A0A060YFG0_ONCMY Loading...

rRNA-processing protein UTP23 homolog

Involved in rRNA-processing and ribosome biogenesis.

AlphaFold DB , UniProt , Accession A0A060YFG0, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene UTP23, Length 249 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
1M56.8Low82.5Confident218 Ų218117 Ų117100%1.07454%0.544SS*.  0-33.20-81.5-177.7-145.900114I3M1-I3 PolarHBondContact O-N 3.43Å
2T60.1Low83.6Confident94 Ų94108.2 Ų108.258%0.57750%0.504SS*.Hα-helixtrans-59.5-39.3-179.45.40000114.7K4 R5 Q6T2-K4 PolarHBondContact O-N 2.9Å; T2-R5 PolarHBondContact O-N 3.42Å; T2-Q6 PolarHBondContact O-N 3.43Å
3I75Confident84.4Confident134 Ų134100.4 Ų100.469%0.68747%0.468SS*.Hα-helixtrans-63.2-41-177-59.4172.3000112.2M1 R5 Q6 K7M1-I3 PolarHBondContact O-N 3.43Å; I3-R5 VanDerWaalsContact C-N 3.34Å; I3-R5 PolarHBondContact O-N 3.04Å; I3-Q6 PolarHBondContact O-N 3.26Å; I3-K7 WeakPolarHBondContact O-CB 3.4Å; I3-K7 PolarHBondContact O-N 3.08Å
4K83.6Confident85.2Confident180 Ų18097.6 Ų97.678%0.78346%0.458SS*.Hα-helixtrans-64.3-39.9178.5-68.6-174.3-179.9-178.90111.5T2 K7 K8T2-K4 PolarHBondContact O-N 2.9Å; K4-K7 PolarHBondContact O-N 3.07Å; K4-K8 PolarHBondContact O-N 3.13Å
5R84.2Confident85.9Confident65 Ų6594.1 Ų94.125%0.24544%0.44CS..Hα-helixtrans-66.1-45.3177.9169.6172.5161.1-130.8-10111.6T2 I3 K8 A9 Y52 I144T2-R5 PolarHBondContact O-N 3.42Å; I3-R5 VanDerWaalsContact C-N 3.34Å; I3-R5 PolarHBondContact O-N 3.04Å; R5-K8 PolarHBondContact O-N 3.26Å; R5-A9 PolarHBondContact O-N 3.1Å; R5-Y52 HydrophobicContact CG-CD2 4.49Å; R5-Y52 HydrophobicContact CG-CE2 3.64Å; R5-I144 VanDerWaalsContact CZ-O 3.23Å; R5-I144 PolarHBondContact NE-O 3.34Å; R5-I144 PolarHBondContact NH2-O 3.33Å
6Q86.8Confident86.5Confident72 Ų7288.4 Ų88.434%0.33641%0.413SS..Hα-helixtrans-64.7-41.5175.2-76.1175.2-28.600112T2 I3 K8 A9 K10T2-Q6 PolarHBondContact O-N 3.43Å; I3-Q6 PolarHBondContact O-N 3.26Å; Q6-K8 VanDerWaalsContact C-N 3.3Å; Q6-K8 PolarHBondContact O-N 2.85Å; Q6-A9 PolarHBondContact O-N 3.11Å; Q6-K10 WeakPolarHBondContact O-CB 3.4Å; Q6-K10 PolarHBondContact O-N 3.29Å
7K90.4Very high86.9Confident161 Ų16187.3 Ų87.370%0.741%0.407SS*.Hα-helixtrans-59.2-41.1175.5-171.7175.4-178.7177.10112I3 K4 K11I3-K7 WeakPolarHBondContact O-CB 3.4Å; I3-K7 PolarHBondContact O-N 3.08Å; K4-K7 PolarHBondContact O-N 3.07Å; K7-K11 PolarHBondContact O-N 3.05Å
8K91.3Very high87.2Confident90 Ų9090.7 Ų90.739%0.39142%0.423SS..Hα-helixtrans-65.6-45.2175.3-172.6-178.2175.3-166.20111.7K4 R5 Q6 K10 K11 N12K4-K8 PolarHBondContact O-N 3.13Å; R5-K8 PolarHBondContact O-N 3.26Å; Q6-K8 VanDerWaalsContact C-N 3.3Å; Q6-K8 PolarHBondContact O-N 2.85Å; K8-K10 PolarHBondContact O-N 2.8Å; K8-K11 PolarHBondContact O-N 3.49Å; K8-N12 PolarHBondContact O-N 2.98Å; K8-N12 PolarHBondContact O-OD1 3.04Å
9A91.9Very high87.5Confident1 Ų189.8 Ų89.81%0.00842%0.421CS..Hα-helixtrans-58.8-48.2175.900000111.3R5 Q6 K11 N12 I13 Y52R5-A9 PolarHBondContact O-N 3.1Å; Q6-A9 PolarHBondContact O-N 3.11Å; A9-K11 VanDerWaalsContact C-N 3.32Å; A9-K11 PolarHBondContact O-N 2.9Å; A9-N12 PolarHBondContact O-N 3.44Å; A9-N12 VanDerWaalsContact O-N 3.1Å; A9-I13 VanDerWaalsContact O-CG1 3.26Å; A9-I13 WeakPolarHBondContact O-CG1 3.35Å; A9-I13 PolarHBondContact O-N 3.15Å; A9-Y52 HydrophobicContact CB-CD2 4.41Å; A9-Y52 HydrophobicContact CB-CE1 4.4Å; A9-Y52 HydrophobicContact CB-CE2 3.64Å
10K93.1Very high87.7Confident113 Ų11386.6 Ų86.649%0.49141%0.405SS..Hα-helixtrans-56.7-43.5176.2-173.6174.5-177.9175.80112.4Q6 K8 I13 N14Q6-K10 WeakPolarHBondContact O-CB 3.4Å; Q6-K10 PolarHBondContact O-N 3.29Å; K8-K10 PolarHBondContact O-N 2.8Å; K10-I13 PolarHBondContact O-N 2.91Å; K10-N14 WeakPolarHBondContact O-CB 3.29Å; K10-N14 VanDerWaalsContact O-CG 3.23Å; K10-N14 PolarHBondContact O-N 3.36Å; K10-N14 PolarHBondContact O-OD1 2.98Å
11K94.5Very high88Confident159 Ų15985.7 Ų85.769%0.69141%0.409SS*.Hα-helixtrans-59.6-46.8175.3-175.9179.6177.8179.10111.6K7 K8 A9 N14 F15K7-K11 PolarHBondContact O-N 3.05Å; K8-K11 PolarHBondContact O-N 3.49Å; A9-K11 VanDerWaalsContact C-N 3.32Å; A9-K11 PolarHBondContact O-N 2.9Å; K11-N14 PolarHBondContact O-N 3.36Å; K11-F15 PolarHBondContact O-N 3.48Å; K11-F15 VanDerWaalsContact O-N 3.11Å
12N95.1Very high89.8Confident11 Ų1175.7 Ų75.76%0.05936%0.359CS..Hα-helixtrans-67.9-42.3-179.2-65.6-1.5000111.5K8 A9 N14 F15 Y16 L146 D147K8-N12 PolarHBondContact O-N 2.98Å; K8-N12 PolarHBondContact O-OD1 3.04Å; A9-N12 PolarHBondContact O-N 3.44Å; A9-N12 VanDerWaalsContact O-N 3.1Å; N12-N14 VanDerWaalsContact C-N 3.34Å; N12-N14 PolarHBondContact O-N 3.47Å; N12-F15 WeakPolarHBondContact O-CB 3.4Å; N12-F15 PolarHBondContact O-N 3.25Å; N12-Y16 WeakPolarHBondContact O-CD2 3.34Å; N12-Y16 PolarHBondContact O-N 3.43Å; N12-L146 HydrophobicContact CB-CD2 3.84Å; N12-L146 HydrophobicContact CB-CG 4.45Å; N12-D147 PolarHBondContact ND2-O 3.45Å
13I94.8Very high91.4Very high7 Ų780.7 Ų80.74%0.03637%0.368CS..Hα-helixtrans-60.5-45.5175.9-66.6164.5000110.2A9 K10 F15 Y16 K17 F26 L53 L146A9-I13 VanDerWaalsContact O-CG1 3.26Å; A9-I13 WeakPolarHBondContact O-CG1 3.35Å; A9-I13 PolarHBondContact O-N 3.15Å; K10-I13 PolarHBondContact O-N 2.91Å; I13-F15 VanDerWaalsContact C-N 3.28Å; I13-F15 PolarHBondContact O-N 2.97Å; I13-Y16 PolarHBondContact O-N 3.21Å; I13-K17 HydrophobicContact CG2-CD 4.13Å; I13-K17 HydrophobicContact CG2-CG 4.14Å; I13-K17 WeakPolarHBondContact O-CG 3.43Å; I13-K17 PolarHBondContact O-N 3.36Å; I13-F26 HydrophobicContact CG2-CE1 4.34Å; I13-F26 HydrophobicContact CG2-CZ 3.78Å; I13-L53 HydrophobicContact CD1-CB 4.19Å; I13-L53 HydrophobicContact CD1-CD2 3.65Å; I13-L53 WeakPolarHBondContact CD1-O 3.38Å; I13-L53 HydrophobicContact CG1-CD2 4.24Å; I13-L146 HydrophobicContact CD1-CD2 4.43Å; I13-L146 HydrophobicContact CG1-CD2 3.71Å
14N94.9Very high92.2Very high61 Ų6178.5 Ų78.533%0.32636%0.355SS..Hα-helixtrans-59.7-39.6177.6-75.41.6000111.9K10 K11 N12 Y16 K17 H18K10-N14 WeakPolarHBondContact O-CB 3.29Å; K10-N14 VanDerWaalsContact O-CG 3.23Å; K10-N14 PolarHBondContact O-N 3.36Å; K10-N14 PolarHBondContact O-OD1 2.98Å; K11-N14 PolarHBondContact O-N 3.36Å; N12-N14 VanDerWaalsContact C-N 3.34Å; N12-N14 PolarHBondContact O-N 3.47Å; N14-Y16 VanDerWaalsContact C-N 3.31Å; N14-Y16 PolarHBondContact O-N 3.01Å; N14-K17 PolarHBondContact O-N 3.42Å; N14-H18 PolarHBondContact O-CD2 3.27Å; N14-H18 PolarHBondContact O-N 2.88Å
15F95.7Very high92.8Very high46 Ų4672.7 Ų72.720%0.20234%0.335CS..Hα-helixtrans-56.4-45.1173.4172.4-88.1000111.7K11 N12 I13 N19 F20 P149 V154 V157K11-F15 PolarHBondContact O-N 3.48Å; K11-F15 VanDerWaalsContact O-N 3.11Å; N12-F15 WeakPolarHBondContact O-CB 3.4Å; N12-F15 PolarHBondContact O-N 3.25Å; I13-F15 VanDerWaalsContact C-N 3.28Å; I13-F15 PolarHBondContact O-N 2.97Å; F15-N19 WeakPolarHBondContact CD2-ND2 3.41Å; F15-N19 VanDerWaalsContact CE2-ND2 3.31Å; F15-N19 WeakPolarHBondContact CE2-ND2 3.3Å; F15-N19 WeakPolarHBondContact O-CB 3.37Å; F15-N19 PolarHBondContact O-N 2.62Å; F15-N19 VanDerWaalsContact O-N 3.1Å; F15-N19 PolarHBondContact O-ND2 3.04Å; F15-F20 HydrophobicContact CE1-CD2 4.23Å; F15-F20 AromaticContact CE1-CE2 3.69Å; F15-F20 HydrophobicContact CE1-CE2 3.69Å; F15-F20 HydrophobicContact CZ-CE2 4.1Å; F15-P149 HydrophobicContact CB-CG 4.37Å; F15-P149 HydrophobicContact CD1-CB 3.76Å; F15-P149 HydrophobicContact CD1-CG 3.42Å; F15-P149 VanDerWaalsContact CD1-CG 3.42Å; F15-P149 HydrophobicContact CE1-CB 3.52Å; F15-P149 HydrophobicContact CE1-CG 3.76Å; F15-P149 HydrophobicContact CG-CG 3.86Å; F15-P149 HydrophobicContact CZ-CB 4.09Å; F15-P149 HydrophobicContact CZ-CG 4.44Å; F15-V154 HydrophobicContact CZ-CG2 4.27Å; F15-V157 HydrophobicContact CE2-CB 4.46Å; F15-V157 HydrophobicContact CE2-CG1 4.48Å; F15-V157 HydrophobicContact CE2-CG2 4.22Å; F15-V157 HydrophobicContact CZ-CB 4.36Å; F15-V157 HydrophobicContact CZ-CG2 3.79Å
16Y95.3Very high93.3Very high2 Ų269.6 Ų69.61%0.00832%0.324CS..Hα-helixtrans-71.2-37.2177.4-68.3-69.3000113.2N12 I13 N14 F20 S21 F22 V134 P135 P149N12-Y16 WeakPolarHBondContact O-CD2 3.34Å; N12-Y16 PolarHBondContact O-N 3.43Å; I13-Y16 PolarHBondContact O-N 3.21Å; N14-Y16 VanDerWaalsContact C-N 3.31Å; N14-Y16 PolarHBondContact O-N 3.01Å; Y16-F20 AromaticContact CD1-CD2 3.86Å; Y16-F20 HydrophobicContact CD1-CD2 3.86Å; Y16-F20 HydrophobicContact CD1-CE2 4.44Å; Y16-F20 HydrophobicContact CE1-CD2 4.47Å; Y16-F20 CarbonylContact O-C 3.58Å; Y16-F20 WeakPolarHBondContact O-CA 3.36Å; Y16-F20 WeakPolarHBondContact O-CB 3.48Å; Y16-F20 PolarHBondContact O-N 3.24Å; Y16-S21 PolarHBondContact O-N 3.39Å; Y16-F22 HydrophobicContact CD1-CE2 4.19Å; Y16-F22 WeakPolarHBondContact O-CD2 3.48Å; Y16-F22 PolarHBondContact O-N 2.76Å; Y16-V134 PolarHBondContact OH-O 2.96Å; Y16-P135 HydrophobicContact CD1-CG 3.89Å; Y16-P135 HydrophobicContact CD2-CB 4.01Å; Y16-P135 HydrophobicContact CD2-CG 3.85Å; Y16-P135 HydrophobicContact CE1-CB 4.33Å; Y16-P135 HydrophobicContact CE1-CG 3.89Å; Y16-P135 HydrophobicContact CE2-CB 3.64Å; Y16-P135 HydrophobicContact CE2-CG 3.87Å; Y16-P135 HydrophobicContact CG-CG 3.87Å; Y16-P135 WeakPolarHBondContact OH-CA 3.39Å; Y16-P149 HydrophobicContact CE2-CG 4.21Å; Y16-P149 WeakPolarHBondContact OH-CA 3.41Å
17K94.4Very high93.8Very high70 Ų7068.6 Ų68.630%0.30432%0.319SS..Hα-helixtrans-61.2-46.4175.7-72.1-170.7173.1-174.60111.9I13 N14 S21 F22 E24 F26I13-K17 HydrophobicContact CG2-CD 4.13Å; I13-K17 HydrophobicContact CG2-CG 4.14Å; I13-K17 WeakPolarHBondContact O-CG 3.43Å; I13-K17 PolarHBondContact O-N 3.36Å; N14-K17 PolarHBondContact O-N 3.42Å; K17-S21 WeakPolarHBondContact O-CA 3.12Å; K17-S21 PolarHBondContact O-N 3.24Å; K17-F22 HydrophobicContact CG-CB 4.39Å; K17-E24 IonicContact NZ-OE1 2.71Å; K17-E24 PolarHBondContact NZ-OE1 2.99Å; K17-F26 VanDerWaalsContact CE-CZ 3.41Å
18H92.6Very high94.1Very high149 Ų14960.9 Ų60.969%0.6929%0.285SS*.Hα-helixtrans-76.9-41.5-175.6-69.7-61.2000113.2N14N14-H18 PolarHBondContact O-CD2 3.27Å; N14-H18 PolarHBondContact O-N 2.88Å
19N92.2Very high94.3Very high73 Ų7356.6 Ų56.639%0.3927%0.267SS..Hα-helixtrans-94.1-32.4-172-61-49.3000113.6F15 V157F15-N19 WeakPolarHBondContact CD2-ND2 3.41Å; F15-N19 VanDerWaalsContact CE2-ND2 3.31Å; F15-N19 WeakPolarHBondContact CE2-ND2 3.3Å; F15-N19 WeakPolarHBondContact O-CB 3.37Å; F15-N19 PolarHBondContact O-N 2.62Å; F15-N19 VanDerWaalsContact O-N 3.1Å; F15-N19 PolarHBondContact O-ND2 3.04Å; N19-V157 HydrophobicContact CB-CG1 4.25Å; N19-V157 HydrophobicContact CB-CG2 3.54Å; N19-V157 WeakPolarHBondContact OD1-CG1 3.44Å
20F92.2Very high94.6Very high25 Ų2556.7 Ų56.711%0.1127%0.267CS..SBendtrans-117.114.4-175.1-63.5-84.1000112.3F15 Y16 F22 H114 P132 G133 H156 V157F15-F20 HydrophobicContact CE1-CD2 4.23Å; F15-F20 AromaticContact CE1-CE2 3.69Å; F15-F20 HydrophobicContact CE1-CE2 3.69Å; F15-F20 HydrophobicContact CZ-CE2 4.1Å; Y16-F20 AromaticContact CD1-CD2 3.86Å; Y16-F20 HydrophobicContact CD1-CD2 3.86Å; Y16-F20 HydrophobicContact CD1-CE2 4.44Å; Y16-F20 HydrophobicContact CE1-CD2 4.47Å; Y16-F20 CarbonylContact O-C 3.58Å; Y16-F20 WeakPolarHBondContact O-CA 3.36Å; Y16-F20 WeakPolarHBondContact O-CB 3.48Å; Y16-F20 PolarHBondContact O-N 3.24Å; F20-F22 HydrophobicContact CB-CD2 3.66Å; F20-F22 HydrophobicContact CB-CE2 3.66Å; F20-F22 PolarHBondContact O-N 2.9Å; F20-F22 VanDerWaalsContact O-N 3.12Å; F20-H114 PolarHBondContact O-CD2 3.45Å; F20-H114 PolarHBondContact O-NE2 3.42Å; F20-P132 HydrophobicContact CE1-CB 4.21Å; F20-P132 HydrophobicContact CZ-CB 4.34Å; F20-G133 VanDerWaalsContact CD1-CA 3.41Å; F20-H156 AromaticContact CE1-CD2 3.78Å; F20-H156 AromaticContact CZ-CD2 3.95Å; F20-V157 HydrophobicContact CE2-CG2 3.67Å; F20-V157 HydrophobicContact CZ-CG2 3.85Å
21S92.2Very high94.6Very high68 Ų6851.7 Ų51.748%0.47625%0.246SC..  trans55.630.1173.7-61.20000115.8Y16 K17Y16-S21 PolarHBondContact O-N 3.39Å; K17-S21 WeakPolarHBondContact O-CA 3.12Å; K17-S21 PolarHBondContact O-N 3.24Å
22F94.8Very high94.6Very high8 Ų844.2 Ų44.24%0.03521%0.214CC..  trans-62.9138.3176.2-84.1-105.2000111.9Y16 K17 F20 H114 F116 G133 P135Y16-F22 HydrophobicContact CD1-CE2 4.19Å; Y16-F22 WeakPolarHBondContact O-CD2 3.48Å; Y16-F22 PolarHBondContact O-N 2.76Å; K17-F22 HydrophobicContact CG-CB 4.39Å; F20-F22 HydrophobicContact CB-CD2 3.66Å; F20-F22 HydrophobicContact CB-CE2 3.66Å; F20-F22 PolarHBondContact O-N 2.9Å; F20-F22 VanDerWaalsContact O-N 3.12Å; F22-H114 HydrophobicContact CD1-CB 3.8Å; F22-H114 HydrophobicContact CD2-CB 4.29Å; F22-H114 VanDerWaalsContact CE1-C 3.43Å; F22-H114 HydrophobicContact CE1-CB 3.7Å; F22-H114 WeakPolarHBondContact CE1-O 3.33Å; F22-H114 HydrophobicContact CE2-CB 4.17Å; F22-H114 HydrophobicContact CG-CB 4.13Å; F22-H114 HydrophobicContact CZ-CB 3.89Å; F22-F116 HydrophobicContact CD1-CD2 4.06Å; F22-F116 AromaticContact CD1-CE2 3.37Å; F22-F116 HydrophobicContact CD1-CE2 3.37Å; F22-F116 HydrophobicContact CD1-CZ 4.05Å; F22-F116 AromaticContact CE1-CD2 3.75Å; F22-F116 HydrophobicContact CE1-CD2 3.75Å; F22-F116 AromaticContact CE1-CE2 3.5Å; F22-F116 HydrophobicContact CE1-CE2 3.5Å; F22-F116 HydrophobicContact CE1-CZ 4.25Å; F22-F116 HydrophobicContact CG-CE2 4.5Å; F22-G133 WeakPolarHBondContact CZ-O 3.49Å; F22-P135 HydrophobicContact CE1-CG 3.74Å; F22-P135 HydrophobicContact CE2-CG 4.39Å; F22-P135 HydrophobicContact CZ-CG 3.64Å
23R93.8Very high94.6Very high200 Ų20046.4 Ų46.476%0.75523%0.227SC*.  trans-132.3157.6-179.4-62.5179.3-169.7179.11.4111
24E92.8Very high94.6Very high88 Ų8846 Ų4641%0.41123%0.226SC..SBendtrans-82.2145.4171.6-70.7168.7-141.800109.5K17 F26K17-E24 IonicContact NZ-OE1 2.71Å; K17-E24 PolarHBondContact NZ-OE1 2.99Å; E24-F26 HydrophobicContact CG-CD1 4.34Å; E24-F26 HydrophobicContact CG-CD2 4.07Å; E24-F26 HydrophobicContact CG-CE1 3.91Å; E24-F26 HydrophobicContact CG-CE2 3.61Å; E24-F26 HydrophobicContact CG-CG 4.42Å; E24-F26 HydrophobicContact CG-CZ 3.52Å
25P95.6Very high94.6Very high57 Ų5743.1 Ų43.137%0.3721%0.21SC..SBendcis-73.8136.4-0.430.5-35.3000112.7Q27 E56 Q58P25-Q27 PolarHBondContact O-N 3.27Å; P25-E56 CarbonylContact C-O 3.5Å; P25-E56 WeakPolarHBondContact CA-O 3.41Å; P25-E56 HydrophobicContact CB-CB 4Å; P25-Q58 HydrophobicContact CB-CB 4.49Å
