A0A096MIA1_POEFO Loading...

Proteasome 20S subunit beta 7

AlphaFold DB , UniProt , Accession A0A096MIA1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 166 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
1E32.9Very low62.6Low241 Ų241114.3 Ų114.3100%1.12658%0.577SS**  0106.90-74.8175.4133.700109.9K3E1-K3 PolarHBondContact O-N 3.25Å; E1-K3 VanDerWaalsContact O-N 3.15Å
2T28.5Very low65.1Low146 Ų146105.8 Ų105.890%0.89653%0.534SS*.  trans-81.991.6177.1-26.60000107.4M4T2-M4 PolarHBondContact O-N 3.39Å
3K40.1Very low67.1Low183 Ų183103.4 Ų103.480%0.79652%0.52SS*.  trans-60.4106.7163.4-80-176.5177.2-179.60106.1E1 L5E1-K3 PolarHBondContact O-N 3.25Å; E1-K3 VanDerWaalsContact O-N 3.15Å; K3-L5 VanDerWaalsContact C-N 3.28Å; K3-L5 PolarHBondContact O-N 3.44Å
4M40.8Very low69Low141 Ų141100.5 Ų100.570%0.69551%0.514SS*.  trans-62.895.7171.8-168.4166.3179.100106.5T2 F6T2-M4 PolarHBondContact O-N 3.39Å; M4-F6 VanDerWaalsContact C-N 3.32Å; M4-F6 HydrophobicContact CB-CD2 4.48Å; M4-F6 HydrophobicContact CB-CE2 4.11Å; M4-F6 HydrophobicContact CE-CE1 3.8Å; M4-F6 HydrophobicContact CE-CE2 4.48Å; M4-F6 HydrophobicContact CE-CZ 3.67Å; M4-F6 HydrophobicContact CG-CD2 4.25Å; M4-F6 HydrophobicContact CG-CE2 3.81Å; M4-F6 HydrophobicContact CG-CZ 3.95Å; M4-F6 WeakPolarHBondContact O-CD2 3.47Å; M4-F6 PolarHBondContact O-N 3.15Å; M4-F6 HydrophobicContact SD-CE1 4.29Å; M4-F6 HydrophobicContact SD-CE2 3.91Å; M4-F6 HydrophobicContact SD-CZ 3.58Å; M4-F6 VanDerWaalsContact SD-CZ 3.58Å
5L53.1Low70.5Confident124 Ų12496.1 Ų96.165%0.64949%0.494SS*.  trans-68.295.2173.5-99.6109000107K3 M7K3-L5 VanDerWaalsContact C-N 3.28Å; K3-L5 PolarHBondContact O-N 3.44Å; L5-M7 PolarHBondContact O-N 2.84Å
6F63.5Low71.9Confident137 Ų13794.3 Ų94.360%0.60148%0.481SS*.  trans-68.9110.8167.5-75.2-81.5000108.1M4M4-F6 VanDerWaalsContact C-N 3.32Å; M4-F6 HydrophobicContact CB-CD2 4.48Å; M4-F6 HydrophobicContact CB-CE2 4.11Å; M4-F6 HydrophobicContact CE-CE1 3.8Å; M4-F6 HydrophobicContact CE-CE2 4.48Å; M4-F6 HydrophobicContact CE-CZ 3.67Å; M4-F6 HydrophobicContact CG-CD2 4.25Å; M4-F6 HydrophobicContact CG-CE2 3.81Å; M4-F6 HydrophobicContact CG-CZ 3.95Å; M4-F6 WeakPolarHBondContact O-CD2 3.47Å; M4-F6 PolarHBondContact O-N 3.15Å; M4-F6 HydrophobicContact SD-CE1 4.29Å; M4-F6 HydrophobicContact SD-CE2 3.91Å; M4-F6 HydrophobicContact SD-CZ 3.58Å; M4-F6 VanDerWaalsContact SD-CZ 3.58Å
7M79.3Confident73.1Confident72 Ų7297.4 Ų97.436%0.35549%0.487SS..  trans-64.3137.7171.3-65.6-177.585.500109.4L5 S9 H10 C11L5-M7 PolarHBondContact O-N 2.84Å; M7-S9 WeakPolarHBondContact CB-OG 3.36Å; M7-S9 PolarHBondContact O-N 3.03Å; M7-S9 VanDerWaalsContact O-N 3.16Å; M7-H10 HydrophobicContact CB-CB 4.49Å; M7-H10 WeakPolarHBondContact O-CB 3.34Å; M7-H10 PolarHBondContact O-N 2.8Å; M7-C11 PolarHBondContact O-N 2.91Å
8A84.2Confident74.2Confident9 Ų997.2 Ų97.27%0.07449%0.487CS..Hα-helixtrans-56.8-33.2177.700000111.7H10 C11 N12 H41 Y43A8-H10 VanDerWaalsContact C-N 3.35Å; A8-H10 PolarHBondContact O-N 2.89Å; A8-C11 PolarHBondContact O-N 3.3Å; A8-N12 WeakPolarHBondContact O-CB 3.3Å; A8-N12 PolarHBondContact O-N 3.07Å; A8-H41 HydrophobicContact CB-CB 4.12Å; A8-Y43 HydrophobicContact CB-CE2 4.14Å
9S85.8Confident75.3Confident45 Ų4592.3 Ų92.332%0.31546%0.463SS..Hα-helixtrans-61.8-37.1173.957.90000113.6M7 Q13M7-S9 WeakPolarHBondContact CB-OG 3.36Å; M7-S9 PolarHBondContact O-N 3.03Å; M7-S9 VanDerWaalsContact O-N 3.16Å; S9-Q13 PolarHBondContact O-N 2.77Å; S9-Q13 VanDerWaalsContact O-N 3.07Å
10H90.4Very high76.2Confident111 Ų11193.5 Ų93.551%0.51447%0.465SS..Hα-helixtrans-69.3-45.5178.1-169.882.5000110.9M7 A8 N12 Q13 S14M7-H10 HydrophobicContact CB-CB 4.49Å; M7-H10 WeakPolarHBondContact O-CB 3.34Å; M7-H10 PolarHBondContact O-N 2.8Å; A8-H10 VanDerWaalsContact C-N 3.35Å; A8-H10 PolarHBondContact O-N 2.89Å; H10-N12 VanDerWaalsContact C-N 3.32Å; H10-N12 PolarHBondContact O-N 3.12Å; H10-Q13 PolarHBondContact O-N 3.08Å; H10-S14 PolarHBondContact O-N 2.68Å; H10-S14 PolarHBondContact O-OG 3.36Å
11C90.6Very high77.1Confident48 Ų4898.8 Ų98.832%0.32448%0.48SS..Hα-helixtrans-57.9-46.1175-174.70000111.2M7 A8 Q13 S14 V15 L32M7-C11 PolarHBondContact O-N 2.91Å; A8-C11 PolarHBondContact O-N 3.3Å; C11-Q13 VanDerWaalsContact C-N 3.32Å; C11-Q13 PolarHBondContact O-N 3.3Å; C11-S14 PolarHBondContact O-N 2.76Å; C11-V15 WeakPolarHBondContact O-CG2 3.18Å; C11-V15 PolarHBondContact O-N 3.47Å; C11-L32 HydrophobicContact CB-CD1 4.45Å; C11-L32 HydrophobicContact CB-CD2 4.08Å
12N91.6Very high80Confident12 Ų1292.8 Ų92.86%0.06445%0.448CS..Hα-helixtrans-55.1-47.7175.7-175.929.8000111.6A8 H10 S14 V15 K16 L32 Y43 I45 T51A8-N12 WeakPolarHBondContact O-CB 3.3Å; A8-N12 PolarHBondContact O-N 3.07Å; H10-N12 VanDerWaalsContact C-N 3.32Å; H10-N12 PolarHBondContact O-N 3.12Å; N12-S14 PolarHBondContact O-N 2.91Å; N12-V15 PolarHBondContact O-N 3.26Å; N12-K16 WeakPolarHBondContact O-CB 3.48Å; N12-K16 PolarHBondContact O-N 3.3Å; N12-L32 HydrophobicContact CB-CD2 3.76Å; N12-Y43 HydrophobicContact CB-CD2 4.34Å; N12-Y43 HydrophobicContact CB-CE2 4.49Å; N12-Y43 HydrophobicContact CB-CG 4.41Å; N12-Y43 WeakPolarHBondContact ND2-CD1 3.41Å; N12-I45 WeakPolarHBondContact OD1-CD1 3.36Å; N12-T51 WeakPolarHBondContact OD1-CG2 3.37Å
13Q92.3Very high83.1Confident75 Ų7591.9 Ų91.935%0.3543%0.433SS..Hα-helixtrans-64.7-42.9-178.5-164.668.70.100112.3S9 H10 C11 Y17S9-Q13 PolarHBondContact O-N 2.77Å; S9-Q13 VanDerWaalsContact O-N 3.07Å; H10-Q13 PolarHBondContact O-N 3.08Å; C11-Q13 VanDerWaalsContact C-N 3.32Å; C11-Q13 PolarHBondContact O-N 3.3Å; Q13-Y17 HydrophobicContact CG-CD2 3.8Å; Q13-Y17 HydrophobicContact CG-CE2 3.44Å; Q13-Y17 VanDerWaalsContact CG-CE2 3.44Å; Q13-Y17 PolarHBondContact NE2-OH 3.37Å; Q13-Y17 WeakPolarHBondContact O-CD2 3.45Å; Q13-Y17 PolarHBondContact O-N 3Å
14S92.5Very high85.4Confident63 Ų6384.6 Ų84.644%0.44141%0.41SS..Hα-helixtrans-60.9-47.6177.1-58.90000112H10 C11 N12 L18H10-S14 PolarHBondContact O-N 2.68Å; H10-S14 PolarHBondContact O-OG 3.36Å; C11-S14 PolarHBondContact O-N 2.76Å; N12-S14 PolarHBondContact O-N 2.91Å; S14-L18 PolarHBondContact O-N 3.22Å; S14-L18 VanDerWaalsContact O-N 3.13Å
15V92.3Very high87.9Confident35 Ų3587.9 Ų87.921%0.21242%0.416CS..Hα-helixtrans-67-43.9-179.31750000111C11 N12 Y17 L18 I19 L30 I45C11-V15 WeakPolarHBondContact O-CG2 3.18Å; C11-V15 PolarHBondContact O-N 3.47Å; N12-V15 PolarHBondContact O-N 3.26Å; V15-Y17 PolarHBondContact O-N 2.9Å; V15-L18 WeakPolarHBondContact O-CB 3.45Å; V15-L18 PolarHBondContact O-N 2.95Å; V15-I19 HydrophobicContact CG1-CD1 3.7Å; V15-I19 HydrophobicContact CG1-CG1 4.34Å; V15-I19 WeakPolarHBondContact O-CG1 3.3Å; V15-I19 PolarHBondContact O-N 2.93Å; V15-L30 HydrophobicContact CG1-CD1 3.53Å; V15-I45 HydrophobicContact CB-CD1 3.98Å; V15-I45 HydrophobicContact CG1-CD1 3.69Å; V15-I45 HydrophobicContact CG1-CG2 4.41Å
16K92.3Very high89.8Confident66 Ų6685 Ų8529%0.28740%0.401SS..Hα-helixtrans-54.4-51.3175.5172.1172.8-173169.10112.3N12 L18 I19 F20 G49 T51N12-K16 WeakPolarHBondContact O-CB 3.48Å; N12-K16 PolarHBondContact O-N 3.3Å; K16-L18 VanDerWaalsContact C-N 3.31Å; K16-L18 PolarHBondContact O-N 2.94Å; K16-I19 PolarHBondContact O-N 2.94Å; K16-F20 VanDerWaalsContact O-CB 3.25Å; K16-F20 WeakPolarHBondContact O-CB 3.34Å; K16-F20 PolarHBondContact O-N 3.31Å; K16-G49 WeakPolarHBondContact CE-O 3.32Å; K16-G49 WeakPolarHBondContact CG-O 3.48Å; K16-T51 HydrophobicContact CB-CG2 4.03Å; K16-T51 HydrophobicContact CD-CG2 3.8Å; K16-T51 HydrophobicContact CG-CG2 4.12Å
17Y92.8Very high91.1Very high147 Ų14781.9 Ų81.958%0.57641%0.407SS*.Hα-helixtrans-63.8-38.7179.8-80.5-58.2000112.3Q13 V15 R21Q13-Y17 HydrophobicContact CG-CD2 3.8Å; Q13-Y17 HydrophobicContact CG-CE2 3.44Å; Q13-Y17 VanDerWaalsContact CG-CE2 3.44Å; Q13-Y17 PolarHBondContact NE2-OH 3.37Å; Q13-Y17 WeakPolarHBondContact O-CD2 3.45Å; Q13-Y17 PolarHBondContact O-N 3Å; V15-Y17 PolarHBondContact O-N 2.9Å; Y17-R21 WeakPolarHBondContact O-CB 3.48Å; Y17-R21 PolarHBondContact O-N 3.4Å
