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Translation initiation factor eIF2 assembly protein

ATP-dependent protein-folding chaperone for the eIF2 complex. Binds to the gamma subunit of the eIF2 complex which allows the subunit to assemble with the alpha and beta subunits.

AlphaFold DB , UniProt , Accession X6RKY7, Species HUMAN (Homo sapiens, Human), Gene CDC123, Length 157 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
1M85.7Confident94.6Very high126 Ų12677.4 Ų77.462%0.62138%0.378SS*.  0156.70-174.4173.5-7800107.7H5 V6 H150 C151 T152M1-H5 HydrophobicContact CG-CB 4.13Å; M1-V6 HydrophobicContact CG-CG2 4.12Å; M1-V6 HydrophobicContact SD-CG2 3.42Å; M1-V6 WeakPolarHBondContact SD-CG2 3.36Å; M1-H150 WeakPolarHBondContact CB-O 3.34Å; M1-H150 PolarHBondContact N-O 2.76Å; M1-H150 VanDerWaalsContact N-O 3.11Å; M1-C151 CarbonylContact O-C 3.53Å; M1-C151 WeakPolarHBondContact O-CA 3.48Å; M1-T152 PolarHBondContact O-N 2.97Å; M1-T152 PolarHBondContact O-OG1 2.84Å; M1-T152 VanDerWaalsContact O-OG1 3.13Å
2K93.4Very high94.8Very high113 Ų11375 Ų7549%0.49138%0.375SS..  trans-95.8147.7170.5-68.9-172.1176.2-175.10110E4 H5 V6 D153K2-E4 PolarHBondContact O-N 3.21Å; K2-H5 WeakPolarHBondContact O-CB 3.47Å; K2-H5 PolarHBondContact O-N 3.17Å; K2-V6 PolarHBondContact O-N 3.34Å; K2-D153 VanDerWaalsContact CA-OD1 3.29Å; K2-D153 WeakPolarHBondContact CA-OD1 3.44Å
3K93.3Very high95Very high63 Ų6371.7 Ų71.727%0.27437%0.367SS..Hα-helixtrans-51.7-44.1175.1-78.7-178.2174.9174.20111.9H5 V6 L7 F148 C151 D153 D154K3-H5 PolarHBondContact O-N 3.33Å; K3-V6 WeakPolarHBondContact O-CB 3.35Å; K3-V6 PolarHBondContact O-N 2.74Å; K3-L7 WeakPolarHBondContact O-CG 3.35Å; K3-L7 PolarHBondContact O-N 3.23Å; K3-F148 HydrophobicContact CB-CD1 4.38Å; K3-F148 HydrophobicContact CG-CB 4.5Å; K3-F148 HydrophobicContact CG-CD1 4.11Å; K3-F148 HydrophobicContact CG-CG 4.34Å; K3-C151 HydrophobicContact CG-CB 3.93Å; K3-D153 WeakPolarHBondContact CE-O 2.83Å; K3-D153 VanDerWaalsContact N-CG 3.32Å; K3-D153 PolarHBondContact N-OD1 3.07Å; K3-D153 PolarHBondContact N-OD2 3.14Å; K3-D153 PolarHBondContact NZ-O 2.75Å; K3-D154 HydrophobicContact CD-CB 4.49Å; K3-D154 WeakPolarHBondContact CE-OD1 3.49Å; K3-D154 HydrophobicContact CG-CB 4.46Å; K3-D154 IonicContact NZ-OD1 2.66Å; K3-D154 PolarHBondContact NZ-OD1 2.78Å
4E95.1Very high95.2Very high107 Ų10771.4 Ų71.450%0.536%0.359SS..Hα-helixtrans-55.7-38177.7-174.8180-176.400112.6K2 V6 L7 H8K2-E4 PolarHBondContact O-N 3.21Å; E4-V6 VanDerWaalsContact C-N 3.33Å; E4-V6 PolarHBondContact O-N 3.19Å; E4-L7 PolarHBondContact O-N 3.09Å; E4-H8 VanDerWaalsContact CG-CE1 3.49Å; E4-H8 WeakPolarHBondContact CG-CE1 3.45Å; E4-H8 PolarHBondContact O-N 3.44Å; E4-H8 PolarHBondContact O-ND1 2.93Å; E4-H8 IonicContact OE1-CE1 3.38Å; E4-H8 PolarHBondContact OE1-CE1 2.88Å
5H94.7Very high95.4Very high99 Ų9967.6 Ų67.646%0.45834%0.339SS..Hα-helixtrans-65.7-37.8177.5-57.6170.5000111.6M1 K2 K3 C9M1-H5 HydrophobicContact CG-CB 4.13Å; K2-H5 WeakPolarHBondContact O-CB 3.47Å; K2-H5 PolarHBondContact O-N 3.17Å; K3-H5 PolarHBondContact O-N 3.33Å; H5-C9 PolarHBondContact O-N 3.36Å; H5-C9 PolarHBondContact O-SG 3.18Å; H5-C9 VanDerWaalsContact O-SG 3.35Å
6V95.5Very high95.5Very high14 Ų1468.6 Ų68.69%0.08535%0.352CS..Hα-helixtrans-67.6-41.5175.5178.10000110.6M1 K2 K3 E4 C9 Q10 W107 F148 C151M1-V6 HydrophobicContact CG-CG2 4.12Å; M1-V6 HydrophobicContact SD-CG2 3.42Å; M1-V6 WeakPolarHBondContact SD-CG2 3.36Å; K2-V6 PolarHBondContact O-N 3.34Å; K3-V6 WeakPolarHBondContact O-CB 3.35Å; K3-V6 PolarHBondContact O-N 2.74Å; E4-V6 VanDerWaalsContact C-N 3.33Å; E4-V6 PolarHBondContact O-N 3.19Å; V6-C9 WeakPolarHBondContact O-CB 3.23Å; V6-C9 PolarHBondContact O-N 3.44Å; V6-C9 VanDerWaalsContact O-N 3.13Å; V6-Q10 PolarHBondContact O-N 2.96Å; V6-W107 HydrophobicContact CG1-CZ2 3.81Å; V6-W107 PolarHBondContact O-NE1 2.78Å; V6-F148 HydrophobicContact CB-CD1 3.79Å; V6-F148 HydrophobicContact CB-CE1 3.75Å; V6-F148 HydrophobicContact CG1-CD1 3.74Å; V6-F148 HydrophobicContact CG1-CE1 3.58Å; V6-F148 HydrophobicContact CG2-CD1 4.18Å; V6-C151 VanDerWaalsContact CG2-SG 3.54Å
7L95.9Very high95.6Very high74 Ų7474.4 Ų74.439%0.38737%0.374SS..Hα-helixtrans-62.2-42.7177.6-67.6176.2000112.2K3 E4 C9 Q10 F148K3-L7 WeakPolarHBondContact O-CG 3.35Å; K3-L7 PolarHBondContact O-N 3.23Å; E4-L7 PolarHBondContact O-N 3.09Å; L7-C9 PolarHBondContact O-N 3.44Å; L7-Q10 VanDerWaalsContact O-CB 3.3Å; L7-Q10 WeakPolarHBondContact O-CB 3.4Å; L7-Q10 VanDerWaalsContact O-CG 3.29Å; L7-Q10 WeakPolarHBondContact O-CG 3.45Å; L7-Q10 PolarHBondContact O-N 3.02Å; L7-Q10 VanDerWaalsContact O-N 3.07Å; L7-F148 HydrophobicContact CD2-CE1 3.99Å; L7-F148 HydrophobicContact CD2-CZ 3.72Å; L7-F148 HydrophobicContact CG-CE1 4.14Å; L7-F148 HydrophobicContact CG-CZ 4.32Å
8H96.4Very high95.7Very high113 Ų11376.6 Ų76.652%0.52338%0.381SS..Hα-helixtrans-64.4-23.4175.3-70.3152.2000113.7E4 Q10E4-H8 VanDerWaalsContact CG-CE1 3.49Å; E4-H8 WeakPolarHBondContact CG-CE1 3.45Å; E4-H8 PolarHBondContact O-N 3.44Å; E4-H8 PolarHBondContact O-ND1 2.93Å; E4-H8 IonicContact OE1-CE1 3.38Å; E4-H8 PolarHBondContact OE1-CE1 2.88Å; H8-Q10 VanDerWaalsContact C-N 3.32Å
9C95.9Very high95.7Very high78 Ų7881.2 Ų81.253%0.52739%0.393SS..THydrogen-bonded Turntrans-84-2.4175.5-71.30000113.8H5 V6 L7 W14H5-C9 PolarHBondContact O-N 3.36Å; H5-C9 PolarHBondContact O-SG 3.18Å; H5-C9 VanDerWaalsContact O-SG 3.35Å; V6-C9 WeakPolarHBondContact O-CB 3.23Å; V6-C9 PolarHBondContact O-N 3.44Å; V6-C9 VanDerWaalsContact O-N 3.13Å; L7-C9 PolarHBondContact O-N 3.44Å; C9-W14 PolarHBondContact O-NE1 3.24Å
10Q97.3Very high95.8Very high41 Ų4181.2 Ų81.219%0.19242%0.416CS..SBendtrans-62.3138.3173.3-68.8-176.2-7.100110.7V6 L7 H8 S12 A13 W14 N106 W107V6-Q10 PolarHBondContact O-N 2.96Å; L7-Q10 VanDerWaalsContact O-CB 3.3Å; L7-Q10 WeakPolarHBondContact O-CB 3.4Å; L7-Q10 VanDerWaalsContact O-CG 3.29Å; L7-Q10 WeakPolarHBondContact O-CG 3.45Å; L7-Q10 PolarHBondContact O-N 3.02Å; L7-Q10 VanDerWaalsContact O-N 3.07Å; H8-Q10 VanDerWaalsContact C-N 3.32Å; Q10-S12 PolarHBondContact O-N 3.23Å; Q10-A13 HydrophobicContact CB-CB 4.13Å; Q10-A13 WeakPolarHBondContact O-CA 3.2Å; Q10-A13 WeakPolarHBondContact O-CB 3.5Å; Q10-A13 PolarHBondContact O-N 3.34Å; Q10-W14 PolarHBondContact O-N 2.9Å; Q10-N106 HydrophobicContact CB-CB 4.4Å; Q10-N106 HydrophobicContact CG-CB 4.13Å; Q10-W107 HydrophobicContact CG-CH2 4.34Å; Q10-W107 HydrophobicContact CG-CZ2 3.44Å; Q10-W107 VanDerWaalsContact CG-CZ2 3.44Å
11F97.6Very high95.9Very high23 Ų2383.2 Ų83.210%0.10143%0.432CS..Hα-helixtrans-52.6-42.4177.7-168.9-87000112.4A13 W14 Y15 S25 I27 K104 N106F11-A13 VanDerWaalsContact C-N 3.28Å; F11-A13 PolarHBondContact O-N 3.48Å; F11-W14 AromaticContact CD2-CE2 3.97Å; F11-W14 AromaticContact CD2-CH2 3.6Å; F11-W14 HydrophobicContact CD2-CH2 3.6Å; F11-W14 AromaticContact CD2-CZ2 3.22Å; F11-W14 HydrophobicContact CD2-CZ2 3.22Å; F11-W14 AromaticContact CE2-CH2 3.34Å; F11-W14 HydrophobicContact CE2-CH2 3.34Å; F11-W14 AromaticContact CE2-CZ2 3.52Å; F11-W14 HydrophobicContact CE2-CZ2 3.52Å; F11-W14 HydrophobicContact CE2-CZ3 4.27Å; F11-W14 HydrophobicContact CG-CZ2 4.11Å; F11-W14 HydrophobicContact CZ-CH2 4.17Å; F11-Y15 HydrophobicContact CD1-CG 4.28Å; F11-Y15 HydrophobicContact CE1-CD1 4.02Å; F11-Y15 AromaticContact CE1-CD2 3.71Å; F11-Y15 HydrophobicContact CE1-CD2 3.71Å; F11-Y15 HydrophobicContact CE1-CE2 4.38Å; F11-Y15 AromaticContact CE1-CG 3.51Å; F11-Y15 HydrophobicContact CE1-CG 3.51Å; F11-Y15 HydrophobicContact CE2-CD2 4.37Å; F11-Y15 AromaticContact CZ-CD2 3.46Å; F11-Y15 HydrophobicContact CZ-CD2 3.46Å; F11-Y15 VanDerWaalsContact CZ-CD2 3.46Å; F11-Y15 HydrophobicContact CZ-CE2 4.07Å; F11-Y15 AromaticContact CZ-CG 3.78Å; F11-Y15 HydrophobicContact CZ-CG 3.78Å; F11-Y15 WeakPolarHBondContact O-CB 3.16Å; F11-Y15 PolarHBondContact O-N 3.23Å; F11-S25 VanDerWaalsContact CZ-CB 3.45Å; F11-S25 WeakPolarHBondContact CZ-OG 3.46Å; F11-I27 HydrophobicContact CD1-CD1 3.85Å; F11-I27 HydrophobicContact CD1-CG1 3.71Å; F11-I27 HydrophobicContact CE1-CD1 4.02Å; F11-I27 HydrophobicContact CE1-CG1 3.76Å; F11-K104 HydrophobicContact CD2-CD 3.87Å; F11-K104 HydrophobicContact CE2-CD 4.3Å; F11-N106 PolarHBondContact N-O 3.49Å
12S97.1Very high96.4Very high49 Ų4979.6 Ų79.634%0.34342%0.417SS..Hα-helixtrans-64-29.3175.950.80000114.1Q10 P16Q10-S12 PolarHBondContact O-N 3.23Å; S12-P16 VanDerWaalsContact O-CD 3.29Å; S12-P16 WeakPolarHBondContact O-CD 3.29Å
13A97.6Very high96.5Very high32 Ų3279.4 Ų79.426%0.26442%0.42SS..Hα-helixtrans-75-47.917900000111.3Q10 F11 F17Q10-A13 HydrophobicContact CB-CB 4.13Å; Q10-A13 WeakPolarHBondContact O-CA 3.2Å; Q10-A13 WeakPolarHBondContact O-CB 3.5Å; Q10-A13 PolarHBondContact O-N 3.34Å; F11-A13 VanDerWaalsContact C-N 3.28Å; F11-A13 PolarHBondContact O-N 3.48Å; A13-F17 WeakPolarHBondContact O-CD2 3Å; A13-F17 WeakPolarHBondContact O-CE2 3.45Å
14W97.6Very high96.7Very high67 Ų6783 Ų8325%0.25444%0.436SS..Hα-helixtrans-92.9-27.9-173.565.3-105.9000114.5C9 Q10 F11 P16 F17 F18 T22C9-W14 PolarHBondContact O-NE1 3.24Å; Q10-W14 PolarHBondContact O-N 2.9Å; F11-W14 AromaticContact CD2-CE2 3.97Å; F11-W14 AromaticContact CD2-CH2 3.6Å; F11-W14 HydrophobicContact CD2-CH2 3.6Å; F11-W14 AromaticContact CD2-CZ2 3.22Å; F11-W14 HydrophobicContact CD2-CZ2 3.22Å; F11-W14 AromaticContact CE2-CH2 3.34Å; F11-W14 HydrophobicContact CE2-CH2 3.34Å; F11-W14 AromaticContact CE2-CZ2 3.52Å; F11-W14 HydrophobicContact CE2-CZ2 3.52Å; F11-W14 HydrophobicContact CE2-CZ3 4.27Å; F11-W14 HydrophobicContact CG-CZ2 4.11Å; F11-W14 HydrophobicContact CZ-CH2 4.17Å; W14-P16 VanDerWaalsContact C-CD 3.49Å; W14-F17 PolarHBondContact O-N 3.08Å; W14-F17 VanDerWaalsContact O-N 3.1Å; W14-F18 HydrophobicContact CB-CD2 4.05Å; W14-F18 HydrophobicContact CB-CE2 4.23Å; W14-F18 HydrophobicContact CE3-CB 4.3Å; W14-F18 HydrophobicContact CE3-CD2 4.19Å; W14-F18 VanDerWaalsContact O-CD2 3.29Å; W14-F18 WeakPolarHBondContact O-CD2 3.01Å; W14-F18 PolarHBondContact O-N 3.48Å; W14-T22 HydrophobicContact CZ3-CG2 4.15Å
