y71 P77Y33-S73 PolarHBondContact OH-OG 3.39Å; L69-S73 WeakPolarHBondContact O-CB 3.45Å; L69-S73 PolarHBondContact O-N 3.03Å; L69-S73 PolarHBondContact O-OG 3.49Å; G70-S73 PolarHBondContact O-N 3.47Å; Y71-S73 VanDerWaalsContact C-N 3.33Å; Y71-S73 PolarHBondContact O-N 3.22Å; S73-P77 WeakPolarHBondContact O-CD 3.33Å; S73-P77 VanDerWaalsContact O-CG 3.27Å; S73-P77 WeakPolarHBondContact O-CG 3.48Å
74A83.6Confident84.9Confident24 Ų2429 Ų2920%0.19817%0.168CC..Hα-helixtrans-69.6-39.9171.200000111.3G70 Y71 S72 Q98 F101G70-A74 PolarHBondContact O-N 2.96Å; Y71-A74 PolarHBondContact O-N 2.9Å; S72-A74 VanDerWaalsContact C-N 3.34Å; A74-Q98 HydrophobicContact CB-CG 4.39Å; A74-Q98 WeakPolarHBondContact O-CG 3.44Å; A74-F101 HydrophobicContact CB-CB 4.28Å
75V79.2Confident84.3Confident1 Ų133 Ų331%0.00620%0.195CC..Hα-helixtrans-96.7-52.8-171.5178.40000112.7Y71 S72 K78 T79 Q98 F102 F175 F176Y71-V75 PolarHBondContact O-N 3.24Å; S72-V75 PolarHBondContact O-N 3.23Å; V75-K78 PolarHBondContact O-N 2.84Å; V75-T79 PolarHBondContact O-N 3.47Å; V75-T79 PolarHBondContact O-OG1 3.47Å; V75-T79 VanDerWaalsContact O-OG1 3.12Å; V75-Q98 HydrophobicContact CG2-CG 4.43Å; V75-F102 HydrophobicContact CG2-CD2 3.86Å; V75-F102 HydrophobicContact CG2-CG 4.5Å; V75-F175 HydrophobicContact CG1-CD2 4.18Å; V75-F175 HydrophobicContact CG1-CE2 3.79Å; V75-F176 HydrophobicContact CG1-CB 3.78Å; V75-F176 HydrophobicContact CG1-CG 4.19Å; V75-F176 HydrophobicContact CG2-CB 4.47Å; V75-F176 HydrophobicContact CG2-CD2 4.28Å
76A81.3Confident83.5Confident3 Ų335.5 Ų35.53%0.02522%0.221CC..Hα-helixtrans-62.4-42.8-166.900000114.5Y33 S72 K78 T79 V80Y33-A76 HydrophobicContact CD2-CB 3.61Å; Y33-A76 HydrophobicContact CE2-CB 4.29Å; Y33-A76 HydrophobicContact CG-CB 3.97Å; S72-A76 WeakPolarHBondContact O-CB 3.5Å; S72-A76 PolarHBondContact O-N 2.99Å; A76-K78 VanDerWaalsContact C-N 3.35Å; A76-K78 PolarHBondContact O-N 2.82Å; A76-T79 PolarHBondContact O-N 3.24Å; A76-V80 WeakPolarHBondContact O-CB 3.34Å; A76-V80 VanDerWaalsContact O-CG2 3.28Å; A76-V80 WeakPolarHBondContact O-CG2 3.34Å; A76-V80 PolarHBondContact O-N 3.42Å
77P80.4Confident82.9Confident57 Ų5735.1 Ų35.137%0.3722%0.224SC..Hα-helixtrans-61.3-40.9-179.1-25.736.7000113.1S73 V80 A81S73-P77 WeakPolarHBondContact O-CD 3.33Å; S73-P77 VanDerWaalsContact O-CG 3.27Å; S73-P77 WeakPolarHBondContact O-CG 3.48Å; P77-V80 PolarHBondContact O-N 3.32Å; P77-A81 WeakPolarHBondContact O-CB 3.46Å; P77-A81 PolarHBondContact O-N 3.33Å
78K82.7Confident82.4Confident50 Ų5037.3 Ų37.322%0.21723%0.233CC..Hα-helixtrans-70.1-39.5178.8-175.454.2176.71670111.3L12 V75 A76 A81 A82 A89 I90L12-K78 HydrophobicContact CD1-CG 4.42Å; V75-K78 PolarHBondContact O-N 2.84Å; A76-K78 VanDerWaalsContact C-N 3.35Å; A76-K78 PolarHBondContact O-N 2.82Å; K78-A81 PolarHBondContact O-N 3.06Å; K78-A82 WeakPolarHBondContact O-CB 3.34Å; K78-A82 PolarHBondContact O-N 3.35Å; K78-A89 WeakPolarHBondContact CE-O 3.45Å; K78-A89 PolarHBondContact NZ-O 2.92Å; K78-I90 HydrophobicContact CG-CD1 4.37Å
79T80.7Confident82.2Confident6 Ų638.7 Ų38.74%0.03724%0.244CC..Hα-helixtrans-63-43.8174.8-52.80000111.9F29 V75 A76 A82 L83 F175F29-T79 HydrophobicContact CD1-CG2 4Å; F29-T79 HydrophobicContact CE1-CG2 3.84Å; F29-T79 HydrophobicContact CG-CG2 4.39Å; F29-T79 HydrophobicContact CZ-CG2 4.13Å; V75-T79 PolarHBondContact O-N 3.47Å; V75-T79 PolarHBondContact O-OG1 3.47Å; V75-T79 VanDerWaalsContact O-OG1 3.12Å; A76-T79 PolarHBondContact O-N 3.24Å; T79-A82 PolarHBondContact O-N 3.36Å; T79-L83 HydrophobicContact CG2-CD1 4.16Å; T79-L83 WeakPolarHBondContact O-CB 3.45Å; T79-L83 VanDerWaalsContact O-CG 3.3Å; T79-L83 WeakPolarHBondContact O-CG 3.36Å; T79-L83 PolarHBondContact O-N 3.43Å; T79-F175 HydrophobicContact CG2-CB 4.24Å; T79-F175 HydrophobicContact CG2-CD2 4.03Å; T79-F175 HydrophobicContact CG2-CG 4.5Å; T79-F175 PolarHBondContact OG1-O 2.84Å
80V82.6Confident82.1Confident22 Ų2237.8 Ų37.813%0.13324%0.24CC..Hα-helixtrans-63-45.9176.1169.20000110.9L26 F29 A76 P77 A82 L83 Q84L26-V80 HydrophobicContact CD1-CB 4.44Å; L26-V80 HydrophobicContact CD1-CG1 3.85Å; F29-V80 HydrophobicContact CB-CG2 4.13Å; A76-V80 WeakPolarHBondContact O-CB 3.34Å; A76-V80 VanDerWaalsContact O-CG2 3.28Å; A76-V80 WeakPolarHBondContact O-CG2 3.34Å; A76-V80 PolarHBondContact O-N 3.42Å; P77-V80 PolarHBondContact O-N 3.32Å; V80-A82 VanDerWaalsContact C-N 3.34Å; V80-A82 PolarHBondContact O-N 2.75Å; V80-L83 PolarHBondContact O-N 3.13Å; V80-Q84 WeakPolarHBondContact O-CB 3.18Å; V80-Q84 PolarHBondContact O-N 3.45Å
81A81.8Confident82.2Confident41 Ų4139.7 Ų39.734%0.33925%0.25SS..Hα-helixtrans-61.8-41.1177.500000112.2P77 K78 Q84 S85P77-A81 WeakPolarHBondContact O-CB 3.46Å; P77-A81 PolarHBondContact O-N 3.33Å; K78-A81 PolarHBondContact O-N 3.06Å; A81-Q84 PolarHBondContact O-N 2.95Å; A81-S85 WeakPolarHBondContact O-CB 3.26Å; A81-S85 PolarHBondContact O-N 3.5Å; A81-S85 PolarHBondContact O-OG 3.03Å
82A82.4Confident82.3Confident15 Ų1542.4 Ų42.412%0.12426%0.26CS..Hα-helixtrans-65.3-39.617700000112.2K78 T79 V80 G86 D87K78-A82 WeakPolarHBondContact O-CB 3.34Å; K78-A82 PolarHBondContact O-N 3.35Å; T79-A82 PolarHBondContact O-N 3.36Å; V80-A82 VanDerWaalsContact C-N 3.34Å; V80-A82 PolarHBondContact O-N 2.75Å; A82-G86 VanDerWaalsContact O-CA 3.29Å; A82-G86 WeakPolarHBondContact O-CA 3.18Å; A82-G86 PolarHBondContact O-N 3.28Å; A82-D87 WeakPolarHBondContact CA-O 3.48Å
83L79.6Confident82.4Confident34 Ų3447.9 Ų47.918%0.17829%0.289CS..Hα-helixtrans-69.5-32176-72.3169.7000112.8Q22 L25 L26 T79 V80Q22-L83 HydrophobicContact CB-CD2 4.27Å; Q22-L83 HydrophobicContact CG-CD2 4.17Å; L25-L83 HydrophobicContact CB-CD1 4.3Å; L26-L83 HydrophobicContact CB-CB 4.24Å; L26-L83 HydrophobicContact CB-CD1 4.32Å; L26-L83 HydrophobicContact CD1-CB 3.84Å; T79-L83 HydrophobicContact CG2-CD1 4.16Å; T79-L83 WeakPolarHBondContact O-CB 3.45Å; T79-L83 VanDerWaalsContact O-CG 3.3Å; T79-L83 WeakPolarHBondContact O-CG 3.36Å; T79-L83 PolarHBondContact O-N 3.43Å; V80-L83 PolarHBondContact O-N 3.13Å
84Q80.6Confident82.5Confident153 Ų15346.9 Ų46.972%0.71529%0.286SS*.Hα-helixtrans-82.3-45.6-179-175.7-179.52.400113.1L26 V80 A81L26-Q84 HydrophobicContact CD1-CB 4.47Å; V80-Q84 WeakPolarHBondContact O-CB 3.18Å; V80-Q84 PolarHBondContact O-N 3.45Å; A81-Q84 PolarHBondContact O-N 2.95Å
85S79.5Confident82.6Confident83 Ų8345.7 Ų45.758%0.5828%0.277SS*.Hα-helixtrans-93.6-16.1-173.464.30000113.7A81 D87A81-S85 WeakPolarHBondContact O-CB 3.26Å; A81-S85 PolarHBondContact O-N 3.5Å; A81-S85 PolarHBondContact O-OG 3.03Å; S85-D87 PolarHBondContact O-N 3.44Å; S85-D87 WeakPolarHBondContact OG-CB 3.25Å; S85-D87 PolarHBondContact OG-N 3.12Å; S85-D87 VanDerWaalsContact OG-N 3.16Å
86G74.2Confident83Confident54 Ų5446.7 Ų46.756%0.55729%0.285SS*.  trans74.1-7.1-167.900000113.8A82 K88A82-G86 VanDerWaalsContact O-CA 3.29Å; A82-G86 WeakPolarHBondContact O-CA 3.18Å; A82-G86 PolarHBondContact O-N 3.28Å; G86-K88 PolarHBondContact O-N 3.39Å; G86-K88 VanDerWaalsContact O-N 3.1Å
87D80.2Confident83.4Confident87 Ų8748.7 Ų48.747%0.46530%0.301SS..  trans-77.697.5177.2-179.519.8000111.2A82 S85 A89A82-D87 WeakPolarHBondContact CA-O 3.48Å; S85-D87 PolarHBondContact O-N 3.44Å; S85-D87 WeakPolarHBondContact OG-CB 3.25Å; S85-D87 PolarHBondContact OG-N 3.12Å; S85-D87 VanDerWaalsContact OG-N 3.16Å; D87-A89 VanDerWaalsContact C-N 3.34Å; D87-A89 VanDerWaalsContact OD1-CB 3.3Å; D87-A89 WeakPolarHBondContact OD1-CB 3.25Å; D87-A89 PolarHBondContact OD1-N 3.31Å
88K82.8Confident83.9Confident47 Ų4746.5 Ų46.520%0.20429%0.286CS..  trans-86.2-2.6179.5-69.5175.2179.2-166.30112.9I11 L12 L13 D17 G86I11-K88 HydrophobicContact CG2-CB 4.01Å; L12-K88 PolarHBondContact N-O 3.41Å; L12-K88 VanDerWaalsContact O-CB 3.29Å; L12-K88 WeakPolarHBondContact O-CB 3.48Å; L12-K88 VanDerWaalsContact O-CD 3.3Å; L12-K88 WeakPolarHBondContact O-CD 3.5Å; L12-K88 WeakPolarHBondContact O-CG 3.26Å; L13-K88 PolarHBondContact O-NZ 2.71Å; D17-K88 IonicContact OD1-NZ 3.4Å; D17-K88 PolarHBondContact OD1-NZ 2.9Å; G86-K88 PolarHBondContact O-N 3.39Å; G86-K88 VanDerWaalsContact O-N 3.1Å
89A85.6Confident84.2Confident28 Ų2844.1 Ų44.123%0.23128%0.276CS..EExtended strand (participates in β ladder)trans-75.3137.7-176.300000111.7F10 K78 D87F10-A89 CarbonylContact O-C 3.57Å; F10-A89 WeakPolarHBondContact O-CA 3.42Å; K78-A89 WeakPolarHBondContact CE-O 3.45Å; K78-A89 PolarHBondContact NZ-O 2.92Å; D87-A89 VanDerWaalsContact C-N 3.34Å; D87-A89 VanDerWaalsContact OD1-CB 3.3Å; D87-A89 WeakPolarHBondContact OD1-CB 3.25Å; D87-A89 PolarHBondContact OD1-N 3.31Å
90I86.5Confident84.7Confident14 Ų1446.4 Ų46.47%0.07229%0.285CS..EExtended strand (participates in β ladder)trans-131.9133.8171.6-170.5171.4000108.5E9 F10 L12 K78 C95E9-I90 CarbonylContact C-O 3.58Å; E9-I90 WeakPolarHBondContact CA-O 3.37Å; F10-I90 HydrophobicContact CB-CG2 3.91Å; F10-I90 PolarHBondContact N-O 3.27Å; F10-I90 PolarHBondContact O-N 3.48Å; L12-I90 HydrophobicContact CD1-CB 4.37Å; L12-I90 HydrophobicContact CD1-CG2 4.11Å; L12-I90 HydrophobicContact CD2-CG2 4.45Å; L12-I90 HydrophobicContact CG-CG2 4.02Å; K78-I90 HydrophobicContact CG-CD1 4.37Å; I90-C95 HydrophobicContact CD1-CB 4.26Å; I90-C95 HydrophobicContact CG1-CB 4.42Å; I90-C95 HydrophobicContact CG2-CB 4.17Å
91S89.1Confident85.1Confident59 Ų5949.8 Ų49.841%0.41330%0.298SS..EExtended strand (participates in β ladder)trans-63.9152.217667.30000110.6N93 G94 C95S91-N93 VanDerWaalsContact C-N 3.26Å; S91-N93 PolarHBondContact O-N 3.47Å; S91-G94 WeakPolarHBondContact O-CA 3.48Å; S91-G94 PolarHBondContact O-N 2.85Å; S91-G94 PolarHBondContact OG-N 3.23Å; S91-C95 WeakPolarHBondContact O-CB 3.21Å; S91-C95 PolarHBondContact O-N 2.94Å
92Y84.9Confident85.4Confident58 Ų5848.4 Ų48.423%0.22729%0.285CS..Hα-helixtrans-51.7-46.8176176.3-83.7000111.9T8 F10 G94 C95 A96 F162 F166T8-Y92 PolarHBondContact O-N 2.87Å; F10-Y92 AromaticContact CE2-CD2 3.55Å; F10-Y92 HydrophobicContact CE2-CD2 3.55Å; F10-Y92 HydrophobicContact CE2-CE2 4.34Å; F10-Y92 HydrophobicContact CE2-CG 4.21Å; F10-Y92 AromaticContact CZ-CD2 3.89Å; F10-Y92 HydrophobicContact CZ-CD2 3.89Å; F10-Y92 HydrophobicContact CZ-CE2 4.39Å; Y92-G94 PolarHBondContact O-N 3.12Å; Y92-C95 WeakPolarHBondContact O-CB 3.39Å; Y92-C95 PolarHBondContact O-N 2.84Å; Y92-A96 WeakPolarHBondContact O-CB 3.35Å; Y92-A96 PolarHBondContact O-N 3.28Å; Y92-F162 HydrophobicContact CD2-CD1 4.46Å; Y92-F162 HydrophobicContact CE1-CD1 4.06Å; Y92-F162 AromaticContact CE2-CD1 3.75Å; Y92-F162 HydrophobicContact CE2-CD1 3.75Å; Y92-F162 HydrophobicContact CE2-CE1 4.4Å; Y92-F162 AromaticContact CZ-CD1 3.53Å; Y92-F162 VanDerWaalsContact OH-CB 3.3Å; Y92-F162 WeakPolarHBondContact OH-CB 2.92Å; Y92-F162 PolarHBondContact OH-O 3.43Å; Y92-F166 HydrophobicContact CE2-CD2 4.26Å; Y92-F166 AromaticContact CE2-CE2 3.94Å; Y92-F166 HydrophobicContact CE2-CE2 3.94Å
93N86.8Confident85.7Confident123 Ų12348.2 Ų48.266%0.65828%0.282SS*.Hα-helixtrans-67.6-35178.1-70.4-27.1000112.5S91 A96 A97S91-N93 VanDerWaalsContact C-N 3.26Å; S91-N93 PolarHBondContact O-N 3.47Å; N93-A96 PolarHBondContact O-N 2.99Å; N93-A97 WeakPolarHBondContact O-CB 3.34Å; N93-A97 PolarHBondContact O-N 3.47Å
94G87.1Confident86.3Confident25 Ų2546.6 Ų46.626%0.25827%0.274SS..Hα-helixtrans-64.7-43.1173.700000111.8S91 Y92 A97 Q98S91-G94 WeakPolarHBondContact O-CA 3.48Å; S91-G94 PolarHBondContact O-N 2.85Å; S91-G94 PolarHBondContact OG-N 3.23Å; Y92-G94 PolarHBondContact O-N 3.12Å; G94-A97 PolarHBondContact O-N 3.05Å; G94-Q98 VanDerWaalsContact O-CB 3.29Å; G94-Q98 WeakPolarHBondContact O-CB 3.28Å; G94-Q98 PolarHBondContact O-N 2.88Å
95C86.9Confident86.8Confident0 Ų040.1 Ų40.10%024%0.243CC..Hα-helixtrans-62.3-43.8174.8-1740000111.7F10 I90 S91 Y92 Q98 F99 C177F10-C95 HydrophobicContact CD2-CB 3.92Å; F10-C95 HydrophobicContact CE2-CB 4.32Å; I90-C95 HydrophobicContact CD1-CB 4.26Å; I90-C95 HydrophobicContact CG1-CB 4.42Å; I90-C95 HydrophobicContact CG2-CB 4.17Å; S91-C95 WeakPolarHBondContact O-CB 3.21Å; S91-C95 PolarHBondContact O-N 2.94Å; Y92-C95 WeakPolarHBondContact O-CB 3.39Å; Y92-C95 PolarHBondContact O-N 2.84Å; C95-Q98 PolarHBondContact O-N 3.4Å; C95-F99 WeakPolarHBondContact O-CB 3.3Å; C95-F99 PolarHBondContact O-N 3.37Å; C95-C177 WeakPolarHBondContact CA-SG 3.44Å; C95-C177 HydrophobicContact CB-CB 4.13Å; C95-C177 WeakPolarHBondContact CB-SG 3.47Å; C95-C177 WeakPolarHBondContact SG-CB 3.49Å; C95-C177 CovalentContact SG-SG 2.02Å; C95-C177 PolarHBondContact SG-SG 2.9Å
96A88Confident87.2Confident21 Ų2137.3 Ų37.317%0.17423%0.225CC..Hα-helixtrans-64.1-43.6176.400000113.1Y92 N93 F100 F162Y92-A96 WeakPolarHBondContact O-CB 3.35Å; Y92-A96 PolarHBondContact O-N 3.28Å; N93-A96 PolarHBondContact O-N 2.99Å; A96-F100 VanDerWaalsContact O-CB 3.28Å; A96-F100 WeakPolarHBondContact O-CB 3.02Å; A96-F100 PolarHBondContact O-N 2.7Å; A96-F162 HydrophobicContact CB-CD1 4.04Å; A96-F162 HydrophobicContact CB-CD2 4.01Å; A96-F162 HydrophobicContact CB-CE1 3.8Å; A96-F162 HydrophobicContact CB-CE2 3.8Å; A96-F162 HydrophobicContact CB-CG 4.15Å; A96-F162 HydrophobicContact CB-CZ 3.7Å
97A89.9Confident88Confident45 Ų4535.3 Ų35.337%0.37220%0.202SC..Hα-helixtrans-64.6-47.8176.300000111.5N93 G94 F99 F100 F101N93-A97 WeakPolarHBondContact O-CB 3.34Å; N93-A97 PolarHBondContact O-N 3.47Å; G94-A97 PolarHBondContact O-N 3.05Å; A97-F99 VanDerWaalsContact C-N 3.32Å; A97-F99 PolarHBondContact O-N 3.45Å; A97-F100 PolarHBondContact O-N 3.3Å; A97-F101 WeakPolarHBondContact O-CD2 3.42Å; A97-F101 PolarHBondContact O-N 2.93Å
98Q90.8Very high88.7Confident11 Ų1131.2 Ų31.25%0.05118%0.18CC..Hα-helixtrans-57.2-48.2177.6-172.9-167.9-75.800111.1A74 V75 G94 C95 F102A74-Q98 HydrophobicContact CB-CG 4.39Å; A74-Q98 WeakPolarHBondContact O-CG 3.44Å; V75-Q98 HydrophobicContact CG2-CG 4.43Å; G94-Q98 VanDerWaalsContact O-CB 3.29Å; G94-Q98 WeakPolarHBondContact O-CB 3.28Å; G94-Q98 PolarHBondContact O-N 2.88Å; C95-Q98 PolarHBondContact O-N 3.4Å; Q98-F102 WeakPolarHBondContact O-CB 3.08Å; Q98-F102 PolarHBondContact O-N 3.36Å
99F88.6Confident89.1Confident0 Ų029 Ų290%017%0.171CC..Hα-helixtrans-57.4-49.6176.6175.9-90.2000112.2C95 A97 F102 V103 H157 A158 F162 C177 I179 L182C95-F99 WeakPolarHBondContact O-CB 3.3Å; C95-F99 PolarHBondContact O-N 3.37Å; A97-F99 VanDerWaalsContact C-N 3.32Å; A97-F99 PolarHBondContact O-N 3.45Å; F99-F102 PolarHBondContact O-N 2.94Å; F99-V103 HydrophobicContact CD1-CG2 4.5Å; F99-V103 HydrophobicContact CD2-CG2 4.27Å; F99-V103 HydrophobicContact CE1-CG2 4.02Å; F99-V103 HydrophobicContact CE2-CG2 3.78Å; F99-V103 HydrophobicContact CZ-CG2 3.63Å; F99-V103 WeakPolarHBondContact O-CG2 3.49Å; F99-V103 PolarHBondContact O-N 3.47Å; F99-H157 HydrophobicContact CE1-CB 3.93Å; F99-H157 HydrophobicContact CZ-CB 3.89Å; F99-A158 HydrophobicContact CD1-CB 4.15Å; F99-A158 HydrophobicContact CE1-CB 4.15Å; F99-F162 HydrophobicContact CB-CE2 4.04Å; F99-F162 HydrophobicContact CB-CZ 4.23Å; F99-F162 AromaticContact CD1-CE2 3.8Å; F99-F162 HydrophobicContact CD1-CE2 3.8Å; F99-F162 AromaticContact CG-CE2 3.93Å; F99-F162 HydrophobicContact CG-CE2 3.93Å; F99-F162 HydrophobicContact CG-CZ 4.43Å; F99-C177 HydrophobicContact CB-CB 4.43Å; F99-I179 HydrophobicContact CE2-CB 4.31Å; F99-I179 HydrophobicContact CE2-CD1 4.23Å; F99-I179 HydrophobicContact CE2-CG1 3.28Å; F99-I179 HydrophobicContact CZ-CD1 3.92Å; F99-I179 HydrophobicContact CZ-CG1 3.4Å; F99-I179 VanDerWaalsContact CZ-CG1 3.4Å; F99-L182 HydrophobicContact CD2-CD1 4.2Å
100F91.2Very high89.3Confident55 Ų5528.2 Ų28.224%0.24116%0.163CC..Hα-helixtrans-60.7-49-177.3178.6-92.2000112A96 A97 G104 F151 A154 S155 A158A96-F100 VanDerWaalsContact O-CB 3.28Å; A96-F100 WeakPolarHBondContact O-CB 3.02Å; A96-F100 PolarHBondContact O-N 2.7Å; A97-F100 PolarHBondContact O-N 3.3Å; F100-G104 PolarHBondContact O-N 2.95Å; F100-F151 AromaticContact CE1-CD1 3.68Å; F100-F151 HydrophobicContact CE1-CD1 3.68Å; F100-F151 HydrophobicContact CE1-CE1 4.11Å; F100-F151 HydrophobicContact CZ-CB 4.39Å; F100-F151 AromaticContact CZ-CD1 3.85Å; F100-F151 HydrophobicContact CZ-CD1 3.85Å; F100-A154 HydrophobicContact CD2-CB 3.71Å; F100-A154 HydrophobicContact CE2-CB 3.77Å; F100-A154 HydrophobicContact CG-CB 4.26Å; F100-A154 HydrophobicContact CZ-CB 4.33Å; F100-A154 WeakPolarHBondContact O-CB 3.34Å; F100-S155 WeakPolarHBondContact CE2-OG 3.43Å; F100-A158 HydrophobicContact CD2-CB 4.21Å
101F91Very high89.7Confident92 Ų9228.8 Ų28.840%0.40417%0.165SC..Hα-helixtrans-66.9-40.6178.5-75.2-65.5000111.8A74 A97 G104 F105A74-F101 HydrophobicContact CB-CB 4.28Å; A97-F101 WeakPolarHBondContact O-CD2 3.42Å; A97-F101 PolarHBondContact O-N 2.93Å; F101-G104 PolarHBondContact O-N 2.89Å; F101-F105 HydrophobicContact CB-CD2 4.1Å; F101-F105 HydrophobicContact CB-CE2 4.05Å; F101-F105 HydrophobicContact CD1-CD2 4.37Å; F101-F105 AromaticContact CD1-CE2 3.62Å; F101-F105 HydrophobicContact CD1-CE2 3.62Å; F101-F105 HydrophobicContact CD1-CZ 4.06Å; F101-F105 HydrophobicContact CG-CE2 4.23Å; F101-F105 VanDerWaalsContact O-CB 3.27Å; F101-F105 WeakPolarHBondContact O-CB 3.12Å; F101-F105 WeakPolarHBondContact O-CD2 3.12Å; F101-F105 WeakPolarHBondContact O-CG 3.2Å; F101-F105 PolarHBondContact O-N 3.41Å
102F87.8Confident89.9Confident12 Ų1226 Ų265%0.05315%0.145CC..Hα-helixtrans-59.1-56.7177.8180-97.5000111.7Y71 V75 Q98 F99 G104 A106 F176 Y276 T277Y71-F102 HydrophobicContact CD2-CD2 4.28Å; Y71-F102 AromaticContact CD2-CE2 4Å; Y71-F102 HydrophobicContact CD2-CE2 4Å; Y71-F102 HydrophobicContact CG-CD2 4.5Å; V75-F102 HydrophobicContact CG2-CD2 3.86Å; V75-F102 HydrophobicContact CG2-CG 4.5Å; Q98-F102 WeakPolarHBondContact O-CB 3.08Å; Q98-F102 PolarHBondContact O-N 3.36Å; F99-F102 PolarHBondContact O-N 2.94Å; F102-G104 VanDerWaalsContact C-N 3.32Å; F102-G104 PolarHBondContact O-N 3.45Å; F102-A106 VanDerWaalsContact O-CB 3.26Å; F102-A106 WeakPolarHBondContact O-CB 3.09Å; F102-A106 PolarHBondContact O-N 2.94Å; F102-F176 HydrophobicContact CD1-CE2 4.06Å; F102-F176 HydrophobicContact CE1-CE2 4.1Å; F102-F176 HydrophobicContact CG-CE2 4.39Å; F102-F176 HydrophobicContact CZ-CE2 4.49Å; F102-Y276 AromaticContact CE1-CE2 3.99Å; F102-Y276 HydrophobicContact CE1-CE2 3.99Å; F102-Y276 AromaticContact CZ-CD2 3.88Å; F102-Y276 HydrophobicContact CZ-CD2 3.88Å; F102-Y276 AromaticContact CZ-CE2 3.56Å; F102-Y276 HydrophobicContact CZ-CE2 3.56Å; F102-T277 HydrophobicContact CE2-CG2 3.62Å; F102-T277 HydrophobicContact CZ-CG2 3.64Å