26F95.8Very high94.5Very high1 Ų143 Ų430%0.00421%0.21CC..EExtended strand (participates in β ladder)trans-70.1121179.5-59.4-57.6000110.7I13 K17 E24 L53 E56 V57 Q58 F116I13-F26 HydrophobicContact CG2-CE1 4.34Å; I13-F26 HydrophobicContact CG2-CZ 3.78Å; K17-F26 VanDerWaalsContact CE-CZ 3.41Å; E24-F26 HydrophobicContact CG-CD1 4.34Å; E24-F26 HydrophobicContact CG-CD2 4.07Å; E24-F26 HydrophobicContact CG-CE1 3.91Å; E24-F26 HydrophobicContact CG-CE2 3.61Å; E24-F26 HydrophobicContact CG-CG 4.42Å; E24-F26 HydrophobicContact CG-CZ 3.52Å; F26-L53 HydrophobicContact CD2-CB 4.26Å; F26-L53 HydrophobicContact CD2-CD1 4.22Å; F26-L53 HydrophobicContact CE2-CB 4.38Å; F26-E56 PolarHBondContact N-O 3.31Å; F26-V57 HydrophobicContact CD2-CG2 4.43Å; F26-V57 WeakPolarHBondContact O-CA 3.4Å; F26-Q58 PolarHBondContact O-N 3.43Å; F26-F116 HydrophobicContact CB-CD2 4.16Å; F26-F116 HydrophobicContact CB-CE2 3.88Å; F26-F116 AromaticContact CD1-CE2 3.57Å; F26-F116 HydrophobicContact CD1-CE2 3.57Å; F26-F116 AromaticContact CD1-CZ 3.95Å; F26-F116 HydrophobicContact CD1-CZ 3.95Å; F26-F116 HydrophobicContact CE1-CE2 4.35Å; F26-F116 HydrophobicContact CE1-CZ 4.36Å; F26-F116 AromaticContact CG-CE2 3.92Å; F26-F116 HydrophobicContact CG-CE2 3.92Å; F26-F116 HydrophobicContact CG-CZ 4.27Å
27Q95.9Very high94.5Very high50 Ų5043.6 Ų43.623%0.23422%0.216CC..EExtended strand (participates in β ladder)trans-87.5120179-59.7-179.343.200109.5P25 Q58 Y115 F116P25-Q27 PolarHBondContact O-N 3.27Å; Q27-Q58 WeakPolarHBondContact CA-O 3.26Å; Q27-Q58 HydrophobicContact CG-CB 4.47Å; Q27-Y115 HydrophobicContact CB-CD1 3.61Å; Q27-Y115 HydrophobicContact CB-CE1 3.84Å; Q27-Y115 WeakPolarHBondContact O-CA 3.26Å; Q27-F116 PolarHBondContact O-N 2.84Å
28I96.8Very high94.5Very high0 Ų040.3 Ų40.30%020%0.201CC..EExtended strand (participates in β ladder)trans-117.6115.8-176.4-48-176.8000109.3I30 M49 L53 V57 Q58 L59 C60 F116 A118 M137I28-I30 HydrophobicContact CG2-CG1 4.24Å; I28-I30 PolarHBondContact O-N 3.34Å; I28-M49 HydrophobicContact CD1-CE 4.12Å; I28-M49 HydrophobicContact CD1-CG 3.39Å; I28-M49 HydrophobicContact CD1-SD 3.81Å; I28-L53 HydrophobicContact CD1-CD1 3.64Å; I28-V57 HydrophobicContact CD1-CG1 3.34Å; I28-V57 HydrophobicContact CD1-CG2 4.45Å; I28-V57 HydrophobicContact CG1-CG1 3.82Å; I28-Q58 PolarHBondContact N-O 3.46Å; I28-L59 HydrophobicContact CB-CD2 4.17Å; I28-L59 HydrophobicContact CD1-CD2 4.13Å; I28-L59 HydrophobicContact CG1-CD2 4.49Å; I28-C60 WeakPolarHBondContact O-CA 3.25Å; I28-C60 PolarHBondContact O-N 3.21Å; I28-C60 VanDerWaalsContact O-O 3.11Å; I28-F116 CarbonylContact C-O 3.58Å; I28-F116 WeakPolarHBondContact CA-O 3.45Å; I28-F116 HydrophobicContact CB-CB 4.26Å; I28-F116 HydrophobicContact CG1-CB 3.95Å; I28-F116 HydrophobicContact CG1-CG 4.42Å; I28-F116 HydrophobicContact CG2-CB 4.1Å; I28-A118 HydrophobicContact CG2-CB 3.96Å; I28-M137 HydrophobicContact CD1-SD 4.13Å
29L96.8Very high94.6Very high0 Ų036.4 Ų36.40%019%0.185CC..EExtended strand (participates in β ladder)trans-78.6115.3169.7-65.1173.5000108.8C60 R88 L103 M106 L107 Y115 F116 A118L29-C60 WeakPolarHBondContact CA-O 3.41Å; L29-C60 HydrophobicContact CD2-CB 4.03Å; L29-R88 HydrophobicContact CD2-CG 4.38Å; L29-L103 HydrophobicContact CB-CD2 3.89Å; L29-L103 HydrophobicContact CD1-CD2 3.82Å; L29-L103 HydrophobicContact CG-CD2 4.31Å; L29-M106 HydrophobicContact CD2-CE 4.4Å; L29-L107 HydrophobicContact CD1-CD2 4.49Å; L29-Y115 HydrophobicContact CD1-CD1 4.04Å; L29-Y115 HydrophobicContact CD1-CD2 3.78Å; L29-Y115 HydrophobicContact CD1-CE2 4.39Å; L29-Y115 HydrophobicContact CD1-CG 3.59Å; L29-Y115 HydrophobicContact CD2-CD1 4.06Å; L29-Y115 HydrophobicContact CD2-CE1 4.13Å; L29-Y115 HydrophobicContact CD2-CG 4.44Å; L29-Y115 HydrophobicContact CG-CD1 3.72Å; L29-Y115 HydrophobicContact CG-CD2 4.39Å; L29-Y115 HydrophobicContact CG-CE1 4.3Å; L29-Y115 HydrophobicContact CG-CG 3.79Å; L29-F116 PolarHBondContact N-O 2.99Å; L29-A118 PolarHBondContact O-N 2.98Å
30I96.6Very high94.6Very high2 Ų240.2 Ų40.21%0.0120%0.198CC..EExtended strand (participates in β ladder)trans-101.9133176.9-62.4172.9000109.2I28 F34 C35 I45 L59 C60 L82 Y85 A118I28-I30 HydrophobicContact CG2-CG1 4.24Å; I28-I30 PolarHBondContact O-N 3.34Å; I30-F34 HydrophobicContact CG2-CB 4.31Å; I30-F34 HydrophobicContact CG2-CD1 3.94Å; I30-C35 VanDerWaalsContact CG2-SG 3.51Å; I30-I45 HydrophobicContact CD1-CG2 3.89Å; I30-L59 HydrophobicContact CD1-CB 4.09Å; I30-L59 HydrophobicContact CD1-CD1 4.13Å; I30-L59 HydrophobicContact CD1-CD2 3.82Å; I30-L59 HydrophobicContact CD1-CG 4.22Å; I30-C60 PolarHBondContact N-O 2.91Å; I30-L82 HydrophobicContact CB-CD1 4.06Å; I30-L82 HydrophobicContact CG2-CD1 3.76Å; I30-Y85 HydrophobicContact CD1-CD2 3.8Å; I30-Y85 HydrophobicContact CD1-CE2 3.54Å; I30-A118 HydrophobicContact CG1-CB 4.17Å
31D94.6Very high94.7Very high9 Ų941.6 Ų41.65%0.04821%0.207CC..  trans-98.4160.2172-178.439.7000112.6T33 F34 C35 A99 L103 A118D31-T33 VanDerWaalsContact C-N 3.28Å; D31-T33 PolarHBondContact O-N 3.05Å; D31-T33 WeakPolarHBondContact OD2-CG2 3.12Å; D31-T33 PolarHBondContact OD2-N 3.29Å; D31-T33 PolarHBondContact OD2-OG1 3.2Å; D31-F34 WeakPolarHBondContact O-CB 3.44Å; D31-F34 PolarHBondContact O-N 3.18Å; D31-C35 PolarHBondContact O-N 3.2Å; D31-A99 VanDerWaalsContact OD1-CB 3.3Å; D31-A99 WeakPolarHBondContact OD1-CB 3.23Å; D31-L103 HydrophobicContact CB-CD1 4.13Å; D31-A118 PolarHBondContact N-O 3.42Å; D31-A118 VanDerWaalsContact N-O 3.14Å
32G93.6Very high94.7Very high2 Ų247.3 Ų47.32%0.02122%0.223CC..Hα-helixtrans-59-36.3178.400000113.8F34 C35 Q36G32-F34 VanDerWaalsContact C-N 3.31Å; G32-F34 PolarHBondContact O-N 3.49Å; G32-C35 PolarHBondContact O-N 3.04Å; G32-Q36 PolarHBondContact O-N 3.28Å
33T94.2Very high94.6Very high56 Ų5647.6 Ų47.634%0.34423%0.225SC..Hα-helixtrans-60.5-40.6176.359.10000112.2D31 Q36 A37 Q120D31-T33 VanDerWaalsContact C-N 3.28Å; D31-T33 PolarHBondContact O-N 3.05Å; D31-T33 WeakPolarHBondContact OD2-CG2 3.12Å; D31-T33 PolarHBondContact OD2-N 3.29Å; D31-T33 PolarHBondContact OD2-OG1 3.2Å; T33-Q36 PolarHBondContact O-N 3.35Å; T33-A37 PolarHBondContact O-N 2.83Å; T33-Q120 PolarHBondContact OG1-N 3.28Å
34F95.9Very high94.6Very high0 Ų043.5 Ų43.50%021%0.214CC..Hα-helixtrans-68.8-43.1177.2-172.8-89.3000111.6I30 D31 G32 Q36 A37 A38 I45 M49 A118 Q120 I139 I144I30-F34 HydrophobicContact CG2-CB 4.31Å; I30-F34 HydrophobicContact CG2-CD1 3.94Å; D31-F34 WeakPolarHBondContact O-CB 3.44Å; D31-F34 PolarHBondContact O-N 3.18Å; G32-F34 VanDerWaalsContact C-N 3.31Å; G32-F34 PolarHBondContact O-N 3.49Å; F34-Q36 VanDerWaalsContact C-N 3.31Å; F34-Q36 PolarHBondContact O-N 2.85Å; F34-A37 PolarHBondContact O-N 3.1Å; F34-A38 WeakPolarHBondContact O-CB 3.27Å; F34-A38 PolarHBondContact O-N 3.2Å; F34-I45 HydrophobicContact CD1-CD1 4.06Å; F34-I45 HydrophobicContact CE1-CD1 3.96Å; F34-I45 HydrophobicContact CE1-CG1 4.27Å; F34-I45 HydrophobicContact CE1-CG2 4.39Å; F34-M49 HydrophobicContact CE1-CE 4.28Å; F34-M49 HydrophobicContact CZ-CE 4.26Å; F34-A118 WeakPolarHBondContact CB-O 3.42Å; F34-A118 HydrophobicContact CD1-CB 4.05Å; F34-A118 HydrophobicContact CD2-CB 3.84Å; F34-A118 HydrophobicContact CE1-CB 4.09Å; F34-A118 HydrophobicContact CE2-CB 3.87Å; F34-A118 HydrophobicContact CG-CB 3.92Å; F34-A118 HydrophobicContact CZ-CB 4Å; F34-Q120 HydrophobicContact CD2-CG 4.47Å; F34-I139 HydrophobicContact CD1-CD1 4.21Å; F34-I139 HydrophobicContact CD2-CD1 4.13Å; F34-I139 HydrophobicContact CD2-CG1 4.26Å; F34-I139 HydrophobicContact CE1-CD1 3.9Å; F34-I139 HydrophobicContact CE1-CG1 4.38Å; F34-I139 HydrophobicContact CE2-CD1 3.83Å; F34-I139 HydrophobicContact CE2-CG1 3.61Å; F34-I139 HydrophobicContact CG-CD1 4.32Å; F34-I139 HydrophobicContact CZ-CD1 3.7Å; F34-I139 HydrophobicContact CZ-CG1 3.67Å; F34-I144 HydrophobicContact CZ-CD1 4.46Å; F34-I144 HydrophobicContact CZ-CG1 4.27Å; F34-I144 HydrophobicContact CZ-CG2 4.15Å
35C95.1Very high94.7Very high0 Ų039.6 Ų39.60%020%0.196CC..Hα-helixtrans-60-41.3173.9-80.30000112.1I30 D31 G32 A38 L39 A78I30-C35 VanDerWaalsContact CG2-SG 3.51Å; D31-C35 PolarHBondContact O-N 3.2Å; G32-C35 PolarHBondContact O-N 3.04Å; C35-A38 WeakPolarHBondContact O-CB 3.16Å; C35-A38 PolarHBondContact O-N 2.88Å; C35-L39 PolarHBondContact O-N 3.45Å; C35-A78 HydrophobicContact CB-CB 3.86Å
36Q94.1Very high94.5Very high43 Ų4344.6 Ų44.620%0.20121%0.212CC..Hα-helixtrans-64.3-42.1176.8-176.6632.300111.8G32 T33 F34 A38 L39 K40 L75 A78G32-Q36 PolarHBondContact O-N 3.28Å; T33-Q36 PolarHBondContact O-N 3.35Å; F34-Q36 VanDerWaalsContact C-N 3.31Å; F34-Q36 PolarHBondContact O-N 2.85Å; Q36-A38 VanDerWaalsContact C-N 3.32Å; Q36-A38 PolarHBondContact O-N 3.5Å; Q36-L39 PolarHBondContact O-N 2.98Å; Q36-K40 WeakPolarHBondContact O-CG 3.37Å; Q36-K40 PolarHBondContact O-N 3.28Å; Q36-L75 HydrophobicContact CB-CD2 4.16Å; Q36-L75 HydrophobicContact CG-CD2 3.55Å; Q36-A78 HydrophobicContact CB-CB 4.15Å
37A94.6Very high94.4Very high15 Ų1549.5 Ų49.512%0.12424%0.235CC..Hα-helixtrans-65-36174.300000112.4T33 F34 N41 Q120 I139T33-A37 PolarHBondContact O-N 2.83Å; F34-A37 PolarHBondContact O-N 3.1Å; A37-N41 PolarHBondContact O-N 3.2Å; A37-N41 VanDerWaalsContact O-N 3.15Å; A37-N41 PolarHBondContact O-ND2 3.24Å; A37-Q120 HydrophobicContact CB-CG 3.85Å; A37-I139 HydrophobicContact CB-CD1 4.12Å
38A95.1Very high94.2Very high1 Ų150.3 Ų50.31%0.00824%0.239CC..Hα-helixtrans-65.1-41175.700000111.8F34 C35 Q36 N41 K42 I43 I45 I139F34-A38 WeakPolarHBondContact O-CB 3.27Å; F34-A38 PolarHBondContact O-N 3.2Å; C35-A38 WeakPolarHBondContact O-CB 3.16Å; C35-A38 PolarHBondContact O-N 2.88Å; Q36-A38 VanDerWaalsContact C-N 3.32Å; Q36-A38 PolarHBondContact O-N 3.5Å; A38-N41 CarbonylContact O-C 3.58Å; A38-N41 PolarHBondContact O-N 2.95Å; A38-K42 PolarHBondContact O-N 3.41Å; A38-I43 HydrophobicContact CB-CB 4.3Å; A38-I43 PolarHBondContact O-N 3.04Å; A38-I45 HydrophobicContact CB-CD1 3.65Å; A38-I45 HydrophobicContact CB-CG1 3.72Å; A38-I139 HydrophobicContact CB-CD1 3.73Å
39L93.4Very high94Very high67 Ų6750.3 Ų50.335%0.35124%0.239SC..Hα-helixtrans-62.1-49.2175.2-80168.8000112.3C35 Q36 N41 K42 A78 I81C35-L39 PolarHBondContact O-N 3.45Å; Q36-L39 PolarHBondContact O-N 2.98Å; L39-N41 PolarHBondContact O-N 3.46Å; L39-K42 PolarHBondContact O-N 2.85Å; L39-K42 VanDerWaalsContact O-N 3.11Å; L39-A78 HydrophobicContact CD1-CB 4.14Å; L39-I81 HydrophobicContact CD1-CD1 3.92Å; L39-I81 HydrophobicContact CD2-CD1 3.38Å; L39-I81 HydrophobicContact CG-CD1 3.53Å
40K93.1Very high93.8Very high152 Ų15252.5 Ų52.566%0.66125%0.253SS*.Hα-helixtrans-56.2-41.4178.7-73.8179.2178.3-176.50111.9Q36Q36-K40 WeakPolarHBondContact O-CG 3.37Å; Q36-K40 PolarHBondContact O-N 3.28Å
41N93.4Very high93.6Very high54 Ų5459.1 Ų59.129%0.28928%0.282SS..THydrogen-bonded Turntrans-93.57.2-178-60.8-52.6000114A37 A38 L39 I43 V141A37-N41 PolarHBondContact O-N 3.2Å; A37-N41 VanDerWaalsContact O-N 3.15Å; A37-N41 PolarHBondContact O-ND2 3.24Å; A38-N41 CarbonylContact O-C 3.58Å; A38-N41 PolarHBondContact O-N 2.95Å; L39-N41 PolarHBondContact O-N 3.46Å; N41-I43 HydrophobicContact CB-CD1 3.82Å; N41-I43 HydrophobicContact CB-CG1 3.93Å; N41-I43 PolarHBondContact O-N 2.97Å; N41-V141 PolarHBondContact ND2-O 3.3Å; N41-V141 VanDerWaalsContact ND2-O 3.13Å; N41-V141 PolarHBondContact OD1-O 3.34Å
42K92.6Very high93.5Very high189 Ų18959.2 Ų59.282%0.82228%0.282SS*.THydrogen-bonded Turntrans53.139.2-178.9-56.6179.8-178.2179.10113.4A38 L39A38-K42 PolarHBondContact O-N 3.41Å; L39-K42 PolarHBondContact O-N 2.85Å; L39-K42 VanDerWaalsContact O-N 3.11Å
43I93.4Very high93.4Very high13 Ų1359.4 Ų59.47%0.06728%0.282CS..  trans-90.3123.2-178.8-65.5172.2000110.2A38 N41 I45 I139 N142 I144A38-I43 HydrophobicContact CB-CB 4.3Å; A38-I43 PolarHBondContact O-N 3.04Å; N41-I43 HydrophobicContact CB-CD1 3.82Å; N41-I43 HydrophobicContact CB-CG1 3.93Å; N41-I43 PolarHBondContact O-N 2.97Å; I43-I45 PolarHBondContact O-N 2.84Å; I43-I139 HydrophobicContact CD1-CB 4.4Å; I43-I139 HydrophobicContact CD1-CD1 4.2Å; I43-I139 HydrophobicContact CD1-CG1 4.08Å; I43-I139 HydrophobicContact CD1-CG2 3.43Å; I43-I139 VanDerWaalsContact CD1-CG2 3.43Å; I43-N142 VanDerWaalsContact CD1-C 3.47Å; I43-I144 HydrophobicContact CG2-CD1 3.94Å; I43-I144 HydrophobicContact CG2-CG1 4.05Å
44Q93.3Very high93.2Very high115 Ų11562 Ų6254%0.53729%0.291SS..  trans-84.495.6172.9-60.6-169.928.700110.8K46 E47 Q48Q44-K46 PolarHBondContact O-N 3.38Å; Q44-E47 HydrophobicContact CB-CB 4.45Å; Q44-E47 HydrophobicContact CB-CG 4.49Å; Q44-E47 PolarHBondContact O-N 2.91Å; Q44-E47 PolarHBondContact OE1-OE1 3.09Å; Q44-E47 PolarHBondContact OE1-OE2 3.37Å; Q44-Q48 WeakPolarHBondContact O-CB 3.4Å; Q44-Q48 WeakPolarHBondContact O-CG 3.49Å; Q44-Q48 PolarHBondContact O-N 2.9Å
45I94.1Very high93Very high5 Ų562.7 Ų62.73%0.02630%0.299CS..Hα-helixtrans-56.8-48-175-55.5175.5000111.6I30 F34 A38 I43 E47 Q48 M49 L59I30-I45 HydrophobicContact CD1-CG2 3.89Å; F34-I45 HydrophobicContact CD1-CD1 4.06Å; F34-I45 HydrophobicContact CE1-CD1 3.96Å; F34-I45 HydrophobicContact CE1-CG1 4.27Å; F34-I45 HydrophobicContact CE1-CG2 4.39Å; A38-I45 HydrophobicContact CB-CD1 3.65Å; A38-I45 HydrophobicContact CB-CG1 3.72Å; I43-I45 PolarHBondContact O-N 2.84Å; I45-E47 VanDerWaalsContact C-N 3.27Å; I45-E47 PolarHBondContact O-N 2.82Å; I45-Q48 PolarHBondContact O-N 2.9Å; I45-M49 HydrophobicContact CG2-CE 3.79Å; I45-M49 WeakPolarHBondContact O-CB 3.34Å; I45-M49 PolarHBondContact O-N 3.22Å; I45-L59 HydrophobicContact CG2-CD1 3.9Å
46K92.6Very high92.9Very high163 Ų16369.2 Ų69.271%0.70933%0.33SS*.Hα-helixtrans-59.8-34.8-175.4-170.2178.2179.5-177.80113.1Q44 P50 L59Q44-K46 PolarHBondContact O-N 3.38Å; K46-P50 WeakPolarHBondContact O-CD 3.45Å; K46-P50 WeakPolarHBondContact O-CG 3.31Å; K46-L59 HydrophobicContact CB-CD1 4.42Å
47E92.6Very high93Very high104 Ų10468.7 Ų68.749%0.48633%0.329SS..Hα-helixtrans-88.8-40.5-179.8-60.1-169.2172.800112.9Q44 I45 K51Q44-E47 HydrophobicContact CB-CB 4.45Å; Q44-E47 HydrophobicContact CB-CG 4.49Å; Q44-E47 PolarHBondContact O-N 2.91Å; Q44-E47 PolarHBondContact OE1-OE1 3.09Å; Q44-E47 PolarHBondContact OE1-OE2 3.37Å; I45-E47 VanDerWaalsContact C-N 3.27Å; I45-E47 PolarHBondContact O-N 2.82Å; E47-K51 WeakPolarHBondContact O-CD 3.48Å; E47-K51 VanDerWaalsContact O-CG 3.3Å; E47-K51 WeakPolarHBondContact O-CG 2.92Å
