A0A096MLB9_PAPAN Loading...

Olfactory receptor family 13 subfamily G member 1

AlphaFold DB , UniProt , Accession A0A096MLB9, Species PAPAN (Papio anubis, Olive baboon), Gene OR13G1, Length 307 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
1M36.2Very low58.6Low216 Ų21694.5 Ų94.5100%1.06451%0.51SS*.  0128.80-85.4168.1158.400107.5H3M1-H3 PolarHBondContact O-CD2 3.38Å; M1-H3 PolarHBondContact O-N 2.85Å; M1-H3 VanDerWaalsContact O-N 3.08Å
2N38.5Very low58.9Low169 Ų16990.4 Ų90.490%0.90449%0.487SS*.  trans-65.6104.2173.1-100.9-8.7000108.1S4N2-S4 VanDerWaalsContact C-N 3.31Å; N2-S4 PolarHBondContact O-N 3.18Å; N2-S4 VanDerWaalsContact O-N 3.08Å
3H47Very low59.1Low146 Ų14684.5 Ų84.568%0.67646%0.46SS*.  trans-79.482.6172.4-66.3-71.3000108.5M1 V5M1-H3 PolarHBondContact O-CD2 3.38Å; M1-H3 PolarHBondContact O-N 2.85Å; M1-H3 VanDerWaalsContact O-N 3.08Å; H3-V5 PolarHBondContact O-N 3.41Å; H3-V5 VanDerWaalsContact O-N 3.14Å
4S55.9Low59.2Low95 Ų9582.1 Ų82.166%0.66445%0.447SS*.  trans-67.8107.9164.653.10000107.8N2 V6N2-S4 VanDerWaalsContact C-N 3.31Å; N2-S4 PolarHBondContact O-N 3.18Å; N2-S4 VanDerWaalsContact O-N 3.08Å; S4-V6 PolarHBondContact O-N 2.94Å
5V62.1Low59.3Low123 Ų12379.1 Ų79.175%0.74543%0.432SS*.  trans-63.6121.9174.1178.90000108.1H3 T7H3-V5 PolarHBondContact O-N 3.41Å; H3-V5 VanDerWaalsContact O-N 3.14Å; V5-T7 PolarHBondContact O-N 3.43Å
6V63.9Low59.5Low13 Ų1385.1 Ų85.18%0.07945%0.453CS..  trans-69.9112.8177.9177.20000109.3S4 E8 F9 F165 N169S4-V6 PolarHBondContact O-N 2.94Å; V6-E8 WeakPolarHBondContact CG1-O 3.33Å; V6-F9 HydrophobicContact CG1-CD1 4.11Å; V6-F9 HydrophobicContact CG1-CE1 3.8Å; V6-F9 HydrophobicContact CG1-CZ 4.08Å; V6-F165 HydrophobicContact CB-CB 4.26Å; V6-F165 HydrophobicContact CG2-CB 3.95Å; V6-F165 WeakPolarHBondContact CG2-O 3.42Å; V6-N169 HydrophobicContact CG1-CB 4.38Å; V6-N169 WeakPolarHBondContact CG1-OD1 2.96Å; V6-N169 WeakPolarHBondContact CG2-OD1 3.35Å
7T66.6Low59.9Low100 Ų10088.7 Ų88.761%0.61346%0.463SS*.  trans-93.9-23.9179.151.40000112.7V5 Y91V5-T7 PolarHBondContact O-N 3.43Å; T7-Y91 PolarHBondContact O-N 3.42Å
8E71.4Confident60.3Low103 Ų10389.4 Ų89.448%0.48147%0.474SS..EExtended strand (participates in β ladder)trans-142.2144.8-174.2-61.4-175.517200111.3V6 I89 N169V6-E8 WeakPolarHBondContact CG1-O 3.33Å; E8-I89 WeakPolarHBondContact CA-O 3.42Å; E8-N169 WeakPolarHBondContact O-CB 3.5Å; E8-N169 PolarHBondContact O-ND2 3.24Å
9F70.8Confident60.9Low1 Ų194.2 Ų94.20%0.00449%0.493CS..EExtended strand (participates in β ladder)trans-114.2142.1172.3-62.2-78.2000110.3V6 T88 I89 Y91 C94 F165 N169 I171 L181V6-F9 HydrophobicContact CG1-CD1 4.11Å; V6-F9 HydrophobicContact CG1-CE1 3.8Å; V6-F9 HydrophobicContact CG1-CZ 4.08Å; F9-T88 CarbonylContact O-C 3.48Å; F9-T88 VanDerWaalsContact O-CA 3.23Å; F9-T88 WeakPolarHBondContact O-CA 3.44Å; F9-I89 HydrophobicContact CB-CG2 3.8Å; F9-I89 PolarHBondContact N-O 2.89Å; F9-I89 PolarHBondContact O-N 2.66Å; F9-Y91 AromaticContact CE2-CD2 3.65Å; F9-Y91 HydrophobicContact CE2-CD2 3.65Å; F9-Y91 HydrophobicContact CE2-CE2 4.43Å; F9-Y91 HydrophobicContact CE2-CG 4.44Å; F9-Y91 HydrophobicContact CZ-CD2 4.03Å; F9-C94 HydrophobicContact CD2-CB 4.04Å; F9-C94 HydrophobicContact CE2-CB 4.27Å; F9-F165 HydrophobicContact CE1-CD1 4.41Å; F9-F165 HydrophobicContact CE1-CG 4.35Å; F9-F165 HydrophobicContact CZ-CD1 4.4Å; F9-F165 HydrophobicContact CZ-CD2 4.19Å; F9-F165 HydrophobicContact CZ-CE2 4.48Å; F9-F165 HydrophobicContact CZ-CG 4.16Å; F9-N169 CarbonylContact C-O 3.51Å; F9-N169 WeakPolarHBondContact CA-O 3.24Å; F9-I171 HydrophobicContact CB-CD1 3.63Å; F9-I171 HydrophobicContact CB-CG1 4.13Å; F9-I171 HydrophobicContact CD1-CD1 4Å; F9-I171 HydrophobicContact CD1-CG1 4.19Å; F9-I171 HydrophobicContact CD2-CD1 4.4Å; F9-I171 HydrophobicContact CG-CD1 3.78Å; F9-I171 HydrophobicContact CG-CG1 4.37Å; F9-L181 HydrophobicContact CE1-CD2 4.33Å; F9-L181 HydrophobicContact CE2-CD2 4.36Å; F9-L181 HydrophobicContact CZ-CD2 3.99Å
10I65.9Low61.4Low71 Ų7193.2 Ų93.236%0.36449%0.488SS..EExtended strand (participates in β ladder)trans-99.3114.9176.4-56.6170.4000108.1N87 T88 N169 T170 I171I10-N87 CarbonylContact C-O 3.5Å; I10-N87 WeakPolarHBondContact CA-O 3.45Å; I10-N87 HydrophobicContact CG2-CB 4.01Å; I10-T88 HydrophobicContact CG1-CG2 4.05Å; I10-N169 PolarHBondContact N-O 3.07Å; I10-T170 HydrophobicContact CB-CG2 4.19Å; I10-T170 HydrophobicContact CD1-CG2 4.34Å; I10-T170 CarbonylContact O-C 3.5Å; I10-T170 WeakPolarHBondContact O-CA 3.33Å; I10-I171 PolarHBondContact O-N 3.27Å
11I66.4Low61.9Low2 Ų291.8 Ų91.81%0.0148%0.479CS..EExtended strand (participates in β ladder)trans-87.1114177.9-60.1-179.6000108.2G13 N87 I89 H173I11-G13 PolarHBondContact O-N 3.45Å; I11-N87 PolarHBondContact N-O 3.22Å; I11-N87 WeakPolarHBondContact O-CB 2.8Å; I11-I89 HydrophobicContact CD1-CB 3.93Å; I11-I89 HydrophobicContact CD1-CD1 4.33Å; I11-I89 HydrophobicContact CD1-CG2 3.75Å; I11-I89 HydrophobicContact CG1-CB 4.47Å; I11-I89 HydrophobicContact CG1-CG2 3.92Å; I11-H173 WeakPolarHBondContact CG2-O 3.34Å
12L62.3Low63.7Low46 Ų4683.8 Ų83.824%0.24145%0.452CS..  trans-70.2-15.2-177.5-100.290000114.4K16 T170 I171L12-K16 VanDerWaalsContact CD2-CE 3.42Å; L12-T170 HydrophobicContact CD1-CG2 4.06Å; L12-I171 PolarHBondContact N-O 3.36Å
13G62Low65.6Low13 Ų1380.9 Ų80.913%0.13444%0.436CS..  trans72.5-173.2179.300000113.9I11I11-G13 PolarHBondContact O-N 3.45Å
14L59.8Low66.8Low52 Ų5275.3 Ų75.327%0.27241%0.41SS..SBendtrans-84.8-25.8-175-79.1110000114.8I24 F28 M78 F174L14-I24 HydrophobicContact CB-CD1 4.18Å; L14-I24 HydrophobicContact CB-CG2 4.33Å; L14-I24 HydrophobicContact CD1-CG2 4.33Å; L14-F28 HydrophobicContact CD1-CD2 4.41Å; L14-F28 HydrophobicContact CD1-CE2 3.6Å; L14-F28 HydrophobicContact CD1-CZ 4.19Å; L14-F28 HydrophobicContact CD2-CE2 3.89Å; L14-F28 HydrophobicContact CD2-CZ 3.98Å; L14-F28 HydrophobicContact CG-CE2 4.36Å; L14-M78 HydrophobicContact CD1-CG 4.39Å; L14-M78 HydrophobicContact CD1-SD 3.86Å; L14-F174 HydrophobicContact CD1-CB 3.43Å; L14-F174 VanDerWaalsContact CD1-CB 3.43Å; L14-F174 HydrophobicContact CD1-CD1 4.35Å; L14-F174 HydrophobicContact CD1-CD2 4.41Å; L14-F174 HydrophobicContact CD1-CG 3.85Å; L14-F174 HydrophobicContact CD2-CD1 4.48Å; L14-F174 HydrophobicContact CG-CB 3.92Å; L14-F174 HydrophobicContact CG-CD1 4.22Å; L14-F174 HydrophobicContact CG-CG 4.2Å
15T60.7Low68Low37 Ų3773 Ų7323%0.22739%0.389CS..  trans-152.4145.2179.1-167.60000111.8K17 L20 Q21 I24T15-K17 PolarHBondContact OG1-N 3.24Å; T15-L20 HydrophobicContact CG2-CB 4.11Å; T15-L20 HydrophobicContact CG2-CD2 4.47Å; T15-L20 HydrophobicContact CG2-CG 4.44Å; T15-Q21 HydrophobicContact CG2-CB 4.36Å; T15-I24 HydrophobicContact CG2-CD1 3.61Å
16K62.7Low68.9Low175 Ų17571.8 Ų71.876%0.76138%0.377SS*.SBendtrans-93.3-2.1170.7-63-178.3-178.1175.90112.7L12 P18L12-K16 VanDerWaalsContact CD2-CE 3.42Å; K16-P18 WeakPolarHBondContact O-CD 3.23Å
17K66.3Low69.7Low146 Ų14676.9 Ų76.964%0.63540%0.399SS*.  trans-88.9114.9-178.7-66.2-175.8-179.5-179.60110T15 E19 L20 Q21T15-K17 PolarHBondContact OG1-N 3.24Å; K17-E19 PolarHBondContact O-N 3.19Å; K17-L20 HydrophobicContact CB-CB 4.35Å; K17-L20 PolarHBondContact O-N 3.26Å; K17-L20 VanDerWaalsContact O-N 3.09Å; K17-Q21 PolarHBondContact O-N 3.4Å
18P67.3Low70.2Confident102 Ų10272.5 Ų72.566%0.66237%0.371SS*.Hα-helixtrans-61.7-30.9-175.722.6-32.2000112.9K16 L20 Q21K16-P18 WeakPolarHBondContact O-CD 3.23Å; P18-L20 VanDerWaalsContact C-N 3.31Å; P18-L20 PolarHBondContact O-N 3.32Å; P18-Q21 WeakPolarHBondContact O-CB 3.23Å; P18-Q21 PolarHBondContact O-N 3.38Å
19E70.9Confident70.8Confident179 Ų17970 Ų7084%0.83636%0.361SS*.Hα-helixtrans-65.7-30.7177.7-62.2176-178.800113.4K17K17-E19 PolarHBondContact O-N 3.19Å
20L71Confident71.4Confident75 Ų7574.2 Ų74.239%0.39338%0.382SS..Hα-helixtrans-93-19.2-178.3-167.766.1000112.1T15 K17 P18 G22 I23 I24T15-L20 HydrophobicContact CG2-CB 4.11Å; T15-L20 HydrophobicContact CG2-CD2 4.47Å; T15-L20 HydrophobicContact CG2-CG 4.44Å; K17-L20 HydrophobicContact CB-CB 4.35Å; K17-L20 PolarHBondContact O-N 3.26Å; K17-L20 VanDerWaalsContact O-N 3.09Å; P18-L20 VanDerWaalsContact C-N 3.31Å; P18-L20 PolarHBondContact O-N 3.32Å; L20-G22 PolarHBondContact O-N 3.1Å; L20-I23 HydrophobicContact CD1-CB 4.48Å; L20-I23 HydrophobicContact CD1-CD1 4.35Å; L20-I23 PolarHBondContact O-N 3.5Å; L20-I24 HydrophobicContact CD2-CD1 4.03Å; L20-I24 HydrophobicContact CG-CD1 3.86Å; L20-I24 HydrophobicContact CG-CG1 4.16Å; L20-I24 WeakPolarHBondContact O-CG1 3.46Å; L20-I24 PolarHBondContact O-N 3.48Å
21Q72.2Confident72.1Confident63 Ų6372 Ų7229%0.29437%0.371SS..Hα-helixtrans-60.8-43.1-177.5-167.2170.4-15.200112.2T15 K17 P18 I24 F25 T82T15-Q21 HydrophobicContact CG2-CB 4.36Å; K17-Q21 PolarHBondContact O-N 3.4Å; P18-Q21 WeakPolarHBondContact O-CB 3.23Å; P18-Q21 PolarHBondContact O-N 3.38Å; Q21-I24 PolarHBondContact O-N 3.12Å; Q21-F25 WeakPolarHBondContact O-CB 3.43Å; Q21-F25 PolarHBondContact O-N 3.07Å; Q21-T82 HydrophobicContact CG-CG2 3.51Å; Q21-T82 PolarHBondContact NE2-O 3.44Å
22G74.9Confident72.9Confident48 Ų4874 Ų7450%0.49538%0.379SS..Hα-helixtrans-65.6-37.8176.600000113.7L20 L26L20-G22 PolarHBondContact O-N 3.1Å; G22-L26 WeakPolarHBondContact O-CB 3.23Å; G22-L26 PolarHBondContact O-N 3.49Å
23I76.9Confident74.1Confident109 Ų10975.6 Ų75.656%0.55939%0.387SS*.Hα-helixtrans-67.6-45.3177.5-62.4174.7000110.2L20 L26 F27L20-I23 HydrophobicContact CD1-CB 4.48Å; L20-I23 HydrophobicContact CD1-CD1 4.35Å; L20-I23 PolarHBondContact O-N 3.5Å; I23-L26 PolarHBondContact O-N 2.85Å; I23-F27 WeakPolarHBondContact O-CB 3.48Å; I23-F27 PolarHBondContact O-N 3.03Å
24I73.6Confident75.1Confident28 Ų2877.5 Ų77.514%0.14440%0.396CS..Hα-helixtrans-63.1-43.8177.9-71.7175.5000110.9L14 T15 L20 Q21 F27 F28L14-I24 HydrophobicContact CB-CD1 4.18Å; L14-I24 HydrophobicContact CB-CG2 4.33Å; L14-I24 HydrophobicContact CD1-CG2 4.33Å; T15-I24 HydrophobicContact CG2-CD1 3.61Å; L20-I24 HydrophobicContact CD2-CD1 4.03Å; L20-I24 HydrophobicContact CG-CD1 3.86Å; L20-I24 HydrophobicContact CG-CG1 4.16Å; L20-I24 WeakPolarHBondContact O-CG1 3.46Å; L20-I24 PolarHBondContact O-N 3.48Å; Q21-I24 PolarHBondContact O-N 3.12Å; I24-F27 PolarHBondContact O-N 3.31Å; I24-F28 HydrophobicContact CG2-CD2 3.57Å; I24-F28 HydrophobicContact CG2-CE2 3.56Å; I24-F28 VanDerWaalsContact O-CD2 3.26Å; I24-F28 WeakPolarHBondContact O-CD2 3.27Å; I24-F28 PolarHBondContact O-N 3.38Å
25F79.7Confident76.2Confident48 Ų4875 Ų7521%0.21138%0.383CS..Hα-helixtrans-56.3-52.7175175-94.3000111.4Q21 F27 F28 L29 L79 T82 L83Q21-F25 WeakPolarHBondContact O-CB 3.43Å; Q21-F25 PolarHBondContact O-N 3.07Å; F25-F27 VanDerWaalsContact C-N 3.32Å; F25-F27 PolarHBondContact O-N 3.12Å; F25-F28 PolarHBondContact O-N 3.32Å; F25-L29 HydrophobicContact CE1-CD2 3.9Å; F25-L29 HydrophobicContact CZ-CD2 4.2Å; F25-L29 VanDerWaalsContact O-CB 3.26Å; F25-L29 WeakPolarHBondContact O-CB 3.48Å; F25-L29 PolarHBondContact O-N 3.47Å; F25-L79 HydrophobicContact CD2-CB 4.23Å; F25-L79 HydrophobicContact CD2-CD2 3.5Å; F25-L79 HydrophobicContact CD2-CG 4.44Å; F25-L79 HydrophobicContact CE2-CB 3.85Å; F25-L79 HydrophobicContact CE2-CD2 3.68Å; F25-L79 HydrophobicContact CE2-CG 4.25Å; F25-L79 HydrophobicContact CG-CD2 4.21Å; F25-L79 WeakPolarHBondContact O-CD2 3.47Å; F25-T82 HydrophobicContact CB-CG2 3.9Å; F25-T82 HydrophobicContact CD2-CG2 4.48Å; F25-L83 HydrophobicContact CD2-CD1 3.95Å; F25-L83 HydrophobicContact CD2-CG 3.91Å; F25-L83 HydrophobicContact CE2-CD1 3.13Å; F25-L83 HydrophobicContact CE2-CD2 4.37Å; F25-L83 HydrophobicContact CE2-CG 3.61Å; F25-L83 HydrophobicContact CZ-CD1 3.52Å; F25-L83 HydrophobicContact CZ-CD2 4.45Å; F25-L83 HydrophobicContact CZ-CG 4.13Å
26L81.8Confident77.5Confident97 Ų9776 Ų7651%0.50838%0.384SS..Hα-helixtrans-61.7-42.1-179.2-177.563000111.6G22 I23 L29 I30G22-L26 WeakPolarHBondContact O-CB 3.23Å; G22-L26 PolarHBondContact O-N 3.49Å; I23-L26 PolarHBondContact O-N 2.85Å; L26-L29 PolarHBondContact O-N 3.41Å; L26-I30 HydrophobicContact CD1-CD1 4.09Å; L26-I30 HydrophobicContact CD1-CG1 4.35Å; L26-I30 HydrophobicContact CG-CD1 3.93Å; L26-I30 VanDerWaalsContact O-CG1 3.26Å; L26-I30 WeakPolarHBondContact O-CG1 3.23Å; L26-I30 PolarHBondContact O-N 2.87Å
27F80.6Confident78.7Confident120 Ų12073.1 Ų73.153%0.52638%0.377SS..Hα-helixtrans-59.2-51.7178.2176.9-103.3000112.2I23 I24 F25 I30 I31I23-F27 WeakPolarHBondContact O-CB 3.48Å; I23-F27 PolarHBondContact O-N 3.03Å; I24-F27 PolarHBondContact O-N 3.31Å; F25-F27 VanDerWaalsContact C-N 3.32Å; F25-F27 PolarHBondContact O-N 3.12Å; F27-I30 PolarHBondContact O-N 3.4Å; F27-I31 HydrophobicContact CD1-CD1 3.84Å; F27-I31 HydrophobicContact CD2-CD1 4.45Å; F27-I31 HydrophobicContact CE1-CD1 3.33Å; F27-I31 HydrophobicContact CE2-CD1 4.01Å; F27-I31 HydrophobicContact CG-CD1 4.38Å; F27-I31 HydrophobicContact CZ-CD1 3.44Å; F27-I31 VanDerWaalsContact CZ-CD1 3.44Å; F27-I31 WeakPolarHBondContact O-CG1 3.48Å; F27-I31 PolarHBondContact O-N 2.96Å
28F77.6Confident79.5Confident8 Ų867.1 Ų67.14%0.03535%0.353CS..Hα-helixtrans-70.5-31.4179.6-74.6-59.9000113.3L14 I24 F25 I31 Y32 M78 L79 L277L14-F28 HydrophobicContact CD1-CD2 4.41Å; L14-F28 HydrophobicContact CD1-CE2 3.6Å; L14-F28 HydrophobicContact CD1-CZ 4.19Å; L14-F28 HydrophobicContact CD2-CE2 3.89Å; L14-F28 HydrophobicContact CD2-CZ 3.98Å; L14-F28 HydrophobicContact CG-CE2 4.36Å; I24-F28 HydrophobicContact CG2-CD2 3.57Å; I24-F28 HydrophobicContact CG2-CE2 3.56Å; I24-F28 VanDerWaalsContact O-CD2 3.26Å; I24-F28 WeakPolarHBondContact O-CD2 3.27Å; I24-F28 PolarHBondContact O-N 3.38Å; F25-F28 PolarHBondContact O-N 3.32Å; F28-I31 HydrophobicContact CD1-CD1 4.36Å; F28-I31 PolarHBondContact O-N 3.27Å; F28-Y32 WeakPolarHBondContact O-CB 3.24Å; F28-Y32 PolarHBondContact O-N 2.89Å; F28-M78 HydrophobicContact CB-CE 3.43Å; F28-M78 VanDerWaalsContact CB-CE 3.43Å; F28-M78 HydrophobicContact CD1-CE 3.69Å; F28-M78 HydrophobicContact CD2-CE 3.44Å; F28-M78 VanDerWaalsContact CD2-CE 3.44Å; F28-M78 HydrophobicContact CD2-SD 4.28Å; F28-M78 HydrophobicContact CE1-CE 4.3Å; F28-M78 HydrophobicContact CE2-CE 4.05Å; F28-M78 HydrophobicContact CE2-SD 4.34Å; F28-M78 HydrophobicContact CG-CE 3.23Å; F28-M78 HydrophobicContact CG-SD 4.46Å; F28-M78 HydrophobicContact CZ-CE 4.44Å; F28-L79 HydrophobicContact CB-CD2 3.9Å; F28-L277 HydrophobicContact CD1-CD1 3.75Å; F28-L277 HydrophobicContact CE1-CD1 3.27Å; F28-L277 HydrophobicContact CZ-CD1 4.23Å
29L83.6Confident80.5Confident51 Ų5162.4 Ų62.427%0.26732%0.322SS..Hα-helixtrans-62.7-45.8172.8179.866.5000111.2F25 L26 Y32 L33 L79F25-L29 HydrophobicContact CE1-CD2 3.9Å; F25-L29 HydrophobicContact CZ-CD2 4.2Å; F25-L29 VanDerWaalsContact O-CB 3.26Å; F25-L29 WeakPolarHBondContact O-CB 3.48Å; F25-L29 PolarHBondContact O-N 3.47Å; L26-L29 PolarHBondContact O-N 3.41Å; L29-Y32 PolarHBondContact O-N 3.33Å; L29-L33 HydrophobicContact CD1-CD1 4.35Å; L29-L33 HydrophobicContact CD1-CG 4.41Å; L29-L33 HydrophobicContact CG-CD1 4.17Å; L29-L33 WeakPolarHBondContact O-CG 3.44Å; L29-L33 PolarHBondContact O-N 2.96Å; L29-L79 HydrophobicContact CB-CD1 4.24Å; L29-L79 HydrophobicContact CB-CD2 4.3Å; L29-L79 HydrophobicContact CD1-CD1 3.96Å
30I83.4Confident81.4Confident89 Ų8957 Ų5746%0.45630%0.298SS..Hα-helixtrans-61.3-46.6176.7-70167000110.3L26 F27 Y32 L33 V34L26-I30 HydrophobicContact CD1-CD1 4.09Å; L26-I30 HydrophobicContact CD1-CG1 4.35Å; L26-I30 HydrophobicContact CG-CD1 3.93Å; L26-I30 VanDerWaalsContact O-CG1 3.26Å; L26-I30 WeakPolarHBondContact O-CG1 3.23Å; L26-I30 PolarHBondContact O-N 2.87Å; F27-I30 PolarHBondContact O-N 3.4Å; I30-Y32 VanDerWaalsContact C-N 3.33Å; I30-Y32 PolarHBondContact O-N 3.07Å; I30-L33 PolarHBondContact O-N 3.35Å; I30-V34 HydrophobicContact CG2-CG2 4.28Å; I30-V34 WeakPolarHBondContact O-CB 3.19Å; I30-V34 VanDerWaalsContact O-CG2 3.26Å; I30-V34 WeakPolarHBondContact O-CG2 3.33Å; I30-V34 PolarHBondContact O-N 2.84Å
31I80.7Confident82.1Confident25 Ų2555.4 Ų55.413%0.12829%0.29CS..Hα-helixtrans-56.7-47.9176.9-72.9173.9000110.9F27 F28 V34 A35 L277 T281F27-I31 HydrophobicContact CD1-CD1 3.84Å; F27-I31 HydrophobicContact CD2-CD1 4.45Å; F27-I31 HydrophobicContact CE1-CD1 3.33Å; F27-I31 HydrophobicContact CE2-CD1 4.01Å; F27-I31 HydrophobicContact CG-CD1 4.38Å; F27-I31 HydrophobicContact CZ-CD1 3.44Å; F27-I31 VanDerWaalsContact CZ-CD1 3.44Å; F27-I31 WeakPolarHBondContact O-CG1 3.48Å; F27-I31 PolarHBondContact O-N 2.96Å; F28-I31 HydrophobicContact CD1-CD1 4.36Å; F28-I31 PolarHBondContact O-N 3.27Å; I31-V34 PolarHBondContact O-N 3.39Å; I31-A35 WeakPolarHBondContact O-CB 3.27Å; I31-A35 PolarHBondContact O-N 3.46Å; I31-L277 HydrophobicContact CG2-CB 4.37Å; I31-T281 HydrophobicContact CG2-CG2 3.86Å; I31-T281 WeakPolarHBondContact O-CG2 3.39Å
32Y83.9Confident82.8Confident42 Ų4252.6 Ų52.617%0.16528%0.277CS..Hα-helixtrans-60-49.6178.6170.2-108.6000112.4F28 L29 I30 V34 A35 F36 I75 P76F28-Y32 WeakPolarHBondContact O-CB 3.24Å; F28-Y32 PolarHBondContact O-N 2.89Å; L29-Y32 PolarHBondContact O-N 3.33Å; I30-Y32 VanDerWaalsContact C-N 3.33Å; I30-Y32 PolarHBondContact O-N 3.07Å; Y32-V34 VanDerWaalsContact C-N 3.31Å; Y32-V34 PolarHBondContact O-N 3.41Å; Y32-A35 PolarHBondContact O-N 2.94Å; Y32-F36 HydrophobicContact CE2-CB 4.5Å; Y32-F36 VanDerWaalsContact O-CB 3.25Å; Y32-F36 WeakPolarHBondContact O-CB 3.37Å; Y32-F36 PolarHBondContact O-N 3.01Å; Y32-I75 HydrophobicContact CD2-CB 4.14Å; Y32-I75 HydrophobicContact CD2-CD1 4.09Å; Y32-I75 HydrophobicContact CD2-CG2 4.39Å; Y32-I75 HydrophobicContact CG-CB 4.43Å; Y32-I75 HydrophobicContact CG-CD1 4.49Å; Y32-I75 HydrophobicContact CG-CG2 4.18Å; Y32-P76 HydrophobicContact CE2-CG 4.34Å
33L86.1Confident83.5Confident80 Ų8051.5 Ų51.542%0.41926%0.259SS..Hα-helixtrans-61.2-43.1-179.8-70.5173.5000111.2L29 I30 L37L29-L33 HydrophobicContact CD1-CD1 4.35Å; L29-L33 HydrophobicContact CD1-CG 4.41Å; L29-L33 HydrophobicContact CG-CD1 4.17Å; L29-L33 WeakPolarHBondContact O-CG 3.44Å; L29-L33 PolarHBondContact O-N 2.96Å; I30-L33 PolarHBondContact O-N 3.35Å; L33-L37 WeakPolarHBondContact O-CB 3.46Å; L33-L37 WeakPolarHBondContact O-CD1 3.41Å; L33-L37 WeakPolarHBondContact O-CG 3.43Å; L33-L37 PolarHBondContact O-N 3.16Å
34V84.2Confident84Confident54 Ų5450 Ų5033%0.32725%0.252SS..Hα-helixtrans-63.9-45.7176.7171.30000111.1I30 I31 Y32 S38 M285I30-V34 HydrophobicContact CG2-CG2 4.28Å; I30-V34 WeakPolarHBondContact O-CB 3.19Å; I30-V34 VanDerWaalsContact O-CG2 3.26Å; I30-V34 WeakPolarHBondContact O-CG2 3.33Å; I30-V34 PolarHBondContact O-N 2.84Å; I31-V34 PolarHBondContact O-N 3.39Å; Y32-V34 VanDerWaalsContact C-N 3.31Å; Y32-V34 PolarHBondContact O-N 3.41Å; V34-S38 WeakPolarHBondContact O-CB 3.43Å; V34-S38 PolarHBondContact O-N 2.96Å; V34-S38 PolarHBondContact O-OG 3.47Å; V34-M285 HydrophobicContact CG1-CE 3.33Å
35A83.3Confident84.6Confident0 Ų048.7 Ų48.70%025%0.245CC..Hα-helixtrans-60-50.3177.700000111.2I31 Y32 S38 N39 T71 T281I31-A35 WeakPolarHBondContact O-CB 3.27Å; I31-A35 PolarHBondContact O-N 3.46Å; Y32-A35 PolarHBondContact O-N 2.94Å; A35-S38 PolarHBondContact O-OG 3.02Å; A35-S38 VanDerWaalsContact O-OG 3.09Å; A35-N39 WeakPolarHBondContact O-CB 3.26Å; A35-N39 PolarHBondContact O-N 3.47Å; A35-N39 PolarHBondContact O-ND2 3.31Å; A35-T71 HydrophobicContact CB-CG2 4.05Å; A35-T281 HydrophobicContact CB-CG2 3.47Å; A35-T281 VanDerWaalsContact CB-CG2 3.47Å
36F87Confident84.9Confident57 Ų5746.5 Ų46.525%0.2524%0.235CC..Hα-helixtrans-63.3-51-177.1-176.9-93.1000111.3Y32 S38 N39 M40 I68Y32-F36 HydrophobicContact CE2-CB 4.5Å; Y32-F36 VanDerWaalsContact O-CB 3.25Å; Y32-F36 WeakPolarHBondContact O-CB 3.37Å; Y32-F36 PolarHBondContact O-N 3.01Å; F36-S38 PolarHBondContact O-N 3.34Å; F36-N39 PolarHBondContact O-N 3.47Å; F36-M40 HydrophobicContact CD1-CG 4.16Å; F36-M40 HydrophobicContact CE1-CE 4.03Å; F36-M40 HydrophobicContact CE1-CG 3.87Å; F36-M40 HydrophobicContact CE2-CE 3.76Å; F36-M40 HydrophobicContact CE2-CG 4.48Å; F36-M40 HydrophobicContact CZ-CE 3.33Å; F36-M40 HydrophobicContact CZ-CG 4.06Å; F36-M40 VanDerWaalsContact O-CB 3.29Å; F36-M40 WeakPolarHBondContact O-CB 3.3Å; F36-M40 VanDerWaalsContact O-CG 3.23Å; F36-M40 WeakPolarHBondContact O-CG 3.36Å; F36-M40 PolarHBondContact O-N 2.79Å; F36-I68 HydrophobicContact CD2-CG1 4.49Å; F36-I68 HydrophobicContact CD2-CG2 4.06Å; F36-I68 HydrophobicContact CE2-CG2 3.97Å
37L87.2Confident85.2Confident114 Ų11447 Ų4760%0.59724%0.237SC*.Hα-helixtrans-65-40.8-178.6-69.3171000112.1L33 L41L33-L37 WeakPolarHBondContact O-CB 3.46Å; L33-L37 WeakPolarHBondContact O-CD1 3.41Å; L33-L37 WeakPolarHBondContact O-CG 3.43Å; L33-L37 PolarHBondContact O-N 3.16Å; L37-L41 WeakPolarHBondContact O-CB 3.47Å; L37-L41 PolarHBondContact O-N 3.5Å
38S84.3Confident85.3Confident21 Ų2145.2 Ų45.215%0.14724%0.239CC..Hα-helixtrans-68.8-41.1-179.862.20000112.6V34 A35 F36 L41 I42 P284V34-S38 WeakPolarHBondContact O-CB 3.43Å; V34-S38 PolarHBondContact O-N 2.96Å; V34-S38 PolarHBondContact O-OG 3.47Å; A35-S38 PolarHBondContact O-OG 3.02Å; A35-S38 VanDerWaalsContact O-OG 3.09Å; F36-S38 PolarHBondContact O-N 3.34Å; S38-L41 PolarHBondContact O-N 2.88Å; S38-I42 PolarHBondContact O-N 3.44Å; S38-P284 WeakPolarHBondContact OG-CB 3.42Å
39N88.4Confident85.6Confident2 Ų245.5 Ų45.51%0.01124%0.242CC..Hα-helixtrans-68.1-40.6174.3-78.5-64.8000112.3A35 F36 L41 I42 I43 A64 I68 P280 P284A35-N39 WeakPolarHBondContact O-CB 3.26Å; A35-N39 PolarHBondContact O-N 3.47Å; A35-N39 PolarHBondContact O-ND2 3.31Å; F36-N39 PolarHBondContact O-N 3.47Å; N39-L41 VanDerWaalsContact C-N 3.3Å; N39-L41 PolarHBondContact O-N 2.86Å; N39-I42 WeakPolarHBondContact O-CB 3.38Å; N39-I42 PolarHBondContact O-N 3.24Å; N39-I43 WeakPolarHBondContact O-CG1 3.38Å; N39-I43 PolarHBondContact O-N 2.97Å; N39-A64 HydrophobicContact CB-CB 4.12Å; N39-A64 WeakPolarHBondContact OD1-CA 3.37Å; N39-A64 WeakPolarHBondContact OD1-CB 3.26Å; N39-I68 HydrophobicContact CB-CD1 3.79Å; N39-I68 HydrophobicContact CB-CG1 3.61Å; N39-P280 PolarHBondContact ND2-O 2.9Å; N39-P280 VanDerWaalsContact ND2-O 3.14Å; N39-P284 WeakPolarHBondContact ND2-CG 3.36Å; N39-P284 VanDerWaalsContact OD1-CG 3.22Å; N39-P284 WeakPolarHBondContact OD1-CG 3.48Å
40M88.4Confident85.4Confident67 Ų6749.2 Ų49.233%0.3326%0.262SS..Hα-helixtrans-60.4-41173.7-78.8-64-161.500111.9F36 I42 I43 I44 I68F36-M40 HydrophobicContact CD1-CG 4.16Å; F36-M40 HydrophobicContact CE1-CE 4.03Å; F36-M40 HydrophobicContact CE1-CG 3.87Å; F36-M40 HydrophobicContact CE2-CE 3.76Å; F36-M40 HydrophobicContact CE2-CG 4.48Å; F36-M40 HydrophobicContact CZ-CE 3.33Å; F36-M40 HydrophobicContact CZ-CG 4.06Å; F36-M40 VanDerWaalsContact O-CB 3.29Å; F36-M40 WeakPolarHBondContact O-CB 3.3Å; F36-M40 VanDerWaalsContact O-CG 3.23Å; F36-M40 WeakPolarHBondContact O-CG 3.36Å; F36-M40 PolarHBondContact O-N 2.79Å; M40-I42 VanDerWaalsContact C-N 3.31Å; M40-I42 PolarHBondContact O-N 3.43Å; M40-I43 PolarHBondContact O-N 3.39Å; M40-I43 HydrophobicContact SD-CD1 4.37Å; M40-I44 VanDerWaalsContact O-CG1 3.27Å; M40-I44 WeakPolarHBondContact O-CG1 3.38Å; M40-I44 PolarHBondContact O-N 3.42Å; M40-I68 HydrophobicContact CE-CD1 4.21Å; M40-I68 HydrophobicContact CG-CD1 3.9Å; M40-I68 HydrophobicContact SD-CD1 3.82Å
