A0A087Y6A5_POEFO Loading...

Actin-related protein 2/3 complex subunit 5

Functions as component of the Arp2/3 complex which is involved in regulation of actin polymerization and together with an activating nucleation-promoting factor (NPF) mediates the formation of branched actin networks. Arp2/3 complex plays a critical role in the control of cell morphogenesis via the modulation of cell polarity development.

AlphaFold DB , UniProt , Accession A0A087Y6A5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 150 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
1M41.3Very low66.4Low238 Ų238144.1 Ų144.1100%1.17274%0.736SS**  0970-74-81.5-93.800107.8K3M1-K3 PolarHBondContact O-N 3.05Å
2S55.6Low68.3Low129 Ų129150.3 Ų150.390%0.90274%0.743SS**  trans-67.4122.9-179.5-151.20000108.6N4S2-N4 PolarHBondContact O-N 3.43Å
3K54.4Low70Confident194 Ų194145.5 Ų145.584%0.84373%0.727SS**  trans-61.1121.7178.4-76.9177.3174.6176.40107.9M1 T5M1-K3 PolarHBondContact O-N 3.05Å; K3-T5 PolarHBondContact O-N 3.26Å
4N58.6Low71.5Confident137 Ų137141.7 Ų141.773%0.73371%0.71SS**  trans-59.9113.3176.5-164.9-0000108.7S2 V6S2-N4 PolarHBondContact O-N 3.43Å; N4-V6 HydrophobicContact CB-CG2 3.67Å; N4-V6 WeakPolarHBondContact ND2-CG2 3.28Å; N4-V6 PolarHBondContact O-N 3.13Å; N4-V6 WeakPolarHBondContact OD1-CG2 3.46Å
5T61.5Low72.9Confident129 Ų129138.9 Ų138.979%0.79170%0.703SS**  trans-77.458.1178.752.20000110K3 S7K3-T5 PolarHBondContact O-N 3.26Å; T5-S7 PolarHBondContact O-N 3.14Å
6V63.1Low74.1Confident109 Ų109137.5 Ų137.566%0.66170%0.698SS**  trans-72.434.3-173.3-157.30000112.9N4 A8N4-V6 HydrophobicContact CB-CG2 3.67Å; N4-V6 WeakPolarHBondContact ND2-CG2 3.28Å; N4-V6 PolarHBondContact O-N 3.13Å; N4-V6 WeakPolarHBondContact OD1-CG2 3.46Å; V6-A8 PolarHBondContact O-N 3.43Å
7S71Confident75.1Confident75 Ų75135.5 Ų135.552%0.52469%0.686SS.*  trans-87.586.2167.7-172.10000108.1T5 R9 F10T5-S7 PolarHBondContact O-N 3.14Å; S7-R9 PolarHBondContact O-N 3.27Å; S7-R9 WeakPolarHBondContact OG-CB 3.47Å; S7-F10 WeakPolarHBondContact O-CD1 3.43Å; S7-F10 WeakPolarHBondContact O-CE1 3.17Å
8A76.3Confident76Confident48 Ų48138.4 Ų138.440%0.39769%0.688SS.*G310 helixtrans-75.212.5168.500000112.4V6 F10 R11V6-A8 PolarHBondContact O-N 3.43Å; A8-F10 PolarHBondContact O-N 2.99Å; A8-F10 VanDerWaalsContact O-N 3.17Å; A8-R11 WeakPolarHBondContact O-CB 3.18Å; A8-R11 PolarHBondContact O-N 3.47Å
9R81.1Confident77Confident194 Ų194135.3 Ų135.373%0.73267%0.674SS**G310 helixtrans-58.2-29.3-177.7-171.3174.7169.8177.2-3.5112.3S7 R11 R12S7-R9 PolarHBondContact O-N 3.27Å; S7-R9 WeakPolarHBondContact OG-CB 3.47Å; R9-R11 VanDerWaalsContact C-N 3.25Å; R9-R11 PolarHBondContact O-N 3.42Å; R9-R12 PolarHBondContact O-N 3.47Å
10F81.6Confident77.8Confident137 Ų137138.3 Ų138.360%0.60169%0.686SS**G310 helixtrans-66.3-22.8174.767.1-91.7000113.7S7 A8 R12S7-F10 WeakPolarHBondContact O-CD1 3.43Å; S7-F10 WeakPolarHBondContact O-CE1 3.17Å; A8-F10 PolarHBondContact O-N 2.99Å; A8-F10 VanDerWaalsContact O-N 3.17Å; F10-R12 VanDerWaalsContact C-N 3.3Å
11R86.2Confident78.6Confident195 Ų195138.5 Ų138.574%0.73669%0.69SS**G310 helixtrans-83.1-4.5177.6-56.7-176-177.2170.9-2.1113.8A8 R9A8-R11 WeakPolarHBondContact O-CB 3.18Å; A8-R11 PolarHBondContact O-N 3.47Å; R9-R11 VanDerWaalsContact C-N 3.25Å; R9-R11 PolarHBondContact O-N 3.42Å