48Q92.3Very high93.1Very high66 Ų6670.6 Ų70.631%0.30834%0.336SS..Hα-helixtrans-75.8-30.8-175.3-69.2-163.88.200112.5Q44 I45 Y52 I144Q44-Q48 WeakPolarHBondContact O-CB 3.4Å; Q44-Q48 WeakPolarHBondContact O-CG 3.49Å; Q44-Q48 PolarHBondContact O-N 2.9Å; I45-Q48 PolarHBondContact O-N 2.9Å; Q48-Y52 VanDerWaalsContact O-CB 3.25Å; Q48-Y52 WeakPolarHBondContact O-CB 3.47Å; Q48-Y52 PolarHBondContact O-N 3.17Å; Q48-I144 HydrophobicContact CB-CD1 4.07Å
49M92.6Very high93.2Very high0 Ų071.6 Ų71.60%034%0.34CS..Hα-helixtrans-65.2-51.3-175.2-160.774.283.300112.9I28 F34 I45 K51 Y52 L53 V57 L59 M137 I144I28-M49 HydrophobicContact CD1-CE 4.12Å; I28-M49 HydrophobicContact CD1-CG 3.39Å; I28-M49 HydrophobicContact CD1-SD 3.81Å; F34-M49 HydrophobicContact CE1-CE 4.28Å; F34-M49 HydrophobicContact CZ-CE 4.26Å; I45-M49 HydrophobicContact CG2-CE 3.79Å; I45-M49 WeakPolarHBondContact O-CB 3.34Å; I45-M49 PolarHBondContact O-N 3.22Å; M49-K51 PolarHBondContact O-N 3.14Å; M49-Y52 PolarHBondContact O-N 3.28Å; M49-L53 HydrophobicContact CG-CD1 4.18Å; M49-L53 PolarHBondContact O-N 3.35Å; M49-V57 HydrophobicContact CG-CG1 3.95Å; M49-V57 HydrophobicContact CG-CG2 4.39Å; M49-L59 HydrophobicContact CE-CD2 4.49Å; M49-L59 HydrophobicContact CG-CD2 4.23Å; M49-M137 HydrophobicContact CE-CE 4.36Å; M49-M137 HydrophobicContact CE-SD 4.49Å; M49-M137 HydrophobicContact SD-CE 3.27Å; M49-M137 WeakPolarHBondContact SD-CE 3.26Å; M49-M137 HydrophobicContact SD-SD 3.84Å; M49-I144 HydrophobicContact CE-CD1 4.19Å; M49-I144 HydrophobicContact CE-CG2 4.38Å; M49-I144 HydrophobicContact SD-CD1 4.28Å; M49-I144 HydrophobicContact SD-CG2 4.01Å
50P93.3Very high93.3Very high47 Ų4768.4 Ų68.431%0.30532%0.324SS..Hα-helixtrans-64.1-40.1176.9-1932.8000112.1K46 Y52 L53 M54 V57K46-P50 WeakPolarHBondContact O-CD 3.45Å; K46-P50 WeakPolarHBondContact O-CG 3.31Å; P50-Y52 PolarHBondContact O-N 3.18Å; P50-L53 PolarHBondContact O-N 2.98Å; P50-M54 WeakPolarHBondContact O-CA 3.37Å; P50-M54 PolarHBondContact O-N 3.09Å; P50-V57 HydrophobicContact CB-CG2 4.39Å; P50-V57 HydrophobicContact CG-CB 4.26Å; P50-V57 HydrophobicContact CG-CG2 4.37Å
51K92.2Very high93.4Very high141 Ų14161.2 Ų61.261%0.61329%0.293SS*.Hα-helixtrans-60.3-33.2176.1-71.7176.8-176.9170.60112.5E47 M49E47-K51 WeakPolarHBondContact O-CD 3.48Å; E47-K51 VanDerWaalsContact O-CG 3.3Å; E47-K51 WeakPolarHBondContact O-CG 2.92Å; M49-K51 PolarHBondContact O-N 3.14Å
52Y92.2Very high93.5Very high11 Ų1158.7 Ų58.74%0.04328%0.279CS..Hα-helixtrans-83.1-41.7-179.2-180-126000112.9R5 A9 Q48 M49 P50 M54 M137 I144 L146R5-Y52 HydrophobicContact CG-CD2 4.49Å; R5-Y52 HydrophobicContact CG-CE2 3.64Å; A9-Y52 HydrophobicContact CB-CD2 4.41Å; A9-Y52 HydrophobicContact CB-CE1 4.4Å; A9-Y52 HydrophobicContact CB-CE2 3.64Å; Q48-Y52 VanDerWaalsContact O-CB 3.25Å; Q48-Y52 WeakPolarHBondContact O-CB 3.47Å; Q48-Y52 PolarHBondContact O-N 3.17Å; M49-Y52 PolarHBondContact O-N 3.28Å; P50-Y52 PolarHBondContact O-N 3.18Å; Y52-M54 VanDerWaalsContact C-N 3.32Å; Y52-M137 HydrophobicContact CD1-CE 3.92Å; Y52-M137 HydrophobicContact CE1-CE 4.03Å; Y52-I144 HydrophobicContact CD1-CG2 4.32Å; Y52-I144 VanDerWaalsContact CE1-O 3.29Å; Y52-I144 WeakPolarHBondContact CE1-O 3.4Å; Y52-L146 HydrophobicContact CE1-CB 3.91Å; Y52-L146 PolarHBondContact OH-N 3.4Å
53L91.9Very high93.5Very high5 Ų551.5 Ų51.53%0.02625%0.25CC..Hα-helixtrans-80.4-12.5179-65.3178.2000113.4I13 F26 I28 M49 P50 G55 V57 M137 L146I13-L53 HydrophobicContact CD1-CB 4.19Å; I13-L53 HydrophobicContact CD1-CD2 3.65Å; I13-L53 WeakPolarHBondContact CD1-O 3.38Å; I13-L53 HydrophobicContact CG1-CD2 4.24Å; F26-L53 HydrophobicContact CD2-CB 4.26Å; F26-L53 HydrophobicContact CD2-CD1 4.22Å; F26-L53 HydrophobicContact CE2-CB 4.38Å; I28-L53 HydrophobicContact CD1-CD1 3.64Å; M49-L53 HydrophobicContact CG-CD1 4.18Å; M49-L53 PolarHBondContact O-N 3.35Å; P50-L53 PolarHBondContact O-N 2.98Å; L53-G55 VanDerWaalsContact C-N 3.27Å; L53-G55 PolarHBondContact O-N 3.06Å; L53-V57 HydrophobicContact CB-CG2 4.36Å; L53-V57 HydrophobicContact CD1-CG2 3.78Å; L53-M137 HydrophobicContact CD1-CE 4.43Å; L53-M137 HydrophobicContact CD1-SD 4.38Å; L53-M137 HydrophobicContact CD2-CE 4.03Å; L53-M137 HydrophobicContact CD2-SD 4.47Å; L53-M137 HydrophobicContact CG-CE 4.35Å; L53-L146 HydrophobicContact CD2-CD2 4.42Å
54M90.4Very high93.6Very high110 Ų11051 Ų5154%0.54225%0.247SC..THydrogen-bonded Turntrans56.939.3-179.5-52.3176.762.700112.7P50 Y52P50-M54 WeakPolarHBondContact O-CA 3.37Å; P50-M54 PolarHBondContact O-N 3.09Å; Y52-M54 VanDerWaalsContact C-N 3.32Å
55G90.8Very high93.6Very high16 Ų1645.5 Ų45.517%0.16522%0.222CC..SBendtrans-165.8176-178.400000111.4L53L53-G55 VanDerWaalsContact C-N 3.27Å; L53-G55 PolarHBondContact O-N 3.06Å
56E94.2Very high93.6Very high137 Ų13746.2 Ų46.264%0.6423%0.225SC*.  trans-71.9141.6177.6-65.3-169.2166.200111.4P25 F26P25-E56 CarbonylContact C-O 3.5Å; P25-E56 WeakPolarHBondContact CA-O 3.41Å; P25-E56 HydrophobicContact CB-CB 4Å; F26-E56 PolarHBondContact N-O 3.31Å
57V96Very high93.6Very high32 Ų3242.2 Ų42.219%0.19421%0.208CC..EExtended strand (participates in β ladder)trans-134.5134.6-173.1175.80000110.2F26 I28 M49 P50 L53 L59F26-V57 HydrophobicContact CD2-CG2 4.43Å; F26-V57 WeakPolarHBondContact O-CA 3.4Å; I28-V57 HydrophobicContact CD1-CG1 3.34Å; I28-V57 HydrophobicContact CD1-CG2 4.45Å; I28-V57 HydrophobicContact CG1-CG1 3.82Å; M49-V57 HydrophobicContact CG-CG1 3.95Å; M49-V57 HydrophobicContact CG-CG2 4.39Å; P50-V57 HydrophobicContact CB-CG2 4.39Å; P50-V57 HydrophobicContact CG-CB 4.26Å; P50-V57 HydrophobicContact CG-CG2 4.37Å; L53-V57 HydrophobicContact CB-CG2 4.36Å; L53-V57 HydrophobicContact CD1-CG2 3.78Å; V57-L59 HydrophobicContact CG1-CD2 3.53Å; V57-L59 HydrophobicContact CG1-CG 4.26Å
58Q96.2Very high93.6Very high55 Ų5540.6 Ų40.626%0.25720%0.201SC..EExtended strand (participates in β ladder)trans-113.8105.2174.1-170.1174.3800109.6P25 F26 Q27 I28P25-Q58 HydrophobicContact CB-CB 4.49Å; F26-Q58 PolarHBondContact O-N 3.43Å; Q27-Q58 WeakPolarHBondContact CA-O 3.26Å; Q27-Q58 HydrophobicContact CG-CB 4.47Å; I28-Q58 PolarHBondContact N-O 3.46Å
59L96.4Very high93.6Very high21 Ų2137.9 Ų37.911%0.1119%0.188CC..EExtended strand (participates in β ladder)trans-78124.6178.4-58.1-174.8000110.1I28 I30 I45 K46 M49 V57 Y85 Q86I28-L59 HydrophobicContact CB-CD2 4.17Å; I28-L59 HydrophobicContact CD1-CD2 4.13Å; I28-L59 HydrophobicContact CG1-CD2 4.49Å; I30-L59 HydrophobicContact CD1-CB 4.09Å; I30-L59 HydrophobicContact CD1-CD1 4.13Å; I30-L59 HydrophobicContact CD1-CD2 3.82Å; I30-L59 HydrophobicContact CD1-CG 4.22Å; I45-L59 HydrophobicContact CG2-CD1 3.9Å; K46-L59 HydrophobicContact CB-CD1 4.42Å; M49-L59 HydrophobicContact CE-CD2 4.49Å; M49-L59 HydrophobicContact CG-CD2 4.23Å; V57-L59 HydrophobicContact CG1-CD2 3.53Å; V57-L59 HydrophobicContact CG1-CG 4.26Å; L59-Y85 HydrophobicContact CB-CD1 3.77Å; L59-Y85 HydrophobicContact CB-CD2 4.39Å; L59-Y85 HydrophobicContact CB-CE1 4.2Å; L59-Y85 HydrophobicContact CB-CG 3.9Å; L59-Y85 HydrophobicContact CD1-CD1 3.98Å; L59-Y85 HydrophobicContact CD1-CE1 3.53Å; L59-Y85 HydrophobicContact CD1-CE2 4.46Å; L59-Q86 PolarHBondContact O-N 3.32Å; L59-Q86 VanDerWaalsContact O-N 3.1Å
60C95.8Very high93.5Very high0 Ų042.8 Ų42.80%021%0.211CC..EExtended strand (participates in β ladder)trans-127.2154.1-175.5-60.40000111I28 L29 I30 Q86 R88I28-C60 WeakPolarHBondContact O-CA 3.25Å; I28-C60 PolarHBondContact O-N 3.21Å; I28-C60 VanDerWaalsContact O-O 3.11Å; L29-C60 WeakPolarHBondContact CA-O 3.41Å; L29-C60 HydrophobicContact CD2-CB 4.03Å; I30-C60 PolarHBondContact N-O 2.91Å; C60-Q86 CarbonylContact C-O 3.41Å; C60-Q86 WeakPolarHBondContact CA-O 3.48Å; C60-R88 HydrophobicContact CB-CG 3.84Å; C60-R88 PolarHBondContact SG-NE 2.93Å; C60-R88 VanDerWaalsContact SG-NE 3.37Å
61T95.6Very high93.3Very high1 Ų144.9 Ų44.91%0.00623%0.227CC..EExtended strand (participates in β ladder)trans-137.9177.8171.2-171.70000110.3L66 L82 Q86 V87 R88T61-L66 HydrophobicContact CG2-CD1 4.25Å; T61-L66 HydrophobicContact CG2-CG 4.32Å; T61-L82 HydrophobicContact CG2-CG 4.11Å; T61-L82 VanDerWaalsContact OG1-CD2 3.26Å; T61-L82 WeakPolarHBondContact OG1-CD2 3.42Å; T61-L82 VanDerWaalsContact OG1-CG 3.23Å; T61-L82 WeakPolarHBondContact OG1-CG 3.37Å; T61-Q86 PolarHBondContact N-O 2.95Å; T61-V87 HydrophobicContact CG2-CG2 3.98Å; T61-R88 PolarHBondContact O-N 3.36Å
62T95.1Very high93.1Very high2 Ų242 Ų421%0.01222%0.218CC..EExtended strand (participates in β ladder)trans-117154.1176.869.90000111.4C64 A65 L66 L103 M106T62-C64 PolarHBondContact O-N 3.17Å; T62-A65 PolarHBondContact O-N 2.74Å; T62-A65 WeakPolarHBondContact OG1-CB 3.37Å; T62-A65 PolarHBondContact OG1-N 3.08Å; T62-A65 VanDerWaalsContact OG1-N 3.15Å; T62-L66 PolarHBondContact O-N 3.39Å; T62-L103 HydrophobicContact CG2-CD2 3.99Å; T62-M106 HydrophobicContact CG2-SD 3.44Å; T62-M106 WeakPolarHBondContact CG2-SD 3.22Å
63N93.8Very high92.4Very high38 Ų3850.5 Ų50.520%0.20326%0.255CS..Hα-helixtrans-59.7-34.3173.1-76.8-45.5000112.4L66 K67 V87N63-L66 PolarHBondContact O-N 3.07Å; N63-K67 WeakPolarHBondContact O-CG 3.44Å; N63-K67 PolarHBondContact O-N 3.36Å; N63-V87 WeakPolarHBondContact OD1-CG1 3.49Å
64C94.4Very high91.8Very high1 Ų157.7 Ų57.71%0.00729%0.293CS..Hα-helixtrans-63.6-46.4176.3-70.20000112T62 L66 K67 E68 C90 H92 V97 C102T62-C64 PolarHBondContact O-N 3.17Å; C64-L66 VanDerWaalsContact C-N 3.29Å; C64-L66 PolarHBondContact O-N 3.22Å; C64-K67 PolarHBondContact O-N 2.94Å; C64-K67 VanDerWaalsContact O-N 3.17Å; C64-E68 WeakPolarHBondContact O-CB 3.38Å; C64-E68 PolarHBondContact O-N 2.81Å; C64-C90 VanDerWaalsContact SG-SG 3.69Å; C64-H92 VanDerWaalsContact SG-CB 3.57Å; C64-V97 WeakPolarHBondContact CB-O 3.49Å; C64-C102 HydrophobicContact CB-CB 3.62Å
65A93.9Very high91.7Very high1 Ų154.2 Ų54.21%0.00828%0.277CS..Hα-helixtrans-62.4-37.1178.200000112.3T62 L69 L82 A99T62-A65 PolarHBondContact O-N 2.74Å; T62-A65 WeakPolarHBondContact OG1-CB 3.37Å; T62-A65 PolarHBondContact OG1-N 3.08Å; T62-A65 VanDerWaalsContact OG1-N 3.15Å; A65-L69 WeakPolarHBondContact O-CG 3.47Å; A65-L69 PolarHBondContact O-N 3.38Å; A65-L82 HydrophobicContact CB-CD2 4.03Å; A65-A99 HydrophobicContact CB-CB 3.87Å
66L93.5Very high91.5Very high19 Ų1960.6 Ų60.610%0.09930%0.297CS..Hα-helixtrans-65.2-42.6174.3-69.3174.1000112.5T61 T62 N63 C64 L69 E70 L82 Q83 V87T61-L66 HydrophobicContact CG2-CD1 4.25Å; T61-L66 HydrophobicContact CG2-CG 4.32Å; T62-L66 PolarHBondContact O-N 3.39Å; N63-L66 PolarHBondContact O-N 3.07Å; C64-L66 VanDerWaalsContact C-N 3.29Å; C64-L66 PolarHBondContact O-N 3.22Å; L66-L69 PolarHBondContact O-N 2.7Å; L66-E70 WeakPolarHBondContact O-CG 3.47Å; L66-E70 PolarHBondContact O-N 3.44Å; L66-L82 HydrophobicContact CD2-CB 4.03Å; L66-L82 HydrophobicContact CD2-CD2 4.03Å; L66-L82 HydrophobicContact CD2-CG 4.07Å; L66-Q83 HydrophobicContact CD2-CG 3.74Å; L66-V87 HydrophobicContact CD1-CG1 4.39Å; L66-V87 HydrophobicContact CD1-CG2 3.85Å
67K93.1Very high91.4Very high79 Ų7955.7 Ų55.734%0.34328%0.283SS..Hα-helixtrans-68.9-35.2177.5-74.4178.2176.8-1760112.7N63 C64 E70 S71 F93 P96N63-K67 WeakPolarHBondContact O-CG 3.44Å; N63-K67 PolarHBondContact O-N 3.36Å; C64-K67 PolarHBondContact O-N 2.94Å; C64-K67 VanDerWaalsContact O-N 3.17Å; K67-E70 WeakPolarHBondContact O-CB 3.37Å; K67-E70 PolarHBondContact O-N 3.25Å; K67-S71 PolarHBondContact O-N 3.39Å; K67-F93 PolarHBondContact NZ-O 3.41Å; K67-P96 HydrophobicContact CB-CB 4.47Å; K67-P96 HydrophobicContact CD-CB 3.57Å; K67-P96 HydrophobicContact CD-CG 3.98Å
68E92.3Very high91.2Very high71 Ų7154.2 Ų54.233%0.33227%0.274SS..Hα-helixtrans-67-41.2174-178.9174.4-164.300111.6C64 E70 S71 L72 A99C64-E68 WeakPolarHBondContact O-CB 3.38Å; C64-E68 PolarHBondContact O-N 2.81Å; E68-E70 PolarHBondContact O-N 3.33Å; E68-S71 PolarHBondContact O-N 3.33Å; E68-S71 PolarHBondContact O-OG 3.28Å; E68-L72 PolarHBondContact O-N 3.41Å; E68-A99 WeakPolarHBondContact OE2-CA 3.26Å; E68-A99 WeakPolarHBondContact OE2-CB 3.35Å; E68-A99 PolarHBondContact OE2-N 3.37Å
69L91.7Very high91.1Very high9 Ų953.1 Ų53.15%0.04727%0.269CS..Hα-helixtrans-69.6-19.7173.3-71.1178.8000113.4A65 L66 L75 K79 L82A65-L69 WeakPolarHBondContact O-CG 3.47Å; A65-L69 PolarHBondContact O-N 3.38Å; L66-L69 PolarHBondContact O-N 2.7Å; L69-L75 HydrophobicContact CD2-CB 3.81Å; L69-L75 HydrophobicContact CD2-CD1 3.78Å; L69-L75 HydrophobicContact CD2-CG 4.47Å; L69-K79 HydrophobicContact CB-CB 4.04Å; L69-K79 HydrophobicContact CB-CG 4.25Å; L69-K79 HydrophobicContact CD1-CB 4.28Å; L69-L82 HydrophobicContact CD1-CB 4.32Å; L69-L82 HydrophobicContact CD1-CD2 3.56Å
70E90.9Very high90.9Very high103 Ų10355.5 Ų55.548%0.48128%0.281SS..Hα-helixtrans-72.3-36.2173.3-87.9172.3179.500113.2L66 K67 E68 L72 K79L66-E70 WeakPolarHBondContact O-CG 3.47Å; L66-E70 PolarHBondContact O-N 3.44Å; K67-E70 WeakPolarHBondContact O-CB 3.37Å; K67-E70 PolarHBondContact O-N 3.25Å; E68-E70 PolarHBondContact O-N 3.33Å; E70-L72 VanDerWaalsContact C-N 3.28Å; E70-K79 VanDerWaalsContact CD-NZ 3.33Å; E70-K79 HydrophobicContact CG-CD 3.92Å; E70-K79 WeakPolarHBondContact OE1-CE 3.41Å; E70-K79 IonicContact OE1-NZ 2.74Å; E70-K79 PolarHBondContact OE1-NZ 3.2Å
71S89Confident90.8Very high90 Ų9057.2 Ų57.263%0.62929%0.29SS*.Hα-helixtrans-72.3-26.3176.262.60000112K67 E68K67-S71 PolarHBondContact O-N 3.39Å; E68-S71 PolarHBondContact O-N 3.33Å; E68-S71 PolarHBondContact O-OG 3.28Å
72L87.1Confident90.7Very high81 Ų8157.1 Ų57.142%0.42429%0.289SS..  trans-95.593.6-179.7-61.6176.4000112E68 E70 D74 L75E68-L72 PolarHBondContact O-N 3.41Å; E70-L72 VanDerWaalsContact C-N 3.28Å; L72-D74 PolarHBondContact O-N 2.94Å; L72-L75 HydrophobicContact CB-CB 4.49Å; L72-L75 HydrophobicContact CB-CD1 4.22Å; L72-L75 HydrophobicContact CB-CG 4.4Å; L72-L75 HydrophobicContact CD1-CD1 3.82Å; L72-L75 PolarHBondContact O-N 3.46Å
73K77.6Confident90.6Very high189 Ų18961.4 Ų61.482%0.82231%0.309SS*.G310 helixtrans-57.7-32.7-179.5-66.4-176.8-179.2178.80113.8L75 Y76K73-L75 PolarHBondContact O-N 3.45Å; K73-Y76 PolarHBondContact O-N 3.47Å
74D80.3Confident90.6Very high156 Ų15668.7 Ų68.783%0.83433%0.334SS*.G310 helixtrans-70.4-12.2-176.9-61.2-27.5000113.7L72L72-D74 PolarHBondContact O-N 2.94Å