18L93.7Very high91.7Very high94 Ų9479.7 Ų79.749%0.49240%0.401SS..Hα-helixtrans-60.2-55.6176.4-176.869.9000110.4S14 V15 K16 F20 R21 Y22S14-L18 PolarHBondContact O-N 3.22Å; S14-L18 VanDerWaalsContact O-N 3.13Å; V15-L18 WeakPolarHBondContact O-CB 3.45Å; V15-L18 PolarHBondContact O-N 2.95Å; K16-L18 VanDerWaalsContact C-N 3.31Å; K16-L18 PolarHBondContact O-N 2.94Å; L18-F20 VanDerWaalsContact C-N 3.35Å; L18-F20 PolarHBondContact O-N 3.18Å; L18-R21 WeakPolarHBondContact O-CB 3.33Å; L18-R21 PolarHBondContact O-N 2.87Å; L18-Y22 HydrophobicContact CD1-CD2 4.44Å; L18-Y22 HydrophobicContact CD1-CE2 3.79Å; L18-Y22 HydrophobicContact CG-CE2 4.33Å; L18-Y22 WeakPolarHBondContact O-CD2 3.37Å; L18-Y22 PolarHBondContact O-N 2.92Å
19I94.1Very high92.2Very high5 Ų581.9 Ų81.93%0.02642%0.418CS..Hα-helixtrans-61.9-43.3-177.6-66.6174.9000111.1V15 K16 R21 Y22 Q23 A28 L30 I45 P47V15-I19 HydrophobicContact CG1-CD1 3.7Å; V15-I19 HydrophobicContact CG1-CG1 4.34Å; V15-I19 WeakPolarHBondContact O-CG1 3.3Å; V15-I19 PolarHBondContact O-N 2.93Å; K16-I19 PolarHBondContact O-N 2.94Å; I19-R21 VanDerWaalsContact C-N 3.32Å; I19-R21 PolarHBondContact O-N 2.95Å; I19-Y22 CarbonylContact O-C 3.6Å; I19-Y22 PolarHBondContact O-N 2.89Å; I19-Y22 VanDerWaalsContact O-N 3.13Å; I19-Q23 PolarHBondContact O-N 2.85Å; I19-A28 HydrophobicContact CD1-CB 4.36Å; I19-L30 HydrophobicContact CD1-CD1 4.07Å; I19-I45 HydrophobicContact CD1-CG2 3.84Å; I19-P47 VanDerWaalsContact CG2-C 3.44Å; I19-P47 WeakPolarHBondContact CG2-O 3.43Å
20F93.4Very high92.6Very high116 Ų11683 Ų8351%0.50942%0.42SS..Hα-helixtrans-63.6-36178.2-174.6-103.3000112.5K16 L18 Y22 Q23K16-F20 VanDerWaalsContact O-CB 3.25Å; K16-F20 WeakPolarHBondContact O-CB 3.34Å; K16-F20 PolarHBondContact O-N 3.31Å; L18-F20 VanDerWaalsContact C-N 3.35Å; L18-F20 PolarHBondContact O-N 3.18Å; F20-Y22 PolarHBondContact O-N 3.01Å; F20-Q23 PolarHBondContact O-N 3.35Å; F20-Q23 PolarHBondContact O-NE2 3.09Å
21R94.9Very high92.8Very high205 Ų20581.3 Ų81.377%0.77442%0.418SS*.Hα-helixtrans-59.1-34.2175.3-179.3178.6177.4140.70.6112.1Y17 L18 I19 Q23Y17-R21 WeakPolarHBondContact O-CB 3.48Å; Y17-R21 PolarHBondContact O-N 3.4Å; L18-R21 WeakPolarHBondContact O-CB 3.33Å; L18-R21 PolarHBondContact O-N 2.87Å; I19-R21 VanDerWaalsContact C-N 3.32Å; I19-R21 PolarHBondContact O-N 2.95Å; R21-Q23 VanDerWaalsContact C-N 3.3Å
22Y94.9Very high93Very high115 Ų11580.7 Ų80.745%0.45141%0.411SS..THydrogen-bonded Turntrans-87.88.6175.9-68.2-82.7000113.4L18 I19 F20 G24 Y25 I26L18-Y22 HydrophobicContact CD1-CD2 4.44Å; L18-Y22 HydrophobicContact CD1-CE2 3.79Å; L18-Y22 HydrophobicContact CG-CE2 4.33Å; L18-Y22 WeakPolarHBondContact O-CD2 3.37Å; L18-Y22 PolarHBondContact O-N 2.92Å; I19-Y22 CarbonylContact O-C 3.6Å; I19-Y22 PolarHBondContact O-N 2.89Å; I19-Y22 VanDerWaalsContact O-N 3.13Å; F20-Y22 PolarHBondContact O-N 3.01Å; Y22-G24 PolarHBondContact O-N 3.15Å; Y22-Y25 WeakPolarHBondContact O-CB 3.26Å; Y22-Y25 WeakPolarHBondContact O-CD2 3.34Å; Y22-Y25 PolarHBondContact O-N 2.71Å; Y22-I26 HydrophobicContact CD1-CD1 4.11Å; Y22-I26 HydrophobicContact CD1-CG1 4.38Å; Y22-I26 HydrophobicContact CD2-CD1 3.23Å; Y22-I26 HydrophobicContact CD2-CG1 4.11Å; Y22-I26 HydrophobicContact CE1-CD1 4.46Å; Y22-I26 HydrophobicContact CE2-CD1 3.68Å; Y22-I26 HydrophobicContact CG-CD1 3.49Å; Y22-I26 VanDerWaalsContact CG-CD1 3.49Å; Y22-I26 HydrophobicContact CG-CG1 3.86Å
23Q91.9Very high93.1Very high126 Ų12681.7 Ų81.759%0.58943%0.425SS*.THydrogen-bonded Turntrans47.836.2171.3-63.9-68.8-6400114.3I19 F20 R21I19-Q23 PolarHBondContact O-N 2.85Å; F20-Q23 PolarHBondContact O-N 3.35Å; F20-Q23 PolarHBondContact O-NE2 3.09Å; R21-Q23 VanDerWaalsContact C-N 3.3Å
24G89.6Confident93.1Very high31 Ų3179.1 Ų79.132%0.3242%0.418SS..THydrogen-bonded Turntrans84.4-0.1179.700000116.7Y22 I26 P47Y22-G24 PolarHBondContact O-N 3.15Å; G24-I26 PolarHBondContact O-N 2.77Å; G24-P47 WeakPolarHBondContact CA-O 3.43Å
25Y93.3Very high93.1Very high210 Ų21078.4 Ų78.482%0.82441%0.411SS*.  trans-66.4-24.2172.9-71.7-68.6000112.8Y22 G27Y22-Y25 WeakPolarHBondContact O-CB 3.26Å; Y22-Y25 WeakPolarHBondContact O-CD2 3.34Å; Y22-Y25 PolarHBondContact O-N 2.71Å; Y25-G27 PolarHBondContact O-N 2.94Å
26I93Very high93Very high64 Ų6477.2 Ų77.233%0.32840%0.403SS..SBendtrans-89.4102.8170.3-59.8-178000108.2Y22 G24 A28Y22-I26 HydrophobicContact CD1-CD1 4.11Å; Y22-I26 HydrophobicContact CD1-CG1 4.38Å; Y22-I26 HydrophobicContact CD2-CD1 3.23Å; Y22-I26 HydrophobicContact CD2-CG1 4.11Å; Y22-I26 HydrophobicContact CE1-CD1 4.46Å; Y22-I26 HydrophobicContact CE2-CD1 3.68Å; Y22-I26 HydrophobicContact CG-CD1 3.49Å; Y22-I26 VanDerWaalsContact CG-CD1 3.49Å; Y22-I26 HydrophobicContact CG-CG1 3.86Å; G24-I26 PolarHBondContact O-N 2.77Å; I26-A28 HydrophobicContact CG2-CB 3.95Å; I26-A28 PolarHBondContact O-N 3.34Å
27G90.1Very high92.8Very high71 Ų7178.1 Ų78.173%0.73242%0.417SS*.  trans-73.753.9178.100000114.1Y25Y25-G27 PolarHBondContact O-N 2.94Å
28A92.4Very high92.6Very high26 Ų2676.9 Ų76.922%0.21542%0.42CS..  trans-100.5116.6-179.300000111.4I19 I26 L30 P47I19-A28 HydrophobicContact CD1-CB 4.36Å; I26-A28 HydrophobicContact CG2-CB 3.95Å; I26-A28 PolarHBondContact O-N 3.34Å; A28-L30 HydrophobicContact CB-CD1 4.49Å; A28-L30 HydrophobicContact CB-CD2 4.44Å; A28-L30 HydrophobicContact CB-CG 4.29Å; A28-P47 WeakPolarHBondContact O-CA 2.98Å; A28-P47 WeakPolarHBondContact O-CG 3.48Å
29A93.9Very high92.5Very high54 Ų5473.2 Ų73.245%0.44641%0.405SS..  trans-103.3112.6169.100000108.3M59A29-M59 HydrophobicContact CB-CE 3.58Å
30L94.6Very high92.4Very high68 Ų6878.1 Ų78.136%0.35644%0.438SS..EExtended strand (participates in β ladder)trans-119.5139.6-170.7-54.8170.7000110.9V15 I19 A28 I45V15-L30 HydrophobicContact CG1-CD1 3.53Å; I19-L30 HydrophobicContact CD1-CD1 4.07Å; A28-L30 HydrophobicContact CB-CD1 4.49Å; A28-L30 HydrophobicContact CB-CD2 4.44Å; A28-L30 HydrophobicContact CB-CG 4.29Å; L30-I45 HydrophobicContact CB-CB 4.22Å; L30-I45 PolarHBondContact N-O 3.5Å; L30-I45 PolarHBondContact O-N 2.97Å
31V95.5Very high92.4Very high76 Ų7674 Ų7446%0.46142%0.42SS..EExtended strand (participates in β ladder)trans-105.6120.6163.1176.40000106.8L42 Y43 V57 M59V31-L42 HydrophobicContact CG1-CD1 3.76Å; V31-Y43 WeakPolarHBondContact CA-O 3.48Å; V31-V57 HydrophobicContact CB-CG2 4.23Å; V31-V57 HydrophobicContact CG1-CG2 3.48Å; V31-V57 VanDerWaalsContact CG1-CG2 3.48Å; V31-V57 HydrophobicContact CG2-CG2 3.76Å; V31-M59 HydrophobicContact CG2-CB 4.04Å; V31-M59 HydrophobicContact CG2-CG 3.52Å
32L94.7Very high92.4Very high35 Ų3566.4 Ų66.418%0.18340%0.395CS..EExtended strand (participates in β ladder)trans-114.5110.5-179.9175.469.5000108.7C11 N12 L42 Y43 I45C11-L32 HydrophobicContact CB-CD1 4.45Å; C11-L32 HydrophobicContact CB-CD2 4.08Å; N12-L32 HydrophobicContact CB-CD2 3.76Å; L32-L42 CarbonylContact O-C 3.59Å; L32-L42 WeakPolarHBondContact O-CA 3.36Å; L32-Y43 HydrophobicContact CD2-CD2 4.31Å; L32-Y43 PolarHBondContact N-O 3.3Å; L32-Y43 PolarHBondContact O-N 2.98Å; L32-I45 HydrophobicContact CB-CD1 4.41Å; L32-I45 HydrophobicContact CD2-CD1 4.34Å
33G93.4Very high92.4Very high34 Ų3462 Ų6235%0.35138%0.377SS..EExtended strand (participates in β ladder)trans-121146.9176.800000111.5H41G33-H41 WeakPolarHBondContact CA-O 3.41Å
34G92.6Very high92.6Very high20 Ų2056 Ų5621%0.20635%0.35CS..EExtended strand (participates in β ladder)trans-172.6165.7174.400000112.6H41G34-H41 PolarHBondContact N-O 3.45Å; G34-H41 PolarHBondContact O-N 3.16Å
35V92Very high92.9Very high49 Ų4954.6 Ų54.630%0.29734%0.335SS..EExtended strand (participates in β ladder)trans-113.4119.8174.9-177.30000108.1P40 I110 K112V35-P40 HydrophobicContact CG2-CB 4.29Å; V35-I110 HydrophobicContact CG2-CG2 4.01Å; V35-K112 HydrophobicContact CG1-CB 4.12Å
36D89.8Confident92.9Very high9 Ų948.4 Ų48.45%0.04831%0.31CS..EExtended strand (participates in β ladder)trans-110.5-169.4175.870.317.5000111.6N38 G39 H41D36-N38 PolarHBondContact O-N 3.29Å; D36-N38 VanDerWaalsContact OD1-CA 3.3Å; D36-N38 WeakPolarHBondContact OD1-CA 3.3Å; D36-N38 WeakPolarHBondContact OD1-CB 3.47Å; D36-N38 PolarHBondContact OD1-N 2.93Å; D36-G39 PolarHBondContact N-O 2.9Å; D36-G39 PolarHBondContact O-N 3.42Å; D36-G39 PolarHBondContact OD1-N 2.71Å; D36-G39 VanDerWaalsContact OD1-O 3.13Å; D36-H41 IonicContact OD1-CD2 2.77Å; D36-H41 IonicContact OD1-NE2 3.17Å; D36-H41 IonicContact OD2-CD2 2.71Å; D36-H41 PolarHBondContact OD2-CD2 3.48Å; D36-H41 IonicContact OD2-NE2 3.77Å; D36-H41 PolarHBondContact OD2-NE2 2.83Å