103V88.1Confident90.3Very high12 Ų1223.3 Ų23.37%0.07313%0.134CC..Hα-helixtrans-63.2-40.8-179.5173.30000111.3F99 T107 A154F99-V103 HydrophobicContact CD1-CG2 4.5Å; F99-V103 HydrophobicContact CD2-CG2 4.27Å; F99-V103 HydrophobicContact CE1-CG2 4.02Å; F99-V103 HydrophobicContact CE2-CG2 3.78Å; F99-V103 HydrophobicContact CZ-CG2 3.63Å; F99-V103 WeakPolarHBondContact O-CG2 3.49Å; F99-V103 PolarHBondContact O-N 3.47Å; V103-T107 WeakPolarHBondContact O-CB 3.34Å; V103-T107 PolarHBondContact O-N 3.18Å; V103-T107 PolarHBondContact O-OG1 2.72Å; V103-A154 HydrophobicContact CB-CB 4.34Å; V103-A154 HydrophobicContact CG1-CB 4.24Å
104G92.4Very high90.6Very high0 Ų017.7 Ų17.70%011%0.105CC..Hα-helixtrans-59.1-59.6179.400000110.9F100 F101 F102 A106 T107 V108 G150F100-G104 PolarHBondContact O-N 2.95Å; F101-G104 PolarHBondContact O-N 2.89Å; F102-G104 VanDerWaalsContact C-N 3.32Å; F102-G104 PolarHBondContact O-N 3.45Å; G104-A106 PolarHBondContact O-N 3.45Å; G104-T107 WeakPolarHBondContact O-CB 3.19Å; G104-T107 PolarHBondContact O-N 3.33Å; G104-T107 VanDerWaalsContact O-N 3.13Å; G104-V108 WeakPolarHBondContact O-CG2 3.03Å; G104-V108 PolarHBondContact O-N 3.32Å; G104-G150 WeakPolarHBondContact CA-O 3.36Å
105F92.3Very high91Very high16 Ų1616.9 Ų16.97%0.0710%0.096CC..Hα-helixtrans-63.5-41.5-178.2-73.1-43.6000113.2F66 V67 Y71 F101 T107 V108 E109 Y147 F151F66-F105 HydrophobicContact CE1-CE1 4.19Å; F66-F105 HydrophobicContact CE1-CZ 4.46Å; V67-F105 HydrophobicContact CB-CD1 4.32Å; V67-F105 HydrophobicContact CG1-CB 3.61Å; V67-F105 HydrophobicContact CG1-CD1 4.05Å; V67-F105 HydrophobicContact CG1-CG 4.18Å; V67-F105 WeakPolarHBondContact CG1-O 3.24Å; V67-F105 HydrophobicContact CG2-CD1 4Å; Y71-F105 HydrophobicContact CD1-CB 3.97Å; Y71-F105 HydrophobicContact CG-CB 4.49Å; F101-F105 HydrophobicContact CB-CD2 4.1Å; F101-F105 HydrophobicContact CB-CE2 4.05Å; F101-F105 HydrophobicContact CD1-CD2 4.37Å; F101-F105 AromaticContact CD1-CE2 3.62Å; F101-F105 HydrophobicContact CD1-CE2 3.62Å; F101-F105 HydrophobicContact CD1-CZ 4.06Å; F101-F105 HydrophobicContact CG-CE2 4.23Å; F101-F105 VanDerWaalsContact O-CB 3.27Å; F101-F105 WeakPolarHBondContact O-CB 3.12Å; F101-F105 WeakPolarHBondContact O-CD2 3.12Å; F101-F105 WeakPolarHBondContact O-CG 3.2Å; F101-F105 PolarHBondContact O-N 3.41Å; F105-T107 PolarHBondContact O-N 3.48Å; F105-V108 PolarHBondContact O-N 3.48Å; F105-V108 VanDerWaalsContact O-N 3.08Å; F105-E109 PolarHBondContact O-N 3.03Å; F105-Y147 HydrophobicContact CE1-CE1 4.45Å; F105-F151 HydrophobicContact CD1-CZ 4.4Å; F105-F151 HydrophobicContact CE1-CE1 4.45Å; F105-F151 AromaticContact CE1-CZ 3.87Å; F105-F151 HydrophobicContact CE1-CZ 3.87Å; F105-F151 HydrophobicContact CZ-CZ 4.33Å
106A86.8Confident91.4Very high25 Ų2516.9 Ų16.921%0.20710%0.096CC..Hα-helixtrans-58.4-37.3174.300000112F102 G104 C110F102-A106 VanDerWaalsContact O-CB 3.26Å; F102-A106 WeakPolarHBondContact O-CB 3.09Å; F102-A106 PolarHBondContact O-N 2.94Å; G104-A106 PolarHBondContact O-N 3.45Å; A106-C110 PolarHBondContact O-N 2.77Å; A106-C110 PolarHBondContact O-SG 2.89Å; A106-C110 VanDerWaalsContact O-SG 3.33Å
107T91Very high91.6Very high12 Ų1215.9 Ų15.97%0.0749%0.088CC..Hα-helixtrans-70.3-41.4175.4-520000111.5V103 G104 F105 E109 C110 Y111 N153V103-T107 WeakPolarHBondContact O-CB 3.34Å; V103-T107 PolarHBondContact O-N 3.18Å; V103-T107 PolarHBondContact O-OG1 2.72Å; G104-T107 WeakPolarHBondContact O-CB 3.19Å; G104-T107 PolarHBondContact O-N 3.33Å; G104-T107 VanDerWaalsContact O-N 3.13Å; F105-T107 PolarHBondContact O-N 3.48Å; T107-E109 VanDerWaalsContact C-N 3.29Å; T107-E109 PolarHBondContact O-N 3.39Å; T107-C110 WeakPolarHBondContact O-CB 3.4Å; T107-C110 PolarHBondContact O-N 3.17Å; T107-Y111 HydrophobicContact CG2-CD2 4.07Å; T107-Y111 HydrophobicContact CG2-CE2 3.87Å; T107-Y111 VanDerWaalsContact O-CD2 3.32Å; T107-Y111 WeakPolarHBondContact O-CD2 3.27Å; T107-Y111 PolarHBondContact O-N 3.32Å; T107-N153 HydrophobicContact CG2-CB 4.03Å; T107-N153 PolarHBondContact OG1-ND2 3.47Å
108V94.8Very high91.8Very high0 Ų017.5 Ų17.50%08%0.084CC..Hα-helixtrans-58.8-42.5175.2-176.90000110.7V67 G104 F105 C110 Y111 L112 Y147V67-V108 HydrophobicContact CG1-CB 4.32Å; V67-V108 HydrophobicContact CG2-CB 4.13Å; V67-V108 HydrophobicContact CG2-CG1 3.75Å; G104-V108 WeakPolarHBondContact O-CG2 3.03Å; G104-V108 PolarHBondContact O-N 3.32Å; F105-V108 PolarHBondContact O-N 3.48Å; F105-V108 VanDerWaalsContact O-N 3.08Å; V108-C110 VanDerWaalsContact C-N 3.35Å; V108-C110 PolarHBondContact O-N 3.33Å; V108-Y111 PolarHBondContact O-N 3.33Å; V108-Y111 VanDerWaalsContact O-N 3.17Å; V108-L112 HydrophobicContact CG1-CD1 3.77Å; V108-L112 HydrophobicContact CG1-CG 3.99Å; V108-L112 WeakPolarHBondContact O-CG 3.42Å; V108-L112 PolarHBondContact O-N 3.01Å; V108-Y147 HydrophobicContact CG1-CD1 3.92Å; V108-Y147 HydrophobicContact CG1-CD2 4.48Å; V108-Y147 HydrophobicContact CG1-CE1 3.95Å; V108-Y147 HydrophobicContact CG1-CE2 4.49Å; V108-Y147 HydrophobicContact CG1-CG 4.2Å; V108-Y147 HydrophobicContact CG2-CD1 3.86Å; V108-Y147 HydrophobicContact CG2-CE1 4.43Å; V108-Y147 HydrophobicContact CG2-CG 4.39Å
109E91.2Very high92Very high1 Ų117 Ų171%0.0058%0.082CC..Hα-helixtrans-54.8-47.1176.1171165.4-160.400111.7L64 V67 Y71 F105 T107 Y111 L112 L113 F249 N284L64-E109 HydrophobicContact CD1-CB 4.15Å; L64-E109 HydrophobicContact CD1-CG 3.67Å; V67-E109 HydrophobicContact CG1-CB 4.17Å; Y71-E109 WeakPolarHBondContact CE1-OE2 3.33Å; Y71-E109 PolarHBondContact OH-OE2 2.94Å; F105-E109 PolarHBondContact O-N 3.03Å; T107-E109 VanDerWaalsContact C-N 3.29Å; T107-E109 PolarHBondContact O-N 3.39Å; E109-Y111 VanDerWaalsContact C-N 3.32Å; E109-Y111 PolarHBondContact O-N 3Å; E109-L112 PolarHBondContact O-N 3.31Å; E109-L113 HydrophobicContact CG-CD1 4.12Å; E109-L113 HydrophobicContact CG-CG 4.46Å; E109-L113 WeakPolarHBondContact O-CG 3.45Å; E109-L113 PolarHBondContact O-N 3.06Å; E109-F249 HydrophobicContact CG-CD2 4.26Å; E109-F249 HydrophobicContact CG-CE2 3.72Å; E109-F249 HydrophobicContact CG-CZ 4.09Å; E109-F249 WeakPolarHBondContact OE2-CE2 3.37Å; E109-N284 PolarHBondContact OE1-ND2 3.46Å
110C90.8Very high92.1Very high11 Ų1118.9 Ų18.97%0.0749%0.089CC..Hα-helixtrans-55.4-45.5176.6-620000112.7A106 T107 V108 A114 T208 F249A106-C110 PolarHBondContact O-N 2.77Å; A106-C110 PolarHBondContact O-SG 2.89Å; A106-C110 VanDerWaalsContact O-SG 3.33Å; T107-C110 WeakPolarHBondContact O-CB 3.4Å; T107-C110 PolarHBondContact O-N 3.17Å; V108-C110 VanDerWaalsContact C-N 3.35Å; V108-C110 PolarHBondContact O-N 3.33Å; C110-A114 PolarHBondContact O-N 2.75Å; C110-A114 VanDerWaalsContact O-N 3.1Å; C110-T208 HydrophobicContact CB-CG2 4.04Å; C110-F249 WeakPolarHBondContact SG-CE1 3.46Å
111Y94.6Very high92.3Very high27 Ų2718.1 Ų18.111%0.1069%0.086CC..Hα-helixtrans-73.3-34-179.4-79.2-76.9000113T107 V108 E109 A114 S115 S146 S149 N204 F207 T208T107-Y111 HydrophobicContact CG2-CD2 4.07Å; T107-Y111 HydrophobicContact CG2-CE2 3.87Å; T107-Y111 VanDerWaalsContact O-CD2 3.32Å; T107-Y111 WeakPolarHBondContact O-CD2 3.27Å; T107-Y111 PolarHBondContact O-N 3.32Å; V108-Y111 PolarHBondContact O-N 3.33Å; V108-Y111 VanDerWaalsContact O-N 3.17Å; E109-Y111 VanDerWaalsContact C-N 3.32Å; E109-Y111 PolarHBondContact O-N 3Å; Y111-A114 PolarHBondContact O-N 3.13Å; Y111-S115 WeakPolarHBondContact O-CB 3.4Å; Y111-S115 PolarHBondContact O-N 2.95Å; Y111-S115 PolarHBondContact O-OG 2.83Å; Y111-S146 WeakPolarHBondContact CB-OG 3.42Å; Y111-S149 VanDerWaalsContact CE2-CB 3.5Å; Y111-N204 WeakPolarHBondContact CE2-OD1 3.5Å; Y111-N204 PolarHBondContact OH-OD1 2.9Å; Y111-F207 HydrophobicContact CD1-CE1 4.48Å; Y111-F207 AromaticContact CE1-CD1 3.74Å; Y111-F207 HydrophobicContact CE1-CD1 3.74Å; Y111-F207 AromaticContact CE1-CE1 3.82Å; Y111-F207 HydrophobicContact CE1-CE1 3.82Å; Y111-T208 HydrophobicContact CD1-CG2 3.75Å; Y111-T208 HydrophobicContact CD2-CG2 4.38Å; Y111-T208 HydrophobicContact CE1-CG2 3.92Å; Y111-T208 HydrophobicContact CG-CG2 3.99Å
112L94.2Very high92.4Very high0 Ų013.9 Ų13.90%07%0.068CC..Hα-helixtrans-66-43.6173.5-72.2175.5000111F60 N63 L64 V67 V108 E109 A114 S115 M116F60-L112 HydrophobicContact CD1-CD2 3.95Å; N63-L112 HydrophobicContact CB-CD1 3.85Å; N63-L112 HydrophobicContact CB-CD2 4.06Å; L64-L112 HydrophobicContact CB-CD1 4.38Å; V67-L112 HydrophobicContact CG2-CD1 4.14Å; V108-L112 HydrophobicContact CG1-CD1 3.77Å; V108-L112 HydrophobicContact CG1-CG 3.99Å; V108-L112 WeakPolarHBondContact O-CG 3.42Å; V108-L112 PolarHBondContact O-N 3.01Å; E109-L112 PolarHBondContact O-N 3.31Å; L112-A114 VanDerWaalsContact C-N 3.3Å; L112-A114 PolarHBondContact O-N 3.13Å; L112-S115 WeakPolarHBondContact O-CB 3.48Å; L112-S115 PolarHBondContact O-N 2.95Å; L112-S115 VanDerWaalsContact O-N 3.12Å; L112-M116 WeakPolarHBondContact O-CB 3.22Å; L112-M116 VanDerWaalsContact O-CG 3.24Å; L112-M116 WeakPolarHBondContact O-CG 3.49Å; L112-M116 PolarHBondContact O-N 3.29Å
113L91.7Very high92.5Very high1 Ų114.8 Ų14.81%0.0058%0.078CC..Hα-helixtrans-60.3-39.4173.7-69.8174.3000111.9L64 E109 M116 A117 I212 H242 F249L64-L113 HydrophobicContact CD2-CD2 4.23Å; E109-L113 HydrophobicContact CG-CD1 4.12Å; E109-L113 HydrophobicContact CG-CG 4.46Å; E109-L113 WeakPolarHBondContact O-CG 3.45Å; E109-L113 PolarHBondContact O-N 3.06Å; L113-M116 HydrophobicContact CD2-SD 4.48Å; L113-M116 PolarHBondContact O-N 3.24Å; L113-A117 PolarHBondContact O-N 3.13Å; L113-I212 HydrophobicContact CB-CD1 4.45Å; L113-H242 PolarHBondContact O-CE1 3.28Å; L113-H242 PolarHBondContact O-NE2 2.86Å; L113-F249 HydrophobicContact CD1-CB 4.24Å; L113-F249 HydrophobicContact CD1-CD1 4.03Å; L113-F249 HydrophobicContact CD1-CD2 4.32Å; L113-F249 HydrophobicContact CD1-CG 3.93Å
114A93.7Very high92.6Very high5 Ų515.6 Ų15.64%0.0418%0.083CC..Hα-helixtrans-65.4-41.1173.400000112.3C110 Y111 L112 A117 Y118 T208 V211 I212C110-A114 PolarHBondContact O-N 2.75Å; C110-A114 VanDerWaalsContact O-N 3.1Å; Y111-A114 PolarHBondContact O-N 3.13Å; L112-A114 VanDerWaalsContact C-N 3.3Å; L112-A114 PolarHBondContact O-N 3.13Å; A114-A117 WeakPolarHBondContact O-CB 3.42Å; A114-A117 PolarHBondContact O-N 3.01Å; A114-Y118 PolarHBondContact O-N 3Å; A114-T208 HydrophobicContact CB-CG2 4.24Å; A114-V211 HydrophobicContact CB-CB 4.26Å; A114-V211 HydrophobicContact CB-CG1 4.06Å; A114-I212 HydrophobicContact CB-CG1 4.24Å
115S95.9Very high92.5Very high9 Ų916.8 Ų16.86%0.0639%0.091CC..Hα-helixtrans-64.9-38.7176.8-59.80000112Y111 L112 Y118 D119Y111-S115 WeakPolarHBondContact O-CB 3.4Å; Y111-S115 PolarHBondContact O-N 2.95Å; Y111-S115 PolarHBondContact O-OG 2.83Å; L112-S115 WeakPolarHBondContact O-CB 3.48Å; L112-S115 PolarHBondContact O-N 2.95Å; L112-S115 VanDerWaalsContact O-N 3.12Å; S115-Y118 WeakPolarHBondContact O-CB 3.49Å; S115-Y118 PolarHBondContact O-N 2.57Å; S115-D119 PolarHBondContact O-N 3.36Å
116M94Very high92.4Very high0 Ų023.5 Ų23.50%012%0.116CC..Hα-helixtrans-66-40.6173.7-69.3165.878.100111.5M57 F60 L61 L64 L112 L113 Y118 D119 R120 H242 Y288M57-M116 HydrophobicContact CE-CE 3.29Å; M57-M116 HydrophobicContact SD-CB 4.19Å; M57-M116 HydrophobicContact SD-CE 4.04Å; M57-M116 HydrophobicContact SD-CG 4.29Å; F60-M116 HydrophobicContact CB-CG 3.44Å; F60-M116 VanDerWaalsContact CB-CG 3.44Å; F60-M116 HydrophobicContact CB-SD 4.07Å; F60-M116 HydrophobicContact CD2-CG 4.3Å; F60-M116 HydrophobicContact CG-CG 4.09Å; L61-M116 HydrophobicContact CB-CE 4.37Å; L61-M116 HydrophobicContact CD1-CE 4.29Å; L64-M116 HydrophobicContact CD2-CE 4.41Å; L64-M116 HydrophobicContact CD2-SD 4.18Å; L112-M116 WeakPolarHBondContact O-CB 3.22Å; L112-M116 VanDerWaalsContact O-CG 3.24Å; L112-M116 WeakPolarHBondContact O-CG 3.49Å; L112-M116 PolarHBondContact O-N 3.29Å; L113-M116 HydrophobicContact CD2-SD 4.48Å; L113-M116 PolarHBondContact O-N 3.24Å; M116-Y118 VanDerWaalsContact C-N 3.31Å; M116-Y118 PolarHBondContact O-N 3.02Å; M116-D119 PolarHBondContact O-N 3.11Å; M116-R120 WeakPolarHBondContact O-CG 3.37Å; M116-R120 PolarHBondContact O-N 3.38Å; M116-H242 VanDerWaalsContact CB-NE2 3.34Å; M116-H242 WeakPolarHBondContact CB-NE2 3.28Å; M116-Y288 HydrophobicContact CE-CE1 3.77Å; M116-Y288 HydrophobicContact CE-CE2 4.39Å
117A93Very high92.4Very high0 Ų026.5 Ų26.50%013%0.133CC..Hα-helixtrans-61.2-41.4172.400000111.9L113 A114 R120 H121 I212 Y216L113-A117 PolarHBondContact O-N 3.13Å; A114-A117 WeakPolarHBondContact O-CB 3.42Å; A114-A117 PolarHBondContact O-N 3.01Å; A117-R120 PolarHBondContact O-N 3.2Å; A117-H121 WeakPolarHBondContact O-CB 3.32Å; A117-H121 PolarHBondContact O-N 2.92Å; A117-I212 HydrophobicContact CB-CB 4.31Å; A117-I212 HydrophobicContact CB-CG1 3.9Å; A117-I212 HydrophobicContact CB-CG2 4.42Å; A117-Y216 HydrophobicContact CB-CD2 4.41Å; A117-Y216 HydrophobicContact CB-CE2 3.98Å
118Y94.5Very high92.4Very high78 Ų7833.6 Ų33.631%0.30617%0.17SC..Hα-helixtrans-64.2-43.6176.5-179.3-101.2000112.4A114 S115 M116 R120 H121 A122 I133 M134 M138 L142A114-Y118 PolarHBondContact O-N 3Å; S115-Y118 WeakPolarHBondContact O-CB 3.49Å; S115-Y118 PolarHBondContact O-N 2.57Å; M116-Y118 VanDerWaalsContact C-N 3.31Å; M116-Y118 PolarHBondContact O-N 3.02Å; Y118-R120 VanDerWaalsContact C-N 3.35Å; Y118-R120 PolarHBondContact O-N 2.84Å; Y118-H121 WeakPolarHBondContact O-CB 3.41Å; Y118-H121 PolarHBondContact O-N 2.92Å; Y118-A122 PolarHBondContact O-N 3.4Å; Y118-I133 HydrophobicContact CE1-CG2 4.23Å; Y118-M134 HydrophobicContact CD1-SD 3.89Å; Y118-M134 HydrophobicContact CE1-SD 3.82Å; Y118-M138 HydrophobicContact CE1-CE 4.36Å; Y118-L142 HydrophobicContact CD1-CD1 4.28Å
119D94.1Very high92.3Very high1 Ų139 Ų391%0.00520%0.195CC..Hα-helixtrans-54.7-50.1172.6171.871.5000111.3P56 F60 S115 M116 H121 A122 A123 Y130 M134P56-D119 WeakPolarHBondContact CB-OD1 3.37Å; F60-D119 HydrophobicContact CE2-CB 4.49Å; S115-D119 PolarHBondContact O-N 3.36Å; M116-D119 PolarHBondContact O-N 3.11Å; D119-H121 VanDerWaalsContact C-N 3.31Å; D119-H121 PolarHBondContact O-N 2.88Å; D119-A122 PolarHBondContact O-N 2.97Å; D119-A123 WeakPolarHBondContact O-CB 3.29Å; D119-A123 PolarHBondContact O-N 3.03Å; D119-Y130 VanDerWaalsContact OD1-CE2 3.3Å; D119-Y130 WeakPolarHBondContact OD1-CE2 3.34Å; D119-Y130 PolarHBondContact OD1-OH 3.13Å; D119-M134 HydrophobicContact CB-CE 3.75Å
120R92.1Very high92.3Very high40 Ų4041.3 Ų41.315%0.15120%0.204CC..Hα-helixtrans-61.6-39.9178.7-66.4-55.2-177.5-179.73.3112.3M57 M116 A117 Y118 A123 V124 I219 T238M57-R120 HydrophobicContact SD-CG 4.38Å; M57-R120 PolarHBondContact SD-NE 3.27Å; M57-R120 PolarHBondContact SD-NH2 2.89Å; M116-R120 WeakPolarHBondContact O-CG 3.37Å; M116-R120 PolarHBondContact O-N 3.38Å; A117-R120 PolarHBondContact O-N 3.2Å; Y118-R120 VanDerWaalsContact C-N 3.35Å; Y118-R120 PolarHBondContact O-N 2.84Å; R120-A123 PolarHBondContact O-N 3.49Å; R120-V124 WeakPolarHBondContact O-CB 3.35Å; R120-V124 WeakPolarHBondContact O-CG2 3.43Å; R120-V124 PolarHBondContact O-N 3.44Å; R120-I219 HydrophobicContact CB-CD1 4.1Å; R120-T238 VanDerWaalsContact CZ-CG2 3.46Å
121H93.6Very high92.3Very high39 Ų3945.8 Ų45.818%0.18123%0.231CC..Hα-helixtrans-62-48.5174.3164.3-95.1000111.3A117 Y118 D119 A123 V124 C125 I219A117-H121 WeakPolarHBondContact O-CB 3.32Å; A117-H121 PolarHBondContact O-N 2.92Å; Y118-H121 WeakPolarHBondContact O-CB 3.41Å; Y118-H121 PolarHBondContact O-N 2.92Å; D119-H121 VanDerWaalsContact C-N 3.31Å; D119-H121 PolarHBondContact O-N 2.88Å; H121-A123 VanDerWaalsContact C-N 3.31Å; H121-A123 PolarHBondContact O-N 2.93Å; H121-V124 PolarHBondContact O-N 3.24Å; H121-C125 VanDerWaalsContact CD2-SG 3.51Å; H121-C125 VanDerWaalsContact O-CB 3.26Å; H121-C125 WeakPolarHBondContact O-CB 3.4Å; H121-C125 PolarHBondContact O-N 3.08Å; H121-I219 HydrophobicContact CB-CD1 4.26Å; H121-I219 HydrophobicContact CB-CG1 4.35Å
122A93.6Very high92.2Very high2 Ų249 Ų492%0.01725%0.254CS..Hα-helixtrans-59.5-43.117800000111.7Y118 D119 V124 R126 Y130 I133 M134Y118-A122 PolarHBondContact O-N 3.4Å; D119-A122 PolarHBondContact O-N 2.97Å; A122-V124 PolarHBondContact O-N 3.23Å; A122-R126 CarbonylContact O-C 3.52Å; A122-R126 VanDerWaalsContact O-C 3.23Å; A122-R126 WeakPolarHBondContact O-CA 3.16Å; A122-R126 PolarHBondContact O-N 3.02Å; A122-R126 VanDerWaalsContact O-N 3.12Å; A122-Y130 HydrophobicContact CB-CD2 3.99Å; A122-Y130 HydrophobicContact CB-CE2 4.4Å; A122-I133 HydrophobicContact CB-CG2 4.09Å; A122-M134 HydrophobicContact CB-CG 4.03Å
123A91.3Very high92.1Very high32 Ų3251.4 Ų51.426%0.26427%0.266SS..Hα-helixtrans-64.9-39.6-179.800000113.1D119 R120 H121 Y130D119-A123 WeakPolarHBondContact O-CB 3.29Å; D119-A123 PolarHBondContact O-N 3.03Å; R120-A123 PolarHBondContact O-N 3.49Å; H121-A123 VanDerWaalsContact C-N 3.31Å; H121-A123 PolarHBondContact O-N 2.93Å; A123-Y130 VanDerWaalsContact CA-CD2 3.44Å; A123-Y130 HydrophobicContact CB-CD2 3.78Å; A123-Y130 HydrophobicContact CB-CE2 3.69Å; A123-Y130 HydrophobicContact CB-CG 4.44Å
124V89.8Confident92.2Very high29 Ų2951.8 Ų51.818%0.17627%0.268CS..Hα-helixtrans-89.3-46.9-175.1175.10000112.1R120 H121 A122 I219 T222 V235R120-V124 WeakPolarHBondContact O-CB 3.35Å; R120-V124 WeakPolarHBondContact O-CG2 3.43Å; R120-V124 PolarHBondContact O-N 3.44Å; H121-V124 PolarHBondContact O-N 3.24Å; A122-V124 PolarHBondContact O-N 3.23Å; V124-I219 HydrophobicContact CB-CG1 4.34Å; V124-I219 HydrophobicContact CG1-CG2 4.32Å; V124-T222 HydrophobicContact CG1-CG2 3.91Å; V124-V235 HydrophobicContact CG1-CG1 4.04Å; V124-V235 HydrophobicContact CG1-CG2 4.44Å; V124-V235 HydrophobicContact CG2-CG1 3.85Å; V124-V235 HydrophobicContact CG2-CG2 4.36Å
125C90Very high92.3Very high24 Ų2454.5 Ų54.516%0.16228%0.284CS..Hα-helixtrans-85.4-22.6-172.6-60.60000112.8H121 F218 T222H121-C125 VanDerWaalsContact CD2-SG 3.51Å; H121-C125 VanDerWaalsContact O-CB 3.26Å; H121-C125 WeakPolarHBondContact O-CB 3.4Å; H121-C125 PolarHBondContact O-N 3.08Å; C125-F218 VanDerWaalsContact SG-C 3.53Å; C125-F218 PolarHBondContact SG-O 3.34Å; C125-T222 PolarHBondContact SG-OG1 3.38Å