12R88.6Confident81Confident219 Ų219131.4 Ų131.483%0.82665%0.652SS**G310 helixtrans-89-10.9174.8-63.5-175.4178.6177-1.7112.5R9 F10 D14R9-R12 PolarHBondContact O-N 3.47Å; F10-R12 VanDerWaalsContact C-N 3.3Å; R12-D14 PolarHBondContact O-N 3.39Å
13V90.4Very high82.7Confident87 Ų87132.5 Ų132.553%0.52764%0.641SS.*SBendtrans-78.8121.1177.3-177.80000107.1V15V13-V15 HydrophobicContact CG1-CG1 4.36Å; V13-V15 PolarHBondContact O-N 3.33Å
14D91.8Very high84.3Confident93 Ų93128.7 Ų128.750%0.49763%0.634SS.*  trans-76.999.7171-170.8-8.4000108.2R12 D16R12-D14 PolarHBondContact O-N 3.39Å; D14-D16 VanDerWaalsContact C-N 3.3Å; D14-D16 WeakPolarHBondContact OD1-CB 3.08Å; D14-D16 PolarHBondContact OD1-N 2.89Å; D14-D16 VanDerWaalsContact OD1-N 3.15Å
15V91.8Very high85.6Confident99 Ų99125.2 Ų125.260%0.662%0.615SS**SBendtrans-77.5-20.7-179.7-66.60000111.9V13 E17 Y18V13-V15 HydrophobicContact CG1-CG1 4.36Å; V13-V15 PolarHBondContact O-N 3.33Å; V15-E17 VanDerWaalsContact C-N 3.27Å; V15-E17 PolarHBondContact O-N 3.44Å; V15-Y18 PolarHBondContact O-N 3.24Å
16D91.9Very high86.6Confident117 Ų117127 Ų12763%0.62662%0.615SS**G310 helixtrans-73.5-23.8-177.9-59.6-22.5000111D14 Y18 D19D14-D16 VanDerWaalsContact C-N 3.3Å; D14-D16 WeakPolarHBondContact OD1-CB 3.08Å; D14-D16 PolarHBondContact OD1-N 2.89Å; D14-D16 VanDerWaalsContact OD1-N 3.15Å; D16-Y18 PolarHBondContact O-N 3.3Å; D16-D19 PolarHBondContact O-N 3.22Å
17E91.9Very high86.8Confident104 Ų104129 Ų12949%0.48662%0.617SS.*G310 helixtrans-58.8-27.1172.7-171.258.6-146.900112.8V15 K22V15-E17 VanDerWaalsContact C-N 3.27Å; V15-E17 PolarHBondContact O-N 3.44Å; E17-K22 IonicContact OE1-NZ 2.73Å; E17-K22 PolarHBondContact OE1-NZ 2.83Å; E17-K22 IonicContact OE2-NZ 3.75Å; E17-K22 PolarHBondContact OE2-NZ 3.47Å
18Y90.9Very high86.4Confident188 Ų188130.9 Ų130.974%0.73762%0.621SS**G310 helixtrans-104.79.7-177-56.8-80.8000113.4V15 D16 E20V15-Y18 PolarHBondContact O-N 3.24Å; D16-Y18 PolarHBondContact O-N 3.3Å; Y18-E20 PolarHBondContact O-N 3.11Å
19D95.1Very high85.6Confident79 Ų79132 Ų13242%0.42264%0.638SS.*  trans-66.7122.5173.9-174.9-5.8000110.1D16 N21 K22D16-D19 PolarHBondContact O-N 3.22Å; D19-N21 PolarHBondContact O-N 3.15Å; D19-N21 VanDerWaalsContact O-N 3.15Å; D19-N21 WeakPolarHBondContact OD1-CB 3.45Å; D19-N21 PolarHBondContact OD1-N 2.99Å; D19-N21 PolarHBondContact OD1-ND2 3.27Å; D19-K22 HydrophobicContact CB-CB 4.45Å; D19-K22 WeakPolarHBondContact O-CB 3.47Å; D19-K22 PolarHBondContact O-N 3.05Å
20E92.6Very high84.6Confident194 Ų194123.2 Ų123.291%0.90761%0.608SS**THydrogen-bonded Turntrans-61.5-21.1177.8-63-178.7173.300112.7Y18 K22Y18-E20 PolarHBondContact O-N 3.11Å; E20-K22 VanDerWaalsContact C-N 3.35Å
21N94.1Very high83.7Confident144 Ų144124.8 Ų124.877%0.7762%0.617SS**THydrogen-bonded Turntrans-88.4-1.4176.9-54.6-72.9000113.3D19 F23D19-N21 PolarHBondContact O-N 3.15Å; D19-N21 VanDerWaalsContact O-N 3.15Å; D19-N21 WeakPolarHBondContact OD1-CB 3.45Å; D19-N21 PolarHBondContact OD1-N 2.99Å; D19-N21 PolarHBondContact OD1-ND2 3.27Å; N21-F23 PolarHBondContact O-N 2.83Å
22K93.3Very high83Confident88 Ų88122.8 Ų122.838%0.38362%0.62SS.*SBendtrans-62.5128.7178.4-175.1179.1173.2-170.30109.7E17 D19 E20 V24E17-K22 IonicContact OE1-NZ 2.73Å; E17-K22 PolarHBondContact OE1-NZ 2.83Å; E17-K22 IonicContact OE2-NZ 3.75Å; E17-K22 PolarHBondContact OE2-NZ 3.47Å; D19-K22 HydrophobicContact CB-CB 4.45Å; D19-K22 WeakPolarHBondContact O-CB 3.47Å; D19-K22 PolarHBondContact O-N 3.05Å; E20-K22 VanDerWaalsContact C-N 3.35Å; K22-V24 PolarHBondContact O-N 3.41Å