41L87.1Confident85.1Confident41 Ų4149.6 Ų49.622%0.21527%0.268CS..Hα-helixtrans-61.4-40.3176.5-177.963.3000111.8L37 S38 N39 I44 A45 I298 V301 F302L37-L41 WeakPolarHBondContact O-CB 3.47Å; L37-L41 PolarHBondContact O-N 3.5Å; S38-L41 PolarHBondContact O-N 2.88Å; N39-L41 VanDerWaalsContact C-N 3.3Å; N39-L41 PolarHBondContact O-N 2.86Å; L41-I44 PolarHBondContact O-N 3.14Å; L41-A45 WeakPolarHBondContact O-CB 3.29Å; L41-A45 PolarHBondContact O-N 2.96Å; L41-I298 HydrophobicContact CD1-CG2 4.33Å; L41-I298 HydrophobicContact CD2-CD1 4.05Å; L41-I298 HydrophobicContact CD2-CG1 4.21Å; L41-I298 HydrophobicContact CD2-CG2 3.93Å; L41-I298 HydrophobicContact CG-CD1 4.3Å; L41-I298 HydrophobicContact CG-CG1 4.09Å; L41-I298 HydrophobicContact CG-CG2 4.38Å; L41-V301 HydrophobicContact CD1-CG1 4.34Å; L41-F302 HydrophobicContact CD1-CE2 4.34Å; L41-F302 HydrophobicContact CD1-CZ 4.42Å; L41-F302 HydrophobicContact CD2-CE2 4.25Å; L41-F302 HydrophobicContact CD2-CZ 4.38Å
42I86.9Confident85.1Confident4 Ų448.5 Ų48.52%0.02126%0.262CS..Hα-helixtrans-62.3-47.1174.8-71.6178.6000110.8S38 N39 M40 I44 A45 I46 A64 P284 M294S38-I42 PolarHBondContact O-N 3.44Å; N39-I42 WeakPolarHBondContact O-CB 3.38Å; N39-I42 PolarHBondContact O-N 3.24Å; M40-I42 VanDerWaalsContact C-N 3.31Å; M40-I42 PolarHBondContact O-N 3.43Å; I42-I44 PolarHBondContact O-N 3.33Å; I42-A45 PolarHBondContact O-N 2.95Å; I42-I46 HydrophobicContact CG2-CD1 3.6Å; I42-I46 HydrophobicContact CG2-CG1 4.44Å; I42-I46 VanDerWaalsContact O-CG1 3.3Å; I42-I46 WeakPolarHBondContact O-CG1 3.45Å; I42-I46 PolarHBondContact O-N 2.86Å; I42-A64 HydrophobicContact CB-CB 4.41Å; I42-A64 HydrophobicContact CG2-CB 4.13Å; I42-P284 VanDerWaalsContact CD1-CA 3.48Å; I42-P284 HydrophobicContact CD1-CB 3.51Å; I42-P284 HydrophobicContact CD1-CG 4.3Å; I42-M294 HydrophobicContact CG2-CE 4.1Å
43I89.3Confident85Confident25 Ų2551.2 Ų51.213%0.12828%0.276CS..Hα-helixtrans-57.4-51.5178.2-68.9167.1000110.2N39 M40 A45 I46 I47 L61 A64 V65 I68N39-I43 WeakPolarHBondContact O-CG1 3.38Å; N39-I43 PolarHBondContact O-N 2.97Å; M40-I43 PolarHBondContact O-N 3.39Å; M40-I43 HydrophobicContact SD-CD1 4.37Å; I43-A45 VanDerWaalsContact C-N 3.35Å; I43-A45 PolarHBondContact O-N 3.48Å; I43-I46 PolarHBondContact O-N 3.44Å; I43-I47 HydrophobicContact CG2-CD1 3.59Å; I43-I47 HydrophobicContact CG2-CG1 4.47Å; I43-I47 WeakPolarHBondContact O-CB 3.24Å; I43-I47 VanDerWaalsContact O-CG1 3.29Å; I43-I47 WeakPolarHBondContact O-CG1 3.35Å; I43-I47 PolarHBondContact O-N 2.65Å; I43-L61 HydrophobicContact CB-CD1 4.04Å; I43-L61 HydrophobicContact CG1-CD1 3.87Å; I43-L61 HydrophobicContact CG2-CD1 3.97Å; I43-A64 HydrophobicContact CD1-CB 4.23Å; I43-A64 HydrophobicContact CG1-CB 3.89Å; I43-V65 HydrophobicContact CD1-CG2 3.88Å; I43-V65 HydrophobicContact CG1-CG2 4.41Å; I43-I68 HydrophobicContact CD1-CD1 3.57Å
44I87Confident84.9Confident78 Ų7849.8 Ų49.840%0.427%0.271SS..Hα-helixtrans-61.6-44.1179.5-65.9165.8000110.5M40 L41 I42 I46 I47 S48 V301M40-I44 VanDerWaalsContact O-CG1 3.27Å; M40-I44 WeakPolarHBondContact O-CG1 3.38Å; M40-I44 PolarHBondContact O-N 3.42Å; L41-I44 PolarHBondContact O-N 3.14Å; I42-I44 PolarHBondContact O-N 3.33Å; I44-I46 VanDerWaalsContact C-N 3.34Å; I44-I46 PolarHBondContact O-N 2.97Å; I44-I47 PolarHBondContact O-N 2.91Å; I44-S48 WeakPolarHBondContact O-CB 3.23Å; I44-S48 PolarHBondContact O-N 2.9Å; I44-S48 PolarHBondContact O-OG 2.88Å; I44-V301 HydrophobicContact CG2-CG1 3.72Å; I44-V301 HydrophobicContact CG2-CG2 3.98Å
45A86Confident85Confident0 Ų048.1 Ų48.10%026%0.261CS..Hα-helixtrans-62.1-40.6-179.300000112.5L41 I42 I43 N49 M294 I298 V301L41-A45 WeakPolarHBondContact O-CB 3.29Å; L41-A45 PolarHBondContact O-N 2.96Å; I42-A45 PolarHBondContact O-N 2.95Å; I43-A45 VanDerWaalsContact C-N 3.35Å; I43-A45 PolarHBondContact O-N 3.48Å; A45-N49 WeakPolarHBondContact O-CB 3.39Å; A45-N49 PolarHBondContact O-N 3.06Å; A45-M294 HydrophobicContact CB-SD 4.1Å; A45-I298 HydrophobicContact CB-CG1 4.04Å; A45-V301 HydrophobicContact CB-CG2 4.28Å
46I86.9Confident85.2Confident2 Ų248.7 Ų48.71%0.0126%0.264CS..Hα-helixtrans-70.6-50.1179-65.9166.1000110.3I42 I43 I44 S48 N49 H53 Y57 L60 L61 M294I42-I46 HydrophobicContact CG2-CD1 3.6Å; I42-I46 HydrophobicContact CG2-CG1 4.44Å; I42-I46 VanDerWaalsContact O-CG1 3.3Å; I42-I46 WeakPolarHBondContact O-CG1 3.45Å; I42-I46 PolarHBondContact O-N 2.86Å; I43-I46 PolarHBondContact O-N 3.44Å; I44-I46 VanDerWaalsContact C-N 3.34Å; I44-I46 PolarHBondContact O-N 2.97Å; I46-S48 VanDerWaalsContact C-N 3.27Å; I46-S48 PolarHBondContact O-N 3.36Å; I46-N49 PolarHBondContact O-N 2.95Å; I46-H53 PolarHBondContact O-NE2 3.37Å; I46-Y57 WeakPolarHBondContact CD1-O 3.46Å; I46-L60 HydrophobicContact CD1-CB 4.36Å; I46-L61 HydrophobicContact CB-CD1 4.36Å; I46-L61 HydrophobicContact CD1-CB 3.94Å; I46-L61 HydrophobicContact CD1-CD1 4.43Å; I46-L61 HydrophobicContact CG2-CB 4.42Å; I46-L61 HydrophobicContact CG2-CD1 4.43Å; I46-M294 HydrophobicContact CD1-CE 4.14Å; I46-M294 HydrophobicContact CG1-CE 4.08Å
47I87.5Confident85.2Confident107 Ų10746.2 Ų46.255%0.54925%0.253SS..Hα-helixtrans-62.4-36.2-179-66.5172.4000111.5I43 I44 L61I43-I47 HydrophobicContact CG2-CD1 3.59Å; I43-I47 HydrophobicContact CG2-CG1 4.47Å; I43-I47 WeakPolarHBondContact O-CB 3.24Å; I43-I47 VanDerWaalsContact O-CG1 3.29Å; I43-I47 WeakPolarHBondContact O-CG1 3.35Å; I43-I47 PolarHBondContact O-N 2.65Å; I44-I47 PolarHBondContact O-N 2.91Å; I47-L61 HydrophobicContact CG1-CD1 4.39Å
48S83.1Confident85.3Confident82 Ų8242.9 Ų42.957%0.57324%0.236SC*.Hα-helixtrans-81.8-12.2-176.5-50.70000113.7I44 I46I44-S48 WeakPolarHBondContact O-CB 3.23Å; I44-S48 PolarHBondContact O-N 2.9Å; I44-S48 PolarHBondContact O-OG 2.88Å; I46-S48 VanDerWaalsContact C-N 3.27Å; I46-S48 PolarHBondContact O-N 3.36Å
49N82.8Confident85.6Confident15 Ų1541.9 Ų41.98%0.0823%0.229CC..  trans-12899.5-174.4-170.810.3000112A45 I46 T51 L52A45-N49 WeakPolarHBondContact O-CB 3.39Å; A45-N49 PolarHBondContact O-N 3.06Å; I46-N49 PolarHBondContact O-N 2.95Å; N49-T51 VanDerWaalsContact CG-OG1 3.28Å; N49-T51 PolarHBondContact ND2-OG1 3.39Å; N49-T51 PolarHBondContact O-N 3.29Å; N49-T51 PolarHBondContact OD1-N 3.02Å; N49-T51 PolarHBondContact OD1-OG1 3.37Å; N49-L52 HydrophobicContact CB-CD1 4.04Å; N49-L52 HydrophobicContact CB-CG 4.22Å; N49-L52 WeakPolarHBondContact O-CB 3.46Å; N49-L52 PolarHBondContact O-N 3.36Å
50N79.8Confident85.7Confident129 Ų12942.1 Ų42.169%0.6923%0.23SC*.G310 helixtrans-54.8-25.1177.9-71.9-27.6000114.1L52 H53N50-L52 PolarHBondContact O-N 3.39Å; N50-H53 WeakPolarHBondContact O-CB 3.47Å; N50-H53 PolarHBondContact O-N 3.47Å; N50-H53 PolarHBondContact OD1-CE1 3.1Å; N50-H53 VanDerWaalsContact OD1-CE1 3.22Å
51T77.4Confident85.8Confident97 Ų9741 Ų4160%0.59523%0.225SC*.G310 helixtrans-68.8-17.717771.20000112.8N49N49-T51 VanDerWaalsContact CG-OG1 3.28Å; N49-T51 PolarHBondContact ND2-OG1 3.39Å; N49-T51 PolarHBondContact O-N 3.29Å; N49-T51 PolarHBondContact OD1-N 3.02Å; N49-T51 PolarHBondContact OD1-OG1 3.37Å
52L79.5Confident86Confident1 Ų140.1 Ų40.11%0.00522%0.222CC..G310 helixtrans-913.7176.1-62.3176000112.2N49 N50 T54 Y57 E293N49-L52 HydrophobicContact CB-CD1 4.04Å; N49-L52 HydrophobicContact CB-CG 4.22Å; N49-L52 WeakPolarHBondContact O-CB 3.46Å; N49-L52 PolarHBondContact O-N 3.36Å; N50-L52 PolarHBondContact O-N 3.39Å; L52-T54 PolarHBondContact O-N 3.18Å; L52-Y57 HydrophobicContact CB-CD2 4.05Å; L52-Y57 HydrophobicContact CB-CG 4.18Å; L52-Y57 HydrophobicContact CD2-CD1 4.37Å; L52-Y57 HydrophobicContact CD2-CD2 3.94Å; L52-Y57 HydrophobicContact CD2-CE1 4.02Å; L52-Y57 HydrophobicContact CD2-CE2 3.57Å; L52-Y57 HydrophobicContact CD2-CG 4.36Å; L52-Y57 WeakPolarHBondContact O-CB 3.33Å; L52-Y57 WeakPolarHBondContact O-CD2 3.48Å; L52-E293 HydrophobicContact CD2-CB 4.07Å
53H82Confident86.2Confident99 Ų9940.1 Ų40.146%0.45822%0.221SC..  trans-7952178-66.4177.4000112.7I46 N50I46-H53 PolarHBondContact O-NE2 3.37Å; N50-H53 WeakPolarHBondContact O-CB 3.47Å; N50-H53 PolarHBondContact O-N 3.47Å; N50-H53 PolarHBondContact OD1-CE1 3.1Å; N50-H53 VanDerWaalsContact OD1-CE1 3.22Å
54T84.4Confident86.3Confident50 Ų5039 Ų3931%0.30722%0.216SC..SBendtrans-100.9156.7171.574.90000110.3L52 M56 Y57 I58L52-T54 PolarHBondContact O-N 3.18Å; T54-M56 VanDerWaalsContact C-N 3.29Å; T54-M56 PolarHBondContact O-N 2.95Å; T54-Y57 PolarHBondContact O-N 3.42Å; T54-Y57 WeakPolarHBondContact OG1-CD2 3.38Å; T54-I58 WeakPolarHBondContact O-CG1 3.26Å; T54-I58 PolarHBondContact O-N 3.43Å; T54-I58 VanDerWaalsContact O-N 3.12Å
55P86.3Confident86.5Confident19 Ų1938.3 Ų38.312%0.12322%0.215CC..Hα-helixtrans-50.8-44.8-176.6-29.335.4000114.1Y57 I58 F59 M133 C138P55-Y57 VanDerWaalsContact C-N 3.33Å; P55-Y57 PolarHBondContact O-N 3.02Å; P55-I58 PolarHBondContact O-N 3.26Å; P55-I58 VanDerWaalsContact O-N 3.12Å; P55-F59 HydrophobicContact CB-CE2 4.2Å; P55-F59 WeakPolarHBondContact O-CD2 3.45Å; P55-F59 WeakPolarHBondContact O-CG 3.19Å; P55-F59 PolarHBondContact O-N 3.43Å; P55-M133 HydrophobicContact CB-CE 3.77Å; P55-M133 HydrophobicContact CG-CB 4.47Å; P55-M133 HydrophobicContact CG-CE 4.44Å; P55-C138 HydrophobicContact CB-CB 4.47Å
56M88.4Confident86.7Confident13 Ų1338.4 Ų38.46%0.06422%0.216CC..Hα-helixtrans-53.3-45.7175.8-175.868.3-171.400113.5T54 F59 L60 M115 R119 Y287T54-M56 VanDerWaalsContact C-N 3.29Å; T54-M56 PolarHBondContact O-N 2.95Å; M56-F59 PolarHBondContact O-N 2.92Å; M56-L60 PolarHBondContact O-N 3.07Å; M56-M115 HydrophobicContact CE-CB 4.06Å; M56-M115 HydrophobicContact CE-CG 4.07Å; M56-M115 HydrophobicContact CE-SD 3.79Å; M56-M115 HydrophobicContact SD-CB 3.98Å; M56-M115 HydrophobicContact SD-CG 3.94Å; M56-M115 HydrophobicContact SD-SD 4.35Å; M56-R119 HydrophobicContact SD-CG 4.37Å; M56-Y287 HydrophobicContact CE-CE1 4.25Å
57Y86.9Confident86.8Confident5 Ų538.3 Ų38.32%0.0222%0.215CC..Hα-helixtrans-74.5-28.5-179.5-71.8-62.7000112.3I46 L52 T54 P55 F59 L60 L61 N291 E293 M294I46-Y57 WeakPolarHBondContact CD1-O 3.46Å; L52-Y57 HydrophobicContact CB-CD2 4.05Å; L52-Y57 HydrophobicContact CB-CG 4.18Å; L52-Y57 HydrophobicContact CD2-CD1 4.37Å; L52-Y57 HydrophobicContact CD2-CD2 3.94Å; L52-Y57 HydrophobicContact CD2-CE1 4.02Å; L52-Y57 HydrophobicContact CD2-CE2 3.57Å; L52-Y57 HydrophobicContact CD2-CG 4.36Å; L52-Y57 WeakPolarHBondContact O-CB 3.33Å; L52-Y57 WeakPolarHBondContact O-CD2 3.48Å; T54-Y57 PolarHBondContact O-N 3.42Å; T54-Y57 WeakPolarHBondContact OG1-CD2 3.38Å; P55-Y57 VanDerWaalsContact C-N 3.33Å; P55-Y57 PolarHBondContact O-N 3.02Å; Y57-F59 VanDerWaalsContact C-N 3.31Å; Y57-L60 HydrophobicContact CD1-CD1 3.77Å; Y57-L60 HydrophobicContact CE1-CD1 4.07Å; Y57-L60 PolarHBondContact O-N 3.33Å; Y57-L61 WeakPolarHBondContact O-CB 3.44Å; Y57-L61 PolarHBondContact O-N 3.1Å; Y57-N291 PolarHBondContact OH-ND2 3.19Å; Y57-N291 PolarHBondContact OH-OD1 3.17Å; Y57-E293 VanDerWaalsContact OH-CB 3.3Å; Y57-E293 WeakPolarHBondContact OH-CB 3.43Å; Y57-E293 PolarHBondContact OH-OE2 2.86Å; Y57-E293 VanDerWaalsContact OH-OE2 3.06Å; Y57-M294 HydrophobicContact CD1-CE 3.83Å; Y57-M294 HydrophobicContact CE1-CE 3.83Å
58I89.6Confident86.8Confident44 Ų4434.1 Ų34.123%0.22619%0.194CC..Hα-helixtrans-65.6-38.5171.3-59171.6000110.1T54 P55 L61 T62 L142T54-I58 WeakPolarHBondContact O-CG1 3.26Å; T54-I58 PolarHBondContact O-N 3.43Å; T54-I58 VanDerWaalsContact O-N 3.12Å; P55-I58 PolarHBondContact O-N 3.26Å; P55-I58 VanDerWaalsContact O-N 3.12Å; I58-L61 WeakPolarHBondContact O-CB 3.15Å; I58-L61 PolarHBondContact O-N 3.22Å; I58-T62 PolarHBondContact O-N 3.46Å; I58-T62 PolarHBondContact O-OG1 3.45Å; I58-L142 HydrophobicContact CG2-CD1 3.65Å
59F90.8Very high87.2Confident0 Ų032.6 Ų32.60%018%0.179CC..Hα-helixtrans-64.2-41.6171.4-57.1-45.5000112P55 M56 Y57 T62 L63 L111 T114 M115 D118 M133 L141 L142P55-F59 HydrophobicContact CB-CE2 4.2Å; P55-F59 WeakPolarHBondContact O-CD2 3.45Å; P55-F59 WeakPolarHBondContact O-CG 3.19Å; P55-F59 PolarHBondContact O-N 3.43Å; M56-F59 PolarHBondContact O-N 2.92Å; Y57-F59 VanDerWaalsContact C-N 3.31Å; F59-T62 WeakPolarHBondContact O-CB 3.35Å; F59-T62 PolarHBondContact O-N 2.76Å; F59-L63 WeakPolarHBondContact O-CB 3.47Å; F59-L63 PolarHBondContact O-N 3.25Å; F59-L111 HydrophobicContact CB-CD2 4.45Å; F59-L111 HydrophobicContact CD1-CD2 4.49Å; F59-T114 HydrophobicContact CD1-CG2 4.02Å; F59-T114 HydrophobicContact CD2-CG2 4.23Å; F59-T114 HydrophobicContact CE1-CG2 3.61Å; F59-T114 HydrophobicContact CE2-CG2 3.85Å; F59-T114 HydrophobicContact CG-CG2 4.35Å; F59-T114 HydrophobicContact CZ-CG2 3.53Å; F59-M115 HydrophobicContact CB-CG 3.61Å; F59-M115 HydrophobicContact CB-SD 4.21Å; F59-M115 HydrophobicContact CD2-CG 4.14Å; F59-M115 HydrophobicContact CG-CG 4.22Å; F59-D118 HydrophobicContact CD2-CB 4.49Å; F59-D118 HydrophobicContact CE2-CB 4.07Å; F59-M133 HydrophobicContact CE2-CE 3.83Å; F59-M133 HydrophobicContact CZ-CE 3.91Å; F59-L141 HydrophobicContact CE1-CB 4.25Å; F59-L141 HydrophobicContact CZ-CB 4.32Å; F59-L141 HydrophobicContact CZ-CD1 4.08Å; F59-L142 HydrophobicContact CD1-CD2 3.61Å; F59-L142 HydrophobicContact CD1-CG 4.03Å; F59-L142 HydrophobicContact CE1-CD2 3.97Å; F59-L142 HydrophobicContact CE1-CG 3.88Å
60L88.9Confident87.3Confident6 Ų632 Ų323%0.03118%0.176CC..Hα-helixtrans-64.6-38.1175.1-74172.5000113.2I46 M56 Y57 T62 L63 A64 M115 Y287I46-L60 HydrophobicContact CD1-CB 4.36Å; M56-L60 PolarHBondContact O-N 3.07Å; Y57-L60 HydrophobicContact CD1-CD1 3.77Å; Y57-L60 HydrophobicContact CE1-CD1 4.07Å; Y57-L60 PolarHBondContact O-N 3.33Å; L60-T62 VanDerWaalsContact C-N 3.3Å; L60-L63 HydrophobicContact CD2-CD2 4.41Å; L60-L63 PolarHBondContact O-N 3.18Å; L60-A64 WeakPolarHBondContact O-CB 3.38Å; L60-A64 PolarHBondContact O-N 2.78Å; L60-M115 HydrophobicContact CD2-SD 3.81Å; L60-M115 HydrophobicContact CG-SD 4.14Å; L60-Y287 HydrophobicContact CD1-CD1 4.27Å; L60-Y287 HydrophobicContact CD1-CG 4.4Å; L60-Y287 HydrophobicContact CD2-CD1 3.88Å; L60-Y287 HydrophobicContact CD2-CD2 3.45Å; L60-Y287 VanDerWaalsContact CD2-CD2 3.45Å; L60-Y287 HydrophobicContact CD2-CE1 3.92Å; L60-Y287 HydrophobicContact CD2-CE2 3.51Å; L60-Y287 HydrophobicContact CD2-CG 3.67Å
61L90.9Very high87.5Confident43 Ų4326 Ų2623%0.22514%0.144CC..Hα-helixtrans-59.4-46.4173.3179.373000110.2I43 I46 I47 Y57 I58 A64 V65I43-L61 HydrophobicContact CB-CD1 4.04Å; I43-L61 HydrophobicContact CG1-CD1 3.87Å; I43-L61 HydrophobicContact CG2-CD1 3.97Å; I46-L61 HydrophobicContact CB-CD1 4.36Å; I46-L61 HydrophobicContact CD1-CB 3.94Å; I46-L61 HydrophobicContact CD1-CD1 4.43Å; I46-L61 HydrophobicContact CG2-CB 4.42Å; I46-L61 HydrophobicContact CG2-CD1 4.43Å; I47-L61 HydrophobicContact CG1-CD1 4.39Å; Y57-L61 WeakPolarHBondContact O-CB 3.44Å; Y57-L61 PolarHBondContact O-N 3.1Å; I58-L61 WeakPolarHBondContact O-CB 3.15Å; I58-L61 PolarHBondContact O-N 3.22Å; L61-A64 PolarHBondContact O-N 2.89Å; L61-V65 WeakPolarHBondContact O-CG2 3.37Å; L61-V65 PolarHBondContact O-N 2.88Å; L61-V65 VanDerWaalsContact O-N 3.09Å
62T92.5Very high87.9Confident24 Ų2424.1 Ų24.115%0.14713%0.132CC..Hα-helixtrans-63.1-44.3178.3-53.60000111I58 F59 L60 A64 V65 V66 L111 L142 M146I58-T62 PolarHBondContact O-N 3.46Å; I58-T62 PolarHBondContact O-OG1 3.45Å; F59-T62 WeakPolarHBondContact O-CB 3.35Å; F59-T62 PolarHBondContact O-N 2.76Å; L60-T62 VanDerWaalsContact C-N 3.3Å; T62-A64 PolarHBondContact O-N 3.48Å; T62-V65 PolarHBondContact O-N 3.28Å; T62-V66 WeakPolarHBondContact O-CG2 3.35Å; T62-V66 PolarHBondContact O-N 2.93Å; T62-L111 HydrophobicContact CG2-CD1 4.11Å; T62-L111 HydrophobicContact CG2-CD2 4.22Å; T62-L142 HydrophobicContact CG2-CD2 4Å; T62-L142 WeakPolarHBondContact OG1-CD2 3.5Å; T62-M146 HydrophobicContact CG2-CE 3.17Å
63L90.1Very high88.1Confident3 Ų325.7 Ų25.72%0.01614%0.143CC..Hα-helixtrans-59-45.9175.4-173.669.9000111.5F59 L60 V65 V66 D67 E108 L111 F112 M115 N283 Y287F59-L63 WeakPolarHBondContact O-CB 3.47Å; F59-L63 PolarHBondContact O-N 3.25Å; L60-L63 HydrophobicContact CD2-CD2 4.41Å; L60-L63 PolarHBondContact O-N 3.18Å; L63-V65 VanDerWaalsContact C-N 3.29Å; L63-V65 PolarHBondContact O-N 3.5Å; L63-V66 WeakPolarHBondContact O-CB 3.26Å; L63-V66 PolarHBondContact O-N 3.42Å; L63-V66 VanDerWaalsContact O-N 3.14Å; L63-D67 WeakPolarHBondContact O-CB 3.2Å; L63-D67 PolarHBondContact O-N 2.92Å; L63-E108 HydrophobicContact CD1-CB 4.28Å; L63-E108 HydrophobicContact CD1-CG 3.84Å; L63-L111 HydrophobicContact CB-CD1 4.13Å; L63-L111 HydrophobicContact CD1-CB 4.38Å; L63-L111 HydrophobicContact CD1-CD1 3.98Å; L63-F112 HydrophobicContact CD2-CE1 4Å; L63-F112 HydrophobicContact CD2-CZ 4.36Å; L63-M115 HydrophobicContact CD2-CE 3.94Å; L63-N283 HydrophobicContact CD2-CB 4.44Å; L63-Y287 HydrophobicContact CD2-CE2 4.24Å
64A90.6Very high87.9Confident2 Ų221.1 Ų21.12%0.01712%0.122CC..Hα-helixtrans-62.5-36.117900000112.7N39 I42 I43 L60 L61 T62 I68N39-A64 HydrophobicContact CB-CB 4.12Å; N39-A64 WeakPolarHBondContact OD1-CA 3.37Å; N39-A64 WeakPolarHBondContact OD1-CB 3.26Å; I42-A64 HydrophobicContact CB-CB 4.41Å; I42-A64 HydrophobicContact CG2-CB 4.13Å; I43-A64 HydrophobicContact CD1-CB 4.23Å; I43-A64 HydrophobicContact CG1-CB 3.89Å; L60-A64 WeakPolarHBondContact O-CB 3.38Å; L60-A64 PolarHBondContact O-N 2.78Å; L61-A64 PolarHBondContact O-N 2.89Å; T62-A64 PolarHBondContact O-N 3.48Å; A64-I68 VanDerWaalsContact O-CG1 3.31Å; A64-I68 WeakPolarHBondContact O-CG1 3.49Å; A64-I68 PolarHBondContact O-N 3.4Å; A64-I68 VanDerWaalsContact O-N 3.1Å
65V91.5Very high87.6Confident64 Ų6418.7 Ų18.739%0.38811%0.107SC..Hα-helixtrans-66.3-44.8173.5171.30000111I43 L61 T62 L63 I68 I69I43-V65 HydrophobicContact CD1-CG2 3.88Å; I43-V65 HydrophobicContact CG1-CG2 4.41Å; L61-V65 WeakPolarHBondContact O-CG2 3.37Å; L61-V65 PolarHBondContact O-N 2.88Å; L61-V65 VanDerWaalsContact O-N 3.09Å; T62-V65 PolarHBondContact O-N 3.28Å; L63-V65 VanDerWaalsContact C-N 3.29Å; L63-V65 PolarHBondContact O-N 3.5Å; V65-I68 PolarHBondContact O-N 3.24Å; V65-I69 HydrophobicContact CG1-CD1 3.87Å; V65-I69 WeakPolarHBondContact O-CG1 3.3Å; V65-I69 PolarHBondContact O-N 3.36Å
66V91.1Very high87.2Confident1 Ų120.4 Ų20.41%0.00612%0.119CC..Hα-helixtrans-60.7-44.2177171.40000111.3T62 L63 I68 I69 C70 W103 S104 A107 E108 L111 M146T62-V66 WeakPolarHBondContact O-CG2 3.35Å; T62-V66 PolarHBondContact O-N 2.93Å; L63-V66 WeakPolarHBondContact O-CB 3.26Å; L63-V66 PolarHBondContact O-N 3.42Å; L63-V66 VanDerWaalsContact O-N 3.14Å; V66-I68 PolarHBondContact O-N 3.44Å; V66-I69 PolarHBondContact O-N 3.04Å; V66-C70 WeakPolarHBondContact O-CB 3.38Å; V66-C70 PolarHBondContact O-N 3.38Å; V66-W103 HydrophobicContact CG1-CZ3 4.43Å; V66-W103 HydrophobicContact CG2-CH2 3.8Å; V66-W103 HydrophobicContact CG2-CZ2 4.32Å; V66-W103 HydrophobicContact CG2-CZ3 4.24Å; V66-S104 PolarHBondContact O-OG 3.48Å; V66-A107 HydrophobicContact CG1-CB 4.09Å; V66-A107 HydrophobicContact CG2-CB 4.04Å; V66-E108 HydrophobicContact CG1-CG 3.99Å; V66-L111 HydrophobicContact CG2-CD1 4.4Å; V66-M146 HydrophobicContact CG2-CE 4.35Å
67D88.1Confident86.7Confident0 Ų023.8 Ų23.80%013%0.133CC..Hα-helixtrans-61.9-41.9178.4-78.5-2000111.5L63 C70 T71 P280 N283L63-D67 WeakPolarHBondContact O-CB 3.2Å; L63-D67 PolarHBondContact O-N 2.92Å; D67-C70 PolarHBondContact O-N 3.46Å; D67-T71 WeakPolarHBondContact O-CB 3.17Å; D67-T71 WeakPolarHBondContact O-CG2 3Å; D67-T71 PolarHBondContact O-N 3.46Å; D67-T71 PolarHBondContact O-OG1 3.21Å; D67-P280 HydrophobicContact CB-CB 3.95Å; D67-N283 PolarHBondContact OD2-ND2 2.78Å
68I89.2Confident86.1Confident20 Ų2023.8 Ų23.810%0.10313%0.133CC..Hα-helixtrans-64.1-45.2175.3-71.6169.3000110.9F36 N39 M40 I43 A64 V65 V66 C70 T71 T72F36-I68 HydrophobicContact CD2-CG1 4.49Å; F36-I68 HydrophobicContact CD2-CG2 4.06Å; F36-I68 HydrophobicContact CE2-CG2 3.97Å; N39-I68 HydrophobicContact CB-CD1 3.79Å; N39-I68 HydrophobicContact CB-CG1 3.61Å; M40-I68 HydrophobicContact CE-CD1 4.21Å; M40-I68 HydrophobicContact CG-CD1 3.9Å; M40-I68 HydrophobicContact SD-CD1 3.82Å; I43-I68 HydrophobicContact CD1-CD1 3.57Å; A64-I68 VanDerWaalsContact O-CG1 3.31Å; A64-I68 WeakPolarHBondContact O-CG1 3.49Å; A64-I68 PolarHBondContact O-N 3.4Å; A64-I68 VanDerWaalsContact O-N 3.1Å; V65-I68 PolarHBondContact O-N 3.24Å; V66-I68 PolarHBondContact O-N 3.44Å; I68-C70 VanDerWaalsContact C-N 3.34Å; I68-C70 PolarHBondContact O-N 2.77Å; I68-T71 PolarHBondContact O-OG1 3.38Å; I68-T72 WeakPolarHBondContact O-CB 3.38Å; I68-T72 PolarHBondContact O-N 2.88Å; I68-T72 PolarHBondContact O-OG1 2.94Å
69I89.8Confident85.3Confident50 Ų5022.3 Ų22.326%0.25613%0.125SC..Hα-helixtrans-62.6-44.5178.9-68.4165.1000110.3V65 V66 S73 F100 W103V65-I69 HydrophobicContact CG1-CD1 3.87Å; V65-I69 WeakPolarHBondContact O-CG1 3.3Å; V65-I69 PolarHBondContact O-N 3.36Å; V66-I69 PolarHBondContact O-N 3.04Å; I69-S73 VanDerWaalsContact O-CB 3.27Å; I69-S73 WeakPolarHBondContact O-CB 3.4Å; I69-S73 PolarHBondContact O-N 2.93Å; I69-S73 PolarHBondContact O-OG 3.47Å; I69-F100 HydrophobicContact CG2-CB 4.45Å; I69-F100 HydrophobicContact CG2-CD1 3.8Å; I69-F100 HydrophobicContact CG2-CE1 4.48Å; I69-F100 HydrophobicContact CG2-CG 4.38Å; I69-W103 HydrophobicContact CB-CZ3 4.05Å; I69-W103 HydrophobicContact CD1-CH2 3.72Å; I69-W103 HydrophobicContact CD1-CZ3 3.72Å; I69-W103 HydrophobicContact CG2-CE3 4.28Å; I69-W103 HydrophobicContact CG2-CZ3 3.76Å
70C86.2Confident84.4Confident2 Ų223.6 Ų23.61%0.01414%0.139CC..Hα-helixtrans-58.1-56.3178.2-171.20000111.3V66 D67 I68 T72 S73 I74 S104V66-C70 WeakPolarHBondContact O-CB 3.38Å; V66-C70 PolarHBondContact O-N 3.38Å; D67-C70 PolarHBondContact O-N 3.46Å; I68-C70 VanDerWaalsContact C-N 3.34Å; I68-C70 PolarHBondContact O-N 2.77Å; C70-T72 PolarHBondContact O-N 2.95Å; C70-S73 PolarHBondContact O-N 3.36Å; C70-I74 PolarHBondContact O-N 3Å; C70-S104 WeakPolarHBondContact CB-OG 3.26Å
71T83.8Confident83.5Confident3 Ų323.7 Ų23.72%0.01814%0.14CC..Hα-helixtrans-64.4-39.8-176.8520000112.3A35 D67 I68 I74 I75 P76 P280A35-T71 HydrophobicContact CB-CG2 4.05Å; D67-T71 WeakPolarHBondContact O-CB 3.17Å; D67-T71 WeakPolarHBondContact O-CG2 3Å; D67-T71 PolarHBondContact O-N 3.46Å; D67-T71 PolarHBondContact O-OG1 3.21Å; I68-T71 PolarHBondContact O-OG1 3.38Å; T71-I74 PolarHBondContact O-N 3.3Å; T71-I75 HydrophobicContact CG2-CD1 4.14Å; T71-I75 WeakPolarHBondContact O-CB 3.5Å; T71-I75 WeakPolarHBondContact O-CG1 3.26Å; T71-I75 PolarHBondContact O-N 2.91Å; T71-P76 WeakPolarHBondContact O-CD 3.42Å; T71-P280 HydrophobicContact CG2-CB 3.8Å; T71-P280 HydrophobicContact CG2-CG 4.14Å
72T85.9Confident82.3Confident57 Ų5722.5 Ų22.535%0.3514%0.135SC..Hα-helixtrans-72.3-27.9179-52.60000112.7I68 C70 I74 P76I68-T72 WeakPolarHBondContact O-CB 3.38Å; I68-T72 PolarHBondContact O-N 2.88Å; I68-T72 PolarHBondContact O-OG1 2.94Å; C70-T72 PolarHBondContact O-N 2.95Å; T72-I74 VanDerWaalsContact C-N 3.34Å; T72-P76 HydrophobicContact CG2-CG 4.4Å; T72-P76 WeakPolarHBondContact O-CD 3.22Å; T72-P76 VanDerWaalsContact O-CG 3.26Å; T72-P76 WeakPolarHBondContact O-CG 3.18Å
73S83.2Confident81Confident34 Ų3427 Ų2724%0.23816%0.157CC..Hα-helixtrans-75.2-24.8178.1-60.50000112.8I69 C70I69-S73 VanDerWaalsContact O-CB 3.27Å; I69-S73 WeakPolarHBondContact O-CB 3.4Å; I69-S73 PolarHBondContact O-N 2.93Å; I69-S73 PolarHBondContact O-OG 3.47Å; C70-S73 PolarHBondContact O-N 3.36Å
74I78.4Confident79.6Confident3 Ų330.3 Ų30.32%0.01518%0.178CC..Hα-helixtrans-108.3-53.8-171.5-59.9168.4000111.5C70 T71 T72 M78 F101 F175C70-I74 PolarHBondContact O-N 3Å; T71-I74 PolarHBondContact O-N 3.3Å; T72-I74 VanDerWaalsContact C-N 3.34Å; I74-M78 WeakPolarHBondContact O-CB 3.38Å; I74-M78 PolarHBondContact O-N 2.97Å; I74-M78 VanDerWaalsContact O-N 3.17Å; I74-F101 HydrophobicContact CD1-CB 4.24Å; I74-F101 HydrophobicContact CD1-CD2 3.34Å; I74-F101 HydrophobicContact CD1-CE2 3.86Å; I74-F101 HydrophobicContact CD1-CG 3.96Å; I74-F175 HydrophobicContact CG2-CB 3.97Å; I74-F175 HydrophobicContact CG2-CG 4.37Å