126R89.8Confident92.1Very high158 Ų15858.3 Ų58.360%0.59632%0.316SS*.  trans-13554.5-178.6-61.7-65.2-155.7-163.15.1112.5A122 L128 H129 Y130 I133A122-R126 CarbonylContact O-C 3.52Å; A122-R126 VanDerWaalsContact O-C 3.23Å; A122-R126 WeakPolarHBondContact O-CA 3.16Å; A122-R126 PolarHBondContact O-N 3.02Å; A122-R126 VanDerWaalsContact O-N 3.12Å; R126-L128 VanDerWaalsContact C-N 3.32Å; R126-L128 PolarHBondContact O-N 2.91Å; R126-H129 PolarHBondContact O-N 2.94Å; R126-Y130 PolarHBondContact O-N 3.34Å; R126-I133 HydrophobicContact CB-CD1 4.08Å
127P87.8Confident92.2Very high88 Ų8860.8 Ų60.857%0.57134%0.341SS*.G310 helixtrans-58.7-37.2-170.423.4-34.3000114.1H129 Y130P127-H129 VanDerWaalsContact C-N 3.29Å; P127-H129 PolarHBondContact O-N 3.38Å; P127-Y130 WeakPolarHBondContact O-CB 3.41Å; P127-Y130 PolarHBondContact O-N 2.9Å
128L90.9Very high92.3Very high161 Ų16163.4 Ų63.484%0.84335%0.354SS*.G310 helixtrans-69.9-23.9179.6-65.6175.4000113.8R126R126-L128 VanDerWaalsContact C-N 3.32Å; R126-L128 PolarHBondContact O-N 2.91Å
129H91.7Very high92.4Very high114 Ų11460 Ų6053%0.52834%0.341SS..G310 helixtrans-105.60.5-179.8-69.2-74.2000112.5R126 P127 T131 T132 I133R126-H129 PolarHBondContact O-N 2.94Å; P127-H129 VanDerWaalsContact C-N 3.29Å; P127-H129 PolarHBondContact O-N 3.38Å; H129-T131 VanDerWaalsContact C-N 3.33Å; H129-T131 PolarHBondContact O-N 3.44Å; H129-T132 PolarHBondContact O-N 2.97Å; H129-T132 PolarHBondContact O-OG1 2.93Å; H129-I133 HydrophobicContact CB-CD1 3.83Å; H129-I133 HydrophobicContact CB-CG1 4.31Å; H129-I133 VanDerWaalsContact O-CG1 3.31Å; H129-I133 WeakPolarHBondContact O-CG1 3.18Å; H129-I133 PolarHBondContact O-N 2.99Å
130Y92.2Very high92.5Very high49 Ų4962 Ų6219%0.19236%0.358CS..Hα-helixtrans-54.4-47.6-173.9174.7-108000112.4P56 D119 A122 A123 R126 P127 T132 I133 M134P56-Y130 WeakPolarHBondContact CG-OH 3.3Å; D119-Y130 VanDerWaalsContact OD1-CE2 3.3Å; D119-Y130 WeakPolarHBondContact OD1-CE2 3.34Å; D119-Y130 PolarHBondContact OD1-OH 3.13Å; A122-Y130 HydrophobicContact CB-CD2 3.99Å; A122-Y130 HydrophobicContact CB-CE2 4.4Å; A123-Y130 VanDerWaalsContact CA-CD2 3.44Å; A123-Y130 HydrophobicContact CB-CD2 3.78Å; A123-Y130 HydrophobicContact CB-CE2 3.69Å; A123-Y130 HydrophobicContact CB-CG 4.44Å; R126-Y130 PolarHBondContact O-N 3.34Å; P127-Y130 WeakPolarHBondContact O-CB 3.41Å; P127-Y130 PolarHBondContact O-N 2.9Å; Y130-T132 PolarHBondContact O-N 3.34Å; Y130-I133 PolarHBondContact O-N 3.25Å; Y130-I133 VanDerWaalsContact O-N 3.16Å; Y130-M134 HydrophobicContact CD2-CB 4.25Å; Y130-M134 HydrophobicContact CD2-CG 3.99Å; Y130-M134 HydrophobicContact CE2-CB 3.8Å; Y130-M134 HydrophobicContact CE2-CG 3.56Å; Y130-M134 PolarHBondContact O-N 2.93Å
131T90.2Very high92.7Very high105 Ų10565.6 Ų65.664%0.64438%0.38SS*.Hα-helixtrans-66.7-25.4-179.152.60000113.5H129H129-T131 VanDerWaalsContact C-N 3.33Å; H129-T131 PolarHBondContact O-N 3.44Å
132T92.2Very high92.9Very high95 Ų9565.7 Ų65.758%0.58338%0.382SS*.Hα-helixtrans-85.3-25.517556.60000113.1H129 Y130H129-T132 PolarHBondContact O-N 2.97Å; H129-T132 PolarHBondContact O-OG1 2.93Å; Y130-T132 PolarHBondContact O-N 3.34Å
133I91.9Very high93Very high49 Ų4965.8 Ų65.825%0.25138%0.382SS..Hα-helixtrans-84.3-54.8178.3-65.9164.9000109.9Y118 A122 R126 H129 Y130 T135 M138Y118-I133 HydrophobicContact CE1-CG2 4.23Å; A122-I133 HydrophobicContact CB-CG2 4.09Å; R126-I133 HydrophobicContact CB-CD1 4.08Å; H129-I133 HydrophobicContact CB-CD1 3.83Å; H129-I133 HydrophobicContact CB-CG1 4.31Å; H129-I133 VanDerWaalsContact O-CG1 3.31Å; H129-I133 WeakPolarHBondContact O-CG1 3.18Å; H129-I133 PolarHBondContact O-N 2.99Å; Y130-I133 PolarHBondContact O-N 3.25Å; Y130-I133 VanDerWaalsContact O-N 3.16Å; I133-T135 VanDerWaalsContact C-N 3.34Å; I133-T135 PolarHBondContact O-N 3.41Å; I133-M138 WeakPolarHBondContact O-CG 3.28Å
134M94.8Very high93.3Very high9 Ų968.3 Ų68.34%0.04439%0.394CS..SBendtrans-9463.2-176.5-64.7-58.3-66.400110.9P56 F60 Y118 D119 A122 Y130 L142P56-M134 HydrophobicContact CB-CB 4.34Å; P56-M134 HydrophobicContact CB-CE 4Å; P56-M134 HydrophobicContact CG-CB 4.03Å; F60-M134 HydrophobicContact CE2-CE 3.66Å; F60-M134 HydrophobicContact CZ-CE 4.17Å; Y118-M134 HydrophobicContact CD1-SD 3.89Å; Y118-M134 HydrophobicContact CE1-SD 3.82Å; D119-M134 HydrophobicContact CB-CE 3.75Å; A122-M134 HydrophobicContact CB-CG 4.03Å; Y130-M134 HydrophobicContact CD2-CB 4.25Å; Y130-M134 HydrophobicContact CD2-CG 3.99Å; Y130-M134 HydrophobicContact CE2-CB 3.8Å; Y130-M134 HydrophobicContact CE2-CG 3.56Å; Y130-M134 PolarHBondContact O-N 2.93Å; M134-L142 HydrophobicContact CE-CD1 4.41Å
135T94.9Very high93.7Very high63 Ų6368.5 Ų68.539%0.38740%0.402SS..  trans-75.1162.6172.264.70000111I133 G137 M138 C139I133-T135 VanDerWaalsContact C-N 3.34Å; I133-T135 PolarHBondContact O-N 3.41Å; T135-G137 PolarHBondContact O-N 3.08Å; T135-M138 PolarHBondContact O-N 2.96Å; T135-M138 VanDerWaalsContact O-N 3.13Å; T135-M138 PolarHBondContact OG1-N 3.26Å; T135-C139 PolarHBondContact O-N 3.13Å; T135-C139 PolarHBondContact O-SG 2.96Å
136A92.9Very high94Very high88 Ų8867.4 Ų67.473%0.72740%0.395SS*.Hα-helixtrans-56.6-38.3173.800000112.3C139 A140A136-C139 PolarHBondContact O-N 3.06Å; A136-A140 WeakPolarHBondContact O-CB 3.33Å; A136-A140 PolarHBondContact O-N 2.89Å
137G95.4Very high94.3Very high52 Ų5261.9 Ų61.954%0.53638%0.375SS..Hα-helixtrans-64.2-41.9175.700000112.8T135 A140 L141T135-G137 PolarHBondContact O-N 3.08Å; G137-A140 PolarHBondContact O-N 2.7Å; G137-L141 WeakPolarHBondContact O-CB 3.38Å; G137-L141 PolarHBondContact O-N 3.34Å
138M95.8Very high94.8Very high56 Ų5661.4 Ų61.428%0.27637%0.37SS..Hα-helixtrans-65.3-41.9175.1-173.261154.800111.7Y118 I133 T135 A140 L141 L142Y118-M138 HydrophobicContact CE1-CE 4.36Å; I133-M138 WeakPolarHBondContact O-CG 3.28Å; T135-M138 PolarHBondContact O-N 2.96Å; T135-M138 VanDerWaalsContact O-N 3.13Å; T135-M138 PolarHBondContact OG1-N 3.26Å; M138-A140 PolarHBondContact O-N 3.4Å; M138-L141 PolarHBondContact O-N 3.32Å; M138-L141 HydrophobicContact SD-CD2 4.22Å; M138-L142 HydrophobicContact CG-CD1 4.21Å; M138-L142 WeakPolarHBondContact O-CG 3.28Å; M138-L142 PolarHBondContact O-N 3.17Å
139C95.6Very high94.9Very high5 Ų555.6 Ų55.63%0.03434%0.343CS..Hα-helixtrans-61.3-45.9176.2-610000111.4P56 F59 F60 T135 A136 L141 L142 A143P56-C139 VanDerWaalsContact CB-SG 3.56Å; F59-C139 HydrophobicContact CD1-CB 3.77Å; F59-C139 HydrophobicContact CE1-CB 3.87Å; F59-C139 WeakPolarHBondContact CE1-O 3.42Å; F60-C139 HydrophobicContact CZ-CB 4.2Å; T135-C139 PolarHBondContact O-N 3.13Å; T135-C139 PolarHBondContact O-SG 2.96Å; A136-C139 PolarHBondContact O-N 3.06Å; C139-L141 VanDerWaalsContact C-N 3.33Å; C139-L141 PolarHBondContact O-N 2.92Å; C139-L142 PolarHBondContact O-N 3.33Å; C139-A143 WeakPolarHBondContact O-CB 3.44Å; C139-A143 PolarHBondContact O-N 3.49Å
140A95.8Very high95Very high43 Ų4350.2 Ų50.236%0.35532%0.318SS..Hα-helixtrans-62.5-40.1176.400000112A136 G137 M138 T144A136-A140 WeakPolarHBondContact O-CB 3.33Å; A136-A140 PolarHBondContact O-N 2.89Å; G137-A140 PolarHBondContact O-N 2.7Å; M138-A140 PolarHBondContact O-N 3.4Å; A140-T144 VanDerWaalsContact O-CB 3.25Å; A140-T144 WeakPolarHBondContact O-CB 3.38Å; A140-T144 PolarHBondContact O-N 3.25Å; A140-T144 PolarHBondContact O-OG1 3.3Å
141L97.4Very high95.2Very high116 Ų11650.7 Ų50.761%0.60732%0.321SS*.Hα-helixtrans-62.5-47.8175.9-179.666.3000111.6G137 M138 C139 T144 G145G137-L141 WeakPolarHBondContact O-CB 3.38Å; G137-L141 PolarHBondContact O-N 3.34Å; M138-L141 PolarHBondContact O-N 3.32Å; M138-L141 HydrophobicContact SD-CD2 4.22Å; C139-L141 VanDerWaalsContact C-N 3.33Å; C139-L141 PolarHBondContact O-N 2.92Å; L141-T144 PolarHBondContact O-N 2.91Å; L141-G145 PolarHBondContact O-N 3.42Å
142L97.1Very high95.4Very high42 Ų4250.6 Ų50.622%0.2232%0.316CS..Hα-helixtrans-63.4-43.5178.6-71.5172.4000111.8F60 Y118 M134 M138 C139 S146F60-L142 HydrophobicContact CE1-CB 3.84Å; F60-L142 HydrophobicContact CZ-CB 3.89Å; F60-L142 HydrophobicContact CZ-CD1 3.86Å; Y118-L142 HydrophobicContact CD1-CD1 4.28Å; M134-L142 HydrophobicContact CE-CD1 4.41Å; M138-L142 HydrophobicContact CG-CD1 4.21Å; M138-L142 WeakPolarHBondContact O-CG 3.28Å; M138-L142 PolarHBondContact O-N 3.17Å; C139-L142 PolarHBondContact O-N 3.33Å; L142-S146 WeakPolarHBondContact O-CB 3.42Å; L142-S146 PolarHBondContact O-N 3.33Å; L142-S146 PolarHBondContact O-OG 3.1Å
143A96.6Very high95.4Very high4 Ų446.5 Ų46.53%0.03329%0.291CS..Hα-helixtrans-64.4-48.7175.800000111.6F59 F60 C139 G145 S146 Y147F59-A143 HydrophobicContact CE1-CB 3.71Å; F59-A143 HydrophobicContact CZ-CB 4.01Å; F60-A143 HydrophobicContact CE1-CB 4.49Å; C139-A143 WeakPolarHBondContact O-CB 3.44Å; C139-A143 PolarHBondContact O-N 3.49Å; A143-G145 VanDerWaalsContact C-N 3.33Å; A143-G145 PolarHBondContact O-N 3.18Å; A143-S146 VanDerWaalsContact O-CB 3.29Å; A143-S146 WeakPolarHBondContact O-CB 3.49Å; A143-S146 PolarHBondContact O-N 3.34Å; A143-S146 VanDerWaalsContact O-N 3.09Å; A143-Y147 WeakPolarHBondContact O-CD2 3.24Å; A143-Y147 PolarHBondContact O-N 2.78Å
144T97Very high95.4Very high84 Ų8444.2 Ų44.252%0.51528%0.279SS..Hα-helixtrans-61.1-43.7178.8-54.90000111.1A140 L141 S146 Y147 V148A140-T144 VanDerWaalsContact O-CB 3.25Å; A140-T144 WeakPolarHBondContact O-CB 3.38Å; A140-T144 PolarHBondContact O-N 3.25Å; A140-T144 PolarHBondContact O-OG1 3.3Å; L141-T144 PolarHBondContact O-N 2.91Å; T144-S146 VanDerWaalsContact C-N 3.29Å; T144-S146 PolarHBondContact O-N 3.11Å; T144-Y147 PolarHBondContact O-N 2.87Å; T144-V148 HydrophobicContact CG2-CG2 4.28Å; T144-V148 WeakPolarHBondContact O-CB 2.99Å; T144-V148 VanDerWaalsContact O-CG2 3.31Å; T144-V148 WeakPolarHBondContact O-CG2 3.17Å; T144-V148 PolarHBondContact O-N 2.77Å
145G97Very high95.3Very high33 Ų3346.3 Ų46.334%0.3429%0.294SS..Hα-helixtrans-58.8-40.2174.100000112.4L141 A143 V148 S149L141-G145 PolarHBondContact O-N 3.42Å; A143-G145 VanDerWaalsContact C-N 3.33Å; A143-G145 PolarHBondContact O-N 3.18Å; G145-V148 PolarHBondContact O-N 3.39Å; G145-S149 WeakPolarHBondContact O-CB 3.25Å; G145-S149 PolarHBondContact O-N 2.99Å; G145-S149 PolarHBondContact O-OG 3.48Å
146S96.8Very high95Very high2 Ų247.2 Ų47.21%0.01430%0.296CS..Hα-helixtrans-60.1-48.3175.4-550000111.5Y111 L142 A143 T144 G150Y111-S146 WeakPolarHBondContact CB-OG 3.42Å; L142-S146 WeakPolarHBondContact O-CB 3.42Å; L142-S146 PolarHBondContact O-N 3.33Å; L142-S146 PolarHBondContact O-OG 3.1Å; A143-S146 VanDerWaalsContact O-CB 3.29Å; A143-S146 WeakPolarHBondContact O-CB 3.49Å; A143-S146 PolarHBondContact O-N 3.34Å; A143-S146 VanDerWaalsContact O-N 3.09Å; T144-S146 VanDerWaalsContact C-N 3.29Å; T144-S146 PolarHBondContact O-N 3.11Å; S146-G150 PolarHBondContact O-N 3.39Å
147Y96.9Very high94.7Very high42 Ų4243.2 Ų43.217%0.16526%0.262CS..Hα-helixtrans-64.4-44.8176.9-75.3-75.3000112.9N63 F66 V67 F105 V108 A143 T144 G150 F151N63-Y147 WeakPolarHBondContact OD1-CE2 3.28Å; N63-Y147 PolarHBondContact OD1-OH 3.03Å; F66-Y147 HydrophobicContact CD1-CE1 4.45Å; F66-Y147 WeakPolarHBondContact CD1-OH 3.32Å; F66-Y147 HydrophobicContact CE1-CE1 4.47Å; V67-Y147 HydrophobicContact CG2-CE1 3.9Å; F105-Y147 HydrophobicContact CE1-CE1 4.45Å; V108-Y147 HydrophobicContact CG1-CD1 3.92Å; V108-Y147 HydrophobicContact CG1-CD2 4.48Å; V108-Y147 HydrophobicContact CG1-CE1 3.95Å; V108-Y147 HydrophobicContact CG1-CE2 4.49Å; V108-Y147 HydrophobicContact CG1-CG 4.2Å; V108-Y147 HydrophobicContact CG2-CD1 3.86Å; V108-Y147 HydrophobicContact CG2-CE1 4.43Å; V108-Y147 HydrophobicContact CG2-CG 4.39Å; A143-Y147 WeakPolarHBondContact O-CD2 3.24Å; A143-Y147 PolarHBondContact O-N 2.78Å; T144-Y147 PolarHBondContact O-N 2.87Å; Y147-G150 PolarHBondContact O-N 3.22Å; Y147-F151 AromaticContact CD1-CE2 3.73Å; Y147-F151 HydrophobicContact CD1-CE2 3.73Å; Y147-F151 HydrophobicContact CD1-CZ 4.38Å; Y147-F151 HydrophobicContact CG-CE2 4.44Å; Y147-F151 WeakPolarHBondContact O-CD2 3.49Å; Y147-F151 PolarHBondContact O-N 2.85Å
148V97Very high94.4Very high77 Ų7741.5 Ų41.547%0.46724%0.243SC..Hα-helixtrans-60.2-49.9178.2169.60000110.2T144 G145 G150 F151 L152T144-V148 HydrophobicContact CG2-CG2 4.28Å; T144-V148 WeakPolarHBondContact O-CB 2.99Å; T144-V148 VanDerWaalsContact O-CG2 3.31Å; T144-V148 WeakPolarHBondContact O-CG2 3.17Å; T144-V148 PolarHBondContact O-N 2.77Å; G145-V148 PolarHBondContact O-N 3.39Å; V148-G150 VanDerWaalsContact C-N 3.32Å; V148-G150 PolarHBondContact O-N 3.49Å; V148-F151 PolarHBondContact O-N 3.18Å; V148-L152 HydrophobicContact CG1-CD1 3.63Å; V148-L152 HydrophobicContact CG1-CG 4.27Å; V148-L152 VanDerWaalsContact O-CB 3.26Å; V148-L152 WeakPolarHBondContact O-CB 3.18Å; V148-L152 WeakPolarHBondContact O-CG 3.33Å; V148-L152 PolarHBondContact O-N 3.32Å
149S94.6Very high93.9Very high40 Ų4041.3 Ų41.328%0.2825%0.251SS..Hα-helixtrans-59.5-42.8176.3-73.10000112Y111 G145 N153Y111-S149 VanDerWaalsContact CE2-CB 3.5Å; G145-S149 WeakPolarHBondContact O-CB 3.25Å; G145-S149 PolarHBondContact O-N 2.99Å; G145-S149 PolarHBondContact O-OG 3.48Å; S149-N153 VanDerWaalsContact O-CB 3.25Å; S149-N153 WeakPolarHBondContact O-CB 3.23Å; S149-N153 PolarHBondContact O-N 2.92Å
150G94Very high93.3Very high0 Ų042.4 Ų42.40%026%0.263CS..Hα-helixtrans-64.7-47.8179.600000113.7G104 S146 Y147 V148 N153 A154G104-G150 WeakPolarHBondContact CA-O 3.36Å; S146-G150 PolarHBondContact O-N 3.39Å; Y147-G150 PolarHBondContact O-N 3.22Å; V148-G150 VanDerWaalsContact C-N 3.32Å; V148-G150 PolarHBondContact O-N 3.49Å; G150-N153 WeakPolarHBondContact O-CB 3.28Å; G150-N153 PolarHBondContact O-N 2.68Å; G150-A154 PolarHBondContact O-N 3.09Å
151F95Very high92.7Very high60 Ų6040.5 Ų40.526%0.26325%0.247SC..Hα-helixtrans-73.9-29.9179.8-68.2-57.7000113.3F100 F105 Y147 V148 S155F100-F151 AromaticContact CE1-CD1 3.68Å; F100-F151 HydrophobicContact CE1-CD1 3.68Å; F100-F151 HydrophobicContact CE1-CE1 4.11Å; F100-F151 HydrophobicContact CZ-CB 4.39Å; F100-F151 AromaticContact CZ-CD1 3.85Å; F100-F151 HydrophobicContact CZ-CD1 3.85Å; F105-F151 HydrophobicContact CD1-CZ 4.4Å; F105-F151 HydrophobicContact CE1-CE1 4.45Å; F105-F151 AromaticContact CE1-CZ 3.87Å; F105-F151 HydrophobicContact CE1-CZ 3.87Å; F105-F151 HydrophobicContact CZ-CZ 4.33Å; Y147-F151 AromaticContact CD1-CE2 3.73Å; Y147-F151 HydrophobicContact CD1-CE2 3.73Å; Y147-F151 HydrophobicContact CD1-CZ 4.38Å; Y147-F151 HydrophobicContact CG-CE2 4.44Å; Y147-F151 WeakPolarHBondContact O-CD2 3.49Å; Y147-F151 PolarHBondContact O-N 2.85Å; V148-F151 PolarHBondContact O-N 3.18Å; F151-S155 WeakPolarHBondContact O-CB 3.13Å; F151-S155 PolarHBondContact O-N 3.07Å; F151-S155 PolarHBondContact O-OG 3.41Å
152L94.4Very high92Very high103 Ų10336.1 Ų36.154%0.53922%0.223SC..Hα-helixtrans-64.3-45.1169.1-74.2173.3000110.9V148 A154 S155 I156V148-L152 HydrophobicContact CG1-CD1 3.63Å; V148-L152 HydrophobicContact CG1-CG 4.27Å; V148-L152 VanDerWaalsContact O-CB 3.26Å; V148-L152 WeakPolarHBondContact O-CB 3.18Å; V148-L152 WeakPolarHBondContact O-CG 3.33Å; V148-L152 PolarHBondContact O-N 3.32Å; L152-A154 PolarHBondContact O-N 3.46Å; L152-S155 PolarHBondContact O-N 3.45Å; L152-I156 WeakPolarHBondContact O-CG1 3.11Å; L152-I156 PolarHBondContact O-N 3.27Å
153N92.2Very high91.3Very high9 Ų944.7 Ų44.75%0.04825%0.252CS..Hα-helixtrans-57.5-49.7175-174.555000111.5T107 S149 G150 S155 I156 H157 V200T107-N153 HydrophobicContact CG2-CB 4.03Å; T107-N153 PolarHBondContact OG1-ND2 3.47Å; S149-N153 VanDerWaalsContact O-CB 3.25Å; S149-N153 WeakPolarHBondContact O-CB 3.23Å; S149-N153 PolarHBondContact O-N 2.92Å; G150-N153 WeakPolarHBondContact O-CB 3.28Å; G150-N153 PolarHBondContact O-N 2.68Å; N153-S155 VanDerWaalsContact C-N 3.32Å; N153-S155 PolarHBondContact O-N 3.21Å; N153-I156 PolarHBondContact O-N 2.88Å; N153-H157 PolarHBondContact O-CD2 3.12Å; N153-H157 PolarHBondContact O-N 2.86Å; N153-H157 VanDerWaalsContact O-N 3.07Å; N153-H157 PolarHBondContact OD1-CD2 3.34Å; N153-H157 PolarHBondContact OD1-NE2 3.38Å; N153-H157 VanDerWaalsContact OD1-NE2 3.11Å; N153-V200 WeakPolarHBondContact OD1-CG1 3.23Å
154A91.9Very high90.5Very high0 Ų045.6 Ų45.60%026%0.256CS..Hα-helixtrans-59.8-40.6176.300000112.6F100 V103 G150 L152 H157 A158F100-A154 HydrophobicContact CD2-CB 3.71Å; F100-A154 HydrophobicContact CE2-CB 3.77Å; F100-A154 HydrophobicContact CG-CB 4.26Å; F100-A154 HydrophobicContact CZ-CB 4.33Å; F100-A154 WeakPolarHBondContact O-CB 3.34Å; V103-A154 HydrophobicContact CB-CB 4.34Å; V103-A154 HydrophobicContact CG1-CB 4.24Å; G150-A154 PolarHBondContact O-N 3.09Å; L152-A154 PolarHBondContact O-N 3.46Å; A154-H157 PolarHBondContact O-N 3.25Å; A154-A158 WeakPolarHBondContact O-CB 3.49Å; A154-A158 PolarHBondContact O-N 2.94Å
155S92.6Very high89.6Confident54 Ų5442.6 Ų42.638%0.37824%0.239SC..Hα-helixtrans-63.6-44.1178.3-60.40000111.9F100 F151 L152 N153 A158 A159F100-S155 WeakPolarHBondContact CE2-OG 3.43Å; F151-S155 WeakPolarHBondContact O-CB 3.13Å; F151-S155 PolarHBondContact O-N 3.07Å; F151-S155 PolarHBondContact O-OG 3.41Å; L152-S155 PolarHBondContact O-N 3.45Å; N153-S155 VanDerWaalsContact C-N 3.32Å; N153-S155 PolarHBondContact O-N 3.21Å; S155-A158 PolarHBondContact O-N 3.41Å; S155-A159 WeakPolarHBondContact O-CB 3.27Å; S155-A159 PolarHBondContact O-N 2.76Å
156I89.5Confident88.8Confident81 Ų8142 Ų4242%0.41523%0.227SC..Hα-helixtrans-60.5-47.6177.2-68.5164.7000110L152 N153 G160 V196L152-I156 WeakPolarHBondContact O-CG1 3.11Å; L152-I156 PolarHBondContact O-N 3.27Å; N153-I156 PolarHBondContact O-N 2.88Å; I156-G160 PolarHBondContact O-N 3.08Å; I156-V196 HydrophobicContact CG2-CG1 3.7Å