15Y97.9Very high96.8Very high15 Ų1579 Ų796%0.05942%0.42CS..Hα-helixtrans-57.4-41.3-174.4176.4-106.8000114.3F11 F17 F18 R19 T22 S25 I27F11-Y15 HydrophobicContact CD1-CG 4.28Å; F11-Y15 HydrophobicContact CE1-CD1 4.02Å; F11-Y15 AromaticContact CE1-CD2 3.71Å; F11-Y15 HydrophobicContact CE1-CD2 3.71Å; F11-Y15 HydrophobicContact CE1-CE2 4.38Å; F11-Y15 AromaticContact CE1-CG 3.51Å; F11-Y15 HydrophobicContact CE1-CG 3.51Å; F11-Y15 HydrophobicContact CE2-CD2 4.37Å; F11-Y15 AromaticContact CZ-CD2 3.46Å; F11-Y15 HydrophobicContact CZ-CD2 3.46Å; F11-Y15 VanDerWaalsContact CZ-CD2 3.46Å; F11-Y15 HydrophobicContact CZ-CE2 4.07Å; F11-Y15 AromaticContact CZ-CG 3.78Å; F11-Y15 HydrophobicContact CZ-CG 3.78Å; F11-Y15 WeakPolarHBondContact O-CB 3.16Å; F11-Y15 PolarHBondContact O-N 3.23Å; Y15-F17 PolarHBondContact O-N 2.94Å; Y15-F18 PolarHBondContact O-N 3.23Å; Y15-R19 HydrophobicContact CE1-CG 4.43Å; Y15-R19 HydrophobicContact CE2-CG 4.34Å; Y15-R19 WeakPolarHBondContact O-CA 3.38Å; Y15-R19 PolarHBondContact O-N 3.29Å; Y15-T22 HydrophobicContact CD2-CG2 3.61Å; Y15-T22 HydrophobicContact CE2-CG2 3.6Å; Y15-S25 PolarHBondContact OH-N 2.73Å; Y15-S25 PolarHBondContact OH-O 2.9Å; Y15-I27 HydrophobicContact CD1-CD1 3.79Å; Y15-I27 HydrophobicContact CD1-CG1 4.47Å; Y15-I27 HydrophobicContact CG-CD1 4.4Å
16P97.1Very high97Very high84 Ų8477.5 Ų77.555%0.54542%0.417SS..Hα-helixtrans-57.8-35177.1-26.136.2000113.7S12 W14S12-P16 VanDerWaalsContact O-CD 3.29Å; S12-P16 WeakPolarHBondContact O-CD 3.29Å; W14-P16 VanDerWaalsContact C-CD 3.49Å
17F97.5Very high97.1Very high167 Ų16780.4 Ų80.473%0.73243%0.431SS*.Hα-helixtrans-78.4-34.9-178.6-59.1-75.7000112.7A13 W14 Y15A13-F17 WeakPolarHBondContact O-CD2 3Å; A13-F17 WeakPolarHBondContact O-CE2 3.45Å; W14-F17 PolarHBondContact O-N 3.08Å; W14-F17 VanDerWaalsContact O-N 3.1Å; Y15-F17 PolarHBondContact O-N 2.94Å
18F97Very high97.1Very high114 Ų11479.9 Ų79.950%0.543%0.428SS..Hα-helixtrans-10714.8-174.3-59.6-68.9000113.8W14 Y15 G20 V21 T22W14-F18 HydrophobicContact CB-CD2 4.05Å; W14-F18 HydrophobicContact CB-CE2 4.23Å; W14-F18 HydrophobicContact CE3-CB 4.3Å; W14-F18 HydrophobicContact CE3-CD2 4.19Å; W14-F18 VanDerWaalsContact O-CD2 3.29Å; W14-F18 WeakPolarHBondContact O-CD2 3.01Å; W14-F18 PolarHBondContact O-N 3.48Å; Y15-F18 PolarHBondContact O-N 3.23Å; F18-G20 PolarHBondContact O-N 3.1Å; F18-V21 HydrophobicContact CB-CG2 3.88Å; F18-V21 HydrophobicContact CD1-CG2 4.1Å; F18-V21 HydrophobicContact CG-CG2 4.47Å; F18-V21 WeakPolarHBondContact O-CG2 3.49Å; F18-V21 PolarHBondContact O-N 3.24Å; F18-T22 VanDerWaalsContact O-CG2 3.23Å; F18-T22 WeakPolarHBondContact O-CG2 3.35Å; F18-T22 PolarHBondContact O-N 3.23Å
19R96.2Very high97.2Very high163 Ų16380 Ų8062%0.61544%0.439SS*.G310 helixtrans-52.3-35.3-176.8-167.1-179.5-168.1-166.54.9113.5Y15 V21Y15-R19 HydrophobicContact CE1-CG 4.43Å; Y15-R19 HydrophobicContact CE2-CG 4.34Å; Y15-R19 WeakPolarHBondContact O-CA 3.38Å; Y15-R19 PolarHBondContact O-N 3.29Å; R19-V21 VanDerWaalsContact C-N 3.31Å; R19-V21 PolarHBondContact O-N 2.98Å
20G97.4Very high97.2Very high82 Ų8277.9 Ų77.985%0.84542%0.423SS*.G310 helixtrans-75.5-14-179.800000115.2F18F18-G20 PolarHBondContact O-N 3.1Å
21V97.3Very high97.1Very high124 Ų12478 Ų7875%0.75243%0.427SS*.G310 helixtrans-125.616-175.1-61.60000112.6F18 R19F18-V21 HydrophobicContact CB-CG2 3.88Å; F18-V21 HydrophobicContact CD1-CG2 4.1Å; F18-V21 HydrophobicContact CG-CG2 4.47Å; F18-V21 WeakPolarHBondContact O-CG2 3.49Å; F18-V21 PolarHBondContact O-N 3.24Å; R19-V21 VanDerWaalsContact C-N 3.31Å; R19-V21 PolarHBondContact O-N 2.98Å
22T96.8Very high96.9Very high50 Ų5082.1 Ų82.131%0.30745%0.447SS..SBendtrans-134.5171.4-178.8-162.90000111.4W14 Y15 F18 K24W14-T22 HydrophobicContact CZ3-CG2 4.15Å; Y15-T22 HydrophobicContact CD2-CG2 3.61Å; Y15-T22 HydrophobicContact CE2-CG2 3.6Å; F18-T22 VanDerWaalsContact O-CG2 3.23Å; F18-T22 WeakPolarHBondContact O-CG2 3.35Å; F18-T22 PolarHBondContact O-N 3.23Å; T22-K24 PolarHBondContact O-N 3.16Å
23I95.4Very high96.7Very high109 Ų10984 Ų8456%0.55945%0.453SS*.  trans-67.6130.9-179.5-56.3171.3000109.2S25 F102I23-S25 PolarHBondContact O-N 3.45Å; I23-S25 VanDerWaalsContact O-N 3.16Å; I23-S25 PolarHBondContact O-OG 2.78Å; I23-F102 HydrophobicContact CD1-CE1 4.27Å
24K97.1Very high96.6Very high139 Ų13982.5 Ų82.560%0.60444%0.44SS*.  trans-52.6121.9174.3-170.4-169.2-177.9-165.20109.7T22 S96 L97T22-K24 PolarHBondContact O-N 3.16Å; K24-S96 PolarHBondContact NZ-O 3.34Å; K24-S96 VanDerWaalsContact NZ-O 3.09Å; K24-L97 HydrophobicContact CB-CD2 4.42Å; K24-L97 HydrophobicContact CD-CD2 4.03Å; K24-L97 HydrophobicContact CG-CD2 3.89Å; K24-L97 WeakPolarHBondContact O-CD2 3.34Å
25S97.6Very high96.4Very high23 Ų2382.6 Ų82.616%0.16144%0.442CS..  trans-139.7156.2-172.6-570000111.6F11 Y15 I23F11-S25 VanDerWaalsContact CZ-CB 3.45Å; F11-S25 WeakPolarHBondContact CZ-OG 3.46Å; Y15-S25 PolarHBondContact OH-N 2.73Å; Y15-S25 PolarHBondContact OH-O 2.9Å; I23-S25 PolarHBondContact O-N 3.45Å; I23-S25 VanDerWaalsContact O-N 3.16Å; I23-S25 PolarHBondContact O-OG 2.78Å
26V97.9Very high96.2Very high66 Ų6685.9 Ų85.940%0.446%0.461SS..  trans-120.1137172.2175.10000107.9L28 A93 L97V26-L28 HydrophobicContact CG1-CD2 3.93Å; V26-L28 HydrophobicContact CG1-CG 4.26Å; V26-A93 HydrophobicContact CB-CB 4.16Å; V26-A93 HydrophobicContact CG1-CB 3.89Å; V26-A93 HydrophobicContact CG2-CB 4.5Å; V26-L97 HydrophobicContact CB-CD1 4.26Å; V26-L97 HydrophobicContact CG2-CD1 4.02Å; V26-L97 HydrophobicContact CG2-CD2 4.14Å; V26-L97 HydrophobicContact CG2-CG 4.04Å
27I97.9Very high95.9Very high76 Ų7683.1 Ų83.139%0.3944%0.44SS..  trans-106.8121.1179.5-58.9164.9000107.7F11 Y15F11-I27 HydrophobicContact CD1-CD1 3.85Å; F11-I27 HydrophobicContact CD1-CG1 3.71Å; F11-I27 HydrophobicContact CE1-CD1 4.02Å; F11-I27 HydrophobicContact CE1-CG1 3.76Å; Y15-I27 HydrophobicContact CD1-CD1 3.79Å; Y15-I27 HydrophobicContact CD1-CG1 4.47Å; Y15-I27 HydrophobicContact CG-CD1 4.4Å
28L97.5Very high95.6Very high62 Ų6275.6 Ų75.633%0.32541%0.408SS..  trans-112.5121.6177.3-61.1179.4000109V26 L30 F86 V90 A93V26-L28 HydrophobicContact CG1-CD2 3.93Å; V26-L28 HydrophobicContact CG1-CG 4.26Å; L28-L30 PolarHBondContact O-N 3.02Å; L28-F86 HydrophobicContact CB-CE2 4.44Å; L28-V90 HydrophobicContact CD1-CB 4.41Å; L28-V90 HydrophobicContact CD1-CG2 3.71Å; L28-A93 HydrophobicContact CD1-CB 4.03Å
29P96.9Very high95.4Very high115 Ų11574.1 Ų74.175%0.74740%0.404SS*.PPolyproline II helixtrans-60129169.8-20.832.4000109.6P31P29-P31 VanDerWaalsContact O-CD 3.31Å; P29-P31 WeakPolarHBondContact O-CD 3.29Å
30L95.7Very high95.1Very high35 Ų3570.7 Ų70.718%0.18340%0.398CS..PPolyproline II helixtrans-82.9117.4-178.5-166.563.9000109.9L28 V34 K35 L38 F86 L105 F144L28-L30 PolarHBondContact O-N 3.02Å; L30-V34 HydrophobicContact CD1-CB 3.94Å; L30-V34 HydrophobicContact CD1-CG1 3.47Å; L30-V34 VanDerWaalsContact CD1-CG1 3.47Å; L30-V34 HydrophobicContact CG-CB 4.33Å; L30-V34 HydrophobicContact CG-CG1 4.25Å; L30-K35 HydrophobicContact CB-CG 4.28Å; L30-K35 HydrophobicContact CD2-CD 4.49Å; L30-K35 HydrophobicContact CD2-CG 3.46Å; L30-K35 VanDerWaalsContact CD2-CG 3.46Å; L30-K35 HydrophobicContact CG-CG 3.73Å; L30-K35 VanDerWaalsContact O-CE 3.27Å; L30-K35 WeakPolarHBondContact O-CE 3.27Å; L30-L38 HydrophobicContact CD2-CD1 4.06Å; L30-F86 HydrophobicContact CD1-CE1 4.07Å; L30-F86 HydrophobicContact CD1-CE2 4.08Å; L30-F86 HydrophobicContact CD1-CZ 3.54Å; L30-L105 HydrophobicContact CD2-CD2 4.3Å; L30-F144 HydrophobicContact CD2-CE1 3.65Å; L30-F144 HydrophobicContact CD2-CZ 3.48Å; L30-F144 VanDerWaalsContact CD2-CZ 3.48Å
31P96.1Very high94.1Very high43 Ų4374.7 Ų74.728%0.27940%0.4SS..PPolyproline II helixtrans-60.5150.1176.3-24.136.3000111.9P29 N33 V34 K35 F86P29-P31 VanDerWaalsContact O-CD 3.31Å; P29-P31 WeakPolarHBondContact O-CD 3.29Å; P31-N33 WeakPolarHBondContact CB-OD1 3.31Å; P31-N33 PolarHBondContact O-N 2.9Å; P31-V34 HydrophobicContact CB-CB 4.46Å; P31-V34 HydrophobicContact CB-CG2 4.01Å; P31-V34 HydrophobicContact CG-CG2 4.04Å; P31-V34 PolarHBondContact O-N 3.35Å; P31-V34 VanDerWaalsContact O-N 3.12Å; P31-K35 PolarHBondContact O-N 2.88Å; P31-F86 VanDerWaalsContact CD-CD2 3.48Å; P31-F86 HydrophobicContact CG-CB 4.34Å; P31-F86 HydrophobicContact CG-CD2 3.77Å; P31-F86 HydrophobicContact CG-CE2 4.42Å; P31-F86 HydrophobicContact CG-CG 4.23Å
32Q94.3Very high93Very high110 Ų11070.3 Ų70.351%0.51438%0.38SS..Hα-helixtrans-61.7-44.7-176.1-171.25843.400112.1V34 K35 D36Q32-V34 PolarHBondContact O-N 3.39Å; Q32-K35 WeakPolarHBondContact O-CA 3.3Å; Q32-K35 WeakPolarHBondContact O-CB 3.45Å; Q32-K35 PolarHBondContact O-N 3.19Å; Q32-D36 PolarHBondContact NE2-OD1 3.35Å; Q32-D36 PolarHBondContact O-N 2.76Å
33N92.6Very high91.7Very high88 Ų8873.6 Ų73.647%0.47140%0.4SS..Hα-helixtrans-58.8-32.2175.760.4-39.3000113.5P31 Y37 F83P31-N33 WeakPolarHBondContact CB-OD1 3.31Å; P31-N33 PolarHBondContact O-N 2.9Å; N33-Y37 WeakPolarHBondContact O-CB 3.29Å; N33-Y37 PolarHBondContact O-N 3.46Å; N33-Y37 VanDerWaalsContact O-N 3.11Å; N33-F83 HydrophobicContact CB-CE1 4.24Å; N33-F83 VanDerWaalsContact ND2-CD1 3.34Å; N33-F83 WeakPolarHBondContact ND2-CD1 3.46Å
34V93.9Very high90.5Very high1 Ų169.9 Ų69.91%0.00638%0.381CS..Hα-helixtrans-72.9-39.3174.5-178.20000110.7L30 P31 Q32 Y37 L38 F83 F86 F131L30-V34 HydrophobicContact CD1-CB 3.94Å; L30-V34 HydrophobicContact CD1-CG1 3.47Å; L30-V34 VanDerWaalsContact CD1-CG1 3.47Å; L30-V34 HydrophobicContact CG-CB 4.33Å; L30-V34 HydrophobicContact CG-CG1 4.25Å; P31-V34 HydrophobicContact CB-CB 4.46Å; P31-V34 HydrophobicContact CB-CG2 4.01Å; P31-V34 HydrophobicContact CG-CG2 4.04Å; P31-V34 PolarHBondContact O-N 3.35Å; P31-V34 VanDerWaalsContact O-N 3.12Å; Q32-V34 PolarHBondContact O-N 3.39Å; V34-Y37 PolarHBondContact O-N 2.88Å; V34-L38 HydrophobicContact CG1-CD1 4.23Å; V34-L38 HydrophobicContact CG1-CG 4.46Å; V34-L38 VanDerWaalsContact O-CG 3.3Å; V34-L38 WeakPolarHBondContact O-CG 3.35Å; V34-L38 PolarHBondContact O-N 2.97Å; V34-F83 HydrophobicContact CB-CE1 4.49Å; V34-F83 HydrophobicContact CG2-CB 4.29Å; V34-F83 HydrophobicContact CG2-CD1 3.46Å; V34-F83 VanDerWaalsContact CG2-CD1 3.46Å; V34-F83 HydrophobicContact CG2-CE1 3.88Å; V34-F83 HydrophobicContact CG2-CG 3.87Å; V34-F86 HydrophobicContact CG1-CD1 4.18Å; V34-F86 HydrophobicContact CG1-CE1 3.98Å; V34-F86 HydrophobicContact CG2-CB 4.24Å; V34-F86 HydrophobicContact CG2-CD1 3.86Å; V34-F86 HydrophobicContact CG2-CE1 4.41Å; V34-F86 HydrophobicContact CG2-CG 4.02Å; V34-F131 HydrophobicContact CG1-CE1 3.67Å; V34-F131 HydrophobicContact CG1-CZ 3.73Å