75I77.6Confident77.9Confident0 Ų036.1 Ų36.10%022%0.218CC..Hα-helixtrans-69.9-43.8-165.1-55.7172.7000112.7Y32 T71 K77 M78 L79 L277Y32-I75 HydrophobicContact CD2-CB 4.14Å; Y32-I75 HydrophobicContact CD2-CD1 4.09Å; Y32-I75 HydrophobicContact CD2-CG2 4.39Å; Y32-I75 HydrophobicContact CG-CB 4.43Å; Y32-I75 HydrophobicContact CG-CD1 4.49Å; Y32-I75 HydrophobicContact CG-CG2 4.18Å; T71-I75 HydrophobicContact CG2-CD1 4.14Å; T71-I75 WeakPolarHBondContact O-CB 3.5Å; T71-I75 WeakPolarHBondContact O-CG1 3.26Å; T71-I75 PolarHBondContact O-N 2.91Å; I75-K77 VanDerWaalsContact C-N 3.34Å; I75-K77 PolarHBondContact O-N 3.15Å; I75-M78 HydrophobicContact CG2-CE 4.14Å; I75-M78 PolarHBondContact O-N 2.97Å; I75-L79 HydrophobicContact CG2-CD1 3.63Å; I75-L79 HydrophobicContact CG2-CG 3.86Å; I75-L79 WeakPolarHBondContact O-CB 3.27Å; I75-L79 VanDerWaalsContact O-CG 3.28Å; I75-L79 WeakPolarHBondContact O-CG 3.46Å; I75-L79 PolarHBondContact O-N 3.25Å; I75-L277 HydrophobicContact CD1-CD2 3.52Å; I75-L277 HydrophobicContact CG1-CD2 3.6Å
76P78.3Confident76.4Confident55 Ų5540 Ų4036%0.35723%0.232SC..Hα-helixtrans-58.8-41.9178.7-27.136.7000113.5Y32 T71 T72 L79 G80Y32-P76 HydrophobicContact CE2-CG 4.34Å; T71-P76 WeakPolarHBondContact O-CD 3.42Å; T72-P76 HydrophobicContact CG2-CG 4.4Å; T72-P76 WeakPolarHBondContact O-CD 3.22Å; T72-P76 VanDerWaalsContact O-CG 3.26Å; T72-P76 WeakPolarHBondContact O-CG 3.18Å; P76-L79 PolarHBondContact O-N 2.89Å; P76-G80 PolarHBondContact O-N 2.79Å
77K77.1Confident75.3Confident83 Ų8342.5 Ų42.536%0.36125%0.245SC..Hα-helixtrans-67.9-42.9178.5-175.960.9177.1172.70111.1I75 G80 T81 T88 I89I75-K77 VanDerWaalsContact C-N 3.34Å; I75-K77 PolarHBondContact O-N 3.15Å; K77-G80 PolarHBondContact O-N 2.91Å; K77-T81 PolarHBondContact O-N 3.22Å; K77-T81 PolarHBondContact O-OG1 2.97Å; K77-T88 PolarHBondContact NZ-O 2.96Å; K77-I89 HydrophobicContact CG-CD1 4.4Å
78M73.8Confident74.5Confident5 Ų544.8 Ų44.83%0.02526%0.259CS..Hα-helixtrans-61.8-42.1175.5-178.6-1677300112.3L14 F28 I74 I75 T81 T82 F174L14-M78 HydrophobicContact CD1-CG 4.39Å; L14-M78 HydrophobicContact CD1-SD 3.86Å; F28-M78 HydrophobicContact CB-CE 3.43Å; F28-M78 VanDerWaalsContact CB-CE 3.43Å; F28-M78 HydrophobicContact CD1-CE 3.69Å; F28-M78 HydrophobicContact CD2-CE 3.44Å; F28-M78 VanDerWaalsContact CD2-CE 3.44Å; F28-M78 HydrophobicContact CD2-SD 4.28Å; F28-M78 HydrophobicContact CE1-CE 4.3Å; F28-M78 HydrophobicContact CE2-CE 4.05Å; F28-M78 HydrophobicContact CE2-SD 4.34Å; F28-M78 HydrophobicContact CG-CE 3.23Å; F28-M78 HydrophobicContact CG-SD 4.46Å; F28-M78 HydrophobicContact CZ-CE 4.44Å; I74-M78 WeakPolarHBondContact O-CB 3.38Å; I74-M78 PolarHBondContact O-N 2.97Å; I74-M78 VanDerWaalsContact O-N 3.17Å; I75-M78 HydrophobicContact CG2-CE 4.14Å; I75-M78 PolarHBondContact O-N 2.97Å; M78-T81 WeakPolarHBondContact CA-OG1 3.41Å; M78-T81 PolarHBondContact O-N 2.61Å; M78-T81 PolarHBondContact O-OG1 2.86Å; M78-T82 PolarHBondContact O-N 3.36Å; M78-T82 VanDerWaalsContact O-N 3.13Å; M78-T82 PolarHBondContact O-OG1 3.02Å; M78-F174 HydrophobicContact CG-CB 4.21Å; M78-F174 HydrophobicContact SD-CB 4.11Å; M78-F174 HydrophobicContact SD-CD2 3.56Å; M78-F174 VanDerWaalsContact SD-CD2 3.56Å; M78-F174 HydrophobicContact SD-CE2 4.41Å; M78-F174 HydrophobicContact SD-CG 4.21Å
79L74.3Confident73.9Confident13 Ų1344.1 Ų44.17%0.06826%0.255CS..Hα-helixtrans-64.7-41.2175.4-74.4175.7000111.3F25 F28 L29 I75 P76 T82 L83F25-L79 HydrophobicContact CD2-CB 4.23Å; F25-L79 HydrophobicContact CD2-CD2 3.5Å; F25-L79 HydrophobicContact CD2-CG 4.44Å; F25-L79 HydrophobicContact CE2-CB 3.85Å; F25-L79 HydrophobicContact CE2-CD2 3.68Å; F25-L79 HydrophobicContact CE2-CG 4.25Å; F25-L79 HydrophobicContact CG-CD2 4.21Å; F25-L79 WeakPolarHBondContact O-CD2 3.47Å; F28-L79 HydrophobicContact CB-CD2 3.9Å; L29-L79 HydrophobicContact CB-CD1 4.24Å; L29-L79 HydrophobicContact CB-CD2 4.3Å; L29-L79 HydrophobicContact CD1-CD1 3.96Å; I75-L79 HydrophobicContact CG2-CD1 3.63Å; I75-L79 HydrophobicContact CG2-CG 3.86Å; I75-L79 WeakPolarHBondContact O-CB 3.27Å; I75-L79 VanDerWaalsContact O-CG 3.28Å; I75-L79 WeakPolarHBondContact O-CG 3.46Å; I75-L79 PolarHBondContact O-N 3.25Å; P76-L79 PolarHBondContact O-N 2.89Å; L79-T82 WeakPolarHBondContact O-CB 3.47Å; L79-T82 PolarHBondContact O-N 2.88Å; L79-T82 VanDerWaalsContact O-N 3.11Å; L79-L83 PolarHBondContact O-N 3.45Å
80G71.4Confident73.6Confident28 Ų2844.6 Ų44.629%0.28926%0.264SS..Hα-helixtrans-57.8-50.6173.700000112.3P76 K77 T82 L83 T84P76-G80 PolarHBondContact O-N 2.79Å; K77-G80 PolarHBondContact O-N 2.91Å; G80-T82 PolarHBondContact O-N 3.28Å; G80-T82 VanDerWaalsContact O-N 3.14Å; G80-L83 PolarHBondContact O-N 3.33Å; G80-T84 PolarHBondContact O-N 2.93Å; G80-T84 PolarHBondContact O-OG1 3.18Å
81T69.4Low73.1Confident7 Ų747.2 Ų47.24%0.04327%0.274CS..Hα-helixtrans-63.5-19.1176.151.80000113.4K77 M78 N87K77-T81 PolarHBondContact O-N 3.22Å; K77-T81 PolarHBondContact O-OG1 2.97Å; M78-T81 WeakPolarHBondContact CA-OG1 3.41Å; M78-T81 PolarHBondContact O-N 2.61Å; M78-T81 PolarHBondContact O-OG1 2.86Å; T81-N87 PolarHBondContact O-OD1 3.33Å; T81-N87 VanDerWaalsContact O-OD1 3.08Å
82T66.3Low72.9Confident19 Ų1950 Ų5012%0.11730%0.297CS..Hα-helixtrans-84.8-18.3175-510000111.9Q21 F25 M78 L79 G80Q21-T82 HydrophobicContact CG-CG2 3.51Å; Q21-T82 PolarHBondContact NE2-O 3.44Å; F25-T82 HydrophobicContact CB-CG2 3.9Å; F25-T82 HydrophobicContact CD2-CG2 4.48Å; M78-T82 PolarHBondContact O-N 3.36Å; M78-T82 VanDerWaalsContact O-N 3.13Å; M78-T82 PolarHBondContact O-OG1 3.02Å; L79-T82 WeakPolarHBondContact O-CB 3.47Å; L79-T82 PolarHBondContact O-N 2.88Å; L79-T82 VanDerWaalsContact O-N 3.11Å; G80-T82 PolarHBondContact O-N 3.28Å; G80-T82 VanDerWaalsContact O-N 3.14Å
83L64.4Low72.7Confident119 Ų11948.5 Ų48.562%0.62329%0.292SS*.Hα-helixtrans-99.4-37.4179.8-85.2156.2000112.9F25 L79 G80F25-L83 HydrophobicContact CD2-CD1 3.95Å; F25-L83 HydrophobicContact CD2-CG 3.91Å; F25-L83 HydrophobicContact CE2-CD1 3.13Å; F25-L83 HydrophobicContact CE2-CD2 4.37Å; F25-L83 HydrophobicContact CE2-CG 3.61Å; F25-L83 HydrophobicContact CZ-CD1 3.52Å; F25-L83 HydrophobicContact CZ-CD2 4.45Å; F25-L83 HydrophobicContact CZ-CG 4.13Å; L79-L83 PolarHBondContact O-N 3.45Å; G80-L83 PolarHBondContact O-N 3.33Å
84T60.8Low72.6Confident72 Ų7246.9 Ų46.944%0.44228%0.281SS..SBendtrans-102.9144.8-177.550.80000111G80 E86G80-T84 PolarHBondContact O-N 2.93Å; G80-T84 PolarHBondContact O-OG1 3.18Å; T84-E86 PolarHBondContact O-N 3.43Å; T84-E86 VanDerWaalsContact O-N 3.12Å
85S56.4Low73Confident123 Ų12347.2 Ų47.286%0.8628%0.283SS*.SBendtrans-68.1-4.2171.1-171.30000113N87S85-N87 PolarHBondContact O-N 3.45Å
86E60Low73.3Confident147 Ų14750.1 Ų50.169%0.68730%0.303SS*.  trans-83.893.1173.6-70.3-171.2171.500110.1T84 T88T84-E86 PolarHBondContact O-N 3.43Å; T84-E86 VanDerWaalsContact O-N 3.12Å; E86-T88 VanDerWaalsContact C-N 3.26Å; E86-T88 PolarHBondContact O-N 3.11Å
87N67Low73.6Confident52 Ų5248 Ų4828%0.27829%0.289SS..  trans-89.418.5-179.4-72.2-33.5000113I10 I11 T81 S85I10-N87 CarbonylContact C-O 3.5Å; I10-N87 WeakPolarHBondContact CA-O 3.45Å; I10-N87 HydrophobicContact CG2-CB 4.01Å; I11-N87 PolarHBondContact N-O 3.22Å; I11-N87 WeakPolarHBondContact O-CB 2.8Å; T81-N87 PolarHBondContact O-OD1 3.33Å; T81-N87 VanDerWaalsContact O-OD1 3.08Å; S85-N87 PolarHBondContact O-N 3.45Å
88T70.9Confident74Confident48 Ų4844.1 Ų44.129%0.29427%0.272SS..EExtended strand (participates in β ladder)trans-95.4140.7-172.5550000112.9F9 I10 K77 E86F9-T88 CarbonylContact O-C 3.48Å; F9-T88 VanDerWaalsContact O-CA 3.23Å; F9-T88 WeakPolarHBondContact O-CA 3.44Å; I10-T88 HydrophobicContact CG1-CG2 4.05Å; K77-T88 PolarHBondContact NZ-O 2.96Å; E86-T88 VanDerWaalsContact C-N 3.26Å; E86-T88 PolarHBondContact O-N 3.11Å
89I77.3Confident74.7Confident6 Ų646.2 Ų46.23%0.03128%0.28CS..EExtended strand (participates in β ladder)trans-121.2134.8166.5-168.5168.4000108E8 F9 I11 K77 C94E8-I89 WeakPolarHBondContact CA-O 3.42Å; F9-I89 HydrophobicContact CB-CG2 3.8Å; F9-I89 PolarHBondContact N-O 2.89Å; F9-I89 PolarHBondContact O-N 2.66Å; I11-I89 HydrophobicContact CD1-CB 3.93Å; I11-I89 HydrophobicContact CD1-CD1 4.33Å; I11-I89 HydrophobicContact CD1-CG2 3.75Å; I11-I89 HydrophobicContact CG1-CB 4.47Å; I11-I89 HydrophobicContact CG1-CG2 3.92Å; K77-I89 HydrophobicContact CG-CD1 4.4Å; I89-C94 HydrophobicContact CD1-CB 4.33Å; I89-C94 HydrophobicContact CG2-CB 4.26Å
90S82.1Confident75.3Confident61 Ų6149.6 Ų49.643%0.42730%0.295SS..EExtended strand (participates in β ladder)trans-66.5152.4173.765.20000110A92 G93 C94S90-A92 PolarHBondContact O-N 3.31Å; S90-G93 WeakPolarHBondContact O-CA 3.32Å; S90-G93 PolarHBondContact O-N 3.35Å; S90-G93 PolarHBondContact OG-N 2.68Å; S90-G93 VanDerWaalsContact OG-N 3.08Å; S90-C94 PolarHBondContact O-N 2.88Å
91Y77.6Confident75.9Confident57 Ų5748.6 Ų48.622%0.22428%0.282CS..Hα-helixtrans-50.8-46.7174.3178-91.4000112.2T7 F9 G93 C94 M95 M161 F165T7-Y91 PolarHBondContact O-N 3.42Å; F9-Y91 AromaticContact CE2-CD2 3.65Å; F9-Y91 HydrophobicContact CE2-CD2 3.65Å; F9-Y91 HydrophobicContact CE2-CE2 4.43Å; F9-Y91 HydrophobicContact CE2-CG 4.44Å; F9-Y91 HydrophobicContact CZ-CD2 4.03Å; Y91-G93 VanDerWaalsContact C-N 3.34Å; Y91-G93 PolarHBondContact O-N 3.34Å; Y91-C94 WeakPolarHBondContact O-CB 3.31Å; Y91-C94 PolarHBondContact O-N 3.13Å; Y91-M95 HydrophobicContact CD1-CG 4.2Å; Y91-M95 HydrophobicContact CD2-CE 4.24Å; Y91-M95 HydrophobicContact CE1-CG 3.8Å; Y91-M95 HydrophobicContact CE2-CE 3.73Å; Y91-M95 HydrophobicContact CE2-CG 4.46Å; Y91-M95 WeakPolarHBondContact O-CG 3.26Å; Y91-M95 PolarHBondContact O-N 3.23Å; Y91-M161 WeakPolarHBondContact OH-CA 2.98Å; Y91-F165 HydrophobicContact CE2-CD2 4.05Å; Y91-F165 AromaticContact CE2-CE2 3.79Å; Y91-F165 HydrophobicContact CE2-CE2 3.79Å
92A79.6Confident76.6Confident62 Ų6249.1 Ų49.151%0.51229%0.286SS..Hα-helixtrans-64.8-35.2177.800000113.3S90 S96S90-A92 PolarHBondContact O-N 3.31Å; A92-S96 WeakPolarHBondContact O-CB 3.5Å; A92-S96 PolarHBondContact O-N 2.94Å; A92-S96 PolarHBondContact O-OG 3.47Å
93G81.4Confident77.8Confident24 Ų2449.7 Ų49.725%0.24729%0.286CS..Hα-helixtrans-65.3-43.417300000111.9S90 Y91 S96 Q97S90-G93 WeakPolarHBondContact O-CA 3.32Å; S90-G93 PolarHBondContact O-N 3.35Å; S90-G93 PolarHBondContact OG-N 2.68Å; S90-G93 VanDerWaalsContact OG-N 3.08Å; Y91-G93 VanDerWaalsContact C-N 3.34Å; Y91-G93 PolarHBondContact O-N 3.34Å; G93-S96 PolarHBondContact O-N 2.98Å; G93-Q97 VanDerWaalsContact O-CB 3.29Å; G93-Q97 WeakPolarHBondContact O-CB 3.5Å; G93-Q97 PolarHBondContact O-N 2.96Å
94C81.1Confident78.9Confident0 Ų044 Ų440%026%0.256CS..Hα-helixtrans-61.7-47.7176.8-152.20000111F9 I89 S90 Y91 S96 Q97 L98 C176F9-C94 HydrophobicContact CD2-CB 4.04Å; F9-C94 HydrophobicContact CE2-CB 4.27Å; I89-C94 HydrophobicContact CD1-CB 4.33Å; I89-C94 HydrophobicContact CG2-CB 4.26Å; S90-C94 PolarHBondContact O-N 2.88Å; Y91-C94 WeakPolarHBondContact O-CB 3.31Å; Y91-C94 PolarHBondContact O-N 3.13Å; C94-S96 PolarHBondContact O-N 2.88Å; C94-Q97 PolarHBondContact O-N 3.4Å; C94-L98 WeakPolarHBondContact O-CB 3.44Å; C94-L98 PolarHBondContact O-N 2.83Å; C94-C176 WeakPolarHBondContact CA-SG 3.2Å; C94-C176 HydrophobicContact CB-CB 4.02Å; C94-C176 WeakPolarHBondContact CB-SG 3.27Å; C94-C176 PolarHBondContact O-SG 3.11Å; C94-C176 WeakPolarHBondContact SG-CB 3.22Å; C94-C176 CovalentContact SG-SG 2.03Å; C94-C176 PolarHBondContact SG-SG 2.93Å
95M85.3Confident79.9Confident10 Ų1042.8 Ų42.85%0.04925%0.247CC..Hα-helixtrans-65.5-39.8179.3-64.9-57.4132.600112.6Y91 L98 F99 T157 T160 M161 F165 L181Y91-M95 HydrophobicContact CD1-CG 4.2Å; Y91-M95 HydrophobicContact CD2-CE 4.24Å; Y91-M95 HydrophobicContact CE1-CG 3.8Å; Y91-M95 HydrophobicContact CE2-CE 3.73Å; Y91-M95 HydrophobicContact CE2-CG 4.46Å; Y91-M95 WeakPolarHBondContact O-CG 3.26Å; Y91-M95 PolarHBondContact O-N 3.23Å; M95-L98 PolarHBondContact O-N 2.88Å; M95-F99 WeakPolarHBondContact O-CB 3.33Å; M95-F99 PolarHBondContact O-N 3.01Å; M95-T157 HydrophobicContact CB-CG2 4.3Å; M95-T160 HydrophobicContact CE-CG2 3.8Å; M95-T160 HydrophobicContact SD-CG2 3.87Å; M95-M161 HydrophobicContact CG-CG 4.03Å; M95-M161 HydrophobicContact SD-CG 3.93Å; M95-F165 HydrophobicContact CE-CZ 4.5Å; M95-L181 HydrophobicContact CE-CD1 4.45Å; M95-L181 HydrophobicContact CE-CD2 4.22Å
96S85.8Confident81.3Confident61 Ų6137.1 Ų37.143%0.42721%0.207SC..Hα-helixtrans-62.2-46.4174.1-60.40000111.3A92 G93 C94 L98 F99 F100A92-S96 WeakPolarHBondContact O-CB 3.5Å; A92-S96 PolarHBondContact O-N 2.94Å; A92-S96 PolarHBondContact O-OG 3.47Å; G93-S96 PolarHBondContact O-N 2.98Å; C94-S96 PolarHBondContact O-N 2.88Å; S96-L98 VanDerWaalsContact C-N 3.34Å; S96-L98 PolarHBondContact O-N 3.04Å; S96-F99 PolarHBondContact O-N 2.8Å; S96-F100 WeakPolarHBondContact O-CD2 3.3Å; S96-F100 PolarHBondContact O-N 3.36Å
97Q84.2Confident82.8Confident12 Ų1230.1 Ų30.16%0.05618%0.175CC..Hα-helixtrans-62.7-42.1178.9-175.4176.9-29.300111.8G93 C94 F101 F175 C176G93-Q97 VanDerWaalsContact O-CB 3.29Å; G93-Q97 WeakPolarHBondContact O-CB 3.5Å; G93-Q97 PolarHBondContact O-N 2.96Å; C94-Q97 PolarHBondContact O-N 3.4Å; Q97-F101 VanDerWaalsContact O-CB 3.22Å; Q97-F101 WeakPolarHBondContact O-CB 3.34Å; Q97-F101 PolarHBondContact O-N 2.77Å; Q97-F175 VanDerWaalsContact NE2-CB 3.27Å; Q97-C176 HydrophobicContact CB-CB 4.47Å
98L83.9Confident83.7Confident1 Ų127.8 Ų27.81%0.00516%0.162CC..Hα-helixtrans-59.5-46.5174.2-178.765.1000111.3C94 M95 S96 F101 T102 T160 M178 L181C94-L98 WeakPolarHBondContact O-CB 3.44Å; C94-L98 PolarHBondContact O-N 2.83Å; M95-L98 PolarHBondContact O-N 2.88Å; S96-L98 VanDerWaalsContact C-N 3.34Å; S96-L98 PolarHBondContact O-N 3.04Å; L98-F101 PolarHBondContact O-N 2.76Å; L98-T102 WeakPolarHBondContact O-CB 3.49Å; L98-T102 PolarHBondContact O-N 3.38Å; L98-T102 PolarHBondContact O-OG1 3.13Å; L98-T102 VanDerWaalsContact O-OG1 3.11Å; L98-T160 HydrophobicContact CD2-CG2 4.05Å; L98-M178 HydrophobicContact CD1-CG 3.69Å; L98-M178 HydrophobicContact CD2-CG 4.22Å; L98-M178 HydrophobicContact CG-CG 4.49Å; L98-L181 HydrophobicContact CD2-CD1 4.18Å
99F88.5Confident84.3Confident48 Ų4826.6 Ų26.621%0.21115%0.154CC..Hα-helixtrans-59.8-52.4179.4178-91000112M95 S96 F101 W103 S153 W154 T157M95-F99 WeakPolarHBondContact O-CB 3.33Å; M95-F99 PolarHBondContact O-N 3.01Å; S96-F99 PolarHBondContact O-N 2.8Å; F99-F101 VanDerWaalsContact C-N 3.3Å; F99-F101 PolarHBondContact O-N 3.04Å; F99-W103 WeakPolarHBondContact O-CB 3.22Å; F99-W103 PolarHBondContact O-N 3.49Å; F99-S153 VanDerWaalsContact C-OG 3.32Å; F99-S153 VanDerWaalsContact CA-OG 3.27Å; F99-S153 WeakPolarHBondContact CA-OG 3.23Å; F99-S153 WeakPolarHBondContact CD2-OG 3.42Å; F99-S153 WeakPolarHBondContact CG-OG 3.34Å; F99-S153 PolarHBondContact O-OG 3Å; F99-W154 HydrophobicContact CE2-CB 4.42Å; F99-T157 WeakPolarHBondContact CA-OG1 3.39Å; F99-T157 HydrophobicContact CB-CG2 4.38Å
100F88.2Confident84.8Confident84 Ų8426.8 Ų26.837%0.36816%0.155SC..Hα-helixtrans-64.5-37.8-179-74.6-65.2000111.9I69 S96 S104I69-F100 HydrophobicContact CG2-CB 4.45Å; I69-F100 HydrophobicContact CG2-CD1 3.8Å; I69-F100 HydrophobicContact CG2-CE1 4.48Å; I69-F100 HydrophobicContact CG2-CG 4.38Å; S96-F100 WeakPolarHBondContact O-CD2 3.3Å; S96-F100 PolarHBondContact O-N 3.36Å; F100-S104 WeakPolarHBondContact O-CB 3.43Å; F100-S104 PolarHBondContact O-N 2.96Å; F100-S104 PolarHBondContact O-OG 3.46Å
101F83.7Confident85.2Confident7 Ų723.9 Ų23.93%0.03114%0.135CC..Hα-helixtrans-65.2-51.8178.2179.4-123.8000112.7I74 Q97 L98 F99 W103 S104 L105 F175 E177 T276I74-F101 HydrophobicContact CD1-CB 4.24Å; I74-F101 HydrophobicContact CD1-CD2 3.34Å; I74-F101 HydrophobicContact CD1-CE2 3.86Å; I74-F101 HydrophobicContact CD1-CG 3.96Å; Q97-F101 VanDerWaalsContact O-CB 3.22Å; Q97-F101 WeakPolarHBondContact O-CB 3.34Å; Q97-F101 PolarHBondContact O-N 2.77Å; L98-F101 PolarHBondContact O-N 2.76Å; F99-F101 VanDerWaalsContact C-N 3.3Å; F99-F101 PolarHBondContact O-N 3.04Å; F101-W103 VanDerWaalsContact C-N 3.28Å; F101-W103 PolarHBondContact O-N 3.19Å; F101-S104 PolarHBondContact O-N 2.88Å; F101-L105 HydrophobicContact CD1-CD1 4.29Å; F101-L105 HydrophobicContact CD2-CD1 4.26Å; F101-L105 HydrophobicContact CD2-CG 4.26Å; F101-L105 HydrophobicContact CE1-CD1 3.69Å; F101-L105 HydrophobicContact CE2-CD1 3.66Å; F101-L105 HydrophobicContact CE2-CD2 4.19Å; F101-L105 HydrophobicContact CE2-CG 3.83Å; F101-L105 HydrophobicContact CZ-CD1 3.37Å; F101-L105 HydrophobicContact CZ-CG 4.09Å; F101-L105 PolarHBondContact O-N 3.26Å; F101-F175 AromaticContact CD1-CE2 3.93Å; F101-F175 HydrophobicContact CD1-CE2 3.93Å; F101-F175 AromaticContact CE1-CE2 3.6Å; F101-F175 HydrophobicContact CE1-CE2 3.6Å; F101-F175 HydrophobicContact CE1-CZ 4.18Å; F101-F175 AromaticContact CZ-CE2 3.98Å; F101-F175 HydrophobicContact CZ-CE2 3.98Å; F101-F175 HydrophobicContact CZ-CZ 4.27Å; F101-E177 HydrophobicContact CE1-CG 4.35Å; F101-T276 HydrophobicContact CD2-CG2 4.33Å; F101-T276 HydrophobicContact CE2-CG2 3.15Å; F101-T276 HydrophobicContact CZ-CG2 3.32Å
102T83.5Confident85.6Confident19 Ų1921.2 Ų21.212%0.11712%0.124CC..Hα-helixtrans-64-35.9178.4-57.70000111.8L98 G106 H156L98-T102 WeakPolarHBondContact O-CB 3.49Å; L98-T102 PolarHBondContact O-N 3.38Å; L98-T102 PolarHBondContact O-OG1 3.13Å; L98-T102 VanDerWaalsContact O-OG1 3.11Å; T102-G106 PolarHBondContact O-N 2.83Å; T102-G106 VanDerWaalsContact O-N 3.1Å; T102-H156 HydrophobicContact CG2-CB 4.38Å
103W91.1Very high86Confident30 Ų3019.1 Ų19.111%0.11411%0.105CC..Hα-helixtrans-63.7-48.4174.4171.377.5000111.5V66 I69 F99 F101 G106 A107 M146V66-W103 HydrophobicContact CG1-CZ3 4.43Å; V66-W103 HydrophobicContact CG2-CH2 3.8Å; V66-W103 HydrophobicContact CG2-CZ2 4.32Å; V66-W103 HydrophobicContact CG2-CZ3 4.24Å; I69-W103 HydrophobicContact CB-CZ3 4.05Å; I69-W103 HydrophobicContact CD1-CH2 3.72Å; I69-W103 HydrophobicContact CD1-CZ3 3.72Å; I69-W103 HydrophobicContact CG2-CE3 4.28Å; I69-W103 HydrophobicContact CG2-CZ3 3.76Å; F99-W103 WeakPolarHBondContact O-CB 3.22Å; F99-W103 PolarHBondContact O-N 3.49Å; F101-W103 VanDerWaalsContact C-N 3.28Å; F101-W103 PolarHBondContact O-N 3.19Å; W103-G106 PolarHBondContact O-N 3.22Å; W103-A107 WeakPolarHBondContact O-CB 3.42Å; W103-A107 PolarHBondContact O-N 3.18Å; W103-M146 HydrophobicContact CZ2-CE 4.49Å; W103-M146 HydrophobicContact CZ2-SD 3.73Å
104S87.9Confident86.4Confident0 Ų018.5 Ų18.50%010%0.097CC..Hα-helixtrans-61.8-47.1-179.6-74.10000112V66 C70 F100 F101 G106 A107 E108V66-S104 PolarHBondContact O-OG 3.48Å; C70-S104 WeakPolarHBondContact CB-OG 3.26Å; F100-S104 WeakPolarHBondContact O-CB 3.43Å; F100-S104 PolarHBondContact O-N 2.96Å; F100-S104 PolarHBondContact O-OG 3.46Å; F101-S104 PolarHBondContact O-N 2.88Å; S104-G106 PolarHBondContact O-N 3.5Å; S104-A107 PolarHBondContact O-N 3.2Å; S104-E108 WeakPolarHBondContact O-CB 3.21Å; S104-E108 WeakPolarHBondContact O-CG 3.42Å; S104-E108 PolarHBondContact O-N 2.88Å
105L82.3Confident86.8Confident47 Ų4718.5 Ų18.525%0.24610%0.097CC..Hα-helixtrans-59.4-45.6177.1-72.5178.7000112.4F101 E108 M109F101-L105 HydrophobicContact CD1-CD1 4.29Å; F101-L105 HydrophobicContact CD2-CD1 4.26Å; F101-L105 HydrophobicContact CD2-CG 4.26Å; F101-L105 HydrophobicContact CE1-CD1 3.69Å; F101-L105 HydrophobicContact CE2-CD1 3.66Å; F101-L105 HydrophobicContact CE2-CD2 4.19Å; F101-L105 HydrophobicContact CE2-CG 3.83Å; F101-L105 HydrophobicContact CZ-CD1 3.37Å; F101-L105 HydrophobicContact CZ-CG 4.09Å; F101-L105 PolarHBondContact O-N 3.26Å; L105-E108 PolarHBondContact O-N 3.42Å; L105-M109 WeakPolarHBondContact O-CG 3.33Å; L105-M109 PolarHBondContact O-N 3.49Å; L105-M109 VanDerWaalsContact O-N 3.16Å
106G86Confident86.9Confident3 Ų318 Ų183%0.0319%0.094CC..Hα-helixtrans-63-42.5177.100000112.2T102 W103 S104 V110T102-G106 PolarHBondContact O-N 2.83Å; T102-G106 VanDerWaalsContact O-N 3.1Å; W103-G106 PolarHBondContact O-N 3.22Å; S104-G106 PolarHBondContact O-N 3.5Å; G106-V110 WeakPolarHBondContact O-CG2 3.46Å; G106-V110 PolarHBondContact O-N 3.06Å
107A90.4Very high87Confident0 Ų019.1 Ų19.10%09%0.09CC..Hα-helixtrans-65.1-43.7177.900000111.8V66 W103 S104 M109 V110 L111 V145 A149V66-A107 HydrophobicContact CG1-CB 4.09Å; V66-A107 HydrophobicContact CG2-CB 4.04Å; W103-A107 WeakPolarHBondContact O-CB 3.42Å; W103-A107 PolarHBondContact O-N 3.18Å; S104-A107 PolarHBondContact O-N 3.2Å; A107-M109 PolarHBondContact O-N 2.94Å; A107-V110 PolarHBondContact O-N 3.02Å; A107-L111 VanDerWaalsContact O-CB 3.23Å; A107-L111 WeakPolarHBondContact O-CB 3.5Å; A107-L111 WeakPolarHBondContact O-CD1 3.29Å; A107-L111 WeakPolarHBondContact O-CG 3.08Å; A107-L111 PolarHBondContact O-N 3.38Å; A107-V145 HydrophobicContact CB-CG1 4.39Å; A107-A149 HydrophobicContact CB-CB 3.81Å
108E86.4Confident87.3Confident3 Ų318.6 Ų18.61%0.0149%0.087CC..Hα-helixtrans-56.4-48.7176.7-76.5171.7-146.800111.9L63 V66 S104 L105 L111 F112L63-E108 HydrophobicContact CD1-CB 4.28Å; L63-E108 HydrophobicContact CD1-CG 3.84Å; V66-E108 HydrophobicContact CG1-CG 3.99Å; S104-E108 WeakPolarHBondContact O-CB 3.21Å; S104-E108 WeakPolarHBondContact O-CG 3.42Å; S104-E108 PolarHBondContact O-N 2.88Å; L105-E108 PolarHBondContact O-N 3.42Å; E108-L111 PolarHBondContact O-N 2.9Å; E108-F112 VanDerWaalsContact O-CD2 3.23Å; E108-F112 WeakPolarHBondContact O-CD2 3.24Å; E108-F112 WeakPolarHBondContact O-CG 3.47Å; E108-F112 PolarHBondContact O-N 3.45Å
109M83.3Confident87.4Confident24 Ų2420.5 Ų20.512%0.1189%0.094CC..Hα-helixtrans-60.1-50.8-179.6-70-172-175.600112.1L105 A107 L111 F112 T113 L203 A204 D207 Y248L105-M109 WeakPolarHBondContact O-CG 3.33Å; L105-M109 PolarHBondContact O-N 3.49Å; L105-M109 VanDerWaalsContact O-N 3.16Å; A107-M109 PolarHBondContact O-N 2.94Å; M109-L111 VanDerWaalsContact C-N 3.31Å; M109-L111 PolarHBondContact O-N 3.23Å; M109-F112 PolarHBondContact O-N 2.83Å; M109-T113 PolarHBondContact O-N 3.04Å; M109-T113 VanDerWaalsContact O-N 3.13Å; M109-T113 PolarHBondContact O-OG1 3.47Å; M109-L203 HydrophobicContact SD-CB 4.4Å; M109-A204 HydrophobicContact CE-CB 3.99Å; M109-A204 HydrophobicContact SD-CB 3.91Å; M109-D207 HydrophobicContact CB-CB 4.42Å; M109-Y248 HydrophobicContact CE-CE1 3.99Å; M109-Y248 WeakPolarHBondContact CE-OH 3.33Å; M109-Y248 HydrophobicContact CG-CE1 3.8Å; M109-Y248 WeakPolarHBondContact CG-OH 3.42Å
110V89.3Confident87.3Confident10 Ų1020.8 Ų20.86%0.0619%0.094CC..Hα-helixtrans-69.5-31.8-178.3-1720000110.9G106 A107 T113 T114 V145 I148 L203G106-V110 WeakPolarHBondContact O-CG2 3.46Å; G106-V110 PolarHBondContact O-N 3.06Å; A107-V110 PolarHBondContact O-N 3.02Å; V110-T113 PolarHBondContact O-N 3.35Å; V110-T114 WeakPolarHBondContact O-CB 3.37Å; V110-T114 PolarHBondContact O-N 3.14Å; V110-T114 PolarHBondContact O-OG1 2.95Å; V110-V145 HydrophobicContact CB-CG2 4.24Å; V110-V145 HydrophobicContact CG1-CB 4.32Å; V110-V145 HydrophobicContact CG1-CG2 3.69Å; V110-I148 HydrophobicContact CG1-CD1 4.33Å; V110-I148 HydrophobicContact CG2-CG2 4.1Å; V110-L203 HydrophobicContact CG2-CD2 4.38Å