157H86.9Confident87.6Confident4 Ų446.2 Ų46.22%0.01926%0.255CS..Hα-helixtrans-70.4-39.9-179.7-69.6-49000113F99 N153 A154 G160 T161 I179F99-H157 HydrophobicContact CE1-CB 3.93Å; F99-H157 HydrophobicContact CZ-CB 3.89Å; N153-H157 PolarHBondContact O-CD2 3.12Å; N153-H157 PolarHBondContact O-N 2.86Å; N153-H157 VanDerWaalsContact O-N 3.07Å; N153-H157 PolarHBondContact OD1-CD2 3.34Å; N153-H157 PolarHBondContact OD1-NE2 3.38Å; N153-H157 VanDerWaalsContact OD1-NE2 3.11Å; A154-H157 PolarHBondContact O-N 3.25Å; H157-G160 PolarHBondContact O-N 3.31Å; H157-T161 VanDerWaalsContact O-CB 3.29Å; H157-T161 WeakPolarHBondContact O-CB 3.17Å; H157-T161 PolarHBondContact O-N 3.45Å; H157-T161 PolarHBondContact O-OG1 3.02Å; H157-I179 HydrophobicContact CB-CD1 4.21Å
158A87.3Confident86.2Confident16 Ų1645.9 Ų45.913%0.13227%0.265CS..Hα-helixtrans-65.3-48.2177.500000110.4F99 F100 A154 S155 G160 T161 F162F99-A158 HydrophobicContact CD1-CB 4.15Å; F99-A158 HydrophobicContact CE1-CB 4.15Å; F100-A158 HydrophobicContact CD2-CB 4.21Å; A154-A158 WeakPolarHBondContact O-CB 3.49Å; A154-A158 PolarHBondContact O-N 2.94Å; S155-A158 PolarHBondContact O-N 3.41Å; A158-G160 VanDerWaalsContact C-N 3.3Å; A158-G160 PolarHBondContact O-N 2.99Å; A158-T161 PolarHBondContact O-N 3.11Å; A158-F162 HydrophobicContact CB-CD2 4.29Å; A158-F162 WeakPolarHBondContact O-CB 3.5Å; A158-F162 WeakPolarHBondContact O-CD2 3.46Å; A158-F162 PolarHBondContact O-N 3.01Å
159A86Confident85Confident53 Ų5345.7 Ų45.744%0.43827%0.267SS..Hα-helixtrans-61.8-37.9176.200000112.1S155 R163S155-A159 WeakPolarHBondContact O-CB 3.27Å; S155-A159 PolarHBondContact O-N 2.76Å; A159-R163 VanDerWaalsContact O-CB 3.23Å; A159-R163 WeakPolarHBondContact O-CB 3.43Å; A159-R163 WeakPolarHBondContact O-CD 3.45Å; A159-R163 WeakPolarHBondContact O-CG 3.18Å; A159-R163 PolarHBondContact O-N 3.5Å
160G83.4Confident84.3Confident28 Ų2846 Ų4629%0.28927%0.266SS..Hα-helixtrans-68.9-39.9177.200000113.6I156 H157 A158I156-G160 PolarHBondContact O-N 3.08Å; H157-G160 PolarHBondContact O-N 3.31Å; A158-G160 VanDerWaalsContact C-N 3.3Å; A158-G160 PolarHBondContact O-N 2.99Å
161T82.7Confident83.6Confident3 Ų350 Ų502%0.01828%0.284CS..Hα-helixtrans-80.2-47.3-176.4-60.30000111.8H157 A158 R163 L164 F166 L182H157-T161 VanDerWaalsContact O-CB 3.29Å; H157-T161 WeakPolarHBondContact O-CB 3.17Å; H157-T161 PolarHBondContact O-N 3.45Å; H157-T161 PolarHBondContact O-OG1 3.02Å; A158-T161 PolarHBondContact O-N 3.11Å; T161-R163 VanDerWaalsContact C-N 3.34Å; T161-R163 PolarHBondContact O-N 2.86Å; T161-L164 WeakPolarHBondContact O-CB 3.5Å; T161-L164 PolarHBondContact O-N 3.27Å; T161-F166 WeakPolarHBondContact O-CZ 3.14Å; T161-L182 HydrophobicContact CG2-CB 3.67Å; T161-L182 HydrophobicContact CG2-CD1 3.78Å; T161-L182 HydrophobicContact CG2-CG 4.32Å
162F83Confident82.8Confident24 Ų2447.1 Ų47.111%0.10527%0.272CS..Hα-helixtrans-82.3-9.6-173.1-71.4-74000113.6Y92 A96 F99 A158 L164 L182Y92-F162 HydrophobicContact CD2-CD1 4.46Å; Y92-F162 HydrophobicContact CE1-CD1 4.06Å; Y92-F162 AromaticContact CE2-CD1 3.75Å; Y92-F162 HydrophobicContact CE2-CD1 3.75Å; Y92-F162 HydrophobicContact CE2-CE1 4.4Å; Y92-F162 AromaticContact CZ-CD1 3.53Å; Y92-F162 VanDerWaalsContact OH-CB 3.3Å; Y92-F162 WeakPolarHBondContact OH-CB 2.92Å; Y92-F162 PolarHBondContact OH-O 3.43Å; A96-F162 HydrophobicContact CB-CD1 4.04Å; A96-F162 HydrophobicContact CB-CD2 4.01Å; A96-F162 HydrophobicContact CB-CE1 3.8Å; A96-F162 HydrophobicContact CB-CE2 3.8Å; A96-F162 HydrophobicContact CB-CG 4.15Å; A96-F162 HydrophobicContact CB-CZ 3.7Å; F99-F162 HydrophobicContact CB-CE2 4.04Å; F99-F162 HydrophobicContact CB-CZ 4.23Å; F99-F162 AromaticContact CD1-CE2 3.8Å; F99-F162 HydrophobicContact CD1-CE2 3.8Å; F99-F162 AromaticContact CG-CE2 3.93Å; F99-F162 HydrophobicContact CG-CE2 3.93Å; F99-F162 HydrophobicContact CG-CZ 4.43Å; A158-F162 HydrophobicContact CB-CD2 4.29Å; A158-F162 WeakPolarHBondContact O-CB 3.5Å; A158-F162 WeakPolarHBondContact O-CD2 3.46Å; A158-F162 PolarHBondContact O-N 3.01Å; F162-L164 VanDerWaalsContact C-N 3.29Å; F162-L182 HydrophobicContact CE1-CD1 4.46Å; F162-L182 HydrophobicContact CE2-CD1 4.45Å; F162-L182 HydrophobicContact CZ-CD1 3.86Å
163R81.9Confident81.8Confident222 Ų22244.4 Ų44.484%0.83826%0.258SS*.THydrogen-bonded Turntrans-78.7-10.7167-71.7178.895.5-169.37.5113.8A159 T161A159-R163 VanDerWaalsContact O-CB 3.23Å; A159-R163 WeakPolarHBondContact O-CB 3.43Å; A159-R163 WeakPolarHBondContact O-CD 3.45Å; A159-R163 WeakPolarHBondContact O-CG 3.18Å; A159-R163 PolarHBondContact O-N 3.5Å; T161-R163 VanDerWaalsContact C-N 3.34Å; T161-R163 PolarHBondContact O-N 2.86Å
164L80.1Confident81Confident22 Ų2244.2 Ų44.212%0.11526%0.257CS..SBendtrans-74.4149.1179.2-63.7168.8000111T161 F162 F166 L183 T190T161-L164 WeakPolarHBondContact O-CB 3.5Å; T161-L164 PolarHBondContact O-N 3.27Å; F162-L164 VanDerWaalsContact C-N 3.29Å; L164-F166 HydrophobicContact CB-CZ 4.48Å; L164-F166 WeakPolarHBondContact O-CE2 3.43Å; L164-L183 HydrophobicContact CD1-CD2 3.43Å; L164-L183 VanDerWaalsContact CD1-CD2 3.43Å; L164-T190 HydrophobicContact CD1-CG2 4.25Å
165S77.8Confident80.2Confident22 Ų2244.4 Ų44.415%0.15426%0.258CS..PPolyproline II helixtrans-83.7116.1170.463.10000110.3C187 S188S165-C187 PolarHBondContact O-N 2.99Å; S165-S188 PolarHBondContact N-OG 3.44Å; S165-S188 PolarHBondContact OG-OG 3.18Å
166F80.1Confident79.5Confident19 Ų1941.9 Ų41.98%0.08324%0.24CC..BIsolated β-bridgetrans-86.3129.2172.9-55.9-76.9000109.5V7 F10 Y92 T161 L164 L182 L185V7-F166 HydrophobicContact CG2-CB 3.9Å; F10-F166 HydrophobicContact CE1-CD1 4.44Å; F10-F166 HydrophobicContact CE1-CG 4.26Å; F10-F166 HydrophobicContact CZ-CD2 4.04Å; F10-F166 HydrophobicContact CZ-CE2 4.21Å; F10-F166 HydrophobicContact CZ-CG 4.23Å; Y92-F166 HydrophobicContact CE2-CD2 4.26Å; Y92-F166 AromaticContact CE2-CE2 3.94Å; Y92-F166 HydrophobicContact CE2-CE2 3.94Å; T161-F166 WeakPolarHBondContact O-CZ 3.14Å; L164-F166 HydrophobicContact CB-CZ 4.48Å; L164-F166 WeakPolarHBondContact O-CE2 3.43Å; F166-L182 HydrophobicContact CE1-CD2 4.49Å; F166-L182 WeakPolarHBondContact CE1-O 3.3Å; F166-L185 HydrophobicContact CD1-CB 4.06Å
167C72.8Confident79Confident91 Ų9138 Ų3862%0.61522%0.22SC*.  trans-1399.8176.487.70000114.2L185 C187C167-L185 PolarHBondContact N-O 2.86Å; C167-C187 WeakPolarHBondContact CA-SG 3.39Å; C167-C187 HydrophobicContact CB-CB 3.82Å; C167-C187 WeakPolarHBondContact CB-SG 3.06Å; C167-C187 PolarHBondContact N-SG 3.28Å; C167-C187 WeakPolarHBondContact SG-CB 3.44Å; C167-C187 CovalentContact SG-SG 1.98Å; C167-C187 PolarHBondContact SG-SG 2.88Å
168G67.8Low78.6Confident36 Ų3638.9 Ų38.937%0.37123%0.225SC..SBendtrans-75.3-166.9171.400000113.3N170G168-N170 PolarHBondContact O-N 3.39Å
169S71.6Confident78Confident73 Ų7338.8 Ų38.851%0.5122%0.222SC..  trans-65.92.717954.90000114.8E171S169-E171 PolarHBondContact O-N 2.96Å; S169-E171 VanDerWaalsContact O-N 3.15Å; S169-E171 WeakPolarHBondContact OG-CB 3.45Å; S169-E171 PolarHBondContact OG-OE2 3.07Å
170N78.9Confident77.3Confident46 Ų4640.3 Ų40.325%0.24623%0.227CC..SBendtrans57.216.1-169-56.8-33000113.8V7 F10 I11 G168V7-N170 HydrophobicContact CG1-CB 4.37Å; V7-N170 WeakPolarHBondContact CG1-OD1 3.26Å; V7-N170 VanDerWaalsContact CG2-OD1 3.3Å; V7-N170 WeakPolarHBondContact CG2-OD1 3.31Å; F10-N170 CarbonylContact C-O 3.53Å; F10-N170 WeakPolarHBondContact CA-O 3.42Å; F10-N170 HydrophobicContact CD1-CB 4.35Å; I11-N170 PolarHBondContact N-O 3.04Å; G168-N170 PolarHBondContact O-N 3.39Å
171E79.5Confident76.7Confident84 Ų8440.1 Ų40.139%0.39322%0.221SC..EExtended strand (participates in β ladder)trans-92.5110.9178.8-66.5169.5159.500110.7I11 L13 S169 N173 L185I11-E171 HydrophobicContact CB-CG 4.34Å; I11-E171 CarbonylContact O-C 3.58Å; I11-E171 WeakPolarHBondContact O-CA 3.41Å; L13-E171 HydrophobicContact CD1-CB 4.26Å; L13-E171 HydrophobicContact CD2-CB 4.23Å; L13-E171 HydrophobicContact CD2-CG 4.27Å; L13-E171 HydrophobicContact CG-CB 4.19Å; S169-E171 PolarHBondContact O-N 2.96Å; S169-E171 VanDerWaalsContact O-N 3.15Å; S169-E171 WeakPolarHBondContact OG-CB 3.45Å; S169-E171 PolarHBondContact OG-OE2 3.07Å; E171-N173 PolarHBondContact O-N 2.83Å; E171-L185 WeakPolarHBondContact O-CD2 3.2Å
172I77.6Confident76.4Confident0 Ų040 Ų400%022%0.22CC..EExtended strand (participates in β ladder)trans-83.9114.5173.2-64.2174.5000107.1F10 I11 L12 L13 N174 P181 L182 L185F10-I172 HydrophobicContact CB-CD1 3.65Å; F10-I172 HydrophobicContact CB-CG1 4.17Å; F10-I172 HydrophobicContact CD1-CD1 3.98Å; F10-I172 HydrophobicContact CD1-CG1 4.15Å; F10-I172 HydrophobicContact CD2-CD1 4.39Å; F10-I172 HydrophobicContact CG-CD1 3.77Å; F10-I172 HydrophobicContact CG-CG1 4.36Å; I11-I172 PolarHBondContact O-N 2.95Å; L12-I172 HydrophobicContact CD2-CB 4.02Å; L12-I172 HydrophobicContact CD2-CD1 4.16Å; L12-I172 HydrophobicContact CD2-CG2 3.96Å; L13-I172 PolarHBondContact N-O 3.44Å; I172-N174 HydrophobicContact CG2-CB 3.97Å; I172-N174 PolarHBondContact O-N 2.94Å; I172-P181 HydrophobicContact CG2-CB 3.73Å; I172-L182 HydrophobicContact CD1-CD2 3.7Å; I172-L182 HydrophobicContact CG1-CD2 4.3Å; I172-L185 HydrophobicContact CG1-CD1 3.63Å
173N74.9Confident76Confident46 Ų4639.5 Ų39.525%0.24622%0.218CC..SBendtrans-75.454.1175.2-172.651000112.9L13 E171 M266 K270L13-N173 HydrophobicContact CD1-CB 4.01Å; E171-N173 PolarHBondContact O-N 2.83Å; N173-M266 HydrophobicContact CB-CE 4.16Å; N173-M266 WeakPolarHBondContact ND2-CE 3.46Å; N173-K270 WeakPolarHBondContact O-CE 3.34Å; N173-K270 WeakPolarHBondContact OD1-CE 3.36Å; N173-K270 PolarHBondContact OD1-NZ 3.45Å
174N74.3Confident75.7Confident4 Ų433 Ų332%0.02121%0.212CC..SBendtrans-154.6166176.1-157.8-0.5000109.2G14 I172 F176 P181G14-N174 PolarHBondContact N-O 3.12Å; I172-N174 HydrophobicContact CG2-CB 3.97Å; I172-N174 PolarHBondContact O-N 2.94Å; N174-F176 VanDerWaalsContact C-N 3.26Å; N174-F176 WeakPolarHBondContact CB-O 3.47Å; N174-F176 WeakPolarHBondContact ND2-CD1 3.13Å; N174-F176 WeakPolarHBondContact ND2-CE1 3.14Å; N174-P181 HydrophobicContact CB-CB 4.43Å; N174-P181 HydrophobicContact CB-CG 3.92Å
175F75Confident75.3Confident5 Ų532.9 Ų32.92%0.02221%0.211CC..SBendtrans-85-2176.264.3-88.1000113.2L15 F29 V75 T79 V274 T277L15-F175 HydrophobicContact CD1-CD1 4.34Å; L15-F175 HydrophobicContact CD2-CD1 3.6Å; L15-F175 HydrophobicContact CD2-CE1 4.08Å; L15-F175 HydrophobicContact CD2-CG 4.46Å; L15-F175 HydrophobicContact CG-CB 4.22Å; L15-F175 HydrophobicContact CG-CD1 3.89Å; L15-F175 HydrophobicContact CG-CG 4.27Å; F29-F175 HydrophobicContact CE1-CD2 4.25Å; F29-F175 HydrophobicContact CE1-CE2 4.01Å; F29-F175 HydrophobicContact CZ-CD2 4.24Å; F29-F175 HydrophobicContact CZ-CE2 4.1Å; F29-F175 HydrophobicContact CZ-CZ 4.42Å; V75-F175 HydrophobicContact CG1-CD2 4.18Å; V75-F175 HydrophobicContact CG1-CE2 3.79Å; T79-F175 HydrophobicContact CG2-CB 4.24Å; T79-F175 HydrophobicContact CG2-CD2 4.03Å; T79-F175 HydrophobicContact CG2-CG 4.5Å; T79-F175 PolarHBondContact OG1-O 2.84Å; F175-V274 HydrophobicContact CE1-CG2 3.78Å; F175-V274 HydrophobicContact CZ-CG2 4.06Å; F175-T277 HydrophobicContact CZ-CG2 4.48Å; F175-T277 WeakPolarHBondContact CZ-OG1 3.42Å
176F78.6Confident75.3Confident0 Ų032.7 Ų32.70%021%0.21CC..SBendtrans-154.9161.4-177.783.7-82.5000110V75 F102 N174 D178 Y276 T277V75-F176 HydrophobicContact CG1-CB 3.78Å; V75-F176 HydrophobicContact CG1-CG 4.19Å; V75-F176 HydrophobicContact CG2-CB 4.47Å; V75-F176 HydrophobicContact CG2-CD2 4.28Å; F102-F176 HydrophobicContact CD1-CE2 4.06Å; F102-F176 HydrophobicContact CE1-CE2 4.1Å; F102-F176 HydrophobicContact CG-CE2 4.39Å; F102-F176 HydrophobicContact CZ-CE2 4.49Å; N174-F176 VanDerWaalsContact C-N 3.26Å; N174-F176 WeakPolarHBondContact CB-O 3.47Å; N174-F176 WeakPolarHBondContact ND2-CD1 3.13Å; N174-F176 WeakPolarHBondContact ND2-CE1 3.14Å; F176-D178 HydrophobicContact CD2-CB 4.29Å; F176-D178 HydrophobicContact CE1-CB 4.4Å; F176-D178 HydrophobicContact CE2-CB 3.59Å; F176-D178 HydrophobicContact CZ-CB 3.65Å; F176-D178 PolarHBondContact O-N 3.08Å; F176-Y276 HydrophobicContact CZ-CE2 4.28Å; F176-Y276 WeakPolarHBondContact CZ-OH 3.29Å; F176-T277 HydrophobicContact CD1-CG2 4.45Å; F176-T277 HydrophobicContact CE1-CG2 3.78Å; F176-T277 HydrophobicContact CE2-CG2 4.18Å; F176-T277 HydrophobicContact CZ-CG2 3.62Å
177C79.8Confident75.2Confident0 Ų034.8 Ų34.80%023%0.227CC..  trans-76.3115.2176.8-680000111.9C95 F99 L182C95-C177 WeakPolarHBondContact CA-SG 3.44Å; C95-C177 HydrophobicContact CB-CB 4.13Å; C95-C177 WeakPolarHBondContact CB-SG 3.47Å; C95-C177 WeakPolarHBondContact SG-CB 3.49Å; C95-C177 CovalentContact SG-SG 2.02Å; C95-C177 PolarHBondContact SG-SG 2.9Å; F99-C177 HydrophobicContact CB-CB 4.43Å; C177-L182 HydrophobicContact CB-CD1 4.37Å
178D77.9Confident75.5Confident22 Ų2232.5 Ų32.512%0.11821%0.211CC..  trans-135.3162.7-179.8-167.318000111.6F176 P180 P181 L182 Y276F176-D178 HydrophobicContact CD2-CB 4.29Å; F176-D178 HydrophobicContact CE1-CB 4.4Å; F176-D178 HydrophobicContact CE2-CB 3.59Å; F176-D178 HydrophobicContact CZ-CB 3.65Å; F176-D178 PolarHBondContact O-N 3.08Å; D178-P180 WeakPolarHBondContact OD2-CD 3.46Å; D178-P181 HydrophobicContact CB-CG 4.36Å; D178-P181 WeakPolarHBondContact O-CD 3.2Å; D178-L182 WeakPolarHBondContact O-CB 3.39Å; D178-L182 WeakPolarHBondContact O-CD1 3.31Å; D178-L182 VanDerWaalsContact O-CG 3.26Å; D178-L182 WeakPolarHBondContact O-CG 3.43Å; D178-L182 PolarHBondContact O-N 3.02Å; D178-L182 VanDerWaalsContact O-N 3.16Å; D178-Y276 PolarHBondContact OD2-OH 3.2Å
179I73.5Confident76Confident14 Ų1436.5 Ų36.57%0.07223%0.225CC..Hα-helixtrans-58.1-56.3-174.3-55.4-177.4000111.7F99 H157 L182 L183 V197F99-I179 HydrophobicContact CE2-CB 4.31Å; F99-I179 HydrophobicContact CE2-CD1 4.23Å; F99-I179 HydrophobicContact CE2-CG1 3.28Å; F99-I179 HydrophobicContact CZ-CD1 3.92Å; F99-I179 HydrophobicContact CZ-CG1 3.4Å; F99-I179 VanDerWaalsContact CZ-CG1 3.4Å; H157-I179 HydrophobicContact CB-CD1 4.21Å; I179-L182 PolarHBondContact O-N 3.37Å; I179-L183 HydrophobicContact CG2-CD1 3.64Å; I179-L183 HydrophobicContact CG2-CG 4.02Å; I179-L183 WeakPolarHBondContact O-CG 3.34Å; I179-L183 PolarHBondContact O-N 2.87Å; I179-V197 HydrophobicContact CD1-CG1 4.39Å; I179-V197 HydrophobicContact CD1-CG2 4.05Å; I179-V197 HydrophobicContact CG2-CG1 4.46Å; I179-V197 HydrophobicContact CG2-CG2 3.7Å
180P72.9Confident76.4Confident85 Ų8534 Ų3455%0.55221%0.206SC*.Hα-helixtrans-63.5-44.5-172.1-16.730.3000113.3D178 L182 L183 A184D178-P180 WeakPolarHBondContact OD2-CD 3.46Å; P180-L182 PolarHBondContact O-N 2.7Å; P180-L183 PolarHBondContact O-N 3.33Å; P180-A184 PolarHBondContact O-N 3.46Å; P180-A184 VanDerWaalsContact O-N 3.09Å
181P70.8Confident76.4Confident25 Ų2540.3 Ų40.316%0.16223%0.227CC..Hα-helixtrans-61.3-40.1174.4-25.835.3000114I172 N174 D178 A184I172-P181 HydrophobicContact CG2-CB 3.73Å; N174-P181 HydrophobicContact CB-CB 4.43Å; N174-P181 HydrophobicContact CB-CG 3.92Å; D178-P181 HydrophobicContact CB-CG 4.36Å; D178-P181 WeakPolarHBondContact O-CD 3.2Å; P181-A184 PolarHBondContact O-N 3.05Å
182L76.6Confident76.5Confident0 Ų042.2 Ų42.20%024%0.238CC..Hα-helixtrans-68.3-41.6178.5-73.7170000111.6F10 F99 T161 F162 F166 I172 C177 D178 I179 P180 A184 L185F10-L182 HydrophobicContact CE1-CD2 4.45Å; F10-L182 HydrophobicContact CZ-CD2 4.35Å; F99-L182 HydrophobicContact CD2-CD1 4.2Å; T161-L182 HydrophobicContact CG2-CB 3.67Å; T161-L182 HydrophobicContact CG2-CD1 3.78Å; T161-L182 HydrophobicContact CG2-CG 4.32Å; F162-L182 HydrophobicContact CE1-CD1 4.46Å; F162-L182 HydrophobicContact CE2-CD1 4.45Å; F162-L182 HydrophobicContact CZ-CD1 3.86Å; F166-L182 HydrophobicContact CE1-CD2 4.49Å; F166-L182 WeakPolarHBondContact CE1-O 3.3Å; I172-L182 HydrophobicContact CD1-CD2 3.7Å; I172-L182 HydrophobicContact CG1-CD2 4.3Å; C177-L182 HydrophobicContact CB-CD1 4.37Å; D178-L182 WeakPolarHBondContact O-CB 3.39Å; D178-L182 WeakPolarHBondContact O-CD1 3.31Å; D178-L182 VanDerWaalsContact O-CG 3.26Å; D178-L182 WeakPolarHBondContact O-CG 3.43Å; D178-L182 PolarHBondContact O-N 3.02Å; D178-L182 VanDerWaalsContact O-N 3.16Å; I179-L182 PolarHBondContact O-N 3.37Å; P180-L182 PolarHBondContact O-N 2.7Å; L182-A184 VanDerWaalsContact C-N 3.27Å; L182-A184 PolarHBondContact O-N 3.33Å; L182-L185 PolarHBondContact O-N 2.75Å
183L74.3Confident76.6Confident13 Ų1342.9 Ų42.97%0.06824%0.243CC..Hα-helixtrans-64.4-31.3176-68.9-178.6000112.4L164 I179 P180 L185 S186 T190 K194L164-L183 HydrophobicContact CD1-CD2 3.43Å; L164-L183 VanDerWaalsContact CD1-CD2 3.43Å; I179-L183 HydrophobicContact CG2-CD1 3.64Å; I179-L183 HydrophobicContact CG2-CG 4.02Å; I179-L183 WeakPolarHBondContact O-CG 3.34Å; I179-L183 PolarHBondContact O-N 2.87Å; P180-L183 PolarHBondContact O-N 3.33Å; L183-L185 PolarHBondContact O-N 3.38Å; L183-S186 PolarHBondContact O-N 3.31Å; L183-T190 HydrophobicContact CB-CG2 4.36Å; L183-T190 HydrophobicContact CD2-CG2 4.11Å; L183-K194 HydrophobicContact CD1-CG 3.99Å
184A74.6Confident76.7Confident85 Ų8546.6 Ų46.670%0.70226%0.257SS*.Hα-helixtrans-66.9-24.7176.600000113.3P180 P181 L182P180-A184 PolarHBondContact O-N 3.46Å; P180-A184 VanDerWaalsContact O-N 3.09Å; P181-A184 PolarHBondContact O-N 3.05Å; L182-A184 VanDerWaalsContact C-N 3.27Å; L182-A184 PolarHBondContact O-N 3.33Å
185L72.4Confident77Confident20 Ų2050.3 Ų50.311%0.10528%0.276CS..THydrogen-bonded Turntrans-87.5-10178.4-67.4172.1000113.9F10 F166 C167 E171 I172 L182 L183F10-L185 HydrophobicContact CD1-CD1 4.45Å; F166-L185 HydrophobicContact CD1-CB 4.06Å; C167-L185 PolarHBondContact N-O 2.86Å; E171-L185 WeakPolarHBondContact O-CD2 3.2Å; I172-L185 HydrophobicContact CG1-CD1 3.63Å; L182-L185 PolarHBondContact O-N 2.75Å; L183-L185 PolarHBondContact O-N 3.38Å
186S78.3Confident77.4Confident19 Ų1952.5 Ų52.513%0.13329%0.29CS..BIsolated β-bridgetrans-74.4136.5-178.4170.40000111.7L183 S188L183-S186 PolarHBondContact O-N 3.31Å; S186-S188 PolarHBondContact OG-N 3.06Å; S186-S188 VanDerWaalsContact OG-N 3.1Å; S186-S188 PolarHBondContact OG-O 3.13Å
187C78.1Confident77.5Confident63 Ų6353.9 Ų53.943%0.42630%0.299SS..  trans-100.2-5171.1-57.50000113.1S165 C167S165-C187 PolarHBondContact O-N 2.99Å; C167-C187 WeakPolarHBondContact CA-SG 3.39Å; C167-C187 HydrophobicContact CB-CB 3.82Å; C167-C187 WeakPolarHBondContact CB-SG 3.06Å; C167-C187 PolarHBondContact N-SG 3.28Å; C167-C187 WeakPolarHBondContact SG-CB 3.44Å; C167-C187 CovalentContact SG-SG 1.98Å; C167-C187 PolarHBondContact SG-SG 2.88Å