23F91.3Very high82.5Confident153 Ų153115.3 Ų115.367%0.67160%0.595SS**  trans-65.1128.6176.6179.9-92.8000110.8N21 D25N21-F23 PolarHBondContact O-N 2.83Å; F23-D25 WeakPolarHBondContact CE1-OD1 3.5Å
24V88.1Confident82.1Confident113 Ų113117.9 Ų117.969%0.68561%0.605SS**  trans-120.4132.5175.1-176.50000108.2K22K22-V24 PolarHBondContact O-N 3.41Å
25D85Confident81.9Confident64 Ų64114.1 Ų114.134%0.34259%0.588SS.*  trans-66.7142.8174.2-72.7-59.7000111.1F23 E27 R147F23-D25 WeakPolarHBondContact CE1-OD1 3.5Å; D25-E27 PolarHBondContact O-N 3.26Å; D25-R147 IonicContact OD1-CZ 3.29Å; D25-R147 VanDerWaalsContact OD1-CZ 3.29Å; D25-R147 IonicContact OD1-NE 2.79Å; D25-R147 PolarHBondContact OD1-NE 2.79Å; D25-R147 IonicContact OD1-NH2 3.11Å; D25-R147 PolarHBondContact OD1-NH2 3.06Å; D25-R147 VanDerWaalsContact OD1-NH2 3.11Å; D25-R147 IonicContact OD2-CZ 3.35Å; D25-R147 IonicContact OD2-NE 3.22Å; D25-R147 PolarHBondContact OD2-NE 3.24Å; D25-R147 IonicContact OD2-NH2 2.67Å; D25-R147 PolarHBondContact OD2-NH2 3.22Å
26E83.3Confident81.9Confident167 Ų167110.1 Ų110.178%0.7856%0.564SS**  trans-65.8115.1172.9-67.2178.8171.600111.1D28 K148E26-D28 PolarHBondContact O-N 3.37Å; E26-K148 WeakPolarHBondContact O-CE 3.46Å; E26-K148 PolarHBondContact O-NZ 2.92Å
27E66.9Low81.9Confident150 Ų150108.9 Ų108.970%0.70156%0.558SS**  trans-79.3108.3170-57.1-160.3153.500108.9D25 K66D25-E27 PolarHBondContact O-N 3.26Å; E27-K66 IonicContact OE1-NZ 3.39Å; E27-K66 PolarHBondContact OE1-NZ 2.93Å; E27-K66 IonicContact OE2-NZ 2.87Å; E27-K66 PolarHBondContact OE2-NZ 3.36Å
28D62.2Low81.9Confident115 Ų115108.5 Ų108.562%0.61556%0.556SS**  trans-108.5130.7176.8-150.33.2000108.7E26 G30 K148E26-D28 PolarHBondContact O-N 3.37Å; D28-G30 PolarHBondContact O-N 3.31Å; D28-K148 VanDerWaalsContact CB-NZ 3.34Å
29G58.9Low82Confident73 Ų73103 Ų10375%0.75355%0.549SS*.  trans-71.372.8-159.800000115.4E31G29-E31 VanDerWaalsContact C-N 3.32Å; G29-E31 PolarHBondContact O-N 2.97Å
30G61.3Low82Confident9 Ų9103.5 Ų103.59%0.09355%0.549CS..  trans-88.526.217500000115.5D28 N32 Q33 N64 T65D28-G30 PolarHBondContact O-N 3.31Å; G30-N32 PolarHBondContact O-N 2.72Å; G30-N32 VanDerWaalsContact O-N 3.07Å; G30-Q33 PolarHBondContact O-N 2.69Å; G30-Q33 VanDerWaalsContact O-N 3.14Å; G30-N64 WeakPolarHBondContact CA-O 3.28Å; G30-T65 WeakPolarHBondContact O-CB 3.4Å
31E62.9Low82Confident169 Ų16994.2 Ų94.279%0.7951%0.506SS*.THydrogen-bonded Turntrans-60.1-22.7-174-65.7-166.5150.500113.6G29G29-E31 VanDerWaalsContact C-N 3.32Å; G29-E31 PolarHBondContact O-N 2.97Å
32N70Confident82Confident153 Ų15389 Ų8982%0.81848%0.477SS*.THydrogen-bonded Turntrans-97.67.3-178.7-67.3-33.4000114.9G30 L34G30-N32 PolarHBondContact O-N 2.72Å; G30-N32 VanDerWaalsContact O-N 3.07Å; N32-L34 PolarHBondContact O-N 3.39Å
33Q79.3Confident82.2Confident62 Ų6287.3 Ų87.329%0.2948%0.477SS..  trans-71.4118173.9-71.6-173.1-18.600110.1G30 I63G30-Q33 PolarHBondContact O-N 2.69Å; G30-Q33 VanDerWaalsContact O-N 3.14Å; Q33-I63 VanDerWaalsContact OE1-N 3.1Å