35K94.2Very high89Confident68 Ų6865.4 Ų65.430%0.29637%0.366SS..Hα-helixtrans-60.5-47173.6-67.2176.1-172.3169.70111.2L30 P31 Q32 Y37 L38 L39 F144L30-K35 HydrophobicContact CB-CG 4.28Å; L30-K35 HydrophobicContact CD2-CD 4.49Å; L30-K35 HydrophobicContact CD2-CG 3.46Å; L30-K35 VanDerWaalsContact CD2-CG 3.46Å; L30-K35 HydrophobicContact CG-CG 3.73Å; L30-K35 VanDerWaalsContact O-CE 3.27Å; L30-K35 WeakPolarHBondContact O-CE 3.27Å; P31-K35 PolarHBondContact O-N 2.88Å; Q32-K35 WeakPolarHBondContact O-CA 3.3Å; Q32-K35 WeakPolarHBondContact O-CB 3.45Å; Q32-K35 PolarHBondContact O-N 3.19Å; K35-Y37 VanDerWaalsContact C-N 3.28Å; K35-Y37 PolarHBondContact O-N 2.65Å; K35-L38 PolarHBondContact O-N 3.25Å; K35-L38 VanDerWaalsContact O-N 3.14Å; K35-L39 WeakPolarHBondContact O-CG 3.47Å; K35-L39 PolarHBondContact O-N 3.36Å; K35-F144 HydrophobicContact CG-CE1 4.01Å
36D92.9Very high87.2Confident85 Ų8567.3 Ų67.346%0.45538%0.376SS..Hα-helixtrans-60.3-43.2-179.4-58.1-23.7000110Q32 L38 L39 D40Q32-D36 PolarHBondContact NE2-OD1 3.35Å; Q32-D36 PolarHBondContact O-N 2.76Å; D36-L38 PolarHBondContact O-N 3.37Å; D36-L39 PolarHBondContact O-N 3.19Å; D36-D40 WeakPolarHBondContact O-CB 3.39Å; D36-D40 PolarHBondContact O-N 2.88Å
37Y91.5Very high85.2Confident25 Ų2568.5 Ų68.510%0.09839%0.387CS..Hα-helixtrans-63.8-38.6174.2171.3-108.8000114.3N33 V34 K35 L39 D40 P81 F83 F131 K135N33-Y37 WeakPolarHBondContact O-CB 3.29Å; N33-Y37 PolarHBondContact O-N 3.46Å; N33-Y37 VanDerWaalsContact O-N 3.11Å; V34-Y37 PolarHBondContact O-N 2.88Å; K35-Y37 VanDerWaalsContact C-N 3.28Å; K35-Y37 PolarHBondContact O-N 2.65Å; Y37-L39 VanDerWaalsContact C-N 3.29Å; Y37-D40 PolarHBondContact O-N 3.44Å; Y37-P81 HydrophobicContact CD2-CB 4.48Å; Y37-P81 HydrophobicContact CD2-CG 3.29Å; Y37-P81 HydrophobicContact CE2-CG 3.23Å; Y37-P81 HydrophobicContact CG-CG 4.05Å; Y37-F83 AromaticContact CD1-CE2 3.72Å; Y37-F83 HydrophobicContact CD1-CE2 3.72Å; Y37-F83 AromaticContact CD1-CZ 3.93Å; Y37-F83 HydrophobicContact CD1-CZ 3.93Å; Y37-F83 HydrophobicContact CD2-CZ 4.42Å; Y37-F83 HydrophobicContact CE1-CE2 4.22Å; Y37-F83 AromaticContact CG-CE2 3.89Å; Y37-F83 HydrophobicContact CG-CE2 3.89Å; Y37-F83 AromaticContact CG-CZ 3.69Å; Y37-F83 HydrophobicContact CG-CZ 3.69Å; Y37-F131 HydrophobicContact CD1-CD2 4.38Å; Y37-F131 HydrophobicContact CD1-CE2 4.23Å; Y37-F131 HydrophobicContact CD1-CZ 4.48Å; Y37-F131 AromaticContact CE1-CD2 3.71Å; Y37-F131 HydrophobicContact CE1-CD2 3.71Å; Y37-F131 AromaticContact CE1-CE2 3.95Å; Y37-F131 HydrophobicContact CE1-CE2 3.95Å; Y37-F131 HydrophobicContact CE1-CG 4.14Å; Y37-K135 HydrophobicContact CE1-CD 4.1Å; Y37-K135 PolarHBondContact O-NZ 3.06Å
38L92.4Very high82.9Confident10 Ų1067.8 Ų67.85%0.05240%0.399CS..Hα-helixtrans-68.2-32.4177.1-72.4173.9000111.9L30 V34 K35 D36 F131 F134 K135 F144L30-L38 HydrophobicContact CD2-CD1 4.06Å; V34-L38 HydrophobicContact CG1-CD1 4.23Å; V34-L38 HydrophobicContact CG1-CG 4.46Å; V34-L38 VanDerWaalsContact O-CG 3.3Å; V34-L38 WeakPolarHBondContact O-CG 3.35Å; V34-L38 PolarHBondContact O-N 2.97Å; K35-L38 PolarHBondContact O-N 3.25Å; K35-L38 VanDerWaalsContact O-N 3.14Å; D36-L38 PolarHBondContact O-N 3.37Å; L38-F131 HydrophobicContact CD2-CD1 3.92Å; L38-F131 HydrophobicContact CD2-CE1 4.37Å; L38-F134 HydrophobicContact CD1-CD2 3.98Å; L38-F134 HydrophobicContact CD2-CB 3.76Å; L38-F134 HydrophobicContact CD2-CD2 4.48Å; L38-K135 HydrophobicContact CD2-CG 3.88Å; L38-F144 HydrophobicContact CB-CE2 4.09Å; L38-F144 HydrophobicContact CD1-CE2 4.06Å; L38-F144 HydrophobicContact CD1-CZ 3.92Å
39L91.8Very high80.7Confident82 Ų8270.6 Ų70.643%0.42941%0.405SS..Hα-helixtrans-84.4-16.3177.7-71.9172.5000114K35 D36 Y37 F144 T145K35-L39 WeakPolarHBondContact O-CG 3.47Å; K35-L39 PolarHBondContact O-N 3.36Å; D36-L39 PolarHBondContact O-N 3.19Å; Y37-L39 VanDerWaalsContact C-N 3.29Å; L39-F144 HydrophobicContact CD1-CB 4.35Å; L39-F144 HydrophobicContact CD2-CB 3.83Å; L39-F144 HydrophobicContact CD2-CD2 3.98Å; L39-F144 HydrophobicContact CD2-CG 4.19Å; L39-F144 HydrophobicContact CG-CB 4.43Å; L39-F144 HydrophobicContact CG-CD2 4.29Å; L39-F144 HydrophobicContact CG-CG 4.46Å; L39-T145 HydrophobicContact CD2-CG2 3.88Å
40D90.6Very high78Confident91 Ų9173 Ų7349%0.48741%0.412SS..SBendtrans-64.5138.1175.5-177.753.7000111.1D36 Y37 G42 K135D36-D40 WeakPolarHBondContact O-CB 3.39Å; D36-D40 PolarHBondContact O-N 2.88Å; Y37-D40 PolarHBondContact O-N 3.44Å; D40-G42 PolarHBondContact O-N 3.38Å; D40-G42 WeakPolarHBondContact OD2-CA 3.32Å; D40-G42 PolarHBondContact OD2-N 2.93Å; D40-G42 VanDerWaalsContact OD2-N 3.09Å; D40-K135 PolarHBondContact O-NZ 3.2Å
41D76.2Confident75.4Confident167 Ų16777.2 Ų77.289%0.89343%0.434SS*.  trans-78.81.9179.1-158.930.6000112.3
42G73.2Confident72.4Confident32 Ų3280.2 Ų80.233%0.3345%0.454SS..SBendtrans-62.7142.4177.500000113.1D40 L44 K135D40-G42 PolarHBondContact O-N 3.38Å; D40-G42 WeakPolarHBondContact OD2-CA 3.32Å; D40-G42 PolarHBondContact OD2-N 2.93Å; D40-G42 VanDerWaalsContact OD2-N 3.09Å; G42-L44 PolarHBondContact O-N 2.85Å; G42-K135 WeakPolarHBondContact O-CE 3.36Å
43T69.8Low69.9Low118 Ų11879.8 Ų79.872%0.72446%0.461SS*.  trans-56.5129.7174.3-520000110.4V45T43-V45 PolarHBondContact O-N 3.37Å; T43-V45 VanDerWaalsContact O-N 3.12Å
44L69.9Low67.3Low32 Ų3281.9 Ų81.917%0.16848%0.477CS..  trans-67.1114173-165.2142.1000109.1G42 V46 F131 L132 K135G42-L44 PolarHBondContact O-N 2.85Å; L44-V46 HydrophobicContact CD2-CB 4.27Å; L44-V46 HydrophobicContact CD2-CG2 3.19Å; L44-V46 PolarHBondContact O-N 2.81Å; L44-F131 HydrophobicContact CD1-CB 3.63Å; L44-F131 VanDerWaalsContact CD1-O 3.31Å; L44-F131 WeakPolarHBondContact CD1-O 3.45Å; L44-L132 HydrophobicContact CD2-CD1 4.35Å; L44-K135 HydrophobicContact CB-CD 3.98Å; L44-K135 HydrophobicContact CD1-CB 4.17Å; L44-K135 HydrophobicContact CD1-CD 3.47Å; L44-K135 VanDerWaalsContact CD1-CD 3.47Å; L44-K135 HydrophobicContact CD1-CG 3.95Å; L44-K135 HydrophobicContact CG-CD 4.08Å
45V65.4Low64.8Low45 Ų4589.8 Ų89.827%0.27351%0.513SS..  trans-81.599.3172.2-177.90000107.8T43 S47 L78 A80T43-V45 PolarHBondContact O-N 3.37Å; T43-V45 VanDerWaalsContact O-N 3.12Å; V45-S47 PolarHBondContact O-N 3.39Å; V45-L78 WeakPolarHBondContact CG1-O 3.43Å; V45-L78 HydrophobicContact CG2-CB 3.6Å; V45-L78 WeakPolarHBondContact CG2-O 3.47Å; V45-A80 HydrophobicContact CB-CB 3.91Å; V45-A80 HydrophobicContact CG1-CB 4.19Å; V45-A80 WeakPolarHBondContact O-CB 3.27Å
46V61.6Low62.3Low63 Ų6391.8 Ų91.838%0.38254%0.536SS..  trans-80.8110.3165.7-171.80000106.1L44 G48 L132L44-V46 HydrophobicContact CD2-CB 4.27Å; L44-V46 HydrophobicContact CD2-CG2 3.19Å; L44-V46 PolarHBondContact O-N 2.81Å; V46-G48 PolarHBondContact O-N 2.87Å; V46-L132 HydrophobicContact CG2-CD1 4.4Å
47S55.4Low59.9Low91 Ų9195.8 Ų95.864%0.63655%0.552SS**PPolyproline II helixtrans-54117.7163.9-56.90000107.1V45 R49V45-S47 PolarHBondContact O-N 3.39Å; S47-R49 PolarHBondContact O-N 3.27Å
48G48.8Very low58Low61 Ų6199 Ų9963%0.62958%0.576SS**PPolyproline II helixtrans-47.1128.3-178.600000109.5V46 D50V46-G48 PolarHBondContact O-N 2.87Å; G48-D50 PolarHBondContact O-N 3.49Å
49R50.7Low55.3Low121 Ų121105.8 Ų105.846%0.45761%0.612SS.*PPolyproline II helixtrans-63.9120.5167.9-72.5178177.1169-3.1106S47 D51 D129S47-R49 PolarHBondContact O-N 3.27Å; R49-D51 PolarHBondContact O-N 3.29Å; R49-D129 IonicContact CZ-OD1 3.74Å; R49-D129 IonicContact NH2-OD1 2.62Å; R49-D129 PolarHBondContact NH2-OD1 3.27Å; R49-D129 IonicContact NH2-OD2 3.39Å; R49-D129 PolarHBondContact NH2-OD2 3.38Å
50D41.2Very low52.8Low165 Ų165107.6 Ų107.688%0.88263%0.632SS**  trans-69.452.3168.2-68.1-44.6000110.5G48 P52G48-D50 PolarHBondContact O-N 3.49Å; D50-P52 VanDerWaalsContact O-CD 3.31Å; D50-P52 WeakPolarHBondContact O-CD 3.45Å
51D40.5Very low50.7Low124 Ų124110.7 Ų110.766%0.66365%0.648SS**  trans-82.1111.8163.8-80.5-46.8000106.1R49R49-D51 PolarHBondContact O-N 3.29Å
52P34.4Very low49Very low105 Ų105110.3 Ų110.368%0.68265%0.646SS**  trans-59.5134.9179.721.7-29.8000108.8D50 T54D50-P52 VanDerWaalsContact O-CD 3.31Å; D50-P52 WeakPolarHBondContact O-CD 3.45Å; P52-T54 PolarHBondContact O-N 3.39Å
53P40.9Very low47.8Very low102 Ų102118.6 Ų118.666%0.66268%0.676SS**  trans-60.1117174.323.8-30.1000107.3H55P53-H55 PolarHBondContact O-N 3.34Å
54T37.8Very low46.5Very low132 Ų132117.2 Ų117.281%0.8168%0.676SS**  trans-66.487170.2-25.90000106.8P52 S56P52-T54 PolarHBondContact O-N 3.39Å; T54-S56 PolarHBondContact O-N 3.44Å; T54-S56 PolarHBondContact O-OG 2.92Å
55H42.2Very low45.1Very low167 Ų167124.5 Ų124.577%0.77371%0.71SS**  trans-56.3104.4172.5-93-82.6000108.3P53P53-H55 PolarHBondContact O-N 3.34Å
56S41.4Very low44Very low109 Ų109130.8 Ų130.876%0.76274%0.736SS**  trans-110.7100.9162.6-38.70000105.4T54T54-S56 PolarHBondContact O-N 3.44Å; T54-S56 PolarHBondContact O-OG 2.92Å
57Q42.4Very low43Very low170 Ų170133.9 Ų133.979%0.79475%0.749SS**  trans-138.7158.8167.5-87.7-115.6-59.500107.4
58P51.1Low41.9Very low93 Ų93137.9 Ų137.960%0.60476%0.758SS**  cis-130.6162.93.933.2-14.3000113.5
59D35.9Very low41.6Very low152 Ų152145.8 Ų145.881%0.81377%0.769SS**  175.1144.6116.3-96.6-25000112.7
60S39.4Very low40.9Very low120 Ų120144.9 Ų144.984%0.83978%0.781SS**  trans99.6118.7161-153.20000117.7
61D47.3Very low41Very low156 Ų156143.5 Ų143.583%0.83477%0.774SS**  trans-35.5125.1171.7-78.4-34.8000114.5
62D39.5Very low40.9Very low158 Ų158144.2 Ų144.285%0.84578%0.777SS**  trans-152.7126.7145.1-103.8-36000108.6A64D62-A64 PolarHBondContact O-N 3.08Å
63E49.1Very low41.3Very low207 Ų207148.3 Ų148.397%0.96779%0.788SS**  trans-61.494.1174.7-74.6-167.2135.100110
64A42.8Very low41.2Very low88 Ų88150.6 Ų150.673%0.72779%0.794SS**  trans-94.7110.8167.300000108.3D62 E66D62-A64 PolarHBondContact O-N 3.08Å; A64-E66 PolarHBondContact O-N 3.4Å
65E40.4Very low41.3Very low186 Ų186149.2 Ų149.287%0.86979%0.785SS**  trans-55.1108.4166.5-68.8-154.3163.100109I67E65-I67 PolarHBondContact O-N 3.42Å
66E40.4Very low41.2Very low177 Ų177144.6 Ų144.683%0.82778%0.777SS**  trans-61.9100.4166.4-81.7-171.3155.200107.5A64 Q68A64-E66 PolarHBondContact O-N 3.4Å; E66-Q68 PolarHBondContact O-N 3.38Å
67I40.6Very low41.3Very low128 Ų128145.6 Ų145.666%0.65678%0.778SS**  trans-66.387.4162.2-57.3173.9000105.9E65 W69E65-I67 PolarHBondContact O-N 3.42Å; I67-W69 VanDerWaalsContact C-N 3.33Å; I67-W69 PolarHBondContact O-N 2.9Å