188S78.1Confident77.5Confident42 Ų4260.9 Ų60.929%0.29433%0.329SS..SBendtrans-83.6154.5166.3-73.10000110.6S165 S186 T190S165-S188 PolarHBondContact N-OG 3.44Å; S165-S188 PolarHBondContact OG-OG 3.18Å; S186-S188 PolarHBondContact OG-N 3.06Å; S186-S188 VanDerWaalsContact OG-N 3.1Å; S186-S188 PolarHBondContact OG-O 3.13Å; S188-T190 WeakPolarHBondContact O-CG2 3.46Å; S188-T190 PolarHBondContact O-N 3.47Å; S188-T190 VanDerWaalsContact O-N 3.15Å
189D77.5Confident77.8Confident121 Ų12166.3 Ų66.365%0.64735%0.352SS*.  trans-56.7118.5174.6-177.25.6000110.7R191D189-R191 WeakPolarHBondContact OD1-CB 3.26Å; D189-R191 PolarHBondContact OD1-N 3.25Å
190T81.1Confident78.4Confident21 Ų2167.3 Ų67.313%0.12936%0.359CS..  trans-93.9-0.2-178.157.30000113.4L164 L183 S188 I192 S193 K194L164-T190 HydrophobicContact CD1-CG2 4.25Å; L183-T190 HydrophobicContact CB-CG2 4.36Å; L183-T190 HydrophobicContact CD2-CG2 4.11Å; S188-T190 WeakPolarHBondContact O-CG2 3.46Å; S188-T190 PolarHBondContact O-N 3.47Å; S188-T190 VanDerWaalsContact O-N 3.15Å; T190-I192 VanDerWaalsContact C-N 3.35Å; T190-I192 PolarHBondContact O-N 2.72Å; T190-S193 PolarHBondContact O-N 3.37Å; T190-K194 WeakPolarHBondContact O-CB 3.45Å; T190-K194 WeakPolarHBondContact O-CG 3.34Å; T190-K194 PolarHBondContact O-N 3.24Å; T190-K194 WeakPolarHBondContact OG1-CE 3.29Å
191R79.1Confident78.9Confident178 Ų17864.9 Ų64.967%0.67234%0.342SS*.Hα-helixtrans-58.6-44.2-175.1-172.2178.1-179.4-176.70.3112.4D189 K194 L195D189-R191 WeakPolarHBondContact OD1-CB 3.26Å; D189-R191 PolarHBondContact OD1-N 3.25Å; R191-K194 PolarHBondContact O-N 3.1Å; R191-L195 HydrophobicContact CG-CD1 4.39Å; R191-L195 WeakPolarHBondContact O-CG 3.22Å; R191-L195 PolarHBondContact O-N 2.86Å
192I80.6Confident79.5Confident123 Ų12365.4 Ų65.463%0.63135%0.352SS*.Hα-helixtrans-64.9-47.8178-62.2178.4000110.1T190 K194 L195 V196T190-I192 VanDerWaalsContact C-N 3.35Å; T190-I192 PolarHBondContact O-N 2.72Å; I192-K194 VanDerWaalsContact C-N 3.31Å; I192-K194 PolarHBondContact O-N 2.84Å; I192-L195 PolarHBondContact O-N 3.22Å; I192-L195 VanDerWaalsContact O-N 3.16Å; I192-V196 HydrophobicContact CG2-CG2 4.25Å; I192-V196 WeakPolarHBondContact O-CG2 3.19Å; I192-V196 PolarHBondContact O-N 2.97Å
193S79.9Confident80.1Confident15 Ų1571.4 Ų71.411%0.10538%0.378CS..Hα-helixtrans-59.5-41.5178.3-55.10000111.8T190 V196 V197T190-S193 PolarHBondContact O-N 3.37Å; S193-V196 PolarHBondContact O-N 3.2Å; S193-V197 WeakPolarHBondContact O-CB 3.3Å; S193-V197 WeakPolarHBondContact O-CG2 3.34Å; S193-V197 PolarHBondContact O-N 2.91Å
194K77.2Confident80.8Confident123 Ų12371.5 Ų71.554%0.53538%0.379SS..Hα-helixtrans-62.3-43174.8-73175.6179.7174.50112.5L183 T190 R191 I192 V197 F198L183-K194 HydrophobicContact CD1-CG 3.99Å; T190-K194 WeakPolarHBondContact O-CB 3.45Å; T190-K194 WeakPolarHBondContact O-CG 3.34Å; T190-K194 PolarHBondContact O-N 3.24Å; T190-K194 WeakPolarHBondContact OG1-CE 3.29Å; R191-K194 PolarHBondContact O-N 3.1Å; I192-K194 VanDerWaalsContact C-N 3.31Å; I192-K194 PolarHBondContact O-N 2.84Å; K194-V197 PolarHBondContact O-N 3.44Å; K194-F198 WeakPolarHBondContact O-CB 3.33Å; K194-F198 PolarHBondContact O-N 3.5Å
195L80.1Confident81.3Confident83 Ų8368.9 Ų68.944%0.43535%0.354SS..Hα-helixtrans-64.7-44.2176.1-72.7171000111.6R191 I192 V197 F198 F199R191-L195 HydrophobicContact CG-CD1 4.39Å; R191-L195 WeakPolarHBondContact O-CG 3.22Å; R191-L195 PolarHBondContact O-N 2.86Å; I192-L195 PolarHBondContact O-N 3.22Å; I192-L195 VanDerWaalsContact O-N 3.16Å; L195-V197 VanDerWaalsContact C-N 3.33Å; L195-V197 PolarHBondContact O-N 2.9Å; L195-F198 PolarHBondContact O-N 2.91Å; L195-F199 HydrophobicContact CB-CD2 4.46Å; L195-F199 HydrophobicContact CD2-CE2 4.21Å; L195-F199 WeakPolarHBondContact O-CD2 3.34Å; L195-F199 PolarHBondContact O-N 3.49Å
196V84.1Confident82Confident51 Ų5174.6 Ų74.631%0.30938%0.378SS..Hα-helixtrans-59.2-45.8175.81710000110.5I156 I192 S193 F199 V200I156-V196 HydrophobicContact CG2-CG1 3.7Å; I192-V196 HydrophobicContact CG2-CG2 4.25Å; I192-V196 WeakPolarHBondContact O-CG2 3.19Å; I192-V196 PolarHBondContact O-N 2.97Å; S193-V196 PolarHBondContact O-N 3.2Å; V196-F199 PolarHBondContact O-N 3.28Å; V196-V200 HydrophobicContact CG1-CG2 3.98Å; V196-V200 WeakPolarHBondContact O-CB 3Å; V196-V200 WeakPolarHBondContact O-CG2 3.2Å; V196-V200 PolarHBondContact O-N 3.43Å
197V81.8Confident82.7Confident29 Ų2977.8 Ų77.818%0.17639%0.39CS..Hα-helixtrans-57.9-51.6175.1173.10000111I179 S193 K194 L195 F199 V201I179-V197 HydrophobicContact CD1-CG1 4.39Å; I179-V197 HydrophobicContact CD1-CG2 4.05Å; I179-V197 HydrophobicContact CG2-CG1 4.46Å; I179-V197 HydrophobicContact CG2-CG2 3.7Å; S193-V197 WeakPolarHBondContact O-CB 3.3Å; S193-V197 WeakPolarHBondContact O-CG2 3.34Å; S193-V197 PolarHBondContact O-N 2.91Å; K194-V197 PolarHBondContact O-N 3.44Å; L195-V197 VanDerWaalsContact C-N 3.33Å; L195-V197 PolarHBondContact O-N 2.9Å; V197-F199 PolarHBondContact O-N 2.92Å; V197-V201 HydrophobicContact CG1-CG2 4.12Å; V197-V201 WeakPolarHBondContact O-CB 3.31Å; V197-V201 VanDerWaalsContact O-CG2 3.31Å; V197-V201 WeakPolarHBondContact O-CG2 3.18Å; V197-V201 PolarHBondContact O-N 3.41Å
198F78.9Confident83.4Confident147 Ų14774.8 Ų74.865%0.64537%0.37SS*.Hα-helixtrans-58.1-49.5-179.4-179.1-98.1000112.5K194 L195 G202K194-F198 WeakPolarHBondContact O-CB 3.33Å; K194-F198 PolarHBondContact O-N 3.5Å; L195-F198 PolarHBondContact O-N 2.91Å; F198-G202 VanDerWaalsContact O-CA 3.31Å; F198-G202 WeakPolarHBondContact O-CA 3.09Å; F198-G202 PolarHBondContact O-N 3.35Å
199F84.3Confident84Confident136 Ų13674.5 Ų74.560%0.59637%0.365SS*.Hα-helixtrans-71.8-44.2-177.7-77-65.6000112.8L195 V196 V197 F203L195-F199 HydrophobicContact CB-CD2 4.46Å; L195-F199 HydrophobicContact CD2-CE2 4.21Å; L195-F199 WeakPolarHBondContact O-CD2 3.34Å; L195-F199 PolarHBondContact O-N 3.49Å; V196-F199 PolarHBondContact O-N 3.28Å; V197-F199 PolarHBondContact O-N 2.92Å; F199-F203 WeakPolarHBondContact O-CB 3.31Å; F199-F203 PolarHBondContact O-N 3.03Å
200V86.6Confident84.7Confident35 Ų3572.2 Ų72.221%0.21235%0.352CS..Hα-helixtrans-74.7-49.6-174.9-177.90000110.5N153 V196 G202 F203 N204N153-V200 WeakPolarHBondContact OD1-CG1 3.23Å; V196-V200 HydrophobicContact CG1-CG2 3.98Å; V196-V200 WeakPolarHBondContact O-CB 3Å; V196-V200 WeakPolarHBondContact O-CG2 3.2Å; V196-V200 PolarHBondContact O-N 3.43Å; V200-G202 VanDerWaalsContact C-N 3.34Å; V200-G202 PolarHBondContact O-N 2.9Å; V200-F203 PolarHBondContact O-N 3.31Å; V200-N204 PolarHBondContact O-N 2.88Å; V200-N204 PolarHBondContact O-ND2 2.99Å
201V83.3Confident85.3Confident34 Ų3473 Ų7321%0.20636%0.357CS..Hα-helixtrans-63-44.9176.1178.70000109.9V197 F203 N204 V205V197-V201 HydrophobicContact CG1-CG2 4.12Å; V197-V201 WeakPolarHBondContact O-CB 3.31Å; V197-V201 VanDerWaalsContact O-CG2 3.31Å; V197-V201 WeakPolarHBondContact O-CG2 3.18Å; V197-V201 PolarHBondContact O-N 3.41Å; V201-F203 VanDerWaalsContact C-N 3.34Å; V201-F203 PolarHBondContact O-N 2.96Å; V201-N204 PolarHBondContact O-N 2.96Å; V201-V205 HydrophobicContact CG1-CG2 4.17Å; V201-V205 WeakPolarHBondContact O-CB 3.45Å; V201-V205 WeakPolarHBondContact O-CG2 3.23Å; V201-V205 PolarHBondContact O-N 3.24Å
202G83.6Confident85.9Confident36 Ų3664.7 Ų64.737%0.37133%0.326SS..Hα-helixtrans-57.8-44.1176.800000112.7F198 V200 F206F198-G202 VanDerWaalsContact O-CA 3.31Å; F198-G202 WeakPolarHBondContact O-CA 3.09Å; F198-G202 PolarHBondContact O-N 3.35Å; V200-G202 VanDerWaalsContact C-N 3.34Å; V200-G202 PolarHBondContact O-N 2.9Å; G202-F206 WeakPolarHBondContact O-CB 3.31Å; G202-F206 PolarHBondContact O-N 3.43Å
203F88.8Confident86.5Confident126 Ų12664.3 Ų64.355%0.55332%0.324SS*.Hα-helixtrans-62.7-48.6176174.7-97.7000112.2F199 V200 V201 V205 F206 F207F199-F203 WeakPolarHBondContact O-CB 3.31Å; F199-F203 PolarHBondContact O-N 3.03Å; V200-F203 PolarHBondContact O-N 3.31Å; V201-F203 VanDerWaalsContact C-N 3.34Å; V201-F203 PolarHBondContact O-N 2.96Å; F203-V205 PolarHBondContact O-N 2.92Å; F203-F206 PolarHBondContact O-N 3.3Å; F203-F207 WeakPolarHBondContact O-CB 3.33Å; F203-F207 PolarHBondContact O-N 3.44Å
204N88.6Confident87.1Confident15 Ų1567.4 Ų67.48%0.0834%0.339CS..Hα-helixtrans-59.2-49.5179.6-79.6-81.1000111.3Y111 V200 V201 T208Y111-N204 WeakPolarHBondContact CE2-OD1 3.5Å; Y111-N204 PolarHBondContact OH-OD1 2.9Å; V200-N204 PolarHBondContact O-N 2.88Å; V200-N204 PolarHBondContact O-ND2 2.99Å; V201-N204 PolarHBondContact O-N 2.96Å; N204-T208 WeakPolarHBondContact O-CB 3.3Å; N204-T208 WeakPolarHBondContact O-CG2 3.32Å; N204-T208 PolarHBondContact O-N 3.21Å; N204-T208 VanDerWaalsContact O-N 3.08Å; N204-T208 PolarHBondContact O-OG1 2.92Å
205V85.4Confident87.9Confident30 Ų3061.9 Ų61.918%0.18232%0.316CS..Hα-helixtrans-63.8-47.4179.3170.90000110.9V201 F203 T208 L209 Y250V201-V205 HydrophobicContact CG1-CG2 4.17Å; V201-V205 WeakPolarHBondContact O-CB 3.45Å; V201-V205 WeakPolarHBondContact O-CG2 3.23Å; V201-V205 PolarHBondContact O-N 3.24Å; F203-V205 PolarHBondContact O-N 2.92Å; V205-T208 PolarHBondContact O-OG1 2.95Å; V205-T208 VanDerWaalsContact O-OG1 3.12Å; V205-L209 HydrophobicContact CG1-CD1 3.79Å; V205-L209 HydrophobicContact CG1-CG 4.43Å; V205-L209 VanDerWaalsContact O-CB 3.23Å; V205-L209 WeakPolarHBondContact O-CB 3.28Å; V205-L209 VanDerWaalsContact O-CG 3.31Å; V205-L209 WeakPolarHBondContact O-CG 3.17Å; V205-L209 PolarHBondContact O-N 2.88Å; V205-Y250 HydrophobicContact CG1-CD1 4.36Å; V205-Y250 HydrophobicContact CG1-CE1 4.15Å
206F87.5Confident88.4Confident139 Ų13958.7 Ų58.761%0.6130%0.298SS*.Hα-helixtrans-62.4-46.8179.9177.8-99.5000111.9G202 F203 L210G202-F206 WeakPolarHBondContact O-CB 3.31Å; G202-F206 PolarHBondContact O-N 3.43Å; F203-F206 PolarHBondContact O-N 3.3Å; F206-L210 HydrophobicContact CE1-CD2 4.2Å; F206-L210 HydrophobicContact CZ-CD2 4.48Å; F206-L210 VanDerWaalsContact O-CB 3.25Å; F206-L210 WeakPolarHBondContact O-CB 3.23Å; F206-L210 PolarHBondContact O-N 3.36Å
207F92.6Very high88.7Confident86 Ų8662.5 Ų62.538%0.37731%0.31SS..Hα-helixtrans-61.5-49.9-179.1176.4-99.1000111.7Y111 F203 L210 V211Y111-F207 HydrophobicContact CD1-CE1 4.48Å; Y111-F207 AromaticContact CE1-CD1 3.74Å; Y111-F207 HydrophobicContact CE1-CD1 3.74Å; Y111-F207 AromaticContact CE1-CE1 3.82Å; Y111-F207 HydrophobicContact CE1-CE1 3.82Å; F203-F207 WeakPolarHBondContact O-CB 3.33Å; F203-F207 PolarHBondContact O-N 3.44Å; F207-L210 PolarHBondContact O-N 3.48Å; F207-V211 HydrophobicContact CE1-CG2 4.26Å; F207-V211 HydrophobicContact CE2-CG2 4.48Å; F207-V211 HydrophobicContact CZ-CG2 4.17Å; F207-V211 WeakPolarHBondContact O-CG2 3.3Å; F207-V211 PolarHBondContact O-N 3.2Å; F207-V211 VanDerWaalsContact O-N 3.07Å
208T92.8Very high89.2Confident0 Ų065.7 Ų65.70%032%0.322CS..Hα-helixtrans-65.7-41.9-179.449.10000111.8C110 Y111 A114 N204 V205 L210 V211 I212 Y250C110-T208 HydrophobicContact CB-CG2 4.04Å; Y111-T208 HydrophobicContact CD1-CG2 3.75Å; Y111-T208 HydrophobicContact CD2-CG2 4.38Å; Y111-T208 HydrophobicContact CE1-CG2 3.92Å; Y111-T208 HydrophobicContact CG-CG2 3.99Å; A114-T208 HydrophobicContact CB-CG2 4.24Å; N204-T208 WeakPolarHBondContact O-CB 3.3Å; N204-T208 WeakPolarHBondContact O-CG2 3.32Å; N204-T208 PolarHBondContact O-N 3.21Å; N204-T208 VanDerWaalsContact O-N 3.08Å; N204-T208 PolarHBondContact O-OG1 2.92Å; V205-T208 PolarHBondContact O-OG1 2.95Å; V205-T208 VanDerWaalsContact O-OG1 3.12Å; T208-L210 PolarHBondContact O-N 2.64Å; T208-V211 PolarHBondContact O-N 2.88Å; T208-I212 VanDerWaalsContact O-CG1 3.28Å; T208-I212 WeakPolarHBondContact O-CG1 3.43Å; T208-I212 PolarHBondContact O-N 3.39Å; T208-I212 VanDerWaalsContact O-N 3.09Å; T208-Y250 VanDerWaalsContact CB-OH 3.28Å; T208-Y250 WeakPolarHBondContact CB-OH 3.49Å; T208-Y250 PolarHBondContact OG1-OH 2.81Å
209L89.3Confident89.8Confident37 Ų3758.8 Ų58.819%0.19429%0.292CS..Hα-helixtrans-59.3-44.5171.9-82.2175.6000112.6V205 V211 I212 L213 Y250V205-L209 HydrophobicContact CG1-CD1 3.79Å; V205-L209 HydrophobicContact CG1-CG 4.43Å; V205-L209 VanDerWaalsContact O-CB 3.23Å; V205-L209 WeakPolarHBondContact O-CB 3.28Å; V205-L209 VanDerWaalsContact O-CG 3.31Å; V205-L209 WeakPolarHBondContact O-CG 3.17Å; V205-L209 PolarHBondContact O-N 2.88Å; L209-V211 VanDerWaalsContact C-N 3.33Å; L209-V211 PolarHBondContact O-N 2.97Å; L209-I212 PolarHBondContact O-N 3.4Å; L209-L213 WeakPolarHBondContact O-CB 3.44Å; L209-L213 VanDerWaalsContact O-CG 3.28Å; L209-L213 WeakPolarHBondContact O-CG 3.44Å; L209-L213 PolarHBondContact O-N 2.93Å; L209-Y250 HydrophobicContact CD1-CD1 3.77Å; L209-Y250 HydrophobicContact CD1-CE1 4.06Å; L209-Y250 HydrophobicContact CD2-CD1 3.31Å; L209-Y250 HydrophobicContact CD2-CD2 3.71Å; L209-Y250 HydrophobicContact CD2-CE1 3.61Å; L209-Y250 HydrophobicContact CD2-CE2 3.99Å; L209-Y250 HydrophobicContact CD2-CG 3.36Å; L209-Y250 HydrophobicContact CG-CD1 3.47Å; L209-Y250 VanDerWaalsContact CG-CD1 3.47Å; L209-Y250 HydrophobicContact CG-CE1 3.42Å; L209-Y250 VanDerWaalsContact CG-CE1 3.42Å; L209-Y250 HydrophobicContact CG-CG 4.08Å
210L92.8Very high89.9Confident72 Ų7255.4 Ų55.438%0.37728%0.284SS..Hα-helixtrans-60.6-44.9-179.8-175.966.3000111.1F206 F207 T208 I212 L213 I214F206-L210 HydrophobicContact CE1-CD2 4.2Å; F206-L210 HydrophobicContact CZ-CD2 4.48Å; F206-L210 VanDerWaalsContact O-CB 3.25Å; F206-L210 WeakPolarHBondContact O-CB 3.23Å; F206-L210 PolarHBondContact O-N 3.36Å; F207-L210 PolarHBondContact O-N 3.48Å; T208-L210 PolarHBondContact O-N 2.64Å; L210-I212 VanDerWaalsContact C-N 3.33Å; L210-I212 PolarHBondContact O-N 2.72Å; L210-L213 PolarHBondContact O-N 2.89Å; L210-I214 HydrophobicContact CD1-CD1 3.85Å; L210-I214 HydrophobicContact CD1-CG1 4.23Å; L210-I214 HydrophobicContact CD2-CD1 4.47Å; L210-I214 HydrophobicContact CG-CD1 3.76Å; L210-I214 HydrophobicContact CG-CG1 4.45Å; L210-I214 WeakPolarHBondContact O-CB 3.42Å; L210-I214 VanDerWaalsContact O-CG1 3.24Å; L210-I214 WeakPolarHBondContact O-CG1 3.46Å; L210-I214 PolarHBondContact O-N 2.87Å
211V94.6Very high90Very high38 Ų3855.7 Ų55.723%0.2328%0.284CS..Hα-helixtrans-59.3-44.7175.8171.90000111.2A114 F207 T208 L209 S215A114-V211 HydrophobicContact CB-CB 4.26Å; A114-V211 HydrophobicContact CB-CG1 4.06Å; F207-V211 HydrophobicContact CE1-CG2 4.26Å; F207-V211 HydrophobicContact CE2-CG2 4.48Å; F207-V211 HydrophobicContact CZ-CG2 4.17Å; F207-V211 WeakPolarHBondContact O-CG2 3.3Å; F207-V211 PolarHBondContact O-N 3.2Å; F207-V211 VanDerWaalsContact O-N 3.07Å; T208-V211 PolarHBondContact O-N 2.88Å; L209-V211 VanDerWaalsContact C-N 3.33Å; L209-V211 PolarHBondContact O-N 2.97Å; V211-S215 VanDerWaalsContact O-CB 3.26Å; V211-S215 WeakPolarHBondContact O-CB 3.19Å; V211-S215 PolarHBondContact O-N 3.44Å; V211-S215 PolarHBondContact O-OG 3.42Å
212I92.1Very high90.2Very high4 Ų455.8 Ų55.82%0.02129%0.285CS..Hα-helixtrans-63.2-51.2178.4-67.7167.3000110.6L113 A114 A117 T208 L209 L210 I214 S215 Y216 V246 Y250L113-I212 HydrophobicContact CB-CD1 4.45Å; A114-I212 HydrophobicContact CB-CG1 4.24Å; A117-I212 HydrophobicContact CB-CB 4.31Å; A117-I212 HydrophobicContact CB-CG1 3.9Å; A117-I212 HydrophobicContact CB-CG2 4.42Å; T208-I212 VanDerWaalsContact O-CG1 3.28Å; T208-I212 WeakPolarHBondContact O-CG1 3.43Å; T208-I212 PolarHBondContact O-N 3.39Å; T208-I212 VanDerWaalsContact O-N 3.09Å; L209-I212 PolarHBondContact O-N 3.4Å; L210-I212 VanDerWaalsContact C-N 3.33Å; L210-I212 PolarHBondContact O-N 2.72Å; I212-I214 PolarHBondContact O-N 2.87Å; I212-S215 WeakPolarHBondContact O-CB 3.29Å; I212-S215 PolarHBondContact O-N 3.32Å; I212-Y216 HydrophobicContact CG2-CD2 3.84Å; I212-Y216 HydrophobicContact CG2-CE2 4.15Å; I212-Y216 WeakPolarHBondContact O-CD2 3.12Å; I212-Y216 PolarHBondContact O-N 3.37Å; I212-V246 HydrophobicContact CD1-CG1 4.3Å; I212-V246 HydrophobicContact CD1-CG2 4.26Å; I212-V246 HydrophobicContact CG2-CG1 3.88Å; I212-V246 HydrophobicContact CG2-CG2 4.45Å; I212-Y250 HydrophobicContact CD1-CD2 4.45Å; I212-Y250 HydrophobicContact CD1-CE2 3.59Å
213L91.7Very high90.3Very high114 Ų11455.7 Ų55.760%0.59728%0.276SS*.Hα-helixtrans-61.3-45.4-177.6-71.6174.3000111.8L209 L210 Y216 F217L209-L213 WeakPolarHBondContact O-CB 3.44Å; L209-L213 VanDerWaalsContact O-CG 3.28Å; L209-L213 WeakPolarHBondContact O-CG 3.44Å; L209-L213 PolarHBondContact O-N 2.93Å; L210-L213 PolarHBondContact O-N 2.89Å; L213-Y216 PolarHBondContact O-N 2.9Å; L213-F217 VanDerWaalsContact O-CB 3.23Å; L213-F217 WeakPolarHBondContact O-CB 3.41Å; L213-F217 PolarHBondContact O-N 2.98Å
214I93.8Very high90.1Very high81 Ų8156.7 Ų56.742%0.41528%0.282SS..Hα-helixtrans-62-46.3176.9-69.1172.8000110.4L210 I212 Y216 F217 F218L210-I214 HydrophobicContact CD1-CD1 3.85Å; L210-I214 HydrophobicContact CD1-CG1 4.23Å; L210-I214 HydrophobicContact CD2-CD1 4.47Å; L210-I214 HydrophobicContact CG-CD1 3.76Å; L210-I214 HydrophobicContact CG-CG1 4.45Å; L210-I214 WeakPolarHBondContact O-CB 3.42Å; L210-I214 VanDerWaalsContact O-CG1 3.24Å; L210-I214 WeakPolarHBondContact O-CG1 3.46Å; L210-I214 PolarHBondContact O-N 2.87Å; I212-I214 PolarHBondContact O-N 2.87Å; I214-Y216 VanDerWaalsContact C-N 3.35Å; I214-Y216 PolarHBondContact O-N 3.48Å; I214-F217 PolarHBondContact O-N 3.38Å; I214-F218 HydrophobicContact CG2-CD2 3.78Å; I214-F218 HydrophobicContact CG2-CE2 3.6Å; I214-F218 WeakPolarHBondContact O-CD2 3.42Å; I214-F218 PolarHBondContact O-N 3.38Å; I214-F218 VanDerWaalsContact O-N 3.13Å
215S93.9Very high90Very high6 Ų665.6 Ų65.64%0.04232%0.315CS..Hα-helixtrans-57-48.6178.6-640000111.3V211 I212 F218 I219V211-S215 VanDerWaalsContact O-CB 3.26Å; V211-S215 WeakPolarHBondContact O-CB 3.19Å; V211-S215 PolarHBondContact O-N 3.44Å; V211-S215 PolarHBondContact O-OG 3.42Å; I212-S215 WeakPolarHBondContact O-CB 3.29Å; I212-S215 PolarHBondContact O-N 3.32Å; S215-F218 PolarHBondContact O-N 2.94Å; S215-I219 VanDerWaalsContact O-CG1 3.25Å; S215-I219 WeakPolarHBondContact O-CG1 3.48Å; S215-I219 PolarHBondContact O-N 3.46Å