37C88.9Confident92.9Very high85 Ų8547.3 Ų47.357%0.57431%0.307SS*.THydrogen-bonded Turntrans-66.2-20.7178.558.40000113.7
38N88Confident93Very high121 Ų12149.2 Ų49.265%0.64730%0.297SS*.THydrogen-bonded Turntrans-95.2-13.2179.8-63.913.1000112D36D36-N38 PolarHBondContact O-N 3.29Å; D36-N38 VanDerWaalsContact OD1-CA 3.3Å; D36-N38 WeakPolarHBondContact OD1-CA 3.3Å; D36-N38 WeakPolarHBondContact OD1-CB 3.47Å; D36-N38 PolarHBondContact OD1-N 2.93Å
39G90.6Very high92.8Very high17 Ų1748.2 Ų48.218%0.17529%0.289CS..EExtended strand (participates in β ladder)trans130.6-163.7171.500000113.4D36D36-G39 PolarHBondContact N-O 2.9Å; D36-G39 PolarHBondContact O-N 3.42Å; D36-G39 PolarHBondContact OD1-N 2.71Å; D36-G39 VanDerWaalsContact OD1-O 3.13Å
40P92.9Very high92.8Very high109 Ų10947.3 Ų47.371%0.70828%0.279SS*.EExtended strand (participates in β ladder)trans-73.2135.7176.829.8-33.4000111.1V35V35-P40 HydrophobicContact CG2-CB 4.29Å
41H93.5Very high92.8Very high28 Ų2845.6 Ų45.613%0.1327%0.272CS..EExtended strand (participates in β ladder)trans-132.6136.6176.1-65-23.4000110.2A8 G33 G34 D36 Y43 K53A8-H41 HydrophobicContact CB-CB 4.12Å; G33-H41 WeakPolarHBondContact CA-O 3.41Å; G34-H41 PolarHBondContact N-O 3.45Å; G34-H41 PolarHBondContact O-N 3.16Å; D36-H41 IonicContact OD1-CD2 2.77Å; D36-H41 IonicContact OD1-NE2 3.17Å; D36-H41 IonicContact OD2-CD2 2.71Å; D36-H41 PolarHBondContact OD2-CD2 3.48Å; D36-H41 IonicContact OD2-NE2 3.77Å; D36-H41 PolarHBondContact OD2-NE2 2.83Å; H41-Y43 HydrophobicContact CB-CE2 3.75Å; H41-K53 PolarHBondContact CE1-NZ 3.43Å; H41-K53 PolarHBondContact ND1-NZ 2.9Å; H41-K53 VanDerWaalsContact ND1-NZ 3.15Å
42L95.2Very high92.7Very high47 Ų4745.3 Ų45.325%0.24627%0.268CS..EExtended strand (participates in β ladder)trans-130.9128.7178.2-172.466.6000109.2V31 L32 K53 L54 V57V31-L42 HydrophobicContact CG1-CD1 3.76Å; L32-L42 CarbonylContact O-C 3.59Å; L32-L42 WeakPolarHBondContact O-CA 3.36Å; L42-K53 WeakPolarHBondContact O-CA 3.5Å; L42-L54 PolarHBondContact O-N 3.46Å; L42-V57 HydrophobicContact CD1-CG2 4.31Å; L42-V57 HydrophobicContact CD2-CG1 4.44Å; L42-V57 HydrophobicContact CD2-CG2 3.98Å; L42-V57 HydrophobicContact CG-CG2 4.02Å
43Y95.4Very high92.7Very high22 Ų2249.4 Ų49.49%0.08628%0.284CS..EExtended strand (participates in β ladder)trans-127.6140.6-178.2-60-83.6000110.4A8 N12 V31 L32 H41 D52 K53A8-Y43 HydrophobicContact CB-CE2 4.14Å; N12-Y43 HydrophobicContact CB-CD2 4.34Å; N12-Y43 HydrophobicContact CB-CE2 4.49Å; N12-Y43 HydrophobicContact CB-CG 4.41Å; N12-Y43 WeakPolarHBondContact ND2-CD1 3.41Å; V31-Y43 WeakPolarHBondContact CA-O 3.48Å; L32-Y43 HydrophobicContact CD2-CD2 4.31Å; L32-Y43 PolarHBondContact N-O 3.3Å; L32-Y43 PolarHBondContact O-N 2.98Å; H41-Y43 HydrophobicContact CB-CE2 3.75Å; Y43-D52 CarbonylContact C-O 3.59Å; Y43-D52 WeakPolarHBondContact CA-O 3.47Å; Y43-K53 HydrophobicContact CD1-CB 3.92Å; Y43-K53 HydrophobicContact CD1-CG 4.21Å; Y43-K53 HydrophobicContact CE1-CB 3.84Å; Y43-K53 HydrophobicContact CE1-CD 3.93Å; Y43-K53 HydrophobicContact CE1-CG 3.9Å
44S95.3Very high92.7Very high1 Ų151.8 Ų51.81%0.00729%0.288CS..EExtended strand (participates in β ladder)trans-103.9132.916252.50000109T51 D52S44-T51 VanDerWaalsContact O-CA 3.24Å; S44-T51 WeakPolarHBondContact O-CA 3.49Å; S44-D52 PolarHBondContact N-O 3.22Å; S44-D52 PolarHBondContact O-N 3.41Å
45I94.9Very high92.8Very high1 Ų154.9 Ų54.91%0.00531%0.305CS..EExtended strand (participates in β ladder)trans-119.8118.3178.2-49.5178000107.6N12 V15 I19 L30 L32 S50 T51N12-I45 WeakPolarHBondContact OD1-CD1 3.36Å; V15-I45 HydrophobicContact CB-CD1 3.98Å; V15-I45 HydrophobicContact CG1-CD1 3.69Å; V15-I45 HydrophobicContact CG1-CG2 4.41Å; I19-I45 HydrophobicContact CD1-CG2 3.84Å; L30-I45 HydrophobicContact CB-CB 4.22Å; L30-I45 PolarHBondContact N-O 3.5Å; L30-I45 PolarHBondContact O-N 2.97Å; L32-I45 HydrophobicContact CB-CD1 4.41Å; L32-I45 HydrophobicContact CD2-CD1 4.34Å; I45-S50 WeakPolarHBondContact CA-O 3.49Å; I45-T51 HydrophobicContact CB-CG2 4.41Å; I45-T51 HydrophobicContact CG1-CG2 4.05Å; I45-T51 HydrophobicContact CG2-CG2 4.08Å
46Y94.6Very high93Very high80 Ų8054.7 Ų54.731%0.31430%0.299SS..  trans-88.6159.3178.7-64.5-90.3000111.4H48 G49 S50 D52 M59Y46-H48 WeakPolarHBondContact CB-CE1 3.46Å; Y46-H48 AromaticContact CG-CE1 4Å; Y46-H48 PolarHBondContact O-N 3.49Å; Y46-G49 PolarHBondContact O-N 2.99Å; Y46-S50 WeakPolarHBondContact CB-OG 3.47Å; Y46-S50 VanDerWaalsContact CD2-OG 3.28Å; Y46-S50 WeakPolarHBondContact CD2-OG 3.28Å; Y46-S50 PolarHBondContact N-O 2.77Å; Y46-D52 WeakPolarHBondContact CE2-OD2 3.47Å; Y46-M59 HydrophobicContact CD1-CE 3.79Å; Y46-M59 HydrophobicContact CE1-CE 3.74Å; Y46-M59 HydrophobicContact CE1-SD 4.02Å
47P93.3Very high93.3Very high40 Ų4055.3 Ų55.326%0.2630%0.303SS..THydrogen-bonded Turntrans-57.7-17.6-177.4-27.834.6000116I19 G24 A28I19-P47 VanDerWaalsContact CG2-C 3.44Å; I19-P47 WeakPolarHBondContact CG2-O 3.43Å; G24-P47 WeakPolarHBondContact CA-O 3.43Å; A28-P47 WeakPolarHBondContact O-CA 2.98Å; A28-P47 WeakPolarHBondContact O-CG 3.48Å
48H91.1Very high93.6Very high111 Ų11152.4 Ų52.451%0.51428%0.283SS..THydrogen-bonded Turntrans-93.52.7177.656.1-80.5000113.2Y46 S50Y46-H48 WeakPolarHBondContact CB-CE1 3.46Å; Y46-H48 AromaticContact CG-CE1 4Å; Y46-H48 PolarHBondContact O-N 3.49Å; H48-S50 PolarHBondContact CD2-OG 3.46Å; H48-S50 PolarHBondContact CE1-OG 2.82Å; H48-S50 WeakPolarHBondContact NE2-CB 3.34Å; H48-S50 PolarHBondContact NE2-OG 3.39Å
49G89.4Confident94Very high5 Ų549.2 Ų49.25%0.05227%0.265CS..SBendtrans83.811.6179.600000114.7K16 Y46K16-G49 WeakPolarHBondContact CE-O 3.32Å; K16-G49 WeakPolarHBondContact CG-O 3.48Å; Y46-G49 PolarHBondContact O-N 2.99Å
50S92.9Very high94.2Very high35 Ų3551 Ų5125%0.24528%0.283CS..  trans-74.1150.6164.6660000110.1I45 Y46 H48I45-S50 WeakPolarHBondContact CA-O 3.49Å; Y46-S50 WeakPolarHBondContact CB-OG 3.47Å; Y46-S50 VanDerWaalsContact CD2-OG 3.28Å; Y46-S50 WeakPolarHBondContact CD2-OG 3.28Å; Y46-S50 PolarHBondContact N-O 2.77Å; H48-S50 PolarHBondContact CD2-OG 3.46Å; H48-S50 PolarHBondContact CE1-OG 2.82Å; H48-S50 WeakPolarHBondContact NE2-CB 3.34Å; H48-S50 PolarHBondContact NE2-OG 3.39Å
51T94.6Very high94.3Very high33 Ų3349.6 Ų49.620%0.20228%0.276CS..EExtended strand (participates in β ladder)trans-142.6125.2-17257.50000109.9N12 K16 S44 I45N12-T51 WeakPolarHBondContact OD1-CG2 3.37Å; K16-T51 HydrophobicContact CB-CG2 4.03Å; K16-T51 HydrophobicContact CD-CG2 3.8Å; K16-T51 HydrophobicContact CG-CG2 4.12Å; S44-T51 VanDerWaalsContact O-CA 3.24Å; S44-T51 WeakPolarHBondContact O-CA 3.49Å; I45-T51 HydrophobicContact CB-CG2 4.41Å; I45-T51 HydrophobicContact CG1-CG2 4.05Å; I45-T51 HydrophobicContact CG2-CG2 4.08Å
52D94.6Very high94.3Very high70 Ų7048.8 Ų48.837%0.37428%0.275SS..EExtended strand (participates in β ladder)trans-114.3146175.1-58.4-43.6000110.5Y43 S44 Y46 L54Y43-D52 CarbonylContact C-O 3.59Å; Y43-D52 WeakPolarHBondContact CA-O 3.47Å; S44-D52 PolarHBondContact N-O 3.22Å; S44-D52 PolarHBondContact O-N 3.41Å; Y46-D52 WeakPolarHBondContact CE2-OD2 3.47Å; D52-L54 HydrophobicContact CB-CD1 4.22Å; D52-L54 HydrophobicContact CB-CG 4.32Å
53K94.1Very high94.3Very high120 Ų12047.8 Ų47.852%0.52227%0.272SS..EExtended strand (participates in β ladder)trans-111.6112.9173.2-175179.9-179.1174.50108.4H41 L42 Y43H41-K53 PolarHBondContact CE1-NZ 3.43Å; H41-K53 PolarHBondContact ND1-NZ 2.9Å; H41-K53 VanDerWaalsContact ND1-NZ 3.15Å; L42-K53 WeakPolarHBondContact O-CA 3.5Å; Y43-K53 HydrophobicContact CD1-CB 3.92Å; Y43-K53 HydrophobicContact CD1-CG 4.21Å; Y43-K53 HydrophobicContact CE1-CB 3.84Å; Y43-K53 HydrophobicContact CE1-CD 3.93Å; Y43-K53 HydrophobicContact CE1-CG 3.9Å
54L94Very high94.3Very high84 Ų8453.6 Ų53.644%0.4430%0.304SS..  trans-137.7154.9-172.3-67.5171.4000110.6L42 D52 Y56 V57L42-L54 PolarHBondContact O-N 3.46Å; D52-L54 HydrophobicContact CB-CD1 4.22Å; D52-L54 HydrophobicContact CB-CG 4.32Å; L54-Y56 VanDerWaalsContact C-N 3.3Å; L54-Y56 WeakPolarHBondContact CB-O 3.22Å; L54-Y56 PolarHBondContact O-N 3.01Å; L54-V57 HydrophobicContact CB-CG1 3.81Å; L54-V57 HydrophobicContact CD1-CG1 4.12Å