34L81.7Confident82.4Confident142 Ų14281.2 Ų81.274%0.74345%0.451SS*.  trans-92.7-11.5-179.4-67.1167000113.4N32 V70N32-L34 PolarHBondContact O-N 3.39Å; L34-V70 VanDerWaalsContact C-CG1 3.49Å; L34-V70 WeakPolarHBondContact O-CG1 3.43Å
35G88.1Confident82.7Confident14 Ų1477.4 Ų77.414%0.14443%0.427CS..  trans85.2-169.9-173.500000113.3N60G35-N60 CarbonylContact C-O 3.26Å; G35-N60 VanDerWaalsContact C-O 3.26Å; G35-N60 VanDerWaalsContact CA-O 3.29Å; G35-N60 WeakPolarHBondContact CA-O 3.24Å
36P90.5Very high83.1Confident15 Ų1583.9 Ų83.910%0.09745%0.447CS..SBendtrans-66.4150.9175.525.6-32.6000112.8E38 V57 A74 L77P36-E38 PolarHBondContact O-N 2.84Å; P36-V57 HydrophobicContact CB-CG2 4.11Å; P36-V57 HydrophobicContact CG-CG2 3.93Å; P36-A74 HydrophobicContact CG-CB 4.05Å; P36-L77 HydrophobicContact CB-CD2 4.13Å; P36-L77 HydrophobicContact CG-CD2 3.95Å
37D92.3Very high83.6Confident90 Ų9081.8 Ų81.848%0.48144%0.437SS..  trans-75.6111.2178.9-171.9-29.5000110.8A39 E40 V41D37-A39 VanDerWaalsContact C-N 3.35Å; D37-A39 PolarHBondContact O-N 2.85Å; D37-A39 WeakPolarHBondContact OD1-CB 3.43Å; D37-A39 PolarHBondContact OD1-N 3.43Å; D37-E40 HydrophobicContact CB-CB 3.91Å; D37-E40 PolarHBondContact O-N 3.38Å; D37-E40 PolarHBondContact OD1-N 3.48Å; D37-V41 WeakPolarHBondContact O-CG2 3.27Å; D37-V41 PolarHBondContact O-N 3.04Å; D37-V41 VanDerWaalsContact O-N 3.12Å
38E92.3Very high84.8Confident97 Ų9784.4 Ų84.445%0.45344%0.44SS..Hα-helixtrans-63.4-37.6-179.8-174.8174.5-178.400112.7P36 V41 D42 L77P36-E38 PolarHBondContact O-N 2.84Å; E38-V41 PolarHBondContact O-N 2.84Å; E38-D42 VanDerWaalsContact O-CB 3.28Å; E38-D42 WeakPolarHBondContact O-CB 3.43Å; E38-D42 PolarHBondContact O-N 3.14Å; E38-L77 HydrophobicContact CB-CD2 4.32Å; E38-L77 HydrophobicContact CG-CD1 4.23Å
39A93Very high86.3Confident72 Ų7282 Ų8260%0.59543%0.427SS*.Hα-helixtrans-71-38.6-178.100000111.4D37 S43D37-A39 VanDerWaalsContact C-N 3.35Å; D37-A39 PolarHBondContact O-N 2.85Å; D37-A39 WeakPolarHBondContact OD1-CB 3.43Å; D37-A39 PolarHBondContact OD1-N 3.43Å; A39-S43 VanDerWaalsContact O-CB 3.32Å; A39-S43 WeakPolarHBondContact O-CB 3.46Å; A39-S43 PolarHBondContact O-N 2.65Å
40E94.1Very high88Confident89 Ų8979.6 Ų79.642%0.41640%0.397SS..Hα-helixtrans-61.7-51.9173.5-175.5178.4-166.100110.8D37 D42 S43 L44 A56D37-E40 HydrophobicContact CB-CB 3.91Å; D37-E40 PolarHBondContact O-N 3.38Å; D37-E40 PolarHBondContact OD1-N 3.48Å; E40-D42 PolarHBondContact O-N 2.94Å; E40-S43 WeakPolarHBondContact O-CB 3.46Å; E40-S43 PolarHBondContact O-N 2.98Å; E40-L44 HydrophobicContact CG-CD1 4.1Å; E40-L44 WeakPolarHBondContact O-CG 3.29Å; E40-L44 PolarHBondContact O-N 3.09Å; E40-A56 HydrophobicContact CG-CB 4.45Å
41V94.3Very high89.6Confident0 Ų082.4 Ų82.40%041%0.409CS..Hα-helixtrans-62.7-43.3-178.8173.50000111.6D37 E38 S43 L44 I45 A56 V57 L77 V81D37-V41 WeakPolarHBondContact O-CG2 3.27Å; D37-V41 PolarHBondContact O-N 3.04Å; D37-V41 VanDerWaalsContact O-N 3.12Å; E38-V41 PolarHBondContact O-N 2.84Å; V41-S43 VanDerWaalsContact C-N 3.32Å; V41-S43 PolarHBondContact O-N 3.22Å; V41-L44 PolarHBondContact O-N 3.14Å; V41-I45 HydrophobicContact CG1-CD1 3.87Å; V41-I45 HydrophobicContact CG1-CG1 4.41Å; V41-I45 WeakPolarHBondContact O-CG1 3.38Å; V41-I45 PolarHBondContact O-N 3.08Å; V41-A56 HydrophobicContact CG2-CB 3.99Å; V41-V57 HydrophobicContact CG2-CB 4.04Å; V41-V57 HydrophobicContact CG2-CG2 4.43Å; V41-L77 HydrophobicContact CB-CD1 4.01Å; V41-L77 HydrophobicContact CB-CD2 3.95Å; V41-L77 HydrophobicContact CB-CG 4.14Å; V41-L77 HydrophobicContact CG1-CD1 3.67Å; V41-L77 HydrophobicContact CG1-CD2 4.24Å; V41-L77 HydrophobicContact CG1-CG 3.86Å; V41-L77 HydrophobicContact CG2-CD2 3.85Å; V41-L77 HydrophobicContact CG2-CG 4.33Å; V41-V81 HydrophobicContact CG1-CG2 3.41Å; V41-V81 VanDerWaalsContact CG1-CG2 3.41Å