68Q33.9Very low41.8Very low174 Ų174143.1 Ų143.181%0.81377%0.77SS**  trans-67.393.6172.4-162.5175.441.600106.6E66 S70E66-Q68 PolarHBondContact O-N 3.38Å; Q68-S70 PolarHBondContact O-N 3.47Å
69W42.9Very low42.1Very low227 Ų227144.7 Ų144.786%0.8678%0.778SS**  trans-59105.2167.5-65.892.5000106.4I67 D71I67-W69 VanDerWaalsContact C-N 3.33Å; I67-W69 PolarHBondContact O-N 2.9Å; W69-D71 PolarHBondContact O-N 3.37Å
70S35.4Very low43.4Very low102 Ų102138.8 Ų138.871%0.71375%0.75SS**  trans-56.4113.1176.254.50000107.7Q68 D72Q68-S70 PolarHBondContact O-N 3.47Å; S70-D72 PolarHBondContact O-N 3.2Å
71D42.3Very low45Very low137 Ų137136.1 Ų136.173%0.73373%0.73SS**  trans-67.586173.1-163.616.7000106.9W69 E73W69-D71 PolarHBondContact O-N 3.37Å; D71-E73 PolarHBondContact O-N 2.62Å; D71-E73 VanDerWaalsContact O-N 3.13Å
72D38.5Very low46.7Very low138 Ų138136.8 Ų136.874%0.73873%0.728SS**  trans-65.7114.3179-139.3-0.6000106.9S70 N74S70-D72 PolarHBondContact O-N 3.2Å; D72-N74 PolarHBondContact O-N 3.24Å
73E42.5Very low49.1Very low192 Ų192130.2 Ų130.290%0.89769%0.692SS**SBendtrans-7160.4-166.8-161.2-174.1158.200111.6D71D71-E73 PolarHBondContact O-N 2.62Å; D71-E73 VanDerWaalsContact O-N 3.13Å
74N39.5Very low51.1Low149 Ų149124.6 Ų124.680%0.79767%0.673SS**  trans-146.826.3169.6-165.752.4000112.4D72 A76D72-N74 PolarHBondContact O-N 3.24Å; N74-A76 PolarHBondContact O-N 3.47Å
75T40.5Very low53.6Low103 Ų103126.8 Ų126.863%0.63267%0.669SS**  trans-70.177.9169.844.10000109.4T77T75-T77 PolarHBondContact O-N 2.8Å
76A38.9Very low56.2Low71 Ų71119 Ų11959%0.58763%0.632SS**  trans-44.7117.4149.300000105.4N74 L78N74-A76 PolarHBondContact O-N 3.47Å; A76-L78 PolarHBondContact O-N 3Å
77T43.5Very low58.8Low130 Ų130112.2 Ų112.280%0.79861%0.606SS**  trans-59.789.5178.428.40000107T75 T79T75-T77 PolarHBondContact O-N 2.8Å; T77-T79 VanDerWaalsContact C-N 3.31Å; T77-T79 PolarHBondContact O-N 2.76Å
78L53.4Low61.4Low117 Ų117109.9 Ų109.961%0.61360%0.598SS**  trans-63.4101.2178.2-69.6174.5000104.7V45 A76 A80V45-L78 WeakPolarHBondContact CG1-O 3.43Å; V45-L78 HydrophobicContact CG2-CB 3.6Å; V45-L78 WeakPolarHBondContact CG2-O 3.47Å; A76-L78 PolarHBondContact O-N 3Å; L78-A80 PolarHBondContact O-N 3.07Å
79T57.2Low64.5Low126 Ų126105.9 Ų105.977%0.77358%0.578SS**PPolyproline II helixtrans-75122.3174.423.40000106.2T77T77-T79 VanDerWaalsContact C-N 3.31Å; T77-T79 PolarHBondContact O-N 2.76Å
80A63.9Low67.1Low29 Ų2995.5 Ų95.524%0.2454%0.539CS..PPolyproline II helixtrans-55.4129.7175.100000108.2V45 L78 E82V45-A80 HydrophobicContact CB-CB 3.91Å; V45-A80 HydrophobicContact CG1-CB 4.19Å; V45-A80 WeakPolarHBondContact O-CB 3.27Å; L78-A80 PolarHBondContact O-N 3.07Å; A80-E82 PolarHBondContact O-N 3.12Å
81P73.1Confident70Confident63 Ų6394.1 Ų94.141%0.40952%0.522SS..PPolyproline II helixtrans-59.9129.9176.221.5-29.4000109.5Y37 F83Y37-P81 HydrophobicContact CD2-CB 4.48Å; Y37-P81 HydrophobicContact CD2-CG 3.29Å; Y37-P81 HydrophobicContact CE2-CG 3.23Å; Y37-P81 HydrophobicContact CG-CG 4.05Å; P81-F83 HydrophobicContact CB-CE2 4.03Å; P81-F83 HydrophobicContact CB-CZ 3.98Å; P81-F83 HydrophobicContact CG-CE2 4.05Å; P81-F83 HydrophobicContact CG-CZ 4.19Å; P81-F83 WeakPolarHBondContact O-CD2 3.31Å; P81-F83 VanDerWaalsContact O-CE2 3.3Å; P81-F83 WeakPolarHBondContact O-CE2 3.11Å
82E81.9Confident72.7Confident170 Ų17093.4 Ų93.479%0.79451%0.514SS*.PPolyproline II helixtrans-90.8136.4-178.3-64.9-169.5170.700111.3A80 P84A80-E82 PolarHBondContact O-N 3.12Å; E82-P84 VanDerWaalsContact C-CD 3.44Å; E82-P84 WeakPolarHBondContact O-CD 3.34Å
83F90.9Very high75.5Confident20 Ų2087.4 Ų87.49%0.08848%0.483CS..  trans-12463176.2-54.8-82.9000110N33 V34 Y37 P81 E85 F86 A87 F131N33-F83 HydrophobicContact CB-CE1 4.24Å; N33-F83 VanDerWaalsContact ND2-CD1 3.34Å; N33-F83 WeakPolarHBondContact ND2-CD1 3.46Å; V34-F83 HydrophobicContact CB-CE1 4.49Å; V34-F83 HydrophobicContact CG2-CB 4.29Å; V34-F83 HydrophobicContact CG2-CD1 3.46Å; V34-F83 VanDerWaalsContact CG2-CD1 3.46Å; V34-F83 HydrophobicContact CG2-CE1 3.88Å; V34-F83 HydrophobicContact CG2-CG 3.87Å; Y37-F83 AromaticContact CD1-CE2 3.72Å; Y37-F83 HydrophobicContact CD1-CE2 3.72Å; Y37-F83 AromaticContact CD1-CZ 3.93Å; Y37-F83 HydrophobicContact CD1-CZ 3.93Å; Y37-F83 HydrophobicContact CD2-CZ 4.42Å; Y37-F83 HydrophobicContact CE1-CE2 4.22Å; Y37-F83 AromaticContact CG-CE2 3.89Å; Y37-F83 HydrophobicContact CG-CE2 3.89Å; Y37-F83 AromaticContact CG-CZ 3.69Å; Y37-F83 HydrophobicContact CG-CZ 3.69Å; P81-F83 HydrophobicContact CB-CE2 4.03Å; P81-F83 HydrophobicContact CB-CZ 3.98Å; P81-F83 HydrophobicContact CG-CE2 4.05Å; P81-F83 HydrophobicContact CG-CZ 4.19Å; P81-F83 WeakPolarHBondContact O-CD2 3.31Å; P81-F83 VanDerWaalsContact O-CE2 3.3Å; P81-F83 WeakPolarHBondContact O-CE2 3.11Å; F83-E85 PolarHBondContact O-N 3.43Å; F83-F86 HydrophobicContact CB-CB 4.02Å; F83-F86 PolarHBondContact O-N 3.21Å; F83-A87 VanDerWaalsContact O-CB 3.3Å; F83-A87 WeakPolarHBondContact O-CB 3.3Å; F83-A87 PolarHBondContact O-N 3.35Å; F83-F131 AromaticContact CD2-CE2 3.67Å; F83-F131 HydrophobicContact CD2-CE2 3.67Å; F83-F131 AromaticContact CD2-CZ 3.91Å; F83-F131 HydrophobicContact CD2-CZ 3.91Å; F83-F131 AromaticContact CE2-CE2 3.9Å; F83-F131 HydrophobicContact CE2-CE2 3.9Å; F83-F131 HydrophobicContact CE2-CZ 4.22Å
84P91.4Very high78.2Confident89 Ų8978.4 Ų78.458%0.57844%0.441SS*.Hα-helixtrans-57-45.1-166.420.9-33000112.8E82 F86 A87 T88E82-P84 VanDerWaalsContact C-CD 3.44Å; E82-P84 WeakPolarHBondContact O-CD 3.34Å; P84-F86 PolarHBondContact O-N 3.21Å; P84-A87 PolarHBondContact O-N 3.38Å; P84-T88 PolarHBondContact O-N 3.42Å; P84-T88 PolarHBondContact O-OG1 2.96Å; P84-T88 VanDerWaalsContact O-OG1 3.08Å
85E94.2Very high80.9Confident135 Ų13576 Ų7663%0.63143%0.429SS*.Hα-helixtrans-62.9-42.6178.3-168.5-166.3156.600112.2F83 K89F83-E85 PolarHBondContact O-N 3.43Å; E85-K89 WeakPolarHBondContact O-CG 3.4Å; E85-K89 PolarHBondContact O-N 3.45Å; E85-K89 WeakPolarHBondContact OE1-CE 3.49Å; E85-K89 IonicContact OE1-NZ 2.65Å; E85-K89 PolarHBondContact OE1-NZ 2.85Å
86F95.4Very high83.7Confident22 Ų2274 Ų7410%0.09642%0.419CS..Hα-helixtrans-71.3-39.2179.1-172.7-113.3000111.4L28 L30 P31 V34 F83 P84 T88 K89 V90 L127 F131L28-F86 HydrophobicContact CB-CE2 4.44Å; L30-F86 HydrophobicContact CD1-CE1 4.07Å; L30-F86 HydrophobicContact CD1-CE2 4.08Å; L30-F86 HydrophobicContact CD1-CZ 3.54Å; P31-F86 VanDerWaalsContact CD-CD2 3.48Å; P31-F86 HydrophobicContact CG-CB 4.34Å; P31-F86 HydrophobicContact CG-CD2 3.77Å; P31-F86 HydrophobicContact CG-CE2 4.42Å; P31-F86 HydrophobicContact CG-CG 4.23Å; V34-F86 HydrophobicContact CG1-CD1 4.18Å; V34-F86 HydrophobicContact CG1-CE1 3.98Å; V34-F86 HydrophobicContact CG2-CB 4.24Å; V34-F86 HydrophobicContact CG2-CD1 3.86Å; V34-F86 HydrophobicContact CG2-CE1 4.41Å; V34-F86 HydrophobicContact CG2-CG 4.02Å; F83-F86 HydrophobicContact CB-CB 4.02Å; F83-F86 PolarHBondContact O-N 3.21Å; P84-F86 PolarHBondContact O-N 3.21Å; F86-T88 VanDerWaalsContact C-N 3.34Å; F86-T88 PolarHBondContact O-N 3.25Å; F86-K89 PolarHBondContact O-N 3.28Å; F86-V90 HydrophobicContact CD1-CG2 4.01Å; F86-V90 HydrophobicContact CD2-CG2 4.4Å; F86-V90 HydrophobicContact CE1-CG2 3.65Å; F86-V90 HydrophobicContact CE2-CG2 4.07Å; F86-V90 HydrophobicContact CG-CG2 4.37Å; F86-V90 HydrophobicContact CZ-CG2 3.68Å; F86-V90 WeakPolarHBondContact O-CB 3.49Å; F86-V90 VanDerWaalsContact O-CG2 3.29Å; F86-V90 WeakPolarHBondContact O-CG2 3.29Å; F86-V90 PolarHBondContact O-N 3.07Å; F86-L127 HydrophobicContact CD1-CD1 3.99Å; F86-L127 HydrophobicContact CD1-CD2 4.33Å; F86-L127 HydrophobicContact CE1-CD1 3.82Å; F86-F131 HydrophobicContact CD1-CZ 4.28Å; F86-F131 HydrophobicContact CE1-CE1 4.15Å; F86-F131 HydrophobicContact CE1-CZ 4.33Å
87A94.8Very high86.4Confident34 Ų3473 Ų7328%0.28140%0.403SS..Hα-helixtrans-59.1-44.3175.700000111.4F83 P84 V90 Q91 L127F83-A87 VanDerWaalsContact O-CB 3.3Å; F83-A87 WeakPolarHBondContact O-CB 3.3Å; F83-A87 PolarHBondContact O-N 3.35Å; P84-A87 PolarHBondContact O-N 3.38Å; A87-V90 PolarHBondContact O-N 3.46Å; A87-Q91 WeakPolarHBondContact O-CB 3.3Å; A87-Q91 PolarHBondContact O-N 3.13Å; A87-L127 HydrophobicContact CB-CD2 3.69Å
88T96.3Very high88.9Confident79 Ų7970.1 Ų70.149%0.48540%0.399SS..Hα-helixtrans-59.6-50.3174.1-58.90000111.4P84 F86 V90 Q91 E92P84-T88 PolarHBondContact O-N 3.42Å; P84-T88 PolarHBondContact O-OG1 2.96Å; P84-T88 VanDerWaalsContact O-OG1 3.08Å; F86-T88 VanDerWaalsContact C-N 3.34Å; F86-T88 PolarHBondContact O-N 3.25Å; T88-V90 VanDerWaalsContact C-N 3.31Å; T88-V90 PolarHBondContact O-N 3.25Å; T88-Q91 PolarHBondContact O-N 3.35Å; T88-E92 HydrophobicContact CG2-CG 4.44Å; T88-E92 WeakPolarHBondContact O-CG 3.36Å; T88-E92 PolarHBondContact O-N 2.98Å
89K97.8Very high91Very high91 Ų9165.9 Ų65.940%0.39638%0.384SS..Hα-helixtrans-60-40.5179.4-70.8175.5-172.7169.20112.5E85 F86 A93E85-K89 WeakPolarHBondContact O-CG 3.4Å; E85-K89 PolarHBondContact O-N 3.45Å; E85-K89 WeakPolarHBondContact OE1-CE 3.49Å; E85-K89 IonicContact OE1-NZ 2.65Å; E85-K89 PolarHBondContact OE1-NZ 2.85Å; F86-K89 PolarHBondContact O-N 3.28Å; K89-A93 WeakPolarHBondContact O-CB 3.21Å; K89-A93 PolarHBondContact O-N 3.38Å
90V97.2Very high92.8Very high8 Ų861.9 Ų61.95%0.04836%0.361CS..Hα-helixtrans-66.3-45.1177169.20000110.6L28 F86 A87 T88 E92 A93 I94 L127 I130L28-V90 HydrophobicContact CD1-CB 4.41Å; L28-V90 HydrophobicContact CD1-CG2 3.71Å; F86-V90 HydrophobicContact CD1-CG2 4.01Å; F86-V90 HydrophobicContact CD2-CG2 4.4Å; F86-V90 HydrophobicContact CE1-CG2 3.65Å; F86-V90 HydrophobicContact CE2-CG2 4.07Å; F86-V90 HydrophobicContact CG-CG2 4.37Å; F86-V90 HydrophobicContact CZ-CG2 3.68Å; F86-V90 WeakPolarHBondContact O-CB 3.49Å; F86-V90 VanDerWaalsContact O-CG2 3.29Å; F86-V90 WeakPolarHBondContact O-CG2 3.29Å; F86-V90 PolarHBondContact O-N 3.07Å; A87-V90 PolarHBondContact O-N 3.46Å; T88-V90 VanDerWaalsContact C-N 3.31Å; T88-V90 PolarHBondContact O-N 3.25Å; V90-E92 PolarHBondContact O-N 2.84Å; V90-A93 WeakPolarHBondContact O-CB 3.23Å; V90-A93 PolarHBondContact O-N 3.08Å; V90-I94 HydrophobicContact CG1-CD1 3.78Å; V90-I94 HydrophobicContact CG1-CG1 4.39Å; V90-I94 VanDerWaalsContact O-CG1 3.27Å; V90-I94 WeakPolarHBondContact O-CG1 3.48Å; V90-I94 PolarHBondContact O-N 2.98Å; V90-L127 HydrophobicContact CB-CD1 4.35Å; V90-L127 HydrophobicContact CG1-CB 4.38Å; V90-L127 HydrophobicContact CG1-CD1 4.15Å; V90-L127 HydrophobicContact CG2-CD1 4.06Å; V90-I130 HydrophobicContact CG1-CD1 3.73Å