55P94.3Very high94.4Very high85 Ų8554.8 Ų54.855%0.55231%0.313SS*.SBendtrans-66-31178.224.1-32.5000113.5Y74P55-Y74 HydrophobicContact CB-CE1 4.35Å; P55-Y74 WeakPolarHBondContact CB-OH 3.42Å
56Y95.9Very high94.5Very high45 Ų4555 Ų5518%0.17632%0.315CS..SBendtrans-142.4150.5172.554-90000108.9L54 M67 F70 E71 Y74L54-Y56 VanDerWaalsContact C-N 3.3Å; L54-Y56 WeakPolarHBondContact CB-O 3.22Å; L54-Y56 PolarHBondContact O-N 3.01Å; Y56-M67 HydrophobicContact CD2-SD 4.14Å; Y56-M67 HydrophobicContact CE2-SD 3.69Å; Y56-F70 HydrophobicContact CD2-CB 3.69Å; Y56-F70 HydrophobicContact CD2-CD1 4.44Å; Y56-F70 HydrophobicContact CD2-CD2 4.38Å; Y56-F70 AromaticContact CD2-CG 3.95Å; Y56-F70 HydrophobicContact CD2-CG 3.95Å; Y56-F70 HydrophobicContact CE2-CB 3.81Å; Y56-F70 HydrophobicContact CG-CB 4.28Å; Y56-F70 HydrophobicContact CG-CD1 4.31Å; Y56-F70 HydrophobicContact CG-CG 4.27Å; Y56-E71 PolarHBondContact OH-OE1 3.25Å; Y56-Y74 AromaticContact CD1-CD1 3.68Å; Y56-Y74 HydrophobicContact CD1-CD1 3.68Å; Y56-Y74 AromaticContact CD1-CD2 3.69Å; Y56-Y74 HydrophobicContact CD1-CD2 3.69Å; Y56-Y74 AromaticContact CD1-CE1 3.84Å; Y56-Y74 HydrophobicContact CD1-CE1 3.84Å; Y56-Y74 AromaticContact CD1-CE2 3.84Å; Y56-Y74 HydrophobicContact CD1-CE2 3.84Å; Y56-Y74 AromaticContact CD1-CG 3.6Å; Y56-Y74 HydrophobicContact CD1-CG 3.6Å; Y56-Y74 AromaticContact CD1-CZ 3.93Å; Y56-Y74 AromaticContact CE1-CD1 3.38Å; Y56-Y74 HydrophobicContact CE1-CD1 3.38Å; Y56-Y74 HydrophobicContact CE1-CD2 4.22Å; Y56-Y74 AromaticContact CE1-CE1 3.76Å; Y56-Y74 HydrophobicContact CE1-CE1 3.76Å; Y56-Y74 AromaticContact CE1-CG 3.64Å; Y56-Y74 HydrophobicContact CE1-CG 3.64Å; Y56-Y74 HydrophobicContact CG-CD2 4.48Å
57V96Very high94.6Very high23 Ų2354.1 Ų54.114%0.13932%0.315CS..  trans-142.2148.2177.5-60.30000110.2V31 L42 L54V31-V57 HydrophobicContact CB-CG2 4.23Å; V31-V57 HydrophobicContact CG1-CG2 3.48Å; V31-V57 VanDerWaalsContact CG1-CG2 3.48Å; V31-V57 HydrophobicContact CG2-CG2 3.76Å; L42-V57 HydrophobicContact CD1-CG2 4.31Å; L42-V57 HydrophobicContact CD2-CG1 4.44Å; L42-V57 HydrophobicContact CD2-CG2 3.98Å; L42-V57 HydrophobicContact CG-CG2 4.02Å; L54-V57 HydrophobicContact CB-CG1 3.81Å; L54-V57 HydrophobicContact CD1-CG1 4.12Å
58T96.1Very high94.8Very high24 Ų2455.1 Ų55.115%0.14733%0.327CS..  trans-130129.7174.758.90000109.2S63 A66 M67 F70T58-S63 PolarHBondContact OG1-O 2.96Å; T58-A66 HydrophobicContact CG2-CB 3.7Å; T58-M67 HydrophobicContact CG2-CB 4.46Å; T58-M67 WeakPolarHBondContact OG1-CE 3.1Å; T58-F70 HydrophobicContact CG2-CD2 3.56Å; T58-F70 HydrophobicContact CG2-CE2 3.65Å
59M95.6Very high95.2Very high53 Ų5350.8 Ų50.826%0.26131%0.308SS..  trans-130.5162.5178.1-62-64.3-70.500109.9A29 V31 Y46A29-M59 HydrophobicContact CB-CE 3.58Å; V31-M59 HydrophobicContact CG2-CB 4.04Å; V31-M59 HydrophobicContact CG2-CG 3.52Å; Y46-M59 HydrophobicContact CD1-CE 3.79Å; Y46-M59 HydrophobicContact CE1-CE 3.74Å; Y46-M59 HydrophobicContact CE1-SD 4.02Å
60G94.1Very high95.6Very high54 Ų5451.6 Ų51.656%0.55731%0.31SS*.SBendtrans95.8-177.9-178.300000113.6S63G60-S63 VanDerWaalsContact O-CB 3.22Å; G60-S63 WeakPolarHBondContact O-CB 3.43Å; G60-S63 PolarHBondContact O-N 3.2Å; G60-S63 PolarHBondContact O-OG 3.28Å
61S94.8Very high95.8Very high80 Ų8055.8 Ų55.856%0.55933%0.326SS*.THydrogen-bonded Turntrans-67.9-40.2-175.946.20000113.2S63 D98S61-S63 PolarHBondContact O-N 3.25Å; S61-D98 WeakPolarHBondContact CB-OD2 3.25Å; S61-D98 PolarHBondContact OG-OD2 3.38Å
62G94.5Very high95.9Very high11 Ų1160.6 Ų60.611%0.11335%0.35CS..THydrogen-bonded Turntrans-809.5175.500000115.4L64 A65 A66 D98G62-L64 VanDerWaalsContact C-N 3.34Å; G62-L64 PolarHBondContact O-N 2.89Å; G62-A65 PolarHBondContact O-N 3.07Å; G62-A66 PolarHBondContact O-N 3.14Å; G62-D98 PolarHBondContact N-OD2 3.31Å; G62-D98 VanDerWaalsContact N-OD2 3.15Å
63S95Very high96Very high26 Ų2662 Ų6218%0.18235%0.35CS..Hα-helixtrans-60.5-37.9-173.952.20000113.8T58 G60 S61 A65 A66 M67T58-S63 PolarHBondContact OG1-O 2.96Å; G60-S63 VanDerWaalsContact O-CB 3.22Å; G60-S63 WeakPolarHBondContact O-CB 3.43Å; G60-S63 PolarHBondContact O-N 3.2Å; G60-S63 PolarHBondContact O-OG 3.28Å; S61-S63 PolarHBondContact O-N 3.25Å; S63-A65 PolarHBondContact O-N 3.2Å; S63-A66 PolarHBondContact O-N 3.49Å; S63-M67 WeakPolarHBondContact O-CB 3.36Å; S63-M67 PolarHBondContact O-N 2.88Å
64L95.9Very high96.2Very high145 Ų14559.9 Ų59.976%0.75934%0.34SS*.Hα-helixtrans-65.5-38.7-179-65.3175.7000112.5G62 M67 A68G62-L64 VanDerWaalsContact C-N 3.34Å; G62-L64 PolarHBondContact O-N 2.89Å; L64-M67 PolarHBondContact O-N 3.32Å; L64-A68 PolarHBondContact O-N 2.6Å; L64-A68 VanDerWaalsContact O-N 3.11Å
65A96.7Very high96.3Very high25 Ų2561.8 Ų61.821%0.20734%0.344CS..Hα-helixtrans-68.5-40.4176.100000111.4G62 S63 A68 V69 N97G62-A65 PolarHBondContact O-N 3.07Å; S63-A65 PolarHBondContact O-N 3.2Å; A65-A68 PolarHBondContact O-N 3.24Å; A65-V69 PolarHBondContact O-N 3.16Å; A65-N97 HydrophobicContact CB-CB 4.04Å
66A97.1Very high96.3Very high6 Ų662.1 Ų62.15%0.0535%0.347CS..Hα-helixtrans-64-40.4173.600000111.8T58 G62 S63 A68 V69 F70 A90T58-A66 HydrophobicContact CG2-CB 3.7Å; G62-A66 PolarHBondContact O-N 3.14Å; S63-A66 PolarHBondContact O-N 3.49Å; A66-A68 PolarHBondContact O-N 3.02Å; A66-V69 WeakPolarHBondContact O-CB 3.47Å; A66-V69 PolarHBondContact O-N 3Å; A66-F70 VanDerWaalsContact O-CD2 3.28Å; A66-F70 WeakPolarHBondContact O-CD2 3.39Å; A66-F70 PolarHBondContact O-N 3.42Å; A66-F70 VanDerWaalsContact O-N 3.14Å; A66-A90 HydrophobicContact CB-CB 4.17Å
67M97.6Very high96.3Very high61 Ų6167.7 Ų67.730%0.338%0.379SS..Hα-helixtrans-62.6-42.4179.1-17362.285.200111.5Y56 T58 S63 L64 V69 F70 E71Y56-M67 HydrophobicContact CD2-SD 4.14Å; Y56-M67 HydrophobicContact CE2-SD 3.69Å; T58-M67 HydrophobicContact CG2-CB 4.46Å; T58-M67 WeakPolarHBondContact OG1-CE 3.1Å; S63-M67 WeakPolarHBondContact O-CB 3.36Å; S63-M67 PolarHBondContact O-N 2.88Å; L64-M67 PolarHBondContact O-N 3.32Å; M67-V69 PolarHBondContact O-N 3.49Å; M67-F70 PolarHBondContact O-N 3.18Å; M67-F70 VanDerWaalsContact O-N 3.07Å; M67-E71 HydrophobicContact CG-CG 4.21Å; M67-E71 WeakPolarHBondContact O-CG 3.41Å; M67-E71 PolarHBondContact O-N 3.36Å; M67-E71 HydrophobicContact SD-CG 4.37Å
68A97.7Very high96.2Very high62 Ų6268.6 Ų68.651%0.51238%0.383SS..Hα-helixtrans-57.5-36.9176.800000112.5L64 A65 A66 D72L64-A68 PolarHBondContact O-N 2.6Å; L64-A68 VanDerWaalsContact O-N 3.11Å; A65-A68 PolarHBondContact O-N 3.24Å; A66-A68 PolarHBondContact O-N 3.02Å; A68-D72 WeakPolarHBondContact O-CB 3.33Å; A68-D72 PolarHBondContact O-N 3.07Å
69V97.8Very high96.3Very high19 Ų1974.5 Ų74.512%0.11541%0.409CS..Hα-helixtrans-69-41.2175.5168.40000112A65 A66 M67 R73 L86 D89 A90 A93A65-V69 PolarHBondContact O-N 3.16Å; A66-V69 WeakPolarHBondContact O-CB 3.47Å; A66-V69 PolarHBondContact O-N 3Å; M67-V69 PolarHBondContact O-N 3.49Å; V69-R73 PolarHBondContact O-N 3.29Å; V69-L86 HydrophobicContact CG1-CD1 3.97Å; V69-D89 HydrophobicContact CG1-CB 4.43Å; V69-A90 HydrophobicContact CB-CB 4.08Å; V69-A90 HydrophobicContact CG1-CB 3.86Å; V69-A93 HydrophobicContact CG2-CB 3.66Å
70F97.6Very high96.3Very high22 Ų2276.1 Ų76.110%0.09642%0.416CS..Hα-helixtrans-65.1-46.6176.6-77.7-63.4000111.6Y56 T58 A66 M67 D72 R73 Y74 L86 V87 A90Y56-F70 HydrophobicContact CD2-CB 3.69Å; Y56-F70 HydrophobicContact CD2-CD1 4.44Å; Y56-F70 HydrophobicContact CD2-CD2 4.38Å; Y56-F70 AromaticContact CD2-CG 3.95Å; Y56-F70 HydrophobicContact CD2-CG 3.95Å; Y56-F70 HydrophobicContact CE2-CB 3.81Å; Y56-F70 HydrophobicContact CG-CB 4.28Å; Y56-F70 HydrophobicContact CG-CD1 4.31Å; Y56-F70 HydrophobicContact CG-CG 4.27Å; T58-F70 HydrophobicContact CG2-CD2 3.56Å; T58-F70 HydrophobicContact CG2-CE2 3.65Å; A66-F70 VanDerWaalsContact O-CD2 3.28Å; A66-F70 WeakPolarHBondContact O-CD2 3.39Å; A66-F70 PolarHBondContact O-N 3.42Å; A66-F70 VanDerWaalsContact O-N 3.14Å; M67-F70 PolarHBondContact O-N 3.18Å; M67-F70 VanDerWaalsContact O-N 3.07Å; F70-D72 VanDerWaalsContact C-N 3.26Å; F70-D72 PolarHBondContact O-N 3.43Å; F70-R73 PolarHBondContact O-N 3.42Å; F70-Y74 WeakPolarHBondContact O-CA 3.43Å; F70-Y74 WeakPolarHBondContact O-CB 3.12Å; F70-Y74 PolarHBondContact O-N 2.82Å; F70-L86 HydrophobicContact CD1-CD1 4.5Å; F70-L86 HydrophobicContact CD1-CD2 3.97Å; F70-L86 HydrophobicContact CD1-CG 4.07Å; F70-L86 HydrophobicContact CE1-CD2 4.06Å; F70-L86 HydrophobicContact CE1-CG 3.96Å; F70-V87 HydrophobicContact CE1-CG2 4.37Å; F70-V87 HydrophobicContact CZ-CG2 4.23Å; F70-A90 HydrophobicContact CD2-CB 4.14Å; F70-A90 HydrophobicContact CE2-CB 3.68Å; F70-A90 HydrophobicContact CZ-CB 3.93Å