42D94.4Very high91.1Very high33 Ų3379.1 Ų79.118%0.17639%0.394CS..Hα-helixtrans-65.1-36.6178.5-87.816.8000112.7E38 E40 R46 K80E38-D42 VanDerWaalsContact O-CB 3.28Å; E38-D42 WeakPolarHBondContact O-CB 3.43Å; E38-D42 PolarHBondContact O-N 3.14Å; E40-D42 PolarHBondContact O-N 2.94Å; D42-R46 VanDerWaalsContact O-CG 3.25Å; D42-R46 WeakPolarHBondContact O-CG 3.4Å; D42-R46 PolarHBondContact O-N 3.26Å; D42-R46 VanDerWaalsContact O-N 3.1Å; D42-K80 WeakPolarHBondContact OD1-CE 3.26Å; D42-K80 IonicContact OD1-NZ 2.63Å; D42-K80 PolarHBondContact OD1-NZ 3.41Å; D42-K80 IonicContact OD2-NZ 2.93Å; D42-K80 PolarHBondContact OD2-NZ 3.49Å
43S96Very high92.4Very high53 Ų5371.8 Ų71.837%0.37136%0.355SS..Hα-helixtrans-62.7-45173.5-173.50000111.2A39 E40 V41 R46 Q47A39-S43 VanDerWaalsContact O-CB 3.32Å; A39-S43 WeakPolarHBondContact O-CB 3.46Å; A39-S43 PolarHBondContact O-N 2.65Å; E40-S43 WeakPolarHBondContact O-CB 3.46Å; E40-S43 PolarHBondContact O-N 2.98Å; V41-S43 VanDerWaalsContact C-N 3.32Å; V41-S43 PolarHBondContact O-N 3.22Å; S43-R46 PolarHBondContact O-N 3.37Å; S43-Q47 VanDerWaalsContact O-CG 3.28Å; S43-Q47 WeakPolarHBondContact O-CG 3.48Å; S43-Q47 PolarHBondContact O-N 3.15Å; S43-Q47 PolarHBondContact OG-NE2 3.16Å
44L95.6Very high93.2Very high25 Ų2568.9 Ų68.913%0.13134%0.341CS..Hα-helixtrans-65.9-40.3179.8-68.8167.7000112.4E40 V41 R46 Q47 W48 N49 E52 A53 A56E40-L44 HydrophobicContact CG-CD1 4.1Å; E40-L44 WeakPolarHBondContact O-CG 3.29Å; E40-L44 PolarHBondContact O-N 3.09Å; V41-L44 PolarHBondContact O-N 3.14Å; L44-R46 PolarHBondContact O-N 3.11Å; L44-Q47 PolarHBondContact O-N 3.49Å; L44-W48 PolarHBondContact O-N 2.92Å; L44-N49 HydrophobicContact CD2-CB 4.3Å; L44-N49 PolarHBondContact O-N 3.11Å; L44-E52 HydrophobicContact CD1-CB 4.16Å; L44-E52 HydrophobicContact CD2-CB 3.94Å; L44-A53 HydrophobicContact CB-CB 3.76Å; L44-A53 HydrophobicContact CD1-CB 4.47Å; L44-A56 HydrophobicContact CD1-CB 3.89Å
45I94Very high93.9Very high34 Ų3465.4 Ų65.417%0.17432%0.321CS..Hα-helixtrans-60.7-45.2173.9-67.5167.2000110.6V41 Q47 W48 A53 K80 V81V41-I45 HydrophobicContact CG1-CD1 3.87Å; V41-I45 HydrophobicContact CG1-CG1 4.41Å; V41-I45 WeakPolarHBondContact O-CG1 3.38Å; V41-I45 PolarHBondContact O-N 3.08Å; I45-Q47 VanDerWaalsContact C-N 3.27Å; I45-Q47 PolarHBondContact O-N 3.47Å; I45-W48 PolarHBondContact O-N 3.03Å; I45-A53 HydrophobicContact CG1-CB 4.24Å; I45-K80 HydrophobicContact CD1-CD 4.29Å; I45-K80 HydrophobicContact CD1-CG 4.2Å; I45-V81 HydrophobicContact CD1-CG2 3.97Å; I45-V81 HydrophobicContact CG1-CG2 4.45Å
46R94.4Very high94.2Very high200 Ų20065.2 Ų65.276%0.75532%0.318SS*.Hα-helixtrans-64.4-32178.7-71.8173.1-170.2-146.24.8113D42 S43 L44 W48D42-R46 VanDerWaalsContact O-CG 3.25Å; D42-R46 WeakPolarHBondContact O-CG 3.4Å; D42-R46 PolarHBondContact O-N 3.26Å; D42-R46 VanDerWaalsContact O-N 3.1Å; S43-R46 PolarHBondContact O-N 3.37Å; L44-R46 PolarHBondContact O-N 3.11Å; R46-W48 PolarHBondContact O-N 3.25Å