91Q97.4Very high94.4Very high74 Ų7461.7 Ų61.735%0.34636%0.357SS..Hα-helixtrans-64.5-41.6179.5-168.160.257.700111.9A87 T88 A93 I94 N95A87-Q91 WeakPolarHBondContact O-CB 3.3Å; A87-Q91 PolarHBondContact O-N 3.13Å; T88-Q91 PolarHBondContact O-N 3.35Å; Q91-A93 VanDerWaalsContact C-N 3.34Å; Q91-A93 PolarHBondContact O-N 3.12Å; Q91-I94 PolarHBondContact O-N 3.23Å; Q91-N95 PolarHBondContact NE2-OD1 3.48Å; Q91-N95 WeakPolarHBondContact O-CB 3.15Å; Q91-N95 PolarHBondContact O-N 2.97Å; Q91-N95 PolarHBondContact O-ND2 3.27Å; Q91-N95 PolarHBondContact O-OD1 2.89Å
92E98.1Very high95.5Very high121 Ų12163.3 Ų63.357%0.56536%0.358SS*.Hα-helixtrans-59.6-44.5173.1-73.1174.6177.600111.6T88 V90 N95 S96T88-E92 HydrophobicContact CG2-CG 4.44Å; T88-E92 WeakPolarHBondContact O-CG 3.36Å; T88-E92 PolarHBondContact O-N 2.98Å; V90-E92 PolarHBondContact O-N 2.84Å; E92-N95 PolarHBondContact O-N 3.47Å; E92-S96 WeakPolarHBondContact O-CB 3.33Å; E92-S96 PolarHBondContact O-N 2.86Å
93A98.1Very high96.2Very high12 Ų1255.8 Ų55.810%0.09932%0.324CS..Hα-helixtrans-61.8-46.1176.800000111.7V26 L28 K89 V90 Q91 N95 S96 L97V26-A93 HydrophobicContact CB-CB 4.16Å; V26-A93 HydrophobicContact CG1-CB 3.89Å; V26-A93 HydrophobicContact CG2-CB 4.5Å; L28-A93 HydrophobicContact CD1-CB 4.03Å; K89-A93 WeakPolarHBondContact O-CB 3.21Å; K89-A93 PolarHBondContact O-N 3.38Å; V90-A93 WeakPolarHBondContact O-CB 3.23Å; V90-A93 PolarHBondContact O-N 3.08Å; Q91-A93 VanDerWaalsContact C-N 3.34Å; Q91-A93 PolarHBondContact O-N 3.12Å; A93-N95 VanDerWaalsContact C-N 3.34Å; A93-N95 PolarHBondContact O-N 2.92Å; A93-S96 PolarHBondContact O-N 2.9Å; A93-S96 PolarHBondContact O-OG 3.26Å; A93-L97 WeakPolarHBondContact O-CG 3.4Å; A93-L97 PolarHBondContact O-N 3.46Å; A93-L97 VanDerWaalsContact O-N 3.14Å
94I97.9Very high96.5Very high3 Ų357.9 Ų57.92%0.01533%0.333CS..Hα-helixtrans-57.8-47.5176.8-69.8169.1000110.5V90 Q91 S96 L97 G98 G99 V101 K125 I130V90-I94 HydrophobicContact CG1-CD1 3.78Å; V90-I94 HydrophobicContact CG1-CG1 4.39Å; V90-I94 VanDerWaalsContact O-CG1 3.27Å; V90-I94 WeakPolarHBondContact O-CG1 3.48Å; V90-I94 PolarHBondContact O-N 2.98Å; Q91-I94 PolarHBondContact O-N 3.23Å; I94-S96 VanDerWaalsContact C-N 3.35Å; I94-S96 PolarHBondContact O-N 3.47Å; I94-L97 PolarHBondContact O-N 2.91Å; I94-G98 PolarHBondContact O-N 3.4Å; I94-G99 WeakPolarHBondContact O-CA 3.23Å; I94-G99 PolarHBondContact O-N 3.49Å; I94-V101 HydrophobicContact CB-CG1 4.41Å; I94-V101 HydrophobicContact CD1-CG2 4.42Å; I94-V101 HydrophobicContact CG1-CG1 4.11Å; I94-V101 HydrophobicContact CG1-CG2 3.83Å; I94-K125 WeakPolarHBondContact CD1-O 3.44Å; I94-I130 HydrophobicContact CD1-CD1 4.38Å
95N97.8Very high96.8Very high100 Ų10055 Ų5554%0.53531%0.312SS..Hα-helixtrans-61.6-43.1178.8-66.8-13.7000111.3Q91 E92 A93 L97 G98Q91-N95 PolarHBondContact NE2-OD1 3.48Å; Q91-N95 WeakPolarHBondContact O-CB 3.15Å; Q91-N95 PolarHBondContact O-N 2.97Å; Q91-N95 PolarHBondContact O-ND2 3.27Å; Q91-N95 PolarHBondContact O-OD1 2.89Å; E92-N95 PolarHBondContact O-N 3.47Å; A93-N95 VanDerWaalsContact C-N 3.34Å; A93-N95 PolarHBondContact O-N 2.92Å; N95-L97 PolarHBondContact O-N 2.87Å; N95-G98 PolarHBondContact O-N 3Å; N95-G98 VanDerWaalsContact O-N 3.17Å
96S97.7Very high96.9Very high61 Ų6151.7 Ų51.743%0.42730%0.299SS..Hα-helixtrans-65.6-19.8178.881.50000114.6K24 E92 A93 I94K24-S96 PolarHBondContact NZ-O 3.34Å; K24-S96 VanDerWaalsContact NZ-O 3.09Å; E92-S96 WeakPolarHBondContact O-CB 3.33Å; E92-S96 PolarHBondContact O-N 2.86Å; A93-S96 PolarHBondContact O-N 2.9Å; A93-S96 PolarHBondContact O-OG 3.26Å; I94-S96 VanDerWaalsContact C-N 3.35Å; I94-S96 PolarHBondContact O-N 3.47Å
97L97.2Very high97Very high49 Ų4953.1 Ų53.126%0.25730%0.304SS..THydrogen-bonded Turntrans-100.35.5179.8-67.8174.1000113.1K24 V26 A93 I94 N95 V101K24-L97 HydrophobicContact CB-CD2 4.42Å; K24-L97 HydrophobicContact CD-CD2 4.03Å; K24-L97 HydrophobicContact CG-CD2 3.89Å; K24-L97 WeakPolarHBondContact O-CD2 3.34Å; V26-L97 HydrophobicContact CB-CD1 4.26Å; V26-L97 HydrophobicContact CG2-CD1 4.02Å; V26-L97 HydrophobicContact CG2-CD2 4.14Å; V26-L97 HydrophobicContact CG2-CG 4.04Å; A93-L97 WeakPolarHBondContact O-CG 3.4Å; A93-L97 PolarHBondContact O-N 3.46Å; A93-L97 VanDerWaalsContact O-N 3.14Å; I94-L97 PolarHBondContact O-N 2.91Å; N95-L97 PolarHBondContact O-N 2.87Å; L97-V101 HydrophobicContact CB-CG1 3.8Å; L97-V101 HydrophobicContact CD1-CG1 3.74Å; L97-V101 HydrophobicContact CG-CG1 4.42Å
98G96.4Very high97.1Very high69 Ų6952.8 Ų52.871%0.71130%0.3SS*.THydrogen-bonded Turntrans97.220.7175.800000114.6I94 N95 S100I94-G98 PolarHBondContact O-N 3.4Å; N95-G98 PolarHBondContact O-N 3Å; N95-G98 VanDerWaalsContact O-N 3.17Å; G98-S100 VanDerWaalsContact C-N 3.3Å; G98-S100 PolarHBondContact O-N 2.96Å
99G96.2Very high97.1Very high28 Ų2849.5 Ų49.529%0.28928%0.28SS..SBendtrans80.72.3170.200000115.2I94I94-G99 WeakPolarHBondContact O-CA 3.23Å; I94-G99 PolarHBondContact O-N 3.49Å
100S95.8Very high97Very high42 Ų4245.1 Ų45.129%0.29426%0.261SS..  trans-149.8130.3174.6-700000109.7G98 K123G98-S100 VanDerWaalsContact C-N 3.3Å; G98-S100 PolarHBondContact O-N 2.96Å; S100-K123 VanDerWaalsContact CB-CE 3.43Å; S100-K123 WeakPolarHBondContact OG-CE 3.45Å
101V97.1Very high96.9Very high26 Ų2653 Ų5316%0.15829%0.29CS..BIsolated β-bridgetrans-134.2168.8-174.5-57.70000110.4I94 L97 K123 C124I94-V101 HydrophobicContact CB-CG1 4.41Å; I94-V101 HydrophobicContact CD1-CG2 4.42Å; I94-V101 HydrophobicContact CG1-CG1 4.11Å; I94-V101 HydrophobicContact CG1-CG2 3.83Å; L97-V101 HydrophobicContact CB-CG1 3.8Å; L97-V101 HydrophobicContact CD1-CG1 3.74Å; L97-V101 HydrophobicContact CG-CG1 4.42Å; V101-K123 CarbonylContact O-C 3.59Å; V101-K123 WeakPolarHBondContact O-CA 3.45Å; V101-C124 HydrophobicContact CG2-CB 4.22Å; V101-C124 PolarHBondContact N-O 3.14Å; V101-C124 PolarHBondContact O-N 3.41Å
102F95.6Very high96.7Very high96 Ų9651.5 Ų51.542%0.42128%0.284SS..  trans-118.9132.3159.173.9-85000108.1I23 L122I23-F102 HydrophobicContact CD1-CE1 4.27Å; F102-L122 WeakPolarHBondContact CA-O 3.43Å; F102-L122 HydrophobicContact CB-CB 4.17Å; F102-L122 WeakPolarHBondContact CB-O 3.19Å
103P96.6Very high96.5Very high13 Ų1345.8 Ų45.88%0.08426%0.257CS..  trans-87.3150.8-177.636.9-37.7000111P110 C124 I130 L133 F134P103-P110 HydrophobicContact CG-CG 4.38Å; P103-P110 WeakPolarHBondContact O-CD 3.3Å; P103-C124 VanDerWaalsContact CD-SG 3.51Å; P103-I130 HydrophobicContact CB-CB 4.39Å; P103-I130 HydrophobicContact CB-CD1 4.35Å; P103-I130 HydrophobicContact CB-CG1 4Å; P103-I130 HydrophobicContact CB-CG2 3.73Å; P103-I130 HydrophobicContact CG-CB 4.38Å; P103-I130 HydrophobicContact CG-CG1 4.05Å; P103-I130 HydrophobicContact CG-CG2 4.05Å; P103-L133 HydrophobicContact CG-CD1 4.27Å; P103-F134 HydrophobicContact CB-CE1 3.56Å; P103-F134 HydrophobicContact CB-CZ 3.61Å; P103-F134 HydrophobicContact CG-CD1 4.35Å; P103-F134 HydrophobicContact CG-CE1 3.7Å; P103-F134 HydrophobicContact CG-CZ 4.27Å
104K97.5Very high96.1Very high64 Ų6451.2 Ų51.228%0.27828%0.276SS..  trans-151.1157.4167.866.4161.5-75.71690110.3F11 W107 S108 A109F11-K104 HydrophobicContact CD2-CD 3.87Å; F11-K104 HydrophobicContact CE2-CD 4.3Å; K104-W107 PolarHBondContact NZ-O 3.43Å; K104-S108 WeakPolarHBondContact CB-O 3.31Å; K104-A109 HydrophobicContact CB-CB 3.9Å
105L97.7Very high95.7Very high27 Ų2758.8 Ų58.814%0.14131%0.305CS..  trans-88.9-163.6168.6-71.1-174.5000110.5L30 W107 S108 F134 I140 D143 F144L30-L105 HydrophobicContact CD2-CD2 4.3Å; L105-W107 PolarHBondContact O-N 3.21Å; L105-S108 PolarHBondContact N-O 3.11Å; L105-F134 HydrophobicContact CD2-CE2 3.88Å; L105-F134 HydrophobicContact CD2-CZ 4.27Å; L105-F134 HydrophobicContact CG-CE2 4.25Å; L105-F134 HydrophobicContact CG-CZ 4.31Å; L105-I140 HydrophobicContact CB-CD1 4.27Å; L105-I140 HydrophobicContact CD1-CB 4.48Å; L105-I140 HydrophobicContact CD1-CD1 4.06Å; L105-I140 HydrophobicContact CD1-CG2 3.7Å; L105-I140 HydrophobicContact CG-CD1 3.9Å; L105-I140 HydrophobicContact CG-CG2 4.46Å; L105-D143 HydrophobicContact CB-CB 4.3Å; L105-D143 WeakPolarHBondContact CB-OD2 3.34Å; L105-D143 HydrophobicContact CD1-CB 3.98Å; L105-F144 HydrophobicContact CD1-CD1 4.29Å; L105-F144 HydrophobicContact CD1-CD2 4.13Å; L105-F144 HydrophobicContact CD1-CE1 3.75Å; L105-F144 HydrophobicContact CD1-CE2 3.59Å; L105-F144 HydrophobicContact CD1-CG 4.45Å; L105-F144 HydrophobicContact CD1-CZ 3.38Å; L105-F144 HydrophobicContact CD2-CZ 4.17Å; L105-F144 HydrophobicContact CG-CZ 4.42Å
106N97.3Very high95.2Very high66 Ų6656.6 Ų56.635%0.35329%0.293SS..SBendtrans-53.6-41.2-177.1-70.7-24.7000112.1Q10 F11Q10-N106 HydrophobicContact CB-CB 4.4Å; Q10-N106 HydrophobicContact CG-CB 4.13Å; F11-N106 PolarHBondContact N-O 3.49Å
107W97.2Very high94.5Very high53 Ų5354.4 Ų54.420%0.20128%0.278CS..SBendtrans-117.4-50.2-173.5-56.4-79.6000111.2V6 Q10 K104 L105 D143 P147V6-W107 HydrophobicContact CG1-CZ2 3.81Å; V6-W107 PolarHBondContact O-NE1 2.78Å; Q10-W107 HydrophobicContact CG-CH2 4.34Å; Q10-W107 HydrophobicContact CG-CZ2 3.44Å; Q10-W107 VanDerWaalsContact CG-CZ2 3.44Å; K104-W107 PolarHBondContact NZ-O 3.43Å; L105-W107 PolarHBondContact O-N 3.21Å; W107-D143 HydrophobicContact CE3-CB 4.15Å; W107-D143 WeakPolarHBondContact CZ3-O 3.34Å; W107-D143 PolarHBondContact N-OD2 3.02Å; W107-P147 HydrophobicContact CE3-CB 4.11Å; W107-P147 HydrophobicContact CH2-CB 3.59Å; W107-P147 HydrophobicContact CH2-CG 4.27Å; W107-P147 HydrophobicContact CZ2-CB 4.24Å; W107-P147 HydrophobicContact CZ3-CB 3.52Å; W107-P147 HydrophobicContact CZ3-CG 4.31Å
108S97.1Very high93.5Very high27 Ų2759.5 Ų59.519%0.18930%0.302CS..  trans-107.2147.3-167.2-53.70000113.6K104 L105 D143K104-S108 WeakPolarHBondContact CB-O 3.31Å; L105-S108 PolarHBondContact N-O 3.11Å; S108-D143 WeakPolarHBondContact CB-OD1 3.48Å; S108-D143 PolarHBondContact N-OD1 2.89Å; S108-D143 PolarHBondContact N-OD2 3.22Å; S108-D143 PolarHBondContact OG-OD1 3.12Å
109A96.3Very high92.6Very high9 Ų960.4 Ų60.47%0.07429%0.291CS..  trans-100.3150.7165.500000108.9K104 R111K104-A109 HydrophobicContact CB-CB 3.9Å; A109-R111 HydrophobicContact CB-CG 4.07Å; A109-R111 PolarHBondContact O-N 2.83Å