71E97.5Very high96.4Very high124 Ų12478.3 Ų78.358%0.57941%0.412SS*.Hα-helixtrans-60.9-33179.3-69.5-62.2141.900113.1Y56 M67Y56-E71 PolarHBondContact OH-OE1 3.25Å; M67-E71 HydrophobicContact CG-CG 4.21Å; M67-E71 WeakPolarHBondContact O-CG 3.41Å; M67-E71 PolarHBondContact O-N 3.36Å; M67-E71 HydrophobicContact SD-CG 4.37Å
72D97.5Very high96.5Very high133 Ų13379.1 Ų79.171%0.71141%0.407SS*.Hα-helixtrans-76.5-38.8179.1-176.957.1000113.1A68 F70A68-D72 WeakPolarHBondContact O-CB 3.33Å; A68-D72 PolarHBondContact O-N 3.07Å; F70-D72 VanDerWaalsContact C-N 3.26Å; F70-D72 PolarHBondContact O-N 3.43Å
73R96.9Very high96.6Very high99 Ų9980.1 Ų80.137%0.37441%0.414SS..Hα-helixtrans-121.9-13.3-164.4-65.8-172.2-78.6168.6-8.5115.8V69 F70 L86 D89V69-R73 PolarHBondContact O-N 3.29Å; F70-R73 PolarHBondContact O-N 3.42Å; R73-L86 HydrophobicContact CB-CD1 3.65Å; R73-D89 IonicContact CZ-OD2 3.54Å; R73-D89 IonicContact NH1-OD2 3.45Å; R73-D89 PolarHBondContact NH1-OD2 3.13Å; R73-D89 IonicContact NH2-OD2 3.42Å; R73-D89 PolarHBondContact NH2-OD2 2.96Å
74Y97.3Very high96.7Very high77 Ų7780.4 Ų80.430%0.30241%0.412SS..  trans-63.9138.9-179.2175.2-96.8000111.5P55 Y56 F70 L78 L86P55-Y74 HydrophobicContact CB-CE1 4.35Å; P55-Y74 WeakPolarHBondContact CB-OH 3.42Å; Y56-Y74 AromaticContact CD1-CD1 3.68Å; Y56-Y74 HydrophobicContact CD1-CD1 3.68Å; Y56-Y74 AromaticContact CD1-CD2 3.69Å; Y56-Y74 HydrophobicContact CD1-CD2 3.69Å; Y56-Y74 AromaticContact CD1-CE1 3.84Å; Y56-Y74 HydrophobicContact CD1-CE1 3.84Å; Y56-Y74 AromaticContact CD1-CE2 3.84Å; Y56-Y74 HydrophobicContact CD1-CE2 3.84Å; Y56-Y74 AromaticContact CD1-CG 3.6Å; Y56-Y74 HydrophobicContact CD1-CG 3.6Å; Y56-Y74 AromaticContact CD1-CZ 3.93Å; Y56-Y74 AromaticContact CE1-CD1 3.38Å; Y56-Y74 HydrophobicContact CE1-CD1 3.38Å; Y56-Y74 HydrophobicContact CE1-CD2 4.22Å; Y56-Y74 AromaticContact CE1-CE1 3.76Å; Y56-Y74 HydrophobicContact CE1-CE1 3.76Å; Y56-Y74 AromaticContact CE1-CG 3.64Å; Y56-Y74 HydrophobicContact CE1-CG 3.64Å; Y56-Y74 HydrophobicContact CG-CD2 4.48Å; F70-Y74 WeakPolarHBondContact O-CA 3.43Å; F70-Y74 WeakPolarHBondContact O-CB 3.12Å; F70-Y74 PolarHBondContact O-N 2.82Å; Y74-L78 HydrophobicContact CD2-CD1 4.28Å; Y74-L86 HydrophobicContact CD2-CD2 4.3Å
75K96.6Very high96.7Very high124 Ų12481.4 Ų81.454%0.53941%0.406SS..  trans-135.5149.9169.8-62176.6-172.7164.50108.6L78K75-L78 HydrophobicContact CB-CD2 4.08Å; K75-L78 HydrophobicContact CB-CG 4.45Å; K75-L78 VanDerWaalsContact O-CG 3.32Å; K75-L78 WeakPolarHBondContact O-CG 3.41Å
76P95.2Very high96.8Very high92 Ų9280.9 Ų80.960%0.59740%0.399SS*.THydrogen-bonded Turntrans-61.9151.6167.628.1-33.7000110.3L78P76-L78 PolarHBondContact O-N 3.49Å
77D94.4Very high96.8Very high162 Ų16283.1 Ų83.187%0.86641%0.412SS*.THydrogen-bonded Turntrans57.842.8171.6-50.3-47.8000115
78L95.5Very high96.7Very high42 Ų4284.1 Ų84.122%0.2241%0.413CS..  trans-64.7144173.2-68.8165000112Y74 K75 P76 E82 A83 L86Y74-L78 HydrophobicContact CD2-CD1 4.28Å; K75-L78 HydrophobicContact CB-CD2 4.08Å; K75-L78 HydrophobicContact CB-CG 4.45Å; K75-L78 VanDerWaalsContact O-CG 3.32Å; K75-L78 WeakPolarHBondContact O-CG 3.41Å; P76-L78 PolarHBondContact O-N 3.49Å; L78-E82 HydrophobicContact CD2-CB 4.36Å; L78-E82 HydrophobicContact CD2-CG 3.81Å; L78-E82 WeakPolarHBondContact CD2-OE2 3.37Å; L78-A83 HydrophobicContact CB-CB 4.27Å; L78-L86 HydrophobicContact CD1-CD2 3.72Å
79E96.9Very high96.7Very high147 Ų14783 Ų8369%0.68740%0.398SS*.  trans-66.5151.5167.5-70.9-63.5154.800111E81 E82 A83E79-E81 VanDerWaalsContact C-N 3.32Å; E79-E81 PolarHBondContact O-N 2.99Å; E79-E82 HydrophobicContact CB-CB 4.48Å; E79-E82 WeakPolarHBondContact O-CB 3.49Å; E79-E82 PolarHBondContact O-N 3.2Å; E79-A83 PolarHBondContact O-N 3.12Å
80E94.8Very high96.7Very high88 Ų8882.1 Ų82.141%0.41139%0.393SS..Hα-helixtrans-54-46-173.6-174.6-175.1135.400112.8E82 A83 K84 V109E80-E82 VanDerWaalsContact C-N 3.33Å; E80-E82 PolarHBondContact O-N 2.99Å; E80-A83 PolarHBondContact O-N 3.02Å; E80-K84 WeakPolarHBondContact O-CG 3.37Å; E80-K84 PolarHBondContact O-N 3.09Å; E80-K84 WeakPolarHBondContact OE1-CE 3.37Å; E80-K84 IonicContact OE1-NZ 2.68Å; E80-K84 PolarHBondContact OE1-NZ 3.42Å; E80-V109 HydrophobicContact CG-CG1 4.28Å
81E96.3Very high96.6Very high100 Ų10084.7 Ų84.747%0.46741%0.407SS..Hα-helixtrans-69.2-30.3179.8-71.4-58.9128.200113.1E79 K84 R85E79-E81 VanDerWaalsContact C-N 3.32Å; E79-E81 PolarHBondContact O-N 2.99Å; E81-K84 WeakPolarHBondContact OE1-CD 3.15Å; E81-K84 IonicContact OE1-NZ 2.76Å; E81-K84 PolarHBondContact OE1-NZ 3.41Å; E81-R85 VanDerWaalsContact O-CG 3.3Å; E81-R85 WeakPolarHBondContact O-CG 3.28Å; E81-R85 PolarHBondContact O-N 3.38Å
82E97.1Very high96.6Very high96 Ų9679.1 Ų79.145%0.44938%0.382SS..Hα-helixtrans-72.7-42.1174.9-165.4177.5179.900110.3L78 E79 E80 R85 L86L78-E82 HydrophobicContact CD2-CB 4.36Å; L78-E82 HydrophobicContact CD2-CG 3.81Å; L78-E82 WeakPolarHBondContact CD2-OE2 3.37Å; E79-E82 HydrophobicContact CB-CB 4.48Å; E79-E82 WeakPolarHBondContact O-CB 3.49Å; E79-E82 PolarHBondContact O-N 3.2Å; E80-E82 VanDerWaalsContact C-N 3.33Å; E80-E82 PolarHBondContact O-N 2.99Å; E82-R85 PolarHBondContact O-N 2.87Å; E82-L86 WeakPolarHBondContact O-CB 3.24Å; E82-L86 PolarHBondContact O-N 3.43Å
83A96.8Very high96.5Very high33 Ų3373.7 Ų73.727%0.27336%0.356SS..Hα-helixtrans-62-44.117500000112L78 E79 E80 R85 L86 V87L78-A83 HydrophobicContact CB-CB 4.27Å; E79-A83 PolarHBondContact O-N 3.12Å; E80-A83 PolarHBondContact O-N 3.02Å; A83-R85 VanDerWaalsContact C-N 3.34Å; A83-R85 PolarHBondContact O-N 3.28Å; A83-L86 PolarHBondContact O-N 3.15Å; A83-V87 WeakPolarHBondContact O-CG2 3.32Å; A83-V87 PolarHBondContact O-N 3.47Å
84K96.9Very high96.5Very high32 Ų3269.2 Ų69.214%0.13934%0.34CS..Hα-helixtrans-56.2-47174.5-76.6174.2-174.9162.40111.7E80 E81 R88 L107 V109E80-K84 WeakPolarHBondContact O-CG 3.37Å; E80-K84 PolarHBondContact O-N 3.09Å; E80-K84 WeakPolarHBondContact OE1-CE 3.37Å; E80-K84 IonicContact OE1-NZ 2.68Å; E80-K84 PolarHBondContact OE1-NZ 3.42Å; E81-K84 WeakPolarHBondContact OE1-CD 3.15Å; E81-K84 IonicContact OE1-NZ 2.76Å; E81-K84 PolarHBondContact OE1-NZ 3.41Å; K84-R88 VanDerWaalsContact O-CB 3.26Å; K84-R88 WeakPolarHBondContact O-CB 3.38Å; K84-R88 PolarHBondContact O-N 3.11Å; K84-L107 HydrophobicContact CB-CD1 4.1Å; K84-L107 HydrophobicContact CG-CD1 4.24Å; K84-V109 HydrophobicContact CG-CG2 4.29Å
85R97.1Very high96.4Very high166 Ų16666.4 Ų66.463%0.62633%0.33SS*.Hα-helixtrans-64.5-44.2178.5-70.1176.8-146.3-164.45112E81 E82 A83 V87 R88 D89E81-R85 VanDerWaalsContact O-CG 3.3Å; E81-R85 WeakPolarHBondContact O-CG 3.28Å; E81-R85 PolarHBondContact O-N 3.38Å; E82-R85 PolarHBondContact O-N 2.87Å; A83-R85 VanDerWaalsContact C-N 3.34Å; A83-R85 PolarHBondContact O-N 3.28Å; R85-V87 PolarHBondContact O-N 3.49Å; R85-R88 PolarHBondContact O-N 3.4Å; R85-D89 PolarHBondContact O-N 2.79Å
86L97.8Very high96.4Very high14 Ų1466.3 Ų66.37%0.07333%0.33CS..Hα-helixtrans-59.4-48.8178.4178.660.8000111.5V69 F70 R73 Y74 L78 E82 A83 D89 A90V69-L86 HydrophobicContact CG1-CD1 3.97Å; F70-L86 HydrophobicContact CD1-CD1 4.5Å; F70-L86 HydrophobicContact CD1-CD2 3.97Å; F70-L86 HydrophobicContact CD1-CG 4.07Å; F70-L86 HydrophobicContact CE1-CD2 4.06Å; F70-L86 HydrophobicContact CE1-CG 3.96Å; R73-L86 HydrophobicContact CB-CD1 3.65Å; Y74-L86 HydrophobicContact CD2-CD2 4.3Å; L78-L86 HydrophobicContact CD1-CD2 3.72Å; E82-L86 WeakPolarHBondContact O-CB 3.24Å; E82-L86 PolarHBondContact O-N 3.43Å; A83-L86 PolarHBondContact O-N 3.15Å; L86-D89 PolarHBondContact O-N 3.44Å; L86-A90 WeakPolarHBondContact O-CB 3.37Å; L86-A90 PolarHBondContact O-N 3.45Å