47Q94.1Very high94.4Very high123 Ų12364.5 Ų64.558%0.57531%0.313SS*.THydrogen-bonded Turntrans-79.6-0.2175.9-68.3174.841.600113.2S43 L44 I45 N49S43-Q47 VanDerWaalsContact O-CG 3.28Å; S43-Q47 WeakPolarHBondContact O-CG 3.48Å; S43-Q47 PolarHBondContact O-N 3.15Å; S43-Q47 PolarHBondContact OG-NE2 3.16Å; L44-Q47 PolarHBondContact O-N 3.49Å; I45-Q47 VanDerWaalsContact C-N 3.27Å; I45-Q47 PolarHBondContact O-N 3.47Å; Q47-N49 PolarHBondContact O-N 3.36Å
48W90.5Very high94.6Very high204 Ų20460.9 Ų60.977%0.77329%0.294SS*.THydrogen-bonded Turntrans59.318.9-172.7-61.690000113.9L44 I45 R46 L50L44-W48 PolarHBondContact O-N 2.92Å; I45-W48 PolarHBondContact O-N 3.03Å; R46-W48 PolarHBondContact O-N 3.25Å; W48-L50 VanDerWaalsContact C-N 3.3Å; W48-L50 PolarHBondContact O-N 2.96Å; W48-L50 VanDerWaalsContact O-N 3.15Å
49N94.3Very high94.4Very high65 Ų6563.1 Ų63.135%0.34830%0.302SS..  trans-90.170.3175-166.5-6.1000110.1L44 Q47 I51 E52 A53L44-N49 HydrophobicContact CD2-CB 4.3Å; L44-N49 PolarHBondContact O-N 3.11Å; Q47-N49 PolarHBondContact O-N 3.36Å; N49-I51 PolarHBondContact O-N 3.37Å; N49-E52 VanDerWaalsContact ND2-CG 3.27Å; N49-E52 WeakPolarHBondContact ND2-CG 3.41Å; N49-E52 WeakPolarHBondContact OD1-CG 3.31Å; N49-A53 PolarHBondContact O-N 3.26Å; N49-A53 VanDerWaalsContact O-N 3.11Å
50L94.6Very high94.2Very high22 Ų2264.4 Ų64.412%0.11530%0.299CS..Hα-helixtrans-71-29.3-170.8-59.6-178.9000113.5W48 A53 L54 A84 F85W48-L50 VanDerWaalsContact C-N 3.3Å; W48-L50 PolarHBondContact O-N 2.96Å; W48-L50 VanDerWaalsContact O-N 3.15Å; L50-A53 WeakPolarHBondContact O-CB 3.26Å; L50-A53 PolarHBondContact O-N 3.1Å; L50-L54 PolarHBondContact O-N 2.9Å; L50-A84 WeakPolarHBondContact CD1-O 3.34Å; L50-A84 HydrophobicContact CD2-CB 3.98Å; L50-F85 VanDerWaalsContact C-CZ 3.44Å; L50-F85 HydrophobicContact CB-CD1 4.37Å; L50-F85 HydrophobicContact CB-CD2 4.16Å; L50-F85 HydrophobicContact CB-CE1 3.81Å; L50-F85 HydrophobicContact CB-CE2 3.6Å; L50-F85 HydrophobicContact CB-CZ 3.42Å; L50-F85 VanDerWaalsContact CB-CZ 3.42Å; L50-F85 HydrophobicContact CD1-CD1 4.32Å; L50-F85 HydrophobicContact CD1-CD2 4.33Å; L50-F85 HydrophobicContact CD1-CG 4.23Å; L50-F85 WeakPolarHBondContact O-CE2 3.5Å; L50-F85 VanDerWaalsContact O-CZ 3.24Å; L50-F85 WeakPolarHBondContact O-CZ 3.44Å
51I95.3Very high94Very high68 Ų6861.2 Ų61.235%0.34929%0.286SS..Hα-helixtrans-67.6-49.2178.2-63.4178.5000109.7N49 A53 L54 H55N49-I51 PolarHBondContact O-N 3.37Å; I51-A53 VanDerWaalsContact C-N 3.26Å; I51-A53 PolarHBondContact O-N 3.39Å; I51-L54 WeakPolarHBondContact O-CB 3.33Å; I51-L54 PolarHBondContact O-N 3.2Å; I51-L54 VanDerWaalsContact O-N 3.1Å; I51-H55 PolarHBondContact O-CD2 2.82Å; I51-H55 VanDerWaalsContact O-CD2 3.26Å; I51-H55 PolarHBondContact O-N 3.41Å
52E95.3Very high93.8Very high100 Ų10061.2 Ų61.247%0.46729%0.286SS..Hα-helixtrans-62.2-36.1174.9-68.8-62.1153.200111.5L44 N49 L54 H55 A56L44-E52 HydrophobicContact CD1-CB 4.16Å; L44-E52 HydrophobicContact CD2-CB 3.94Å; N49-E52 VanDerWaalsContact ND2-CG 3.27Å; N49-E52 WeakPolarHBondContact ND2-CG 3.41Å; N49-E52 WeakPolarHBondContact OD1-CG 3.31Å; E52-L54 VanDerWaalsContact C-N 3.29Å; E52-L54 PolarHBondContact O-N 3Å; E52-H55 PolarHBondContact O-N 3.41Å; E52-A56 WeakPolarHBondContact O-CB 3.48Å; E52-A56 PolarHBondContact O-N 3.05Å