216Y89.9Confident90.1Very high17 Ų1766.9 Ų66.97%0.06732%0.319CS..Hα-helixtrans-72.9-31.3-179.6-84.5-74.6000114.2A117 I212 L213 I214 I219 C220 C239 H242 L243A117-Y216 HydrophobicContact CB-CD2 4.41Å; A117-Y216 HydrophobicContact CB-CE2 3.98Å; I212-Y216 HydrophobicContact CG2-CD2 3.84Å; I212-Y216 HydrophobicContact CG2-CE2 4.15Å; I212-Y216 WeakPolarHBondContact O-CD2 3.12Å; I212-Y216 PolarHBondContact O-N 3.37Å; L213-Y216 PolarHBondContact O-N 2.9Å; I214-Y216 VanDerWaalsContact C-N 3.35Å; I214-Y216 PolarHBondContact O-N 3.48Å; Y216-I219 HydrophobicContact CD1-CD1 3.97Å; Y216-I219 HydrophobicContact CE1-CD1 4.06Å; Y216-I219 HydrophobicContact CG-CD1 4.44Å; Y216-I219 PolarHBondContact O-N 2.92Å; Y216-C220 WeakPolarHBondContact O-CB 2.97Å; Y216-C220 PolarHBondContact O-N 2.86Å; Y216-C220 PolarHBondContact O-SG 2.85Å; Y216-C239 HydrophobicContact CE1-CB 3.98Å; Y216-H242 AromaticContact CE2-ND1 3.58Å; Y216-H242 AromaticContact CZ-ND1 3.6Å; Y216-H242 WeakPolarHBondContact OH-CB 3.15Å; Y216-H242 PolarHBondContact OH-ND1 3Å; Y216-L243 HydrophobicContact CD1-CD1 3.86Å; Y216-L243 HydrophobicContact CD1-CD2 3.69Å; Y216-L243 HydrophobicContact CD1-CG 3.89Å; Y216-L243 HydrophobicContact CD2-CD2 3.76Å; Y216-L243 HydrophobicContact CE1-CD1 3.68Å; Y216-L243 HydrophobicContact CE1-CD2 3.64Å; Y216-L243 HydrophobicContact CE1-CG 3.43Å; Y216-L243 VanDerWaalsContact CE1-CG 3.43Å; Y216-L243 HydrophobicContact CE2-CD2 3.72Å; Y216-L243 HydrophobicContact CE2-CG 4.2Å; Y216-L243 HydrophobicContact CG-CD2 3.74Å; Y216-L243 HydrophobicContact CG-CG 4.43Å
217F90.7Very high89.9Confident130 Ų13072.1 Ų72.157%0.5734%0.335SS*.Hα-helixtrans-58.8-48.6172.1175.6-104.6000111.1L213 I214 C220 I221L213-F217 VanDerWaalsContact O-CB 3.23Å; L213-F217 WeakPolarHBondContact O-CB 3.41Å; L213-F217 PolarHBondContact O-N 2.98Å; I214-F217 PolarHBondContact O-N 3.38Å; F217-C220 WeakPolarHBondContact O-CB 3.36Å; F217-C220 PolarHBondContact O-N 3.49Å; F217-I221 HydrophobicContact CD1-CD1 3.96Å; F217-I221 HydrophobicContact CE1-CD1 3.45Å; F217-I221 VanDerWaalsContact CE1-CD1 3.45Å; F217-I221 HydrophobicContact CE2-CD1 4.31Å; F217-I221 HydrophobicContact CZ-CD1 3.66Å; F217-I221 WeakPolarHBondContact O-CG1 3.01Å; F217-I221 PolarHBondContact O-N 3.4Å; F217-I221 VanDerWaalsContact O-N 3.08Å
218F92Very high89.6Confident96 Ų9671.1 Ų71.142%0.42134%0.339SS..Hα-helixtrans-66.4-38.4176.2-76.2-64000112.8C125 I214 S215 C220 I221 T222C125-F218 VanDerWaalsContact SG-C 3.53Å; C125-F218 PolarHBondContact SG-O 3.34Å; I214-F218 HydrophobicContact CG2-CD2 3.78Å; I214-F218 HydrophobicContact CG2-CE2 3.6Å; I214-F218 WeakPolarHBondContact O-CD2 3.42Å; I214-F218 PolarHBondContact O-N 3.38Å; I214-F218 VanDerWaalsContact O-N 3.13Å; S215-F218 PolarHBondContact O-N 2.94Å; F218-C220 VanDerWaalsContact C-N 3.33Å; F218-C220 PolarHBondContact O-N 2.86Å; F218-I221 HydrophobicContact CD1-CD1 4.44Å; F218-I221 PolarHBondContact O-N 2.94Å; F218-T222 PolarHBondContact O-N 2.91Å; F218-T222 PolarHBondContact O-OG1 2.69Å
219I90.8Very high89Confident2 Ų274.9 Ų74.91%0.0137%0.37CS..Hα-helixtrans-57.9-46.9173.5-71166.4000110.4R120 H121 V124 S215 Y216 I221 T222 I223 V235R120-I219 HydrophobicContact CB-CD1 4.1Å; H121-I219 HydrophobicContact CB-CD1 4.26Å; H121-I219 HydrophobicContact CB-CG1 4.35Å; V124-I219 HydrophobicContact CB-CG1 4.34Å; V124-I219 HydrophobicContact CG1-CG2 4.32Å; S215-I219 VanDerWaalsContact O-CG1 3.25Å; S215-I219 WeakPolarHBondContact O-CG1 3.48Å; S215-I219 PolarHBondContact O-N 3.46Å; Y216-I219 HydrophobicContact CD1-CD1 3.97Å; Y216-I219 HydrophobicContact CE1-CD1 4.06Å; Y216-I219 HydrophobicContact CG-CD1 4.44Å; Y216-I219 PolarHBondContact O-N 2.92Å; I219-I221 PolarHBondContact O-N 3.34Å; I219-T222 PolarHBondContact O-N 3.44Å; I219-I223 HydrophobicContact CG2-CD1 3.73Å; I219-I223 HydrophobicContact CG2-CG1 4.31Å; I219-I223 VanDerWaalsContact O-CG1 3.29Å; I219-I223 WeakPolarHBondContact O-CG1 3.21Å; I219-I223 PolarHBondContact O-N 2.86Å; I219-V235 HydrophobicContact CG2-CG1 4.31Å
220C87.8Confident88.6Confident65 Ų6580.7 Ų80.744%0.43940%0.396SS..Hα-helixtrans-59.2-44.7177.6-74.90000112.1Y216 F217 F218 T222 I223 Q224Y216-C220 WeakPolarHBondContact O-CB 2.97Å; Y216-C220 PolarHBondContact O-N 2.86Å; Y216-C220 PolarHBondContact O-SG 2.85Å; F217-C220 WeakPolarHBondContact O-CB 3.36Å; F217-C220 PolarHBondContact O-N 3.49Å; F218-C220 VanDerWaalsContact C-N 3.33Å; F218-C220 PolarHBondContact O-N 2.86Å; C220-T222 VanDerWaalsContact C-N 3.34Å; C220-T222 PolarHBondContact O-N 2.95Å; C220-I223 PolarHBondContact O-N 3.2Å; C220-Q224 WeakPolarHBondContact O-CG 3.31Å; C220-Q224 PolarHBondContact O-N 3.37Å
221I88.2Confident87.9Confident41 Ų4178.2 Ų78.221%0.2139%0.388CS..Hα-helixtrans-59-46.5174.8-69.3170.1000110.8F217 F218 I219 I223 Q224 R225F217-I221 HydrophobicContact CD1-CD1 3.96Å; F217-I221 HydrophobicContact CE1-CD1 3.45Å; F217-I221 VanDerWaalsContact CE1-CD1 3.45Å; F217-I221 HydrophobicContact CE2-CD1 4.31Å; F217-I221 HydrophobicContact CZ-CD1 3.66Å; F217-I221 WeakPolarHBondContact O-CG1 3.01Å; F217-I221 PolarHBondContact O-N 3.4Å; F217-I221 VanDerWaalsContact O-N 3.08Å; F218-I221 HydrophobicContact CD1-CD1 4.44Å; F218-I221 PolarHBondContact O-N 2.94Å; I219-I221 PolarHBondContact O-N 3.34Å; I221-I223 PolarHBondContact O-N 3.28Å; I221-Q224 PolarHBondContact O-N 3.38Å; I221-R225 WeakPolarHBondContact O-CG 3.45Å; I221-R225 PolarHBondContact O-N 2.92Å; I221-R225 VanDerWaalsContact O-N 3.13Å
222T88Confident87.2Confident37 Ų3781.4 Ų81.423%0.22740%0.396CS..Hα-helixtrans-61.5-45.2178.8-66.80000111.1V124 C125 F218 I219 C220 Q224 R225 M226V124-T222 HydrophobicContact CG1-CG2 3.91Å; C125-T222 PolarHBondContact SG-OG1 3.38Å; F218-T222 PolarHBondContact O-N 2.91Å; F218-T222 PolarHBondContact O-OG1 2.69Å; I219-T222 PolarHBondContact O-N 3.44Å; C220-T222 VanDerWaalsContact C-N 3.34Å; C220-T222 PolarHBondContact O-N 2.95Å; T222-Q224 VanDerWaalsContact C-N 3.34Å; T222-Q224 PolarHBondContact O-N 3.38Å; T222-R225 CarbonylContact O-C 3.23Å; T222-R225 PolarHBondContact O-N 3.38Å; T222-M226 WeakPolarHBondContact O-CG 3.26Å; T222-M226 PolarHBondContact O-N 3.36Å
223I86Confident86.7Confident34 Ų3489 Ų8917%0.17443%0.428CS..Hα-helixtrans-57.4-45.6177.5-69.1168000111.4I219 C220 I221 R225 M226 R232 V235I219-I223 HydrophobicContact CG2-CD1 3.73Å; I219-I223 HydrophobicContact CG2-CG1 4.31Å; I219-I223 VanDerWaalsContact O-CG1 3.29Å; I219-I223 WeakPolarHBondContact O-CG1 3.21Å; I219-I223 PolarHBondContact O-N 2.86Å; C220-I223 PolarHBondContact O-N 3.2Å; I221-I223 PolarHBondContact O-N 3.28Å; I223-R225 PolarHBondContact O-N 3.48Å; I223-M226 WeakPolarHBondContact O-CB 3.45Å; I223-M226 PolarHBondContact O-N 2.87Å; I223-R232 HydrophobicContact CG2-CB 4.37Å; I223-R232 HydrophobicContact CG2-CG 4.08Å; I223-R232 PolarHBondContact O-NE 2.85Å; I223-R232 VanDerWaalsContact O-NE 3.11Å; I223-V235 HydrophobicContact CD1-CB 4.4Å; I223-V235 HydrophobicContact CD1-CG1 3.64Å; I223-V235 HydrophobicContact CG1-CB 4.28Å; I223-V235 HydrophobicContact CG1-CG1 3.75Å
224Q84.6Confident86.1Confident147 Ų14791 Ų9169%0.68743%0.432SS*.Hα-helixtrans-61.3-34.5177.9-71.7177.7-0.200111.9C220 I221 T222 R232C220-Q224 WeakPolarHBondContact O-CG 3.31Å; C220-Q224 PolarHBondContact O-N 3.37Å; I221-Q224 PolarHBondContact O-N 3.38Å; T222-Q224 VanDerWaalsContact C-N 3.34Å; T222-Q224 PolarHBondContact O-N 3.38Å; Q224-R232 PolarHBondContact O-NH2 2.02Å
225R86.4Confident85.4Confident202 Ų20288 Ų8876%0.76242%0.418SS*.Hα-helixtrans-79.6-18.3177.5-68177.7179.4-174.50.9114.2I221 T222 I223 R227I221-R225 WeakPolarHBondContact O-CG 3.45Å; I221-R225 PolarHBondContact O-N 2.92Å; I221-R225 VanDerWaalsContact O-N 3.13Å; T222-R225 CarbonylContact O-C 3.23Å; T222-R225 PolarHBondContact O-N 3.38Å; I223-R225 PolarHBondContact O-N 3.48Å; R225-R227 PolarHBondContact O-N 3.48Å
226M87.4Confident84.6Confident56 Ų5694.8 Ų94.828%0.27645%0.447SS..  trans-64.2133.9177.2-68.4177.295.100110.6T222 I223 R232 V235T222-M226 WeakPolarHBondContact O-CG 3.26Å; T222-M226 PolarHBondContact O-N 3.36Å; I223-M226 WeakPolarHBondContact O-CB 3.45Å; I223-M226 PolarHBondContact O-N 2.87Å; M226-R232 HydrophobicContact CB-CG 3.92Å; M226-R232 PolarHBondContact O-NE 2.8Å; M226-R232 PolarHBondContact O-NH2 2.87Å; M226-R232 HydrophobicContact SD-CG 4.46Å; M226-V235 HydrophobicContact CE-CG2 4.19Å; M226-V235 HydrophobicContact SD-CG2 4.12Å
227R82.4Confident83.8Confident250 Ų25097.9 Ų97.994%0.94347%0.471SS*.  trans-87.4-22.5176.8-65.6-174178.1179.7-0.7113.8R225R225-R227 PolarHBondContact O-N 3.48Å
228S87.2Confident82.9Confident64 Ų6494 Ų9445%0.44846%0.458SS..  trans-86.9119.5-179.6172.70000111.6E230 G231 R232S228-E230 VanDerWaalsContact C-N 3.25Å; S228-E230 PolarHBondContact O-N 2.89Å; S228-E230 PolarHBondContact OG-N 3.12Å; S228-G231 PolarHBondContact O-N 3.14Å; S228-G231 PolarHBondContact OG-N 3.33Å; S228-G231 VanDerWaalsContact OG-N 3.12Å; S228-R232 WeakPolarHBondContact O-CG 3.45Å; S228-R232 PolarHBondContact O-N 3.18Å
229A80.5Confident82.3Confident80 Ų8089.8 Ų89.866%0.66144%0.44SS*.Hα-helixtrans-61.6-34.9174.200000112.1R232 K233A229-R232 PolarHBondContact O-N 3.09Å; A229-K233 WeakPolarHBondContact O-CB 3.4Å; A229-K233 PolarHBondContact O-N 2.57Å
230E80.6Confident81.7Confident159 Ų15990.8 Ų90.874%0.74345%0.449SS*.Hα-helixtrans-69.3-41.2177.1-167169.7-163.200111.6S228 R232 K233 K234S228-E230 VanDerWaalsContact C-N 3.25Å; S228-E230 PolarHBondContact O-N 2.89Å; S228-E230 PolarHBondContact OG-N 3.12Å; E230-R232 PolarHBondContact O-N 2.92Å; E230-K233 PolarHBondContact O-N 3.06Å; E230-K234 WeakPolarHBondContact O-CB 3.16Å; E230-K234 PolarHBondContact O-N 3.06Å
231G77.5Confident81.1Confident19 Ų1988.3 Ų88.320%0.19643%0.432CS..Hα-helixtrans-59.8-44.9172.100000112.5S228 K234 V235S228-G231 PolarHBondContact O-N 3.14Å; S228-G231 PolarHBondContact OG-N 3.33Å; S228-G231 VanDerWaalsContact OG-N 3.12Å; G231-K234 PolarHBondContact O-N 3.19Å; G231-V235 WeakPolarHBondContact O-CG2 3.39Å; G231-V235 PolarHBondContact O-N 3.18Å
232R80.9Confident80.8Confident106 Ų10686.3 Ų86.340%0.442%0.422SS..Hα-helixtrans-59.7-47.3174.9-69.7179.7178.6175.6-0.3111.9I223 Q224 M226 S228 A229 E230 K234 V235 F236I223-R232 HydrophobicContact CG2-CB 4.37Å; I223-R232 HydrophobicContact CG2-CG 4.08Å; I223-R232 PolarHBondContact O-NE 2.85Å; I223-R232 VanDerWaalsContact O-NE 3.11Å; Q224-R232 PolarHBondContact O-NH2 2.02Å; M226-R232 HydrophobicContact CB-CG 3.92Å; M226-R232 PolarHBondContact O-NE 2.8Å; M226-R232 PolarHBondContact O-NH2 2.87Å; M226-R232 HydrophobicContact SD-CG 4.46Å; S228-R232 WeakPolarHBondContact O-CG 3.45Å; S228-R232 PolarHBondContact O-N 3.18Å; A229-R232 PolarHBondContact O-N 3.09Å; E230-R232 PolarHBondContact O-N 2.92Å; R232-K234 VanDerWaalsContact C-N 3.33Å; R232-K234 PolarHBondContact O-N 3.22Å; R232-V235 PolarHBondContact O-N 3.37Å; R232-F236 WeakPolarHBondContact O-CB 3.48Å; R232-F236 PolarHBondContact O-N 3.46Å
233K79.9Confident80.5Confident163 Ų16387.7 Ų87.771%0.70943%0.428SS*.Hα-helixtrans-62-40179.5-169.1176.4-178.7178.70111.8A229 E230 S237A229-K233 WeakPolarHBondContact O-CB 3.4Å; A229-K233 PolarHBondContact O-N 2.57Å; E230-K233 PolarHBondContact O-N 3.06Å; K233-S237 WeakPolarHBondContact O-CB 3.35Å; K233-S237 PolarHBondContact O-N 2.93Å
234K78.8Confident80.2Confident155 Ų15588.1 Ų88.167%0.67443%0.432SS*.Hα-helixtrans-63.3-47.9176.3-173.5175.5-178.6178.30112E230 G231 R232 S237 T238E230-K234 WeakPolarHBondContact O-CB 3.16Å; E230-K234 PolarHBondContact O-N 3.06Å; G231-K234 PolarHBondContact O-N 3.19Å; R232-K234 VanDerWaalsContact C-N 3.33Å; R232-K234 PolarHBondContact O-N 3.22Å; K234-S237 PolarHBondContact O-N 3.41Å; K234-T238 PolarHBondContact O-N 3.16Å; K234-T238 VanDerWaalsContact O-N 3.13Å; K234-T238 PolarHBondContact O-OG1 3.43Å
235V79.3Confident79.9Confident19 Ų1981.2 Ų81.212%0.11540%0.4CS..Hα-helixtrans-63.9-45.9178.4177.50000110.9V124 I219 I223 M226 G231 R232 S237 T238 C239V124-V235 HydrophobicContact CG1-CG1 4.04Å; V124-V235 HydrophobicContact CG1-CG2 4.44Å; V124-V235 HydrophobicContact CG2-CG1 3.85Å; V124-V235 HydrophobicContact CG2-CG2 4.36Å; I219-V235 HydrophobicContact CG2-CG1 4.31Å; I223-V235 HydrophobicContact CD1-CB 4.4Å; I223-V235 HydrophobicContact CD1-CG1 3.64Å; I223-V235 HydrophobicContact CG1-CB 4.28Å; I223-V235 HydrophobicContact CG1-CG1 3.75Å; M226-V235 HydrophobicContact CE-CG2 4.19Å; M226-V235 HydrophobicContact SD-CG2 4.12Å; G231-V235 WeakPolarHBondContact O-CG2 3.39Å; G231-V235 PolarHBondContact O-N 3.18Å; R232-V235 PolarHBondContact O-N 3.37Å; V235-S237 PolarHBondContact O-N 2.99Å; V235-T238 PolarHBondContact O-N 3.25Å; V235-T238 VanDerWaalsContact O-N 3.13Å; V235-C239 WeakPolarHBondContact O-CB 3.37Å; V235-C239 PolarHBondContact O-N 2.74Å; V235-C239 PolarHBondContact O-SG 2.91Å; V235-C239 VanDerWaalsContact O-SG 3.34Å
236F78.3Confident79.6Confident148 Ų14872.1 Ų72.165%0.64937%0.367SS*.Hα-helixtrans-59.1-46.7178.3-170.9-95.6000111.7R232 T238 C239 A240R232-F236 WeakPolarHBondContact O-CB 3.48Å; R232-F236 PolarHBondContact O-N 3.46Å; F236-T238 PolarHBondContact O-N 2.84Å; F236-C239 PolarHBondContact O-N 3.37Å; F236-A240 VanDerWaalsContact O-CB 3.22Å; F236-A240 WeakPolarHBondContact O-CB 3.38Å; F236-A240 PolarHBondContact O-N 3.45Å
237S71.9Confident79.3Confident82 Ų8273.2 Ų73.257%0.57338%0.38SS*.Hα-helixtrans-61-31.6177.6-173.50000113.1K233 K234 V235K233-S237 WeakPolarHBondContact O-CB 3.35Å; K233-S237 PolarHBondContact O-N 2.93Å; K234-S237 PolarHBondContact O-N 3.41Å; V235-S237 PolarHBondContact O-N 2.99Å
238T73.3Confident79Confident50 Ų5063.9 Ų63.931%0.30735%0.348SS..Hα-helixtrans-83.5-34.9-177.9-49.70000111.8R120 K234 V235 F236 S241R120-T238 VanDerWaalsContact CZ-CG2 3.46Å; K234-T238 PolarHBondContact O-N 3.16Å; K234-T238 VanDerWaalsContact O-N 3.13Å; K234-T238 PolarHBondContact O-OG1 3.43Å; V235-T238 PolarHBondContact O-N 3.25Å; V235-T238 VanDerWaalsContact O-N 3.13Å; F236-T238 PolarHBondContact O-N 2.84Å; T238-S241 PolarHBondContact O-OG 3.16Å
239C78.7Confident78.3Confident6 Ų661.4 Ų61.44%0.04133%0.329CS..Hα-helixtrans-78.8-28.9178.7-70.90000113Y216 V235 F236 S241 H242 L243Y216-C239 HydrophobicContact CE1-CB 3.98Å; V235-C239 WeakPolarHBondContact O-CB 3.37Å; V235-C239 PolarHBondContact O-N 2.74Å; V235-C239 PolarHBondContact O-SG 2.91Å; V235-C239 VanDerWaalsContact O-SG 3.34Å; F236-C239 PolarHBondContact O-N 3.37Å; C239-S241 VanDerWaalsContact C-N 3.34Å; C239-S241 PolarHBondContact O-N 2.86Å; C239-H242 PolarHBondContact O-N 3.36Å; C239-L243 WeakPolarHBondContact O-CB 3.23Å; C239-L243 PolarHBondContact O-N 3.36Å
240A78.3Confident77.9Confident24 Ų2457.9 Ų57.920%0.19830%0.299CS..Hα-helixtrans-61.2-38.8-173.700000113F236 T244F236-A240 VanDerWaalsContact O-CB 3.22Å; F236-A240 WeakPolarHBondContact O-CB 3.38Å; F236-A240 PolarHBondContact O-N 3.45Å; A240-T244 VanDerWaalsContact O-CB 3.31Å; A240-T244 WeakPolarHBondContact O-CB 3.47Å; A240-T244 PolarHBondContact O-N 2.93Å; A240-T244 PolarHBondContact O-OG1 2.95Å
241S75.3Confident77.6Confident12 Ų1252 Ų528%0.08428%0.281CS..Hα-helixtrans-63.7-49.5177.850.40000111.4T238 C239 T244 A245 I287T238-S241 PolarHBondContact O-OG 3.16Å; C239-S241 VanDerWaalsContact C-N 3.34Å; C239-S241 PolarHBondContact O-N 2.86Å; S241-T244 WeakPolarHBondContact O-CB 3.45Å; S241-T244 PolarHBondContact O-N 3.23Å; S241-A245 PolarHBondContact O-N 3.27Å; S241-I287 WeakPolarHBondContact O-CG2 3.3Å
242H82.4Confident77.2Confident0 Ų052.7 Ų52.70%028%0.282CS..Hα-helixtrans-64-43.8178.4-174.5-92000112.2L113 M116 Y216 C239 T244 A245 V246 Y288L113-H242 PolarHBondContact O-CE1 3.28Å; L113-H242 PolarHBondContact O-NE2 2.86Å; M116-H242 VanDerWaalsContact CB-NE2 3.34Å; M116-H242 WeakPolarHBondContact CB-NE2 3.28Å; Y216-H242 AromaticContact CE2-ND1 3.58Å; Y216-H242 AromaticContact CZ-ND1 3.6Å; Y216-H242 WeakPolarHBondContact OH-CB 3.15Å; Y216-H242 PolarHBondContact OH-ND1 3Å; C239-H242 PolarHBondContact O-N 3.36Å; H242-T244 VanDerWaalsContact C-N 3.29Å; H242-T244 PolarHBondContact O-N 3.16Å; H242-A245 PolarHBondContact O-N 3.44Å; H242-V246 VanDerWaalsContact CE1-CG2 3.4Å; H242-V246 WeakPolarHBondContact CE1-CG2 3.29Å; H242-V246 WeakPolarHBondContact O-CB 3.5Å; H242-V246 WeakPolarHBondContact O-CG2 3.18Å; H242-V246 PolarHBondContact O-N 3.47Å; H242-Y288 HydrophobicContact CB-CE1 4.4Å; H242-Y288 PolarHBondContact CD2-OH 3.35Å; H242-Y288 VanDerWaalsContact CD2-OH 3.23Å
243L81.6Confident76.5Confident65 Ų6548.8 Ų48.834%0.3427%0.269SS..Hα-helixtrans-61.1-38.3173.6-78.3172.6000112.2Y216 C239 V246 S247Y216-L243 HydrophobicContact CD1-CD1 3.86Å; Y216-L243 HydrophobicContact CD1-CD2 3.69Å; Y216-L243 HydrophobicContact CD1-CG 3.89Å; Y216-L243 HydrophobicContact CD2-CD2 3.76Å; Y216-L243 HydrophobicContact CE1-CD1 3.68Å; Y216-L243 HydrophobicContact CE1-CD2 3.64Å; Y216-L243 HydrophobicContact CE1-CG 3.43Å; Y216-L243 VanDerWaalsContact CE1-CG 3.43Å; Y216-L243 HydrophobicContact CE2-CD2 3.72Å; Y216-L243 HydrophobicContact CE2-CG 4.2Å; Y216-L243 HydrophobicContact CG-CD2 3.74Å; Y216-L243 HydrophobicContact CG-CG 4.43Å; C239-L243 WeakPolarHBondContact O-CB 3.23Å; C239-L243 PolarHBondContact O-N 3.36Å; L243-V246 PolarHBondContact O-N 3.48Å; L243-S247 VanDerWaalsContact O-CB 3.22Å; L243-S247 WeakPolarHBondContact O-CB 3.13Å; L243-S247 PolarHBondContact O-N 3Å; L243-S247 PolarHBondContact O-OG 3.27Å
244T79.8Confident76Confident44 Ų4444.7 Ų44.727%0.2725%0.254SS..Hα-helixtrans-62.2-46.1175.3-56.10000110.6A240 S241 H242 S247 I248 I287A240-T244 VanDerWaalsContact O-CB 3.31Å; A240-T244 WeakPolarHBondContact O-CB 3.47Å; A240-T244 PolarHBondContact O-N 2.93Å; A240-T244 PolarHBondContact O-OG1 2.95Å; S241-T244 WeakPolarHBondContact O-CB 3.45Å; S241-T244 PolarHBondContact O-N 3.23Å; H242-T244 VanDerWaalsContact C-N 3.29Å; H242-T244 PolarHBondContact O-N 3.16Å; T244-S247 PolarHBondContact O-N 2.67Å; T244-I248 HydrophobicContact CG2-CD1 3.87Å; T244-I248 VanDerWaalsContact O-CG1 3.3Å; T244-I248 WeakPolarHBondContact O-CG1 3.34Å; T244-I248 PolarHBondContact O-N 2.91Å; T244-I287 HydrophobicContact CG2-CD1 4.44Å; T244-I287 HydrophobicContact CG2-CG1 4.49Å; T244-I287 HydrophobicContact CG2-CG2 4.5Å