75L87Confident90.6Very high38 Ų3870 Ų7020%0.19934%0.339CS..G310 helixtrans-110.523.5-175.9-59-179.1000113.1Q36 L69 L72 K73 G77 A78 K79Q36-L75 HydrophobicContact CB-CD2 4.16Å; Q36-L75 HydrophobicContact CG-CD2 3.55Å; L69-L75 HydrophobicContact CD2-CB 3.81Å; L69-L75 HydrophobicContact CD2-CD1 3.78Å; L69-L75 HydrophobicContact CD2-CG 4.47Å; L72-L75 HydrophobicContact CB-CB 4.49Å; L72-L75 HydrophobicContact CB-CD1 4.22Å; L72-L75 HydrophobicContact CB-CG 4.4Å; L72-L75 HydrophobicContact CD1-CD1 3.82Å; L72-L75 PolarHBondContact O-N 3.46Å; K73-L75 PolarHBondContact O-N 3.45Å; L75-G77 VanDerWaalsContact C-N 3.27Å; L75-G77 PolarHBondContact O-N 3.35Å; L75-A78 HydrophobicContact CB-CB 4.45Å; L75-A78 WeakPolarHBondContact O-CB 3.35Å; L75-A78 PolarHBondContact O-N 2.94Å; L75-K79 PolarHBondContact O-N 2.86Å
76Y88.6Confident90.7Very high150 Ų15074.7 Ų74.759%0.58836%0.361SS*.Hα-helixtrans-54.9-40.2-178.1-175.9-100.5000113.5K73 A78 K79 L80K73-Y76 PolarHBondContact O-N 3.47Å; Y76-A78 VanDerWaalsContact C-N 3.33Å; Y76-A78 PolarHBondContact O-N 2.8Å; Y76-K79 WeakPolarHBondContact O-CB 3.2Å; Y76-K79 PolarHBondContact O-N 3.22Å; Y76-L80 PolarHBondContact O-N 3.11Å
77G90.5Very high90.8Very high34 Ų3476.2 Ų76.235%0.35137%0.371SS..Hα-helixtrans-61-42.2176.400000112.4L75 K79 L80 I81L75-G77 VanDerWaalsContact C-N 3.27Å; L75-G77 PolarHBondContact O-N 3.35Å; G77-K79 VanDerWaalsContact C-N 3.33Å; G77-L80 PolarHBondContact O-N 3.21Å; G77-I81 PolarHBondContact O-N 3.24Å
78A92.7Very high90.8Very high0 Ų075.1 Ų75.10%036%0.364CS..Hα-helixtrans-65.5-40.817900000110.6C35 Q36 L39 L75 Y76 L80 I81 L82C35-A78 HydrophobicContact CB-CB 3.86Å; Q36-A78 HydrophobicContact CB-CB 4.15Å; L39-A78 HydrophobicContact CD1-CB 4.14Å; L75-A78 HydrophobicContact CB-CB 4.45Å; L75-A78 WeakPolarHBondContact O-CB 3.35Å; L75-A78 PolarHBondContact O-N 2.94Å; Y76-A78 VanDerWaalsContact C-N 3.33Å; Y76-A78 PolarHBondContact O-N 2.8Å; A78-L80 PolarHBondContact O-N 2.8Å; A78-I81 PolarHBondContact O-N 3.49Å; A78-L82 WeakPolarHBondContact O-CB 3.07Å; A78-L82 PolarHBondContact O-N 3.28Å
79K93.3Very high90.7Very high33 Ų3378.5 Ų78.514%0.14339%0.385CS..Hα-helixtrans-56-49.2174.2-173.9-169.8171.2-176.70111.6L69 E70 L75 Y76 G77 I81 L82 Q83L69-K79 HydrophobicContact CB-CB 4.04Å; L69-K79 HydrophobicContact CB-CG 4.25Å; L69-K79 HydrophobicContact CD1-CB 4.28Å; E70-K79 VanDerWaalsContact CD-NZ 3.33Å; E70-K79 HydrophobicContact CG-CD 3.92Å; E70-K79 WeakPolarHBondContact OE1-CE 3.41Å; E70-K79 IonicContact OE1-NZ 2.74Å; E70-K79 PolarHBondContact OE1-NZ 3.2Å; L75-K79 PolarHBondContact O-N 2.86Å; Y76-K79 WeakPolarHBondContact O-CB 3.2Å; Y76-K79 PolarHBondContact O-N 3.22Å; G77-K79 VanDerWaalsContact C-N 3.33Å; K79-I81 VanDerWaalsContact C-N 3.27Å; K79-I81 PolarHBondContact O-N 3.21Å; K79-L82 PolarHBondContact O-N 3.15Å; K79-L82 VanDerWaalsContact O-N 3.09Å; K79-Q83 VanDerWaalsContact CE-NE2 3.28Å; K79-Q83 HydrophobicContact CG-CG 4.41Å; K79-Q83 WeakPolarHBondContact O-CG 3.37Å; K79-Q83 PolarHBondContact O-N 3.13Å
80L92.7Very high90.6Very high70 Ų7078.7 Ų78.737%0.36639%0.386SS..Hα-helixtrans-63.2-34.1-176.6-16868.6000112.5Y76 G77 A78 R84Y76-L80 PolarHBondContact O-N 3.11Å; G77-L80 PolarHBondContact O-N 3.21Å; A78-L80 PolarHBondContact O-N 2.8Å; L80-R84 WeakPolarHBondContact O-CG 3.44Å
81I93.1Very high90.6Very high36 Ų3681.1 Ų81.119%0.18540%0.395CS..Hα-helixtrans-68.9-47.1172.6-68178.5000110.3L39 G77 A78 K79 Q83 R84 Y85L39-I81 HydrophobicContact CD1-CD1 3.92Å; L39-I81 HydrophobicContact CD2-CD1 3.38Å; L39-I81 HydrophobicContact CG-CD1 3.53Å; G77-I81 PolarHBondContact O-N 3.24Å; A78-I81 PolarHBondContact O-N 3.49Å; K79-I81 VanDerWaalsContact C-N 3.27Å; K79-I81 PolarHBondContact O-N 3.21Å; I81-Q83 VanDerWaalsContact C-N 3.29Å; I81-Q83 PolarHBondContact O-N 3.22Å; I81-R84 WeakPolarHBondContact O-CB 3.46Å; I81-R84 PolarHBondContact O-N 2.87Å; I81-R84 VanDerWaalsContact O-N 3.09Å; I81-Y85 HydrophobicContact CG2-CE2 3.81Å; I81-Y85 VanDerWaalsContact CG2-OH 3.31Å; I81-Y85 WeakPolarHBondContact CG2-OH 3.48Å
82L93.4Very high90.6Very high0 Ų078.8 Ų78.80%037%0.374CS..Hα-helixtrans-64.1-35.6-174.9-157.969.2000112.1I30 T61 A65 L66 L69 A78 K79 R84 Y85I30-L82 HydrophobicContact CB-CD1 4.06Å; I30-L82 HydrophobicContact CG2-CD1 3.76Å; T61-L82 HydrophobicContact CG2-CG 4.11Å; T61-L82 VanDerWaalsContact OG1-CD2 3.26Å; T61-L82 WeakPolarHBondContact OG1-CD2 3.42Å; T61-L82 VanDerWaalsContact OG1-CG 3.23Å; T61-L82 WeakPolarHBondContact OG1-CG 3.37Å; A65-L82 HydrophobicContact CB-CD2 4.03Å; L66-L82 HydrophobicContact CD2-CB 4.03Å; L66-L82 HydrophobicContact CD2-CD2 4.03Å; L66-L82 HydrophobicContact CD2-CG 4.07Å; L69-L82 HydrophobicContact CD1-CB 4.32Å; L69-L82 HydrophobicContact CD1-CD2 3.56Å; A78-L82 WeakPolarHBondContact O-CB 3.07Å; A78-L82 PolarHBondContact O-N 3.28Å; K79-L82 PolarHBondContact O-N 3.15Å; K79-L82 VanDerWaalsContact O-N 3.09Å; L82-R84 PolarHBondContact O-N 3.46Å; L82-Y85 HydrophobicContact CD1-CD2 4.14Å; L82-Y85 PolarHBondContact O-N 2.99Å; L82-Y85 VanDerWaalsContact O-N 3.13Å
83Q94.1Very high90.2Very high91 Ų9181.6 Ų81.643%0.42538%0.383SS..THydrogen-bonded Turntrans-61.5-21.3174.9-76.5-178.8-35.400114.3L66 K79 I81 Y85L66-Q83 HydrophobicContact CD2-CG 3.74Å; K79-Q83 VanDerWaalsContact CE-NE2 3.28Å; K79-Q83 HydrophobicContact CG-CG 4.41Å; K79-Q83 WeakPolarHBondContact O-CG 3.37Å; K79-Q83 PolarHBondContact O-N 3.13Å; I81-Q83 VanDerWaalsContact C-N 3.29Å; I81-Q83 PolarHBondContact O-N 3.22Å; Q83-Y85 VanDerWaalsContact C-N 3.28Å
84R93.6Very high90.5Very high192 Ų19281.5 Ų81.573%0.72538%0.383SS*.THydrogen-bonded Turntrans-79.7-13.3178.2-62.1174.2-176.7-171.9-1.4112.8L80 I81 L82L80-R84 WeakPolarHBondContact O-CG 3.44Å; I81-R84 WeakPolarHBondContact O-CB 3.46Å; I81-R84 PolarHBondContact O-N 2.87Å; I81-R84 VanDerWaalsContact O-N 3.09Å; L82-R84 PolarHBondContact O-N 3.46Å
85Y95.1Very high90.9Very high29 Ų2980.2 Ų80.211%0.11438%0.376CS..SBendtrans-92.5161.8-178.4-57.4-32.2000111.4I30 L59 I81 L82 Q83 V87I30-Y85 HydrophobicContact CD1-CD2 3.8Å; I30-Y85 HydrophobicContact CD1-CE2 3.54Å; L59-Y85 HydrophobicContact CB-CD1 3.77Å; L59-Y85 HydrophobicContact CB-CD2 4.39Å; L59-Y85 HydrophobicContact CB-CE1 4.2Å; L59-Y85 HydrophobicContact CB-CG 3.9Å; L59-Y85 HydrophobicContact CD1-CD1 3.98Å; L59-Y85 HydrophobicContact CD1-CE1 3.53Å; L59-Y85 HydrophobicContact CD1-CE2 4.46Å; I81-Y85 HydrophobicContact CG2-CE2 3.81Å; I81-Y85 VanDerWaalsContact CG2-OH 3.31Å; I81-Y85 WeakPolarHBondContact CG2-OH 3.48Å; L82-Y85 HydrophobicContact CD1-CD2 4.14Å; L82-Y85 PolarHBondContact O-N 2.99Å; L82-Y85 VanDerWaalsContact O-N 3.13Å; Q83-Y85 VanDerWaalsContact C-N 3.28Å; Y85-V87 PolarHBondContact O-N 2.83Å
86Q95.1Very high91Very high99 Ų9981.8 Ų81.846%0.46339%0.389SS..EExtended strand (participates in β ladder)trans-70.8127.2-176.6-172.5166.726.200110.9L59 C60 T61L59-Q86 PolarHBondContact O-N 3.32Å; L59-Q86 VanDerWaalsContact O-N 3.1Å; C60-Q86 CarbonylContact C-O 3.41Å; C60-Q86 WeakPolarHBondContact CA-O 3.48Å; T61-Q86 PolarHBondContact N-O 2.95Å
87V94.9Very high91.2Very high51 Ų5176.8 Ų76.831%0.30937%0.373SS..EExtended strand (participates in β ladder)trans-84.6124.8-179.8-170.90000109.9T61 N63 L66 Y85T61-V87 HydrophobicContact CG2-CG2 3.98Å; N63-V87 WeakPolarHBondContact OD1-CG1 3.49Å; L66-V87 HydrophobicContact CD1-CG1 4.39Å; L66-V87 HydrophobicContact CD1-CG2 3.85Å; Y85-V87 PolarHBondContact O-N 2.83Å
88R93.9Very high91.4Very high56 Ų5676.9 Ų76.921%0.21137%0.369CS..EExtended strand (participates in β ladder)trans-93.3137.4174.1-65.5-68.9179.1166.90.3109.9L29 C60 T61 C90 M106L29-R88 HydrophobicContact CD2-CG 4.38Å; C60-R88 HydrophobicContact CB-CG 3.84Å; C60-R88 PolarHBondContact SG-NE 2.93Å; C60-R88 VanDerWaalsContact SG-NE 3.37Å; T61-R88 PolarHBondContact O-N 3.36Å; R88-C90 PolarHBondContact O-N 3.15Å; R88-M106 HydrophobicContact CB-CE 3.92Å
89N90.6Very high91.4Very high142 Ų14276.9 Ų76.976%0.75937%0.369SS*.PPolyproline II helixtrans-75.7117.9178.7-68.8-6.5000109.6
90C89.9Confident91.5Very high12 Ų1276.8 Ų76.88%0.08137%0.372CS..PPolyproline II helixtrans-98.1158.9172.256.50000110.8C64 R88 H92 C102 M106C64-C90 VanDerWaalsContact SG-SG 3.69Å; R88-C90 PolarHBondContact O-N 3.15Å; C90-H92 PolarHBondContact O-N 3.37Å; C90-H92 VanDerWaalsContact O-N 3.08Å; C90-C102 WeakPolarHBondContact CB-SG 3.39Å; C90-M106 HydrophobicContact CB-CG 4.38Å; C90-M106 HydrophobicContact CB-SD 4.16Å
91K89.2Confident91.5Very high154 Ų15478.9 Ų78.967%0.6738%0.38SS*.THydrogen-bonded Turntrans-62.4-16.3177.8-62.5172.1-173.7163.90112.9F93 E108K91-F93 PolarHBondContact O-N 2.83Å; K91-E108 IonicContact NZ-OE1 2.81Å; K91-E108 PolarHBondContact NZ-OE1 3.19Å
92H89Confident91.6Very high41 Ų4177.1 Ų77.119%0.1937%0.371CS..THydrogen-bonded Turntrans-92.130.3-173.3-48.4124.2000114.8C64 C90 K94 N95 V97 S105C64-H92 VanDerWaalsContact SG-CB 3.57Å; C90-H92 PolarHBondContact O-N 3.37Å; C90-H92 VanDerWaalsContact O-N 3.08Å; H92-K94 VanDerWaalsContact C-N 3.35Å; H92-K94 PolarHBondContact O-N 3.24Å; H92-N95 WeakPolarHBondContact CB-O 3.39Å; H92-N95 CarbonylContact O-C 3.58Å; H92-V97 HydrophobicContact CB-CG2 4.08Å; H92-V97 WeakPolarHBondContact ND1-CG2 3.47Å; H92-S105 PolarHBondContact CE1-OG 3.05Å
93F79.8Confident91.7Very high140 Ų14077.2 Ų77.261%0.61437%0.372SS*.SBendtrans-61.5-43.3-176.5-172.7-98.1000112.7K67 K91K67-F93 PolarHBondContact NZ-O 3.41Å; K91-F93 PolarHBondContact O-N 2.83Å
94K83.4Confident91.7Very high187 Ų18775.6 Ų75.681%0.81337%0.366SS*.SBendtrans-74.6-49.2-178.7-64.5-176.6179.5-177.60112.3H92 P96H92-K94 VanDerWaalsContact C-N 3.35Å; H92-K94 PolarHBondContact O-N 3.24Å; K94-P96 WeakPolarHBondContact O-CD 3.4Å
95N89Confident91.7Very high130 Ų13068.6 Ų68.670%0.69535%0.346SS*.SBendtrans-11596.7-179-64-13.3000108.4H92 V97H92-N95 WeakPolarHBondContact CB-O 3.39Å; H92-N95 CarbonylContact O-C 3.58Å; N95-V97 PolarHBondContact O-N 3.18Å
96P88.7Confident91.5Very high71 Ų7168.4 Ų68.446%0.46135%0.346SS..  trans-66.8127179.428-33000110.3K67 K94K67-P96 HydrophobicContact CB-CB 4.47Å; K67-P96 HydrophobicContact CD-CB 3.57Å; K67-P96 HydrophobicContact CD-CG 3.98Å; K94-P96 WeakPolarHBondContact O-CD 3.4Å
97V94Very high91.3Very high44 Ų4463.7 Ų63.727%0.26732%0.324SS..  trans-101.5174.9170.8-600000110C64 H92 N95 E101 C102C64-V97 WeakPolarHBondContact CB-O 3.49Å; H92-V97 HydrophobicContact CB-CG2 4.08Å; H92-V97 WeakPolarHBondContact ND1-CG2 3.47Å; N95-V97 PolarHBondContact O-N 3.18Å; V97-E101 HydrophobicContact CB-CB 4.39Å; V97-E101 HydrophobicContact CG2-CB 4.16Å; V97-C102 HydrophobicContact CG2-CB 3.96Å
98S93.9Very high91Very high36 Ų3665.8 Ų65.825%0.25233%0.331SS..  trans-58.8153.6173.562.40000111.6S100 E101 C102S98-S100 PolarHBondContact O-N 3.3Å; S98-S100 PolarHBondContact OG-OG 2.87Å; S98-E101 PolarHBondContact O-N 3.44Å; S98-E101 WeakPolarHBondContact OG-CB 3.23Å; S98-E101 VanDerWaalsContact OG-CG 3.26Å; S98-E101 WeakPolarHBondContact OG-CG 3.46Å; S98-E101 PolarHBondContact OG-N 3.15Å; S98-C102 VanDerWaalsContact O-CB 3.3Å; S98-C102 WeakPolarHBondContact O-CB 3.29Å; S98-C102 PolarHBondContact O-N 3.31Å
99A92.8Very high90.6Very high1 Ų165.4 Ų65.41%0.00834%0.344CS..Hα-helixtrans-60.7-37.6177.600000111.5D31 A65 E68 C102 L103D31-A99 VanDerWaalsContact OD1-CB 3.3Å; D31-A99 WeakPolarHBondContact OD1-CB 3.23Å; A65-A99 HydrophobicContact CB-CB 3.87Å; E68-A99 WeakPolarHBondContact OE2-CA 3.26Å; E68-A99 WeakPolarHBondContact OE2-CB 3.35Å; E68-A99 PolarHBondContact OE2-N 3.37Å; A99-C102 PolarHBondContact O-N 2.95Å; A99-L103 WeakPolarHBondContact O-CB 3.37Å; A99-L103 WeakPolarHBondContact O-CG 3.39Å; A99-L103 PolarHBondContact O-N 3.04Å
100S94.4Very high90.4Very high30 Ų3063.3 Ų63.321%0.2134%0.337CS..Hα-helixtrans-60.2-51.3178.755.70000111.8S98 C102 L103 L104 L124S98-S100 PolarHBondContact O-N 3.3Å; S98-S100 PolarHBondContact OG-OG 2.87Å; S100-C102 VanDerWaalsContact C-N 3.33Å; S100-C102 PolarHBondContact O-N 3.15Å; S100-L103 PolarHBondContact O-N 3.17Å; S100-L104 WeakPolarHBondContact O-CG 3.3Å; S100-L104 PolarHBondContact O-N 3.45Å; S100-L104 VanDerWaalsContact O-N 3.09Å; S100-L124 WeakPolarHBondContact O-CD1 3.31Å
101E94.3Very high90.5Very high114 Ų11462.8 Ų62.853%0.53333%0.333SS..Hα-helixtrans-63.5-39.4176.1-70.7175.6-170.100111.9V97 S98 L104 S105V97-E101 HydrophobicContact CB-CB 4.39Å; V97-E101 HydrophobicContact CG2-CB 4.16Å; S98-E101 PolarHBondContact O-N 3.44Å; S98-E101 WeakPolarHBondContact OG-CB 3.23Å; S98-E101 VanDerWaalsContact OG-CG 3.26Å; S98-E101 WeakPolarHBondContact OG-CG 3.46Å; S98-E101 PolarHBondContact OG-N 3.15Å; E101-L104 PolarHBondContact O-N 3.21Å; E101-S105 VanDerWaalsContact O-CB 3.26Å; E101-S105 WeakPolarHBondContact O-CB 3.5Å; E101-S105 PolarHBondContact O-N 2.87Å
102C94.8Very high90.6Very high0 Ų058.1 Ų58.10%032%0.319CS..Hα-helixtrans-62.4-46.6178.4-172.20000112.1C64 C90 V97 S98 A99 S100 S105 M106C64-C102 HydrophobicContact CB-CB 3.62Å; C90-C102 WeakPolarHBondContact CB-SG 3.39Å; V97-C102 HydrophobicContact CG2-CB 3.96Å; S98-C102 VanDerWaalsContact O-CB 3.3Å; S98-C102 WeakPolarHBondContact O-CB 3.29Å; S98-C102 PolarHBondContact O-N 3.31Å; A99-C102 PolarHBondContact O-N 2.95Å; S100-C102 VanDerWaalsContact C-N 3.33Å; S100-C102 PolarHBondContact O-N 3.15Å; C102-S105 PolarHBondContact O-N 3.28Å; C102-M106 WeakPolarHBondContact O-CG 3.22Å; C102-M106 PolarHBondContact O-N 3.06Å
103L94.3Very high90.7Very high2 Ų261.3 Ų61.31%0.0133%0.334CS..Hα-helixtrans-65.9-41.8-180-71172.4000111.6L29 D31 T62 A99 S100 M106 L107 L124L29-L103 HydrophobicContact CB-CD2 3.89Å; L29-L103 HydrophobicContact CD1-CD2 3.82Å; L29-L103 HydrophobicContact CG-CD2 4.31Å; D31-L103 HydrophobicContact CB-CD1 4.13Å; T62-L103 HydrophobicContact CG2-CD2 3.99Å; A99-L103 WeakPolarHBondContact O-CB 3.37Å; A99-L103 WeakPolarHBondContact O-CG 3.39Å; A99-L103 PolarHBondContact O-N 3.04Å; S100-L103 PolarHBondContact O-N 3.17Å; L103-M106 PolarHBondContact O-N 3.44Å; L103-L107 WeakPolarHBondContact O-CD1 3.42Å; L103-L107 WeakPolarHBondContact O-CG 3.47Å; L103-L107 PolarHBondContact O-N 3.05Å; L103-L107 VanDerWaalsContact O-N 3.15Å; L103-L124 HydrophobicContact CB-CD1 4.35Å; L103-L124 HydrophobicContact CD1-CD2 3.68Å
104L94.5Very high91.4Very high57 Ų5758.2 Ų58.230%0.29832%0.321SS..Hα-helixtrans-61.5-44.6174.2-71.5169.2000111.6S100 E101 M106 L107 E108 L124 L128 I131S100-L104 WeakPolarHBondContact O-CG 3.3Å; S100-L104 PolarHBondContact O-N 3.45Å; S100-L104 VanDerWaalsContact O-N 3.09Å; E101-L104 PolarHBondContact O-N 3.21Å; L104-M106 VanDerWaalsContact C-N 3.3Å; L104-M106 PolarHBondContact O-N 3.37Å; L104-L107 PolarHBondContact O-N 2.74Å; L104-E108 PolarHBondContact O-N 3.07Å; L104-E108 VanDerWaalsContact O-N 3.15Å; L104-L124 HydrophobicContact CD1-CD1 4.16Å; L104-L124 HydrophobicContact CD2-CD1 4.08Å; L104-L124 HydrophobicContact CG-CD1 3.7Å; L104-L128 HydrophobicContact CD2-CD2 3.74Å; L104-L128 HydrophobicContact CD2-CG 4.09Å; L104-I131 HydrophobicContact CD2-CD1 4.14Å