53A96.3Very high93.6Very high0 Ų062 Ų620%029%0.289CS..Hα-helixtrans-60.3-39.2174.200000112.2L44 I45 N49 L50 I51 A56 V57 V81L44-A53 HydrophobicContact CB-CB 3.76Å; L44-A53 HydrophobicContact CD1-CB 4.47Å; I45-A53 HydrophobicContact CG1-CB 4.24Å; N49-A53 PolarHBondContact O-N 3.26Å; N49-A53 VanDerWaalsContact O-N 3.11Å; L50-A53 WeakPolarHBondContact O-CB 3.26Å; L50-A53 PolarHBondContact O-N 3.1Å; I51-A53 VanDerWaalsContact C-N 3.26Å; I51-A53 PolarHBondContact O-N 3.39Å; A53-A56 PolarHBondContact O-N 3.15Å; A53-V57 WeakPolarHBondContact O-CB 3.3Å; A53-V57 PolarHBondContact O-N 3.13Å; A53-V81 HydrophobicContact CB-CG1 4.28Å; A53-V81 HydrophobicContact CB-CG2 4.31Å
54L96.4Very high93.2Very high0 Ų062.3 Ų62.30%029%0.287CS..Hα-helixtrans-65.8-42.4175.1-178.565.6000111.7L50 I51 E52 V57 L58 V81 L82 F85 A93 L97 W127L50-L54 PolarHBondContact O-N 2.9Å; I51-L54 WeakPolarHBondContact O-CB 3.33Å; I51-L54 PolarHBondContact O-N 3.2Å; I51-L54 VanDerWaalsContact O-N 3.1Å; E52-L54 VanDerWaalsContact C-N 3.29Å; E52-L54 PolarHBondContact O-N 3Å; L54-V57 HydrophobicContact CD1-CG1 4.49Å; L54-V57 WeakPolarHBondContact O-CG1 3.39Å; L54-L58 HydrophobicContact CD1-CD1 3.99Å; L54-L58 HydrophobicContact CD1-CG 4.43Å; L54-L58 HydrophobicContact CG-CD1 4.18Å; L54-L58 VanDerWaalsContact O-CG 3.28Å; L54-L58 WeakPolarHBondContact O-CG 3.45Å; L54-L58 PolarHBondContact O-N 3.45Å; L54-V81 HydrophobicContact CB-CG1 4.25Å; L54-V81 HydrophobicContact CD1-CG1 4.43Å; L54-L82 HydrophobicContact CD1-CD2 4Å; L54-F85 HydrophobicContact CB-CE2 4.41Å; L54-F85 HydrophobicContact CB-CZ 4.45Å; L54-A93 HydrophobicContact CD2-CB 3.86Å; L54-L97 HydrophobicContact CD2-CD1 4.16Å; L54-L97 HydrophobicContact CD2-CD2 4.34Å; L54-L97 HydrophobicContact CD2-CG 4.36Å; L54-L97 HydrophobicContact CG-CD2 4.39Å; L54-W127 HydrophobicContact CD1-CH2 4.48Å; L54-W127 HydrophobicContact CD2-CH2 4.02Å; L54-W127 HydrophobicContact CD2-CZ3 4.11Å
55H95.6Very high92.7Very high70 Ų7061.5 Ų61.532%0.32428%0.283SS..Hα-helixtrans-64.6-44.2175.2-80-80.2000111.8I51 E52 V57 L58 K59 S96I51-H55 PolarHBondContact O-CD2 2.82Å; I51-H55 VanDerWaalsContact O-CD2 3.26Å; I51-H55 PolarHBondContact O-N 3.41Å; E52-H55 PolarHBondContact O-N 3.41Å; H55-V57 PolarHBondContact O-N 3.4Å; H55-L58 PolarHBondContact O-N 3.21Å; H55-K59 PolarHBondContact O-N 2.95Å; H55-S96 PolarHBondContact CE1-O 3.47Å; H55-S96 VanDerWaalsContact CE1-O 3.24Å; H55-S96 PolarHBondContact NE2-O 3.02Å; H55-S96 PolarHBondContact NE2-OG 3.31Å; H55-S96 VanDerWaalsContact NE2-OG 3.08Å
56A95.2Very high92.3Very high9 Ų967 Ų677%0.07431%0.306CS..Hα-helixtrans-61.3-45179.500000112E40 V41 L44 E52 A53 L58 K59E40-A56 HydrophobicContact CG-CB 4.45Å; V41-A56 HydrophobicContact CG2-CB 3.99Å; L44-A56 HydrophobicContact CD1-CB 3.89Å; E52-A56 WeakPolarHBondContact O-CB 3.48Å; E52-A56 PolarHBondContact O-N 3.05Å; A53-A56 PolarHBondContact O-N 3.15Å; A56-L58 VanDerWaalsContact C-N 3.27Å; A56-L58 PolarHBondContact O-N 3.35Å; A56-K59 WeakPolarHBondContact O-CB 3.29Å; A56-K59 PolarHBondContact O-N 3.4Å