245A77.9Confident75.4Confident1 Ų144.2 Ų44.21%0.00825%0.252CS..Hα-helixtrans-61.5-49.217700000111.8S241 H242 S247 I248 F249 I287 Y288S241-A245 PolarHBondContact O-N 3.27Å; H242-A245 PolarHBondContact O-N 3.44Å; A245-S247 PolarHBondContact O-N 2.93Å; A245-I248 PolarHBondContact O-N 3.32Å; A245-F249 WeakPolarHBondContact O-CB 3.36Å; A245-F249 PolarHBondContact O-N 2.97Å; A245-I287 HydrophobicContact CB-CD1 4.24Å; A245-I287 HydrophobicContact CB-CG2 4.12Å; A245-Y288 HydrophobicContact CB-CE2 4Å; A245-Y288 WeakPolarHBondContact CB-OH 3.29Å
246V80.3Confident74.5Confident11 Ų1145 Ų457%0.06725%0.254CS..Hα-helixtrans-59-45.5176.5166.80000111.7I212 H242 L243 I248 F249 Y250I212-V246 HydrophobicContact CD1-CG1 4.3Å; I212-V246 HydrophobicContact CD1-CG2 4.26Å; I212-V246 HydrophobicContact CG2-CG1 3.88Å; I212-V246 HydrophobicContact CG2-CG2 4.45Å; H242-V246 VanDerWaalsContact CE1-CG2 3.4Å; H242-V246 WeakPolarHBondContact CE1-CG2 3.29Å; H242-V246 WeakPolarHBondContact O-CB 3.5Å; H242-V246 WeakPolarHBondContact O-CG2 3.18Å; H242-V246 PolarHBondContact O-N 3.47Å; L243-V246 PolarHBondContact O-N 3.48Å; V246-I248 VanDerWaalsContact C-N 3.35Å; V246-F249 PolarHBondContact O-N 2.92Å; V246-Y250 HydrophobicContact CG1-CD2 3.87Å; V246-Y250 HydrophobicContact CG1-CE2 4.41Å; V246-Y250 PolarHBondContact O-N 3.22Å
247S79.4Confident73.3Confident79 Ų7945.1 Ų45.155%0.55225%0.252SS*.Hα-helixtrans-65.6-37.3-179.7-69.30000112.2L243 T244 A245 G251L243-S247 VanDerWaalsContact O-CB 3.22Å; L243-S247 WeakPolarHBondContact O-CB 3.13Å; L243-S247 PolarHBondContact O-N 3Å; L243-S247 PolarHBondContact O-OG 3.27Å; T244-S247 PolarHBondContact O-N 2.67Å; A245-S247 PolarHBondContact O-N 2.93Å; S247-G251 WeakPolarHBondContact O-CA 3.42Å; S247-G251 PolarHBondContact O-N 3.42Å
248I76.7Confident72.3Confident54 Ų5447.6 Ų47.628%0.27726%0.258SS..Hα-helixtrans-66.6-51.3173.5-70.6165.1000109.3T244 A245 V246 T252 I280 L283 I287T244-I248 HydrophobicContact CG2-CD1 3.87Å; T244-I248 VanDerWaalsContact O-CG1 3.3Å; T244-I248 WeakPolarHBondContact O-CG1 3.34Å; T244-I248 PolarHBondContact O-N 2.91Å; A245-I248 PolarHBondContact O-N 3.32Å; V246-I248 VanDerWaalsContact C-N 3.35Å; I248-T252 WeakPolarHBondContact O-CB 3.44Å; I248-T252 PolarHBondContact O-N 3Å; I248-T252 PolarHBondContact O-OG1 3.39Å; I248-I280 HydrophobicContact CG2-CG1 4.49Å; I248-L283 HydrophobicContact CD1-CD1 4.45Å; I248-L283 HydrophobicContact CG2-CD1 4.12Å; I248-I287 HydrophobicContact CD1-CD1 3.67Å
249F72.5Confident71.2Confident12 Ų1247.9 Ų47.95%0.05326%0.256CS..Hα-helixtrans-58.5-61.1-177-172.9-92000112.6E109 C110 L113 A245 V246 T252 I253 I280E109-F249 HydrophobicContact CG-CD2 4.26Å; E109-F249 HydrophobicContact CG-CE2 3.72Å; E109-F249 HydrophobicContact CG-CZ 4.09Å; E109-F249 WeakPolarHBondContact OE2-CE2 3.37Å; C110-F249 WeakPolarHBondContact SG-CE1 3.46Å; L113-F249 HydrophobicContact CD1-CB 4.24Å; L113-F249 HydrophobicContact CD1-CD1 4.03Å; L113-F249 HydrophobicContact CD1-CD2 4.32Å; L113-F249 HydrophobicContact CD1-CG 3.93Å; A245-F249 WeakPolarHBondContact O-CB 3.36Å; A245-F249 PolarHBondContact O-N 2.97Å; V246-F249 PolarHBondContact O-N 2.92Å; F249-T252 PolarHBondContact O-N 2.92Å; F249-I253 HydrophobicContact CD1-CD1 3.73Å; F249-I253 HydrophobicContact CE1-CD1 3.29Å; F249-I253 HydrophobicContact CZ-CD1 3.77Å; F249-I253 WeakPolarHBondContact O-CG1 3.2Å; F249-I253 PolarHBondContact O-N 2.93Å; F249-I280 HydrophobicContact CD2-CD1 3.96Å; F249-I280 HydrophobicContact CD2-CG2 3.63Å; F249-I280 HydrophobicContact CE2-CD1 4.44Å; F249-I280 HydrophobicContact CE2-CG2 4.18Å
250Y73.4Confident69.4Low6 Ų651.3 Ų51.32%0.02428%0.278CS..Hα-helixtrans-75-28.9-178.2-73.7-80.2000112.8V205 T208 L209 I212 V246 T252 I253 I254V205-Y250 HydrophobicContact CG1-CD1 4.36Å; V205-Y250 HydrophobicContact CG1-CE1 4.15Å; T208-Y250 VanDerWaalsContact CB-OH 3.28Å; T208-Y250 WeakPolarHBondContact CB-OH 3.49Å; T208-Y250 PolarHBondContact OG1-OH 2.81Å; L209-Y250 HydrophobicContact CD1-CD1 3.77Å; L209-Y250 HydrophobicContact CD1-CE1 4.06Å; L209-Y250 HydrophobicContact CD2-CD1 3.31Å; L209-Y250 HydrophobicContact CD2-CD2 3.71Å; L209-Y250 HydrophobicContact CD2-CE1 3.61Å; L209-Y250 HydrophobicContact CD2-CE2 3.99Å; L209-Y250 HydrophobicContact CD2-CG 3.36Å; L209-Y250 HydrophobicContact CG-CD1 3.47Å; L209-Y250 VanDerWaalsContact CG-CD1 3.47Å; L209-Y250 HydrophobicContact CG-CE1 3.42Å; L209-Y250 VanDerWaalsContact CG-CE1 3.42Å; L209-Y250 HydrophobicContact CG-CG 4.08Å; I212-Y250 HydrophobicContact CD1-CD2 4.45Å; I212-Y250 HydrophobicContact CD1-CE2 3.59Å; V246-Y250 HydrophobicContact CG1-CD2 3.87Å; V246-Y250 HydrophobicContact CG1-CE2 4.41Å; V246-Y250 PolarHBondContact O-N 3.22Å; Y250-T252 VanDerWaalsContact C-N 3.34Å; Y250-I253 PolarHBondContact O-N 3.4Å; Y250-I254 VanDerWaalsContact O-CB 3.29Å; Y250-I254 WeakPolarHBondContact O-CB 3.42Å; Y250-I254 WeakPolarHBondContact O-CD1 3.5Å; Y250-I254 WeakPolarHBondContact O-CG1 3.34Å; Y250-I254 PolarHBondContact O-N 3.44Å
251G72.8Confident68Low36 Ų3656.7 Ų56.737%0.37130%0.303SS..Hα-helixtrans-61.8-43.2173.900000111.6S247 F255S247-G251 WeakPolarHBondContact O-CA 3.42Å; S247-G251 PolarHBondContact O-N 3.42Å; G251-F255 VanDerWaalsContact O-CB 3.23Å; G251-F255 WeakPolarHBondContact O-CB 3.3Å; G251-F255 PolarHBondContact O-N 3.11Å
252T68.8Low66.4Low34 Ų3461.7 Ų61.721%0.20934%0.338CS..Hα-helixtrans-65.1-44.4174.8-60.30000111.7I248 F249 Y250 F255 M256 F275 I280I248-T252 WeakPolarHBondContact O-CB 3.44Å; I248-T252 PolarHBondContact O-N 3Å; I248-T252 PolarHBondContact O-OG1 3.39Å; F249-T252 PolarHBondContact O-N 2.92Å; Y250-T252 VanDerWaalsContact C-N 3.34Å; T252-F255 PolarHBondContact O-N 2.82Å; T252-M256 VanDerWaalsContact O-CB 3.32Å; T252-M256 WeakPolarHBondContact O-CB 3.25Å; T252-M256 PolarHBondContact O-N 2.8Å; T252-F275 HydrophobicContact CG2-CB 4.17Å; T252-I280 HydrophobicContact CG2-CD1 4.44Å
253I67.6Low64.7Low24 Ų2465 Ų6512%0.12336%0.362CS..Hα-helixtrans-59.8-50.8176.5-69172.8000110.8F249 Y250 F255 M256 Y257F249-I253 HydrophobicContact CD1-CD1 3.73Å; F249-I253 HydrophobicContact CE1-CD1 3.29Å; F249-I253 HydrophobicContact CZ-CD1 3.77Å; F249-I253 WeakPolarHBondContact O-CG1 3.2Å; F249-I253 PolarHBondContact O-N 2.93Å; Y250-I253 PolarHBondContact O-N 3.4Å; I253-F255 PolarHBondContact O-N 2.85Å; I253-M256 PolarHBondContact O-N 3.43Å; I253-Y257 HydrophobicContact CG2-CD2 3.71Å; I253-Y257 HydrophobicContact CG2-CE2 3.93Å; I253-Y257 VanDerWaalsContact O-CD2 3.23Å; I253-Y257 WeakPolarHBondContact O-CD2 3.3Å; I253-Y257 PolarHBondContact O-N 3.35Å
254I69.9Low63.1Low77 Ų7765 Ų6540%0.39536%0.36SS..Hα-helixtrans-62.7-44.7-178.3-70.1167.6000110.9Y250 M256 Y257 L258Y250-I254 VanDerWaalsContact O-CB 3.29Å; Y250-I254 WeakPolarHBondContact O-CB 3.42Å; Y250-I254 WeakPolarHBondContact O-CD1 3.5Å; Y250-I254 WeakPolarHBondContact O-CG1 3.34Å; Y250-I254 PolarHBondContact O-N 3.44Å; I254-M256 VanDerWaalsContact C-N 3.29Å; I254-M256 PolarHBondContact O-N 3.37Å; I254-Y257 PolarHBondContact O-N 2.96Å; I254-L258 HydrophobicContact CG2-CD1 3.47Å; I254-L258 VanDerWaalsContact CG2-CD1 3.47Å; I254-L258 HydrophobicContact CG2-CG 4.12Å; I254-L258 WeakPolarHBondContact O-CB 3.3Å; I254-L258 WeakPolarHBondContact O-CG 3.42Å; I254-L258 PolarHBondContact O-N 3.16Å
255F64.9Low61.7Low144 Ų14465.7 Ų65.763%0.63237%0.366SS*.Hα-helixtrans-59.5-42.4177.2-178.3-96.8000111.4G251 T252 I253G251-F255 VanDerWaalsContact O-CB 3.23Å; G251-F255 WeakPolarHBondContact O-CB 3.3Å; G251-F255 PolarHBondContact O-N 3.11Å; T252-F255 PolarHBondContact O-N 2.82Å; I253-F255 PolarHBondContact O-N 2.85Å
256M60.1Low60.6Low35 Ų3571.5 Ų71.517%0.17240%0.395CS..Hα-helixtrans-66.7-40.8179.1-172.1-177.978.200113T252 I253 I254 A272 Y276T252-M256 VanDerWaalsContact O-CB 3.32Å; T252-M256 WeakPolarHBondContact O-CB 3.25Å; T252-M256 PolarHBondContact O-N 2.8Å; I253-M256 PolarHBondContact O-N 3.43Å; I254-M256 VanDerWaalsContact C-N 3.29Å; I254-M256 PolarHBondContact O-N 3.37Å; M256-A272 HydrophobicContact CG-CB 3.94Å; M256-A272 HydrophobicContact SD-CB 4.07Å; M256-Y276 HydrophobicContact CE-CD1 4.19Å; M256-Y276 HydrophobicContact CE-CE1 3.94Å; M256-Y276 HydrophobicContact SD-CD1 3.42Å; M256-Y276 WeakPolarHBondContact SD-CD1 3.44Å; M256-Y276 HydrophobicContact SD-CE1 3.23Å; M256-Y276 WeakPolarHBondContact SD-CE1 3.43Å
257Y52.6Low59.4Low151 Ų15175.9 Ų75.959%0.59242%0.418SS*.Hα-helixtrans-87.6-22.6-175.4-78.3-74.9000114.8I253 I254I253-Y257 HydrophobicContact CG2-CD2 3.71Å; I253-Y257 HydrophobicContact CG2-CE2 3.93Å; I253-Y257 VanDerWaalsContact O-CD2 3.23Å; I253-Y257 WeakPolarHBondContact O-CD2 3.3Å; I253-Y257 PolarHBondContact O-N 3.35Å; I254-Y257 PolarHBondContact O-N 2.96Å
258L52.8Low58.2Low134 Ų13474.3 Ų74.370%0.70241%0.405SS*.Hα-helixtrans-94.9-3.6-179.5-67.4-177.2000114.1I254I254-L258 HydrophobicContact CG2-CD1 3.47Å; I254-L258 VanDerWaalsContact CG2-CD1 3.47Å; I254-L258 HydrophobicContact CG2-CG 4.12Å; I254-L258 WeakPolarHBondContact O-CB 3.3Å; I254-L258 WeakPolarHBondContact O-CG 3.42Å; I254-L258 PolarHBondContact O-N 3.16Å
259Q49.2Very low57.4Low56 Ų5674.8 Ų74.826%0.26241%0.408SS..SBendtrans-70.4125.7177.2-166.5160-2.600110N261Q259-N261 PolarHBondContact O-N 3.33Å
260P41.5Very low57Low78 Ų7875.3 Ų75.351%0.50641%0.41SS..  trans-66.4131.6-173.822.2-30.7000111.9S262 S263P260-S262 PolarHBondContact O-N 3.11Å; P260-S263 PolarHBondContact O-N 3.22Å; P260-S263 VanDerWaalsContact O-N 3.09Å; P260-S263 PolarHBondContact O-OG 3.27Å
261N48.6Very low56.4Low137 Ų13779.7 Ų79.773%0.73343%0.433SS*.G310 helixtrans-52.1-17.1178.4-67.6-0.8000114.8Q259 S263 Q264Q259-N261 PolarHBondContact O-N 3.33Å; N261-S263 VanDerWaalsContact C-N 3.33Å; N261-Q264 PolarHBondContact OD1-OE1 3.23Å
262S41.5Very low55.7Low117 Ų11779 Ų7982%0.81842%0.424SS*.G310 helixtrans-77.6-11.1179.857.20000114.6P260P260-S262 PolarHBondContact O-N 3.11Å
263S45.8Very low55.4Low70 Ų7077.7 Ų77.749%0.4942%0.416SS..G310 helixtrans-115.88.1175.659.60000113.6P260 N261 S265P260-S263 PolarHBondContact O-N 3.22Å; P260-S263 VanDerWaalsContact O-N 3.09Å; P260-S263 PolarHBondContact O-OG 3.27Å; N261-S263 VanDerWaalsContact C-N 3.33Å; S263-S265 PolarHBondContact O-N 3.28Å
264Q48Very low55.2Low65 Ų6577.8 Ų77.830%0.30442%0.418SS..  trans-88.4108-170.5-140.7168.511.800110.7N261 D269N261-Q264 PolarHBondContact OD1-OE1 3.23Å; Q264-D269 WeakPolarHBondContact CG-OD1 3.48Å; Q264-D269 PolarHBondContact NE2-OD1 3.24Å
265S51.8Low54.8Low58 Ų5879.2 Ų79.241%0.40642%0.421SS..  trans-89.2148.6162.767.90000109.7S263 D267 T268S263-S265 PolarHBondContact O-N 3.28Å; S265-D267 PolarHBondContact O-N 2.81Å; S265-T268 WeakPolarHBondContact O-CB 3.2Å; S265-T268 PolarHBondContact O-N 2.99Å; S265-T268 PolarHBondContact OG-OG1 3.48Å; S265-T268 VanDerWaalsContact OG-OG1 3.1Å
266M53.4Low54.7Low124 Ų12473.9 Ų73.961%0.61140%0.397SS*.Hα-helixtrans-55.2-22.8178-69.3165.273.300113.3N173N173-M266 HydrophobicContact CB-CE 4.16Å; N173-M266 WeakPolarHBondContact ND2-CE 3.46Å
267D55.9Low54.7Low103 Ų10372.2 Ų72.255%0.55139%0.389SS*.Hα-helixtrans-74.2-29.1176.2-61.7-35.4000112.7S265 I271S265-D267 PolarHBondContact O-N 2.81Å; D267-I271 WeakPolarHBondContact O-CD1 3.43Å; D267-I271 VanDerWaalsContact O-CG1 3.29Å; D267-I271 WeakPolarHBondContact O-CG1 3.27Å; D267-I271 PolarHBondContact O-N 3.31Å; D267-I271 VanDerWaalsContact O-N 3.13Å
268T55Low55.3Low45 Ų4565.3 Ų65.328%0.27636%0.363SS..Hα-helixtrans-71.5-39.6179.3-52.70000111.2S265 K270 I271 A272S265-T268 WeakPolarHBondContact O-CB 3.2Å; S265-T268 PolarHBondContact O-N 2.99Å; S265-T268 PolarHBondContact OG-OG1 3.48Å; S265-T268 VanDerWaalsContact OG-OG1 3.1Å; T268-K270 VanDerWaalsContact C-N 3.33Å; T268-K270 PolarHBondContact O-N 2.89Å; T268-I271 PolarHBondContact O-N 3.33Å; T268-A272 WeakPolarHBondContact O-CB 3.35Å; T268-A272 PolarHBondContact O-N 3.19Å
269D59.5Low55.9Low65 Ų6560.2 Ų60.235%0.34834%0.337SS..Hα-helixtrans-67.2-34177.7-67.4-20.3000112.3Q264 S273Q264-D269 WeakPolarHBondContact CG-OD1 3.48Å; Q264-D269 PolarHBondContact NE2-OD1 3.24Å; D269-S273 VanDerWaalsContact O-CB 3.29Å; D269-S273 WeakPolarHBondContact O-CB 3.45Å; D269-S273 PolarHBondContact O-N 3.37Å; D269-S273 PolarHBondContact O-OG 2.94Å
270K63.8Low56.8Low22 Ų2257.8 Ų57.810%0.09633%0.326CS..Hα-helixtrans-67.2-42.9172.9-77.3-177.9-176.7-175.60112.1G14 L15 N173 T268 S273 V274G14-K270 WeakPolarHBondContact O-CE 3.49Å; G14-K270 PolarHBondContact O-NZ 2.96Å; L15-K270 HydrophobicContact CD2-CB 3.85Å; L15-K270 HydrophobicContact CD2-CG 4.48Å; N173-K270 WeakPolarHBondContact O-CE 3.34Å; N173-K270 WeakPolarHBondContact OD1-CE 3.36Å; N173-K270 PolarHBondContact OD1-NZ 3.45Å; T268-K270 VanDerWaalsContact C-N 3.33Å; T268-K270 PolarHBondContact O-N 2.89Å; K270-S273 WeakPolarHBondContact O-CB 3.33Å; K270-S273 PolarHBondContact O-N 3.37Å; K270-V274 WeakPolarHBondContact O-CG2 3.08Å; K270-V274 PolarHBondContact O-N 3.48Å; K270-V274 VanDerWaalsContact O-N 3.16Å
271I61.3Low57.9Low99 Ų9954 Ų5451%0.50830%0.302SS..Hα-helixtrans-65.6-45.9176.5-68.1165.7000110.3D267 T268 S273 V274 F275D267-I271 WeakPolarHBondContact O-CD1 3.43Å; D267-I271 VanDerWaalsContact O-CG1 3.29Å; D267-I271 WeakPolarHBondContact O-CG1 3.27Å; D267-I271 PolarHBondContact O-N 3.31Å; D267-I271 VanDerWaalsContact O-N 3.13Å; T268-I271 PolarHBondContact O-N 3.33Å; I271-S273 PolarHBondContact O-N 3.09Å; I271-V274 WeakPolarHBondContact O-CB 3.29Å; I271-V274 PolarHBondContact O-N 3.29Å; I271-V274 VanDerWaalsContact O-N 3.11Å; I271-F275 HydrophobicContact CG2-CD2 4.1Å; I271-F275 HydrophobicContact CG2-CE2 3.89Å; I271-F275 WeakPolarHBondContact O-CD2 3.3Å; I271-F275 PolarHBondContact O-N 3.35Å
272A58.3Low59Low20 Ų2048.9 Ų48.917%0.16527%0.274CS..Hα-helixtrans-57.6-40.9175.500000111.7M256 T268 V274 F275 Y276M256-A272 HydrophobicContact CG-CB 3.94Å; M256-A272 HydrophobicContact SD-CB 4.07Å; T268-A272 WeakPolarHBondContact O-CB 3.35Å; T268-A272 PolarHBondContact O-N 3.19Å; A272-V274 PolarHBondContact O-N 2.99Å; A272-F275 PolarHBondContact O-N 3.24Å; A272-F275 VanDerWaalsContact O-N 3.11Å; A272-Y276 WeakPolarHBondContact O-CD1 3.13Å; A272-Y276 PolarHBondContact O-N 3.42Å
273S61.5Low60.1Low8 Ų845.6 Ų45.66%0.05625%0.246CC..Hα-helixtrans-55.2-45172.8-69.10000113.8D269 K270 I271 F275 Y276 T277D269-S273 VanDerWaalsContact O-CB 3.29Å; D269-S273 WeakPolarHBondContact O-CB 3.45Å; D269-S273 PolarHBondContact O-N 3.37Å; D269-S273 PolarHBondContact O-OG 2.94Å; K270-S273 WeakPolarHBondContact O-CB 3.33Å; K270-S273 PolarHBondContact O-N 3.37Å; I271-S273 PolarHBondContact O-N 3.09Å; S273-F275 VanDerWaalsContact C-N 3.3Å; S273-F275 PolarHBondContact O-N 3.42Å; S273-Y276 PolarHBondContact OG-OH 3.46Å; S273-T277 VanDerWaalsContact O-CB 3.31Å; S273-T277 WeakPolarHBondContact O-CB 3.23Å; S273-T277 WeakPolarHBondContact O-CG2 3.32Å; S273-T277 PolarHBondContact O-N 2.94Å; S273-T277 PolarHBondContact O-OG1 2.95Å
274V63.1Low61.4Low26 Ų2642.4 Ų42.416%0.15822%0.224CC..Hα-helixtrans-60.8-39.8175.8177.80000111.7L15 F29 F175 K270 I271 A272 V278 V279L15-V274 HydrophobicContact CD1-CG2 3.8Å; L15-V274 HydrophobicContact CD2-CG2 3.83Å; L15-V274 HydrophobicContact CG-CG2 4.48Å; F29-V274 HydrophobicContact CE2-CG2 4.43Å; F29-V274 HydrophobicContact CZ-CG1 4.34Å; F29-V274 HydrophobicContact CZ-CG2 4.01Å; F175-V274 HydrophobicContact CE1-CG2 3.78Å; F175-V274 HydrophobicContact CZ-CG2 4.06Å; K270-V274 WeakPolarHBondContact O-CG2 3.08Å; K270-V274 PolarHBondContact O-N 3.48Å; K270-V274 VanDerWaalsContact O-N 3.16Å; I271-V274 WeakPolarHBondContact O-CB 3.29Å; I271-V274 PolarHBondContact O-N 3.29Å; I271-V274 VanDerWaalsContact O-N 3.11Å; A272-V274 PolarHBondContact O-N 2.99Å; V274-V278 WeakPolarHBondContact O-CB 3.35Å; V274-V278 PolarHBondContact O-N 3.1Å; V274-V279 PolarHBondContact O-N 2.86Å
275F61.7Low62.2Low106 Ų10639.5 Ų39.547%0.46521%0.211SC..Iπ-helixtrans-64.4-50.7-178.4-85-83.3000112.6T252 I271 A272 S273 V279 I280T252-F275 HydrophobicContact CG2-CB 4.17Å; I271-F275 HydrophobicContact CG2-CD2 4.1Å; I271-F275 HydrophobicContact CG2-CE2 3.89Å; I271-F275 WeakPolarHBondContact O-CD2 3.3Å; I271-F275 PolarHBondContact O-N 3.35Å; A272-F275 PolarHBondContact O-N 3.24Å; A272-F275 VanDerWaalsContact O-N 3.11Å; S273-F275 VanDerWaalsContact C-N 3.3Å; S273-F275 PolarHBondContact O-N 3.42Å; F275-V279 HydrophobicContact CD1-CB 4.11Å; F275-V279 HydrophobicContact CD1-CG1 4.14Å; F275-V279 HydrophobicContact CD1-CG2 4.03Å; F275-V279 HydrophobicContact CE1-CG1 4.5Å; F275-V279 HydrophobicContact CE1-CG2 4.46Å; F275-V279 HydrophobicContact CG-CG2 4.46Å; F275-V279 WeakPolarHBondContact O-CB 3.23Å; F275-V279 PolarHBondContact O-N 2.95Å; F275-I280 PolarHBondContact O-N 3.15Å; F275-I280 VanDerWaalsContact O-N 3.14Å
276Y64.5Low62.8Low32 Ų3239.9 Ų39.913%0.12521%0.208CC..Iπ-helixtrans-79.9-24.9-17772.1-102.5000114.2F102 F176 D178 M256 A272 S273F102-Y276 AromaticContact CE1-CE2 3.99Å; F102-Y276 HydrophobicContact CE1-CE2 3.99Å; F102-Y276 AromaticContact CZ-CD2 3.88Å; F102-Y276 HydrophobicContact CZ-CD2 3.88Å; F102-Y276 AromaticContact CZ-CE2 3.56Å; F102-Y276 HydrophobicContact CZ-CE2 3.56Å; F176-Y276 HydrophobicContact CZ-CE2 4.28Å; F176-Y276 WeakPolarHBondContact CZ-OH 3.29Å; D178-Y276 PolarHBondContact OD2-OH 3.2Å; M256-Y276 HydrophobicContact CE-CD1 4.19Å; M256-Y276 HydrophobicContact CE-CE1 3.94Å; M256-Y276 HydrophobicContact SD-CD1 3.42Å; M256-Y276 WeakPolarHBondContact SD-CD1 3.44Å; M256-Y276 HydrophobicContact SD-CE1 3.23Å; M256-Y276 WeakPolarHBondContact SD-CE1 3.43Å; A272-Y276 WeakPolarHBondContact O-CD1 3.13Å; A272-Y276 PolarHBondContact O-N 3.42Å; S273-Y276 PolarHBondContact OG-OH 3.46Å
277T59.5Low63.7Low0 Ų034.8 Ų34.80%018%0.183CC..Iπ-helixtrans-86.1-29.6-179.657.20000113.6Y71 F102 F175 F176 S273Y71-T277 WeakPolarHBondContact CE2-O 3.42Å; F102-T277 HydrophobicContact CE2-CG2 3.62Å; F102-T277 HydrophobicContact CZ-CG2 3.64Å; F175-T277 HydrophobicContact CZ-CG2 4.48Å; F175-T277 WeakPolarHBondContact CZ-OG1 3.42Å; F176-T277 HydrophobicContact CD1-CG2 4.45Å; F176-T277 HydrophobicContact CE1-CG2 3.78Å; F176-T277 HydrophobicContact CE2-CG2 4.18Å; F176-T277 HydrophobicContact CZ-CG2 3.62Å; S273-T277 VanDerWaalsContact O-CB 3.31Å; S273-T277 WeakPolarHBondContact O-CB 3.23Å; S273-T277 WeakPolarHBondContact O-CG2 3.32Å; S273-T277 PolarHBondContact O-N 2.94Å; S273-T277 PolarHBondContact O-OG1 2.95Å