87V97.1Very high96.4Very high53 Ų5368 Ų6832%0.32133%0.334SS..Hα-helixtrans-64.8-43.5178.7176.80000110.8F70 A83 R85 D89 A90 I91 L107F70-V87 HydrophobicContact CE1-CG2 4.37Å; F70-V87 HydrophobicContact CZ-CG2 4.23Å; A83-V87 WeakPolarHBondContact O-CG2 3.32Å; A83-V87 PolarHBondContact O-N 3.47Å; R85-V87 PolarHBondContact O-N 3.49Å; V87-D89 VanDerWaalsContact C-N 3.3Å; V87-D89 PolarHBondContact O-N 3.43Å; V87-A90 PolarHBondContact O-N 3.06Å; V87-I91 HydrophobicContact CG1-CG1 4.46Å; V87-I91 WeakPolarHBondContact O-CG1 3.47Å; V87-I91 PolarHBondContact O-N 3.04Å; V87-L107 HydrophobicContact CB-CD2 4.19Å; V87-L107 HydrophobicContact CG1-CD2 3.64Å
88R96.6Very high96.5Very high81 Ų8161.9 Ų61.931%0.30630%0.301SS..Hα-helixtrans-55.2-47.4175175.6-90.6179-163.2-2.6111.1K84 R85 I91 A92 I105 D122K84-R88 VanDerWaalsContact O-CB 3.26Å; K84-R88 WeakPolarHBondContact O-CB 3.38Å; K84-R88 PolarHBondContact O-N 3.11Å; R85-R88 PolarHBondContact O-N 3.4Å; R88-I91 PolarHBondContact O-N 2.83Å; R88-A92 WeakPolarHBondContact O-CB 3.37Å; R88-A92 PolarHBondContact O-N 3Å; R88-I105 HydrophobicContact CG-CD1 4.14Å; R88-I105 HydrophobicContact CG-CG2 4.47Å; R88-D122 IonicContact CZ-OD2 2.71Å; R88-D122 IonicContact NE-OD2 3.48Å; R88-D122 PolarHBondContact NE-OD2 3.47Å; R88-D122 IonicContact NH2-OD2 3.53Å; R88-D122 PolarHBondContact NH2-OD2 3.17Å
89D96.8Very high96.4Very high39 Ų3968.6 Ų68.621%0.20934%0.336CS..Hα-helixtrans-69.8-34.7-178.7-70.2-13.5000112.6V69 R73 R85 L86 V87 A92 A93V69-D89 HydrophobicContact CG1-CB 4.43Å; R73-D89 IonicContact CZ-OD2 3.54Å; R73-D89 IonicContact NH1-OD2 3.45Å; R73-D89 PolarHBondContact NH1-OD2 3.13Å; R73-D89 IonicContact NH2-OD2 3.42Å; R73-D89 PolarHBondContact NH2-OD2 2.96Å; R85-D89 PolarHBondContact O-N 2.79Å; L86-D89 PolarHBondContact O-N 3.44Å; V87-D89 VanDerWaalsContact C-N 3.3Å; V87-D89 PolarHBondContact O-N 3.43Å; D89-A92 PolarHBondContact O-N 3.31Å; D89-A93 WeakPolarHBondContact O-CB 3.22Å; D89-A93 PolarHBondContact O-N 3.03Å
90A97.4Very high96.3Very high1 Ų164.7 Ų64.71%0.00834%0.335CS..Hα-helixtrans-63.3-44175.200000111.5A66 V69 F70 L86 V87 A93 G94A66-A90 HydrophobicContact CB-CB 4.17Å; V69-A90 HydrophobicContact CB-CB 4.08Å; V69-A90 HydrophobicContact CG1-CB 3.86Å; F70-A90 HydrophobicContact CD2-CB 4.14Å; F70-A90 HydrophobicContact CE2-CB 3.68Å; F70-A90 HydrophobicContact CZ-CB 3.93Å; L86-A90 WeakPolarHBondContact O-CB 3.37Å; L86-A90 PolarHBondContact O-N 3.45Å; V87-A90 PolarHBondContact O-N 3.06Å; A90-A93 PolarHBondContact O-N 2.9Å; A90-G94 PolarHBondContact O-N 3.46Å; A90-G94 VanDerWaalsContact O-N 3.09Å
91I96.8Very high96.2Very high76 Ų7662.5 Ų62.539%0.3933%0.33SS..Hα-helixtrans-69.2-40176-60.9-57.9000111.2V87 R88 A93 G94 I95 I105V87-I91 HydrophobicContact CG1-CG1 4.46Å; V87-I91 WeakPolarHBondContact O-CG1 3.47Å; V87-I91 PolarHBondContact O-N 3.04Å; R88-I91 PolarHBondContact O-N 2.83Å; I91-A93 VanDerWaalsContact C-N 3.31Å; I91-A93 PolarHBondContact O-N 2.93Å; I91-G94 WeakPolarHBondContact O-CA 3.35Å; I91-G94 PolarHBondContact O-N 2.92Å; I91-G94 VanDerWaalsContact O-N 3.12Å; I91-I95 HydrophobicContact CG2-CD1 3.97Å; I91-I95 HydrophobicContact CG2-CG1 4.4Å; I91-I95 WeakPolarHBondContact O-CG1 2.9Å; I91-I95 PolarHBondContact O-N 3.32Å; I91-I105 HydrophobicContact CB-CG2 4.17Å; I91-I105 HydrophobicContact CG2-CG1 4.05Å; I91-I105 HydrophobicContact CG2-CG2 4.08Å
92A96.2Very high96Very high7 Ų759.6 Ų59.66%0.05833%0.327CS..Hα-helixtrans-58.7-43.2174.100000111.5R88 D89 G94 I95 F96 I105R88-A92 WeakPolarHBondContact O-CB 3.37Å; R88-A92 PolarHBondContact O-N 3Å; D89-A92 PolarHBondContact O-N 3.31Å; A92-G94 VanDerWaalsContact C-N 3.32Å; A92-G94 PolarHBondContact O-N 3.29Å; A92-I95 PolarHBondContact O-N 3.35Å; A92-F96 HydrophobicContact CB-CE2 4.44Å; A92-F96 WeakPolarHBondContact O-CD2 3.19Å; A92-F96 PolarHBondContact O-N 3.23Å; A92-I105 HydrophobicContact CB-CD1 3.87Å
93A96.6Very high95.7Very high19 Ų1959.4 Ų59.416%0.15734%0.336CS..Hα-helixtrans-60.4-41.2174.400000111.8V69 D89 A90 I91 N97V69-A93 HydrophobicContact CG2-CB 3.66Å; D89-A93 WeakPolarHBondContact O-CB 3.22Å; D89-A93 PolarHBondContact O-N 3.03Å; A90-A93 PolarHBondContact O-N 2.9Å; I91-A93 VanDerWaalsContact C-N 3.31Å; I91-A93 PolarHBondContact O-N 2.93Å; A93-N97 WeakPolarHBondContact O-CB 3.33Å; A93-N97 PolarHBondContact O-N 3.17Å; A93-N97 VanDerWaalsContact O-N 3.15Å; A93-N97 PolarHBondContact O-ND2 2.7Å
94G96.6Very high95.6Very high4 Ų461.3 Ų61.34%0.04134%0.342CS..Hα-helixtrans-58.5-49.4171.300000112.7A90 I91 A92 F96 N97 D98A90-G94 PolarHBondContact O-N 3.46Å; A90-G94 VanDerWaalsContact O-N 3.09Å; I91-G94 WeakPolarHBondContact O-CA 3.35Å; I91-G94 PolarHBondContact O-N 2.92Å; I91-G94 VanDerWaalsContact O-N 3.12Å; A92-G94 VanDerWaalsContact C-N 3.32Å; A92-G94 PolarHBondContact O-N 3.29Å; G94-F96 PolarHBondContact O-N 3.15Å; G94-N97 PolarHBondContact O-N 3.34Å; G94-D98 WeakPolarHBondContact O-CB 3.27Å; G94-D98 PolarHBondContact O-N 2.61Å
95I95.9Very high95.5Very high18 Ų1859.9 Ų59.99%0.09234%0.335CS..Hα-helixtrans-58.6-43179.8-72.6167.7000112.3I91 A92 I105 A124I91-I95 HydrophobicContact CG2-CD1 3.97Å; I91-I95 HydrophobicContact CG2-CG1 4.4Å; I91-I95 WeakPolarHBondContact O-CG1 2.9Å; I91-I95 PolarHBondContact O-N 3.32Å; A92-I95 PolarHBondContact O-N 3.35Å; I95-I105 HydrophobicContact CD1-CD1 4.26Å; I95-I105 HydrophobicContact CD1-CG1 3.67Å; I95-A124 HydrophobicContact CD1-CB 4.08Å; I95-A124 HydrophobicContact CG2-CB 4.04Å
96F95.3Very high95.4Very high123 Ų12355.3 Ų55.354%0.53932%0.323SS..Hα-helixtrans-82.7-16.9-176.2-70.1-64000114.1A92 G94 A124A92-F96 HydrophobicContact CB-CE2 4.44Å; A92-F96 WeakPolarHBondContact O-CD2 3.19Å; A92-F96 PolarHBondContact O-N 3.23Å; G94-F96 PolarHBondContact O-N 3.15Å; F96-A124 HydrophobicContact CE2-CB 4.45Å; F96-A124 HydrophobicContact CZ-CB 4.2Å
97N95.5Very high95.4Very high126 Ų12655.1 Ų55.167%0.67432%0.322SS*.Hα-helixtrans-113.5-8.3-176.3-65.1-77.3000114.3A65 A93 G94A65-N97 HydrophobicContact CB-CB 4.04Å; A93-N97 WeakPolarHBondContact O-CB 3.33Å; A93-N97 PolarHBondContact O-N 3.17Å; A93-N97 VanDerWaalsContact O-N 3.15Å; A93-N97 PolarHBondContact O-ND2 2.7Å; G94-N97 PolarHBondContact O-N 3.34Å
98D96.4Very high95.3Very high35 Ų3555.4 Ų55.419%0.18732%0.324CS..  trans-120.9130.1177173.941.3000111.8S61 G62 G94 G100 S101S61-D98 WeakPolarHBondContact CB-OD2 3.25Å; S61-D98 PolarHBondContact OG-OD2 3.38Å; G62-D98 PolarHBondContact N-OD2 3.31Å; G62-D98 VanDerWaalsContact N-OD2 3.15Å; G94-D98 WeakPolarHBondContact O-CB 3.27Å; G94-D98 PolarHBondContact O-N 2.61Å; D98-G100 VanDerWaalsContact C-N 3.3Å; D98-G100 PolarHBondContact O-N 3.46Å; D98-G100 PolarHBondContact OD1-N 2.81Å; D98-G100 PolarHBondContact OD2-N 3.3Å; D98-S101 PolarHBondContact O-N 3.35Å; D98-S101 WeakPolarHBondContact OD2-CB 3.4Å; D98-S101 PolarHBondContact OD2-N 3.29Å; D98-S101 VanDerWaalsContact OD2-N 3.17Å; D98-S101 PolarHBondContact OD2-OG 3.25Å
99L93.9Very high95.3Very high183 Ų18352.6 Ų52.696%0.95832%0.316SS*.THydrogen-bonded Turntrans-72.4-24.4179.1-63.4175.6000112.8S101L99-S101 VanDerWaalsContact C-N 3.26Å
100G93.5Very high95.2Very high64 Ų6454.3 Ų54.366%0.6633%0.325SS*.THydrogen-bonded Turntrans-79.5-8.6175.900000113.7D98D98-G100 VanDerWaalsContact C-N 3.3Å; D98-G100 PolarHBondContact O-N 3.46Å; D98-G100 PolarHBondContact OD1-N 2.81Å; D98-G100 PolarHBondContact OD2-N 3.3Å
101S93.2Very high95Very high43 Ų4357 Ų5730%0.30134%0.341SS..  trans-112147.4-176.6-62.80000110.8D98 L99D98-S101 PolarHBondContact O-N 3.35Å; D98-S101 WeakPolarHBondContact OD2-CB 3.4Å; D98-S101 PolarHBondContact OD2-N 3.29Å; D98-S101 VanDerWaalsContact OD2-N 3.17Å; D98-S101 PolarHBondContact OD2-OG 3.25Å; L99-S101 VanDerWaalsContact C-N 3.26Å
102G92.2Very high94.6Very high39 Ų3962 Ų6240%0.40236%0.36SS..  trans173.6-174.1-179.500000113.8
103S91Very high94.2Very high91 Ų9165.5 Ų65.564%0.63640%0.397SS*.SBendtrans76.5-144.4-179.5-42.60000114.2
104N94Very high93.9Very high74 Ų7468.5 Ų68.540%0.39641%0.41SS..EExtended strand (participates in β ladder)trans-87.2157.2-175.7-61.8-13.3000111.1P120 D122N104-P120 HydrophobicContact CB-CB 3.94Å; N104-D122 WeakPolarHBondContact CA-O 3.43Å