111L90.2Very high87.3Confident0 Ų016.9 Ų16.90%08%0.077CC..Hα-helixtrans-64.1-41.7172-78168000111.7F59 T62 L63 V66 A107 E108 M109 T113 T114 M115 L142 V145F59-L111 HydrophobicContact CB-CD2 4.45Å; F59-L111 HydrophobicContact CD1-CD2 4.49Å; T62-L111 HydrophobicContact CG2-CD1 4.11Å; T62-L111 HydrophobicContact CG2-CD2 4.22Å; L63-L111 HydrophobicContact CB-CD1 4.13Å; L63-L111 HydrophobicContact CD1-CB 4.38Å; L63-L111 HydrophobicContact CD1-CD1 3.98Å; V66-L111 HydrophobicContact CG2-CD1 4.4Å; A107-L111 VanDerWaalsContact O-CB 3.23Å; A107-L111 WeakPolarHBondContact O-CB 3.5Å; A107-L111 WeakPolarHBondContact O-CD1 3.29Å; A107-L111 WeakPolarHBondContact O-CG 3.08Å; A107-L111 PolarHBondContact O-N 3.38Å; E108-L111 PolarHBondContact O-N 2.9Å; M109-L111 VanDerWaalsContact C-N 3.31Å; M109-L111 PolarHBondContact O-N 3.23Å; L111-T113 VanDerWaalsContact C-N 3.34Å; L111-T113 PolarHBondContact O-N 3.28Å; L111-T114 PolarHBondContact O-N 2.95Å; L111-M115 HydrophobicContact CB-CE 4.28Å; L111-M115 WeakPolarHBondContact O-CB 3.36Å; L111-M115 WeakPolarHBondContact O-CE 3.19Å; L111-M115 WeakPolarHBondContact O-CG 3.43Å; L111-M115 PolarHBondContact O-N 3.16Å; L111-L142 HydrophobicContact CD2-CD2 4.31Å; L111-V145 HydrophobicContact CD1-CG1 4.41Å; L111-V145 HydrophobicContact CD2-CG1 3.95Å; L111-V145 HydrophobicContact CD2-CG2 4.17Å; L111-V145 HydrophobicContact CG-CG1 3.71Å; L111-V145 HydrophobicContact CG-CG2 4.45Å
112F85.6Confident87.5Confident0 Ų017.8 Ų17.80%09%0.086CC..Hα-helixtrans-61.3-42174.2-72.2-45.8000112.5L63 E108 M109 T114 M115 A116 H241 V244 Y248L63-F112 HydrophobicContact CD2-CE1 4Å; L63-F112 HydrophobicContact CD2-CZ 4.36Å; E108-F112 VanDerWaalsContact O-CD2 3.23Å; E108-F112 WeakPolarHBondContact O-CD2 3.24Å; E108-F112 WeakPolarHBondContact O-CG 3.47Å; E108-F112 PolarHBondContact O-N 3.45Å; M109-F112 PolarHBondContact O-N 2.83Å; F112-T114 VanDerWaalsContact C-N 3.34Å; F112-M115 HydrophobicContact CD1-CE 3.48Å; F112-M115 VanDerWaalsContact CD1-CE 3.48Å; F112-M115 HydrophobicContact CE1-CE 3.9Å; F112-M115 HydrophobicContact CG-CE 4.4Å; F112-M115 PolarHBondContact O-N 2.82Å; F112-A116 WeakPolarHBondContact O-CB 3.45Å; F112-A116 PolarHBondContact O-N 3.45Å; F112-H241 PolarHBondContact O-NE2 3.33Å; F112-V244 HydrophobicContact CD1-CG1 4.33Å; F112-V244 HydrophobicContact CE1-CG1 3.4Å; F112-V244 VanDerWaalsContact CE1-CG1 3.4Å; F112-V244 HydrophobicContact CZ-CG1 3.56Å; F112-Y248 HydrophobicContact CD2-CD1 4.27Å; F112-Y248 HydrophobicContact CD2-CG 4.36Å; F112-Y248 HydrophobicContact CE2-CD1 4.22Å; F112-Y248 AromaticContact CE2-CD2 3.93Å; F112-Y248 HydrophobicContact CE2-CD2 3.93Å; F112-Y248 HydrophobicContact CE2-CE2 4.2Å; F112-Y248 AromaticContact CE2-CG 3.88Å; F112-Y248 HydrophobicContact CE2-CG 3.88Å
113T87.4Confident87.5Confident19 Ų1918.7 Ų18.712%0.1179%0.09CC..Hα-helixtrans-62.8-43.1173.9-57.60000111.2M109 V110 L111 A116 Y117 D207 L210M109-T113 PolarHBondContact O-N 3.04Å; M109-T113 VanDerWaalsContact O-N 3.13Å; M109-T113 PolarHBondContact O-OG1 3.47Å; V110-T113 PolarHBondContact O-N 3.35Å; L111-T113 VanDerWaalsContact C-N 3.34Å; L111-T113 PolarHBondContact O-N 3.28Å; T113-A116 WeakPolarHBondContact O-CB 3.15Å; T113-A116 PolarHBondContact O-N 3.03Å; T113-Y117 PolarHBondContact O-N 3Å; T113-D207 WeakPolarHBondContact OG1-CA 2.87Å; T113-D207 WeakPolarHBondContact OG1-CB 3.49Å; T113-D207 VanDerWaalsContact OG1-CG 3.26Å; T113-D207 PolarHBondContact OG1-O 3.41Å; T113-D207 PolarHBondContact OG1-OD1 3.19Å; T113-L210 HydrophobicContact CG2-CB 3.81Å; T113-L210 HydrophobicContact CG2-CD1 4.07Å
114T90.3Very high87.1Confident11 Ų1118.9 Ų18.97%0.06710%0.095CC..Hα-helixtrans-65.1-42.3179.9-58.40000111.9F59 V110 L111 F112 Y117 D118 L141F59-T114 HydrophobicContact CD1-CG2 4.02Å; F59-T114 HydrophobicContact CD2-CG2 4.23Å; F59-T114 HydrophobicContact CE1-CG2 3.61Å; F59-T114 HydrophobicContact CE2-CG2 3.85Å; F59-T114 HydrophobicContact CG-CG2 4.35Å; F59-T114 HydrophobicContact CZ-CG2 3.53Å; V110-T114 WeakPolarHBondContact O-CB 3.37Å; V110-T114 PolarHBondContact O-N 3.14Å; V110-T114 PolarHBondContact O-OG1 2.95Å; L111-T114 PolarHBondContact O-N 2.95Å; F112-T114 VanDerWaalsContact C-N 3.34Å; T114-Y117 WeakPolarHBondContact O-CB 3.28Å; T114-Y117 PolarHBondContact O-N 2.9Å; T114-D118 PolarHBondContact O-N 2.92Å; T114-L141 HydrophobicContact CG2-CB 3.91Å; T114-L141 HydrophobicContact CG2-CD1 4.06Å; T114-L141 HydrophobicContact CG2-CD2 4.45Å; T114-L141 HydrophobicContact CG2-CG 4.37Å
115M90.1Very high86.9Confident0 Ų023.3 Ų23.30%012%0.115CC..Hα-helixtrans-65.1-38.8173.7-74.2-173.5-7900111.8M56 F59 L60 L63 L111 F112 Y117 D118 R119 H241M56-M115 HydrophobicContact CE-CB 4.06Å; M56-M115 HydrophobicContact CE-CG 4.07Å; M56-M115 HydrophobicContact CE-SD 3.79Å; M56-M115 HydrophobicContact SD-CB 3.98Å; M56-M115 HydrophobicContact SD-CG 3.94Å; M56-M115 HydrophobicContact SD-SD 4.35Å; F59-M115 HydrophobicContact CB-CG 3.61Å; F59-M115 HydrophobicContact CB-SD 4.21Å; F59-M115 HydrophobicContact CD2-CG 4.14Å; F59-M115 HydrophobicContact CG-CG 4.22Å; L60-M115 HydrophobicContact CD2-SD 3.81Å; L60-M115 HydrophobicContact CG-SD 4.14Å; L63-M115 HydrophobicContact CD2-CE 3.94Å; L111-M115 HydrophobicContact CB-CE 4.28Å; L111-M115 WeakPolarHBondContact O-CB 3.36Å; L111-M115 WeakPolarHBondContact O-CE 3.19Å; L111-M115 WeakPolarHBondContact O-CG 3.43Å; L111-M115 PolarHBondContact O-N 3.16Å; F112-M115 HydrophobicContact CD1-CE 3.48Å; F112-M115 VanDerWaalsContact CD1-CE 3.48Å; F112-M115 HydrophobicContact CE1-CE 3.9Å; F112-M115 HydrophobicContact CG-CE 4.4Å; F112-M115 PolarHBondContact O-N 2.82Å; M115-Y117 VanDerWaalsContact C-N 3.33Å; M115-Y117 PolarHBondContact O-N 3.3Å; M115-D118 PolarHBondContact O-N 3.13Å; M115-R119 WeakPolarHBondContact O-CG 3.16Å; M115-R119 PolarHBondContact O-N 3.39Å; M115-H241 VanDerWaalsContact CB-NE2 3.3Å; M115-H241 WeakPolarHBondContact CB-NE2 3.44Å
116A86Confident87Confident0 Ų025.2 Ų25.20%013%0.13CC..Hα-helixtrans-62.6-40.5173.200000111.9F112 T113 R119 Y120 T211 Y215F112-A116 WeakPolarHBondContact O-CB 3.45Å; F112-A116 PolarHBondContact O-N 3.45Å; T113-A116 WeakPolarHBondContact O-CB 3.15Å; T113-A116 PolarHBondContact O-N 3.03Å; A116-R119 PolarHBondContact O-N 2.9Å; A116-Y120 WeakPolarHBondContact O-CB 3.38Å; A116-Y120 PolarHBondContact O-N 3.44Å; A116-T211 HydrophobicContact CB-CG2 4.13Å; A116-Y215 HydrophobicContact CB-CD2 4.29Å; A116-Y215 HydrophobicContact CB-CE2 3.75Å
117Y88.8Confident87Confident84 Ų8432.8 Ų32.833%0.32917%0.169SC..Hα-helixtrans-63.7-45.3174.8177.3-104.8000112.1T113 T114 M115 R119 Y120 V121 M133 L141T113-Y117 PolarHBondContact O-N 3Å; T114-Y117 WeakPolarHBondContact O-CB 3.28Å; T114-Y117 PolarHBondContact O-N 2.9Å; M115-Y117 VanDerWaalsContact C-N 3.33Å; M115-Y117 PolarHBondContact O-N 3.3Å; Y117-R119 VanDerWaalsContact C-N 3.35Å; Y117-R119 PolarHBondContact O-N 3.44Å; Y117-Y120 HydrophobicContact CD2-CD1 4.26Å; Y117-Y120 HydrophobicContact CE2-CD1 4.37Å; Y117-Y120 WeakPolarHBondContact O-CB 3.22Å; Y117-Y120 PolarHBondContact O-N 3.23Å; Y117-Y120 VanDerWaalsContact O-N 3.14Å; Y117-V121 HydrophobicContact CD1-CG2 4.42Å; Y117-V121 HydrophobicContact CD2-CG2 4.37Å; Y117-V121 HydrophobicContact CE1-CG2 3.96Å; Y117-V121 HydrophobicContact CE2-CG2 3.9Å; Y117-V121 WeakPolarHBondContact O-CG2 3.3Å; Y117-V121 PolarHBondContact O-N 3.47Å; Y117-M133 HydrophobicContact CD1-SD 4.46Å; Y117-M133 HydrophobicContact CE1-SD 4.16Å; Y117-L141 HydrophobicContact CD1-CD1 4.38Å
118D90Very high86.9Confident0 Ų038.1 Ų38.10%019%0.193CC..Hα-helixtrans-54.9-49.4174171.787.5000111.7F59 T114 M115 Y120 V121 A122 Y129 M133F59-D118 HydrophobicContact CD2-CB 4.49Å; F59-D118 HydrophobicContact CE2-CB 4.07Å; T114-D118 PolarHBondContact O-N 2.92Å; M115-D118 PolarHBondContact O-N 3.13Å; D118-Y120 VanDerWaalsContact C-N 3.31Å; D118-Y120 PolarHBondContact O-N 2.92Å; D118-V121 PolarHBondContact O-N 3.25Å; D118-A122 WeakPolarHBondContact O-CB 3.25Å; D118-A122 PolarHBondContact O-N 2.88Å; D118-Y129 PolarHBondContact OD1-OH 3.01Å; D118-M133 HydrophobicContact CB-CE 4.15Å; D118-M133 WeakPolarHBondContact OD1-CE 3.5Å
119R86.6Confident87Confident41 Ų4140 Ų4016%0.15520%0.201CC..Hα-helixtrans-63-38.2177.1-66.4-61.992.4-179.93.1112.1M56 M115 A116 Y117 A122 I123 I218M56-R119 HydrophobicContact SD-CG 4.37Å; M115-R119 WeakPolarHBondContact O-CG 3.16Å; M115-R119 PolarHBondContact O-N 3.39Å; A116-R119 PolarHBondContact O-N 2.9Å; Y117-R119 VanDerWaalsContact C-N 3.35Å; Y117-R119 PolarHBondContact O-N 3.44Å; R119-A122 PolarHBondContact O-N 3.24Å; R119-I123 WeakPolarHBondContact O-CB 3.38Å; R119-I123 WeakPolarHBondContact O-CG1 3.34Å; R119-I123 PolarHBondContact O-N 3.37Å; R119-I218 HydrophobicContact CB-CD1 4.11Å
120Y86.6Confident87.2Confident55 Ų5543.5 Ų43.522%0.21623%0.227CC..Hα-helixtrans-60.3-50.3175.7163.9-102000111.4A116 Y117 D118 A122 I123 C124 F125 F217 I218A116-Y120 WeakPolarHBondContact O-CB 3.38Å; A116-Y120 PolarHBondContact O-N 3.44Å; Y117-Y120 HydrophobicContact CD2-CD1 4.26Å; Y117-Y120 HydrophobicContact CE2-CD1 4.37Å; Y117-Y120 WeakPolarHBondContact O-CB 3.22Å; Y117-Y120 PolarHBondContact O-N 3.23Å; Y117-Y120 VanDerWaalsContact O-N 3.14Å; D118-Y120 VanDerWaalsContact C-N 3.31Å; D118-Y120 PolarHBondContact O-N 2.92Å; Y120-A122 PolarHBondContact O-N 3.37Å; Y120-I123 PolarHBondContact O-N 2.87Å; Y120-C124 HydrophobicContact CD2-CB 4.19Å; Y120-C124 WeakPolarHBondContact CD2-SG 3.32Å; Y120-C124 HydrophobicContact CE2-CB 3.96Å; Y120-C124 VanDerWaalsContact CE2-SG 3.54Å; Y120-C124 VanDerWaalsContact O-CB 3.23Å; Y120-C124 WeakPolarHBondContact O-CB 3.37Å; Y120-C124 PolarHBondContact O-N 3.33Å; Y120-C124 PolarHBondContact O-SG 3.28Å; Y120-C124 VanDerWaalsContact O-SG 3.41Å; Y120-F125 HydrophobicContact CE1-CD2 4.49Å; Y120-F125 AromaticContact CE1-CE2 3.99Å; Y120-F125 HydrophobicContact CE1-CE2 3.99Å; Y120-F125 AromaticContact CZ-CE2 3.76Å; Y120-F125 WeakPolarHBondContact OH-CE2 3.05Å; Y120-F217 HydrophobicContact CD2-CB 3.91Å; Y120-F217 HydrophobicContact CE2-CB 3.64Å; Y120-F217 HydrophobicContact CE2-CD2 4.27Å; Y120-F217 HydrophobicContact CE2-CG 4.11Å; Y120-I218 HydrophobicContact CD2-CG1 4.47Å
121V88.1Confident87.3Confident2 Ų248 Ų481%0.01226%0.255CS..Hα-helixtrans-63.7-42.6178.8-179.40000110.8Y117 D118 I123 F125 Y129 I132 M133Y117-V121 HydrophobicContact CD1-CG2 4.42Å; Y117-V121 HydrophobicContact CD2-CG2 4.37Å; Y117-V121 HydrophobicContact CE1-CG2 3.96Å; Y117-V121 HydrophobicContact CE2-CG2 3.9Å; Y117-V121 WeakPolarHBondContact O-CG2 3.3Å; Y117-V121 PolarHBondContact O-N 3.47Å; D118-V121 PolarHBondContact O-N 3.25Å; V121-I123 VanDerWaalsContact C-N 3.32Å; V121-I123 PolarHBondContact O-N 3.49Å; V121-F125 CarbonylContact O-C 3.34Å; V121-F125 WeakPolarHBondContact O-CA 3.11Å; V121-F125 PolarHBondContact O-N 3.43Å; V121-Y129 HydrophobicContact CB-CD2 4.41Å; V121-Y129 HydrophobicContact CG1-CD2 4.05Å; V121-I132 HydrophobicContact CG1-CB 3.95Å; V121-I132 HydrophobicContact CG1-CD1 3.93Å; V121-I132 HydrophobicContact CG1-CG2 3.82Å; V121-I132 HydrophobicContact CG2-CG2 4.31Å; V121-M133 HydrophobicContact CB-CG 4.39Å; V121-M133 HydrophobicContact CG1-CG 4.28Å
122A86.8Confident87.2Confident25 Ų2550.7 Ų50.721%0.20727%0.269CS..Hα-helixtrans-60.6-38.1179.900000113.3D118 R119 Y120 Y129D118-A122 WeakPolarHBondContact O-CB 3.25Å; D118-A122 PolarHBondContact O-N 2.88Å; R119-A122 PolarHBondContact O-N 3.24Å; Y120-A122 PolarHBondContact O-N 3.37Å; A122-Y129 VanDerWaalsContact CA-CD2 3.41Å; A122-Y129 HydrophobicContact CB-CD2 3.68Å; A122-Y129 HydrophobicContact CB-CE2 3.66Å; A122-Y129 HydrophobicContact CB-CG 4.48Å
123I83.5Confident87.4Confident38 Ų3851 Ų5120%0.19527%0.27CS..Hα-helixtrans-91-42.4-175.5-64.5171.2000111.9R119 Y120 V121 I218 A221 I222 C238R119-I123 WeakPolarHBondContact O-CB 3.38Å; R119-I123 WeakPolarHBondContact O-CG1 3.34Å; R119-I123 PolarHBondContact O-N 3.37Å; Y120-I123 PolarHBondContact O-N 2.87Å; V121-I123 VanDerWaalsContact C-N 3.32Å; V121-I123 PolarHBondContact O-N 3.49Å; I123-I218 HydrophobicContact CD1-CG2 3.65Å; I123-I218 HydrophobicContact CG2-CG2 4.4Å; I123-A221 HydrophobicContact CG2-CB 4.1Å; I123-I222 HydrophobicContact CG2-CG1 4.37Å; I123-C238 VanDerWaalsContact CD1-SG 3.58Å
124C82.9Confident87.6Confident34 Ų3453.2 Ų53.223%0.2328%0.281CS..Hα-helixtrans-82.5-28.5-175-59.40000112.4Y120 P126Y120-C124 HydrophobicContact CD2-CB 4.19Å; Y120-C124 WeakPolarHBondContact CD2-SG 3.32Å; Y120-C124 HydrophobicContact CE2-CB 3.96Å; Y120-C124 VanDerWaalsContact CE2-SG 3.54Å; Y120-C124 VanDerWaalsContact O-CB 3.23Å; Y120-C124 WeakPolarHBondContact O-CB 3.37Å; Y120-C124 PolarHBondContact O-N 3.33Å; Y120-C124 PolarHBondContact O-SG 3.28Å; Y120-C124 VanDerWaalsContact O-SG 3.41Å; C124-P126 VanDerWaalsContact C-CD 3.47Å
125F85.1Confident87.5Confident94 Ų9459 Ų5941%0.41231%0.307SS..  trans-131.956.2-177.5-56.5-79.3000112.6Y120 V121 L127 H128 Y129Y120-F125 HydrophobicContact CE1-CD2 4.49Å; Y120-F125 AromaticContact CE1-CE2 3.99Å; Y120-F125 HydrophobicContact CE1-CE2 3.99Å; Y120-F125 AromaticContact CZ-CE2 3.76Å; Y120-F125 WeakPolarHBondContact OH-CE2 3.05Å; V121-F125 CarbonylContact O-C 3.34Å; V121-F125 WeakPolarHBondContact O-CA 3.11Å; V121-F125 PolarHBondContact O-N 3.43Å; F125-L127 VanDerWaalsContact C-N 3.28Å; F125-L127 PolarHBondContact O-N 3.37Å; F125-L127 VanDerWaalsContact O-N 3.16Å; F125-H128 PolarHBondContact O-N 3.32Å; F125-Y129 PolarHBondContact O-N 3.24Å
126P83.5Confident87.6Confident86 Ų8666.3 Ų66.356%0.55834%0.341SS*.THydrogen-bonded Turntrans-59.4-35.1-171.624-34.6000113.5C124 H128C124-P126 VanDerWaalsContact C-CD 3.47Å; P126-H128 VanDerWaalsContact C-N 3.32Å; P126-H128 PolarHBondContact O-N 3.47Å
127L86.9Confident87.8Confident162 Ų16269.6 Ų69.685%0.84836%0.357SS*.THydrogen-bonded Turntrans-71-25.2179.2-67.2173.3000113.7F125F125-L127 VanDerWaalsContact C-N 3.28Å; F125-L127 PolarHBondContact O-N 3.37Å; F125-L127 VanDerWaalsContact O-N 3.16Å
128H88.6Confident88Confident112 Ų11265.7 Ų65.752%0.51934%0.342SS..THydrogen-bonded Turntrans-106-0.5-178.8-66.588.4000112.5F125 P126 S130 T131 I132F125-H128 PolarHBondContact O-N 3.32Å; P126-H128 VanDerWaalsContact C-N 3.32Å; P126-H128 PolarHBondContact O-N 3.47Å; H128-S130 PolarHBondContact O-N 2.91Å; H128-T131 PolarHBondContact O-N 3.38Å; H128-I132 HydrophobicContact CB-CD1 3.82Å; H128-I132 HydrophobicContact CB-CG1 4.31Å; H128-I132 WeakPolarHBondContact O-CG1 3.08Å; H128-I132 PolarHBondContact O-N 3.47Å
129Y88.6Confident88.1Confident44 Ų4468.9 Ų68.917%0.17336%0.361CS..Hα-helixtrans-53.9-50.4-175172.7-98.4000112.1D118 V121 A122 F125 T131 I132 M133D118-Y129 PolarHBondContact OD1-OH 3.01Å; V121-Y129 HydrophobicContact CB-CD2 4.41Å; V121-Y129 HydrophobicContact CG1-CD2 4.05Å; A122-Y129 VanDerWaalsContact CA-CD2 3.41Å; A122-Y129 HydrophobicContact CB-CD2 3.68Å; A122-Y129 HydrophobicContact CB-CE2 3.66Å; A122-Y129 HydrophobicContact CB-CG 4.48Å; F125-Y129 PolarHBondContact O-N 3.24Å; Y129-T131 PolarHBondContact O-N 3.45Å; Y129-I132 PolarHBondContact O-N 2.98Å; Y129-M133 HydrophobicContact CD2-CB 4.14Å; Y129-M133 HydrophobicContact CD2-CG 4.24Å; Y129-M133 HydrophobicContact CE2-CB 3.79Å; Y129-M133 HydrophobicContact CE2-CG 3.89Å; Y129-M133 WeakPolarHBondContact O-CA 3.24Å; Y129-M133 PolarHBondContact O-N 3.03Å
130S86.8Confident88.5Confident96 Ų9669.4 Ų69.467%0.67138%0.375SS*.Hα-helixtrans-67.1-23.4-178.2-52.90000113.7H128H128-S130 PolarHBondContact O-N 2.91Å
131T90.1Very high88.9Confident104 Ų10467.6 Ų67.664%0.63837%0.368SS*.Hα-helixtrans-81.2-40.4176.4-49.50000111.1H128 Y129 N134H128-T131 PolarHBondContact O-N 3.38Å; Y129-T131 PolarHBondContact O-N 3.45Å; T131-N134 PolarHBondContact O-ND2 2.98Å
132I89.1Confident89.2Confident57 Ų5768.8 Ų68.829%0.29238%0.375SS..Hα-helixtrans-77.1-55.2-179.6-62.6167.9000110.7V121 H128 Y129 N134 M137V121-I132 HydrophobicContact CG1-CB 3.95Å; V121-I132 HydrophobicContact CG1-CD1 3.93Å; V121-I132 HydrophobicContact CG1-CG2 3.82Å; V121-I132 HydrophobicContact CG2-CG2 4.31Å; H128-I132 HydrophobicContact CB-CD1 3.82Å; H128-I132 HydrophobicContact CB-CG1 4.31Å; H128-I132 WeakPolarHBondContact O-CG1 3.08Å; H128-I132 PolarHBondContact O-N 3.47Å; Y129-I132 PolarHBondContact O-N 2.98Å; I132-N134 VanDerWaalsContact C-N 3.32Å; I132-N134 PolarHBondContact O-N 3.29Å; I132-M137 WeakPolarHBondContact O-CB 3.06Å; I132-M137 WeakPolarHBondContact O-CG 3.44Å
133M90.6Very high89.5Confident7 Ų770.9 Ų70.93%0.03439%0.388CS..SBendtrans-92.462.8178.9-72.4-58.4-69.700111P55 F59 Y117 D118 V121 Y129 M137 L141P55-M133 HydrophobicContact CB-CE 3.77Å; P55-M133 HydrophobicContact CG-CB 4.47Å; P55-M133 HydrophobicContact CG-CE 4.44Å; F59-M133 HydrophobicContact CE2-CE 3.83Å; F59-M133 HydrophobicContact CZ-CE 3.91Å; Y117-M133 HydrophobicContact CD1-SD 4.46Å; Y117-M133 HydrophobicContact CE1-SD 4.16Å; D118-M133 HydrophobicContact CB-CE 4.15Å; D118-M133 WeakPolarHBondContact OD1-CE 3.5Å; V121-M133 HydrophobicContact CB-CG 4.39Å; V121-M133 HydrophobicContact CG1-CG 4.28Å; Y129-M133 HydrophobicContact CD2-CB 4.14Å; Y129-M133 HydrophobicContact CD2-CG 4.24Å; Y129-M133 HydrophobicContact CE2-CB 3.79Å; Y129-M133 HydrophobicContact CE2-CG 3.89Å; Y129-M133 WeakPolarHBondContact O-CA 3.24Å; Y129-M133 PolarHBondContact O-N 3.03Å; M133-M137 HydrophobicContact SD-CG 3.91Å; M133-L141 HydrophobicContact CE-CD1 3.97Å; M133-L141 HydrophobicContact SD-CD1 4.01Å
134N90.9Very high90.1Very high65 Ų6573.8 Ų73.835%0.34840%0.402SS..  trans-85.6176.3170.770.233.8000111.5T131 I132 H136 M137 C138T131-N134 PolarHBondContact O-ND2 2.98Å; I132-N134 VanDerWaalsContact C-N 3.32Å; I132-N134 PolarHBondContact O-N 3.29Å; N134-H136 VanDerWaalsContact C-N 3.33Å; N134-H136 PolarHBondContact O-N 3.1Å; N134-H136 WeakPolarHBondContact OD1-CA 3.44Å; N134-H136 WeakPolarHBondContact OD1-CB 3.48Å; N134-H136 PolarHBondContact OD1-N 3.42Å; N134-M137 PolarHBondContact O-N 3.44Å; N134-M137 PolarHBondContact OD1-N 3.35Å; N134-C138 PolarHBondContact O-N 3.47Å
135H87.9Confident90.6Very high133 Ų13372.1 Ų72.162%0.61639%0.391SS*.Hα-helixtrans-59.1-41.1-179.3-174.669.9000113M137 C138 V139H135-M137 PolarHBondContact O-N 3.34Å; H135-C138 WeakPolarHBondContact O-CB 3.3Å; H135-C138 PolarHBondContact O-N 2.86Å; H135-V139 WeakPolarHBondContact O-CG2 3.43Å; H135-V139 PolarHBondContact O-N 3.23Å
136H91.4Very high91Very high153 Ų15370.3 Ų70.371%0.70838%0.384SS*.Hα-helixtrans-64-41.6178.6-65.3-74.5000112.2N134 V139 A140N134-H136 VanDerWaalsContact C-N 3.33Å; N134-H136 PolarHBondContact O-N 3.1Å; N134-H136 WeakPolarHBondContact OD1-CA 3.44Å; N134-H136 WeakPolarHBondContact OD1-CB 3.48Å; N134-H136 PolarHBondContact OD1-N 3.42Å; H136-V139 PolarHBondContact O-N 3.16Å; H136-A140 VanDerWaalsContact O-CB 3.29Å; H136-A140 WeakPolarHBondContact O-CB 3.22Å; H136-A140 PolarHBondContact O-N 3.33Å
137M92.1Very high91.6Very high70 Ų7068.8 Ų68.835%0.34538%0.379SS..Hα-helixtrans-63.5-43.7175.2-177.260.173.600111.1I132 M133 N134 H135 V139 A140 L141I132-M137 WeakPolarHBondContact O-CB 3.06Å; I132-M137 WeakPolarHBondContact O-CG 3.44Å; M133-M137 HydrophobicContact SD-CG 3.91Å; N134-M137 PolarHBondContact O-N 3.44Å; N134-M137 PolarHBondContact OD1-N 3.35Å; H135-M137 PolarHBondContact O-N 3.34Å; M137-V139 PolarHBondContact O-N 2.88Å; M137-A140 PolarHBondContact O-N 3.12Å; M137-L141 HydrophobicContact CG-CD1 3.92Å; M137-L141 HydrophobicContact CG-CG 4.35Å; M137-L141 WeakPolarHBondContact O-CB 3.38Å; M137-L141 VanDerWaalsContact O-CG 3.29Å; M137-L141 WeakPolarHBondContact O-CG 3.32Å; M137-L141 PolarHBondContact O-N 3.25Å; M137-L141 HydrophobicContact SD-CD1 4.24Å; M137-L141 HydrophobicContact SD-CG 4.13Å
138C92.1Very high91.8Very high2 Ų264 Ų641%0.01435%0.353CS..Hα-helixtrans-58.3-48.3176.4-172.40000111.6P55 N134 H135 A140 L141 L142P55-C138 HydrophobicContact CB-CB 4.47Å; N134-C138 PolarHBondContact O-N 3.47Å; H135-C138 WeakPolarHBondContact O-CB 3.3Å; H135-C138 PolarHBondContact O-N 2.86Å; C138-A140 PolarHBondContact O-N 3.32Å; C138-L141 PolarHBondContact O-N 3.26Å; C138-L142 WeakPolarHBondContact O-CG 3.3Å; C138-L142 PolarHBondContact O-N 2.8Å
139V92.4Very high92Very high66 Ų6658.6 Ų58.640%0.433%0.329SS..Hα-helixtrans-63.5-40.4176.9173.70000111.6H135 H136 M137 L142 S143H135-V139 WeakPolarHBondContact O-CG2 3.43Å; H135-V139 PolarHBondContact O-N 3.23Å; H136-V139 PolarHBondContact O-N 3.16Å; M137-V139 PolarHBondContact O-N 2.88Å; V139-L142 PolarHBondContact O-N 2.87Å; V139-S143 WeakPolarHBondContact O-CB 3.42Å; V139-S143 PolarHBondContact O-N 3.02Å; V139-S143 PolarHBondContact O-OG 3.01Å
140A94.8Very high92.2Very high52 Ų5259.4 Ų59.443%0.4334%0.338SS..Hα-helixtrans-63.8-44.4177.500000112H136 M137 C138 S143 M144H136-A140 VanDerWaalsContact O-CB 3.29Å; H136-A140 WeakPolarHBondContact O-CB 3.22Å; H136-A140 PolarHBondContact O-N 3.33Å; M137-A140 PolarHBondContact O-N 3.12Å; C138-A140 PolarHBondContact O-N 3.32Å; A140-S143 PolarHBondContact O-N 2.87Å; A140-M144 WeakPolarHBondContact O-CB 3.43Å; A140-M144 PolarHBondContact O-N 2.83Å
141L94.1Very high92.5Very high17 Ų1759 Ų599%0.08933%0.331CS..Hα-helixtrans-63.4-45176.7-71.3168.6000111.4F59 T114 Y117 M133 M137 C138 S143 M144 V145F59-L141 HydrophobicContact CE1-CB 4.25Å; F59-L141 HydrophobicContact CZ-CB 4.32Å; F59-L141 HydrophobicContact CZ-CD1 4.08Å; T114-L141 HydrophobicContact CG2-CB 3.91Å; T114-L141 HydrophobicContact CG2-CD1 4.06Å; T114-L141 HydrophobicContact CG2-CD2 4.45Å; T114-L141 HydrophobicContact CG2-CG 4.37Å; Y117-L141 HydrophobicContact CD1-CD1 4.38Å; M133-L141 HydrophobicContact CE-CD1 3.97Å; M133-L141 HydrophobicContact SD-CD1 4.01Å; M137-L141 HydrophobicContact CG-CD1 3.92Å; M137-L141 HydrophobicContact CG-CG 4.35Å; M137-L141 WeakPolarHBondContact O-CB 3.38Å; M137-L141 VanDerWaalsContact O-CG 3.29Å; M137-L141 WeakPolarHBondContact O-CG 3.32Å; M137-L141 PolarHBondContact O-N 3.25Å; M137-L141 HydrophobicContact SD-CD1 4.24Å; M137-L141 HydrophobicContact SD-CG 4.13Å; C138-L141 PolarHBondContact O-N 3.26Å; L141-S143 VanDerWaalsContact C-N 3.33Å; L141-S143 PolarHBondContact O-N 3Å; L141-M144 HydrophobicContact CD2-CE 3.99Å; L141-M144 WeakPolarHBondContact O-CB 3.29Å; L141-M144 PolarHBondContact O-N 3.18Å; L141-V145 VanDerWaalsContact O-CG2 3.28Å; L141-V145 WeakPolarHBondContact O-CG2 3.34Å; L141-V145 PolarHBondContact O-N 3.4Å
142L94.6Very high92.4Very high28 Ų2855.5 Ų55.515%0.14731%0.309CS..Hα-helixtrans-60.8-42.7174.7-73.2169.3000112.2I58 F59 T62 L111 C138 V139 M144 V145 M146I58-L142 HydrophobicContact CG2-CD1 3.65Å; F59-L142 HydrophobicContact CD1-CD2 3.61Å; F59-L142 HydrophobicContact CD1-CG 4.03Å; F59-L142 HydrophobicContact CE1-CD2 3.97Å; F59-L142 HydrophobicContact CE1-CG 3.88Å; T62-L142 HydrophobicContact CG2-CD2 4Å; T62-L142 WeakPolarHBondContact OG1-CD2 3.5Å; L111-L142 HydrophobicContact CD2-CD2 4.31Å; C138-L142 WeakPolarHBondContact O-CG 3.3Å; C138-L142 PolarHBondContact O-N 2.8Å; V139-L142 PolarHBondContact O-N 2.87Å; L142-M144 VanDerWaalsContact C-N 3.29Å; L142-M144 PolarHBondContact O-N 3.28Å; L142-V145 WeakPolarHBondContact O-CB 3.44Å; L142-V145 PolarHBondContact O-N 3.48Å; L142-M146 VanDerWaalsContact O-CG 3.29Å; L142-M146 WeakPolarHBondContact O-CG 3.49Å; L142-M146 PolarHBondContact O-N 3.27Å
143S94.4Very high92.4Very high69 Ų6952.8 Ų52.848%0.48330%0.295SS..Hα-helixtrans-63.1-39.7177.7-57.30000111.1V139 A140 L141 M146 A147V139-S143 WeakPolarHBondContact O-CB 3.42Å; V139-S143 PolarHBondContact O-N 3.02Å; V139-S143 PolarHBondContact O-OG 3.01Å; A140-S143 PolarHBondContact O-N 2.87Å; L141-S143 VanDerWaalsContact C-N 3.33Å; L141-S143 PolarHBondContact O-N 3Å; S143-M146 PolarHBondContact O-N 3.12Å; S143-A147 VanDerWaalsContact O-CB 3.27Å; S143-A147 WeakPolarHBondContact O-CB 3.35Å; S143-A147 PolarHBondContact O-N 2.77Å