110P95.4Very high92Very high0 Ų063 Ų630%030%0.304CS..  trans-77.753.2-174.534.2-37.2000112.4P103 D112 A113 L122 L133 F134 S137 I140P103-P110 HydrophobicContact CG-CG 4.38Å; P103-P110 WeakPolarHBondContact O-CD 3.3Å; P110-D112 VanDerWaalsContact C-N 3.31Å; P110-D112 PolarHBondContact O-N 3.46Å; P110-A113 HydrophobicContact CB-CB 4.31Å; P110-A113 PolarHBondContact O-N 3.43Å; P110-A113 VanDerWaalsContact O-N 3.16Å; P110-L122 HydrophobicContact CG-CD2 4.37Å; P110-L122 WeakPolarHBondContact O-CD2 3.27Å; P110-L133 HydrophobicContact CB-CB 4.11Å; P110-L133 HydrophobicContact CG-CB 3.87Å; P110-L133 HydrophobicContact CG-CD1 4.28Å; P110-F134 HydrophobicContact CB-CD1 4.22Å; P110-F134 HydrophobicContact CG-CD1 3.95Å; P110-F134 HydrophobicContact CG-CE1 3.94Å; P110-S137 WeakPolarHBondContact CA-OG 3.5Å; P110-I140 HydrophobicContact CB-CD1 4.38Å; P110-I140 HydrophobicContact CB-CG1 3.86Å
111R94.3Very high91.7Very high174 Ų17463.2 Ų63.266%0.65731%0.306SS*.G310 helixtrans-71.4-28.3-172.2-61.3-178.5-177.9177.21.8112.8A109 Y114 L122A109-R111 HydrophobicContact CB-CG 4.07Å; A109-R111 PolarHBondContact O-N 2.83Å; R111-Y114 VanDerWaalsContact O-CD1 3.27Å; R111-Y114 WeakPolarHBondContact O-CD1 3.44Å; R111-L122 HydrophobicContact CB-CD1 4.5Å; R111-L122 HydrophobicContact CG-CD1 3.86Å
112D94.1Very high91.5Very high42 Ų4263.7 Ų63.723%0.22531%0.308CS..G310 helixtrans-69.8-19.9172.155.1-26.7000112.9P110 W115 S137 D138 F139P110-D112 VanDerWaalsContact C-N 3.31Å; P110-D112 PolarHBondContact O-N 3.46Å; D112-W115 PolarHBondContact O-NE1 3.01Å; D112-S137 VanDerWaalsContact CG-OG 3.31Å; D112-S137 WeakPolarHBondContact OD1-CB 3.46Å; D112-S137 PolarHBondContact OD1-OG 2.96Å; D112-S137 PolarHBondContact OD2-OG 2.79Å; D112-D138 WeakPolarHBondContact OD2-CA 3.33Å; D112-D138 WeakPolarHBondContact OD2-CB 3.46Å; D112-D138 PolarHBondContact OD2-N 2.88Å; D112-F139 HydrophobicContact CB-CD1 4.41Å; D112-F139 HydrophobicContact CB-CD2 4.33Å; D112-F139 HydrophobicContact CB-CE1 4.35Å; D112-F139 HydrophobicContact CB-CE2 4.25Å; D112-F139 HydrophobicContact CB-CG 4.43Å; D112-F139 HydrophobicContact CB-CZ 4.27Å; D112-F139 WeakPolarHBondContact OD2-CD1 3.29Å; D112-F139 PolarHBondContact OD2-N 3.49Å
113A92.9Very high91.5Very high0 Ų064 Ų640%031%0.309CS..G310 helixtrans-97.88.9178.300000114P110 W115 I116 L133 S136P110-A113 HydrophobicContact CB-CB 4.31Å; P110-A113 PolarHBondContact O-N 3.43Å; P110-A113 VanDerWaalsContact O-N 3.16Å; A113-W115 PolarHBondContact O-N 3.26Å; A113-I116 WeakPolarHBondContact O-CG2 3.33Å; A113-I116 PolarHBondContact O-N 2.86Å; A113-L133 HydrophobicContact CB-CD2 4.26Å; A113-L133 WeakPolarHBondContact CB-O 3.28Å; A113-L133 WeakPolarHBondContact O-CD2 3.34Å; A113-S136 WeakPolarHBondContact CB-O 3.49Å
114Y91Very high91.4Very high126 Ų12663.4 Ų63.449%0.49431%0.305SS..G310 helixtrans-60-24.2-176.283.5-84.2000113.4R111 I116 A117 S120R111-Y114 VanDerWaalsContact O-CD1 3.27Å; R111-Y114 WeakPolarHBondContact O-CD1 3.44Å; Y114-I116 VanDerWaalsContact C-N 3.34Å; Y114-I116 PolarHBondContact O-N 2.97Å; Y114-A117 PolarHBondContact O-N 3.24Å; Y114-S120 WeakPolarHBondContact O-CA 3.45Å
115W89Confident91.2Very high162 Ų16265.8 Ų65.861%0.61432%0.316SS*.G310 helixtrans-69.2-26.5-177.965.9-92.7000113.6D112 A113 A117D112-W115 PolarHBondContact O-NE1 3.01Å; A113-W115 PolarHBondContact O-N 3.26Å; W115-A117 VanDerWaalsContact C-N 3.32Å
116I87.2Confident91Very high55 Ų5566.7 Ų66.728%0.28232%0.322SS..G310 helixtrans-79.7-19.4179.2-160.169.7000111.9A113 Y114 L132 L133A113-I116 WeakPolarHBondContact O-CG2 3.33Å; A113-I116 PolarHBondContact O-N 2.86Å; Y114-I116 VanDerWaalsContact C-N 3.34Å; Y114-I116 PolarHBondContact O-N 2.97Å; I116-L132 HydrophobicContact CG1-CD1 3.85Å; I116-L132 HydrophobicContact CG1-CD2 4.45Å; I116-L132 HydrophobicContact CG1-CG 4.16Å; I116-L132 HydrophobicContact CG2-CD1 4.38Å; I116-L132 HydrophobicContact CG2-CD2 4.37Å; I116-L132 HydrophobicContact CG2-CG 3.88Å; I116-L133 HydrophobicContact CG2-CD2 4.22Å
117A83.7Confident90.8Very high14 Ų1464.6 Ų64.612%0.11631%0.311CS..SBendtrans-72.6134.2178.400000110.9Y114 W115 N119 S120 S121 L133Y114-A117 PolarHBondContact O-N 3.24Å; W115-A117 VanDerWaalsContact C-N 3.32Å; A117-N119 PolarHBondContact O-N 2.97Å; A117-S120 PolarHBondContact O-N 2.64Å; A117-S121 VanDerWaalsContact CB-O 3.23Å; A117-S121 WeakPolarHBondContact CB-O 3.42Å; A117-L133 HydrophobicContact CB-CD2 4.08Å
118M74.8Confident90.6Very high156 Ų15665 Ų6577%0.76832%0.322SS*.THydrogen-bonded Turntrans-54-21.4-178.4-66.1176.2173.500114.7
119N78.3Confident90.3Very high89 Ų8965 Ų6548%0.47632%0.319SS..THydrogen-bonded Turntrans-114.513.5-178.763.1-0.4000113.4A117 S121A117-N119 PolarHBondContact O-N 2.97Å; N119-S121 PolarHBondContact O-N 2.79Å; N119-S121 VanDerWaalsContact O-N 3.12Å; N119-S121 VanDerWaalsContact OD1-CB 3.23Å; N119-S121 WeakPolarHBondContact OD1-CB 3.34Å; N119-S121 PolarHBondContact OD1-N 3.46Å; N119-S121 VanDerWaalsContact OD1-N 3.08Å; N119-S121 PolarHBondContact OD1-O 3.16Å
120S83.9Confident90.2Very high81 Ų8165.4 Ų65.457%0.56632%0.32SS*.SBendtrans5036.2-174.3-63.20000113.1Y114 A117Y114-S120 WeakPolarHBondContact O-CA 3.45Å; A117-S120 PolarHBondContact O-N 2.64Å
121S89.8Confident90.1Very high48 Ų4866.1 Ų66.134%0.33632%0.323SS..SBendtrans-134.7153.1-174.9-168.90000111A117 N119 K123A117-S121 VanDerWaalsContact CB-O 3.23Å; A117-S121 WeakPolarHBondContact CB-O 3.42Å; N119-S121 PolarHBondContact O-N 2.79Å; N119-S121 VanDerWaalsContact O-N 3.12Å; N119-S121 VanDerWaalsContact OD1-CB 3.23Å; N119-S121 WeakPolarHBondContact OD1-CB 3.34Å; N119-S121 PolarHBondContact OD1-N 3.46Å; N119-S121 VanDerWaalsContact OD1-N 3.08Å; N119-S121 PolarHBondContact OD1-O 3.16Å; S121-K123 PolarHBondContact O-N 3.39Å; S121-K123 PolarHBondContact OG-N 3.49Å
122L92.3Very high90Very high36 Ų3659.5 Ų59.519%0.18830%0.301CS..  trans-80.810.3171.3-56177.5000112.7F102 P110 R111 C124 L133F102-L122 WeakPolarHBondContact CA-O 3.43Å; F102-L122 HydrophobicContact CB-CB 4.17Å; F102-L122 WeakPolarHBondContact CB-O 3.19Å; P110-L122 HydrophobicContact CG-CD2 4.37Å; P110-L122 WeakPolarHBondContact O-CD2 3.27Å; R111-L122 HydrophobicContact CB-CD1 4.5Å; R111-L122 HydrophobicContact CG-CD1 3.86Å; L122-C124 PolarHBondContact O-N 3.03Å; L122-L133 HydrophobicContact CD2-CD1 4.17Å; L122-L133 HydrophobicContact CD2-CD2 4.28Å
123K94.5Very high90Very high101 Ų10157.6 Ų57.644%0.43929%0.291SS..  trans-76.4113.2-179.5-178.1-178.1-178.81760110.1S100 V101 S121S100-K123 VanDerWaalsContact CB-CE 3.43Å; S100-K123 WeakPolarHBondContact OG-CE 3.45Å; V101-K123 CarbonylContact O-C 3.59Å; V101-K123 WeakPolarHBondContact O-CA 3.45Å; S121-K123 PolarHBondContact O-N 3.39Å; S121-K123 PolarHBondContact OG-N 3.49Å
124C94.7Very high90.1Very high1 Ų158.3 Ų58.31%0.00729%0.294CS..BIsolated β-bridgetrans-108.8144.4176.3-59.50000111.2V101 P103 L122 D129 I130 L133V101-C124 HydrophobicContact CG2-CB 4.22Å; V101-C124 PolarHBondContact N-O 3.14Å; V101-C124 PolarHBondContact O-N 3.41Å; P103-C124 VanDerWaalsContact CD-SG 3.51Å; L122-C124 PolarHBondContact O-N 3.03Å; C124-D129 HydrophobicContact CB-CB 3.74Å; C124-I130 HydrophobicContact CB-CD1 4.5Å; C124-I130 HydrophobicContact CB-CG1 3.67Å; C124-L133 WeakPolarHBondContact SG-CD1 3.44Å
125K94.8Very high90.2Very high115 Ų11554.2 Ų54.250%0.528%0.279SS..SBendtrans-120.9-18.6172.9-64.5-175.2179.4178.50113.3I94 D129I94-K125 WeakPolarHBondContact CD1-O 3.44Å; K125-D129 PolarHBondContact N-OD2 3.21Å
126T93.2Very high90.3Very high46 Ų4648.5 Ų48.528%0.28226%0.263SS..SBendtrans-131.5167-178.168.20000111.3S128 D129 I130T126-S128 VanDerWaalsContact C-N 3.28Å; T126-S128 PolarHBondContact O-N 3.11Å; T126-S128 PolarHBondContact OG1-N 3.41Å; T126-D129 PolarHBondContact N-OD2 2.98Å; T126-D129 PolarHBondContact O-N 3.16Å; T126-D129 VanDerWaalsContact OG1-CG 3.22Å; T126-D129 PolarHBondContact OG1-N 2.57Å; T126-D129 PolarHBondContact OG1-OD1 3.29Å; T126-D129 PolarHBondContact OG1-OD2 3.24Å; T126-I130 PolarHBondContact O-N 3.27Å
127L93.3Very high90.7Very high22 Ų2246 Ų4612%0.11525%0.25CS..Hα-helixtrans-60.2-39.6171.7-179.660.2000111.6F86 A87 V90 D129 I130 F131F86-L127 HydrophobicContact CD1-CD1 3.99Å; F86-L127 HydrophobicContact CD1-CD2 4.33Å; F86-L127 HydrophobicContact CE1-CD1 3.82Å; A87-L127 HydrophobicContact CB-CD2 3.69Å; V90-L127 HydrophobicContact CB-CD1 4.35Å; V90-L127 HydrophobicContact CG1-CB 4.38Å; V90-L127 HydrophobicContact CG1-CD1 4.15Å; V90-L127 HydrophobicContact CG2-CD1 4.06Å; L127-D129 VanDerWaalsContact C-N 3.31Å; L127-D129 PolarHBondContact O-N 3.2Å; L127-I130 WeakPolarHBondContact O-CB 3.42Å; L127-I130 PolarHBondContact O-N 3.14Å; L127-I130 VanDerWaalsContact O-N 3.08Å; L127-F131 HydrophobicContact CD1-CD1 3.91Å; L127-F131 HydrophobicContact CD1-CD2 4.34Å; L127-F131 HydrophobicContact CD1-CE1 3.51Å; L127-F131 HydrophobicContact CD1-CE2 3.98Å; L127-F131 HydrophobicContact CD1-CG 4.32Å; L127-F131 HydrophobicContact CD1-CZ 3.56Å; L127-F131 HydrophobicContact CD2-CD2 4.42Å; L127-F131 HydrophobicContact CD2-CE2 3.69Å; L127-F131 HydrophobicContact CD2-CZ 3.79Å; L127-F131 HydrophobicContact CG-CD1 4.41Å; L127-F131 HydrophobicContact CG-CD2 3.96Å; L127-F131 HydrophobicContact CG-CE1 4.15Å; L127-F131 HydrophobicContact CG-CE2 3.66Å; L127-F131 HydrophobicContact CG-CG 4.34Å; L127-F131 HydrophobicContact CG-CZ 3.78Å; L127-F131 PolarHBondContact O-N 3.26Å
128S91.3Very high91.2Very high61 Ų6150.9 Ų50.943%0.42728%0.275SS..Hα-helixtrans-60.6-39.4179.1-46.20000112.1T126 I130 F131 L132T126-S128 VanDerWaalsContact C-N 3.28Å; T126-S128 PolarHBondContact O-N 3.11Å; T126-S128 PolarHBondContact OG1-N 3.41Å; S128-I130 VanDerWaalsContact C-N 3.29Å; S128-I130 PolarHBondContact O-N 3.37Å; S128-F131 PolarHBondContact O-N 3.28Å; S128-L132 WeakPolarHBondContact O-CB 3.37Å; S128-L132 PolarHBondContact O-N 3.45Å
129D92.3Very high92.3Very high26 Ų2646.6 Ų46.614%0.13925%0.252CS..Hα-helixtrans-61.9-39.4175.2-60.5-13.7000111.6R49 C124 K125 T126 L127 L133R49-D129 IonicContact CZ-OD1 3.74Å; R49-D129 IonicContact NH2-OD1 2.62Å; R49-D129 PolarHBondContact NH2-OD1 3.27Å; R49-D129 IonicContact NH2-OD2 3.39Å; R49-D129 PolarHBondContact NH2-OD2 3.38Å; C124-D129 HydrophobicContact CB-CB 3.74Å; K125-D129 PolarHBondContact N-OD2 3.21Å; T126-D129 PolarHBondContact N-OD2 2.98Å; T126-D129 PolarHBondContact O-N 3.16Å; T126-D129 VanDerWaalsContact OG1-CG 3.22Å; T126-D129 PolarHBondContact OG1-N 2.57Å; T126-D129 PolarHBondContact OG1-OD1 3.29Å; T126-D129 PolarHBondContact OG1-OD2 3.24Å; L127-D129 VanDerWaalsContact C-N 3.31Å; L127-D129 PolarHBondContact O-N 3.2Å; D129-L133 PolarHBondContact O-N 3.41Å