105I95.2Very high93.8Very high1 Ų171 Ų711%0.00543%0.425CS..EExtended strand (participates in β ladder)trans-96121.3172.9-56.3176.6000107.5R88 I91 A92 I95 L107 H121 D122R88-I105 HydrophobicContact CG-CD1 4.14Å; R88-I105 HydrophobicContact CG-CG2 4.47Å; I91-I105 HydrophobicContact CB-CG2 4.17Å; I91-I105 HydrophobicContact CG2-CG1 4.05Å; I91-I105 HydrophobicContact CG2-CG2 4.08Å; A92-I105 HydrophobicContact CB-CD1 3.87Å; I95-I105 HydrophobicContact CD1-CD1 4.26Å; I95-I105 HydrophobicContact CD1-CG1 3.67Å; I105-L107 HydrophobicContact CG2-CD2 4.49Å; I105-H121 WeakPolarHBondContact O-CB 3.32Å; I105-H121 PolarHBondContact O-N 2.69Å; I105-D122 HydrophobicContact CB-CB 4.25Å; I105-D122 HydrophobicContact CD1-CB 4.37Å; I105-D122 PolarHBondContact N-O 3.41Å; I105-D122 PolarHBondContact O-N 3.43Å
106D95.9Very high93.7Very high70 Ų7073.3 Ų73.337%0.37444%0.437SS..EExtended strand (participates in β ladder)trans-103.5136.6174.7-72.9-16000109.5R119D106-R119 HydrophobicContact CB-CG 3.94Å; D106-R119 VanDerWaalsContact OD2-CD 3.3Å; D106-R119 WeakPolarHBondContact OD2-CD 3.36Å; D106-R119 IonicContact OD2-CZ 3.31Å; D106-R119 IonicContact OD2-NE 3.09Å; D106-R119 PolarHBondContact OD2-NE 2.55Å; D106-R119 IonicContact OD2-NH1 3.51Å; D106-R119 PolarHBondContact OD2-NH1 3.12Å
107L96.3Very high93.7Very high10 Ų1075.3 Ų75.35%0.05244%0.442CS..EExtended strand (participates in β ladder)trans-118.7150.6173.1-65.9-173.6000110.8K84 V87 I105 I118 H121K84-L107 HydrophobicContact CB-CD1 4.1Å; K84-L107 HydrophobicContact CG-CD1 4.24Å; V87-L107 HydrophobicContact CB-CD2 4.19Å; V87-L107 HydrophobicContact CG1-CD2 3.64Å; I105-L107 HydrophobicContact CG2-CD2 4.49Å; L107-I118 HydrophobicContact CB-CB 4.38Å; L107-I118 PolarHBondContact N-O 2.88Å; L107-I118 PolarHBondContact O-N 2.94Å; L107-H121 HydrophobicContact CB-CB 4.21Å; L107-H121 HydrophobicContact CD1-CB 4.27Å; L107-H121 VanDerWaalsContact CD1-CD2 3.43Å; L107-H121 WeakPolarHBondContact CD1-CD2 3.4Å; L107-H121 HydrophobicContact CG-CB 3.94Å
108T96.1Very high93.6Very high60 Ų6071.6 Ų71.637%0.36842%0.422SS..EExtended strand (participates in β ladder)trans-138.1122171.1-59.90000108.4I110 V115 D116 Y117T108-I110 HydrophobicContact CG2-CG1 4.16Å; T108-V115 HydrophobicContact CG2-CG1 4.09Å; T108-D116 WeakPolarHBondContact CA-O 3.49Å; T108-Y117 HydrophobicContact CG2-CD1 3.56Å; T108-Y117 HydrophobicContact CG2-CE1 3.58Å; T108-Y117 HydrophobicContact CG2-CG 4.43Å
109V96Very high93.5Very high22 Ų2278.2 Ų78.213%0.13344%0.444CS..EExtended strand (participates in β ladder)trans-106122.4-179.5-175.80000108.2E80 K84 T111 V115 D116E80-V109 HydrophobicContact CG-CG1 4.28Å; K84-V109 HydrophobicContact CG-CG2 4.29Å; V109-T111 HydrophobicContact CG1-CG2 4.26Å; V109-V115 WeakPolarHBondContact O-CA 3.32Å; V109-D116 HydrophobicContact CB-CB 4.41Å; V109-D116 PolarHBondContact N-O 3Å; V109-D116 PolarHBondContact O-N 2.97Å
110I94.9Very high93.3Very high75 Ų7573.4 Ų73.439%0.38542%0.424SS..EExtended strand (participates in β ladder)trans-115.2116.9-178.9-55175.4000107.7V35 T108 V115V35-I110 HydrophobicContact CG2-CG2 4.01Å; T108-I110 HydrophobicContact CG2-CG1 4.16Å; I110-V115 HydrophobicContact CG1-CG1 4.28Å; I110-V115 HydrophobicContact CG2-CG2 4.32Å
111T93.1Very high93.2Very high58 Ų5873.9 Ų73.936%0.35641%0.409SS..  trans-115.7176.9173.467.70000110V109 G113 N114V109-T111 HydrophobicContact CG1-CG2 4.26Å; T111-G113 PolarHBondContact O-N 3.19Å; T111-G113 VanDerWaalsContact O-N 3.08Å; T111-N114 PolarHBondContact N-O 3.45Å; T111-N114 PolarHBondContact OG1-N 3.41Å; T111-N114 VanDerWaalsContact OG1-N 3.12Å; T111-N114 PolarHBondContact OG1-O 3.23Å; T111-N114 VanDerWaalsContact OG1-O 3.07Å
112K89.2Confident93.2Very high179 Ų17974.1 Ų74.178%0.77841%0.407SS*.SBendtrans-61.3-19-177.7-170.8174179.8176.50114.1V35V35-K112 HydrophobicContact CG1-CB 4.12Å
113G87.1Confident93.1Very high81 Ų8176.6 Ų76.684%0.83541%0.408SS*.SBendtrans-135.5-12.6-17600000115.2T111T111-G113 PolarHBondContact O-N 3.19Å; T111-G113 VanDerWaalsContact O-N 3.08Å
114N91.2Very high92.8Very high82 Ų8273.3 Ų73.344%0.43939%0.386SS..  trans-133.5149.8-176.9-166.824.7000111.7T111 D116T111-N114 PolarHBondContact N-O 3.45Å; T111-N114 PolarHBondContact OG1-N 3.41Å; T111-N114 VanDerWaalsContact OG1-N 3.12Å; T111-N114 PolarHBondContact OG1-O 3.23Å; T111-N114 VanDerWaalsContact OG1-O 3.07Å; N114-D116 PolarHBondContact ND2-OD1 2.92Å; N114-D116 PolarHBondContact ND2-OD2 3.43Å
115V94Very high92.4Very high57 Ų5774 Ų7435%0.34539%0.39SS..EExtended strand (participates in β ladder)trans-129.9114.6171.4-177.20000108.1T108 V109 I110 Y117T108-V115 HydrophobicContact CG2-CG1 4.09Å; V109-V115 WeakPolarHBondContact O-CA 3.32Å; I110-V115 HydrophobicContact CG1-CG1 4.28Å; I110-V115 HydrophobicContact CG2-CG2 4.32Å; V115-Y117 HydrophobicContact CB-CE2 4.31Å; V115-Y117 HydrophobicContact CG1-CD2 4.09Å; V115-Y117 HydrophobicContact CG1-CE1 4.06Å; V115-Y117 HydrophobicContact CG1-CE2 3.5Å; V115-Y117 VanDerWaalsContact CG1-CE2 3.5Å; V115-Y117 VanDerWaalsContact CG1-CZ 3.48Å
116D94.3Very high92.1Very high66 Ų6682.1 Ų82.135%0.35343%0.425SS..EExtended strand (participates in β ladder)trans-105.7113.5179-64.8-40.5000109.9T108 V109 N114T108-D116 WeakPolarHBondContact CA-O 3.49Å; V109-D116 HydrophobicContact CB-CB 4.41Å; V109-D116 PolarHBondContact N-O 3Å; V109-D116 PolarHBondContact O-N 2.97Å; N114-D116 PolarHBondContact ND2-OD1 2.92Å; N114-D116 PolarHBondContact ND2-OD2 3.43Å
117Y94.8Very high91.8Very high166 Ų16688 Ų8865%0.65145%0.447SS*.EExtended strand (participates in β ladder)trans-93.7115.1174.2-62.7-79.3000109.7T108 V115T108-Y117 HydrophobicContact CG2-CD1 3.56Å; T108-Y117 HydrophobicContact CG2-CE1 3.58Å; T108-Y117 HydrophobicContact CG2-CG 4.43Å; V115-Y117 HydrophobicContact CB-CE2 4.31Å; V115-Y117 HydrophobicContact CG1-CD2 4.09Å; V115-Y117 HydrophobicContact CG1-CE1 4.06Å; V115-Y117 HydrophobicContact CG1-CE2 3.5Å; V115-Y117 VanDerWaalsContact CG1-CE2 3.5Å; V115-Y117 VanDerWaalsContact CG1-CZ 3.48Å
118I93.9Very high91.4Very high48 Ų4890.5 Ų90.525%0.24648%0.476CS..EExtended strand (participates in β ladder)trans-113.3100.3-176.2-47.5173.5000108.8L107 H121L107-I118 HydrophobicContact CB-CB 4.38Å; L107-I118 PolarHBondContact N-O 2.88Å; L107-I118 PolarHBondContact O-N 2.94Å; I118-H121 HydrophobicContact CB-CB 4.35Å; I118-H121 HydrophobicContact CG2-CB 3.78Å
119R93.1Very high91.3Very high173 Ų17394 Ų9465%0.65350%0.497SS*.EExtended strand (participates in β ladder)trans-138.3117.2-177.5-58.9-164.5177.7-157.11.7111.6D106D106-R119 HydrophobicContact CB-CG 3.94Å; D106-R119 VanDerWaalsContact OD2-CD 3.3Å; D106-R119 WeakPolarHBondContact OD2-CD 3.36Å; D106-R119 IonicContact OD2-CZ 3.31Å; D106-R119 IonicContact OD2-NE 3.09Å; D106-R119 PolarHBondContact OD2-NE 2.55Å; D106-R119 IonicContact OD2-NH1 3.51Å; D106-R119 PolarHBondContact OD2-NH1 3.12Å
120P90.1Very high91.1Very high83 Ų83101.5 Ų101.554%0.53952%0.523SS..EExtended strand (participates in β ladder)cis-74.2144.1-13.632.1-32.7000110.9N104N104-P120 HydrophobicContact CB-CB 3.94Å
121H92.5Very high91Very high74 Ų74105.2 Ų105.234%0.34355%0.549SS..EExtended strand (participates in β ladder)trans-80.6-44166.2173.1-84.9000110.9I105 L107 I118I105-H121 WeakPolarHBondContact O-CB 3.32Å; I105-H121 PolarHBondContact O-N 2.69Å; L107-H121 HydrophobicContact CB-CB 4.21Å; L107-H121 HydrophobicContact CD1-CB 4.27Å; L107-H121 VanDerWaalsContact CD1-CD2 3.43Å; L107-H121 WeakPolarHBondContact CD1-CD2 3.4Å; L107-H121 HydrophobicContact CG-CB 3.94Å; I118-H121 HydrophobicContact CB-CB 4.35Å; I118-H121 HydrophobicContact CG2-CB 3.78Å
122D92.1Very high90.9Very high48 Ų48103.9 Ų103.926%0.25755%0.547SS..EExtended strand (participates in β ladder)trans-146.3148.6178.7-166.49.7000111.4R88 N104 I105R88-D122 IonicContact CZ-OD2 2.71Å; R88-D122 IonicContact NE-OD2 3.48Å; R88-D122 PolarHBondContact NE-OD2 3.47Å; R88-D122 IonicContact NH2-OD2 3.53Å; R88-D122 PolarHBondContact NH2-OD2 3.17Å; N104-D122 WeakPolarHBondContact CA-O 3.43Å; I105-D122 HydrophobicContact CB-CB 4.25Å; I105-D122 HydrophobicContact CD1-CB 4.37Å; I105-D122 PolarHBondContact N-O 3.41Å; I105-D122 PolarHBondContact O-N 3.43Å