105S93.4Very high92Very high44 Ų4449.8 Ų49.831%0.30828%0.284SS..Hα-helixtrans-64.4-31.7177.5-176.80000113.2H92 E101 C102 E108H92-S105 PolarHBondContact CE1-OG 3.05Å; E101-S105 VanDerWaalsContact O-CB 3.26Å; E101-S105 WeakPolarHBondContact O-CB 3.5Å; E101-S105 PolarHBondContact O-N 2.87Å; C102-S105 PolarHBondContact O-N 3.28Å; S105-E108 WeakPolarHBondContact O-CG 2.91Å
106M92Very high92.3Very high25 Ų2543.6 Ų43.612%0.12325%0.251CS..Hα-helixtrans-73.5-32.7175.9-81-169.166.600113.8L29 T62 R88 C90 C102 L103 L104 Y115L29-M106 HydrophobicContact CD2-CE 4.4Å; T62-M106 HydrophobicContact CG2-SD 3.44Å; T62-M106 WeakPolarHBondContact CG2-SD 3.22Å; R88-M106 HydrophobicContact CB-CE 3.92Å; C90-M106 HydrophobicContact CB-CG 4.38Å; C90-M106 HydrophobicContact CB-SD 4.16Å; C102-M106 WeakPolarHBondContact O-CG 3.22Å; C102-M106 PolarHBondContact O-N 3.06Å; L103-M106 PolarHBondContact O-N 3.44Å; L104-M106 VanDerWaalsContact C-N 3.3Å; L104-M106 PolarHBondContact O-N 3.37Å; M106-Y115 HydrophobicContact CE-CE2 4.01Å
107L91.1Very high92.7Very high0 Ų040.2 Ų40.20%023%0.229CC..Hα-helixtrans-84.9-20.3-177.3-69.2167.7000112.8L29 L103 L104 N111 P112 Y115 V117 L128 I131 V134L29-L107 HydrophobicContact CD1-CD2 4.49Å; L103-L107 WeakPolarHBondContact O-CD1 3.42Å; L103-L107 WeakPolarHBondContact O-CG 3.47Å; L103-L107 PolarHBondContact O-N 3.05Å; L103-L107 VanDerWaalsContact O-N 3.15Å; L104-L107 PolarHBondContact O-N 2.74Å; L107-N111 HydrophobicContact CD2-CB 4.3Å; L107-N111 WeakPolarHBondContact CD2-OD1 3.17Å; L107-N111 VanDerWaalsContact O-CA 3.24Å; L107-N111 WeakPolarHBondContact O-CA 3.39Å; L107-N111 PolarHBondContact O-N 3.36Å; L107-P112 WeakPolarHBondContact O-CD 3.48Å; L107-Y115 HydrophobicContact CD2-CD2 4.15Å; L107-Y115 HydrophobicContact CD2-CG 4.49Å; L107-V117 HydrophobicContact CD1-CG2 3.54Å; L107-V117 HydrophobicContact CD2-CG2 4.43Å; L107-L128 HydrophobicContact CD1-CD2 3.2Å; L107-I131 HydrophobicContact CB-CD1 4.43Å; L107-V134 HydrophobicContact CD1-CG1 4.3Å
108E88.6Confident92.9Very high95 Ų9538.1 Ų38.144%0.44422%0.216SC..THydrogen-bonded Turntrans53.5-143.9179.1-56-175.7164.900110.7K91 L104 S105 I131K91-E108 IonicContact NZ-OE1 2.81Å; K91-E108 PolarHBondContact NZ-OE1 3.19Å; L104-E108 PolarHBondContact O-N 3.07Å; L104-E108 VanDerWaalsContact O-N 3.15Å; S105-E108 WeakPolarHBondContact O-CG 2.91Å; E108-I131 WeakPolarHBondContact O-CD1 3.44Å
109G85.8Confident93Very high48 Ų4836.4 Ų36.450%0.49520%0.204SC..THydrogen-bonded Turntrans-91-17.5-177.700000115.4I131G109-I131 WeakPolarHBondContact O-CG2 3.32Å
110T84.8Confident93.2Very high98 Ų9839.3 Ų39.360%0.60122%0.218SC*.THydrogen-bonded Turntrans-141.39.4-168.6530000114.2
111N93.1Very high93.2Very high2 Ų240 Ų401%0.01122%0.219CC..  trans51.464.4-179.8-170.712.6000113.4L107 H113 H114 Y115 G133 V134L107-N111 HydrophobicContact CD2-CB 4.3Å; L107-N111 WeakPolarHBondContact CD2-OD1 3.17Å; L107-N111 VanDerWaalsContact O-CA 3.24Å; L107-N111 WeakPolarHBondContact O-CA 3.39Å; L107-N111 PolarHBondContact O-N 3.36Å; N111-H113 PolarHBondContact O-N 2.75Å; N111-H113 VanDerWaalsContact O-N 3.09Å; N111-H114 PolarHBondContact O-N 2.86Å; N111-H114 PolarHBondContact OD1-N 2.71Å; N111-Y115 PolarHBondContact ND2-N 3.03Å; N111-Y115 PolarHBondContact ND2-O 3.28Å; N111-Y115 PolarHBondContact OD1-N 2.96Å; N111-G133 PolarHBondContact ND2-O 2.9Å; N111-V134 HydrophobicContact CB-CG2 4.02Å
112P90.1Very high93.2Very high56 Ų5642.4 Ų42.436%0.36423%0.23SC..THydrogen-bonded Turntrans-62.5-24.4-172.225.9-35.3000113.8L107L107-P112 WeakPolarHBondContact O-CD 3.48Å
113H91.4Very high93.3Very high108 Ų10850.2 Ų50.250%0.527%0.267SS..THydrogen-bonded Turntrans-96.51.3-178.4-64-56.6000113.6N111 Y115N111-H113 PolarHBondContact O-N 2.75Å; N111-H113 VanDerWaalsContact O-N 3.09Å; H113-Y115 VanDerWaalsContact C-N 3.35Å; H113-Y115 HydrophobicContact CB-CD2 3.59Å; H113-Y115 HydrophobicContact CB-CE2 3.22Å; H113-Y115 HydrophobicContact CB-CG 4.43Å; H113-Y115 AromaticContact CD2-CE2 3.92Å; H113-Y115 AromaticContact CG-CE2 3.83Å; H113-Y115 PolarHBondContact O-N 3.4Å
114H94.4Very high93.3Very high74 Ų7450.2 Ų50.234%0.34327%0.267SS..  trans54.447.2178.5-46.8110.9000112.9F20 F22 N111F20-H114 PolarHBondContact O-CD2 3.45Å; F20-H114 PolarHBondContact O-NE2 3.42Å; F22-H114 HydrophobicContact CD1-CB 3.8Å; F22-H114 HydrophobicContact CD2-CB 4.29Å; F22-H114 VanDerWaalsContact CE1-C 3.43Å; F22-H114 HydrophobicContact CE1-CB 3.7Å; F22-H114 WeakPolarHBondContact CE1-O 3.33Å; F22-H114 HydrophobicContact CE2-CB 4.17Å; F22-H114 HydrophobicContact CG-CB 4.13Å; F22-H114 HydrophobicContact CZ-CB 3.89Å; N111-H114 PolarHBondContact O-N 2.86Å; N111-H114 PolarHBondContact OD1-N 2.71Å
115Y96.1Very high93.4Very high10 Ų1048.3 Ų48.34%0.03926%0.257CS..EExtended strand (participates in β ladder)trans-77.6140.3174.4-68.5-66000111.1Q27 L29 M106 L107 N111 H113 P135Q27-Y115 HydrophobicContact CB-CD1 3.61Å; Q27-Y115 HydrophobicContact CB-CE1 3.84Å; Q27-Y115 WeakPolarHBondContact O-CA 3.26Å; L29-Y115 HydrophobicContact CD1-CD1 4.04Å; L29-Y115 HydrophobicContact CD1-CD2 3.78Å; L29-Y115 HydrophobicContact CD1-CE2 4.39Å; L29-Y115 HydrophobicContact CD1-CG 3.59Å; L29-Y115 HydrophobicContact CD2-CD1 4.06Å; L29-Y115 HydrophobicContact CD2-CE1 4.13Å; L29-Y115 HydrophobicContact CD2-CG 4.44Å; L29-Y115 HydrophobicContact CG-CD1 3.72Å; L29-Y115 HydrophobicContact CG-CD2 4.39Å; L29-Y115 HydrophobicContact CG-CE1 4.3Å; L29-Y115 HydrophobicContact CG-CG 3.79Å; M106-Y115 HydrophobicContact CE-CE2 4.01Å; L107-Y115 HydrophobicContact CD2-CD2 4.15Å; L107-Y115 HydrophobicContact CD2-CG 4.49Å; N111-Y115 PolarHBondContact ND2-N 3.03Å; N111-Y115 PolarHBondContact ND2-O 3.28Å; N111-Y115 PolarHBondContact OD1-N 2.96Å; H113-Y115 VanDerWaalsContact C-N 3.35Å; H113-Y115 HydrophobicContact CB-CD2 3.59Å; H113-Y115 HydrophobicContact CB-CE2 3.22Å; H113-Y115 HydrophobicContact CB-CG 4.43Å; H113-Y115 AromaticContact CD2-CE2 3.92Å; H113-Y115 AromaticContact CG-CE2 3.83Å; H113-Y115 PolarHBondContact O-N 3.4Å; Y115-P135 WeakPolarHBondContact O-CD 3.45Å
116F96.8Very high93.5Very high0 Ų048.8 Ų48.80%026%0.264CS..EExtended strand (participates in β ladder)trans-83.8149.9155.9-70.6-115.2000108.2F22 F26 Q27 I28 L29 P135 M137 L146F22-F116 HydrophobicContact CD1-CD2 4.06Å; F22-F116 AromaticContact CD1-CE2 3.37Å; F22-F116 HydrophobicContact CD1-CE2 3.37Å; F22-F116 HydrophobicContact CD1-CZ 4.05Å; F22-F116 AromaticContact CE1-CD2 3.75Å; F22-F116 HydrophobicContact CE1-CD2 3.75Å; F22-F116 AromaticContact CE1-CE2 3.5Å; F22-F116 HydrophobicContact CE1-CE2 3.5Å; F22-F116 HydrophobicContact CE1-CZ 4.25Å; F22-F116 HydrophobicContact CG-CE2 4.5Å; F26-F116 HydrophobicContact CB-CD2 4.16Å; F26-F116 HydrophobicContact CB-CE2 3.88Å; F26-F116 AromaticContact CD1-CE2 3.57Å; F26-F116 HydrophobicContact CD1-CE2 3.57Å; F26-F116 AromaticContact CD1-CZ 3.95Å; F26-F116 HydrophobicContact CD1-CZ 3.95Å; F26-F116 HydrophobicContact CE1-CE2 4.35Å; F26-F116 HydrophobicContact CE1-CZ 4.36Å; F26-F116 AromaticContact CG-CE2 3.92Å; F26-F116 HydrophobicContact CG-CE2 3.92Å; F26-F116 HydrophobicContact CG-CZ 4.27Å; Q27-F116 PolarHBondContact O-N 2.84Å; I28-F116 CarbonylContact C-O 3.58Å; I28-F116 WeakPolarHBondContact CA-O 3.45Å; I28-F116 HydrophobicContact CB-CB 4.26Å; I28-F116 HydrophobicContact CG1-CB 3.95Å; I28-F116 HydrophobicContact CG1-CG 4.42Å; I28-F116 HydrophobicContact CG2-CB 4.1Å; L29-F116 PolarHBondContact N-O 2.99Å; F116-P135 HydrophobicContact CD1-CB 3.37Å; F116-P135 HydrophobicContact CD1-CG 3.78Å; F116-P135 HydrophobicContact CD2-CG 4.23Å; F116-P135 HydrophobicContact CE1-CB 3.51Å; F116-P135 HydrophobicContact CE1-CG 3.73Å; F116-P135 HydrophobicContact CE2-CG 4.22Å; F116-P135 HydrophobicContact CG-CB 3.97Å; F116-P135 HydrophobicContact CG-CG 3.99Å; F116-P135 HydrophobicContact CZ-CB 4.25Å; F116-P135 HydrophobicContact CZ-CG 3.96Å; F116-M137 HydrophobicContact CD1-SD 4.16Å; F116-L146 HydrophobicContact CD1-CD1 4.11Å; F116-L146 HydrophobicContact CE1-CD1 4.09Å
117V97.2Very high93.6Very high0 Ų048.4 Ų48.40%027%0.267CS..EExtended strand (participates in β ladder)trans-120.5127.4175.9-172.80000109.9L107 T119 L128 V134 P135 L136 M137L107-V117 HydrophobicContact CD1-CG2 3.54Å; L107-V117 HydrophobicContact CD2-CG2 4.43Å; V117-T119 HydrophobicContact CG1-CG2 4.32Å; V117-L128 HydrophobicContact CB-CD1 4.02Å; V117-L128 HydrophobicContact CG1-CD1 3.67Å; V117-L128 HydrophobicContact CG2-CD1 4.21Å; V117-L128 HydrophobicContact CG2-CD2 4.44Å; V117-V134 HydrophobicContact CG2-CG1 3.84Å; V117-P135 PolarHBondContact N-O 2.9Å; V117-L136 HydrophobicContact CB-CD2 4.1Å; V117-L136 CarbonylContact O-C 3.45Å; V117-L136 WeakPolarHBondContact O-CA 3.14Å; V117-M137 PolarHBondContact O-N 2.93Å
118A97.1Very high93.8Very high0 Ų048.5 Ų48.50%027%0.267CS..EExtended strand (participates in β ladder)trans-111.6106.6175.300000109.3I28 L29 I30 D31 F34 M137I28-A118 HydrophobicContact CG2-CB 3.96Å; L29-A118 PolarHBondContact O-N 2.98Å; I30-A118 HydrophobicContact CG1-CB 4.17Å; D31-A118 PolarHBondContact N-O 3.42Å; D31-A118 VanDerWaalsContact N-O 3.14Å; F34-A118 WeakPolarHBondContact CB-O 3.42Å; F34-A118 HydrophobicContact CD1-CB 4.05Å; F34-A118 HydrophobicContact CD2-CB 3.84Å; F34-A118 HydrophobicContact CE1-CB 4.09Å; F34-A118 HydrophobicContact CE2-CB 3.87Å; F34-A118 HydrophobicContact CG-CB 3.92Å; F34-A118 HydrophobicContact CZ-CB 4Å; A118-M137 WeakPolarHBondContact CA-O 3.29Å; A118-M137 HydrophobicContact CB-CB 4.14Å
119T96.6Very high94.1Very high0 Ų047.9 Ų47.90%026%0.263CS..  trans-142.4159.2-176.1-176.10000110.9V117 D121 L124 L128 M137 Y138V117-T119 HydrophobicContact CG1-CG2 4.32Å; T119-D121 PolarHBondContact OG1-N 3.06Å; T119-L124 HydrophobicContact CG2-CD2 4.14Å; T119-L124 HydrophobicContact CG2-CG 4.43Å; T119-L128 HydrophobicContact CG2-CD1 4.45Å; T119-M137 PolarHBondContact N-O 2.77Å; T119-Y138 HydrophobicContact CG2-CE1 4.43Å; T119-Y138 WeakPolarHBondContact O-CD1 3.21Å; T119-Y138 WeakPolarHBondContact O-CE1 3.48Å
120Q95.6Very high94.6Very high63 Ų6353.3 Ų53.329%0.29427%0.273SS..  trans-116.71.9167.5-68.7-72.117.600112.9T33 F34 A37 I139T33-Q120 PolarHBondContact OG1-N 3.28Å; F34-Q120 HydrophobicContact CD2-CG 4.47Å; A37-Q120 HydrophobicContact CB-CG 3.85Å; Q120-I139 VanDerWaalsContact NE2-CA 3.32Å; Q120-I139 VanDerWaalsContact NE2-CB 3.29Å; Q120-I139 PolarHBondContact NE2-O 3.49Å
121D95.6Very high95Very high44 Ų4449.6 Ų49.624%0.23525%0.249CC..  trans-78.1126.8176.7178.511.5000110.5T119 E123 L124 T125T119-D121 PolarHBondContact OG1-N 3.06Å; D121-E123 PolarHBondContact OD1-N 3.1Å; D121-L124 HydrophobicContact CB-CB 3.97Å; D121-L124 VanDerWaalsContact OD2-CB 3.29Å; D121-L124 WeakPolarHBondContact OD2-CB 3.45Å; D121-L124 PolarHBondContact OD2-N 2.85Å; D121-T125 WeakPolarHBondContact O-CB 3.34Å; D121-T125 PolarHBondContact O-N 2.81Å; D121-T125 VanDerWaalsContact O-N 3.08Å; D121-T125 PolarHBondContact O-OG1 3.09Å
122Q94.8Very high95.1Very high165 Ų16550.4 Ų50.477%0.77125%0.254SS*.Hα-helixtrans-74.5-35.4179.9-65.4-173.8-0.600112T125 A126Q122-T125 WeakPolarHBondContact O-CB 3.36Å; Q122-T125 PolarHBondContact O-N 2.95Å; Q122-A126 PolarHBondContact O-N 3.17Å
123E95.2Very high95.3Very high163 Ų16347.8 Ų47.876%0.76224%0.238SC*.Hα-helixtrans-69.7-49.4-179.1-65.6-174.6-178.500110.2D121 T125 A126 G127D121-E123 PolarHBondContact OD1-N 3.1Å; E123-T125 VanDerWaalsContact C-N 3.29Å; E123-T125 PolarHBondContact O-N 3.45Å; E123-A126 PolarHBondContact O-N 3.34Å; E123-A126 VanDerWaalsContact O-N 3.17Å; E123-G127 PolarHBondContact O-N 2.82Å
124L95.3Very high95.5Very high2 Ų242.8 Ų42.81%0.0122%0.215CC..Hα-helixtrans-56.4-45.5171.5177.557.9000111.2S100 L103 L104 T119 D121 A126 G127 L128S100-L124 WeakPolarHBondContact O-CD1 3.31Å; L103-L124 HydrophobicContact CB-CD1 4.35Å; L103-L124 HydrophobicContact CD1-CD2 3.68Å; L104-L124 HydrophobicContact CD1-CD1 4.16Å; L104-L124 HydrophobicContact CD2-CD1 4.08Å; L104-L124 HydrophobicContact CG-CD1 3.7Å; T119-L124 HydrophobicContact CG2-CD2 4.14Å; T119-L124 HydrophobicContact CG2-CG 4.43Å; D121-L124 HydrophobicContact CB-CB 3.97Å; D121-L124 VanDerWaalsContact OD2-CB 3.29Å; D121-L124 WeakPolarHBondContact OD2-CB 3.45Å; D121-L124 PolarHBondContact OD2-N 2.85Å; L124-A126 VanDerWaalsContact C-N 3.33Å; L124-A126 PolarHBondContact O-N 3.04Å; L124-G127 PolarHBondContact O-N 3.29Å; L124-G127 VanDerWaalsContact O-N 3.15Å; L124-L128 HydrophobicContact CD1-CD1 3.87Å; L124-L128 HydrophobicContact CD1-CD2 4.28Å; L124-L128 HydrophobicContact CD1-CG 3.88Å; L124-L128 HydrophobicContact CD2-CD1 4.33Å; L124-L128 HydrophobicContact CG-CD1 3.7Å; L124-L128 HydrophobicContact CG-CG 4.17Å; L124-L128 VanDerWaalsContact O-CG 3.23Å; L124-L128 WeakPolarHBondContact O-CG 3.47Å; L124-L128 PolarHBondContact O-N 2.89Å
125T95.9Very high95.6Very high17 Ų1739.2 Ų39.210%0.10420%0.198CC..Hα-helixtrans-55.7-45.9176.4-73.80000112.4D121 Q122 E123 G127 L128 K129 L136 Y138D121-T125 WeakPolarHBondContact O-CB 3.34Å; D121-T125 PolarHBondContact O-N 2.81Å; D121-T125 VanDerWaalsContact O-N 3.08Å; D121-T125 PolarHBondContact O-OG1 3.09Å; Q122-T125 WeakPolarHBondContact O-CB 3.36Å; Q122-T125 PolarHBondContact O-N 2.95Å; E123-T125 VanDerWaalsContact C-N 3.29Å; E123-T125 PolarHBondContact O-N 3.45Å; T125-G127 VanDerWaalsContact C-N 3.3Å; T125-G127 PolarHBondContact O-N 2.91Å; T125-L128 PolarHBondContact O-N 3.32Å; T125-K129 HydrophobicContact CG2-CD 4.03Å; T125-K129 HydrophobicContact CG2-CG 4.41Å; T125-K129 WeakPolarHBondContact O-CG 3.42Å; T125-K129 PolarHBondContact O-N 2.95Å; T125-L136 HydrophobicContact CG2-CD1 4.48Å; T125-Y138 WeakPolarHBondContact CB-OH 3.19Å; T125-Y138 HydrophobicContact CG2-CE1 4.47Å; T125-Y138 WeakPolarHBondContact CG2-OH 3.35Å; T125-Y138 WeakPolarHBondContact OG1-CE1 3.32Å; T125-Y138 PolarHBondContact OG1-OH 3.17Å
126A95.3Very high95.6Very high54 Ų5439 Ų3945%0.44620%0.198SC..Hα-helixtrans-63.7-37.6179.600000111.6Q122 E123 L124Q122-A126 PolarHBondContact O-N 3.17Å; E123-A126 PolarHBondContact O-N 3.34Å; E123-A126 VanDerWaalsContact O-N 3.17Å; L124-A126 VanDerWaalsContact C-N 3.33Å; L124-A126 PolarHBondContact O-N 3.04Å