130I94.2Very high93.1Very high18 Ų1842.5 Ų42.59%0.09223%0.23CC..Hα-helixtrans-69.1-46.8179.8-64173.3000110V90 I94 P103 C124 T126 L127 S128 L132 L133 F134V90-I130 HydrophobicContact CG1-CD1 3.73Å; I94-I130 HydrophobicContact CD1-CD1 4.38Å; P103-I130 HydrophobicContact CB-CB 4.39Å; P103-I130 HydrophobicContact CB-CD1 4.35Å; P103-I130 HydrophobicContact CB-CG1 4Å; P103-I130 HydrophobicContact CB-CG2 3.73Å; P103-I130 HydrophobicContact CG-CB 4.38Å; P103-I130 HydrophobicContact CG-CG1 4.05Å; P103-I130 HydrophobicContact CG-CG2 4.05Å; C124-I130 HydrophobicContact CB-CD1 4.5Å; C124-I130 HydrophobicContact CB-CG1 3.67Å; T126-I130 PolarHBondContact O-N 3.27Å; L127-I130 WeakPolarHBondContact O-CB 3.42Å; L127-I130 PolarHBondContact O-N 3.14Å; L127-I130 VanDerWaalsContact O-N 3.08Å; S128-I130 VanDerWaalsContact C-N 3.29Å; S128-I130 PolarHBondContact O-N 3.37Å; I130-L132 VanDerWaalsContact C-N 3.31Å; I130-L132 PolarHBondContact O-N 3.24Å; I130-L133 PolarHBondContact O-N 2.97Å; I130-F134 HydrophobicContact CG2-CD1 4.34Å; I130-F134 HydrophobicContact CG2-CD2 3.93Å; I130-F134 HydrophobicContact CG2-CE1 4.29Å; I130-F134 HydrophobicContact CG2-CE2 3.85Å; I130-F134 HydrophobicContact CG2-CG 4.2Å; I130-F134 HydrophobicContact CG2-CZ 4.06Å; I130-F134 WeakPolarHBondContact O-CB 3.37Å; I130-F134 WeakPolarHBondContact O-CG 3.34Å; I130-F134 PolarHBondContact O-N 3.29Å
131F93.2Very high93.6Very high15 Ų1541.2 Ų41.27%0.06622%0.219CC..Hα-helixtrans-62.7-39.5178.2-73.8-11.8000112.1V34 Y37 L38 L44 F83 F86 L127 S128 L133 F134 K135V34-F131 HydrophobicContact CG1-CE1 3.67Å; V34-F131 HydrophobicContact CG1-CZ 3.73Å; Y37-F131 HydrophobicContact CD1-CD2 4.38Å; Y37-F131 HydrophobicContact CD1-CE2 4.23Å; Y37-F131 HydrophobicContact CD1-CZ 4.48Å; Y37-F131 AromaticContact CE1-CD2 3.71Å; Y37-F131 HydrophobicContact CE1-CD2 3.71Å; Y37-F131 AromaticContact CE1-CE2 3.95Å; Y37-F131 HydrophobicContact CE1-CE2 3.95Å; Y37-F131 HydrophobicContact CE1-CG 4.14Å; L38-F131 HydrophobicContact CD2-CD1 3.92Å; L38-F131 HydrophobicContact CD2-CE1 4.37Å; L44-F131 HydrophobicContact CD1-CB 3.63Å; L44-F131 VanDerWaalsContact CD1-O 3.31Å; L44-F131 WeakPolarHBondContact CD1-O 3.45Å; F83-F131 AromaticContact CD2-CE2 3.67Å; F83-F131 HydrophobicContact CD2-CE2 3.67Å; F83-F131 AromaticContact CD2-CZ 3.91Å; F83-F131 HydrophobicContact CD2-CZ 3.91Å; F83-F131 AromaticContact CE2-CE2 3.9Å; F83-F131 HydrophobicContact CE2-CE2 3.9Å; F83-F131 HydrophobicContact CE2-CZ 4.22Å; F86-F131 HydrophobicContact CD1-CZ 4.28Å; F86-F131 HydrophobicContact CE1-CE1 4.15Å; F86-F131 HydrophobicContact CE1-CZ 4.33Å; L127-F131 HydrophobicContact CD1-CD1 3.91Å; L127-F131 HydrophobicContact CD1-CD2 4.34Å; L127-F131 HydrophobicContact CD1-CE1 3.51Å; L127-F131 HydrophobicContact CD1-CE2 3.98Å; L127-F131 HydrophobicContact CD1-CG 4.32Å; L127-F131 HydrophobicContact CD1-CZ 3.56Å; L127-F131 HydrophobicContact CD2-CD2 4.42Å; L127-F131 HydrophobicContact CD2-CE2 3.69Å; L127-F131 HydrophobicContact CD2-CZ 3.79Å; L127-F131 HydrophobicContact CG-CD1 4.41Å; L127-F131 HydrophobicContact CG-CD2 3.96Å; L127-F131 HydrophobicContact CG-CE1 4.15Å; L127-F131 HydrophobicContact CG-CE2 3.66Å; L127-F131 HydrophobicContact CG-CG 4.34Å; L127-F131 HydrophobicContact CG-CZ 3.78Å; L127-F131 PolarHBondContact O-N 3.26Å; S128-F131 PolarHBondContact O-N 3.28Å; F131-L133 PolarHBondContact O-N 3.26Å; F131-F134 PolarHBondContact O-N 3.45Å; F131-K135 WeakPolarHBondContact O-CB 3.4Å; F131-K135 PolarHBondContact O-N 3.45Å
132L91.6Very high93.9Very high35 Ų3544.4 Ų44.418%0.18322%0.224CC..Hα-helixtrans-57.2-51.1176-177.666.1000110.7L44 V46 I116 S128 I130 F134 S136L44-L132 HydrophobicContact CD2-CD1 4.35Å; V46-L132 HydrophobicContact CG2-CD1 4.4Å; I116-L132 HydrophobicContact CG1-CD1 3.85Å; I116-L132 HydrophobicContact CG1-CD2 4.45Å; I116-L132 HydrophobicContact CG1-CG 4.16Å; I116-L132 HydrophobicContact CG2-CD1 4.38Å; I116-L132 HydrophobicContact CG2-CD2 4.37Å; I116-L132 HydrophobicContact CG2-CG 3.88Å; S128-L132 WeakPolarHBondContact O-CB 3.37Å; S128-L132 PolarHBondContact O-N 3.45Å; I130-L132 VanDerWaalsContact C-N 3.31Å; I130-L132 PolarHBondContact O-N 3.24Å; L132-F134 PolarHBondContact O-N 2.82Å; L132-S136 WeakPolarHBondContact O-CB 3.38Å; L132-S136 PolarHBondContact O-N 3.09Å; L132-S136 PolarHBondContact O-OG 3.1Å; L132-S136 VanDerWaalsContact O-OG 3.1Å
133L93.5Very high94.1Very high3 Ų343.4 Ų43.42%0.01622%0.218CC..Hα-helixtrans-65-39.6177.7-72.1178.9000112.9P103 P110 A113 I116 A117 L122 C124 D129 I130 F131 S137P103-L133 HydrophobicContact CG-CD1 4.27Å; P110-L133 HydrophobicContact CB-CB 4.11Å; P110-L133 HydrophobicContact CG-CB 3.87Å; P110-L133 HydrophobicContact CG-CD1 4.28Å; A113-L133 HydrophobicContact CB-CD2 4.26Å; A113-L133 WeakPolarHBondContact CB-O 3.28Å; A113-L133 WeakPolarHBondContact O-CD2 3.34Å; I116-L133 HydrophobicContact CG2-CD2 4.22Å; A117-L133 HydrophobicContact CB-CD2 4.08Å; L122-L133 HydrophobicContact CD2-CD1 4.17Å; L122-L133 HydrophobicContact CD2-CD2 4.28Å; C124-L133 WeakPolarHBondContact SG-CD1 3.44Å; D129-L133 PolarHBondContact O-N 3.41Å; I130-L133 PolarHBondContact O-N 2.97Å; F131-L133 PolarHBondContact O-N 3.26Å; L133-S137 VanDerWaalsContact O-CB 3.28Å; L133-S137 WeakPolarHBondContact O-CB 3.16Å; L133-S137 PolarHBondContact O-N 2.65Å
134F95.1Very high94.1Very high14 Ų1441 Ų416%0.06121%0.208CC..Hα-helixtrans-71-42.4-176.3-80.610000112.4L38 P103 L105 P110 I130 F131 L132 S136 S137 I140L38-F134 HydrophobicContact CD1-CD2 3.98Å; L38-F134 HydrophobicContact CD2-CB 3.76Å; L38-F134 HydrophobicContact CD2-CD2 4.48Å; P103-F134 HydrophobicContact CB-CE1 3.56Å; P103-F134 HydrophobicContact CB-CZ 3.61Å; P103-F134 HydrophobicContact CG-CD1 4.35Å; P103-F134 HydrophobicContact CG-CE1 3.7Å; P103-F134 HydrophobicContact CG-CZ 4.27Å; L105-F134 HydrophobicContact CD2-CE2 3.88Å; L105-F134 HydrophobicContact CD2-CZ 4.27Å; L105-F134 HydrophobicContact CG-CE2 4.25Å; L105-F134 HydrophobicContact CG-CZ 4.31Å; P110-F134 HydrophobicContact CB-CD1 4.22Å; P110-F134 HydrophobicContact CG-CD1 3.95Å; P110-F134 HydrophobicContact CG-CE1 3.94Å; I130-F134 HydrophobicContact CG2-CD1 4.34Å; I130-F134 HydrophobicContact CG2-CD2 3.93Å; I130-F134 HydrophobicContact CG2-CE1 4.29Å; I130-F134 HydrophobicContact CG2-CE2 3.85Å; I130-F134 HydrophobicContact CG2-CG 4.2Å; I130-F134 HydrophobicContact CG2-CZ 4.06Å; I130-F134 WeakPolarHBondContact O-CB 3.37Å; I130-F134 WeakPolarHBondContact O-CG 3.34Å; I130-F134 PolarHBondContact O-N 3.29Å; F131-F134 PolarHBondContact O-N 3.45Å; L132-F134 PolarHBondContact O-N 2.82Å; F134-S136 VanDerWaalsContact C-N 3.28Å; F134-S136 PolarHBondContact O-N 3.37Å; F134-S137 PolarHBondContact O-N 2.92Å; F134-I140 HydrophobicContact CB-CG2 4.08Å; F134-I140 HydrophobicContact CD1-CD1 4.15Å; F134-I140 HydrophobicContact CD1-CG1 3.9Å; F134-I140 HydrophobicContact CE1-CD1 4.03Å; F134-I140 HydrophobicContact CE1-CG1 4.31Å; F134-I140 HydrophobicContact CG-CG1 4.34Å; F134-I140 HydrophobicContact CG-CG2 4.22Å
135K92.9Very high94.1Very high41 Ų4144.5 Ų44.518%0.17823%0.229CC..Hα-helixtrans-69.4-26.7176.8-71.5-167.870.269.10112.6Y37 L38 D40 G42 L44 F131Y37-K135 HydrophobicContact CE1-CD 4.1Å; Y37-K135 PolarHBondContact O-NZ 3.06Å; L38-K135 HydrophobicContact CD2-CG 3.88Å; D40-K135 PolarHBondContact O-NZ 3.2Å; G42-K135 WeakPolarHBondContact O-CE 3.36Å; L44-K135 HydrophobicContact CB-CD 3.98Å; L44-K135 HydrophobicContact CD1-CB 4.17Å; L44-K135 HydrophobicContact CD1-CD 3.47Å; L44-K135 VanDerWaalsContact CD1-CD 3.47Å; L44-K135 HydrophobicContact CD1-CG 3.95Å; L44-K135 HydrophobicContact CG-CD 4.08Å; F131-K135 WeakPolarHBondContact O-CB 3.4Å; F131-K135 PolarHBondContact O-N 3.45Å
136S92.3Very high94Very high42 Ų4243.5 Ų43.529%0.29423%0.226SC..THydrogen-bonded Turntrans-91.98.1179.6-59.10000114.5A113 L132 F134A113-S136 WeakPolarHBondContact CB-O 3.49Å; L132-S136 WeakPolarHBondContact O-CB 3.38Å; L132-S136 PolarHBondContact O-N 3.09Å; L132-S136 PolarHBondContact O-OG 3.1Å; L132-S136 VanDerWaalsContact O-OG 3.1Å; F134-S136 VanDerWaalsContact C-N 3.28Å; F134-S136 PolarHBondContact O-N 3.37Å
137S95.3Very high94Very high1 Ų143.2 Ų43.21%0.00723%0.225CC..  trans-114.5119.8-174.7173.90000112.6P110 D112 L133 F134 F139 I140 T141P110-S137 WeakPolarHBondContact CA-OG 3.5Å; D112-S137 VanDerWaalsContact CG-OG 3.31Å; D112-S137 WeakPolarHBondContact OD1-CB 3.46Å; D112-S137 PolarHBondContact OD1-OG 2.96Å; D112-S137 PolarHBondContact OD2-OG 2.79Å; L133-S137 VanDerWaalsContact O-CB 3.28Å; L133-S137 WeakPolarHBondContact O-CB 3.16Å; L133-S137 PolarHBondContact O-N 2.65Å; F134-S137 PolarHBondContact O-N 2.92Å; S137-F139 PolarHBondContact O-N 3.47Å; S137-F139 PolarHBondContact OG-N 3.13Å; S137-I140 PolarHBondContact O-N 3.49Å; S137-I140 WeakPolarHBondContact OG-CG1 3.22Å; S137-I140 PolarHBondContact OG-N 3.38Å; S137-T141 PolarHBondContact O-N 3.41Å; S137-T141 VanDerWaalsContact O-N 3.14Å; S137-T141 PolarHBondContact O-OG1 2.67Å
138D94.9Very high94.1Very high117 Ų11744.4 Ų44.463%0.62623%0.23SC*.Hα-helixtrans-64.4-33.1170.7-68.4-26.9000111.1D112 I140 T141 R142D112-D138 WeakPolarHBondContact OD2-CA 3.33Å; D112-D138 WeakPolarHBondContact OD2-CB 3.46Å; D112-D138 PolarHBondContact OD2-N 2.88Å; D138-I140 VanDerWaalsContact C-N 3.28Å; D138-I140 PolarHBondContact O-N 2.78Å; D138-T141 PolarHBondContact O-N 3.11Å; D138-R142 WeakPolarHBondContact O-CG 3.46Å; D138-R142 PolarHBondContact O-N 3.32Å
139F96.4Very high94.1Very high67 Ų6746.2 Ų46.229%0.29423%0.233SC..Hα-helixtrans-62.3-39.3177.6-68.10.7000111.6D112 S137 R142 D143D112-F139 HydrophobicContact CB-CD1 4.41Å; D112-F139 HydrophobicContact CB-CD2 4.33Å; D112-F139 HydrophobicContact CB-CE1 4.35Å; D112-F139 HydrophobicContact CB-CE2 4.25Å; D112-F139 HydrophobicContact CB-CG 4.43Å; D112-F139 HydrophobicContact CB-CZ 4.27Å; D112-F139 WeakPolarHBondContact OD2-CD1 3.29Å; D112-F139 PolarHBondContact OD2-N 3.49Å; S137-F139 PolarHBondContact O-N 3.47Å; S137-F139 PolarHBondContact OG-N 3.13Å; F139-R142 VanDerWaalsContact CE1-NH2 3.27Å; F139-D143 PolarHBondContact O-N 3.25Å; F139-D143 VanDerWaalsContact O-N 3.11Å