144M95.1Very high92.4Very high98 Ų9860.6 Ų60.648%0.48332%0.324SS..Hα-helixtrans-64.7-48.3175.9-172.6-159.3-47.700111.8A140 L141 L142 M146 A147 I148A140-M144 WeakPolarHBondContact O-CB 3.43Å; A140-M144 PolarHBondContact O-N 2.83Å; L141-M144 HydrophobicContact CD2-CE 3.99Å; L141-M144 WeakPolarHBondContact O-CB 3.29Å; L141-M144 PolarHBondContact O-N 3.18Å; L142-M144 VanDerWaalsContact C-N 3.29Å; L142-M144 PolarHBondContact O-N 3.28Å; M144-M146 VanDerWaalsContact C-N 3.29Å; M144-M146 PolarHBondContact O-N 3.02Å; M144-A147 PolarHBondContact O-N 2.92Å; M144-I148 HydrophobicContact CG-CD1 3.77Å; M144-I148 HydrophobicContact CG-CG1 4.42Å; M144-I148 WeakPolarHBondContact O-CB 3.45Å; M144-I148 VanDerWaalsContact O-CG1 3.3Å; M144-I148 WeakPolarHBondContact O-CG1 3.38Å; M144-I148 PolarHBondContact O-N 3.43Å; M144-I148 HydrophobicContact SD-CD1 4.25Å
145V93.8Very high92.3Very high0 Ų059.7 Ų59.70%032%0.321CS..Hα-helixtrans-51-52.3174.3165.50000110A107 V110 L111 L141 L142 I148 A149A107-V145 HydrophobicContact CB-CG1 4.39Å; V110-V145 HydrophobicContact CB-CG2 4.24Å; V110-V145 HydrophobicContact CG1-CB 4.32Å; V110-V145 HydrophobicContact CG1-CG2 3.69Å; L111-V145 HydrophobicContact CD1-CG1 4.41Å; L111-V145 HydrophobicContact CD2-CG1 3.95Å; L111-V145 HydrophobicContact CD2-CG2 4.17Å; L111-V145 HydrophobicContact CG-CG1 3.71Å; L111-V145 HydrophobicContact CG-CG2 4.45Å; L141-V145 VanDerWaalsContact O-CG2 3.28Å; L141-V145 WeakPolarHBondContact O-CG2 3.34Å; L141-V145 PolarHBondContact O-N 3.4Å; L142-V145 WeakPolarHBondContact O-CB 3.44Å; L142-V145 PolarHBondContact O-N 3.48Å; V145-I148 PolarHBondContact O-N 2.93Å; V145-A149 WeakPolarHBondContact O-CB 3.35Å; V145-A149 PolarHBondContact O-N 3.36Å
146M94.3Very high92Very high55 Ų5553.7 Ų53.727%0.27129%0.293SS..Hα-helixtrans-65.2-42.8-177.8-67-61.2155.300111.8T62 V66 W103 L142 S143 M144 A149 V150T62-M146 HydrophobicContact CG2-CE 3.17Å; V66-M146 HydrophobicContact CG2-CE 4.35Å; W103-M146 HydrophobicContact CZ2-CE 4.49Å; W103-M146 HydrophobicContact CZ2-SD 3.73Å; L142-M146 VanDerWaalsContact O-CG 3.29Å; L142-M146 WeakPolarHBondContact O-CG 3.49Å; L142-M146 PolarHBondContact O-N 3.27Å; S143-M146 PolarHBondContact O-N 3.12Å; M144-M146 VanDerWaalsContact C-N 3.29Å; M144-M146 PolarHBondContact O-N 3.02Å; M146-A149 PolarHBondContact O-N 3.29Å; M146-V150 VanDerWaalsContact O-CB 3.29Å; M146-V150 WeakPolarHBondContact O-CB 3.23Å; M146-V150 WeakPolarHBondContact O-CG2 3.28Å; M146-V150 PolarHBondContact O-N 3.32Å
147A94.8Very high91.7Very high54 Ų5447 Ų4745%0.44626%0.263SS..Hα-helixtrans-62.6-44.7178.700000112.2S143 M144 T151S143-A147 VanDerWaalsContact O-CB 3.27Å; S143-A147 WeakPolarHBondContact O-CB 3.35Å; S143-A147 PolarHBondContact O-N 2.77Å; M144-A147 PolarHBondContact O-N 2.92Å; A147-T151 VanDerWaalsContact O-CB 3.25Å; A147-T151 WeakPolarHBondContact O-CB 3.45Å; A147-T151 PolarHBondContact O-N 3.39Å; A147-T151 PolarHBondContact O-OG1 3.13Å
148I92.4Very high91.3Very high61 Ų6145.2 Ų45.231%0.31326%0.259SS..Hα-helixtrans-62.1-51.2177.6-68168.2000109.9V110 M144 V145 V150 T151 N152 L203V110-I148 HydrophobicContact CG1-CD1 4.33Å; V110-I148 HydrophobicContact CG2-CG2 4.1Å; M144-I148 HydrophobicContact CG-CD1 3.77Å; M144-I148 HydrophobicContact CG-CG1 4.42Å; M144-I148 WeakPolarHBondContact O-CB 3.45Å; M144-I148 VanDerWaalsContact O-CG1 3.3Å; M144-I148 WeakPolarHBondContact O-CG1 3.38Å; M144-I148 PolarHBondContact O-N 3.43Å; M144-I148 HydrophobicContact SD-CD1 4.25Å; V145-I148 PolarHBondContact O-N 2.93Å; I148-V150 PolarHBondContact O-N 3.49Å; I148-T151 PolarHBondContact O-N 3.36Å; I148-N152 WeakPolarHBondContact O-CB 3.49Å; I148-N152 PolarHBondContact O-N 3.14Å; I148-L203 HydrophobicContact CG2-CD2 3.79Å
149A91.9Very high90.8Very high0 Ų046.8 Ų46.80%027%0.267CS..Hα-helixtrans-62.3-44.8-177.900000112.7A107 V145 M146 S153A107-A149 HydrophobicContact CB-CB 3.81Å; V145-A149 WeakPolarHBondContact O-CB 3.35Å; V145-A149 PolarHBondContact O-N 3.36Å; M146-A149 PolarHBondContact O-N 3.29Å; A149-S153 WeakPolarHBondContact O-CB 3.15Å; A149-S153 PolarHBondContact O-N 3.32Å
150V93.4Very high90.2Very high60 Ų6043.6 Ų43.636%0.36425%0.248SC..Hα-helixtrans-65.9-43.8178.61700000110.8M146 I148 S153 W154M146-V150 VanDerWaalsContact O-CB 3.29Å; M146-V150 WeakPolarHBondContact O-CB 3.23Å; M146-V150 WeakPolarHBondContact O-CG2 3.28Å; M146-V150 PolarHBondContact O-N 3.32Å; I148-V150 PolarHBondContact O-N 3.49Å; V150-S153 PolarHBondContact O-N 2.81Å; V150-W154 WeakPolarHBondContact O-CB 3.5Å; V150-W154 PolarHBondContact O-N 3.25Å
151T91.6Very high89.5Confident87 Ų8746.2 Ų46.253%0.53425%0.253SS..Hα-helixtrans-63.9-45.4179.7-56.20000110.8A147 I148 W154 V155A147-T151 VanDerWaalsContact O-CB 3.25Å; A147-T151 WeakPolarHBondContact O-CB 3.45Å; A147-T151 PolarHBondContact O-N 3.39Å; A147-T151 PolarHBondContact O-OG1 3.13Å; I148-T151 PolarHBondContact O-N 3.36Å; T151-W154 PolarHBondContact O-N 2.94Å; T151-V155 HydrophobicContact CG2-CG2 4.48Å; T151-V155 WeakPolarHBondContact O-CB 3.5Å; T151-V155 VanDerWaalsContact O-CG2 3.24Å; T151-V155 WeakPolarHBondContact O-CG2 3.11Å; T151-V155 PolarHBondContact O-N 3.17Å
152N88.9Confident88.9Confident31 Ų3155.4 Ų55.417%0.16629%0.286CS..Hα-helixtrans-57.8-53.1176.8-172.858.6000110.9I148 W154 V155 H156 L203I148-N152 WeakPolarHBondContact O-CB 3.49Å; I148-N152 PolarHBondContact O-N 3.14Å; N152-W154 PolarHBondContact O-N 2.87Å; N152-V155 PolarHBondContact O-N 2.8Å; N152-H156 PolarHBondContact O-CD2 2.96Å; N152-H156 PolarHBondContact O-N 3.46Å; N152-H156 PolarHBondContact OD1-CD2 3.05Å; N152-H156 PolarHBondContact OD1-NE2 3.42Å; N152-L203 HydrophobicContact CB-CD1 4.21Å
153S89.4Confident88Confident0 Ų054.8 Ų54.80%028%0.283CS..Hα-helixtrans-60.7-45.7179.8-175.40000112.5F99 A149 V150 V155 H156 T157F99-S153 VanDerWaalsContact C-OG 3.32Å; F99-S153 VanDerWaalsContact CA-OG 3.27Å; F99-S153 WeakPolarHBondContact CA-OG 3.23Å; F99-S153 WeakPolarHBondContact CD2-OG 3.42Å; F99-S153 WeakPolarHBondContact CG-OG 3.34Å; F99-S153 PolarHBondContact O-OG 3Å; A149-S153 WeakPolarHBondContact O-CB 3.15Å; A149-S153 PolarHBondContact O-N 3.32Å; V150-S153 PolarHBondContact O-N 2.81Å; S153-V155 VanDerWaalsContact C-N 3.33Å; S153-V155 PolarHBondContact O-N 2.96Å; S153-H156 PolarHBondContact O-N 3.26Å; S153-T157 WeakPolarHBondContact O-CB 3.34Å; S153-T157 PolarHBondContact O-N 2.71Å; S153-T157 PolarHBondContact O-OG1 2.85Å; S153-T157 VanDerWaalsContact O-OG1 3.08Å
154W90.3Very high86.9Confident171 Ų17154.8 Ų54.865%0.64828%0.28SS*.Hα-helixtrans-57-45.9177.1-179.2-80.3000112F99 V150 T151 N152 T157 A158F99-W154 HydrophobicContact CE2-CB 4.42Å; V150-W154 WeakPolarHBondContact O-CB 3.5Å; V150-W154 PolarHBondContact O-N 3.25Å; T151-W154 PolarHBondContact O-N 2.94Å; N152-W154 PolarHBondContact O-N 2.87Å; W154-T157 PolarHBondContact O-N 2.99Å; W154-A158 WeakPolarHBondContact O-CB 3.42Å; W154-A158 PolarHBondContact O-N 2.88Å
155V88Confident85.9Confident47 Ų4751 Ų5129%0.28526%0.261SS..Hα-helixtrans-61.6-47.5179169.10000110.6T151 N152 S153 A158 L159 M195T151-V155 HydrophobicContact CG2-CG2 4.48Å; T151-V155 WeakPolarHBondContact O-CB 3.5Å; T151-V155 VanDerWaalsContact O-CG2 3.24Å; T151-V155 WeakPolarHBondContact O-CG2 3.11Å; T151-V155 PolarHBondContact O-N 3.17Å; N152-V155 PolarHBondContact O-N 2.8Å; S153-V155 VanDerWaalsContact C-N 3.33Å; S153-V155 PolarHBondContact O-N 2.96Å; V155-A158 PolarHBondContact O-N 2.87Å; V155-L159 HydrophobicContact CG1-CD1 3.85Å; V155-L159 HydrophobicContact CG1-CG 4.47Å; V155-L159 WeakPolarHBondContact O-CB 3.22Å; V155-L159 WeakPolarHBondContact O-CG 2.94Å; V155-L159 PolarHBondContact O-N 2.89Å; V155-M195 HydrophobicContact CG1-CE 3.68Å
156H82.1Confident84.7Confident7 Ų754 Ų543%0.03228%0.281CS..Hα-helixtrans-63.1-46.5178.2-76.5-66.6000112.7T102 N152 S153 T160 M178 A199T102-H156 HydrophobicContact CG2-CB 4.38Å; N152-H156 PolarHBondContact O-CD2 2.96Å; N152-H156 PolarHBondContact O-N 3.46Å; N152-H156 PolarHBondContact OD1-CD2 3.05Å; N152-H156 PolarHBondContact OD1-NE2 3.42Å; S153-H156 PolarHBondContact O-N 3.26Å; H156-T160 WeakPolarHBondContact O-CB 3.49Å; H156-T160 PolarHBondContact O-N 2.94Å; H156-T160 PolarHBondContact O-OG1 2.92Å; H156-M178 HydrophobicContact CB-CE 4.16Å; H156-M178 HydrophobicContact CB-SD 3.83Å; H156-M178 PolarHBondContact ND1-SD 3.37Å; H156-A199 WeakPolarHBondContact NE2-CB 3.47Å
157T84.1Confident83.3Confident13 Ų1352.7 Ų52.78%0.0828%0.282CS..Hα-helixtrans-65.6-44.2178.3-560000111.3M95 F99 S153 W154 L159 T160 M161M95-T157 HydrophobicContact CB-CG2 4.3Å; F99-T157 WeakPolarHBondContact CA-OG1 3.39Å; F99-T157 HydrophobicContact CB-CG2 4.38Å; S153-T157 WeakPolarHBondContact O-CB 3.34Å; S153-T157 PolarHBondContact O-N 2.71Å; S153-T157 PolarHBondContact O-OG1 2.85Å; S153-T157 VanDerWaalsContact O-OG1 3.08Å; W154-T157 PolarHBondContact O-N 2.99Å; T157-L159 PolarHBondContact O-N 3.19Å; T157-T160 WeakPolarHBondContact O-CB 3.48Å; T157-T160 PolarHBondContact O-N 3.1Å; T157-M161 HydrophobicContact CG2-CG 4.45Å; T157-M161 HydrophobicContact CG2-SD 4.32Å; T157-M161 WeakPolarHBondContact O-CG 3.49Å; T157-M161 PolarHBondContact O-N 3.1Å
158A84.6Confident81.7Confident32 Ų3254.4 Ų54.426%0.26429%0.289SS..Hα-helixtrans-65.1-40.1179.600000112.4W154 V155 T160 M161 R162W154-A158 WeakPolarHBondContact O-CB 3.42Å; W154-A158 PolarHBondContact O-N 2.88Å; V155-A158 PolarHBondContact O-N 2.87Å; A158-T160 VanDerWaalsContact C-N 3.32Å; A158-M161 PolarHBondContact O-N 3.47Å; A158-R162 WeakPolarHBondContact O-CG 3.43Å; A158-R162 PolarHBondContact O-N 3.37Å
159L82.7Confident80.3Confident34 Ų3454.5 Ų54.518%0.17829%0.29CS..Hα-helixtrans-65.2-38173.8-72.9172.4000111.5V155 T157 R162 I191 N192 M195V155-L159 HydrophobicContact CG1-CD1 3.85Å; V155-L159 HydrophobicContact CG1-CG 4.47Å; V155-L159 WeakPolarHBondContact O-CB 3.22Å; V155-L159 WeakPolarHBondContact O-CG 2.94Å; V155-L159 PolarHBondContact O-N 2.89Å; T157-L159 PolarHBondContact O-N 3.19Å; L159-R162 PolarHBondContact O-N 3.04Å; L159-I191 HydrophobicContact CD1-CG2 4.39Å; L159-I191 HydrophobicContact CD2-CG2 4.02Å; L159-N192 VanDerWaalsContact C-ND2 3.27Å; L159-N192 PolarHBondContact O-ND2 2.96Å; L159-M195 HydrophobicContact CD1-CB 4.05Å; L159-M195 HydrophobicContact CD1-CG 3.76Å
160T79.1Confident78.7Confident0 Ų057 Ų570%031%0.305CS..Hα-helixtrans-66.8-40.4175.7-54.70000111.3M95 L98 H156 T157 A158 R162 L163 F165 M178 L181 N192M95-T160 HydrophobicContact CE-CG2 3.8Å; M95-T160 HydrophobicContact SD-CG2 3.87Å; L98-T160 HydrophobicContact CD2-CG2 4.05Å; H156-T160 WeakPolarHBondContact O-CB 3.49Å; H156-T160 PolarHBondContact O-N 2.94Å; H156-T160 PolarHBondContact O-OG1 2.92Å; T157-T160 WeakPolarHBondContact O-CB 3.48Å; T157-T160 PolarHBondContact O-N 3.1Å; A158-T160 VanDerWaalsContact C-N 3.32Å; T160-R162 PolarHBondContact O-N 3.37Å; T160-L163 WeakPolarHBondContact O-CB 3.48Å; T160-L163 PolarHBondContact O-N 3.25Å; T160-L163 VanDerWaalsContact O-N 3.08Å; T160-F165 HydrophobicContact CG2-CZ 4.1Å; T160-M178 WeakPolarHBondContact OG1-CE 3.49Å; T160-L181 HydrophobicContact CG2-CD1 4.2Å; T160-N192 PolarHBondContact N-ND2 3.04Å
161M80.7Confident77.2Confident107 Ų10754.2 Ų54.253%0.52729%0.288SS..Hα-helixtrans-64.9-21.8178.5-77.3-178.757.200114.1Y91 M95 T157 A158 L163Y91-M161 WeakPolarHBondContact OH-CA 2.98Å; M95-M161 HydrophobicContact CG-CG 4.03Å; M95-M161 HydrophobicContact SD-CG 3.93Å; T157-M161 HydrophobicContact CG2-CG 4.45Å; T157-M161 HydrophobicContact CG2-SD 4.32Å; T157-M161 WeakPolarHBondContact O-CG 3.49Å; T157-M161 PolarHBondContact O-N 3.1Å; A158-M161 PolarHBondContact O-N 3.47Å; M161-L163 VanDerWaalsContact C-N 3.31Å
162R80.4Confident75.7Confident210 Ų21053 Ų5379%0.79228%0.278SS*.THydrogen-bonded Turntrans-80.7-11.9176.3-72.6179.6-178.7-151.11.2113.3A158 L159 T160A158-R162 WeakPolarHBondContact O-CG 3.43Å; A158-R162 PolarHBondContact O-N 3.37Å; L159-R162 PolarHBondContact O-N 3.04Å; T160-R162 PolarHBondContact O-N 3.37Å
163L75.8Confident74.3Confident15 Ų1552.3 Ų52.38%0.07927%0.274CS..SBendtrans-76.2140.2179.8-66172.9000110.9T160 M161 F165 L182 V189T160-L163 WeakPolarHBondContact O-CB 3.48Å; T160-L163 PolarHBondContact O-N 3.25Å; T160-L163 VanDerWaalsContact O-N 3.08Å; M161-L163 VanDerWaalsContact C-N 3.31Å; L163-F165 HydrophobicContact CB-CE1 4.48Å; L163-F165 HydrophobicContact CB-CE2 4.19Å; L163-F165 HydrophobicContact CB-CZ 4.01Å; L163-F165 HydrophobicContact CD1-CZ 4.47Å; L163-L182 HydrophobicContact CD1-CD2 3.46Å; L163-L182 VanDerWaalsContact CD1-CD2 3.46Å; L163-V189 HydrophobicContact CD1-CG1 4.11Å; L163-V189 HydrophobicContact CD2-CG1 3.98Å
164T72.3Confident72.9Confident69 Ų6952.5 Ų52.542%0.42328%0.275SS..PPolyproline II helixtrans-88.3124.6164.655.50000109.6S185 C186 S187T164-S185 WeakPolarHBondContact O-CA 3.47Å; T164-S185 PolarHBondContact O-OG 3.19Å; T164-C186 PolarHBondContact O-N 3.45Å; T164-S187 PolarHBondContact N-OG 3Å; T164-S187 PolarHBondContact OG1-OG 3.28Å
165F73.7Confident71.5Confident17 Ų1744.4 Ų44.48%0.07524%0.244CC..BIsolated β-bridgetrans-95.7123.3174.3-58.9-80.7000108.3V6 F9 Y91 M95 T160 L163 L181 L184V6-F165 HydrophobicContact CB-CB 4.26Å; V6-F165 HydrophobicContact CG2-CB 3.95Å; V6-F165 WeakPolarHBondContact CG2-O 3.42Å; F9-F165 HydrophobicContact CE1-CD1 4.41Å; F9-F165 HydrophobicContact CE1-CG 4.35Å; F9-F165 HydrophobicContact CZ-CD1 4.4Å; F9-F165 HydrophobicContact CZ-CD2 4.19Å; F9-F165 HydrophobicContact CZ-CE2 4.48Å; F9-F165 HydrophobicContact CZ-CG 4.16Å; Y91-F165 HydrophobicContact CE2-CD2 4.05Å; Y91-F165 AromaticContact CE2-CE2 3.79Å; Y91-F165 HydrophobicContact CE2-CE2 3.79Å; M95-F165 HydrophobicContact CE-CZ 4.5Å; T160-F165 HydrophobicContact CG2-CZ 4.1Å; L163-F165 HydrophobicContact CB-CE1 4.48Å; L163-F165 HydrophobicContact CB-CE2 4.19Å; L163-F165 HydrophobicContact CB-CZ 4.01Å; L163-F165 HydrophobicContact CD1-CZ 4.47Å; F165-L181 HydrophobicContact CE1-CB 4.43Å; F165-L181 HydrophobicContact CE1-CD2 3.81Å; F165-L181 WeakPolarHBondContact CE1-O 3.12Å; F165-L181 HydrophobicContact CZ-CD2 3.95Å; F165-L184 HydrophobicContact CD1-CB 4.18Å
166C67.5Low70.3Confident63 Ų6342.1 Ų42.143%0.42623%0.231SC..  trans-146.28.7176.926.40000113.4C186C166-C186 VanDerWaalsContact C-SG 3.56Å; C166-C186 WeakPolarHBondContact CA-SG 3.24Å; C166-C186 HydrophobicContact CB-CB 4.37Å; C166-C186 WeakPolarHBondContact CB-SG 3.47Å; C166-C186 PolarHBondContact N-SG 3.32Å; C166-C186 WeakPolarHBondContact SG-CB 3.33Å; C166-C186 CovalentContact SG-SG 2.02Å; C166-C186 PolarHBondContact SG-SG 2.99Å
167G64.6Low69.5Low28 Ų2843.4 Ų43.429%0.28924%0.237SC..SBendtrans-72.9-177.9161.300000112.4N169 L184G167-N169 PolarHBondContact O-N 3.49Å; G167-L184 PolarHBondContact N-O 3.17Å
168P61.3Low68.5Low91 Ų9143.4 Ų43.459%0.59124%0.236SC*.  trans-58.7137.5173.425.3-32.6000110.1T170 L184P168-T170 PolarHBondContact O-N 2.95Å; P168-L184 HydrophobicContact CG-CD2 4.41Å; P168-L184 WeakPolarHBondContact O-CD2 3.2Å
169N63.3Low67.4Low62 Ų6245.8 Ų45.833%0.33225%0.249SC..SBendtrans-70.325.5-177.8-66.7-3.8000113.6V6 E8 F9 I10 G167V6-N169 HydrophobicContact CG1-CB 4.38Å; V6-N169 WeakPolarHBondContact CG1-OD1 2.96Å; V6-N169 WeakPolarHBondContact CG2-OD1 3.35Å; E8-N169 WeakPolarHBondContact O-CB 3.5Å; E8-N169 PolarHBondContact O-ND2 3.24Å; F9-N169 CarbonylContact C-O 3.51Å; F9-N169 WeakPolarHBondContact CA-O 3.24Å; I10-N169 PolarHBondContact N-O 3.07Å; G167-N169 PolarHBondContact O-N 3.49Å
170T59.1Low66.2Low54 Ų5444.9 Ų44.933%0.33125%0.245SC..EExtended strand (participates in β ladder)trans-106.8115-173.951.20000110.7I10 L12 P168I10-T170 HydrophobicContact CB-CG2 4.19Å; I10-T170 HydrophobicContact CD1-CG2 4.34Å; I10-T170 CarbonylContact O-C 3.5Å; I10-T170 WeakPolarHBondContact O-CA 3.33Å; L12-T170 HydrophobicContact CD1-CG2 4.06Å; P168-T170 PolarHBondContact O-N 2.95Å
171I61.4Low65.4Low1 Ų145 Ų451%0.00525%0.245CC..EExtended strand (participates in β ladder)trans-90.5110171-61.9174.1000107.2F9 I10 L12 H173 P180 L184F9-I171 HydrophobicContact CB-CD1 3.63Å; F9-I171 HydrophobicContact CB-CG1 4.13Å; F9-I171 HydrophobicContact CD1-CD1 4Å; F9-I171 HydrophobicContact CD1-CG1 4.19Å; F9-I171 HydrophobicContact CD2-CD1 4.4Å; F9-I171 HydrophobicContact CG-CD1 3.78Å; F9-I171 HydrophobicContact CG-CG1 4.37Å; I10-I171 PolarHBondContact O-N 3.27Å; L12-I171 PolarHBondContact N-O 3.36Å; I171-H173 HydrophobicContact CG2-CB 3.81Å; I171-H173 PolarHBondContact O-N 2.99Å; I171-P180 HydrophobicContact CG2-CB 4.05Å; I171-L184 HydrophobicContact CG1-CD1 3.75Å
172D59.4Low64.5Low61 Ų6140.7 Ų40.733%0.32623%0.225SC..  trans-79.754.4175.3-168.430.5000111.9F265 K269D172-F265 HydrophobicContact CB-CE1 4.03Å; D172-K269 WeakPolarHBondContact O-CE 3.23Å; D172-K269 PolarHBondContact O-NZ 3.45Å; D172-K269 IonicContact OD1-NZ 3.62Å; D172-K269 PolarHBondContact OD1-NZ 3Å; D172-K269 IonicContact OD2-NZ 3.28Å; D172-K269 PolarHBondContact OD2-NZ 3.26Å
173H60.9Low63.6Low16 Ų1634.8 Ų34.87%0.07422%0.22CC..SBendtrans-145.6169.7178.2-125.7-105.9000109.9I11 I171 F175 E177 P180I11-H173 WeakPolarHBondContact CG2-O 3.34Å; I171-H173 HydrophobicContact CG2-CB 3.81Å; I171-H173 PolarHBondContact O-N 2.99Å; H173-F175 AromaticContact CE1-CE1 3.91Å; H173-F175 AromaticContact ND1-CD1 3.73Å; H173-F175 AromaticContact ND1-CE1 3.53Å; H173-E177 IonicContact CE1-OE2 3.34Å; H173-E177 PolarHBondContact CE1-OE2 2.68Å; H173-E177 VanDerWaalsContact CE1-OE2 3.28Å; H173-E177 IonicContact ND1-OE2 2.67Å; H173-P180 HydrophobicContact CB-CB 4.45Å; H173-P180 HydrophobicContact CB-CG 4.08Å
174F60.2Low63Low4 Ų435 Ų352%0.01822%0.221CC..SBendtrans-89.7-4179.356.9-85.8000113.7L14 M78 A273L14-F174 HydrophobicContact CD1-CB 3.43Å; L14-F174 VanDerWaalsContact CD1-CB 3.43Å; L14-F174 HydrophobicContact CD1-CD1 4.35Å; L14-F174 HydrophobicContact CD1-CD2 4.41Å; L14-F174 HydrophobicContact CD1-CG 3.85Å; L14-F174 HydrophobicContact CD2-CD1 4.48Å; L14-F174 HydrophobicContact CG-CB 3.92Å; L14-F174 HydrophobicContact CG-CD1 4.22Å; L14-F174 HydrophobicContact CG-CG 4.2Å; M78-F174 HydrophobicContact CG-CB 4.21Å; M78-F174 HydrophobicContact SD-CB 4.11Å; M78-F174 HydrophobicContact SD-CD2 3.56Å; M78-F174 VanDerWaalsContact SD-CD2 3.56Å; M78-F174 HydrophobicContact SD-CE2 4.41Å; M78-F174 HydrophobicContact SD-CG 4.21Å; F174-A273 HydrophobicContact CZ-CB 4.4Å
175F60.7Low62.8Low1 Ų132.7 Ų32.70%0.00421%0.208CC..SBendtrans-158165.4-176.574.3-81.1000110.5I74 Q97 F101 H173 E177I74-F175 HydrophobicContact CG2-CB 3.97Å; I74-F175 HydrophobicContact CG2-CG 4.37Å; Q97-F175 VanDerWaalsContact NE2-CB 3.27Å; F101-F175 AromaticContact CD1-CE2 3.93Å; F101-F175 HydrophobicContact CD1-CE2 3.93Å; F101-F175 AromaticContact CE1-CE2 3.6Å; F101-F175 HydrophobicContact CE1-CE2 3.6Å; F101-F175 HydrophobicContact CE1-CZ 4.18Å; F101-F175 AromaticContact CZ-CE2 3.98Å; F101-F175 HydrophobicContact CZ-CE2 3.98Å; F101-F175 HydrophobicContact CZ-CZ 4.27Å; H173-F175 AromaticContact CE1-CE1 3.91Å; H173-F175 AromaticContact ND1-CD1 3.73Å; H173-F175 AromaticContact ND1-CE1 3.53Å; F175-E177 HydrophobicContact CD2-CB 4.06Å; F175-E177 HydrophobicContact CE2-CB 3.58Å; F175-E177 HydrophobicContact CE2-CG 3.65Å; F175-E177 HydrophobicContact CZ-CB 3.92Å; F175-E177 VanDerWaalsContact CZ-CD 3.43Å; F175-E177 HydrophobicContact CZ-CG 3.83Å; F175-E177 WeakPolarHBondContact CZ-OE2 3.46Å; F175-E177 PolarHBondContact O-N 3.44Å
176C62.3Low62.7Low0 Ų035.6 Ų35.60%023%0.23CC..  trans-78107.7177-169.90000109.8C94 Q97 L181C94-C176 WeakPolarHBondContact CA-SG 3.2Å; C94-C176 HydrophobicContact CB-CB 4.02Å; C94-C176 WeakPolarHBondContact CB-SG 3.27Å; C94-C176 PolarHBondContact O-SG 3.11Å; C94-C176 WeakPolarHBondContact SG-CB 3.22Å; C94-C176 CovalentContact SG-SG 2.03Å; C94-C176 PolarHBondContact SG-SG 2.93Å; Q97-C176 HydrophobicContact CB-CB 4.47Å; C176-L181 WeakPolarHBondContact SG-CD1 3.49Å
177E65.4Low63Low33 Ų3334.1 Ų34.115%0.15422%0.22CC..  trans-127.4153.2-179.4-159.1-177.4-17900110.7F101 H173 F175 P180 L181F101-E177 HydrophobicContact CE1-CG 4.35Å; H173-E177 IonicContact CE1-OE2 3.34Å; H173-E177 PolarHBondContact CE1-OE2 2.68Å; H173-E177 VanDerWaalsContact CE1-OE2 3.28Å; H173-E177 IonicContact ND1-OE2 2.67Å; F175-E177 HydrophobicContact CD2-CB 4.06Å; F175-E177 HydrophobicContact CE2-CB 3.58Å; F175-E177 HydrophobicContact CE2-CG 3.65Å; F175-E177 HydrophobicContact CZ-CB 3.92Å; F175-E177 VanDerWaalsContact CZ-CD 3.43Å; F175-E177 HydrophobicContact CZ-CG 3.83Å; F175-E177 WeakPolarHBondContact CZ-OE2 3.46Å; F175-E177 PolarHBondContact O-N 3.44Å; E177-P180 HydrophobicContact CB-CG 4.3Å; E177-P180 WeakPolarHBondContact O-CD 3.25Å; E177-L181 WeakPolarHBondContact O-CB 3.34Å; E177-L181 WeakPolarHBondContact O-CD1 3.33Å; E177-L181 PolarHBondContact O-N 2.83Å
178M62Low63.4Low14 Ų1438.2 Ų38.27%0.06924%0.242CC..Hα-helixtrans-58.2-52.6-176.6-71.5-157.991.700113.7L98 H156 T160 L181 L182 N192 V196L98-M178 HydrophobicContact CD1-CG 3.69Å; L98-M178 HydrophobicContact CD2-CG 4.22Å; L98-M178 HydrophobicContact CG-CG 4.49Å; H156-M178 HydrophobicContact CB-CE 4.16Å; H156-M178 HydrophobicContact CB-SD 3.83Å; H156-M178 PolarHBondContact ND1-SD 3.37Å; T160-M178 WeakPolarHBondContact OG1-CE 3.49Å; M178-L181 WeakPolarHBondContact O-CB 3.06Å; M178-L181 PolarHBondContact O-N 3.43Å; M178-L182 VanDerWaalsContact O-CG 3.31Å; M178-L182 WeakPolarHBondContact O-CG 3.48Å; M178-L182 PolarHBondContact O-N 3.48Å; M178-N192 HydrophobicContact CE-CB 4.41Å; M178-V196 HydrophobicContact CE-CG2 4.35Å; M178-V196 HydrophobicContact SD-CG2 3.58Å; M178-V196 VanDerWaalsContact SD-CG2 3.58Å
179P61.6Low64.1Low81 Ų8135.1 Ų35.153%0.52622%0.221SC..Hα-helixtrans-60.7-43.5-172.8-18.430.2000113.7L181 L182 A183P179-L181 PolarHBondContact O-N 2.97Å; P179-L182 PolarHBondContact O-N 3.44Å; P179-A183 PolarHBondContact O-N 2.71Å
180P57.5Low64.6Low16 Ų1641.5 Ų41.510%0.10424%0.241CC..Hα-helixtrans-62.9-34.8171.9-23.433.6000114.3I171 H173 E177 L184I171-P180 HydrophobicContact CG2-CB 4.05Å; H173-P180 HydrophobicContact CB-CB 4.45Å; H173-P180 HydrophobicContact CB-CG 4.08Å; E177-P180 HydrophobicContact CB-CG 4.3Å; E177-P180 WeakPolarHBondContact O-CD 3.25Å; P180-L184 WeakPolarHBondContact O-CG 3.46Å
181L64Low65.4Low1 Ų144.4 Ų44.41%0.00525%0.253CS..Hα-helixtrans-68.5-44.4176-89161.5000112F9 M95 L98 T160 F165 C176 E177 M178 P179 A183 L184F9-L181 HydrophobicContact CE1-CD2 4.33Å; F9-L181 HydrophobicContact CE2-CD2 4.36Å; F9-L181 HydrophobicContact CZ-CD2 3.99Å; M95-L181 HydrophobicContact CE-CD1 4.45Å; M95-L181 HydrophobicContact CE-CD2 4.22Å; L98-L181 HydrophobicContact CD2-CD1 4.18Å; T160-L181 HydrophobicContact CG2-CD1 4.2Å; F165-L181 HydrophobicContact CE1-CB 4.43Å; F165-L181 HydrophobicContact CE1-CD2 3.81Å; F165-L181 WeakPolarHBondContact CE1-O 3.12Å; F165-L181 HydrophobicContact CZ-CD2 3.95Å; C176-L181 WeakPolarHBondContact SG-CD1 3.49Å; E177-L181 WeakPolarHBondContact O-CB 3.34Å; E177-L181 WeakPolarHBondContact O-CD1 3.33Å; E177-L181 PolarHBondContact O-N 2.83Å; M178-L181 WeakPolarHBondContact O-CB 3.06Å; M178-L181 PolarHBondContact O-N 3.43Å; P179-L181 PolarHBondContact O-N 2.97Å; L181-A183 VanDerWaalsContact C-N 3.27Å; L181-A183 PolarHBondContact O-N 3.46Å; L181-L184 WeakPolarHBondContact O-CB 3.38Å; L181-L184 PolarHBondContact O-N 2.89Å; L181-L184 VanDerWaalsContact O-N 3.07Å