127G95.1Very high95.6Very high18 Ų1839 Ų3919%0.18620%0.198CC..Hα-helixtrans-62.9-50171.900000112.4E123 L124 T125 K129 K130E123-G127 PolarHBondContact O-N 2.82Å; L124-G127 PolarHBondContact O-N 3.29Å; L124-G127 VanDerWaalsContact O-N 3.15Å; T125-G127 VanDerWaalsContact C-N 3.3Å; T125-G127 PolarHBondContact O-N 2.91Å; G127-K129 VanDerWaalsContact C-N 3.33Å; G127-K129 PolarHBondContact O-N 3.37Å; G127-K130 WeakPolarHBondContact O-CB 3.46Å; G127-K130 PolarHBondContact O-N 3.34Å
128L95.6Very high95.5Very high1 Ų140.5 Ų40.51%0.00520%0.204CC..Hα-helixtrans-65.3-33.5-177.6-65.1171.6000113.1L104 L107 V117 T119 L124 T125 K130 I131 V134 L136L104-L128 HydrophobicContact CD2-CD2 3.74Å; L104-L128 HydrophobicContact CD2-CG 4.09Å; L107-L128 HydrophobicContact CD1-CD2 3.2Å; V117-L128 HydrophobicContact CB-CD1 4.02Å; V117-L128 HydrophobicContact CG1-CD1 3.67Å; V117-L128 HydrophobicContact CG2-CD1 4.21Å; V117-L128 HydrophobicContact CG2-CD2 4.44Å; T119-L128 HydrophobicContact CG2-CD1 4.45Å; L124-L128 HydrophobicContact CD1-CD1 3.87Å; L124-L128 HydrophobicContact CD1-CD2 4.28Å; L124-L128 HydrophobicContact CD1-CG 3.88Å; L124-L128 HydrophobicContact CD2-CD1 4.33Å; L124-L128 HydrophobicContact CG-CD1 3.7Å; L124-L128 HydrophobicContact CG-CG 4.17Å; L124-L128 VanDerWaalsContact O-CG 3.23Å; L124-L128 WeakPolarHBondContact O-CG 3.47Å; L124-L128 PolarHBondContact O-N 2.89Å; T125-L128 PolarHBondContact O-N 3.32Å; L128-K130 PolarHBondContact O-N 2.84Å; L128-I131 HydrophobicContact CD2-CD1 4.47Å; L128-I131 PolarHBondContact O-N 3.4Å; L128-V134 HydrophobicContact CB-CG1 4.46Å; L128-V134 HydrophobicContact CD2-CG1 4.37Å; L128-L136 HydrophobicContact CB-CD1 4.36Å; L128-L136 HydrophobicContact CB-CD2 3.8Å; L128-L136 HydrophobicContact CD1-CD2 3.52Å; L128-L136 HydrophobicContact CG-CD2 4.29Å
129K95.3Very high95.4Very high82 Ų8241 Ų4136%0.35721%0.206SC..Hα-helixtrans-65.2-20.7177.7-78-176.5174.1-172.70113.5T125 G127 I131 L136 D147 S150 C152T125-K129 HydrophobicContact CG2-CD 4.03Å; T125-K129 HydrophobicContact CG2-CG 4.41Å; T125-K129 WeakPolarHBondContact O-CG 3.42Å; T125-K129 PolarHBondContact O-N 2.95Å; G127-K129 VanDerWaalsContact C-N 3.33Å; G127-K129 PolarHBondContact O-N 3.37Å; K129-I131 VanDerWaalsContact C-N 3.31Å; K129-L136 HydrophobicContact CD-CD1 4.31Å; K129-L136 HydrophobicContact CG-CD1 3.55Å; K129-D147 WeakPolarHBondContact CE-OD2 3.26Å; K129-D147 IonicContact NZ-OD2 2.9Å; K129-D147 PolarHBondContact NZ-OD2 3.1Å; K129-S150 WeakPolarHBondContact O-CB 3.3Å; K129-S150 PolarHBondContact O-OG 3.36Å; K129-C152 WeakPolarHBondContact O-CB 3.48Å
130K94.8Very high95.2Very high163 Ų16345.6 Ų45.671%0.70923%0.23SC*.THydrogen-bonded Turntrans-77.9-17174.1-61.8173.4-176.2177.90112.8G127 L128 C152G127-K130 WeakPolarHBondContact O-CB 3.46Å; G127-K130 PolarHBondContact O-N 3.34Å; L128-K130 PolarHBondContact O-N 2.84Å; K130-C152 PolarHBondContact O-SG 2.89Å
131I94.4Very high94.9Very high20 Ų2047.9 Ų47.910%0.10325%0.248CC..SBendtrans-92.8123.3179.3-56.6169.3000107.7L104 L107 E108 G109 L128 K129 V134L104-I131 HydrophobicContact CD2-CD1 4.14Å; L107-I131 HydrophobicContact CB-CD1 4.43Å; E108-I131 WeakPolarHBondContact O-CD1 3.44Å; G109-I131 WeakPolarHBondContact O-CG2 3.32Å; L128-I131 HydrophobicContact CD2-CD1 4.47Å; L128-I131 PolarHBondContact O-N 3.4Å; K129-I131 VanDerWaalsContact C-N 3.31Å; I131-V134 HydrophobicContact CB-CG2 3.92Å; I131-V134 HydrophobicContact CG2-CG2 3.64Å
132P94.4Very high94.5Very high18 Ų1850.3 Ų50.312%0.11726%0.261CS..THydrogen-bonded Turntrans-69.9145.4174.829.9-33.9000110.4F20 H156F20-P132 HydrophobicContact CE1-CB 4.21Å; F20-P132 HydrophobicContact CZ-CB 4.34Å; P132-H156 HydrophobicContact CB-CB 3.82Å
133G93.7Very high94.3Very high1 Ų144.8 Ų44.81%0.0124%0.239CC..THydrogen-bonded Turntrans80.718.9173.300000115.1F20 F22 N111 P135 S153F20-G133 VanDerWaalsContact CD1-CA 3.41Å; F22-G133 WeakPolarHBondContact CZ-O 3.49Å; N111-G133 PolarHBondContact ND2-O 2.9Å; G133-P135 WeakPolarHBondContact O-CD 3.06Å; G133-S153 PolarHBondContact N-OG 3.41Å
134V96.5Very high94.2Very high3 Ų337 Ų372%0.01820%0.202CC..  trans-104.8111.2173.8-176.50000110.1Y16 L107 N111 V117 L128 I131 L136Y16-V134 PolarHBondContact OH-O 2.96Å; L107-V134 HydrophobicContact CD1-CG1 4.3Å; N111-V134 HydrophobicContact CB-CG2 4.02Å; V117-V134 HydrophobicContact CG2-CG1 3.84Å; L128-V134 HydrophobicContact CB-CG1 4.46Å; L128-V134 HydrophobicContact CD2-CG1 4.37Å; I131-V134 HydrophobicContact CB-CG2 3.92Å; I131-V134 HydrophobicContact CG2-CG2 3.64Å; V134-L136 HydrophobicContact CG1-CD2 4.12Å
135P96.1Very high94.1Very high0 Ų038.4 Ų38.40%021%0.21CC..  trans-77.9129.7170.4-9.124.8000111.1Y16 F22 Y115 F116 V117 G133 L146Y16-P135 HydrophobicContact CD1-CG 3.89Å; Y16-P135 HydrophobicContact CD2-CB 4.01Å; Y16-P135 HydrophobicContact CD2-CG 3.85Å; Y16-P135 HydrophobicContact CE1-CB 4.33Å; Y16-P135 HydrophobicContact CE1-CG 3.89Å; Y16-P135 HydrophobicContact CE2-CB 3.64Å; Y16-P135 HydrophobicContact CE2-CG 3.87Å; Y16-P135 HydrophobicContact CG-CG 3.87Å; Y16-P135 WeakPolarHBondContact OH-CA 3.39Å; F22-P135 HydrophobicContact CE1-CG 3.74Å; F22-P135 HydrophobicContact CE2-CG 4.39Å; F22-P135 HydrophobicContact CZ-CG 3.64Å; Y115-P135 WeakPolarHBondContact O-CD 3.45Å; F116-P135 HydrophobicContact CD1-CB 3.37Å; F116-P135 HydrophobicContact CD1-CG 3.78Å; F116-P135 HydrophobicContact CD2-CG 4.23Å; F116-P135 HydrophobicContact CE1-CB 3.51Å; F116-P135 HydrophobicContact CE1-CG 3.73Å; F116-P135 HydrophobicContact CE2-CG 4.22Å; F116-P135 HydrophobicContact CG-CB 3.97Å; F116-P135 HydrophobicContact CG-CG 3.99Å; F116-P135 HydrophobicContact CZ-CB 4.25Å; F116-P135 HydrophobicContact CZ-CG 3.96Å; V117-P135 PolarHBondContact N-O 2.9Å; G133-P135 WeakPolarHBondContact O-CD 3.06Å; P135-L146 HydrophobicContact CB-CD1 3.98Å
136L96.6Very high94.1Very high5 Ų537.6 Ų37.63%0.02621%0.205CC..EExtended strand (participates in β ladder)trans-108.9135.6-177.5-64.5171.9000111.6V117 T125 L128 K129 V134 Y138 D147V117-L136 HydrophobicContact CB-CD2 4.1Å; V117-L136 CarbonylContact O-C 3.45Å; V117-L136 WeakPolarHBondContact O-CA 3.14Å; T125-L136 HydrophobicContact CG2-CD1 4.48Å; L128-L136 HydrophobicContact CB-CD1 4.36Å; L128-L136 HydrophobicContact CB-CD2 3.8Å; L128-L136 HydrophobicContact CD1-CD2 3.52Å; L128-L136 HydrophobicContact CG-CD2 4.29Å; K129-L136 HydrophobicContact CD-CD1 4.31Å; K129-L136 HydrophobicContact CG-CD1 3.55Å; V134-L136 HydrophobicContact CG1-CD2 4.12Å; L136-Y138 HydrophobicContact CB-CE2 3.85Å; L136-Y138 WeakPolarHBondContact CD1-OH 3.45Å; L136-D147 HydrophobicContact CB-CB 4.23Å; L136-D147 PolarHBondContact O-N 2.96Å
137M96.4Very high94.1Very high0 Ų037 Ų370%020%0.195CC..EExtended strand (participates in β ladder)trans-123.7134.7179.9-57.7-170.57300111.2I28 M49 Y52 L53 F116 V117 A118 T119 I144 V145 L146I28-M137 HydrophobicContact CD1-SD 4.13Å; M49-M137 HydrophobicContact CE-CE 4.36Å; M49-M137 HydrophobicContact CE-SD 4.49Å; M49-M137 HydrophobicContact SD-CE 3.27Å; M49-M137 WeakPolarHBondContact SD-CE 3.26Å; M49-M137 HydrophobicContact SD-SD 3.84Å; Y52-M137 HydrophobicContact CD1-CE 3.92Å; Y52-M137 HydrophobicContact CE1-CE 4.03Å; L53-M137 HydrophobicContact CD1-CE 4.43Å; L53-M137 HydrophobicContact CD1-SD 4.38Å; L53-M137 HydrophobicContact CD2-CE 4.03Å; L53-M137 HydrophobicContact CD2-SD 4.47Å; L53-M137 HydrophobicContact CG-CE 4.35Å; F116-M137 HydrophobicContact CD1-SD 4.16Å; V117-M137 PolarHBondContact O-N 2.93Å; A118-M137 WeakPolarHBondContact CA-O 3.29Å; A118-M137 HydrophobicContact CB-CB 4.14Å; T119-M137 PolarHBondContact N-O 2.77Å; M137-I144 HydrophobicContact CE-CG2 3.61Å; M137-V145 WeakPolarHBondContact CA-O 3.39Å; M137-L146 HydrophobicContact CG-CD1 3.69Å; M137-L146 HydrophobicContact SD-CD1 4.39Å
138Y95.9Very high94.1Very high31 Ų3142.2 Ų42.212%0.12221%0.213CC..EExtended strand (participates in β ladder)trans-127160.3-178.7-58.3-74.7000110.7T119 T125 L136 I144 V145 D147T119-Y138 HydrophobicContact CG2-CE1 4.43Å; T119-Y138 WeakPolarHBondContact O-CD1 3.21Å; T119-Y138 WeakPolarHBondContact O-CE1 3.48Å; T125-Y138 WeakPolarHBondContact CB-OH 3.19Å; T125-Y138 HydrophobicContact CG2-CE1 4.47Å; T125-Y138 WeakPolarHBondContact CG2-OH 3.35Å; T125-Y138 WeakPolarHBondContact OG1-CE1 3.32Å; T125-Y138 PolarHBondContact OG1-OH 3.17Å; L136-Y138 HydrophobicContact CB-CE2 3.85Å; L136-Y138 WeakPolarHBondContact CD1-OH 3.45Å; Y138-I144 CarbonylContact O-C 3.34Å; Y138-I144 WeakPolarHBondContact O-CA 3.44Å; Y138-V145 PolarHBondContact N-O 2.96Å; Y138-V145 PolarHBondContact O-N 3.44Å; Y138-D147 HydrophobicContact CD2-CB 4.22Å; Y138-D147 HydrophobicContact CE2-CB 3.85Å
139I95.2Very high94.1Very high10 Ų1043.4 Ų43.45%0.05122%0.22CC..EExtended strand (participates in β ladder)trans-101.4120.9162.4-67.7159000107.9F34 A37 A38 I43 Q120 V141 T143 I144F34-I139 HydrophobicContact CD1-CD1 4.21Å; F34-I139 HydrophobicContact CD2-CD1 4.13Å; F34-I139 HydrophobicContact CD2-CG1 4.26Å; F34-I139 HydrophobicContact CE1-CD1 3.9Å; F34-I139 HydrophobicContact CE1-CG1 4.38Å; F34-I139 HydrophobicContact CE2-CD1 3.83Å; F34-I139 HydrophobicContact CE2-CG1 3.61Å; F34-I139 HydrophobicContact CG-CD1 4.32Å; F34-I139 HydrophobicContact CZ-CD1 3.7Å; F34-I139 HydrophobicContact CZ-CG1 3.67Å; A37-I139 HydrophobicContact CB-CD1 4.12Å; A38-I139 HydrophobicContact CB-CD1 3.73Å; I43-I139 HydrophobicContact CD1-CB 4.4Å; I43-I139 HydrophobicContact CD1-CD1 4.2Å; I43-I139 HydrophobicContact CD1-CG1 4.08Å; I43-I139 HydrophobicContact CD1-CG2 3.43Å; I43-I139 VanDerWaalsContact CD1-CG2 3.43Å; Q120-I139 VanDerWaalsContact NE2-CA 3.32Å; Q120-I139 VanDerWaalsContact NE2-CB 3.29Å; Q120-I139 PolarHBondContact NE2-O 3.49Å; I139-V141 WeakPolarHBondContact CG2-O 3.44Å; I139-T143 WeakPolarHBondContact CA-O 3.4Å; I139-I144 HydrophobicContact CG1-CG1 4.08Å
140I92.4Very high94.1Very high98 Ų9840 Ų4050%0.50321%0.207SC..EExtended strand (participates in β ladder)trans-115.5117.2173.4-58.7175.2000106.9N142 T143 V145I140-N142 PolarHBondContact O-N 3.09Å; I140-N142 VanDerWaalsContact O-N 3.1Å; I140-T143 PolarHBondContact N-O 3.41Å; I140-T143 PolarHBondContact O-N 3.15Å; I140-T143 VanDerWaalsContact O-N 3.07Å; I140-T143 PolarHBondContact O-OG1 2.96Å; I140-T143 VanDerWaalsContact O-OG1 3.08Å; I140-V145 HydrophobicContact CB-CG2 4.42Å; I140-V145 HydrophobicContact CD1-CB 4.28Å; I140-V145 HydrophobicContact CD1-CG2 4.27Å; I140-V145 HydrophobicContact CG1-CG2 4.49Å
141V88Confident94.1Very high110 Ų11038.6 Ų38.667%0.66720%0.203SC*.THydrogen-bonded Turntrans53.9-113.1-171.8-1690000109.1N41 I139N41-V141 PolarHBondContact ND2-O 3.3Å; N41-V141 VanDerWaalsContact ND2-O 3.13Å; N41-V141 PolarHBondContact OD1-O 3.34Å; I139-V141 WeakPolarHBondContact CG2-O 3.44Å
142N87.8Confident94Very high95 Ų9539.9 Ų39.951%0.50821%0.213SC..THydrogen-bonded Turntrans-106.420.3-176.1-65.21.6000112.7I43 I140I43-N142 VanDerWaalsContact CD1-C 3.47Å; I140-N142 PolarHBondContact O-N 3.09Å; I140-N142 VanDerWaalsContact O-N 3.1Å
143T89.9Confident94Very high50 Ų5039 Ų3931%0.30721%0.208SC..EExtended strand (participates in β ladder)trans-137.4139-171.763.30000114I139 I140I139-T143 WeakPolarHBondContact CA-O 3.4Å; I140-T143 PolarHBondContact N-O 3.41Å; I140-T143 PolarHBondContact O-N 3.15Å; I140-T143 VanDerWaalsContact O-N 3.07Å; I140-T143 PolarHBondContact O-OG1 2.96Å; I140-T143 VanDerWaalsContact O-OG1 3.08Å
144I93.7Very high94.1Very high0 Ų040.8 Ų40.80%022%0.218CC..EExtended strand (participates in β ladder)trans-78.8127.3173-55.3171.6000110R5 F34 I43 Q48 M49 Y52 M137 Y138 I139R5-I144 VanDerWaalsContact CZ-O 3.23Å; R5-I144 PolarHBondContact NE-O 3.34Å; R5-I144 PolarHBondContact NH2-O 3.33Å; F34-I144 HydrophobicContact CZ-CD1 4.46Å; F34-I144 HydrophobicContact CZ-CG1 4.27Å; F34-I144 HydrophobicContact CZ-CG2 4.15Å; I43-I144 HydrophobicContact CG2-CD1 3.94Å; I43-I144 HydrophobicContact CG2-CG1 4.05Å; Q48-I144 HydrophobicContact CB-CD1 4.07Å; M49-I144 HydrophobicContact CE-CD1 4.19Å; M49-I144 HydrophobicContact CE-CG2 4.38Å; M49-I144 HydrophobicContact SD-CD1 4.28Å; M49-I144 HydrophobicContact SD-CG2 4.01Å; Y52-I144 HydrophobicContact CD1-CG2 4.32Å; Y52-I144 VanDerWaalsContact CE1-O 3.29Å; Y52-I144 WeakPolarHBondContact CE1-O 3.4Å; M137-I144 HydrophobicContact CE-CG2 3.61Å; Y138-I144 CarbonylContact O-C 3.34Å; Y138-I144 WeakPolarHBondContact O-CA 3.44Å; I139-I144 HydrophobicContact CG1-CG1 4.08Å
145V94.1Very high94Very high30 Ų3043 Ų4318%0.18223%0.234CC..EExtended strand (participates in β ladder)trans-126.8129.9-176.7-178.40000109.7M137 Y138 I140M137-V145 WeakPolarHBondContact CA-O 3.39Å; Y138-V145 PolarHBondContact N-O 2.96Å; Y138-V145 PolarHBondContact O-N 3.44Å; I140-V145 HydrophobicContact CB-CG2 4.42Å; I140-V145 HydrophobicContact CD1-CB 4.28Å; I140-V145 HydrophobicContact CD1-CG2 4.27Å; I140-V145 HydrophobicContact CG1-CG2 4.49Å
146L95.6Very high93.8Very high0 Ų045.8 Ų45.80%025%0.246CC..EExtended strand (participates in β ladder)trans-82.7123.3169.2-177.967.3000108N12 I13 Y52 L53 F116 P135 M137N12-L146 HydrophobicContact CB-CD2 3.84Å; N12-L146 HydrophobicContact CB-CG 4.45Å; I13-L146 HydrophobicContact CD1-CD2 4.43Å; I13-L146 HydrophobicContact CG1-CD2 3.71Å; Y52-L146 HydrophobicContact CE1-CB 3.91Å; Y52-L146 PolarHBondContact OH-N 3.4Å; L53-L146 HydrophobicContact CD2-CD2 4.42Å; F116-L146 HydrophobicContact CD1-CD1 4.11Å; F116-L146 HydrophobicContact CE1-CD1 4.09Å; P135-L146 HydrophobicContact CB-CD1 3.98Å; M137-L146 HydrophobicContact CG-CD1 3.69Å; M137-L146 HydrophobicContact SD-CD1 4.39Å
147D95.1Very high93.5Very high42 Ų4246.8 Ų46.823%0.22525%0.253CS..PPolyproline II helixtrans-65.7161.3178.2-158.36.1000110.6N12 K129 L136 Y138N12-D147 PolarHBondContact ND2-O 3.45Å; K129-D147 WeakPolarHBondContact CE-OD2 3.26Å; K129-D147 IonicContact NZ-OD2 2.9Å; K129-D147 PolarHBondContact NZ-OD2 3.1Å; L136-D147 HydrophobicContact CB-CB 4.23Å; L136-D147 PolarHBondContact O-N 2.96Å; Y138-D147 HydrophobicContact CD2-CB 4.22Å; Y138-D147 HydrophobicContact CE2-CB 3.85Å
148K94.6Very high93.3Very high128 Ų12851.7 Ų51.756%0.55728%0.276SS*.PPolyproline II helixtrans-65.2151167.3-62.5178.3-176.1174.80108.8S150K148-S150 PolarHBondContact O-N 3.38Å