123E89.6Confident91Very high91 Ų91101.4 Ų101.443%0.42554%0.542SS..EExtended strand (participates in β ladder)trans-107.1102176.6-177.2180-168.700108.6N125 K126E123-N125 PolarHBondContact O-N 3.35Å; E123-K126 HydrophobicContact CG-CG 4.3Å
124A85.8Confident91.3Very high22 Ų22104.4 Ų104.418%0.18253%0.529CS..SBendtrans-69-34.6-176.600000112.6I95 F96I95-A124 HydrophobicContact CD1-CB 4.08Å; I95-A124 HydrophobicContact CG2-CB 4.04Å; F96-A124 HydrophobicContact CE2-CB 4.45Å; F96-A124 HydrophobicContact CZ-CB 4.2Å
125N85.9Confident91.4Very high87 Ų87109 Ų10947%0.46555%0.546SS..SBendtrans-137.3125.7-176.3-70.2-62.4000111.1E123E123-N125 PolarHBondContact O-N 3.35Å
126K88.6Confident91.4Very high173 Ų173115.1 Ų115.175%0.75256%0.564SS**PPolyproline II helixtrans-91.7136.8175.6-65.5-174.3178.9-177.70110.9E123 G128E123-K126 HydrophobicContact CG-CG 4.3Å; K126-G128 PolarHBondContact O-N 3.11Å
127K88.5Confident91.4Very high192 Ų192120.7 Ų120.784%0.83559%0.585SS**PPolyproline II helixtrans-69.7131.5173.6-171.2175.5-179.1174.10110.4
128G89Confident91.4Very high63 Ų63124.5 Ų124.565%0.64960%0.598SS**PPolyproline II helixtrans-62.1149.2173.200000112.7K126K126-G128 PolarHBondContact O-N 3.11Å
129V92.8Very high91.4Very high135 Ų135125.6 Ų125.682%0.81862%0.621SS**PPolyproline II helixtrans-76.3131.4175.1-176.30000109.1T131V129-T131 PolarHBondContact O-N 3.38Å
130R91.8Very high91.4Very high179 Ų179121.5 Ų121.568%0.67562%0.616SS**PPolyproline II helixtrans-66.6122.8174-65.9179.570.2178.64108.9
131T93.5Very high91.6Very high152 Ų152122.9 Ų122.993%0.93362%0.623SS**  trans-80.1-26.9-179.645.10000113.5V129V129-T131 PolarHBondContact O-N 3.38Å
132G91.6Very high91.7Very high30 Ų30124 Ų12431%0.30964%0.644SS.*SBendtrans-104.9145.7179.300000113.5Y134G132-Y134 WeakPolarHBondContact O-CD2 3.24Å; G132-Y134 WeakPolarHBondContact O-CE2 3.2Å
133D91.9Very high91.8Very high127 Ų127127 Ų12768%0.67966%0.664SS**  trans-91.6127.5163.9-166.7-1.5000109.7K135D133-K135 WeakPolarHBondContact OD1-CB 3.49Å; D133-K135 VanDerWaalsContact OD1-CG 3.27Å; D133-K135 WeakPolarHBondContact OD1-CG 3.33Å; D133-K135 PolarHBondContact OD1-N 3.27Å
134Y91.5Very high92Very high144 Ų144131.2 Ų131.257%0.56569%0.688SS**  trans-118.620.1-178.2-59.7-91.5000111.3G132 Y136G132-Y134 WeakPolarHBondContact O-CD2 3.24Å; G132-Y134 WeakPolarHBondContact O-CE2 3.2Å; Y134-Y136 WeakPolarHBondContact O-CD2 3.41Å; Y134-Y136 PolarHBondContact O-N 3.48Å
135K93.9Very high92.3Very high180 Ų180135.3 Ų135.378%0.78372%0.716SS**  trans-75.1109175.4-73.1174.9-178.3177.10110.3D133D133-K135 WeakPolarHBondContact OD1-CB 3.49Å; D133-K135 VanDerWaalsContact OD1-CG 3.27Å; D133-K135 WeakPolarHBondContact OD1-CG 3.33Å; D133-K135 PolarHBondContact OD1-N 3.27Å
136Y94.1Very high92.6Very high185 Ų185139.1 Ų139.173%0.72573%0.729SS**PPolyproline II helixtrans-77.6148.3170.5-59.9-79.1000111Y134 T140Y134-Y136 WeakPolarHBondContact O-CD2 3.41Å; Y134-Y136 PolarHBondContact O-N 3.48Å; Y136-T140 WeakPolarHBondContact CB-OG1 3.39Å
137K95.6Very high92.7Very high182 Ų182136.4 Ų136.479%0.79173%0.73SS**PPolyproline II helixtrans-64.5148.7174.6-65-177.1-178.4178.80110.1G139 T140K137-G139 PolarHBondContact O-N 2.89Å; K137-T140 WeakPolarHBondContact O-CG2 3.13Å; K137-T140 PolarHBondContact O-N 2.88Å; K137-T140 PolarHBondContact O-OG1 3.34Å; K137-T140 VanDerWaalsContact O-OG1 3.11Å
138R93.2Very high92.9Very high246 Ų246132.3 Ų132.393%0.92872%0.721SS**THydrogen-bonded Turntrans-57.2132.9175.9-172.6179.3-178.3-164.93.6110.2
139G93.4Very high93Very high71 Ų71134.7 Ų134.773%0.73272%0.723SS**THydrogen-bonded Turntrans100.60.3-179.600000115.2K137 T141K137-G139 PolarHBondContact O-N 2.89Å; G139-T141 VanDerWaalsContact C-N 3.31Å; G139-T141 PolarHBondContact O-N 2.96Å
140T94.3Very high92.7Very high88 Ų88133.1 Ų133.154%0.5472%0.716SS.*  trans-72.3-20.2175.748.70000114.5Y136 K137Y136-T140 WeakPolarHBondContact CB-OG1 3.39Å; K137-T140 WeakPolarHBondContact O-CG2 3.13Å; K137-T140 PolarHBondContact O-N 2.88Å; K137-T140 PolarHBondContact O-OG1 3.34Å; K137-T140 VanDerWaalsContact O-OG1 3.11Å
141T93.8Very high92.5Very high112 Ų112131.6 Ų131.669%0.68772%0.72SS**SBendtrans-99.7126.4179.6-49.40000110G139 V143G139-T141 VanDerWaalsContact C-N 3.31Å; G139-T141 PolarHBondContact O-N 2.96Å; T141-V143 PolarHBondContact O-N 2.94Å
142A94.5Very high91.9Very high96 Ų96131.9 Ų131.979%0.79372%0.716SS**  trans-65.4127.9175.400000110.7
143V94.4Very high91.2Very high111 Ų111137.5 Ų137.567%0.67374%0.738SS**  trans-109.2119.1178.8-179.60000108.4T141 S145 K146T141-V143 PolarHBondContact O-N 2.94Å; V143-S145 WeakPolarHBondContact CG1-O 3.39Å; V143-K146 HydrophobicContact CG1-CB 4.41Å
144L94.9Very high90.3Very high180 Ų180140 Ų14094%0.94275%0.746SS**SBendtrans-77.9-42.8-178.3-62.9176.8000112.5
145S91.8Very high89.1Confident109 Ų109139 Ų13976%0.76275%0.754SS**  trans-145.514917763.70000110.1V143V143-S145 WeakPolarHBondContact CG1-O 3.39Å
146K92.5Very high87.9Confident167 Ų167136.7 Ų136.773%0.72676%0.755SS**  trans-135.7121.4179-176.4-176.6176.5-167.40108.4V143 V148V143-K146 HydrophobicContact CG1-CB 4.41Å; K146-V148 HydrophobicContact CD-CG2 4.43Å; K146-V148 HydrophobicContact CG-CG2 4.25Å
147C90.7Very high86.7Confident116 Ų116136.4 Ų136.478%0.78476%0.76SS**  trans-111.7136.4168.8-173.10000108.1
148V92.1Very high85.1Confident106 Ų106135.6 Ų135.664%0.64276%0.759SS**  trans-125.3115.1175.5-178.60000106.9K146 P150K146-V148 HydrophobicContact CD-CG2 4.43Å; K146-V148 HydrophobicContact CG-CG2 4.25Å; V148-P150 WeakPolarHBondContact O-CD 3.34Å
149T90.2Very high83.6Confident113 Ų113128.8 Ų128.869%0.69375%0.749SS**  trans-99.9110173.9-49.90000107.8
150P88.3Confident82.3Confident102 Ų102132 Ų13266%0.66275%0.748SS**  trans-64.8138.1171.527.3-31.1000109.3V148V148-P150 WeakPolarHBondContact O-CD 3.34Å
151L86.7Confident80.7Confident146 Ų146136.3 Ų136.376%0.76476%0.762SS**  trans-99.9113.6172-72.1166.3000107.5L153L151-L153 PolarHBondContact O-N 3.37Å
152D80.1Confident79Confident159 Ų159136.7 Ų136.785%0.8577%0.765SS**  trans-8197.5169.8-65.5-34.4000107.8
153L78.1Confident77.1Confident148 Ų148140.3 Ų140.378%0.77577%0.767SS**  trans-91.1106.4173.9-68.5166.9000108.3L151 V155L151-L153 PolarHBondContact O-N 3.37Å; L153-V155 PolarHBondContact O-N 3.27Å
154E71.8Confident75.1Confident179 Ų179142.3 Ų142.384%0.83677%0.774SS**  trans-74.3116.4161-76.3-175.3160.800108.1V156E154-V156 PolarHBondContact O-N 3.13Å
155V67.4Low73.2Confident124 Ų124140.1 Ų140.175%0.75277%0.768SS**  trans-71.297.8173.2178.60000107.5L153L153-V155 PolarHBondContact O-N 3.27Å
156V67.8Low71.2Confident130 Ų130143.6 Ų143.679%0.78879%0.793SS**  trans-80-31.6-178.5-176.60000111.6E154E154-V156 PolarHBondContact O-N 3.13Å
157E68.9Low70.1Confident180 Ų180142.5 Ų142.584%0.84180%0.796SS**  trans-163.8133176.8-129.8172.1175.600111.7
158E62.6Low69Low165 Ų165143.8 Ų143.877%0.77180%0.797SS**  trans-106.7107.5172.1-169.2174.6-162.500108
159S61.5Low67.7Low103 Ų103145.9 Ų145.972%0.7281%0.805SS**  trans-108110.1172.955.10000109.8Q161S159-Q161 PolarHBondContact O-N 3.4Å
160I66.9Low66.4Low138 Ų138147.9 Ų147.971%0.70881%0.812SS**  trans-84103.4174-58.6173.4000107.2T162I160-T162 HydrophobicContact CG2-CG2 4.29Å
161Q59.3Low65.1Low179 Ų179150.8 Ų150.884%0.83682%0.821SS**  trans-88.3105.8166.2-74.4-169.9-6.100109.2S159 M163S159-Q161 PolarHBondContact O-N 3.4Å; Q161-M163 PolarHBondContact O-N 2.82Å
162T58.2Low63.6Low120 Ų120151.1 Ų151.174%0.73683%0.825SS**  trans-76.1114.3166.7460000108.9I160I160-T162 HydrophobicContact CG2-CG2 4.29Å
163M54.3Low62.4Low171 Ų171150.5 Ų150.584%0.84282%0.823SS**  trans-82.3118.5163.4-93.3-165.5-71.500108.9Q161 T165Q161-M163 PolarHBondContact O-N 2.82Å; M163-T165 PolarHBondContact O-N 3.48Å
164D53Low61.2Low153 Ų153150.7 Ų150.782%0.81883%0.827SS**  trans-70.4108.1162.8-84-40.6000108.7S166D164-S166 PolarHBondContact O-N 3.43Å
165T54.8Low60.3Low135 Ų135148.3 Ų148.383%0.82883%0.826SS**  trans-88.188.4162.8540000107.8M163M163-T165 PolarHBondContact O-N 3.48Å
166S49.4Very low59.7Low182 Ų182150.5 Ų150.5100%1.27383%0.833SS**  trans-84.20160.5-55.10000110.1D164D164-S166 PolarHBondContact O-N 3.43Å

Retrieved 166 of 166 residues in 76.5 ms (Link to these results)

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