182L60.5Low66.1Low18 Ų1844.7 Ų44.79%0.09425%0.254CS..Hα-helixtrans-61.1-37.7-179.8-65.8177.1000111.4L163 M178 P179 L184 S185 V189 N192 E193L163-L182 HydrophobicContact CD1-CD2 3.46Å; L163-L182 VanDerWaalsContact CD1-CD2 3.46Å; M178-L182 VanDerWaalsContact O-CG 3.31Å; M178-L182 WeakPolarHBondContact O-CG 3.48Å; M178-L182 PolarHBondContact O-N 3.48Å; P179-L182 PolarHBondContact O-N 3.44Å; L182-L184 PolarHBondContact O-N 2.89Å; L182-S185 PolarHBondContact O-N 3.47Å; L182-V189 HydrophobicContact CB-CB 4.34Å; L182-V189 HydrophobicContact CB-CG1 4.09Å; L182-V189 HydrophobicContact CD2-CB 4.02Å; L182-V189 HydrophobicContact CD2-CG1 3.82Å; L182-N192 HydrophobicContact CD1-CB 4.11Å; L182-N192 HydrophobicContact CD2-CB 3.54Å; L182-N192 HydrophobicContact CG-CB 4.49Å; L182-E193 HydrophobicContact CD1-CG 4.27Å
183A63Low66.7Low85 Ų8546.2 Ų46.270%0.70226%0.26SS*.THydrogen-bonded Turntrans-63.3-20.1176.700000114.2P179 L181P179-A183 PolarHBondContact O-N 2.71Å; L181-A183 VanDerWaalsContact C-N 3.27Å; L181-A183 PolarHBondContact O-N 3.46Å
184L61.3Low67.3Low19 Ų1949.3 Ų49.310%0.09928%0.28CS..THydrogen-bonded Turntrans-92.1-7.3180-66.9171000113.4F165 G167 P168 I171 P180 L181 L182F165-L184 HydrophobicContact CD1-CB 4.18Å; G167-L184 PolarHBondContact N-O 3.17Å; P168-L184 HydrophobicContact CG-CD2 4.41Å; P168-L184 WeakPolarHBondContact O-CD2 3.2Å; I171-L184 HydrophobicContact CG1-CD1 3.75Å; P180-L184 WeakPolarHBondContact O-CG 3.46Å; L181-L184 WeakPolarHBondContact O-CB 3.38Å; L181-L184 PolarHBondContact O-N 2.89Å; L181-L184 VanDerWaalsContact O-N 3.07Å; L182-L184 PolarHBondContact O-N 2.89Å
185S69.1Low68.1Low21 Ų2152.3 Ų52.315%0.14729%0.294CS..BIsolated β-bridgetrans-81.2142.7-178.2-170.50000112.2T164 L182 S187T164-S185 WeakPolarHBondContact O-CA 3.47Å; T164-S185 PolarHBondContact O-OG 3.19Å; L182-S185 PolarHBondContact O-N 3.47Å; S185-S187 PolarHBondContact OG-N 2.89Å; S185-S187 PolarHBondContact OG-O 3.46Å
186C71.3Confident68.6Low78 Ų7854 Ų5453%0.52731%0.305SS..SBendtrans-97.4-5.4165.6-37.60000112.8T164 C166T164-C186 PolarHBondContact O-N 3.45Å; C166-C186 VanDerWaalsContact C-SG 3.56Å; C166-C186 WeakPolarHBondContact CA-SG 3.24Å; C166-C186 HydrophobicContact CB-CB 4.37Å; C166-C186 WeakPolarHBondContact CB-SG 3.47Å; C166-C186 PolarHBondContact N-SG 3.32Å; C166-C186 WeakPolarHBondContact SG-CB 3.33Å; C166-C186 CovalentContact SG-SG 2.02Å; C166-C186 PolarHBondContact SG-SG 2.99Å
187S74.3Confident69.1Low32 Ų3261.4 Ų61.422%0.22433%0.334CS..SBendtrans-82153.1172.1-78.20000110T164 S185 V189T164-S187 PolarHBondContact N-OG 3Å; T164-S187 PolarHBondContact OG1-OG 3.28Å; S185-S187 PolarHBondContact OG-N 2.89Å; S185-S187 PolarHBondContact OG-O 3.46Å; S187-V189 PolarHBondContact O-N 3.36Å; S187-V189 VanDerWaalsContact O-N 3.1Å
188P72.8Confident69.6Low115 Ų11563.1 Ų63.175%0.74735%0.346SS*.  trans-62.5115.6175.525.4-33000110.6R190P188-R190 VanDerWaalsContact C-N 3.33Å
189V76.4Confident70.3Confident26 Ų2663 Ų6316%0.15835%0.347CS..  trans-86.70.8-178.2-67.60000114.5L163 L182 S187 I191 N192 E193L163-V189 HydrophobicContact CD1-CG1 4.11Å; L163-V189 HydrophobicContact CD2-CG1 3.98Å; L182-V189 HydrophobicContact CB-CB 4.34Å; L182-V189 HydrophobicContact CB-CG1 4.09Å; L182-V189 HydrophobicContact CD2-CB 4.02Å; L182-V189 HydrophobicContact CD2-CG1 3.82Å; S187-V189 PolarHBondContact O-N 3.36Å; S187-V189 VanDerWaalsContact O-N 3.1Å; V189-I191 VanDerWaalsContact C-N 3.26Å; V189-I191 PolarHBondContact O-N 3.44Å; V189-I191 VanDerWaalsContact O-N 3.13Å; V189-N192 WeakPolarHBondContact O-CA 3.25Å; V189-N192 WeakPolarHBondContact O-CB 3.2Å; V189-N192 PolarHBondContact O-N 3.46Å; V189-E193 HydrophobicContact CG2-CG 4.35Å; V189-E193 PolarHBondContact O-N 3.27Å
190R73.1Confident70.8Confident196 Ų19661.1 Ų61.174%0.7433%0.333SS*.Hα-helixtrans-55.8-36-171.3-168.9172.2-179.4177.40.1113.9P188 V194P188-R190 VanDerWaalsContact C-N 3.33Å; R190-V194 WeakPolarHBondContact O-CB 3.31Å; R190-V194 WeakPolarHBondContact O-CG2 3.12Å; R190-V194 PolarHBondContact O-N 3.39Å
191I76.1Confident71.6Confident114 Ų11465.1 Ų65.159%0.58535%0.352SS*.Hα-helixtrans-68.1-42.3176.9-64.5173.5000110.3L159 V189 V194 M195L159-I191 HydrophobicContact CD1-CG2 4.39Å; L159-I191 HydrophobicContact CD2-CG2 4.02Å; V189-I191 VanDerWaalsContact C-N 3.26Å; V189-I191 PolarHBondContact O-N 3.44Å; V189-I191 VanDerWaalsContact O-N 3.13Å; I191-V194 PolarHBondContact O-N 2.92Å; I191-M195 HydrophobicContact CG2-CG 4.34Å; I191-M195 WeakPolarHBondContact O-CB 3.34Å; I191-M195 VanDerWaalsContact O-CG 3.22Å; I191-M195 WeakPolarHBondContact O-CG 3.27Å; I191-M195 PolarHBondContact O-N 2.87Å
192N75.2Confident72.2Confident7 Ų769 Ų694%0.03738%0.376CS..Hα-helixtrans-64.1-44.8178.3-60.749.2000110.7L159 T160 M178 L182 V189 M195 V196L159-N192 VanDerWaalsContact C-ND2 3.27Å; L159-N192 PolarHBondContact O-ND2 2.96Å; T160-N192 PolarHBondContact N-ND2 3.04Å; M178-N192 HydrophobicContact CE-CB 4.41Å; L182-N192 HydrophobicContact CD1-CB 4.11Å; L182-N192 HydrophobicContact CD2-CB 3.54Å; L182-N192 HydrophobicContact CG-CB 4.49Å; V189-N192 WeakPolarHBondContact O-CA 3.25Å; V189-N192 WeakPolarHBondContact O-CB 3.2Å; V189-N192 PolarHBondContact O-N 3.46Å; N192-M195 PolarHBondContact O-N 3.06Å; N192-V196 VanDerWaalsContact O-CG2 3.3Å; N192-V196 WeakPolarHBondContact O-CG2 3.34Å; N192-V196 PolarHBondContact O-N 3.11Å
193E72.6Confident73Confident94 Ų9469.2 Ų69.244%0.43938%0.378SS..Hα-helixtrans-60.3-48.6176.4-68.4178.2153.400111.7L182 V189 M195 V196 Y197L182-E193 HydrophobicContact CD1-CG 4.27Å; V189-E193 HydrophobicContact CG2-CG 4.35Å; V189-E193 PolarHBondContact O-N 3.27Å; E193-M195 VanDerWaalsContact C-N 3.3Å; E193-M195 PolarHBondContact O-N 3.05Å; E193-V196 PolarHBondContact O-N 2.9Å; E193-Y197 WeakPolarHBondContact O-CD2 3.2Å; E193-Y197 PolarHBondContact O-N 3.28Å
194V73.5Confident73.5Confident81 Ų8165.5 Ų65.549%0.49135%0.347SS..Hα-helixtrans-60.1-42.4177.4169.70000111R190 I191 Y197 V198R190-V194 WeakPolarHBondContact O-CB 3.31Å; R190-V194 WeakPolarHBondContact O-CG2 3.12Å; R190-V194 PolarHBondContact O-N 3.39Å; I191-V194 PolarHBondContact O-N 2.92Å; V194-Y197 PolarHBondContact O-N 2.86Å; V194-V198 HydrophobicContact CG1-CG2 4.34Å; V194-V198 WeakPolarHBondContact O-CB 3.29Å; V194-V198 VanDerWaalsContact O-CG2 3.26Å; V194-V198 WeakPolarHBondContact O-CG2 3.42Å; V194-V198 PolarHBondContact O-N 3.26Å
195M76.6Confident74.2Confident67 Ų6768.9 Ų68.933%0.3336%0.364SS..Hα-helixtrans-67.3-36.5178.8-72.4-59.8-64.700112.6V155 L159 I191 N192 E193 V198 A199V155-M195 HydrophobicContact CG1-CE 3.68Å; L159-M195 HydrophobicContact CD1-CB 4.05Å; L159-M195 HydrophobicContact CD1-CG 3.76Å; I191-M195 HydrophobicContact CG2-CG 4.34Å; I191-M195 WeakPolarHBondContact O-CB 3.34Å; I191-M195 VanDerWaalsContact O-CG 3.22Å; I191-M195 WeakPolarHBondContact O-CG 3.27Å; I191-M195 PolarHBondContact O-N 2.87Å; N192-M195 PolarHBondContact O-N 3.06Å; E193-M195 VanDerWaalsContact C-N 3.3Å; E193-M195 PolarHBondContact O-N 3.05Å; M195-V198 PolarHBondContact O-N 3.49Å; M195-A199 WeakPolarHBondContact O-CB 3.36Å; M195-A199 PolarHBondContact O-N 3.35Å
196V72.6Confident74.7Confident37 Ų3769 Ų6922%0.22437%0.369CS..Hα-helixtrans-61.4-50.4171.81700000110.2M178 N192 E193 V198 A199 D200M178-V196 HydrophobicContact CE-CG2 4.35Å; M178-V196 HydrophobicContact SD-CG2 3.58Å; M178-V196 VanDerWaalsContact SD-CG2 3.58Å; N192-V196 VanDerWaalsContact O-CG2 3.3Å; N192-V196 WeakPolarHBondContact O-CG2 3.34Å; N192-V196 PolarHBondContact O-N 3.11Å; E193-V196 PolarHBondContact O-N 2.9Å; V196-V198 VanDerWaalsContact C-N 3.31Å; V196-V198 PolarHBondContact O-N 2.89Å; V196-A199 PolarHBondContact O-N 3.27Å; V196-A199 VanDerWaalsContact O-N 3.13Å; V196-D200 WeakPolarHBondContact CG1-OD2 3.46Å; V196-D200 PolarHBondContact O-N 3.42Å
197Y71.8Confident75.2Confident155 Ų15565.9 Ų65.961%0.60835%0.347SS*.Hα-helixtrans-58.5-41.7176.4-84-66.9000113.1E193 V194 D200 I201E193-Y197 WeakPolarHBondContact O-CD2 3.2Å; E193-Y197 PolarHBondContact O-N 3.28Å; V194-Y197 PolarHBondContact O-N 2.86Å; Y197-D200 PolarHBondContact O-N 3.33Å; Y197-I201 WeakPolarHBondContact O-CB 3.49Å; Y197-I201 VanDerWaalsContact O-CG1 3.24Å; Y197-I201 WeakPolarHBondContact O-CG1 3.17Å; Y197-I201 PolarHBondContact O-N 2.85Å
198V76.6Confident75.3Confident69 Ų6966.3 Ų66.342%0.41835%0.345SS..Hα-helixtrans-64.8-44.2176.8170.10000110.6V194 M195 V196 I201 T202V194-V198 HydrophobicContact CG1-CG2 4.34Å; V194-V198 WeakPolarHBondContact O-CB 3.29Å; V194-V198 VanDerWaalsContact O-CG2 3.26Å; V194-V198 WeakPolarHBondContact O-CG2 3.42Å; V194-V198 PolarHBondContact O-N 3.26Å; M195-V198 PolarHBondContact O-N 3.49Å; V196-V198 VanDerWaalsContact C-N 3.31Å; V196-V198 PolarHBondContact O-N 2.89Å; V198-I201 PolarHBondContact O-N 3.14Å; V198-T202 HydrophobicContact CG1-CG2 4.24Å; V198-T202 WeakPolarHBondContact O-CB 3.45Å; V198-T202 VanDerWaalsContact O-CG2 3.3Å; V198-T202 WeakPolarHBondContact O-CG2 3.38Å; V198-T202 PolarHBondContact O-N 2.99Å; V198-T202 PolarHBondContact O-OG1 3.36Å
199A76.4Confident75.6Confident11 Ų1165.6 Ų65.69%0.09133%0.333CS..Hα-helixtrans-62.1-44.2176.500000111.5H156 M195 V196 I201 T202 L203H156-A199 WeakPolarHBondContact NE2-CB 3.47Å; M195-A199 WeakPolarHBondContact O-CB 3.36Å; M195-A199 PolarHBondContact O-N 3.35Å; V196-A199 PolarHBondContact O-N 3.27Å; V196-A199 VanDerWaalsContact O-N 3.13Å; A199-I201 PolarHBondContact O-N 3.48Å; A199-T202 PolarHBondContact O-N 2.9Å; A199-T202 PolarHBondContact O-OG1 3.21Å; A199-L203 WeakPolarHBondContact O-CA 3.32Å; A199-L203 VanDerWaalsContact O-CB 3.26Å; A199-L203 WeakPolarHBondContact O-CB 3.47Å; A199-L203 PolarHBondContact O-N 3.22Å
200D72.8Confident76Confident41 Ų4168.8 Ų68.822%0.21935%0.348CS..Iπ-helixtrans-62.1-43.3177-70.6-40.8000112V196 Y197 A204 I205 Y256V196-D200 WeakPolarHBondContact CG1-OD2 3.46Å; V196-D200 PolarHBondContact O-N 3.42Å; Y197-D200 PolarHBondContact O-N 3.33Å; D200-A204 WeakPolarHBondContact O-CA 3.34Å; D200-A204 WeakPolarHBondContact O-CB 3.32Å; D200-A204 PolarHBondContact O-N 3.34Å; D200-I205 PolarHBondContact O-N 3.17Å; D200-I205 VanDerWaalsContact O-N 3.1Å; D200-Y256 PolarHBondContact OD1-OH 3.07Å; D200-Y256 VanDerWaalsContact OD1-OH 3.04Å; D200-Y256 PolarHBondContact OD2-OH 3.09Å
201I74.6Confident76.3Confident100 Ų10059.5 Ų59.551%0.51331%0.313SS..Iπ-helixtrans-67.5-44.4177.9-68.6167.5000110.8Y197 V198 A199 I205 G206Y197-I201 WeakPolarHBondContact O-CB 3.49Å; Y197-I201 VanDerWaalsContact O-CG1 3.24Å; Y197-I201 WeakPolarHBondContact O-CG1 3.17Å; Y197-I201 PolarHBondContact O-N 2.85Å; V198-I201 PolarHBondContact O-N 3.14Å; A199-I201 PolarHBondContact O-N 3.48Å; I201-I205 HydrophobicContact CG1-CD1 4.21Å; I201-I205 WeakPolarHBondContact O-CB 3.46Å; I201-G206 PolarHBondContact O-N 3.33Å; I201-G206 VanDerWaalsContact O-N 3.17Å
202T76Confident76.5Confident82 Ų8261.2 Ų61.250%0.50331%0.313SS..Iπ-helixtrans-77.2-46.5-173.451.70000112.6V198 A199 G206V198-T202 HydrophobicContact CG1-CG2 4.24Å; V198-T202 WeakPolarHBondContact O-CB 3.45Å; V198-T202 VanDerWaalsContact O-CG2 3.3Å; V198-T202 WeakPolarHBondContact O-CG2 3.38Å; V198-T202 PolarHBondContact O-N 2.99Å; V198-T202 PolarHBondContact O-OG1 3.36Å; A199-T202 PolarHBondContact O-N 2.9Å; A199-T202 PolarHBondContact O-OG1 3.21Å; T202-G206 WeakPolarHBondContact O-CA 3.41Å; T202-G206 PolarHBondContact O-N 3.24Å
203L77.4Confident76.8Confident24 Ų2465.4 Ų65.413%0.12633%0.334CS..Iπ-helixtrans-82.5-64179.8-60.8175.3000110M109 V110 I148 N152 A199 D207M109-L203 HydrophobicContact SD-CB 4.4Å; V110-L203 HydrophobicContact CG2-CD2 4.38Å; I148-L203 HydrophobicContact CG2-CD2 3.79Å; N152-L203 HydrophobicContact CB-CD1 4.21Å; A199-L203 WeakPolarHBondContact O-CA 3.32Å; A199-L203 VanDerWaalsContact O-CB 3.26Å; A199-L203 WeakPolarHBondContact O-CB 3.47Å; A199-L203 PolarHBondContact O-N 3.22Å; L203-D207 WeakPolarHBondContact O-CB 3.48Å; L203-D207 PolarHBondContact O-N 3.1Å
204A73Confident77.3Confident7 Ų761.8 Ų61.86%0.05832%0.319CS..Iπ-helixtrans-66.6-49.1-171.400000113M109 D200 F208M109-A204 HydrophobicContact CE-CB 3.99Å; M109-A204 HydrophobicContact SD-CB 3.91Å; D200-A204 WeakPolarHBondContact O-CA 3.34Å; D200-A204 WeakPolarHBondContact O-CB 3.32Å; D200-A204 PolarHBondContact O-N 3.34Å; A204-F208 WeakPolarHBondContact O-CB 3.33Å; A204-F208 PolarHBondContact O-N 3.03Å
205I75.9Confident77.5Confident89 Ų8958.3 Ų58.346%0.45630%0.297SS..Iπ-helixtrans-75.4-41.3179.8-54.2177.3000110.8D200 I201 F208 M209D200-I205 PolarHBondContact O-N 3.17Å; D200-I205 VanDerWaalsContact O-N 3.1Å; I201-I205 HydrophobicContact CG1-CD1 4.21Å; I201-I205 WeakPolarHBondContact O-CB 3.46Å; I205-F208 PolarHBondContact O-N 2.67Å; I205-M209 HydrophobicContact CG2-CE 4.3Å; I205-M209 HydrophobicContact CG2-CG 4.22Å; I205-M209 WeakPolarHBondContact O-CB 3.33Å; I205-M209 VanDerWaalsContact O-CG 3.24Å; I205-M209 WeakPolarHBondContact O-CG 3.42Å; I205-M209 PolarHBondContact O-N 3.45Å
206G80.3Confident77.7Confident25 Ų2556.8 Ų56.826%0.25830%0.299SS..Hα-helixtrans-60.1-53.2178.500000112.8I201 T202 F208 M209 L210I201-G206 PolarHBondContact O-N 3.33Å; I201-G206 VanDerWaalsContact O-N 3.17Å; T202-G206 WeakPolarHBondContact O-CA 3.41Å; T202-G206 PolarHBondContact O-N 3.24Å; G206-F208 VanDerWaalsContact C-N 3.31Å; G206-F208 PolarHBondContact O-N 3.14Å; G206-M209 PolarHBondContact O-N 2.84Å; G206-L210 WeakPolarHBondContact O-CG 3.44Å; G206-L210 PolarHBondContact O-N 3.49Å
207D80.8Confident78.1Confident12 Ų1260.4 Ų60.46%0.06431%0.312CS..Hα-helixtrans-62.6-39.1178-76.4-43.1000111.8M109 T113 L203 M209 L210 T211 Y249M109-D207 HydrophobicContact CB-CB 4.42Å; T113-D207 WeakPolarHBondContact OG1-CA 2.87Å; T113-D207 WeakPolarHBondContact OG1-CB 3.49Å; T113-D207 VanDerWaalsContact OG1-CG 3.26Å; T113-D207 PolarHBondContact OG1-O 3.41Å; T113-D207 PolarHBondContact OG1-OD1 3.19Å; L203-D207 WeakPolarHBondContact O-CB 3.48Å; L203-D207 PolarHBondContact O-N 3.1Å; D207-M209 PolarHBondContact O-N 3.28Å; D207-L210 PolarHBondContact O-N 2.99Å; D207-T211 VanDerWaalsContact O-CB 3.26Å; D207-T211 WeakPolarHBondContact O-CB 3.49Å; D207-T211 PolarHBondContact O-N 3.43Å; D207-T211 PolarHBondContact O-OG1 3.4Å; D207-Y249 WeakPolarHBondContact CB-OH 3.14Å
208F77.1Confident78.6Confident41 Ų4153 Ų5318%0.1828%0.283CS..Hα-helixtrans-59.9-48.5174.3-178.1-112.4000111.8A204 I205 G206 T211 R212 Y249 I253A204-F208 WeakPolarHBondContact O-CB 3.33Å; A204-F208 PolarHBondContact O-N 3.03Å; I205-F208 PolarHBondContact O-N 2.67Å; G206-F208 VanDerWaalsContact C-N 3.31Å; G206-F208 PolarHBondContact O-N 3.14Å; F208-T211 PolarHBondContact O-N 3.25Å; F208-R212 HydrophobicContact CD1-CG 4.2Å; F208-R212 HydrophobicContact CD2-CG 4.26Å; F208-R212 HydrophobicContact CE1-CG 3.86Å; F208-R212 HydrophobicContact CE2-CG 3.95Å; F208-R212 HydrophobicContact CG-CG 4.4Å; F208-R212 HydrophobicContact CZ-CG 3.74Å; F208-R212 WeakPolarHBondContact O-CB 3.11Å; F208-R212 WeakPolarHBondContact O-CG 3.22Å; F208-R212 PolarHBondContact O-N 3.47Å; F208-Y249 HydrophobicContact CB-CD1 3.88Å; F208-Y249 HydrophobicContact CB-CE1 3.58Å; F208-Y249 AromaticContact CD2-CD1 3.48Å; F208-Y249 HydrophobicContact CD2-CD1 3.48Å; F208-Y249 VanDerWaalsContact CD2-CD1 3.48Å; F208-Y249 AromaticContact CD2-CD2 3.61Å; F208-Y249 HydrophobicContact CD2-CD2 3.61Å; F208-Y249 AromaticContact CD2-CE1 3.92Å; F208-Y249 HydrophobicContact CD2-CE1 3.92Å; F208-Y249 HydrophobicContact CD2-CE2 4.04Å; F208-Y249 AromaticContact CD2-CG 3.3Å; F208-Y249 HydrophobicContact CD2-CG 3.3Å; F208-Y249 HydrophobicContact CE2-CD1 4.33Å; F208-Y249 HydrophobicContact CE2-CD2 4.16Å; F208-Y249 AromaticContact CE2-CG 3.82Å; F208-Y249 HydrophobicContact CE2-CG 3.82Å; F208-Y249 AromaticContact CG-CD1 3.99Å; F208-Y249 HydrophobicContact CG-CD1 3.99Å; F208-Y249 HydrophobicContact CG-CE1 4.19Å; F208-Y249 HydrophobicContact CG-CG 4.27Å; F208-Y249 PolarHBondContact N-OH 2.84Å; F208-I253 HydrophobicContact CE1-CD1 3.97Å; F208-I253 HydrophobicContact CE2-CD1 3.93Å; F208-I253 HydrophobicContact CZ-CD1 3.58Å
209M79.4Confident78.8Confident99 Ų9954 Ų5449%0.48829%0.285SS..Hα-helixtrans-65.1-43.6-179.5-70.5-62.1177.900111.6I205 G206 D207 T211 R212 I213I205-M209 HydrophobicContact CG2-CE 4.3Å; I205-M209 HydrophobicContact CG2-CG 4.22Å; I205-M209 WeakPolarHBondContact O-CB 3.33Å; I205-M209 VanDerWaalsContact O-CG 3.24Å; I205-M209 WeakPolarHBondContact O-CG 3.42Å; I205-M209 PolarHBondContact O-N 3.45Å; G206-M209 PolarHBondContact O-N 2.84Å; D207-M209 PolarHBondContact O-N 3.28Å; M209-T211 VanDerWaalsContact C-N 3.31Å; M209-T211 PolarHBondContact O-N 2.97Å; M209-R212 PolarHBondContact O-N 2.86Å; M209-I213 WeakPolarHBondContact O-CB 3.39Å; M209-I213 VanDerWaalsContact O-CG1 3.23Å; M209-I213 WeakPolarHBondContact O-CG1 3.49Å; M209-I213 PolarHBondContact O-N 3.25Å
210L83.8Confident79Confident93 Ų9356.8 Ų56.849%0.48730%0.3SS..Hα-helixtrans-60.2-42.8175.7-73.1171.9000111.7T113 G206 D207 I213 S214T113-L210 HydrophobicContact CG2-CB 3.81Å; T113-L210 HydrophobicContact CG2-CD1 4.07Å; G206-L210 WeakPolarHBondContact O-CG 3.44Å; G206-L210 PolarHBondContact O-N 3.49Å; D207-L210 PolarHBondContact O-N 2.99Å; L210-I213 PolarHBondContact O-N 2.7Å; L210-S214 WeakPolarHBondContact O-CB 3.31Å; L210-S214 PolarHBondContact O-N 3.33Å; L210-S214 PolarHBondContact O-OG 3.27Å
211T80.9Confident79.4Confident1 Ų155.8 Ų55.81%0.00630%0.298CS..Hα-helixtrans-61.9-48.4175.3-610000110.6A116 D207 F208 M209 I213 S214 Y215 V245A116-T211 HydrophobicContact CB-CG2 4.13Å; D207-T211 VanDerWaalsContact O-CB 3.26Å; D207-T211 WeakPolarHBondContact O-CB 3.49Å; D207-T211 PolarHBondContact O-N 3.43Å; D207-T211 PolarHBondContact O-OG1 3.4Å; F208-T211 PolarHBondContact O-N 3.25Å; M209-T211 VanDerWaalsContact C-N 3.31Å; M209-T211 PolarHBondContact O-N 2.97Å; T211-I213 PolarHBondContact O-N 2.98Å; T211-S214 PolarHBondContact O-N 3.35Å; T211-Y215 HydrophobicContact CG2-CD2 3.89Å; T211-Y215 HydrophobicContact CG2-CE2 4.11Å; T211-Y215 WeakPolarHBondContact O-CD2 3.32Å; T211-Y215 PolarHBondContact O-N 3.32Å; T211-V245 HydrophobicContact CG2-CB 4.48Å; T211-V245 HydrophobicContact CG2-CG1 3.67Å; T211-V245 HydrophobicContact CG2-CG2 3.96Å
212R78.7Confident79.6Confident151 Ų15152 Ų5257%0.5728%0.278SS*.Hα-helixtrans-60.5-43.9178.8-71.5-73.6-67.5-173.4-2.5112.4F208 M209 Y215 G216F208-R212 HydrophobicContact CD1-CG 4.2Å; F208-R212 HydrophobicContact CD2-CG 4.26Å; F208-R212 HydrophobicContact CE1-CG 3.86Å; F208-R212 HydrophobicContact CE2-CG 3.95Å; F208-R212 HydrophobicContact CG-CG 4.4Å; F208-R212 HydrophobicContact CZ-CG 3.74Å; F208-R212 WeakPolarHBondContact O-CB 3.11Å; F208-R212 WeakPolarHBondContact O-CG 3.22Å; F208-R212 PolarHBondContact O-N 3.47Å; M209-R212 PolarHBondContact O-N 2.86Å; R212-Y215 PolarHBondContact O-N 3.04Å; R212-G216 PolarHBondContact O-N 3.09Å
213I82.4Confident79.8Confident95 Ų9553.8 Ų53.849%0.48728%0.284SS..Hα-helixtrans-62.9-47.6177.7-70.7166.3000110.2M209 L210 T211 Y215 G216 F217M209-I213 WeakPolarHBondContact O-CB 3.39Å; M209-I213 VanDerWaalsContact O-CG1 3.23Å; M209-I213 WeakPolarHBondContact O-CG1 3.49Å; M209-I213 PolarHBondContact O-N 3.25Å; L210-I213 PolarHBondContact O-N 2.7Å; T211-I213 PolarHBondContact O-N 2.98Å; I213-Y215 VanDerWaalsContact C-N 3.33Å; I213-Y215 PolarHBondContact O-N 3.5Å; I213-G216 PolarHBondContact O-N 3.4Å; I213-G216 VanDerWaalsContact O-N 3.12Å; I213-F217 HydrophobicContact CG2-CD2 3.82Å; I213-F217 HydrophobicContact CG2-CE2 3.44Å; I213-F217 VanDerWaalsContact CG2-CE2 3.44Å; I213-F217 VanDerWaalsContact O-CD2 3.23Å; I213-F217 WeakPolarHBondContact O-CD2 3.33Å; I213-F217 PolarHBondContact O-N 2.86Å
214S83.6Confident79.9Confident17 Ų1762.2 Ų62.212%0.11931%0.314CS..Hα-helixtrans-57-47.2177.9-59.30000111.3L210 T211 G216 F217 I218L210-S214 WeakPolarHBondContact O-CB 3.31Å; L210-S214 PolarHBondContact O-N 3.33Å; L210-S214 PolarHBondContact O-OG 3.27Å; T211-S214 PolarHBondContact O-N 3.35Å; S214-G216 PolarHBondContact O-N 3.18Å; S214-F217 PolarHBondContact O-N 3.5Å; S214-I218 VanDerWaalsContact O-CG1 3.26Å; S214-I218 WeakPolarHBondContact O-CG1 3.37Å; S214-I218 PolarHBondContact O-N 3.17Å
215Y77.7Confident80.3Confident9 Ų964.2 Ų64.24%0.03532%0.323CS..Hα-helixtrans-68-32.7176.5-86.8-79.5000113.7A116 T211 R212 I213 I218 I219 C238 H241 L242A116-Y215 HydrophobicContact CB-CD2 4.29Å; A116-Y215 HydrophobicContact CB-CE2 3.75Å; T211-Y215 HydrophobicContact CG2-CD2 3.89Å; T211-Y215 HydrophobicContact CG2-CE2 4.11Å; T211-Y215 WeakPolarHBondContact O-CD2 3.32Å; T211-Y215 PolarHBondContact O-N 3.32Å; R212-Y215 PolarHBondContact O-N 3.04Å; I213-Y215 VanDerWaalsContact C-N 3.33Å; I213-Y215 PolarHBondContact O-N 3.5Å; Y215-I218 HydrophobicContact CD1-CD1 4.14Å; Y215-I218 HydrophobicContact CE1-CD1 4.15Å; Y215-I218 HydrophobicContact CG-CD1 4.43Å; Y215-I218 PolarHBondContact O-N 3Å; Y215-I219 WeakPolarHBondContact O-CB 3.43Å; Y215-I219 VanDerWaalsContact O-CG1 3.23Å; Y215-I219 WeakPolarHBondContact O-CG1 3.35Å; Y215-I219 PolarHBondContact O-N 3.17Å; Y215-C238 HydrophobicContact CE1-CB 4.04Å; Y215-H241 AromaticContact CE2-CE1 3.83Å; Y215-H241 AromaticContact CE2-ND1 3.38Å; Y215-H241 WeakPolarHBondContact CE2-ND1 3.39Å; Y215-H241 AromaticContact CZ-CG 4Å; Y215-H241 AromaticContact CZ-ND1 3.37Å; Y215-H241 WeakPolarHBondContact OH-CB 3.3Å; Y215-H241 PolarHBondContact OH-ND1 3.04Å; Y215-L242 HydrophobicContact CD1-CD1 4.19Å; Y215-L242 HydrophobicContact CG-CD1 4.2Å
216G79.6Confident80.3Confident35 Ų3571.6 Ų71.636%0.36135%0.346SS..Hα-helixtrans-57.7-48.8171.100000111.5R212 I213 S214 I219 V220R212-G216 PolarHBondContact O-N 3.09Å; I213-G216 PolarHBondContact O-N 3.4Å; I213-G216 VanDerWaalsContact O-N 3.12Å; S214-G216 PolarHBondContact O-N 3.18Å; G216-I219 PolarHBondContact O-N 3.47Å; G216-V220 WeakPolarHBondContact O-CG2 3.18Å; G216-V220 PolarHBondContact O-N 3.43Å
217F82.1Confident80.4Confident113 Ų11374.5 Ų74.550%0.49636%0.359SS..Hα-helixtrans-64.8-40.6175.5-71.9-62.6000112.9Y120 I213 S214 I219 V220 A221Y120-F217 HydrophobicContact CD2-CB 3.91Å; Y120-F217 HydrophobicContact CE2-CB 3.64Å; Y120-F217 HydrophobicContact CE2-CD2 4.27Å; Y120-F217 HydrophobicContact CE2-CG 4.11Å; I213-F217 HydrophobicContact CG2-CD2 3.82Å; I213-F217 HydrophobicContact CG2-CE2 3.44Å; I213-F217 VanDerWaalsContact CG2-CE2 3.44Å; I213-F217 VanDerWaalsContact O-CD2 3.23Å; I213-F217 WeakPolarHBondContact O-CD2 3.33Å; I213-F217 PolarHBondContact O-N 2.86Å; S214-F217 PolarHBondContact O-N 3.5Å; F217-I219 VanDerWaalsContact C-N 3.35Å; F217-I219 PolarHBondContact O-N 3.43Å; F217-V220 PolarHBondContact O-N 3.13Å; F217-A221 WeakPolarHBondContact O-CB 3.21Å; F217-A221 PolarHBondContact O-N 3.05Å
218I81.8Confident80.2Confident0 Ų079.3 Ų79.30%039%0.388CS..Hα-helixtrans-59.2-46.4175.7-70165.6000110.8R119 Y120 I123 S214 Y215 V220 A221 I222 C238R119-I218 HydrophobicContact CB-CD1 4.11Å; Y120-I218 HydrophobicContact CD2-CG1 4.47Å; I123-I218 HydrophobicContact CD1-CG2 3.65Å; I123-I218 HydrophobicContact CG2-CG2 4.4Å; S214-I218 VanDerWaalsContact O-CG1 3.26Å; S214-I218 WeakPolarHBondContact O-CG1 3.37Å; S214-I218 PolarHBondContact O-N 3.17Å; Y215-I218 HydrophobicContact CD1-CD1 4.14Å; Y215-I218 HydrophobicContact CE1-CD1 4.15Å; Y215-I218 HydrophobicContact CG-CD1 4.43Å; Y215-I218 PolarHBondContact O-N 3Å; I218-V220 VanDerWaalsContact C-N 3.34Å; I218-V220 PolarHBondContact O-N 2.93Å; I218-A221 WeakPolarHBondContact O-CB 3.33Å; I218-A221 PolarHBondContact O-N 2.69Å; I218-I222 HydrophobicContact CG2-CD1 3.71Å; I218-I222 HydrophobicContact CG2-CG1 4.27Å; I218-I222 VanDerWaalsContact O-CG1 3.27Å; I218-I222 WeakPolarHBondContact O-CG1 3.45Å; I218-I222 PolarHBondContact O-N 2.88Å; I218-C238 VanDerWaalsContact CG2-SG 3.53Å