149P95.3Very high93Very high25 Ų2550.9 Ų50.916%0.16228%0.276CS..PPolyproline II helixtrans-50.1137172.2-26.735000111.6F15 Y16 V154F15-P149 HydrophobicContact CB-CG 4.37Å; F15-P149 HydrophobicContact CD1-CB 3.76Å; F15-P149 HydrophobicContact CD1-CG 3.42Å; F15-P149 VanDerWaalsContact CD1-CG 3.42Å; F15-P149 HydrophobicContact CE1-CB 3.52Å; F15-P149 HydrophobicContact CE1-CG 3.76Å; F15-P149 HydrophobicContact CG-CG 3.86Å; F15-P149 HydrophobicContact CZ-CB 4.09Å; F15-P149 HydrophobicContact CZ-CG 4.44Å; Y16-P149 HydrophobicContact CE2-CG 4.21Å; Y16-P149 WeakPolarHBondContact OH-CA 3.41Å; P149-V154 HydrophobicContact CB-CG2 4Å
150S95.3Very high92.5Very high12 Ų1252.1 Ų52.18%0.08428%0.284CS..PPolyproline II helixtrans-61.5151.9179.266.60000110.4K129 K148 C152 S153 V154K129-S150 WeakPolarHBondContact O-CB 3.3Å; K129-S150 PolarHBondContact O-OG 3.36Å; K148-S150 PolarHBondContact O-N 3.38Å; S150-C152 PolarHBondContact O-N 3.11Å; S150-S153 WeakPolarHBondContact O-CA 3.36Å; S150-S153 WeakPolarHBondContact O-CB 3.46Å; S150-S153 PolarHBondContact O-N 3.42Å; S150-S153 PolarHBondContact OG-N 3.36Å; S150-S153 VanDerWaalsContact OG-N 3.15Å; S150-S153 PolarHBondContact OG-OG 3.12Å; S150-V154 PolarHBondContact O-N 3.36Å
151Q94.7Very high92.2Very high133 Ų13351.6 Ų51.662%0.62129%0.294SS*.Hα-helixtrans-56.5-38176.4-171.658.644.900111.1S153 V154 S155Q151-S153 PolarHBondContact O-N 3.28Å; Q151-V154 PolarHBondContact O-N 3.17Å; Q151-S155 PolarHBondContact NE2-OG 3.42Å; Q151-S155 WeakPolarHBondContact O-CB 3.47Å; Q151-S155 PolarHBondContact O-N 3.49Å; Q151-S155 PolarHBondContact O-OG 2.85Å
152C93.8Very high92.1Very high47 Ų4752.4 Ų52.432%0.31829%0.294SS..Hα-helixtrans-59-44.4173.5-177.40000112.4K129 K130 S150 H156K129-C152 WeakPolarHBondContact O-CB 3.48Å; K130-C152 PolarHBondContact O-SG 2.89Å; S150-C152 PolarHBondContact O-N 3.11Å; C152-H156 VanDerWaalsContact O-CB 3.26Å; C152-H156 WeakPolarHBondContact O-CB 3.4Å; C152-H156 PolarHBondContact O-N 3.04Å
153S94.4Very high91.6Very high0 Ų050.6 Ų50.60%030%0.297CS..Hα-helixtrans-64-41.6176.9-58.90000112.1G133 S150 Q151 V157G133-S153 PolarHBondContact N-OG 3.41Å; S150-S153 WeakPolarHBondContact O-CA 3.36Å; S150-S153 WeakPolarHBondContact O-CB 3.46Å; S150-S153 PolarHBondContact O-N 3.42Å; S150-S153 PolarHBondContact OG-N 3.36Å; S150-S153 VanDerWaalsContact OG-N 3.15Å; S150-S153 PolarHBondContact OG-OG 3.12Å; Q151-S153 PolarHBondContact O-N 3.28Å; S153-V157 WeakPolarHBondContact O-CG2 3.44Å; S153-V157 PolarHBondContact O-N 3.09Å; S153-V157 VanDerWaalsContact O-N 3.17Å
154V95.1Very high90.9Very high37 Ų3755.3 Ų55.322%0.22432%0.316CS..Hα-helixtrans-65.7-50.7179176.60000110.4F15 P149 S150 Q151 H156 V157 E158F15-V154 HydrophobicContact CZ-CG2 4.27Å; P149-V154 HydrophobicContact CB-CG2 4Å; S150-V154 PolarHBondContact O-N 3.36Å; Q151-V154 PolarHBondContact O-N 3.17Å; V154-H156 VanDerWaalsContact C-N 3.29Å; V154-H156 PolarHBondContact O-N 3.39Å; V154-V157 PolarHBondContact O-N 3.25Å; V154-V157 VanDerWaalsContact O-N 3.09Å; V154-E158 HydrophobicContact CG1-CG 4.4Å; V154-E158 WeakPolarHBondContact CG1-OE1 3.38Å; V154-E158 WeakPolarHBondContact O-CG 3.49Å; V154-E158 PolarHBondContact O-N 3.35Å
155S93.5Very high89.7Confident51 Ų5158.9 Ų58.936%0.35733%0.333SS..Hα-helixtrans-63.1-33.9178.7-630000112.7Q151 E158 A159Q151-S155 PolarHBondContact NE2-OG 3.42Å; Q151-S155 WeakPolarHBondContact O-CB 3.47Å; Q151-S155 PolarHBondContact O-N 3.49Å; Q151-S155 PolarHBondContact O-OG 2.85Å; S155-E158 PolarHBondContact O-N 2.98Å; S155-A159 VanDerWaalsContact O-CB 3.29Å; S155-A159 WeakPolarHBondContact O-CB 3.31Å; S155-A159 PolarHBondContact O-N 3Å
156H91.8Very high88.5Confident57 Ų5760.8 Ų60.826%0.26435%0.345SS..Hα-helixtrans-61.6-45.4172.4178.582.1000111.8F20 P132 C152 V154 A159 V160 M165F20-H156 AromaticContact CE1-CD2 3.78Å; F20-H156 AromaticContact CZ-CD2 3.95Å; P132-H156 HydrophobicContact CB-CB 3.82Å; C152-H156 VanDerWaalsContact O-CB 3.26Å; C152-H156 WeakPolarHBondContact O-CB 3.4Å; C152-H156 PolarHBondContact O-N 3.04Å; V154-H156 VanDerWaalsContact C-N 3.29Å; V154-H156 PolarHBondContact O-N 3.39Å; H156-A159 PolarHBondContact O-N 3.48Å; H156-V160 WeakPolarHBondContact O-CB 3.26Å; H156-V160 VanDerWaalsContact O-CG2 3.26Å; H156-V160 WeakPolarHBondContact O-CG2 3.47Å; H156-V160 PolarHBondContact O-N 3.15Å; H156-M165 HydrophobicContact CB-CE 4.35Å; H156-M165 WeakPolarHBondContact ND1-CE 3.43Å
157V91.7Very high87.4Confident27 Ų2762.5 Ų62.516%0.16436%0.355CS..Hα-helixtrans-66.7-40.6178173.20000111.6F15 N19 F20 S153 V154 V160 A161F15-V157 HydrophobicContact CE2-CB 4.46Å; F15-V157 HydrophobicContact CE2-CG1 4.48Å; F15-V157 HydrophobicContact CE2-CG2 4.22Å; F15-V157 HydrophobicContact CZ-CB 4.36Å; F15-V157 HydrophobicContact CZ-CG2 3.79Å; N19-V157 HydrophobicContact CB-CG1 4.25Å; N19-V157 HydrophobicContact CB-CG2 3.54Å; N19-V157 WeakPolarHBondContact OD1-CG1 3.44Å; F20-V157 HydrophobicContact CE2-CG2 3.67Å; F20-V157 HydrophobicContact CZ-CG2 3.85Å; S153-V157 WeakPolarHBondContact O-CG2 3.44Å; S153-V157 PolarHBondContact O-N 3.09Å; S153-V157 VanDerWaalsContact O-N 3.17Å; V154-V157 PolarHBondContact O-N 3.25Å; V154-V157 VanDerWaalsContact O-N 3.09Å; V157-V160 PolarHBondContact O-N 3.29Å; V157-A161 WeakPolarHBondContact O-CB 3.23Å; V157-A161 PolarHBondContact O-N 3.08Å
158E91.3Very high86.2Confident102 Ų10265.7 Ų65.748%0.47738%0.378SS..Hα-helixtrans-62.5-46.7175.8-71.8169.8173.500111.5V154 S155 V160 A161 L162V154-E158 HydrophobicContact CG1-CG 4.4Å; V154-E158 WeakPolarHBondContact CG1-OE1 3.38Å; V154-E158 WeakPolarHBondContact O-CG 3.49Å; V154-E158 PolarHBondContact O-N 3.35Å; S155-E158 PolarHBondContact O-N 2.98Å; E158-V160 VanDerWaalsContact C-N 3.32Å; E158-V160 PolarHBondContact O-N 3.39Å; E158-A161 WeakPolarHBondContact O-CB 3.24Å; E158-A161 PolarHBondContact O-N 3.46Å; E158-A161 VanDerWaalsContact O-N 3.11Å; E158-L162 WeakPolarHBondContact O-CB 3.45Å; E158-L162 VanDerWaalsContact O-CG 3.31Å; E158-L162 WeakPolarHBondContact O-CG 3.47Å; E158-L162 PolarHBondContact O-N 3.35Å
159A89.1Confident85Confident15 Ų1562.5 Ų62.512%0.12438%0.376CS..Hα-helixtrans-63-37.2176.900000112.6S155 H156 G163 E164 M165S155-A159 VanDerWaalsContact O-CB 3.29Å; S155-A159 WeakPolarHBondContact O-CB 3.31Å; S155-A159 PolarHBondContact O-N 3Å; H156-A159 PolarHBondContact O-N 3.48Å; A159-G163 PolarHBondContact O-N 3.49Å; A159-E164 HydrophobicContact CB-CB 4.47Å; A159-E164 PolarHBondContact O-N 2.94Å; A159-M165 HydrophobicContact CB-CE 3.57Å; A159-M165 HydrophobicContact CB-CG 4.48Å; A159-M165 PolarHBondContact O-N 3.34Å
160V85.9Confident84Confident36 Ų3665.6 Ų65.622%0.21839%0.388CS..Hα-helixtrans-64.4-43.1171.7166.20000111.1H156 V157 E158 L162 G163 M165 T167H156-V160 WeakPolarHBondContact O-CB 3.26Å; H156-V160 VanDerWaalsContact O-CG2 3.26Å; H156-V160 WeakPolarHBondContact O-CG2 3.47Å; H156-V160 PolarHBondContact O-N 3.15Å; V157-V160 PolarHBondContact O-N 3.29Å; E158-V160 VanDerWaalsContact C-N 3.32Å; E158-V160 PolarHBondContact O-N 3.39Å; V160-L162 VanDerWaalsContact C-N 3.33Å; V160-L162 PolarHBondContact O-N 3.23Å; V160-G163 PolarHBondContact O-N 2.81Å; V160-G163 VanDerWaalsContact O-N 3.14Å; V160-M165 HydrophobicContact CG2-CB 3.93Å; V160-T167 HydrophobicContact CG1-CG2 3.32Å; V160-T167 HydrophobicContact CG2-CG2 4.49Å
161A84.8Confident83.1Confident86 Ų8668.9 Ų68.971%0.71140%0.402SS*.Hα-helixtrans-67-34.3178.900000112.7V157 E158 G163V157-A161 WeakPolarHBondContact O-CB 3.23Å; V157-A161 PolarHBondContact O-N 3.08Å; E158-A161 WeakPolarHBondContact O-CB 3.24Å; E158-A161 PolarHBondContact O-N 3.46Å; E158-A161 VanDerWaalsContact O-N 3.11Å; A161-G163 PolarHBondContact O-N 3.41Å
162L86.1Confident82.3Confident128 Ų12868.9 Ų68.967%0.6740%0.402SS*.THydrogen-bonded Turntrans-74.4-9.1174.1-71.3169.7000113.2E158 V160 E164E158-L162 WeakPolarHBondContact O-CB 3.45Å; E158-L162 VanDerWaalsContact O-CG 3.31Å; E158-L162 WeakPolarHBondContact O-CG 3.47Å; E158-L162 PolarHBondContact O-N 3.35Å; V160-L162 VanDerWaalsContact C-N 3.33Å; V160-L162 PolarHBondContact O-N 3.23Å; L162-E164 VanDerWaalsContact C-N 3.28Å; L162-E164 HydrophobicContact CB-CG 4.19Å; L162-E164 PolarHBondContact O-N 3.14Å
163G77.3Confident81.8Confident56 Ų5670 Ų7058%0.57741%0.411SS*.THydrogen-bonded Turntrans78.28.9-17900000114.4A159 V160 A161 M165A159-G163 PolarHBondContact O-N 3.49Å; V160-G163 PolarHBondContact O-N 2.81Å; V160-G163 VanDerWaalsContact O-N 3.14Å; A161-G163 PolarHBondContact O-N 3.41Å; G163-M165 VanDerWaalsContact C-N 3.29Å
164E75.6Confident81.1Confident150 Ų15072.9 Ų72.970%0.70143%0.426SS*.SBendtrans-72.7-26.1176.3-63.2-177.9165.400111.9A159 L162A159-E164 HydrophobicContact CB-CB 4.47Å; A159-E164 PolarHBondContact O-N 2.94Å; L162-E164 VanDerWaalsContact C-N 3.28Å; L162-E164 HydrophobicContact CB-CG 4.19Å; L162-E164 PolarHBondContact O-N 3.14Å
165M68.3Low80.5Confident74 Ų7474.5 Ų74.537%0.36543%0.433SS..SBendtrans-120.5133.1173.8-74.6-160.1-78.200111.6H156 A159 V160 G163H156-M165 HydrophobicContact CB-CE 4.35Å; H156-M165 WeakPolarHBondContact ND1-CE 3.43Å; A159-M165 HydrophobicContact CB-CE 3.57Å; A159-M165 HydrophobicContact CB-CG 4.48Å; A159-M165 PolarHBondContact O-N 3.34Å; V160-M165 HydrophobicContact CG2-CB 3.93Å; G163-M165 VanDerWaalsContact C-N 3.29Å
166V69.1Low80.1Confident70 Ų7075.2 Ų75.242%0.42444%0.438SS..  trans-82.4121.4177.2-173.30000108.8Q170 Q171 I174V166-Q170 HydrophobicContact CG1-CB 3.52Å; V166-Q171 HydrophobicContact CG1-CB 3.95Å; V166-Q171 VanDerWaalsContact CG1-N 3.34Å; V166-I174 HydrophobicContact CG1-CD1 3.65Å; V166-I174 HydrophobicContact CG2-CD1 4.3Å
167T73Confident79.6Confident36 Ų3677.1 Ų77.122%0.22145%0.45CS..  trans-62.9154171.9600000110.9V160 A169 Q170 Q171V160-T167 HydrophobicContact CG1-CG2 3.32Å; V160-T167 HydrophobicContact CG2-CG2 4.49Å; T167-A169 PolarHBondContact O-N 2.9Å; T167-A169 VanDerWaalsContact O-N 3.13Å; T167-Q170 PolarHBondContact O-N 3.13Å; T167-Q170 VanDerWaalsContact OG1-CB 3.29Å; T167-Q170 WeakPolarHBondContact OG1-CB 3.29Å; T167-Q170 WeakPolarHBondContact OG1-CG 3.37Å; T167-Q170 PolarHBondContact OG1-N 3.07Å; T167-Q170 VanDerWaalsContact OG1-N 3.13Å; T167-Q170 PolarHBondContact OG1-OE1 3.28Å; T167-Q171 WeakPolarHBondContact O-CB 3.5Å; T167-Q171 PolarHBondContact O-N 3.01Å
168P69.2Low79.2Confident109 Ų10980.3 Ų80.371%0.70846%0.461SS*.Hα-helixtrans-54.1-35.4175.8-27.334.9000113.5Q171 Q172P168-Q171 PolarHBondContact O-N 3.23Å; P168-Q172 WeakPolarHBondContact O-CG 3.14Å; P168-Q172 PolarHBondContact O-N 2.82Å; P168-Q172 VanDerWaalsContact O-N 3.07Å
169A70.6Confident78.9Confident62 Ų6282.5 Ų82.551%0.51247%0.472SS..Hα-helixtrans-68.2-46.6175.700000112.2T167 Q171 Q172 S173T167-A169 PolarHBondContact O-N 2.9Å; T167-A169 VanDerWaalsContact O-N 3.13Å; A169-Q171 VanDerWaalsContact C-N 3.26Å; A169-Q171 PolarHBondContact O-N 3.43Å; A169-Q172 WeakPolarHBondContact O-CB 3.49Å; A169-Q172 PolarHBondContact O-N 3.13Å; A169-S173 PolarHBondContact O-N 3.06Å; A169-S173 PolarHBondContact O-OG 3.48Å
170Q73.6Confident78.7Confident89 Ų8987.8 Ų87.842%0.41650%0.502SS..Hα-helixtrans-62.2-36173.9-73.4164.2-29.900111.4V166 T167 Q172 S173 I174V166-Q170 HydrophobicContact CG1-CB 3.52Å; T167-Q170 PolarHBondContact O-N 3.13Å; T167-Q170 VanDerWaalsContact OG1-CB 3.29Å; T167-Q170 WeakPolarHBondContact OG1-CB 3.29Å; T167-Q170 WeakPolarHBondContact OG1-CG 3.37Å; T167-Q170 PolarHBondContact OG1-N 3.07Å; T167-Q170 VanDerWaalsContact OG1-N 3.13Å; T167-Q170 PolarHBondContact OG1-OE1 3.28Å; Q170-Q172 VanDerWaalsContact C-N 3.33Å; Q170-Q172 PolarHBondContact O-N 2.79Å; Q170-S173 PolarHBondContact O-N 3.19Å; Q170-I174 WeakPolarHBondContact O-CB 3.21Å; Q170-I174 WeakPolarHBondContact O-CD1 3.37Å; Q170-I174 WeakPolarHBondContact O-CG1 3.22Å; Q170-I174 PolarHBondContact O-N 2.88Å
171Q76.6Confident78.5Confident81 Ų8192.3 Ų92.338%0.37952%0.521SS..Hα-helixtrans-63.2-41.6177-165.672.321.800110.9V166 T167 P168 A169 I174 N175V166-Q171 HydrophobicContact CG1-CB 3.95Å; V166-Q171 VanDerWaalsContact CG1-N 3.34Å; T167-Q171 WeakPolarHBondContact O-CB 3.5Å; T167-Q171 PolarHBondContact O-N 3.01Å; P168-Q171 PolarHBondContact O-N 3.23Å; A169-Q171 VanDerWaalsContact C-N 3.26Å; A169-Q171 PolarHBondContact O-N 3.43Å; Q171-I174 PolarHBondContact O-N 3.42Å; Q171-N175 WeakPolarHBondContact O-CB 3.4Å; Q171-N175 PolarHBondContact O-N 3.39Å; Q171-N175 PolarHBondContact O-ND2 3.44Å; Q171-N175 PolarHBondContact O-OD1 3.43Å
172Q78.7Confident78Confident133 Ų13391.2 Ų91.262%0.62152%0.518SS*.Hα-helixtrans-63.3-46.6174-72.1172.8-200111.4P168 A169 Q170 I174 N175 S176P168-Q172 WeakPolarHBondContact O-CG 3.14Å; P168-Q172 PolarHBondContact O-N 2.82Å; P168-Q172 VanDerWaalsContact O-N 3.07Å; A169-Q172 WeakPolarHBondContact O-CB 3.49Å; A169-Q172 PolarHBondContact O-N 3.13Å; Q170-Q172 VanDerWaalsContact C-N 3.33Å; Q170-Q172 PolarHBondContact O-N 2.79Å; Q172-I174 VanDerWaalsContact C-N 3.34Å; Q172-I174 PolarHBondContact O-N 3.44Å; Q172-N175 PolarHBondContact O-N 3.29Å; Q172-S176 PolarHBondContact O-N 2.91Å; Q172-S176 PolarHBondContact O-OG 3.42Å
173S81.8Confident77.2Confident71 Ų7190.2 Ų90.250%0.49751%0.512SS..Hα-helixtrans-60.2-43.2175.3-58.50000112.2A169 Q170 N175 S176 L177A169-S173 PolarHBondContact O-N 3.06Å; A169-S173 PolarHBondContact O-OG 3.48Å; Q170-S173 PolarHBondContact O-N 3.19Å; S173-N175 VanDerWaalsContact C-N 3.33Å; S173-N175 PolarHBondContact O-N 2.84Å; S173-S176 PolarHBondContact O-N 3.39Å; S173-L177 WeakPolarHBondContact O-CB 3.38Å; S173-L177 VanDerWaalsContact O-CG 3.22Å; S173-L177 WeakPolarHBondContact O-CG 3.44Å; S173-L177 PolarHBondContact O-N 2.88Å
174I80.9Confident76.2Confident60 Ų6090 Ų9031%0.30851%0.51SS..Hα-helixtrans-62-42.2175.8-73.4160.4000110.6V166 Q170 Q171 Q172 L177 K178V166-I174 HydrophobicContact CG1-CD1 3.65Å; V166-I174 HydrophobicContact CG2-CD1 4.3Å; Q170-I174 WeakPolarHBondContact O-CB 3.21Å; Q170-I174 WeakPolarHBondContact O-CD1 3.37Å; Q170-I174 WeakPolarHBondContact O-CG1 3.22Å; Q170-I174 PolarHBondContact O-N 2.88Å; Q171-I174 PolarHBondContact O-N 3.42Å; Q172-I174 VanDerWaalsContact C-N 3.34Å; Q172-I174 PolarHBondContact O-N 3.44Å; I174-L177 PolarHBondContact O-N 3.18Å; I174-K178 HydrophobicContact CG2-CD 4Å; I174-K178 HydrophobicContact CG2-CG 4.37Å; I174-K178 WeakPolarHBondContact O-CB 3.35Å; I174-K178 VanDerWaalsContact O-CG 3.25Å; I174-K178 WeakPolarHBondContact O-CG 3.39Å; I174-K178 PolarHBondContact O-N 3.08Å