278V64.4Low64.3Low7 Ų730.1 Ų30.14%0.04216%0.157CC..Iπ-helixtrans-127.4-37.8-167.7-177.40000112.7F29 I32 V274F29-V278 HydrophobicContact CD1-CG1 4.49Å; F29-V278 HydrophobicContact CD1-CG2 4.21Å; F29-V278 HydrophobicContact CE1-CG2 3.68Å; F29-V278 HydrophobicContact CZ-CG2 4.48Å; I32-V278 HydrophobicContact CB-CG1 3.72Å; I32-V278 HydrophobicContact CD1-CG1 3.77Å; I32-V278 HydrophobicContact CG1-CG1 4.34Å; I32-V278 HydrophobicContact CG2-CG1 3.27Å; I32-V278 VanDerWaalsContact CG2-O 3.3Å; I32-V278 WeakPolarHBondContact CG2-O 3.43Å; V274-V278 WeakPolarHBondContact O-CB 3.35Å; V274-V278 PolarHBondContact O-N 3.1Å
279V65.3Low64.7Low27 Ų2729.4 Ų29.416%0.16415%0.154CC..Iπ-helixtrans-79.7-41-176.1-179.10000112.2V274 F275 M282 L283V274-V279 PolarHBondContact O-N 2.86Å; F275-V279 HydrophobicContact CD1-CB 4.11Å; F275-V279 HydrophobicContact CD1-CG1 4.14Å; F275-V279 HydrophobicContact CD1-CG2 4.03Å; F275-V279 HydrophobicContact CE1-CG1 4.5Å; F275-V279 HydrophobicContact CE1-CG2 4.46Å; F275-V279 HydrophobicContact CG-CG2 4.46Å; F275-V279 WeakPolarHBondContact O-CB 3.23Å; F275-V279 PolarHBondContact O-N 2.95Å; V279-M282 HydrophobicContact CG1-CE 4.41Å; V279-M282 WeakPolarHBondContact O-CB 3.44Å; V279-M282 PolarHBondContact O-N 3.04Å; V279-L283 HydrophobicContact CG1-CD1 3.78Å; V279-L283 HydrophobicContact CG1-CG 4.23Å; V279-L283 VanDerWaalsContact O-CG 3.29Å; V279-L283 WeakPolarHBondContact O-CG 3.29Å; V279-L283 PolarHBondContact O-N 3.35Å; V279-L283 VanDerWaalsContact O-N 3.09Å
280I68.6Low64.7Low4 Ų431.1 Ų31.12%0.02116%0.163CC..Hα-helixtrans-55.7-56.3176.8-70.3-179.5000113.2I248 F249 T252 F275 M282 L283 N284I248-I280 HydrophobicContact CG2-CG1 4.49Å; F249-I280 HydrophobicContact CD2-CD1 3.96Å; F249-I280 HydrophobicContact CD2-CG2 3.63Å; F249-I280 HydrophobicContact CE2-CD1 4.44Å; F249-I280 HydrophobicContact CE2-CG2 4.18Å; T252-I280 HydrophobicContact CG2-CD1 4.44Å; F275-I280 PolarHBondContact O-N 3.15Å; F275-I280 VanDerWaalsContact O-N 3.14Å; I280-M282 PolarHBondContact O-N 3.27Å; I280-L283 PolarHBondContact O-N 2.88Å; I280-N284 PolarHBondContact O-N 3.36Å; I280-N284 VanDerWaalsContact O-N 3.1Å
281P63.8Low64.5Low0 Ų038 Ų380%019%0.188CC..Hα-helixtrans-64.6-26.1-177.621.4-31.3000113T36 N40 D68 Y71 S72 P285T36-P281 HydrophobicContact CG2-CB 4.04Å; N40-P281 PolarHBondContact ND2-O 3.26Å; N40-P281 VanDerWaalsContact ND2-O 3.08Å; D68-P281 HydrophobicContact CB-CB 3.8Å; Y71-P281 HydrophobicContact CD2-CG 4.48Å; Y71-P281 HydrophobicContact CE1-CB 4.45Å; Y71-P281 HydrophobicContact CE2-CB 3.92Å; Y71-P281 HydrophobicContact CE2-CG 3.44Å; Y71-P281 VanDerWaalsContact CE2-CG 3.44Å; Y71-P281 VanDerWaalsContact OH-CB 3.26Å; Y71-P281 WeakPolarHBondContact OH-CB 3.47Å; Y71-P281 WeakPolarHBondContact OH-CD 3.46Å; Y71-P281 WeakPolarHBondContact OH-CG 2.92Å; S72-P281 WeakPolarHBondContact OG-CG 3.36Å; P281-P285 WeakPolarHBondContact O-CD 3.32Å
282M71.5Confident64.8Low29 Ų2934.8 Ų34.814%0.14317%0.172CC..Hα-helixtrans-69.7-37.5173.2-173.4-161.163.500111.7I32 I35 T36 V279 I280 P285I32-M282 HydrophobicContact CB-SD 4.2Å; I32-M282 HydrophobicContact CG1-SD 3.91Å; I32-M282 HydrophobicContact CG2-CB 3.7Å; I32-M282 HydrophobicContact CG2-CG 3.87Å; I32-M282 HydrophobicContact CG2-SD 3.69Å; I35-M282 HydrophobicContact CB-CG 4.01Å; I35-M282 HydrophobicContact CD1-SD 4.32Å; I35-M282 HydrophobicContact CG2-CG 3.49Å; I35-M282 VanDerWaalsContact CG2-CG 3.49Å; I35-M282 HydrophobicContact CG2-SD 4.34Å; T36-M282 WeakPolarHBondContact OG1-CA 3.46Å; V279-M282 HydrophobicContact CG1-CE 4.41Å; V279-M282 WeakPolarHBondContact O-CB 3.44Å; V279-M282 PolarHBondContact O-N 3.04Å; I280-M282 PolarHBondContact O-N 3.27Å; M282-P285 WeakPolarHBondContact O-CD 3.17Å; M282-P285 WeakPolarHBondContact O-CG 3.25Å
283L65.8Low65.2Low47 Ų4742.4 Ų42.425%0.24620%0.202CC..Hα-helixtrans-77.1-30.6-178-70.8174.2000112.6I248 V279 I280 L286 I287I248-L283 HydrophobicContact CD1-CD1 4.45Å; I248-L283 HydrophobicContact CG2-CD1 4.12Å; V279-L283 HydrophobicContact CG1-CD1 3.78Å; V279-L283 HydrophobicContact CG1-CG 4.23Å; V279-L283 VanDerWaalsContact O-CG 3.29Å; V279-L283 WeakPolarHBondContact O-CG 3.29Å; V279-L283 PolarHBondContact O-N 3.35Å; V279-L283 VanDerWaalsContact O-N 3.09Å; I280-L283 PolarHBondContact O-N 2.88Å; L283-L286 HydrophobicContact CD2-CD1 4.45Å; L283-L286 PolarHBondContact O-N 3.04Å; L283-L286 VanDerWaalsContact O-N 3.13Å; L283-I287 HydrophobicContact CB-CD1 3.99Å; L283-I287 WeakPolarHBondContact O-CB 3.3Å; L283-I287 WeakPolarHBondContact O-CD1 3.36Å; L283-I287 WeakPolarHBondContact O-CG1 3.38Å; L283-I287 PolarHBondContact O-N 2.81Å
284N72.6Confident65.4Low4 Ų447.4 Ų47.42%0.02122%0.224CC..Hα-helixtrans-49.4-58.2178.8-79.4-13.4000113.3D68 E109 I280 L286 I287 Y288D68-N284 PolarHBondContact OD1-ND2 2.93Å; D68-N284 WeakPolarHBondContact OD2-CB 3.47Å; D68-N284 PolarHBondContact OD2-ND2 3.24Å; E109-N284 PolarHBondContact OE1-ND2 3.46Å; I280-N284 PolarHBondContact O-N 3.36Å; I280-N284 VanDerWaalsContact O-N 3.1Å; N284-L286 VanDerWaalsContact C-N 3.3Å; N284-L286 PolarHBondContact O-N 3.45Å; N284-I287 PolarHBondContact O-N 3.43Å; N284-Y288 WeakPolarHBondContact O-CD2 3.34Å; N284-Y288 PolarHBondContact O-N 3.48Å
285P64.4Low65.5Low4 Ų446.3 Ų46.33%0.02622%0.218CC..Hα-helixtrans-64.1-33.4179.524-32.8000112P281 M282 S289P281-P285 WeakPolarHBondContact O-CD 3.32Å; M282-P285 WeakPolarHBondContact O-CD 3.17Å; M282-P285 WeakPolarHBondContact O-CG 3.25Å; P285-S289 WeakPolarHBondContact O-CA 3.39Å; P285-S289 WeakPolarHBondContact O-CB 3.37Å; P285-S289 PolarHBondContact O-N 3.1Å; P285-S289 PolarHBondContact O-OG 3.06Å
286L65.2Low66Low65 Ų6545.9 Ų45.934%0.3422%0.215SC..Hα-helixtrans-67.2-42.3176.9-63.1174.7000111.7L283 N284 L290L283-L286 HydrophobicContact CD2-CD1 4.45Å; L283-L286 PolarHBondContact O-N 3.04Å; L283-L286 VanDerWaalsContact O-N 3.13Å; N284-L286 VanDerWaalsContact C-N 3.3Å; N284-L286 PolarHBondContact O-N 3.45Å; L286-L290 HydrophobicContact CB-CD1 4.06Å; L286-L290 HydrophobicContact CD2-CD1 3.86Å; L286-L290 HydrophobicContact CD2-CG 4.34Å; L286-L290 WeakPolarHBondContact O-CB 3.42Å; L286-L290 WeakPolarHBondContact O-CG 3.1Å; L286-L290 PolarHBondContact O-N 3.37Å
287I71.4Confident66.5Low18 Ų1847.2 Ų47.29%0.09223%0.229CC..Hα-helixtrans-65.5-43.5178.8-67.4162.8000110.6S241 T244 A245 I248 L283 N284S241-I287 WeakPolarHBondContact O-CG2 3.3Å; T244-I287 HydrophobicContact CG2-CD1 4.44Å; T244-I287 HydrophobicContact CG2-CG1 4.49Å; T244-I287 HydrophobicContact CG2-CG2 4.5Å; A245-I287 HydrophobicContact CB-CD1 4.24Å; A245-I287 HydrophobicContact CB-CG2 4.12Å; I248-I287 HydrophobicContact CD1-CD1 3.67Å; L283-I287 HydrophobicContact CB-CD1 3.99Å; L283-I287 WeakPolarHBondContact O-CB 3.3Å; L283-I287 WeakPolarHBondContact O-CD1 3.36Å; L283-I287 WeakPolarHBondContact O-CG1 3.38Å; L283-I287 PolarHBondContact O-N 2.81Å; N284-I287 PolarHBondContact O-N 3.43Å
288Y68.8Low67.1Low4 Ų447.2 Ų47.22%0.01623%0.23CC..Hα-helixtrans-82.2-28.4-177.3-69.1-67.5000114M57 L61 L64 M116 H242 A245 N284 N292M57-Y288 HydrophobicContact CE-CD1 4.42Å; M57-Y288 HydrophobicContact CE-CE1 3.93Å; L61-Y288 HydrophobicContact CD1-CD1 4.21Å; L61-Y288 HydrophobicContact CD1-CD2 3.43Å; L61-Y288 VanDerWaalsContact CD1-CD2 3.43Å; L61-Y288 HydrophobicContact CD1-CE2 3.94Å; L61-Y288 HydrophobicContact CD1-CG 3.62Å; L61-Y288 HydrophobicContact CD2-CD1 4.25Å; L61-Y288 HydrophobicContact CD2-CG 3.99Å; L64-Y288 HydrophobicContact CD2-CD2 4.48Å; L64-Y288 HydrophobicContact CD2-CE2 3.75Å; M116-Y288 HydrophobicContact CE-CE1 3.77Å; M116-Y288 HydrophobicContact CE-CE2 4.39Å; H242-Y288 HydrophobicContact CB-CE1 4.4Å; H242-Y288 PolarHBondContact CD2-OH 3.35Å; H242-Y288 VanDerWaalsContact CD2-OH 3.23Å; A245-Y288 HydrophobicContact CB-CE2 4Å; A245-Y288 WeakPolarHBondContact CB-OH 3.29Å; N284-Y288 WeakPolarHBondContact O-CD2 3.34Å; N284-Y288 PolarHBondContact O-N 3.48Å; Y288-N292 WeakPolarHBondContact O-CB 3.34Å
289S64.4Low67.6Low30 Ų3050.5 Ų50.521%0.2125%0.247CC..Hα-helixtrans-92.5-46.7-179.969.60000113.9P285 R291 N292P285-S289 WeakPolarHBondContact O-CA 3.39Å; P285-S289 WeakPolarHBondContact O-CB 3.37Å; P285-S289 PolarHBondContact O-N 3.1Å; P285-S289 PolarHBondContact O-OG 3.06Å; S289-R291 VanDerWaalsContact C-N 3.25Å; S289-R291 PolarHBondContact O-N 2.87Å; S289-N292 PolarHBondContact O-N 2.94Å
290L58.4Low68.2Low102 Ų10256.8 Ų56.853%0.53427%0.268SS..Hα-helixtrans-71.2-21-172-65.9176.2000113L286 K296L286-L290 HydrophobicContact CB-CD1 4.06Å; L286-L290 HydrophobicContact CD2-CD1 3.86Å; L286-L290 HydrophobicContact CD2-CG 4.34Å; L286-L290 WeakPolarHBondContact O-CB 3.42Å; L286-L290 WeakPolarHBondContact O-CG 3.1Å; L286-L290 PolarHBondContact O-N 3.37Å; L290-K296 VanDerWaalsContact C-CE 3.49Å; L290-K296 WeakPolarHBondContact O-CE 3.46Å; L290-K296 PolarHBondContact O-NZ 3.45Å
291R59.8Low68.5Low165 Ų16561.1 Ų61.162%0.62329%0.286SS*.SBendtrans-101.8-13177.4-69.2-174.1172.8-169.1-0.5113.5S289S289-R291 VanDerWaalsContact C-N 3.25Å; S289-R291 PolarHBondContact O-N 2.87Å
292N66.8Low68.9Low32 Ų3263 Ų6317%0.17130%0.296CS..  trans-98.1116.2-175.5-165.7-29000112Y58 Y288 S289 E294 V295 K296Y58-N292 PolarHBondContact OH-ND2 2.8Å; Y58-N292 PolarHBondContact OH-OD1 3.41Å; Y288-N292 WeakPolarHBondContact O-CB 3.34Å; S289-N292 PolarHBondContact O-N 2.94Å; N292-E294 VanDerWaalsContact C-N 3.28Å; N292-E294 PolarHBondContact O-N 2.8Å; N292-E294 WeakPolarHBondContact OD1-CB 3.45Å; N292-E294 PolarHBondContact OD1-N 2.91Å; N292-V295 HydrophobicContact CB-CB 4.23Å; N292-V295 HydrophobicContact CB-CG2 3.89Å; N292-V295 PolarHBondContact O-N 2.91Å; N292-K296 WeakPolarHBondContact O-CG 3.43Å; N292-K296 PolarHBondContact O-N 2.94Å; N292-K296 VanDerWaalsContact O-N 3.15Å
293K67.8Low69.2Low181 Ų18165.4 Ų65.479%0.78731%0.309SS*.Hα-helixtrans-63.9-32.4-179.9-68-173.6177.6-174.80112.8S297K293-S297 WeakPolarHBondContact O-CB 2.99Å; K293-S297 PolarHBondContact O-N 3.46Å
294E64.8Low69.8Low112 Ų11267.4 Ų67.452%0.52332%0.32SS..Hα-helixtrans-70.1-44.7-178.5-62.6173.2177.500110.6L53 Y58 N292 K296 S297 A298L53-E294 HydrophobicContact CD2-CB 4.04Å; Y58-E294 VanDerWaalsContact CE2-OE2 3.3Å; Y58-E294 WeakPolarHBondContact CE2-OE2 3.4Å; Y58-E294 WeakPolarHBondContact OH-CB 3.35Å; Y58-E294 PolarHBondContact OH-OE2 2.9Å; N292-E294 VanDerWaalsContact C-N 3.28Å; N292-E294 PolarHBondContact O-N 2.8Å; N292-E294 WeakPolarHBondContact OD1-CB 3.45Å; N292-E294 PolarHBondContact OD1-N 2.91Å; E294-K296 PolarHBondContact O-N 3.15Å; E294-S297 PolarHBondContact O-N 3.39Å; E294-A298 WeakPolarHBondContact O-CB 3.41Å; E294-A298 PolarHBondContact O-N 2.78Å
295V66.3Low69.9Low3 Ų375.7 Ų75.72%0.01836%0.356CS..Hα-helixtrans-62.7-44.2175.7-178.60000111M43 Y58 N292 S297 A298 L299M43-V295 HydrophobicContact CE-CG1 4.05Å; M43-V295 HydrophobicContact CE-CG2 3.59Å; M43-V295 HydrophobicContact SD-CG1 3.76Å; M43-V295 HydrophobicContact SD-CG2 4.36Å; Y58-V295 HydrophobicContact CE1-CG2 3.76Å; N292-V295 HydrophobicContact CB-CB 4.23Å; N292-V295 HydrophobicContact CB-CG2 3.89Å; N292-V295 PolarHBondContact O-N 2.91Å; V295-S297 VanDerWaalsContact C-N 3.34Å; V295-S297 PolarHBondContact O-N 3.13Å; V295-A298 PolarHBondContact O-N 3.28Å; V295-L299 WeakPolarHBondContact O-CB 3.42Å; V295-L299 PolarHBondContact O-N 3.42Å
296K72.1Confident70.3Confident97 Ų9781.5 Ų81.542%0.42239%0.386SS..Hα-helixtrans-61.2-42175.1-72.6-175.5-178.1-178.40112.5L290 N292 E294 L299 W300L290-K296 VanDerWaalsContact C-CE 3.49Å; L290-K296 WeakPolarHBondContact O-CE 3.46Å; L290-K296 PolarHBondContact O-NZ 3.45Å; N292-K296 WeakPolarHBondContact O-CG 3.43Å; N292-K296 PolarHBondContact O-N 2.94Å; N292-K296 VanDerWaalsContact O-N 3.15Å; E294-K296 PolarHBondContact O-N 3.15Å; K296-L299 PolarHBondContact O-N 3.25Å; K296-W300 VanDerWaalsContact O-CD1 3.28Å; K296-W300 PolarHBondContact O-N 3.41Å
297S74.7Confident70.3Confident60 Ų6087.9 Ų87.942%0.4241%0.407SS..Hα-helixtrans-65.1-43.8178.6-1770000111.5K293 E294 V295 W300 K301K293-S297 WeakPolarHBondContact O-CB 2.99Å; K293-S297 PolarHBondContact O-N 3.46Å; E294-S297 PolarHBondContact O-N 3.39Å; V295-S297 VanDerWaalsContact C-N 3.34Å; V295-S297 PolarHBondContact O-N 3.13Å; S297-W300 PolarHBondContact O-N 3.5Å; S297-K301 WeakPolarHBondContact O-CG 3.49Å; S297-K301 PolarHBondContact O-N 3.38Å
298A71.8Confident69.4Low1 Ų190.8 Ų90.81%0.00843%0.427CS..Hα-helixtrans-63.5-41.9176.100000112I46 D50 L53 E294 V295 W300 K301 I302I46-A298 HydrophobicContact CG2-CB 3.65Å; D50-A298 HydrophobicContact CB-CB 4.23Å; L53-A298 HydrophobicContact CD1-CB 3.73Å; L53-A298 HydrophobicContact CG-CB 4.49Å; E294-A298 WeakPolarHBondContact O-CB 3.41Å; E294-A298 PolarHBondContact O-N 2.78Å; V295-A298 PolarHBondContact O-N 3.28Å; A298-W300 PolarHBondContact O-N 3.21Å; A298-K301 PolarHBondContact O-N 1.98Å; A298-I302 WeakPolarHBondContact O-CG1 3.5Å; A298-I302 PolarHBondContact O-N 3.27Å
299L75Confident68.9Low75 Ų7599.7 Ų99.739%0.39347%0.469SS..Hα-helixtrans-57.8-48.7173.7178.665.3000111.6I46 V295 K296 K301 I302 L303I46-L299 HydrophobicContact CD1-CB 4.24Å; I46-L299 HydrophobicContact CD1-CD1 3.98Å; V295-L299 WeakPolarHBondContact O-CB 3.42Å; V295-L299 PolarHBondContact O-N 3.42Å; K296-L299 PolarHBondContact O-N 3.25Å; L299-K301 VanDerWaalsContact C-N 3.34Å; L299-K301 PolarHBondContact O-N 3.48Å; L299-I302 PolarHBondContact O-N 2.9Å; L299-L303 HydrophobicContact CD1-CD1 4.26Å; L299-L303 HydrophobicContact CD1-CG 4.33Å; L299-L303 HydrophobicContact CG-CD1 4Å; L299-L303 HydrophobicContact CG-CG 4.47Å; L299-L303 WeakPolarHBondContact O-CG 3.29Å; L299-L303 PolarHBondContact O-N 3.04Å
300W77.5Confident68.2Low160 Ų160112.1 Ų112.161%0.60651%0.513SS*.Hα-helixtrans-61-39.6177-89.4108.9000112.9K296 S297 A298 I302 L303 N304K296-W300 VanDerWaalsContact O-CD1 3.28Å; K296-W300 PolarHBondContact O-N 3.41Å; S297-W300 PolarHBondContact O-N 3.5Å; A298-W300 PolarHBondContact O-N 3.21Å; W300-I302 VanDerWaalsContact C-N 3.33Å; W300-I302 PolarHBondContact O-N 2.92Å; W300-L303 PolarHBondContact O-N 2.78Å; W300-N304 WeakPolarHBondContact O-CB 2.97Å; W300-N304 PolarHBondContact O-N 2.98Å; W300-N304 PolarHBondContact O-ND2 3.1Å; W300-N304 PolarHBondContact O-OD1 2.89Å
301K74.7Confident68.7Low95 Ų95112.7 Ų112.741%0.41351%0.512SS..Hα-helixtrans-61.3-41.3175-73.3177.3-171.6171.70112D50 S297 A298 L299 K305D50-K301 IonicContact OD2-NZ 3.04Å; D50-K301 PolarHBondContact OD2-NZ 2.9Å; S297-K301 WeakPolarHBondContact O-CG 3.49Å; S297-K301 PolarHBondContact O-N 3.38Å; A298-K301 PolarHBondContact O-N 1.98Å; L299-K301 VanDerWaalsContact C-N 3.34Å; L299-K301 PolarHBondContact O-N 3.48Å; K301-K305 WeakPolarHBondContact O-CG 3.43Å; K301-K305 PolarHBondContact O-N 3Å
302I73.7Confident69.2Low40 Ų40109.9 Ų109.921%0.20551%0.506CS..Hα-helixtrans-69.2-44.8178.8-67.7167000110.3I46 A298 L299 W300 N304 K305 L306I46-I302 HydrophobicContact CB-CD1 4.37Å; I46-I302 HydrophobicContact CG1-CD1 3.95Å; A298-I302 WeakPolarHBondContact O-CG1 3.5Å; A298-I302 PolarHBondContact O-N 3.27Å; L299-I302 PolarHBondContact O-N 2.9Å; W300-I302 VanDerWaalsContact C-N 3.33Å; W300-I302 PolarHBondContact O-N 2.92Å; I302-N304 VanDerWaalsContact C-N 3.34Å; I302-N304 PolarHBondContact O-N 3.08Å; I302-K305 WeakPolarHBondContact O-CB 3.41Å; I302-K305 PolarHBondContact O-N 3.46Å; I302-K305 VanDerWaalsContact O-N 3.09Å; I302-L306 HydrophobicContact CG2-CD1 3.77Å; I302-L306 HydrophobicContact CG2-CG 4.32Å; I302-L306 WeakPolarHBondContact O-CG 3.47Å; I302-L306 PolarHBondContact O-N 2.87Å
303L77.4Confident69.3Low79 Ų79114.2 Ų114.241%0.41453%0.525SS..Hα-helixtrans-59.7-43.1176.5-71.3173000111.9L299 W300 K305 L306 Y307L299-L303 HydrophobicContact CD1-CD1 4.26Å; L299-L303 HydrophobicContact CD1-CG 4.33Å; L299-L303 HydrophobicContact CG-CD1 4Å; L299-L303 HydrophobicContact CG-CG 4.47Å; L299-L303 WeakPolarHBondContact O-CG 3.29Å; L299-L303 PolarHBondContact O-N 3.04Å; W300-L303 PolarHBondContact O-N 2.78Å; L303-K305 VanDerWaalsContact C-N 3.26Å; L303-K305 PolarHBondContact O-N 3.19Å; L303-L306 PolarHBondContact O-N 3.09Å; L303-Y307 PolarHBondContact O-N 3.1Å
304N78Confident69.4Low89 Ų89110.3 Ų110.348%0.47651%0.509SS..Hα-helixtrans-66.9-25.4176.8-69.3-8.4000113.1W300 I302W300-N304 WeakPolarHBondContact O-CB 2.97Å; W300-N304 PolarHBondContact O-N 2.98Å; W300-N304 PolarHBondContact O-ND2 3.1Å; W300-N304 PolarHBondContact O-OD1 2.89Å; I302-N304 VanDerWaalsContact C-N 3.34Å; I302-N304 PolarHBondContact O-N 3.08Å
305K74.3Confident69.7Low177 Ų177110.2 Ų110.277%0.7751%0.508SS*.Hα-helixtrans-78.8-34.4172.6-77.9-178177.3-175.90112.5K301 I302 L303K301-K305 WeakPolarHBondContact O-CG 3.43Å; K301-K305 PolarHBondContact O-N 3Å; I302-K305 WeakPolarHBondContact O-CB 3.41Å; I302-K305 PolarHBondContact O-N 3.46Å; I302-K305 VanDerWaalsContact O-N 3.09Å; L303-K305 VanDerWaalsContact C-N 3.26Å; L303-K305 PolarHBondContact O-N 3.19Å
306L73.8Confident69.9Low126 Ų126117.3 Ų117.366%0.6654%0.541SS*.Hα-helixtrans-82.6-32.9-178.6-70.2173.5000113.1I302 L303I302-L306 HydrophobicContact CG2-CD1 3.77Å; I302-L306 HydrophobicContact CG2-CG 4.32Å; I302-L306 WeakPolarHBondContact O-CG 3.47Å; I302-L306 PolarHBondContact O-N 2.87Å; L303-L306 PolarHBondContact O-N 3.09Å
307Y64.3Low69.8Low200 Ų200118.8 Ų118.878%0.78455%0.55SS*.SBendtrans-121.483.3171.7-101.2-96.3000108.6L303 Q309L303-Y307 PolarHBondContact O-N 3.1Å; Y307-Q309 PolarHBondContact O-N 3.29Å; Y307-Q309 VanDerWaalsContact O-N 3.11Å
308P54.1Low69.4Low79 Ų79123.3 Ų123.351%0.51356%0.56SS.*  trans-60.2117.7170.2-14.327.6000107.9Y310P308-Y310 PolarHBondContact O-N 3.23Å
309Q57Low69.2Low191 Ų191133.5 Ų133.589%0.89361%0.606SS**  trans-67105165.9-72-172.8-23.500106.9Y307Y307-Q309 PolarHBondContact O-N 3.29Å; Y307-Q309 VanDerWaalsContact O-N 3.11Å
310Y50.5Low68.7Low291 Ų291138.8 Ų138.8100%1.14163%0.625SS**  trans-75.50164.7-86.9-83.8000110.1P308P308-Y310 PolarHBondContact O-N 3.23Å

Retrieved 310 of 310 residues in 717.4 ms (Link to these results)

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