219I79.8Confident80.1Confident90 Ų9084.1 Ų84.146%0.46241%0.411SS..Hα-helixtrans-60.8-45.6178.3-69.9164.4000110.2Y215 G216 F217 A221 I222 L223Y215-I219 WeakPolarHBondContact O-CB 3.43Å; Y215-I219 VanDerWaalsContact O-CG1 3.23Å; Y215-I219 WeakPolarHBondContact O-CG1 3.35Å; Y215-I219 PolarHBondContact O-N 3.17Å; G216-I219 PolarHBondContact O-N 3.47Å; F217-I219 VanDerWaalsContact C-N 3.35Å; F217-I219 PolarHBondContact O-N 3.43Å; I219-A221 VanDerWaalsContact C-N 3.31Å; I219-A221 PolarHBondContact O-N 3.36Å; I219-I222 PolarHBondContact O-N 3.38Å; I219-L223 HydrophobicContact CG2-CD1 4.2Å; I219-L223 HydrophobicContact CG2-CG 4.49Å; I219-L223 WeakPolarHBondContact O-CG 3.46Å; I219-L223 PolarHBondContact O-N 3.08Å
220V81.6Confident79.7Confident68 Ų6880.5 Ų80.541%0.41240%0.399SS..Hα-helixtrans-59.1-43.3175.7171.90000111.2G216 F217 I218 L223 R224G216-V220 WeakPolarHBondContact O-CG2 3.18Å; G216-V220 PolarHBondContact O-N 3.43Å; F217-V220 PolarHBondContact O-N 3.13Å; I218-V220 VanDerWaalsContact C-N 3.34Å; I218-V220 PolarHBondContact O-N 2.93Å; V220-L223 PolarHBondContact O-N 3.21Å; V220-R224 WeakPolarHBondContact O-CG 3.41Å; V220-R224 PolarHBondContact O-N 3.42Å
221A80.9Confident79.4Confident21 Ų2180 Ų8017%0.17439%0.393CS..Hα-helixtrans-63.4-43.7176.800000111.8I123 F217 I218 I219 L223 R224 I225I123-A221 HydrophobicContact CG2-CB 4.1Å; F217-A221 WeakPolarHBondContact O-CB 3.21Å; F217-A221 PolarHBondContact O-N 3.05Å; I218-A221 WeakPolarHBondContact O-CB 3.33Å; I218-A221 PolarHBondContact O-N 2.69Å; I219-A221 VanDerWaalsContact C-N 3.31Å; I219-A221 PolarHBondContact O-N 3.36Å; A221-L223 VanDerWaalsContact C-N 3.33Å; A221-L223 PolarHBondContact O-N 3.38Å; A221-R224 WeakPolarHBondContact O-CB 3.32Å; A221-R224 PolarHBondContact O-N 3.38Å; A221-R224 VanDerWaalsContact O-N 3.1Å; A221-I225 PolarHBondContact O-N 2.99Å
222I79.4Confident79.1Confident19 Ų1989 Ų8910%0.09743%0.427CS..Hα-helixtrans-61.2-41.5176.6-69.1170.8000111.2I123 I218 I219 R224 I225 K231 A234I123-I222 HydrophobicContact CG2-CG1 4.37Å; I218-I222 HydrophobicContact CG2-CD1 3.71Å; I218-I222 HydrophobicContact CG2-CG1 4.27Å; I218-I222 VanDerWaalsContact O-CG1 3.27Å; I218-I222 WeakPolarHBondContact O-CG1 3.45Å; I218-I222 PolarHBondContact O-N 2.88Å; I219-I222 PolarHBondContact O-N 3.38Å; I222-R224 PolarHBondContact O-N 2.83Å; I222-I225 WeakPolarHBondContact O-CB 3.26Å; I222-I225 PolarHBondContact O-N 3.48Å; I222-K231 HydrophobicContact CG2-CG 4.41Å; I222-A234 HydrophobicContact CD1-CB 3.88Å; I222-A234 HydrophobicContact CG1-CB 3.77Å
223L78.8Confident78.8Confident121 Ų12189.2 Ų89.263%0.63443%0.432SS*.Hα-helixtrans-62.5-31.1176.9-70.2174.1000112.3I219 V220 A221I219-L223 HydrophobicContact CG2-CD1 4.2Å; I219-L223 HydrophobicContact CG2-CG 4.49Å; I219-L223 WeakPolarHBondContact O-CG 3.46Å; I219-L223 PolarHBondContact O-N 3.08Å; V220-L223 PolarHBondContact O-N 3.21Å; A221-L223 VanDerWaalsContact C-N 3.33Å; A221-L223 PolarHBondContact O-N 3.38Å
224R81.1Confident78.3Confident200 Ų20085.4 Ų85.476%0.75541%0.414SS*.Hα-helixtrans-77.6-18.8177-70.2179179.3-169.10.6114.3V220 A221 I222 R226V220-R224 WeakPolarHBondContact O-CG 3.41Å; V220-R224 PolarHBondContact O-N 3.42Å; A221-R224 WeakPolarHBondContact O-CB 3.32Å; A221-R224 PolarHBondContact O-N 3.38Å; A221-R224 VanDerWaalsContact O-N 3.1Å; I222-R224 PolarHBondContact O-N 2.83Å; R224-R226 PolarHBondContact O-N 3.19Å
225I80.5Confident77.8Confident49 Ų4991.5 Ų91.525%0.25144%0.439SS..  trans-61.8131.8174.8-63.2173.8000108.8A221 I222 K231 A234A221-I225 PolarHBondContact O-N 2.99Å; I222-I225 WeakPolarHBondContact O-CB 3.26Å; I222-I225 PolarHBondContact O-N 3.48Å; I225-K231 HydrophobicContact CB-CG 4.11Å; I225-K231 HydrophobicContact CG2-CG 4.18Å; I225-K231 WeakPolarHBondContact O-CE 3.26Å; I225-K231 PolarHBondContact O-NZ 3.2Å; I225-A234 HydrophobicContact CD1-CB 4.44Å
226R76.8Confident77.3Confident245 Ų24594.3 Ų94.393%0.92546%0.46SS*.  trans-88.7-19.2-178.2-70-175.2175.1-178.5-1.7114.1R224R224-R226 PolarHBondContact O-N 3.19Å
227T81.1Confident76.8Confident86 Ų8695 Ų9553%0.52846%0.457SS..  trans-95.9138.9-175.857.50000112.6G230 K231T227-G230 PolarHBondContact O-N 3.28Å; T227-G230 PolarHBondContact OG1-N 3.49Å; T227-K231 PolarHBondContact O-N 2.82Å; T227-K231 VanDerWaalsContact O-N 3.12Å
228V77Confident76.1Confident113 Ų11390 Ų9069%0.68544%0.437SS*.Hα-helixtrans-67.5-44-179.6-179.80000111.1G230 K231 R232V228-G230 VanDerWaalsContact C-N 3.34Å; V228-G230 PolarHBondContact O-N 2.75Å; V228-K231 PolarHBondContact O-N 3.08Å; V228-R232 WeakPolarHBondContact O-CB 3.4Å; V228-R232 PolarHBondContact O-N 2.03Å
229E74.8Confident75.6Confident142 Ų14292.2 Ų92.266%0.66445%0.452SS*.Hα-helixtrans-56.5-43.5172.3-91.662.4-145.100112.9R232 K233E229-R232 PolarHBondContact O-N 3.41Å; E229-K233 WeakPolarHBondContact O-CB 3.41Å; E229-K233 PolarHBondContact O-N 3.25Å
230G72.1Confident75Confident23 Ų2388.2 Ų88.224%0.23743%0.432CS..Hα-helixtrans-63.9-43.5179.700000112.1T227 V228 A234T227-G230 PolarHBondContact O-N 3.28Å; T227-G230 PolarHBondContact OG1-N 3.49Å; V228-G230 VanDerWaalsContact C-N 3.34Å; V228-G230 PolarHBondContact O-N 2.75Å; G230-A234 WeakPolarHBondContact O-CB 2.85Å; G230-A234 PolarHBondContact O-N 2.85Å
231K76.9Confident74.5Confident82 Ų8285 Ų8536%0.35741%0.412SS..Hα-helixtrans-61.6-46.9173.6-72.2-172.6-176.3-1740112I222 I225 T227 V228 K233 A234 F235I222-K231 HydrophobicContact CG2-CG 4.41Å; I225-K231 HydrophobicContact CB-CG 4.11Å; I225-K231 HydrophobicContact CG2-CG 4.18Å; I225-K231 WeakPolarHBondContact O-CE 3.26Å; I225-K231 PolarHBondContact O-NZ 3.2Å; T227-K231 PolarHBondContact O-N 2.82Å; T227-K231 VanDerWaalsContact O-N 3.12Å; V228-K231 PolarHBondContact O-N 3.08Å; K231-K233 PolarHBondContact O-N 2.63Å; K231-A234 PolarHBondContact O-N 3.07Å; K231-F235 VanDerWaalsContact O-CB 3.27Å; K231-F235 WeakPolarHBondContact O-CB 3.4Å; K231-F235 PolarHBondContact O-N 3.23Å
232R74.9Confident73.9Confident190 Ų19087 Ų8772%0.71742%0.42SS*.Hα-helixtrans-62.4-42.6-178.6-171.1179-180-1732.1111.8V228 E229 S236V228-R232 WeakPolarHBondContact O-CB 3.4Å; V228-R232 PolarHBondContact O-N 2.03Å; E229-R232 PolarHBondContact O-N 3.41Å; R232-S236 WeakPolarHBondContact O-CB 3.35Å; R232-S236 PolarHBondContact O-N 3.47Å
233K72Confident73.4Confident156 Ų15688.3 Ų88.368%0.67843%0.428SS*.Hα-helixtrans-64-48.7177.1-169.6173.7-178.2178.70111.3E229 K231 F235 S236 T237E229-K233 WeakPolarHBondContact O-CB 3.41Å; E229-K233 PolarHBondContact O-N 3.25Å; K231-K233 PolarHBondContact O-N 2.63Å; K233-F235 PolarHBondContact O-N 3.24Å; K233-S236 PolarHBondContact O-N 2.99Å; K233-T237 PolarHBondContact O-N 2.88Å; K233-T237 PolarHBondContact O-OG1 3.41Å; K233-T237 VanDerWaalsContact O-OG1 3.1Å
234A71.9Confident72.8Confident14 Ų1482.6 Ų82.612%0.11640%0.399CS..Hα-helixtrans-63.9-41179.500000112.8I222 I225 G230 K231 T237 C238I222-A234 HydrophobicContact CD1-CB 3.88Å; I222-A234 HydrophobicContact CG1-CB 3.77Å; I225-A234 HydrophobicContact CD1-CB 4.44Å; G230-A234 WeakPolarHBondContact O-CB 2.85Å; G230-A234 PolarHBondContact O-N 2.85Å; K231-A234 PolarHBondContact O-N 3.07Å; A234-T237 PolarHBondContact O-N 3.16Å; A234-C238 PolarHBondContact O-N 3.32Å
235F72.6Confident72.1Confident145 Ų14573.3 Ų73.364%0.63636%0.364SS*.Hα-helixtrans-64.8-43177.4-164.9-92.1000111.9K231 K233 T237 C238 S239K231-F235 VanDerWaalsContact O-CB 3.27Å; K231-F235 WeakPolarHBondContact O-CB 3.4Å; K231-F235 PolarHBondContact O-N 3.23Å; K233-F235 PolarHBondContact O-N 3.24Å; F235-T237 VanDerWaalsContact C-N 3.29Å; F235-T237 PolarHBondContact O-N 3.01Å; F235-C238 PolarHBondContact O-N 3.27Å; F235-S239 VanDerWaalsContact O-CB 3.23Å; F235-S239 WeakPolarHBondContact O-CB 3.09Å; F235-S239 PolarHBondContact O-N 3.47Å
236S67.8Low71.5Confident68 Ų6874.2 Ų74.248%0.47637%0.372SS..Hα-helixtrans-61.8-36.2177.4-1710000112.7R232 K233R232-S236 WeakPolarHBondContact O-CB 3.35Å; R232-S236 PolarHBondContact O-N 3.47Å; K233-S236 PolarHBondContact O-N 2.99Å
237T68Low71Confident49 Ų4966.4 Ų66.430%0.30135%0.348SS..Hα-helixtrans-79.1-34.5179.8-50.40000112.7K233 A234 F235 S240K233-T237 PolarHBondContact O-N 2.88Å; K233-T237 PolarHBondContact O-OG1 3.41Å; K233-T237 VanDerWaalsContact O-OG1 3.1Å; A234-T237 PolarHBondContact O-N 3.16Å; F235-T237 VanDerWaalsContact C-N 3.29Å; F235-T237 PolarHBondContact O-N 3.01Å; T237-S240 PolarHBondContact O-OG 2.69Å; T237-S240 VanDerWaalsContact O-OG 3.11Å
238C69.4Low70.2Confident10 Ų1062.7 Ų62.77%0.06833%0.325CS..Hα-helixtrans-79.6-31.8178.1-81.30000113.7I123 Y215 I218 A234 F235 S240 H241 L242I123-C238 VanDerWaalsContact CD1-SG 3.58Å; Y215-C238 HydrophobicContact CE1-CB 4.04Å; I218-C238 VanDerWaalsContact CG2-SG 3.53Å; A234-C238 PolarHBondContact O-N 3.32Å; F235-C238 PolarHBondContact O-N 3.27Å; C238-S240 PolarHBondContact O-N 3.42Å; C238-H241 PolarHBondContact O-N 3.38Å; C238-L242 VanDerWaalsContact O-CB 3.29Å; C238-L242 WeakPolarHBondContact O-CB 3.48Å; C238-L242 PolarHBondContact O-N 3.5Å
239S69.9Low69.7Low45 Ų4557.5 Ų57.532%0.31529%0.293SS..Hα-helixtrans-59.5-36.6-177.4-173.30000112.1F235 T243F235-S239 VanDerWaalsContact O-CB 3.23Å; F235-S239 WeakPolarHBondContact O-CB 3.09Å; F235-S239 PolarHBondContact O-N 3.47Å; S239-T243 WeakPolarHBondContact O-CB 3.47Å; S239-T243 PolarHBondContact O-N 2.98Å; S239-T243 PolarHBondContact O-OG1 2.95Å
240S67.5Low69.2Low6 Ų653.7 Ų53.74%0.04228%0.282CS..Hα-helixtrans-66.8-52179.356.80000111.9T237 C238 L242 T243 V244 V286T237-S240 PolarHBondContact O-OG 2.69Å; T237-S240 VanDerWaalsContact O-OG 3.11Å; C238-S240 PolarHBondContact O-N 3.42Å; S240-L242 PolarHBondContact O-N 3.36Å; S240-T243 WeakPolarHBondContact O-CB 3.36Å; S240-T243 PolarHBondContact O-N 2.92Å; S240-V244 WeakPolarHBondContact O-CG2 3.49Å; S240-V244 PolarHBondContact O-N 3.46Å; S240-V286 WeakPolarHBondContact O-CG1 3.29Å
241H71.1Confident68.6Low1 Ų154.5 Ų54.51%0.00528%0.283CS..Hα-helixtrans-65.5-38.2178-172.6-74.7000112F112 M115 Y215 C238 T243 V244 V245 Y287F112-H241 PolarHBondContact O-NE2 3.33Å; M115-H241 VanDerWaalsContact CB-NE2 3.3Å; M115-H241 WeakPolarHBondContact CB-NE2 3.44Å; Y215-H241 AromaticContact CE2-CE1 3.83Å; Y215-H241 AromaticContact CE2-ND1 3.38Å; Y215-H241 WeakPolarHBondContact CE2-ND1 3.39Å; Y215-H241 AromaticContact CZ-CG 4Å; Y215-H241 AromaticContact CZ-ND1 3.37Å; Y215-H241 WeakPolarHBondContact OH-CB 3.3Å; Y215-H241 PolarHBondContact OH-ND1 3.04Å; C238-H241 PolarHBondContact O-N 3.38Å; H241-T243 VanDerWaalsContact C-N 3.29Å; H241-T243 PolarHBondContact O-N 3.26Å; H241-V244 PolarHBondContact O-N 2.93Å; H241-V245 WeakPolarHBondContact CE1-CG2 3.47Å; H241-V245 WeakPolarHBondContact ND1-CG2 3.45Å; H241-V245 WeakPolarHBondContact O-CB 3.45Å; H241-V245 VanDerWaalsContact O-CG2 3.26Å; H241-V245 WeakPolarHBondContact O-CG2 3.14Å; H241-V245 PolarHBondContact O-N 2.98Å; H241-Y287 PolarHBondContact CD2-OH 2.97Å
242L68.5Low67.7Low63 Ų6351.8 Ų51.833%0.3327%0.273SS..Hα-helixtrans-64.5-35.5175-169.369.5000111.7Y215 C238 S240 T246Y215-L242 HydrophobicContact CD1-CD1 4.19Å; Y215-L242 HydrophobicContact CG-CD1 4.2Å; C238-L242 VanDerWaalsContact O-CB 3.29Å; C238-L242 WeakPolarHBondContact O-CB 3.48Å; C238-L242 PolarHBondContact O-N 3.5Å; S240-L242 PolarHBondContact O-N 3.36Å; L242-T246 VanDerWaalsContact O-CB 3.22Å; L242-T246 WeakPolarHBondContact O-CB 3.45Å; L242-T246 PolarHBondContact O-N 2.79Å; L242-T246 PolarHBondContact O-OG1 2.65Å
243T67.8Low67Low46 Ų4645.7 Ų45.728%0.28225%0.254SS..Hα-helixtrans-64.2-46.6174.1-58.90000110.6S239 S240 H241 T246 L247 V286S239-T243 WeakPolarHBondContact O-CB 3.47Å; S239-T243 PolarHBondContact O-N 2.98Å; S239-T243 PolarHBondContact O-OG1 2.95Å; S240-T243 WeakPolarHBondContact O-CB 3.36Å; S240-T243 PolarHBondContact O-N 2.92Å; H241-T243 VanDerWaalsContact C-N 3.29Å; H241-T243 PolarHBondContact O-N 3.26Å; T243-T246 PolarHBondContact O-N 2.7Å; T243-L247 HydrophobicContact CG2-CD1 3.79Å; T243-L247 HydrophobicContact CG2-CG 4.41Å; T243-L247 WeakPolarHBondContact O-CB 3.27Å; T243-L247 VanDerWaalsContact O-CG 3.27Å; T243-L247 WeakPolarHBondContact O-CG 3.09Å; T243-L247 PolarHBondContact O-N 2.91Å; T243-V286 HydrophobicContact CG2-CG1 4.35Å
244V67.3Low66.3Low2 Ų244.5 Ų44.51%0.01225%0.246CC..Hα-helixtrans-60.6-50.7176.8175.90000111.4F112 S240 H241 T246 L247 Y248 N283 V286 Y287F112-V244 HydrophobicContact CD1-CG1 4.33Å; F112-V244 HydrophobicContact CE1-CG1 3.4Å; F112-V244 VanDerWaalsContact CE1-CG1 3.4Å; F112-V244 HydrophobicContact CZ-CG1 3.56Å; S240-V244 WeakPolarHBondContact O-CG2 3.49Å; S240-V244 PolarHBondContact O-N 3.46Å; H241-V244 PolarHBondContact O-N 2.93Å; V244-T246 VanDerWaalsContact C-N 3.31Å; V244-T246 PolarHBondContact O-N 2.9Å; V244-L247 PolarHBondContact O-N 3.44Å; V244-Y248 WeakPolarHBondContact O-CB 3.38Å; V244-Y248 PolarHBondContact O-N 3.42Å; V244-N283 WeakPolarHBondContact CG1-OD1 3.47Å; V244-V286 HydrophobicContact CG2-CB 3.6Å; V244-V286 HydrophobicContact CG2-CG1 3.45Å; V244-V286 VanDerWaalsContact CG2-CG1 3.45Å; V244-V286 HydrophobicContact CG2-CG2 4.24Å; V244-Y287 HydrophobicContact CB-CE2 4.42Å; V244-Y287 HydrophobicContact CG1-CE2 4.16Å; V244-Y287 HydrophobicContact CG2-CD2 4.35Å; V244-Y287 HydrophobicContact CG2-CE1 4.45Å; V244-Y287 HydrophobicContact CG2-CE2 3.85Å
245V66.2Low65.3Low5 Ų545.3 Ų45.33%0.0325%0.25CC..Hα-helixtrans-58.5-43.9177.4168.20000110.8T211 H241 Y248 Y249T211-V245 HydrophobicContact CG2-CB 4.48Å; T211-V245 HydrophobicContact CG2-CG1 3.67Å; T211-V245 HydrophobicContact CG2-CG2 3.96Å; H241-V245 WeakPolarHBondContact CE1-CG2 3.47Å; H241-V245 WeakPolarHBondContact ND1-CG2 3.45Å; H241-V245 WeakPolarHBondContact O-CB 3.45Å; H241-V245 VanDerWaalsContact O-CG2 3.26Å; H241-V245 WeakPolarHBondContact O-CG2 3.14Å; H241-V245 PolarHBondContact O-N 2.98Å; V245-Y248 PolarHBondContact O-N 3.15Å; V245-Y249 HydrophobicContact CB-CD2 4.48Å; V245-Y249 HydrophobicContact CG1-CD2 3.62Å; V245-Y249 HydrophobicContact CG1-CE2 3.94Å; V245-Y249 WeakPolarHBondContact O-CB 3.46Å; V245-Y249 VanDerWaalsContact O-CD2 3.26Å; V245-Y249 WeakPolarHBondContact O-CD2 3.39Å; V245-Y249 PolarHBondContact O-N 3.33Å
246T66.9Low64Low68 Ų6844.7 Ų44.742%0.41724%0.244SC..Hα-helixtrans-66.5-42.3-180-56.30000111.3L242 T243 V244 Y248 S250L242-T246 VanDerWaalsContact O-CB 3.22Å; L242-T246 WeakPolarHBondContact O-CB 3.45Å; L242-T246 PolarHBondContact O-N 2.79Å; L242-T246 PolarHBondContact O-OG1 2.65Å; T243-T246 PolarHBondContact O-N 2.7Å; V244-T246 VanDerWaalsContact C-N 3.31Å; V244-T246 PolarHBondContact O-N 2.9Å; T246-Y248 VanDerWaalsContact C-N 3.29Å; T246-Y248 PolarHBondContact O-N 3.49Å; T246-S250 WeakPolarHBondContact O-CB 3.42Å; T246-S250 PolarHBondContact O-N 3.41Å; T246-S250 PolarHBondContact O-OG 2.91Å
247L66.7Low63Low80 Ų8047.7 Ų47.742%0.41925%0.253SS..Hα-helixtrans-65.2-33.8176.4-73.6167.7000112.3T243 V244 P251 L282 V286T243-L247 HydrophobicContact CG2-CD1 3.79Å; T243-L247 HydrophobicContact CG2-CG 4.41Å; T243-L247 WeakPolarHBondContact O-CB 3.27Å; T243-L247 VanDerWaalsContact O-CG 3.27Å; T243-L247 WeakPolarHBondContact O-CG 3.09Å; T243-L247 PolarHBondContact O-N 2.91Å; V244-L247 PolarHBondContact O-N 3.44Å; L247-P251 WeakPolarHBondContact O-CD 3.22Å; L247-P251 WeakPolarHBondContact O-CG 3.39Å; L247-L282 HydrophobicContact CD1-CD1 4.1Å; L247-V286 HydrophobicContact CD1-CG2 4.42Å
248Y65.6Low61.9Low9 Ų949.4 Ų49.44%0.03525%0.254CS..Hα-helixtrans-72.3-50.7177.2-173-102.8000112.7M109 F112 V244 V245 T246 P251 V252 T279M109-Y248 HydrophobicContact CE-CE1 3.99Å; M109-Y248 WeakPolarHBondContact CE-OH 3.33Å; M109-Y248 HydrophobicContact CG-CE1 3.8Å; M109-Y248 WeakPolarHBondContact CG-OH 3.42Å; F112-Y248 HydrophobicContact CD2-CD1 4.27Å; F112-Y248 HydrophobicContact CD2-CG 4.36Å; F112-Y248 HydrophobicContact CE2-CD1 4.22Å; F112-Y248 AromaticContact CE2-CD2 3.93Å; F112-Y248 HydrophobicContact CE2-CD2 3.93Å; F112-Y248 HydrophobicContact CE2-CE2 4.2Å; F112-Y248 AromaticContact CE2-CG 3.88Å; F112-Y248 HydrophobicContact CE2-CG 3.88Å; V244-Y248 WeakPolarHBondContact O-CB 3.38Å; V244-Y248 PolarHBondContact O-N 3.42Å; V245-Y248 PolarHBondContact O-N 3.15Å; T246-Y248 VanDerWaalsContact C-N 3.29Å; T246-Y248 PolarHBondContact O-N 3.49Å; Y248-P251 WeakPolarHBondContact O-CD 3.15Å; Y248-V252 WeakPolarHBondContact O-CG2 3.38Å; Y248-T279 HydrophobicContact CD2-CG2 3.29Å; Y248-T279 HydrophobicContact CE2-CG2 3.66Å; Y248-T279 HydrophobicContact CG-CG2 4.46Å
249Y64.9Low60.3Low4 Ų452.8 Ų52.82%0.01628%0.276CS..Hα-helixtrans-84.3-23.5-172.5-74.3-75.6000113.8D207 F208 V245 V252 I253D207-Y249 WeakPolarHBondContact CB-OH 3.14Å; F208-Y249 HydrophobicContact CB-CD1 3.88Å; F208-Y249 HydrophobicContact CB-CE1 3.58Å; F208-Y249 AromaticContact CD2-CD1 3.48Å; F208-Y249 HydrophobicContact CD2-CD1 3.48Å; F208-Y249 VanDerWaalsContact CD2-CD1 3.48Å; F208-Y249 AromaticContact CD2-CD2 3.61Å; F208-Y249 HydrophobicContact CD2-CD2 3.61Å; F208-Y249 AromaticContact CD2-CE1 3.92Å; F208-Y249 HydrophobicContact CD2-CE1 3.92Å; F208-Y249 HydrophobicContact CD2-CE2 4.04Å; F208-Y249 AromaticContact CD2-CG 3.3Å; F208-Y249 HydrophobicContact CD2-CG 3.3Å; F208-Y249 HydrophobicContact CE2-CD1 4.33Å; F208-Y249 HydrophobicContact CE2-CD2 4.16Å; F208-Y249 AromaticContact CE2-CG 3.82Å; F208-Y249 HydrophobicContact CE2-CG 3.82Å; F208-Y249 AromaticContact CG-CD1 3.99Å; F208-Y249 HydrophobicContact CG-CD1 3.99Å; F208-Y249 HydrophobicContact CG-CE1 4.19Å; F208-Y249 HydrophobicContact CG-CG 4.27Å; F208-Y249 PolarHBondContact N-OH 2.84Å; V245-Y249 HydrophobicContact CB-CD2 4.48Å; V245-Y249 HydrophobicContact CG1-CD2 3.62Å; V245-Y249 HydrophobicContact CG1-CE2 3.94Å; V245-Y249 WeakPolarHBondContact O-CB 3.46Å; V245-Y249 VanDerWaalsContact O-CD2 3.26Å; V245-Y249 WeakPolarHBondContact O-CD2 3.39Å; V245-Y249 PolarHBondContact O-N 3.33Å; Y249-V252 PolarHBondContact O-N 2.91Å; Y249-I253 WeakPolarHBondContact O-CB 3.27Å; Y249-I253 WeakPolarHBondContact O-CD1 3.29Å; Y249-I253 WeakPolarHBondContact O-CG1 3.34Å; Y249-I253 PolarHBondContact O-N 2.92Å
250S64.3Low59Low62 Ų6254.7 Ų54.743%0.43429%0.294SS..Hα-helixtrans-61.3-45.5179.7-590000113.4T246 Y254T246-S250 WeakPolarHBondContact O-CB 3.42Å; T246-S250 PolarHBondContact O-N 3.41Å; T246-S250 PolarHBondContact O-OG 2.91Å; S250-Y254 VanDerWaalsContact O-CB 3.26Å; S250-Y254 WeakPolarHBondContact O-CB 3.04Å; S250-Y254 PolarHBondContact O-N 3.04Å
251P60.3Low57.6Low39 Ų3959.9 Ų59.925%0.25333%0.331SS..Hα-helixtrans-63-43.1173.5-21.232.7000112.4L247 Y248 Y254 T255 Y275L247-P251 WeakPolarHBondContact O-CD 3.22Å; L247-P251 WeakPolarHBondContact O-CG 3.39Å; Y248-P251 WeakPolarHBondContact O-CD 3.15Å; P251-Y254 WeakPolarHBondContact O-CB 3.42Å; P251-Y254 PolarHBondContact O-N 2.92Å; P251-T255 PolarHBondContact O-N 3.42Å; P251-T255 PolarHBondContact O-OG1 2.93Å; P251-Y275 HydrophobicContact CB-CD1 4.41Å
252V58.2Low56.4Low25 Ų2562.4 Ų62.415%0.15235%0.349CS..Hα-helixtrans-59-51.6179.1175.90000110.1Y248 Y249 Y254 T255 Y256Y248-V252 WeakPolarHBondContact O-CG2 3.38Å; Y249-V252 PolarHBondContact O-N 2.91Å; V252-Y254 VanDerWaalsContact C-N 3.31Å; V252-Y254 PolarHBondContact O-N 2.92Å; V252-T255 PolarHBondContact O-N 3.23Å; V252-Y256 HydrophobicContact CG1-CD2 3.77Å; V252-Y256 HydrophobicContact CG1-CE2 3.91Å; V252-Y256 VanDerWaalsContact O-CD2 3.24Å; V252-Y256 WeakPolarHBondContact O-CD2 3.37Å; V252-Y256 PolarHBondContact O-N 3.43Å
253I60.3Low55.2Low63 Ų6365.7 Ų65.732%0.32336%0.358SS..Hα-helixtrans-60.4-41.5177.3-68166.8000111.1F208 Y249 T255 Y256 I257F208-I253 HydrophobicContact CE1-CD1 3.97Å; F208-I253 HydrophobicContact CE2-CD1 3.93Å; F208-I253 HydrophobicContact CZ-CD1 3.58Å; Y249-I253 WeakPolarHBondContact O-CB 3.27Å; Y249-I253 WeakPolarHBondContact O-CD1 3.29Å; Y249-I253 WeakPolarHBondContact O-CG1 3.34Å; Y249-I253 PolarHBondContact O-N 2.92Å; I253-T255 VanDerWaalsContact C-N 3.33Å; I253-T255 PolarHBondContact O-N 3.37Å; I253-Y256 PolarHBondContact O-N 3.41Å; I253-I257 HydrophobicContact CG2-CD1 3.41Å; I253-I257 VanDerWaalsContact CG2-CD1 3.41Å; I253-I257 HydrophobicContact CG2-CG1 4.13Å; I253-I257 WeakPolarHBondContact O-CB 3.35Å; I253-I257 VanDerWaalsContact O-CG1 3.3Å; I253-I257 WeakPolarHBondContact O-CG1 3.44Å; I253-I257 PolarHBondContact O-N 3.36Å
254Y56.5Low54Low130 Ų13067.3 Ų67.351%0.5137%0.368SS..Hα-helixtrans-63.4-38.6178.4-176.1-102.7000112.5S250 P251 V252 R258S250-Y254 VanDerWaalsContact O-CB 3.26Å; S250-Y254 WeakPolarHBondContact O-CB 3.04Å; S250-Y254 PolarHBondContact O-N 3.04Å; P251-Y254 WeakPolarHBondContact O-CB 3.42Å; P251-Y254 PolarHBondContact O-N 2.92Å; V252-Y254 VanDerWaalsContact C-N 3.31Å; V252-Y254 PolarHBondContact O-N 2.92Å; Y254-R258 PolarHBondContact OH-NH2 3.41Å
255T51.5Low52.7Low31 Ų3173.1 Ų73.119%0.1939%0.393CS..Hα-helixtrans-69-42.3176.4-55.70000111.4P251 V252 I253P251-T255 PolarHBondContact O-N 3.42Å; P251-T255 PolarHBondContact O-OG1 2.93Å; V252-T255 PolarHBondContact O-N 3.23Å; I253-T255 VanDerWaalsContact C-N 3.33Å; I253-T255 PolarHBondContact O-N 3.37Å
256Y45.8Very low51.5Low133 Ų13381.1 Ų81.152%0.52243%0.43SS..Hα-helixtrans-78.3-24.6-177.6-81.9-74.1000115.1D200 V252 I253D200-Y256 PolarHBondContact OD1-OH 3.07Å; D200-Y256 VanDerWaalsContact OD1-OH 3.04Å; D200-Y256 PolarHBondContact OD2-OH 3.09Å; V252-Y256 HydrophobicContact CG1-CD2 3.77Å; V252-Y256 HydrophobicContact CG1-CE2 3.91Å; V252-Y256 VanDerWaalsContact O-CD2 3.24Å; V252-Y256 WeakPolarHBondContact O-CD2 3.37Å; V252-Y256 PolarHBondContact O-N 3.43Å; I253-Y256 PolarHBondContact O-N 3.41Å
257I45.8Very low50.1Low130 Ų13085.9 Ų85.967%0.66744%0.44SS*.Hα-helixtrans-82-15.1177.8-69.9179.6000112.2I253I253-I257 HydrophobicContact CG2-CD1 3.41Å; I253-I257 VanDerWaalsContact CG2-CD1 3.41Å; I253-I257 HydrophobicContact CG2-CG1 4.13Å; I253-I257 WeakPolarHBondContact O-CB 3.35Å; I253-I257 VanDerWaalsContact O-CG1 3.3Å; I253-I257 WeakPolarHBondContact O-CG1 3.44Å; I253-I257 PolarHBondContact O-N 3.36Å
258R44.8Very low49.1Very low86 Ų8684.2 Ų84.233%0.32543%0.432SS..SBendtrans-68.4132.2178-83.4-156-151.5-125.113.4111.3Y254 A260Y254-R258 PolarHBondContact OH-NH2 3.41Å; R258-A260 PolarHBondContact O-N 2.95Å
259P37.1Very low48.1Very low80 Ų8085.1 Ų85.152%0.51944%0.436SS..  trans-64.6136.3174.623.9-29.7000110.7S261 S262P259-S261 PolarHBondContact O-N 2.97Å; P259-S262 PolarHBondContact O-N 2.92Å; P259-S262 PolarHBondContact O-OG 3.34Å
260A42.3Very low47Very low85 Ų8590 Ų9070%0.70247%0.466SS*.G310 helixtrans-52.7-21.6179.300000114R258 S262 Y263R258-A260 PolarHBondContact O-N 2.95Å; A260-S262 VanDerWaalsContact C-N 3.25Å; A260-S262 PolarHBondContact O-N 3.18Å; A260-Y263 WeakPolarHBondContact O-CB 3.17Å; A260-Y263 PolarHBondContact O-N 2.94Å
261S38.4Very low45.9Very low116 Ų11689.1 Ų89.181%0.81146%0.458SS*.G310 helixtrans-73.5-9.2176.356.70000115P259P259-S261 PolarHBondContact O-N 2.97Å
262S44.4Very low45.2Very low53 Ų5387.4 Ų87.437%0.37145%0.447SS..G310 helixtrans-105.76.8177.256.20000113.8P259 A260P259-S262 PolarHBondContact O-N 2.92Å; P259-S262 PolarHBondContact O-OG 3.34Å; A260-S262 VanDerWaalsContact C-N 3.25Å; A260-S262 PolarHBondContact O-N 3.18Å
263Y43.2Very low44.7Very low133 Ų13387 Ų8752%0.52245%0.446SS..  trans-67125.7175.4-99.8-103.4000111.5A260 D268A260-Y263 WeakPolarHBondContact O-CB 3.17Å; A260-Y263 PolarHBondContact O-N 2.94Å; Y263-D268 WeakPolarHBondContact CD1-OD2 3.47Å; Y263-D268 WeakPolarHBondContact CE1-OD2 3.15Å