175N81.9Confident75Confident71 Ų7189.2 Ų89.238%0.3851%0.506SS..Hα-helixtrans-65.2-45.9178.1-71.3-12.2000111.5Q171 Q172 S173 L177 K178 E179Q171-N175 WeakPolarHBondContact O-CB 3.4Å; Q171-N175 PolarHBondContact O-N 3.39Å; Q171-N175 PolarHBondContact O-ND2 3.44Å; Q171-N175 PolarHBondContact O-OD1 3.43Å; Q172-N175 PolarHBondContact O-N 3.29Å; S173-N175 VanDerWaalsContact C-N 3.33Å; S173-N175 PolarHBondContact O-N 2.84Å; N175-L177 VanDerWaalsContact C-N 3.33Å; N175-L177 PolarHBondContact O-N 3.4Å; N175-K178 PolarHBondContact O-N 3.46Å; N175-E179 WeakPolarHBondContact O-CG 3.25Å; N175-E179 PolarHBondContact O-N 3.21Å
176S84.5Confident74.3Confident67 Ų6794.2 Ų94.247%0.46953%0.534SS..Hα-helixtrans-60.8-41174.5-590000112.1Q172 S173 E179 V180Q172-S176 PolarHBondContact O-N 2.91Å; Q172-S176 PolarHBondContact O-OG 3.42Å; S173-S176 PolarHBondContact O-N 3.39Å; S176-E179 PolarHBondContact O-N 3.4Å; S176-V180 WeakPolarHBondContact O-CG2 3.34Å; S176-V180 PolarHBondContact O-N 2.89Å
177L81.8Confident73.6Confident97 Ų9793.7 Ų93.751%0.50854%0.543SS..Hα-helixtrans-65.8-39.3175.6-72.9170.1000112.1S173 I174 N175 E179 V180 Q181S173-L177 WeakPolarHBondContact O-CB 3.38Å; S173-L177 VanDerWaalsContact O-CG 3.22Å; S173-L177 WeakPolarHBondContact O-CG 3.44Å; S173-L177 PolarHBondContact O-N 2.88Å; I174-L177 PolarHBondContact O-N 3.18Å; N175-L177 VanDerWaalsContact C-N 3.33Å; N175-L177 PolarHBondContact O-N 3.4Å; L177-E179 VanDerWaalsContact C-N 3.32Å; L177-E179 PolarHBondContact O-N 2.95Å; L177-V180 PolarHBondContact O-N 3.48Å; L177-Q181 WeakPolarHBondContact O-CB 3.32Å; L177-Q181 WeakPolarHBondContact O-CG 3.32Å; L177-Q181 PolarHBondContact O-N 3.44Å
178K83.9Confident72.5Confident93 Ų9399 Ų9940%0.40457%0.565SS.*Hα-helixtrans-63.6-36.7174.4-77.7174.8177.8-179.80112.2I174 N175 G182 I183I174-K178 HydrophobicContact CG2-CD 4Å; I174-K178 HydrophobicContact CG2-CG 4.37Å; I174-K178 WeakPolarHBondContact O-CB 3.35Å; I174-K178 VanDerWaalsContact O-CG 3.25Å; I174-K178 WeakPolarHBondContact O-CG 3.39Å; I174-K178 PolarHBondContact O-N 3.08Å; N175-K178 PolarHBondContact O-N 3.46Å; K178-G182 PolarHBondContact O-N 3.49Å; K178-G182 VanDerWaalsContact O-N 3.08Å; K178-I183 PolarHBondContact O-N 3.12Å
179E84.4Confident71.6Confident148 Ų148104.1 Ų104.169%0.69257%0.57SS**Hα-helixtrans-66.6-47.7174.6-73.6173.5-178.200111.5N175 S176 L177 Q181 G182N175-E179 WeakPolarHBondContact O-CG 3.25Å; N175-E179 PolarHBondContact O-N 3.21Å; S176-E179 PolarHBondContact O-N 3.4Å; L177-E179 VanDerWaalsContact C-N 3.32Å; L177-E179 PolarHBondContact O-N 2.95Å; E179-Q181 VanDerWaalsContact C-N 3.34Å; E179-Q181 PolarHBondContact O-N 2.85Å; E179-G182 PolarHBondContact O-N 3.02Å; E179-G182 VanDerWaalsContact O-N 3.12Å
180V84.6Confident70.7Confident126 Ų126110.9 Ų110.976%0.76458%0.583SS**Hα-helixtrans-62.9-39.3177.8172.90000111.8S176 L177 G182S176-V180 WeakPolarHBondContact O-CG2 3.34Å; S176-V180 PolarHBondContact O-N 2.89Å; L177-V180 PolarHBondContact O-N 3.48Å; V180-G182 VanDerWaalsContact C-N 3.27Å; V180-G182 PolarHBondContact O-N 3.33Å
181Q82.8Confident69.4Low132 Ų132109.6 Ų109.662%0.61759%0.593SS**THydrogen-bonded Turntrans-81.7-2.6177.8-67.4-179.43.700113.4L177 E179 I183L177-Q181 WeakPolarHBondContact O-CB 3.32Å; L177-Q181 WeakPolarHBondContact O-CG 3.32Å; L177-Q181 PolarHBondContact O-N 3.44Å; E179-Q181 VanDerWaalsContact C-N 3.34Å; E179-Q181 PolarHBondContact O-N 2.85Å; Q181-I183 VanDerWaalsContact C-N 3.3Å; Q181-I183 HydrophobicContact CB-CD1 4Å; Q181-I183 HydrophobicContact CB-CG1 4.12Å; Q181-I183 PolarHBondContact O-N 3.4Å
182G72.9Confident68.2Low62 Ų62115.2 Ų115.264%0.63962%0.616SS**THydrogen-bonded Turntrans69.521.2178.700000115K178 E179 V180 G184K178-G182 PolarHBondContact O-N 3.49Å; K178-G182 VanDerWaalsContact O-N 3.08Å; E179-G182 PolarHBondContact O-N 3.02Å; E179-G182 VanDerWaalsContact O-N 3.12Å; V180-G182 VanDerWaalsContact C-N 3.27Å; V180-G182 PolarHBondContact O-N 3.33Å; G182-G184 VanDerWaalsContact C-N 3.35Å
183I69.1Low66.9Low108 Ų108118.6 Ų118.655%0.55463%0.629SS**  trans-90.51.5-177.1-59.7176.2000111.8K178 Q181K178-I183 PolarHBondContact O-N 3.12Å; Q181-I183 VanDerWaalsContact C-N 3.3Å; Q181-I183 HydrophobicContact CB-CD1 4Å; Q181-I183 HydrophobicContact CB-CG1 4.12Å; Q181-I183 PolarHBondContact O-N 3.4Å
184G56.8Low65.6Low51 Ų51126.4 Ų126.453%0.52665%0.648SS.*  trans-100.569.1178.700000114.5G182G182-G184 VanDerWaalsContact C-N 3.35Å
185Q50.5Low64.3Low133 Ų133133.2 Ų133.262%0.62168%0.675SS**  trans-165.855.9163.8-121.4175.862.100115.2G187Q185-G187 VanDerWaalsContact C-N 3.29Å; Q185-G187 PolarHBondContact O-N 3.28Å
186D53.3Low62.9Low180 Ų180141.3 Ų141.396%0.96370%0.7SS**  trans-91.668.8161.8-73.1-35000110.2
187G55.8Low61.5Low58 Ų58147.6 Ų147.660%0.59872%0.719SS**SBendtrans-157.588.8177.400000110Q185Q185-G187 VanDerWaalsContact C-N 3.29Å; Q185-G187 PolarHBondContact O-N 3.28Å
188E49.6Very low60.2Low147 Ų147150.8 Ų150.869%0.68774%0.735SS**  trans5770.4172.1-65.9-165.6119.900118.1R190E188-R190 PolarHBondContact O-N 3.21Å; E188-R190 WeakPolarHBondContact OE1-CD 3.45Å; E188-R190 IonicContact OE1-CZ 3.6Å; E188-R190 IonicContact OE1-NE 3.51Å; E188-R190 IonicContact OE1-NH1 3.59Å
189R50.1Low58.6Low217 Ų217151.3 Ų151.382%0.81975%0.75SS**  trans-82.566.1137.8-70.5-173.6-175.9-177.42.8109.5G191R189-G191 PolarHBondContact O-N 2.83Å
190R50.6Low57.5Low205 Ų205150.9 Ų150.977%0.77475%0.752SS**  trans-64.289.5153.3-85179.7172.1174.4-1.3105.8E188 K192E188-R190 PolarHBondContact O-N 3.21Å; E188-R190 WeakPolarHBondContact OE1-CD 3.45Å; E188-R190 IonicContact OE1-CZ 3.6Å; E188-R190 IonicContact OE1-NE 3.51Å; E188-R190 IonicContact OE1-NH1 3.59Å; R190-K192 PolarHBondContact O-N 2.92Å
191G47.8Very low56.3Low62 Ų62150.2 Ų150.264%0.63975%0.751SS**  trans-48.1115167.800000106.8R189 K193R189-G191 PolarHBondContact O-N 2.83Å; G191-K193 PolarHBondContact O-N 2.79Å
192K51Low55.2Low199 Ų199149.1 Ų149.187%0.86575%0.749SS**  trans-49.8107.2174.3-81.5178177.41740105.7R190 R194R190-K192 PolarHBondContact O-N 2.92Å; K192-R194 VanDerWaalsContact C-N 3.31Å; K192-R194 PolarHBondContact O-N 2.79Å
193K51.4Low54.5Low203 Ų203151.9 Ų151.988%0.88376%0.756SS**  trans-56.8104.5171.5-75.8-176.7179.5177.60104.9G191 K195G191-K193 PolarHBondContact O-N 2.79Å; K193-K195 PolarHBondContact O-N 3Å
194R53.7Low54Low236 Ų236153.4 Ų153.489%0.89177%0.765SS**PPolyproline II helixtrans-52.2117.7172.5-81.3-179.8163.9-178.8-4.3105.6K192 R196K192-R194 VanDerWaalsContact C-N 3.31Å; K192-R194 PolarHBondContact O-N 2.79Å; R194-R196 PolarHBondContact O-N 3Å
195K53.9Low53.9Low203 Ų203155.7 Ų155.788%0.88377%0.773SS**PPolyproline II helixtrans-51.5117.2170.2-76.3-175.1176.6-178.60106K193 K197K193-K195 PolarHBondContact O-N 3Å; K195-K197 PolarHBondContact O-N 3.37Å; K195-K197 VanDerWaalsContact O-N 3.08Å
196R52.9Low54.3Low240 Ų240155 Ų15591%0.90678%0.781SS**PPolyproline II helixtrans-58118.1173.6-76.6-179.6174.7173.4-2106.1R194 I198R194-R196 PolarHBondContact O-N 3Å; R196-I198 PolarHBondContact O-N 3.08Å
197K54.1Low54.8Low199 Ų199154.1 Ų154.187%0.86578%0.775SS**PPolyproline II helixtrans-56.5132.5165.8-69.5-176.1178.2-175.60106.4K195 S199K195-K197 PolarHBondContact O-N 3.37Å; K195-K197 VanDerWaalsContact O-N 3.08Å; K197-S199 PolarHBondContact O-N 2.93Å
198I55.3Low55.1Low165 Ų165161 Ų16185%0.84679%0.789SS**  trans-58.4107.6173-66.4162.3000105.8R196 N200R196-I198 PolarHBondContact O-N 3.08Å; I198-N200 PolarHBondContact O-N 3.4Å
199S50.2Low55.4Low103 Ų103163.9 Ų163.972%0.7280%0.799SS**PPolyproline II helixtrans-69.9123.6173.2-177.60000106.7K197K197-S199 PolarHBondContact O-N 2.93Å
200N61.2Low55.6Low139 Ų139163.1 Ų163.174%0.74380%0.802SS**PPolyproline II helixtrans-54.3141.7158.7-72.5-43000108.3I198 N202I198-N200 PolarHBondContact O-N 3.4Å; N200-N202 PolarHBondContact O-N 3.43Å
201P58.8Low55.2Low113 Ų113163.4 Ų163.473%0.73481%0.808SS**PPolyproline II helixtrans-60.5139.2-175.522.6-31.8000111.1
202N61Low54.8Low108 Ų108170.3 Ų170.358%0.57882%0.821SS**PPolyproline II helixtrans-58.9125.7178.6178.8-4.5000110.2N200 L204 S205N200-N202 PolarHBondContact O-N 3.43Å; N202-L204 PolarHBondContact O-N 2.97Å; N202-L204 PolarHBondContact OD1-N 3.47Å; N202-S205 WeakPolarHBondContact O-CB 3.43Å; N202-S205 PolarHBondContact O-N 3.14Å; N202-S205 VanDerWaalsContact O-N 3.14Å
203P57.3Low54.3Low121 Ų121169.7 Ų169.779%0.78682%0.821SS**THydrogen-bonded Turntrans-64.8-5.2-172.124.9-35.4000115.7
204L59.1Low53.8Low140 Ų140165.5 Ų165.573%0.73382%0.815SS**THydrogen-bonded Turntrans-89.21.4174.7-74.3161000114.2N202 C206N202-L204 PolarHBondContact O-N 2.97Å; N202-L204 PolarHBondContact OD1-N 3.47Å; L204-C206 PolarHBondContact O-N 3.12Å; L204-C206 VanDerWaalsContact O-N 3.12Å
205S54.5Low53.4Low99 Ų99160.3 Ų160.369%0.69281%0.812SS**  trans-78.719.8-178.5-174.30000115.1N202N202-S205 WeakPolarHBondContact O-CB 3.43Å; N202-S205 PolarHBondContact O-N 3.14Å; N202-S205 VanDerWaalsContact O-N 3.14Å
206C59.6Low52.5Low117 Ų117157.6 Ų157.679%0.79181%0.812SS**  trans-118.145.2-177.3-72.20000113.3L204L204-C206 PolarHBondContact O-N 3.12Å; L204-C206 VanDerWaalsContact O-N 3.12Å
207L62.9Low51.9Low163 Ų163155.1 Ų155.185%0.85381%0.811SS**PPolyproline II helixtrans-102116.7168.9-72171.1000111.2
208K61.9Low51.4Low203 Ų203151.2 Ų151.288%0.88381%0.806SS**PPolyproline II helixtrans-63.8142.2-177.6-71.6176.2178.91750111.8K210K208-K210 PolarHBondContact O-N 3.35Å
209K55.6Low50.3Low207 Ų207152.1 Ų152.190%0.981%0.811SS**PPolyproline II helixtrans-60.9118.8177.1-162.3176.5-172.91780110.9
210K53.9Low49.5Very low200 Ų200156.6 Ų156.687%0.8782%0.818SS**PPolyproline II helixtrans-72.7134169.1-75.7-174.1177.1-178.20110.3K208K208-K210 PolarHBondContact O-N 3.35Å
211K42.8Very low48Very low211 Ų211156.4 Ų156.492%0.91782%0.822SS**PPolyproline II helixtrans-68.1139.4177.7-83.5179.4173.4178.30111.2
212K40.2Very low46.8Very low208 Ų208157.9 Ų157.990%0.90482%0.819SS**PPolyproline II helixtrans-82.5141.3167.3-76.9-177.2173.9-176.90110.3
213Q39.5Very low45.4Very low185 Ų185160.7 Ų160.786%0.86483%0.826SS**PPolyproline II helixtrans-90.4156.7163.2-78.7-171.5-11.200111.1
214P42Very low44.2Very low116 Ų116164.8 Ų164.875%0.75383%0.832SS**PPolyproline II helixtrans-84.4169.9-172.826.1-15.5000113.5
215P45.6Very low43Very low127 Ų127167.9 Ų167.983%0.82584%0.839SS**PPolyproline II helixtrans-90.9154.4-158.435.9-32.2000113.3
216T33.6Very low42.1Very low145 Ų145175.5 Ų175.589%0.8985%0.853SS**  trans-123.6143.7166-26.40000110.2
217Q40.6Very low40.9Very low188 Ų188176.8 Ų176.888%0.87985%0.852SS**  trans-76.5170-161.7-73.6-176.116.900115.5
218P43.7Very low39.5Very low118 Ų118178.5 Ų178.577%0.76685%0.847SS**  trans-99.9157.2-161.237.4-30.3000114.5
219L32.6Very low38.3Very low183 Ų183176.7 Ų176.796%0.95884%0.841SS**  trans-119.7138.7164.6-96.5149.2000111
220K33.9Very low37.4Very low197 Ų197178.1 Ų178.186%0.85784%0.841SS**  trans-81.9154.7-168.2-63.6170.3176.71730113.1
221T30Very low36.4Very low135 Ų135178.7 Ų178.783%0.82884%0.844SS**  trans-176.3105134.921.50000107.8
222E32.5Very low36.1Very low145 Ų145180 Ų18068%0.67884%0.843SS**  91.6107.693.6-82.1-117.8138.100115.1
223K31.6Very low35.8Very low167 Ų167176.8 Ų176.873%0.72684%0.841SS**  trans62.2128.7142.1-61.1173.3-175.6143.90118.3
224K31.7Very low35.8Very low207 Ų207177.8 Ų177.890%0.984%0.842SS**  -159.9140.859.2-117.7170.1-175.8173.20112
225K34.2Very low35.9Very low204 Ų204177.9 Ų177.989%0.88784%0.843SS**  trans-66.8141.8171-76.1171.9172.1173.10111.8
226R35Very low35.5Very low259 Ų259181.6 Ų181.698%0.97785%0.849SS**  trans-129.8139.5141.7-97.3-175.6173.4-179.4-2110.4
227N34.7Very low35.4Very low144 Ų144178.4 Ų178.477%0.7785%0.845SS**  trans-98160.6-154.9-1597.5000111.4
228R34.9Very low35Very low199 Ų199173.1 Ų173.175%0.75184%0.841SS**  trans-6.5150.7152.5-80.8173.5162.7178-4.3117
229Q35.5Very low34.6Very low165 Ų165177.3 Ų177.377%0.77185%0.851SS**  cis-179158.641.3-131.7157.2-1.400110.2
230R36.7Very low34.8Very low237 Ų237171.5 Ų171.589%0.89484%0.835SS**  trans-77.4141.8163.6-76.5173.2165.4174-5.4111.5
231K33.1Very low35.3Very low212 Ų212168.8 Ų168.892%0.92284%0.838SS**  173.7158.4117.2-103.6-179.6176.3179.70114.1
232R36.7Very low35.6Very low240 Ų240168 Ų16891%0.90684%0.838SS**  trans-68.3155.2-172.9-70.2167.7157.2169.7-8116.6
233T34.3Very low36.1Very low139 Ų139169.3 Ų169.385%0.85385%0.848SS**  trans-159110142.336.80000107.9
234K39.4Very low36.6Very low207 Ų207171 Ų17190%0.986%0.856SS**  69.214993.5-88.5-158.3179.7-175.60117
235P43.4Very low37.4Very low118 Ų118166.9 Ų166.977%0.76685%0.85SS**  trans-107.2158.9-152.340-30.7000115.3
236E37.1Very low38Very low204 Ų204164.8 Ų164.895%0.95385%0.848SS**  trans-128.7145.5161.4-63.9-174.9142.500106
237G32.9Very low39.1Very low78 Ų78158.1 Ų158.180%0.80484%0.838SS**  cis142.3123.811.300000108.5
238G32Very low39.5Very low78 Ų78158.1 Ų158.180%0.80484%0.838SS**  trans76.3143.3162.300000117.8
239E35.1Very low40.7Very low205 Ų205157.9 Ų157.996%0.95886%0.863SS**  cis-153151.45.2-75.1179123.400108.9
240G35.7Very low40.9Very low62 Ų62157.6 Ų157.664%0.63987%0.867SS**  trans-130145.6167.700000110.1
241P43.9Very low41.2Very low140 Ų140153.4 Ų153.491%0.90987%0.866SS**PPolyproline II helixtrans-81.5133.7-18030.7-30.4000111.4
242S36.9Very low41.6Very low118 Ų118150.1 Ų150.183%0.82586%0.863SS**PPolyproline II helixtrans-97.3135.9176.7-66.50000111.5
243L42.4Very low41.9Very low172 Ų172144.8 Ų144.890%0.90186%0.86SS**PPolyproline II helixtrans-68142.8163.8-79.1151.3000111.4
244K43.6Very low42.4Very low202 Ų202145.2 Ų145.288%0.87886%0.861SS**  trans-144.5156.2154.7-80.3-162.6-177.7178.70112.3
245P48.7Very low42.6Very low121 Ų121141.1 Ų141.179%0.78686%0.858SS**  trans-105.7172-155.635-21.6000115.1
246L45.9Very low42.5Very low160 Ų160142.7 Ų142.784%0.83887%0.865SS**  trans-58.1159.7176.5-71.2160.5000114.8
247P57.8Low42.9Very low120 Ų120138 Ų13878%0.77986%0.858SS**  trans-136.7145.413234.8-20000114.6
248N44.3Very low43.8Very low143 Ų143143 Ų14377%0.76586%0.862SS**  trans-77.9162.8162.7-79.4-3.4000110.4
249P58.6Low44.8Very low195 Ų195148.9 Ų148.9100%1.26687%0.868SS**  -112.9086.832.8-33.8000114.8

Retrieved 249 of 249 residues in 1246.1 ms (Link to these results)

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