140I96.3Very high94Very high2 Ų252.1 Ų52.11%0.0126%0.26CS..Hα-helixtrans-68.9-44.2175.6-65.7-49.9000111.1L105 P110 F134 S137 D138 R142 D143 F144L105-I140 HydrophobicContact CB-CD1 4.27Å; L105-I140 HydrophobicContact CD1-CB 4.48Å; L105-I140 HydrophobicContact CD1-CD1 4.06Å; L105-I140 HydrophobicContact CD1-CG2 3.7Å; L105-I140 HydrophobicContact CG-CD1 3.9Å; L105-I140 HydrophobicContact CG-CG2 4.46Å; P110-I140 HydrophobicContact CB-CD1 4.38Å; P110-I140 HydrophobicContact CB-CG1 3.86Å; F134-I140 HydrophobicContact CB-CG2 4.08Å; F134-I140 HydrophobicContact CD1-CD1 4.15Å; F134-I140 HydrophobicContact CD1-CG1 3.9Å; F134-I140 HydrophobicContact CE1-CD1 4.03Å; F134-I140 HydrophobicContact CE1-CG1 4.31Å; F134-I140 HydrophobicContact CG-CG1 4.34Å; F134-I140 HydrophobicContact CG-CG2 4.22Å; S137-I140 PolarHBondContact O-N 3.49Å; S137-I140 WeakPolarHBondContact OG-CG1 3.22Å; S137-I140 PolarHBondContact OG-N 3.38Å; D138-I140 VanDerWaalsContact C-N 3.28Å; D138-I140 PolarHBondContact O-N 2.78Å; I140-R142 VanDerWaalsContact C-N 3.31Å; I140-R142 PolarHBondContact O-N 2.92Å; I140-D143 WeakPolarHBondContact O-CB 3.17Å; I140-D143 PolarHBondContact O-N 2.91Å; I140-D143 VanDerWaalsContact O-N 3.16Å; I140-F144 HydrophobicContact CG2-CD2 4.17Å; I140-F144 HydrophobicContact CG2-CE2 3.74Å; I140-F144 WeakPolarHBondContact O-CD2 3.49Å; I140-F144 PolarHBondContact O-N 3.31Å
141T95.1Very high93.9Very high54 Ų5451.9 Ų51.933%0.33126%0.259SS..Hα-helixtrans-58.4-41.9175.8-59.60000112.2S137 D138 F144 T145S137-T141 PolarHBondContact O-N 3.41Å; S137-T141 VanDerWaalsContact O-N 3.14Å; S137-T141 PolarHBondContact O-OG1 2.67Å; D138-T141 PolarHBondContact O-N 3.11Å; T141-F144 PolarHBondContact O-N 2.98Å; T141-T145 HydrophobicContact CG2-CG2 4.43Å; T141-T145 WeakPolarHBondContact O-CB 3.29Å; T141-T145 WeakPolarHBondContact O-CG2 3.47Å; T141-T145 PolarHBondContact O-N 3.4Å; T141-T145 PolarHBondContact O-OG1 2.82Å
142R94.9Very high93.8Very high116 Ų11656.5 Ų56.544%0.43829%0.289SS..Hα-helixtrans-66.5-38.9175.6-70.6-174-41.4-152.63.8112.9D138 F139 I140 F144 T145 Q146D138-R142 WeakPolarHBondContact O-CG 3.46Å; D138-R142 PolarHBondContact O-N 3.32Å; F139-R142 VanDerWaalsContact CE1-NH2 3.27Å; I140-R142 VanDerWaalsContact C-N 3.31Å; I140-R142 PolarHBondContact O-N 2.92Å; R142-F144 PolarHBondContact O-N 3.16Å; R142-T145 PolarHBondContact O-N 2.87Å; R142-Q146 CarbonylContact O-C 3.28Å; R142-Q146 VanDerWaalsContact O-C 3.28Å; R142-Q146 WeakPolarHBondContact O-CA 3.41Å; R142-Q146 PolarHBondContact O-N 3.36Å
143D95.9Very high93.6Very high14 Ų1458.3 Ų58.38%0.07530%0.299CS..Hα-helixtrans-57.3-33.3175.4-94.836.8000111.3L105 W107 S108 F139 I140L105-D143 HydrophobicContact CB-CB 4.3Å; L105-D143 WeakPolarHBondContact CB-OD2 3.34Å; L105-D143 HydrophobicContact CD1-CB 3.98Å; W107-D143 HydrophobicContact CE3-CB 4.15Å; W107-D143 WeakPolarHBondContact CZ3-O 3.34Å; W107-D143 PolarHBondContact N-OD2 3.02Å; S108-D143 WeakPolarHBondContact CB-OD1 3.48Å; S108-D143 PolarHBondContact N-OD1 2.89Å; S108-D143 PolarHBondContact N-OD2 3.22Å; S108-D143 PolarHBondContact OG-OD1 3.12Å; F139-D143 PolarHBondContact O-N 3.25Å; F139-D143 VanDerWaalsContact O-N 3.11Å; I140-D143 WeakPolarHBondContact O-CB 3.17Å; I140-D143 PolarHBondContact O-N 2.91Å; I140-D143 VanDerWaalsContact O-N 3.16Å
144F94.6Very high92.7Very high51 Ų5161.4 Ų61.422%0.22432%0.316CS..Hα-helixtrans-81.1-45.5175.6-71.5-53.5000114.3L30 K35 L38 L39 L105 I140 T141 R142L30-F144 HydrophobicContact CD2-CE1 3.65Å; L30-F144 HydrophobicContact CD2-CZ 3.48Å; L30-F144 VanDerWaalsContact CD2-CZ 3.48Å; K35-F144 HydrophobicContact CG-CE1 4.01Å; L38-F144 HydrophobicContact CB-CE2 4.09Å; L38-F144 HydrophobicContact CD1-CE2 4.06Å; L38-F144 HydrophobicContact CD1-CZ 3.92Å; L39-F144 HydrophobicContact CD1-CB 4.35Å; L39-F144 HydrophobicContact CD2-CB 3.83Å; L39-F144 HydrophobicContact CD2-CD2 3.98Å; L39-F144 HydrophobicContact CD2-CG 4.19Å; L39-F144 HydrophobicContact CG-CB 4.43Å; L39-F144 HydrophobicContact CG-CD2 4.29Å; L39-F144 HydrophobicContact CG-CG 4.46Å; L105-F144 HydrophobicContact CD1-CD1 4.29Å; L105-F144 HydrophobicContact CD1-CD2 4.13Å; L105-F144 HydrophobicContact CD1-CE1 3.75Å; L105-F144 HydrophobicContact CD1-CE2 3.59Å; L105-F144 HydrophobicContact CD1-CG 4.45Å; L105-F144 HydrophobicContact CD1-CZ 3.38Å; L105-F144 HydrophobicContact CD2-CZ 4.17Å; L105-F144 HydrophobicContact CG-CZ 4.42Å; I140-F144 HydrophobicContact CG2-CD2 4.17Å; I140-F144 HydrophobicContact CG2-CE2 3.74Å; I140-F144 WeakPolarHBondContact O-CD2 3.49Å; I140-F144 PolarHBondContact O-N 3.31Å; T141-F144 PolarHBondContact O-N 2.98Å; R142-F144 PolarHBondContact O-N 3.16Å
145T94.3Very high91.2Very high74 Ų7464.8 Ų64.845%0.45434%0.341SS..Hα-helixtrans-98.7-28.9-164.357.10000113.6L39 T141 R142L39-T145 HydrophobicContact CD2-CG2 3.88Å; T141-T145 HydrophobicContact CG2-CG2 4.43Å; T141-T145 WeakPolarHBondContact O-CB 3.29Å; T141-T145 WeakPolarHBondContact O-CG2 3.47Å; T141-T145 PolarHBondContact O-N 3.4Å; T141-T145 PolarHBondContact O-OG1 2.82Å; R142-T145 PolarHBondContact O-N 2.87Å
146Q93.9Very high89.7Confident95 Ų9569 Ų6944%0.44437%0.372SS..  trans-138.939.1-169.7-63.6177.523.600113.6R142 F148 I149R142-Q146 CarbonylContact O-C 3.28Å; R142-Q146 VanDerWaalsContact O-C 3.28Å; R142-Q146 WeakPolarHBondContact O-CA 3.41Å; R142-Q146 PolarHBondContact O-N 3.36Å; Q146-F148 PolarHBondContact O-N 2.91Å; Q146-F148 VanDerWaalsContact O-N 3.16Å; Q146-I149 HydrophobicContact CB-CB 4.17Å; Q146-I149 HydrophobicContact CB-CD1 4.4Å; Q146-I149 HydrophobicContact CB-CG2 4.35Å; Q146-I149 HydrophobicContact CG-CD1 4.36Å; Q146-I149 WeakPolarHBondContact O-CG2 3.45Å; Q146-I149 PolarHBondContact O-N 3.33Å
147P93.6Very high87.6Confident40 Ų4078.4 Ų78.426%0.2642%0.419SS..THydrogen-bonded Turntrans-64.3-24.9-17626.2-34.7000113.5W107W107-P147 HydrophobicContact CE3-CB 4.11Å; W107-P147 HydrophobicContact CH2-CB 3.59Å; W107-P147 HydrophobicContact CH2-CG 4.27Å; W107-P147 HydrophobicContact CZ2-CB 4.24Å; W107-P147 HydrophobicContact CZ3-CB 3.52Å; W107-P147 HydrophobicContact CZ3-CG 4.31Å
148F94.4Very high87.2Confident47 Ų4782.3 Ų82.321%0.20644%0.44CS..THydrogen-bonded Turntrans-112.712.2-175-53.7-67.1000114K3 V6 L7 Q146 H150 C151 D154K3-F148 HydrophobicContact CB-CD1 4.38Å; K3-F148 HydrophobicContact CG-CB 4.5Å; K3-F148 HydrophobicContact CG-CD1 4.11Å; K3-F148 HydrophobicContact CG-CG 4.34Å; V6-F148 HydrophobicContact CB-CD1 3.79Å; V6-F148 HydrophobicContact CB-CE1 3.75Å; V6-F148 HydrophobicContact CG1-CD1 3.74Å; V6-F148 HydrophobicContact CG1-CE1 3.58Å; V6-F148 HydrophobicContact CG2-CD1 4.18Å; L7-F148 HydrophobicContact CD2-CE1 3.99Å; L7-F148 HydrophobicContact CD2-CZ 3.72Å; L7-F148 HydrophobicContact CG-CE1 4.14Å; L7-F148 HydrophobicContact CG-CZ 4.32Å; Q146-F148 PolarHBondContact O-N 2.91Å; Q146-F148 VanDerWaalsContact O-N 3.16Å; F148-H150 PolarHBondContact O-N 2.66Å; F148-C151 HydrophobicContact CB-CB 4.17Å; F148-C151 WeakPolarHBondContact O-CA 3.48Å; F148-C151 WeakPolarHBondContact O-CB 3.48Å; F148-C151 PolarHBondContact O-N 2.96Å; F148-D154 HydrophobicContact CB-CB 4.29Å; F148-D154 VanDerWaalsContact CB-OD2 3.29Å; F148-D154 WeakPolarHBondContact CB-OD2 3.42Å
149I92.3Very high86.8Confident98 Ų9880.4 Ų80.450%0.50343%0.43SS..THydrogen-bonded Turntrans-54.7-24.1-174-170.5163.4000115.2Q146Q146-I149 HydrophobicContact CB-CB 4.17Å; Q146-I149 HydrophobicContact CB-CD1 4.4Å; Q146-I149 HydrophobicContact CB-CG2 4.35Å; Q146-I149 HydrophobicContact CG-CD1 4.36Å; Q146-I149 WeakPolarHBondContact O-CG2 3.45Å; Q146-I149 PolarHBondContact O-N 3.33Å
150H90.3Very high86.3Confident151 Ų15181.2 Ų81.270%0.69944%0.438SS*.THydrogen-bonded Turntrans-102.311.3177.7-56.9-51.6000113.8M1 F148M1-H150 WeakPolarHBondContact CB-O 3.34Å; M1-H150 PolarHBondContact N-O 2.76Å; M1-H150 VanDerWaalsContact N-O 3.11Å; F148-H150 PolarHBondContact O-N 2.66Å
151C91.9Very high85.7Confident12 Ų1285.8 Ų85.88%0.08146%0.463CS..  trans-85.8128177.9-65.20000110.5M1 K3 V6 F148 D153 D154M1-C151 CarbonylContact O-C 3.53Å; M1-C151 WeakPolarHBondContact O-CA 3.48Å; K3-C151 HydrophobicContact CG-CB 3.93Å; V6-C151 VanDerWaalsContact CG2-SG 3.54Å; F148-C151 HydrophobicContact CB-CB 4.17Å; F148-C151 WeakPolarHBondContact O-CA 3.48Å; F148-C151 WeakPolarHBondContact O-CB 3.48Å; F148-C151 PolarHBondContact O-N 2.96Å; C151-D153 VanDerWaalsContact C-N 3.27Å; C151-D153 WeakPolarHBondContact CB-OD1 3.5Å; C151-D153 PolarHBondContact O-N 3Å; C151-D154 HydrophobicContact CB-CB 3.88Å; C151-D154 PolarHBondContact O-N 2.94Å
152T89.9Confident85.1Confident113 Ų11387.8 Ų87.869%0.69347%0.471SS*.THydrogen-bonded Turntrans-77.3-19-177.947.50000112.6M1M1-T152 PolarHBondContact O-N 2.97Å; M1-T152 PolarHBondContact O-OG1 2.84Å; M1-T152 VanDerWaalsContact O-OG1 3.13Å
153D88.6Confident84.5Confident72 Ų7285.9 Ų85.939%0.38547%0.473SS..THydrogen-bonded Turntrans-98.511.6176.356.6-27.7000112.3K2 K3 C151 S155K2-D153 VanDerWaalsContact CA-OD1 3.29Å; K2-D153 WeakPolarHBondContact CA-OD1 3.44Å; K3-D153 WeakPolarHBondContact CE-O 2.83Å; K3-D153 VanDerWaalsContact N-CG 3.32Å; K3-D153 PolarHBondContact N-OD1 3.07Å; K3-D153 PolarHBondContact N-OD2 3.14Å; K3-D153 PolarHBondContact NZ-O 2.75Å; C151-D153 VanDerWaalsContact C-N 3.27Å; C151-D153 WeakPolarHBondContact CB-OD1 3.5Å; C151-D153 PolarHBondContact O-N 3Å; D153-S155 PolarHBondContact O-N 3.13Å
154D74.8Confident83.7Confident69 Ų6991.1 Ų91.137%0.36950%0.502SS..  trans-97.662168.9-160.129.1000110.7K3 F148 C151K3-D154 HydrophobicContact CD-CB 4.49Å; K3-D154 WeakPolarHBondContact CE-OD1 3.49Å; K3-D154 HydrophobicContact CG-CB 4.46Å; K3-D154 IonicContact NZ-OD1 2.66Å; K3-D154 PolarHBondContact NZ-OD1 2.78Å; F148-D154 HydrophobicContact CB-CB 4.29Å; F148-D154 VanDerWaalsContact CB-OD2 3.29Å; F148-D154 WeakPolarHBondContact CB-OD2 3.42Å; C151-D154 HydrophobicContact CB-CB 3.88Å; C151-D154 PolarHBondContact O-N 2.94Å
155S62.9Low82.8Confident85 Ų8594.2 Ų94.259%0.59452%0.523SS*.  trans-80.9134.9166.9-55.50000108.3D153 D157D153-S155 PolarHBondContact O-N 3.13Å; S155-D157 PolarHBondContact O-N 2.92Å
156P61.3Low81.9Confident128 Ų12895.8 Ų95.883%0.83153%0.529SS*.  trans-64125.6170.526-30.4000108.6
157D48.2Very low80.8Confident240 Ų24095.9 Ų95.9100%1.28354%0.537SS*.  trans-660162.5-80.6-36.2000110.2S155S155-D157 PolarHBondContact O-N 2.92Å

Retrieved 157 of 157 residues in 31.3 ms (Link to these results)

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