264T42.9Very low44Very low80 Ų8086.7 Ų86.749%0.49145%0.448SS..  trans-139.4122.416939.30000108.8E266 R267 D268T264-E266 PolarHBondContact O-N 3.29Å; T264-R267 PolarHBondContact O-N 3.4Å; T264-D268 PolarHBondContact O-N 2.94Å
265F41.2Very low43.7Very low123 Ų12383.4 Ų83.454%0.53944%0.435SS..Hα-helixtrans-53.7-28.7-169.7-141.4-94.4000114.4D172D172-F265 HydrophobicContact CB-CE1 4.03Å
266E39.8Very low43.8Very low174 Ų17482.3 Ų82.381%0.81343%0.428SS*.Hα-helixtrans-78.6-26.7177.2-69.6-155.6156.200114.4T264T264-E266 PolarHBondContact O-N 3.29Å
267R38.9Very low44.2Very low167 Ų16776.2 Ų76.263%0.6341%0.405SS*.Hα-helixtrans-82.3-29.9177.1-90.4-170.9179.6-156.90.8112.6T264 K269 V270 V271T264-R267 PolarHBondContact O-N 3.4Å; R267-K269 PolarHBondContact O-N 3.42Å; R267-V270 PolarHBondContact O-N 3.4Å; R267-V270 VanDerWaalsContact O-N 3.17Å; R267-V271 WeakPolarHBondContact O-CG2 3.48Å; R267-V271 PolarHBondContact O-N 2.93Å
268D44.9Very low44.7Very low46 Ų4672.7 Ų72.725%0.24639%0.39CS..Hα-helixtrans-69.7-31.5-177.9-66.6-31.1000112.3Y263 T264 V270 V271 A272Y263-D268 WeakPolarHBondContact CD1-OD2 3.47Å; Y263-D268 WeakPolarHBondContact CE1-OD2 3.15Å; T264-D268 PolarHBondContact O-N 2.94Å; D268-V270 PolarHBondContact O-N 3.21Å; D268-V271 PolarHBondContact O-N 3.24Å; D268-A272 WeakPolarHBondContact O-CA 3.41Å; D268-A272 WeakPolarHBondContact O-CB 3.25Å; D268-A272 PolarHBondContact O-N 3.09Å
269K44.2Very low45.4Very low28 Ų2869.1 Ų69.112%0.12238%0.377CS..Hα-helixtrans-59.7-33.8170.6-71.4179.6-176.8176.90113.3D172 R267 A273D172-K269 WeakPolarHBondContact O-CE 3.23Å; D172-K269 PolarHBondContact O-NZ 3.45Å; D172-K269 IonicContact OD1-NZ 3.62Å; D172-K269 PolarHBondContact OD1-NZ 3Å; D172-K269 IonicContact OD2-NZ 3.28Å; D172-K269 PolarHBondContact OD2-NZ 3.26Å; R267-K269 PolarHBondContact O-N 3.42Å; K269-A273 PolarHBondContact O-N 3.03Å
270V42.1Very low46.4Very low107 Ų10765.3 Ų65.365%0.64835%0.353SS*.Hα-helixtrans-87.6-29.2-177.5-178.30000111.9R267 D268 P274R267-V270 PolarHBondContact O-N 3.4Å; R267-V270 VanDerWaalsContact O-N 3.17Å; D268-V270 PolarHBondContact O-N 3.21Å; V270-P274 WeakPolarHBondContact O-CD 3.46Å; V270-P274 WeakPolarHBondContact O-CG 3.34Å
271V41.2Very low47.2Very low42 Ų4262 Ų6226%0.25532%0.323SS..Hα-helixtrans-83.4-22.1173.9178.50000111.5R267 D268 P274 Y275R267-V271 WeakPolarHBondContact O-CG2 3.48Å; R267-V271 PolarHBondContact O-N 2.93Å; D268-V271 PolarHBondContact O-N 3.24Å; V271-P274 WeakPolarHBondContact O-CD 3.29Å; V271-Y275 VanDerWaalsContact O-CD1 3.28Å; V271-Y275 WeakPolarHBondContact O-CD1 3.22Å; V271-Y275 VanDerWaalsContact O-CE1 3.25Å; V271-Y275 WeakPolarHBondContact O-CE1 3.27Å
272A45.2Very low48.2Very low4 Ų459 Ų593%0.03330%0.298CS..Hα-helixtrans-76.6-47.2176.800000114.7D268 P274 Y275 T276D268-A272 WeakPolarHBondContact O-CA 3.41Å; D268-A272 WeakPolarHBondContact O-CB 3.25Å; D268-A272 PolarHBondContact O-N 3.09Å; A272-P274 VanDerWaalsContact C-N 3.3Å; A272-Y275 WeakPolarHBondContact CA-OH 3.5Å; A272-Y275 HydrophobicContact CB-CE1 4.1Å; A272-Y275 HydrophobicContact CB-CE2 4.37Å; A272-Y275 WeakPolarHBondContact CB-OH 3.26Å; A272-Y275 WeakPolarHBondContact O-CD2 3.26Å; A272-Y275 WeakPolarHBondContact O-CE2 3.39Å; A272-Y275 PolarHBondContact O-N 3.38Å; A272-T276 PolarHBondContact O-N 3.03Å; A272-T276 PolarHBondContact O-OG1 3.31Å
273A47.9Very low49.2Very low16 Ų1656.8 Ų56.813%0.13228%0.282CS..Hα-helixtrans-53.6-35.8-177.500000115F174 K269 L277F174-A273 HydrophobicContact CZ-CB 4.4Å; K269-A273 PolarHBondContact O-N 3.03Å; A273-L277 HydrophobicContact CB-CD1 4.5Å; A273-L277 WeakPolarHBondContact O-CB 3.37Å; A273-L277 PolarHBondContact O-N 3.46Å
274P46.7Very low50.1Low56 Ų5650.5 Ų50.536%0.36426%0.257SS..Hα-helixtrans-61.7-53.4176.3-23.232.4000113.5V270 V271 A272 T276 L277 V278V270-P274 WeakPolarHBondContact O-CD 3.46Å; V270-P274 WeakPolarHBondContact O-CG 3.34Å; V271-P274 WeakPolarHBondContact O-CD 3.29Å; A272-P274 VanDerWaalsContact C-N 3.3Å; P274-T276 VanDerWaalsContact C-N 3.31Å; P274-T276 PolarHBondContact O-N 2.96Å; P274-L277 PolarHBondContact O-N 3.47Å; P274-V278 HydrophobicContact CB-CG2 4.22Å; P274-V278 WeakPolarHBondContact O-CA 3.37Å; P274-V278 WeakPolarHBondContact O-CB 3.26Å; P274-V278 VanDerWaalsContact O-CG2 3.24Å; P274-V278 WeakPolarHBondContact O-CG2 3.4Å; P274-V278 PolarHBondContact O-N 2.02Å
275Y49.7Very low51Low62 Ų6250.1 Ų50.124%0.24325%0.251CS..Hα-helixtrans-69.7-30.3-172.753.2-107000113.2P251 V271 A272 T279P251-Y275 HydrophobicContact CB-CD1 4.41Å; V271-Y275 VanDerWaalsContact O-CD1 3.28Å; V271-Y275 WeakPolarHBondContact O-CD1 3.22Å; V271-Y275 VanDerWaalsContact O-CE1 3.25Å; V271-Y275 WeakPolarHBondContact O-CE1 3.27Å; A272-Y275 WeakPolarHBondContact CA-OH 3.5Å; A272-Y275 HydrophobicContact CB-CE1 4.1Å; A272-Y275 HydrophobicContact CB-CE2 4.37Å; A272-Y275 WeakPolarHBondContact CB-OH 3.26Å; A272-Y275 WeakPolarHBondContact O-CD2 3.26Å; A272-Y275 WeakPolarHBondContact O-CE2 3.39Å; A272-Y275 PolarHBondContact O-N 3.38Å; Y275-T279 WeakPolarHBondContact O-CB 3.15Å; Y275-T279 PolarHBondContact O-OG1 3.46Å
276T52.9Low52.1Low7 Ų745 Ų454%0.04323%0.23CC..Hα-helixtrans-79.2-27.9-178.6-27.40000113.7F101 A272 P274F101-T276 HydrophobicContact CD2-CG2 4.33Å; F101-T276 HydrophobicContact CE2-CG2 3.15Å; F101-T276 HydrophobicContact CZ-CG2 3.32Å; A272-T276 PolarHBondContact O-N 3.03Å; A272-T276 PolarHBondContact O-OG1 3.31Å; P274-T276 VanDerWaalsContact C-N 3.31Å; P274-T276 PolarHBondContact O-N 2.96Å
277L54.7Low53.3Low5 Ų536.9 Ų36.93%0.02619%0.192CC..Hα-helixtrans-120.3-23.7-170.8-62.6165000113.5F28 I31 I75 A273 P274 T281F28-L277 HydrophobicContact CD1-CD1 3.75Å; F28-L277 HydrophobicContact CE1-CD1 3.27Å; F28-L277 HydrophobicContact CZ-CD1 4.23Å; I31-L277 HydrophobicContact CG2-CB 4.37Å; I75-L277 HydrophobicContact CD1-CD2 3.52Å; I75-L277 HydrophobicContact CG1-CD2 3.6Å; A273-L277 HydrophobicContact CB-CD1 4.5Å; A273-L277 WeakPolarHBondContact O-CB 3.37Å; A273-L277 PolarHBondContact O-N 3.46Å; P274-L277 PolarHBondContact O-N 3.47Å; L277-T281 PolarHBondContact O-OG1 2.92Å
278V55.4Low54.5Low57 Ų5729.6 Ų29.635%0.34517%0.166SC..Hα-helixtrans-84.4-28.9178.7-177.50000110.8P274 T281 L282P274-V278 HydrophobicContact CB-CG2 4.22Å; P274-V278 WeakPolarHBondContact O-CA 3.37Å; P274-V278 WeakPolarHBondContact O-CB 3.26Å; P274-V278 VanDerWaalsContact O-CG2 3.24Å; P274-V278 WeakPolarHBondContact O-CG2 3.4Å; P274-V278 PolarHBondContact O-N 2.02Å; V278-T281 VanDerWaalsContact CA-OG1 3.27Å; V278-T281 WeakPolarHBondContact CA-OG1 3.39Å; V278-T281 PolarHBondContact O-N 2.76Å; V278-T281 PolarHBondContact O-OG1 3.44Å; V278-L282 HydrophobicContact CG1-CD1 3.3Å; V278-L282 HydrophobicContact CG1-CG 3.59Å; V278-L282 VanDerWaalsContact O-CB 3.25Å; V278-L282 WeakPolarHBondContact O-CB 3.46Å; V278-L282 WeakPolarHBondContact O-CG 3.03Å; V278-L282 PolarHBondContact O-N 2.96Å
279T61.2Low55.2Low10 Ų1034.4 Ų34.46%0.06119%0.185CC..Hα-helixtrans-61.4-54.6176-55.80000112.4Y248 Y275 T281 L282 N283Y248-T279 HydrophobicContact CD2-CG2 3.29Å; Y248-T279 HydrophobicContact CE2-CG2 3.66Å; Y248-T279 HydrophobicContact CG-CG2 4.46Å; Y275-T279 WeakPolarHBondContact O-CB 3.15Å; Y275-T279 PolarHBondContact O-OG1 3.46Å; T279-T281 PolarHBondContact O-N 3.3Å; T279-T281 VanDerWaalsContact O-N 3.14Å; T279-L282 PolarHBondContact O-N 3.49Å; T279-L282 VanDerWaalsContact O-N 3.13Å; T279-N283 PolarHBondContact O-N 3.23Å; T279-N283 PolarHBondContact O-ND2 2.72Å; T279-N283 PolarHBondContact O-OD1 2.76Å
280P57.7Low56.2Low1 Ų136.8 Ų36.81%0.00620%0.197CC..Hα-helixtrans-68.1-18.5-176-2035.4000113.2N39 D67 T71 P284N39-P280 PolarHBondContact ND2-O 2.9Å; N39-P280 VanDerWaalsContact ND2-O 3.14Å; D67-P280 HydrophobicContact CB-CB 3.95Å; T71-P280 HydrophobicContact CG2-CB 3.8Å; T71-P280 HydrophobicContact CG2-CG 4.14Å; P280-P284 WeakPolarHBondContact O-CD 2.93Å; P280-P284 WeakPolarHBondContact O-CG 3.33Å
281T58.4Low57.4Low14 Ų1433.2 Ų33.29%0.08617%0.174CC..Hα-helixtrans-87.6-32.6174.239.50000113I31 A35 L277 V278 T279 M285I31-T281 HydrophobicContact CG2-CG2 3.86Å; I31-T281 WeakPolarHBondContact O-CG2 3.39Å; A35-T281 HydrophobicContact CB-CG2 3.47Å; A35-T281 VanDerWaalsContact CB-CG2 3.47Å; L277-T281 PolarHBondContact O-OG1 2.92Å; V278-T281 VanDerWaalsContact CA-OG1 3.27Å; V278-T281 WeakPolarHBondContact CA-OG1 3.39Å; V278-T281 PolarHBondContact O-N 2.76Å; V278-T281 PolarHBondContact O-OG1 3.44Å; T279-T281 PolarHBondContact O-N 3.3Å; T279-T281 VanDerWaalsContact O-N 3.14Å; T281-M285 WeakPolarHBondContact O-CG 3.4Å
282L60.3Low58.7Low54 Ų5440.3 Ų40.328%0.28320%0.196SC..Hα-helixtrans-83.7-33.6179.6-70.5-175.3000112.9L247 V278 T279 M285 V286L247-L282 HydrophobicContact CD1-CD1 4.1Å; V278-L282 HydrophobicContact CG1-CD1 3.3Å; V278-L282 HydrophobicContact CG1-CG 3.59Å; V278-L282 VanDerWaalsContact O-CB 3.25Å; V278-L282 WeakPolarHBondContact O-CB 3.46Å; V278-L282 WeakPolarHBondContact O-CG 3.03Å; V278-L282 PolarHBondContact O-N 2.96Å; T279-L282 PolarHBondContact O-N 3.49Å; T279-L282 VanDerWaalsContact O-N 3.13Å; L282-M285 PolarHBondContact O-N 3Å; L282-V286 VanDerWaalsContact O-CG2 3.32Å; L282-V286 WeakPolarHBondContact O-CG2 3.35Å; L282-V286 PolarHBondContact O-N 3.36Å
283N65.8Low59.8Low6 Ų645.1 Ų45.13%0.03222%0.218CC..Hα-helixtrans-52.2-51.8178.3-61-21.9000111.2L63 D67 V244 T279 M285 V286 Y287L63-N283 HydrophobicContact CD2-CB 4.44Å; D67-N283 PolarHBondContact OD2-ND2 2.78Å; V244-N283 WeakPolarHBondContact CG1-OD1 3.47Å; T279-N283 PolarHBondContact O-N 3.23Å; T279-N283 PolarHBondContact O-ND2 2.72Å; T279-N283 PolarHBondContact O-OD1 2.76Å; N283-M285 PolarHBondContact O-N 2.98Å; N283-V286 PolarHBondContact O-N 3.08Å; N283-Y287 HydrophobicContact CB-CD2 4.45Å; N283-Y287 HydrophobicContact CB-CE2 4.45Å; N283-Y287 WeakPolarHBondContact O-CD2 3.39Å; N283-Y287 PolarHBondContact O-N 3.11Å
284P61.2Low61.1Low1 Ų144.4 Ų44.41%0.00621%0.212CC..Hα-helixtrans-68.4-37-176-23.138.4000112.5S38 N39 I42 P280 S288S38-P284 WeakPolarHBondContact OG-CB 3.42Å; N39-P284 WeakPolarHBondContact ND2-CG 3.36Å; N39-P284 VanDerWaalsContact OD1-CG 3.22Å; N39-P284 WeakPolarHBondContact OD1-CG 3.48Å; I42-P284 VanDerWaalsContact CD1-CA 3.48Å; I42-P284 HydrophobicContact CD1-CB 3.51Å; I42-P284 HydrophobicContact CD1-CG 4.3Å; P280-P284 WeakPolarHBondContact O-CD 2.93Å; P280-P284 WeakPolarHBondContact O-CG 3.33Å; P284-S288 WeakPolarHBondContact O-CB 3.15Å; P284-S288 PolarHBondContact O-N 3.26Å; P284-S288 PolarHBondContact O-OG 3.17Å
285M60.8Low62.4Low72 Ų7244.8 Ų44.836%0.35521%0.209SC..Hα-helixtrans-65.3-46.7177.6-70.2-168.8-177.900110.8V34 T281 L282 N283 S288 F289V34-M285 HydrophobicContact CG1-CE 3.33Å; T281-M285 WeakPolarHBondContact O-CG 3.4Å; L282-M285 PolarHBondContact O-N 3Å; N283-M285 PolarHBondContact O-N 2.98Å; M285-S288 PolarHBondContact O-N 3.27Å; M285-F289 HydrophobicContact CB-CD2 3.95Å; M285-F289 HydrophobicContact CB-CE2 4.12Å; M285-F289 HydrophobicContact CG-CD2 4.47Å; M285-F289 HydrophobicContact CG-CE2 4.13Å; M285-F289 VanDerWaalsContact O-CB 3.24Å; M285-F289 WeakPolarHBondContact O-CB 3.36Å; M285-F289 WeakPolarHBondContact O-CD2 3.29Å; M285-F289 PolarHBondContact O-N 3.26Å
286V65.6Low63.7Low15 Ų1547.2 Ų47.29%0.09122%0.222CC..Hα-helixtrans-66-44.8-179.3178.10000110.8S240 T243 V244 L247 L282 N283 Q290S240-V286 WeakPolarHBondContact O-CG1 3.29Å; T243-V286 HydrophobicContact CG2-CG1 4.35Å; V244-V286 HydrophobicContact CG2-CB 3.6Å; V244-V286 HydrophobicContact CG2-CG1 3.45Å; V244-V286 VanDerWaalsContact CG2-CG1 3.45Å; V244-V286 HydrophobicContact CG2-CG2 4.24Å; L247-V286 HydrophobicContact CD1-CG2 4.42Å; L282-V286 VanDerWaalsContact O-CG2 3.32Å; L282-V286 WeakPolarHBondContact O-CG2 3.35Å; L282-V286 PolarHBondContact O-N 3.36Å; N283-V286 PolarHBondContact O-N 3.08Å; V286-Q290 VanDerWaalsContact O-CB 3.31Å; V286-Q290 WeakPolarHBondContact O-CB 3.36Å; V286-Q290 WeakPolarHBondContact O-CG 3.39Å; V286-Q290 PolarHBondContact O-N 2.76Å; V286-Q290 VanDerWaalsContact O-N 3.14Å
287Y65.3Low64.7Low5 Ų546.9 Ų46.92%0.0222%0.22CC..Hα-helixtrans-67.9-38177.9-72-61.3000112.7M56 L60 L63 H241 V244 N283 N291M56-Y287 HydrophobicContact CE-CE1 4.25Å; L60-Y287 HydrophobicContact CD1-CD1 4.27Å; L60-Y287 HydrophobicContact CD1-CG 4.4Å; L60-Y287 HydrophobicContact CD2-CD1 3.88Å; L60-Y287 HydrophobicContact CD2-CD2 3.45Å; L60-Y287 VanDerWaalsContact CD2-CD2 3.45Å; L60-Y287 HydrophobicContact CD2-CE1 3.92Å; L60-Y287 HydrophobicContact CD2-CE2 3.51Å; L60-Y287 HydrophobicContact CD2-CG 3.67Å; L63-Y287 HydrophobicContact CD2-CE2 4.24Å; H241-Y287 PolarHBondContact CD2-OH 2.97Å; V244-Y287 HydrophobicContact CB-CE2 4.42Å; V244-Y287 HydrophobicContact CG1-CE2 4.16Å; V244-Y287 HydrophobicContact CG2-CD2 4.35Å; V244-Y287 HydrophobicContact CG2-CE1 4.45Å; V244-Y287 HydrophobicContact CG2-CE2 3.85Å; N283-Y287 HydrophobicContact CB-CD2 4.45Å; N283-Y287 HydrophobicContact CB-CE2 4.45Å; N283-Y287 WeakPolarHBondContact O-CD2 3.39Å; N283-Y287 PolarHBondContact O-N 3.11Å; Y287-N291 WeakPolarHBondContact O-CB 3.48Å; Y287-N291 PolarHBondContact O-N 3.13Å
288S63.4Low65.8Low14 Ų1447.6 Ų47.610%0.09822%0.224CC..Hα-helixtrans-76.7-40.3-179.8-57.30000113.1P284 M285 Q295P284-S288 WeakPolarHBondContact O-CB 3.15Å; P284-S288 PolarHBondContact O-N 3.26Å; P284-S288 PolarHBondContact O-OG 3.17Å; M285-S288 PolarHBondContact O-N 3.27Å; S288-Q295 WeakPolarHBondContact O-CG 3.47Å
289F59.2Low66.9Low147 Ų14753.2 Ų53.265%0.64524%0.239SC*.Hα-helixtrans-81.8-26-176.7-73.2-64000113.7M285 Q295M285-F289 HydrophobicContact CB-CD2 3.95Å; M285-F289 HydrophobicContact CB-CE2 4.12Å; M285-F289 HydrophobicContact CG-CD2 4.47Å; M285-F289 HydrophobicContact CG-CE2 4.13Å; M285-F289 VanDerWaalsContact O-CB 3.24Å; M285-F289 WeakPolarHBondContact O-CB 3.36Å; M285-F289 WeakPolarHBondContact O-CD2 3.29Å; M285-F289 PolarHBondContact O-N 3.26Å; F289-Q295 PolarHBondContact O-NE2 3.08Å
290Q64.6Low67.7Low78 Ų7858.2 Ų58.236%0.36426%0.26SS..Hα-helixtrans-101.2-15-177.2-58.2-171.213.100113.7V286V286-Q290 VanDerWaalsContact O-CB 3.31Å; V286-Q290 WeakPolarHBondContact O-CB 3.36Å; V286-Q290 WeakPolarHBondContact O-CG 3.39Å; V286-Q290 PolarHBondContact O-N 2.76Å; V286-Q290 VanDerWaalsContact O-N 3.14Å
291N68.5Low68.7Low31 Ų3158.8 Ų58.817%0.16626%0.263CS..  trans-101.8111.6179.5-167.5-32.8000112Y57 Y287 E293 M294 Q295Y57-N291 PolarHBondContact OH-ND2 3.19Å; Y57-N291 PolarHBondContact OH-OD1 3.17Å; Y287-N291 WeakPolarHBondContact O-CB 3.48Å; Y287-N291 PolarHBondContact O-N 3.13Å; N291-E293 VanDerWaalsContact C-N 3.33Å; N291-E293 PolarHBondContact O-N 2.92Å; N291-E293 PolarHBondContact OD1-N 2.71Å; N291-M294 HydrophobicContact CB-CB 3.99Å; N291-M294 WeakPolarHBondContact O-CB 3.12Å; N291-M294 PolarHBondContact O-N 3.14Å; N291-M294 VanDerWaalsContact O-N 3.16Å; N291-Q295 WeakPolarHBondContact O-CG 3.26Å; N291-Q295 PolarHBondContact O-N 2.8Å
292R67.4Low69.7Low191 Ų19163.9 Ų63.972%0.72128%0.284SS*.Hα-helixtrans-58.9-38.7-179.8-72.8-175.1173.4-171.2-3.8113.7M294 Q295 E296R292-M294 VanDerWaalsContact C-N 3.31Å; R292-M294 PolarHBondContact O-N 3.46Å; R292-Q295 WeakPolarHBondContact O-CB 3.41Å; R292-Q295 PolarHBondContact O-N 3.46Å; R292-E296 WeakPolarHBondContact O-CG 3.43Å; R292-E296 PolarHBondContact O-N 2.83Å
293E69.8Low70.5Confident106 Ų10664.1 Ų64.150%0.49530%0.295SS..Hα-helixtrans-66.8-36.6179.3-67.2175.2-179.400110.7L52 Y57 N291 G297L52-E293 HydrophobicContact CD2-CB 4.07Å; Y57-E293 VanDerWaalsContact OH-CB 3.3Å; Y57-E293 WeakPolarHBondContact OH-CB 3.43Å; Y57-E293 PolarHBondContact OH-OE2 2.86Å; Y57-E293 VanDerWaalsContact OH-OE2 3.06Å; N291-E293 VanDerWaalsContact C-N 3.33Å; N291-E293 PolarHBondContact O-N 2.92Å; N291-E293 PolarHBondContact OD1-N 2.71Å; E293-G297 PolarHBondContact O-N 3.45Å
294M73.9Confident70.9Confident1 Ų171.8 Ų71.81%0.00533%0.328CS..Hα-helixtrans-68.8-42.7173.2-173.959.478.200111.5I42 A45 I46 Y57 N291 R292 E296 G297 I298I42-M294 HydrophobicContact CG2-CE 4.1Å; A45-M294 HydrophobicContact CB-SD 4.1Å; I46-M294 HydrophobicContact CD1-CE 4.14Å; I46-M294 HydrophobicContact CG1-CE 4.08Å; Y57-M294 HydrophobicContact CD1-CE 3.83Å; Y57-M294 HydrophobicContact CE1-CE 3.83Å; N291-M294 HydrophobicContact CB-CB 3.99Å; N291-M294 WeakPolarHBondContact O-CB 3.12Å; N291-M294 PolarHBondContact O-N 3.14Å; N291-M294 VanDerWaalsContact O-N 3.16Å; R292-M294 VanDerWaalsContact C-N 3.31Å; R292-M294 PolarHBondContact O-N 3.46Å; M294-E296 VanDerWaalsContact C-N 3.29Å; M294-E296 PolarHBondContact O-N 3.22Å; M294-G297 PolarHBondContact O-N 3.24Å; M294-I298 HydrophobicContact CG-CD1 3.93Å; M294-I298 HydrophobicContact CG-CG1 4.45Å; M294-I298 WeakPolarHBondContact O-CB 3.28Å; M294-I298 WeakPolarHBondContact O-CG1 3.37Å; M294-I298 PolarHBondContact O-N 3.44Å; M294-I298 HydrophobicContact SD-CD1 4.35Å; M294-I298 HydrophobicContact SD-CG1 4.38Å
295Q74.6Confident71.3Confident64 Ų6477.5 Ų77.530%0.29936%0.358SS..Hα-helixtrans-58.6-41.3175.2-69.8-178.4-21.800112.3S288 F289 N291 R292 I298 R299S288-Q295 WeakPolarHBondContact O-CG 3.47Å; F289-Q295 PolarHBondContact O-NE2 3.08Å; N291-Q295 WeakPolarHBondContact O-CG 3.26Å; N291-Q295 PolarHBondContact O-N 2.8Å; R292-Q295 WeakPolarHBondContact O-CB 3.41Å; R292-Q295 PolarHBondContact O-N 3.46Å; Q295-I298 PolarHBondContact O-N 3.03Å; Q295-R299 WeakPolarHBondContact O-CB 3.48Å; Q295-R299 WeakPolarHBondContact O-CG 3.37Å; Q295-R299 PolarHBondContact O-N 3.08Å
296E76.6Confident71.7Confident112 Ų11283.1 Ų83.152%0.52338%0.38SS..Hα-helixtrans-66.9-41.4176.2-75.2177.9-172.900112R292 M294 R299 K300R292-E296 WeakPolarHBondContact O-CG 3.43Å; R292-E296 PolarHBondContact O-N 2.83Å; M294-E296 VanDerWaalsContact C-N 3.29Å; M294-E296 PolarHBondContact O-N 3.22Å; E296-R299 PolarHBondContact O-N 3.29Å; E296-K300 WeakPolarHBondContact O-CG 3.49Å; E296-K300 PolarHBondContact O-N 3.41Å; E296-K300 VanDerWaalsContact O-N 3.1Å
297G74.6Confident71Confident0 Ų093.1 Ų93.10%043%0.426CS..Hα-helixtrans-57.9-49.3172.500000112.2E293 M294 R299 K300 V301E293-G297 PolarHBondContact O-N 3.45Å; M294-G297 PolarHBondContact O-N 3.24Å; G297-R299 PolarHBondContact O-N 3.02Å; G297-K300 WeakPolarHBondContact O-CB 3.33Å; G297-K300 PolarHBondContact O-N 3.44Å; G297-K300 VanDerWaalsContact O-N 3.17Å; G297-V301 PolarHBondContact O-N 3.08Å; G297-V301 VanDerWaalsContact O-N 3.13Å
298I77.6Confident71.2Confident20 Ų2097.6 Ų97.610%0.10345%0.446CS..Hα-helixtrans-61.2-42.5178.1-70.9172.2000111.5L41 A45 M294 Q295 K300 V301 F302L41-I298 HydrophobicContact CD1-CG2 4.33Å; L41-I298 HydrophobicContact CD2-CD1 4.05Å; L41-I298 HydrophobicContact CD2-CG1 4.21Å; L41-I298 HydrophobicContact CD2-CG2 3.93Å; L41-I298 HydrophobicContact CG-CD1 4.3Å; L41-I298 HydrophobicContact CG-CG1 4.09Å; L41-I298 HydrophobicContact CG-CG2 4.38Å; A45-I298 HydrophobicContact CB-CG1 4.04Å; M294-I298 HydrophobicContact CG-CD1 3.93Å; M294-I298 HydrophobicContact CG-CG1 4.45Å; M294-I298 WeakPolarHBondContact O-CB 3.28Å; M294-I298 WeakPolarHBondContact O-CG1 3.37Å; M294-I298 PolarHBondContact O-N 3.44Å; M294-I298 HydrophobicContact SD-CD1 4.35Å; M294-I298 HydrophobicContact SD-CG1 4.38Å; Q295-I298 PolarHBondContact O-N 3.03Å; I298-K300 VanDerWaalsContact C-N 3.3Å; I298-K300 PolarHBondContact O-N 3.27Å; I298-V301 WeakPolarHBondContact O-CB 3.34Å; I298-V301 PolarHBondContact O-N 2.8Å; I298-V301 VanDerWaalsContact O-N 3.17Å; I298-F302 HydrophobicContact CG2-CD2 3.57Å; I298-F302 HydrophobicContact CG2-CE2 3.37Å; I298-F302 VanDerWaalsContact O-CD2 3.26Å; I298-F302 WeakPolarHBondContact O-CD2 3.48Å; I298-F302 PolarHBondContact O-N 2.84Å
299R79.4Confident71.7Confident175 Ų175101.9 Ų101.966%0.6646%0.464SS*.Hα-helixtrans-59.5-39.6175.7-79.8176.8-179.3174.61.2112.4Q295 E296 G297 F302 A303Q295-R299 WeakPolarHBondContact O-CB 3.48Å; Q295-R299 WeakPolarHBondContact O-CG 3.37Å; Q295-R299 PolarHBondContact O-N 3.08Å; E296-R299 PolarHBondContact O-N 3.29Å; G297-R299 PolarHBondContact O-N 3.02Å; R299-F302 PolarHBondContact O-N 2.79Å; R299-A303 WeakPolarHBondContact O-CB 3.12Å; R299-A303 PolarHBondContact O-N 2.84Å
300K77.8Confident72.3Confident116 Ų11699.4 Ų99.450%0.50445%0.454SS..Hα-helixtrans-64.3-40.5175.8-71.2177.5-177.1177.40111.7E296 G297 I298 A303 F304E296-K300 WeakPolarHBondContact O-CG 3.49Å; E296-K300 PolarHBondContact O-N 3.41Å; E296-K300 VanDerWaalsContact O-N 3.1Å; G297-K300 WeakPolarHBondContact O-CB 3.33Å; G297-K300 PolarHBondContact O-N 3.44Å; G297-K300 VanDerWaalsContact O-N 3.17Å; I298-K300 VanDerWaalsContact C-N 3.3Å; I298-K300 PolarHBondContact O-N 3.27Å; K300-A303 PolarHBondContact O-N 2.98Å; K300-F304 WeakPolarHBondContact O-CB 3.23Å; K300-F304 PolarHBondContact O-N 2.96Å
301V78.7Confident72.8Confident12 Ų12100.7 Ų100.77%0.07346%0.459CS..Hα-helixtrans-61.2-48175.3175.40000110.9L41 I44 A45 G297 I298 A303 F304 L305L41-V301 HydrophobicContact CD1-CG1 4.34Å; I44-V301 HydrophobicContact CG2-CG1 3.72Å; I44-V301 HydrophobicContact CG2-CG2 3.98Å; A45-V301 HydrophobicContact CB-CG2 4.28Å; G297-V301 PolarHBondContact O-N 3.08Å; G297-V301 VanDerWaalsContact O-N 3.13Å; I298-V301 WeakPolarHBondContact O-CB 3.34Å; I298-V301 PolarHBondContact O-N 2.8Å; I298-V301 VanDerWaalsContact O-N 3.17Å; V301-A303 VanDerWaalsContact C-N 3.31Å; V301-A303 PolarHBondContact O-N 3.42Å; V301-F304 PolarHBondContact O-N 3.3Å; V301-L305 HydrophobicContact CG1-CD1 3.92Å; V301-L305 HydrophobicContact CG1-CG 4.4Å; V301-L305 WeakPolarHBondContact O-CG 3.46Å; V301-L305 PolarHBondContact O-N 3.12Å
302F79.8Confident73.1Confident121 Ų121105.1 Ų105.153%0.53148%0.478SS..Hα-helixtrans-64.7-33.6176.9-77.5-65.6000113.3L41 I298 R299 K306L41-F302 HydrophobicContact CD1-CE2 4.34Å; L41-F302 HydrophobicContact CD1-CZ 4.42Å; L41-F302 HydrophobicContact CD2-CE2 4.25Å; L41-F302 HydrophobicContact CD2-CZ 4.38Å; I298-F302 HydrophobicContact CG2-CD2 3.57Å; I298-F302 HydrophobicContact CG2-CE2 3.37Å; I298-F302 VanDerWaalsContact O-CD2 3.26Å; I298-F302 WeakPolarHBondContact O-CD2 3.48Å; I298-F302 PolarHBondContact O-N 2.84Å; R299-F302 PolarHBondContact O-N 2.79Å; F302-K306 PolarHBondContact O-N 2.97Å
303A77Confident73.4Confident60 Ų6099.3 Ų99.350%0.49646%0.462SS..Hα-helixtrans-66.9-38173.800000111.9R299 K300 V301R299-A303 WeakPolarHBondContact O-CB 3.12Å; R299-A303 PolarHBondContact O-N 2.84Å; K300-A303 PolarHBondContact O-N 2.98Å; V301-A303 VanDerWaalsContact C-N 3.31Å; V301-A303 PolarHBondContact O-N 3.42Å
304F72.7Confident73.7Confident166 Ų16698.9 Ų98.973%0.72846%0.459SS*.Hα-helixtrans-69.4-41.6175.7-176.4-96.5000112.5K300 V301 K306 H307K300-F304 WeakPolarHBondContact O-CB 3.23Å; K300-F304 PolarHBondContact O-N 2.96Å; V301-F304 PolarHBondContact O-N 3.3Å; F304-K306 PolarHBondContact O-N 3.14Å; F304-H307 PolarHBondContact O-N 3.23Å
305L71Confident73.7Confident121 Ų121106.4 Ų106.463%0.63449%0.494SS*.Hα-helixtrans-68.3-14.4177.7-71.7171.4000114.3V301 H307V301-L305 HydrophobicContact CG1-CD1 3.92Å; V301-L305 HydrophobicContact CG1-CG 4.4Å; V301-L305 WeakPolarHBondContact O-CG 3.46Å; V301-L305 PolarHBondContact O-N 3.12Å; L305-H307 VanDerWaalsContact C-N 3.34Å
306K68.8Low73.6Confident190 Ų190109.9 Ų109.983%0.82651%0.51SS*.THydrogen-bonded Turntrans-86.1-10.1177.8-162.4176.1178.6-176.70112.5F302 F304F302-K306 PolarHBondContact O-N 2.97Å; F304-K306 PolarHBondContact O-N 3.14Å
307H49.6Very low73.3Confident226 Ų226109.7 Ų109.7100%1.04651%0.509SS*.  trans-99.10175.3-97.4-58.9000111.2F304 L305F304-H307 PolarHBondContact O-N 3.23Å; L305-H307 VanDerWaalsContact C-N 3.34Å

Retrieved 307 of 307 residues in 261.3 ms (Link to these results)

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