57V95.5Very high92.1Very high0 Ų061 Ų610%029%0.289CS..Hα-helixtrans-69.5-25.2-178.479.90000113.1P36 V41 A53 L54 H55 L77 V78 V81P36-V57 HydrophobicContact CB-CG2 4.11Å; P36-V57 HydrophobicContact CG-CG2 3.93Å; V41-V57 HydrophobicContact CG2-CB 4.04Å; V41-V57 HydrophobicContact CG2-CG2 4.43Å; A53-V57 WeakPolarHBondContact O-CB 3.3Å; A53-V57 PolarHBondContact O-N 3.13Å; L54-V57 HydrophobicContact CD1-CG1 4.49Å; L54-V57 WeakPolarHBondContact O-CG1 3.39Å; H55-V57 PolarHBondContact O-N 3.4Å; V57-L77 HydrophobicContact CG2-CB 4.07Å; V57-L77 HydrophobicContact CG2-CD2 3.99Å; V57-L77 HydrophobicContact CG2-CG 3.79Å; V57-V78 HydrophobicContact CB-CG2 4.38Å; V57-V78 HydrophobicContact CG1-CG2 4.03Å; V57-V78 HydrophobicContact CG2-CB 4.3Å; V57-V78 HydrophobicContact CG2-CG2 3.49Å; V57-V78 VanDerWaalsContact CG2-CG2 3.49Å; V57-V81 HydrophobicContact CB-CG2 4.39Å; V57-V81 HydrophobicContact CG1-CB 4.5Å; V57-V81 HydrophobicContact CG1-CG2 4.29Å
58L94.6Very high91.9Very high14 Ų1459.3 Ų59.37%0.07328%0.281CS..Hα-helixtrans-90.5-6.6178.6-65.4178.7000113.9L54 H55 A56 L97 L104 L105 Y108L54-L58 HydrophobicContact CD1-CD1 3.99Å; L54-L58 HydrophobicContact CD1-CG 4.43Å; L54-L58 HydrophobicContact CG-CD1 4.18Å; L54-L58 VanDerWaalsContact O-CG 3.28Å; L54-L58 WeakPolarHBondContact O-CG 3.45Å; L54-L58 PolarHBondContact O-N 3.45Å; H55-L58 PolarHBondContact O-N 3.21Å; A56-L58 VanDerWaalsContact C-N 3.27Å; A56-L58 PolarHBondContact O-N 3.35Å; L58-L97 HydrophobicContact CD1-CD1 3.89Å; L58-L97 HydrophobicContact CD1-CD2 3.83Å; L58-L104 HydrophobicContact CB-CD2 4.13Å; L58-L104 HydrophobicContact CD2-CD2 4.04Å; L58-L104 HydrophobicContact CD2-CG 4.08Å; L58-L104 VanDerWaalsContact O-CD2 3.24Å; L58-L104 WeakPolarHBondContact O-CD2 3.25Å; L58-L105 HydrophobicContact CD1-CB 4.38Å; L58-Y108 HydrophobicContact CD2-CD2 3.82Å; L58-Y108 HydrophobicContact CD2-CE2 3.95Å
59K88.9Confident91.9Very high145 Ų14555.3 Ų55.363%0.6328%0.275SS*.SBendtrans-69.5-40.2-172-169.6175.1-179.7179.40114.3H55 A56H55-K59 PolarHBondContact O-N 2.95Å; A56-K59 WeakPolarHBondContact O-CB 3.29Å; A56-K59 PolarHBondContact O-N 3.4Å
60N87.8Confident91.7Very high98 Ų9853 Ų5352%0.52426%0.263SS..SBendtrans-130.668.9-174.2-66.9-42.2000111.7G35G35-N60 CarbonylContact C-O 3.26Å; G35-N60 VanDerWaalsContact C-O 3.26Å; G35-N60 VanDerWaalsContact CA-O 3.29Å; G35-N60 WeakPolarHBondContact CA-O 3.24Å
61P89.9Confident91.6Very high23 Ų2353.5 Ų53.515%0.14926%0.264CS..  trans-70.3137-179.631.8-37.2000111.2I63 L104 Y108 V150P61-I63 HydrophobicContact CB-CD1 4.1Å; P61-I63 HydrophobicContact CB-CG1 3.92Å; P61-I63 HydrophobicContact CG-CD1 3.66Å; P61-I63 HydrophobicContact CG-CG1 3.96Å; P61-I63 PolarHBondContact O-N 3.43Å; P61-L104 HydrophobicContact CB-CD1 3.9Å; P61-L104 HydrophobicContact CB-CD2 4.01Å; P61-L104 HydrophobicContact CG-CD1 4.05Å; P61-L104 HydrophobicContact CG-CD2 3.73Å; P61-Y108 HydrophobicContact CB-CE2 4.44Å; P61-V150 HydrophobicContact CB-CG1 4.08Å
62P91.4Very high91.5Very high0 Ų052.2 Ų52.20%026%0.258CS..  trans-77.961.5-179.733.7-36.6000112.4T65 V70 K71 A74P62-T65 HydrophobicContact CB-CG2 3.66Å; P62-V70 HydrophobicContact CB-CG1 3.7Å; P62-V70 HydrophobicContact CG-CG1 4.2Å; P62-K71 HydrophobicContact CB-CG 4.43Å; P62-K71 HydrophobicContact CG-CG 4.18Å; P62-K71 VanDerWaalsContact O-CE 3.31Å; P62-K71 WeakPolarHBondContact O-CE 3.36Å; P62-A74 HydrophobicContact CG-CB 3.62Å
63I89.3Confident91.3Very high48 Ų4854.9 Ų54.925%0.24626%0.264CS..  trans-75.8-36.1-175-63.1174.5000112Q33 P61 L104 K148 V150Q33-I63 VanDerWaalsContact OE1-N 3.1Å; P61-I63 HydrophobicContact CB-CD1 4.1Å; P61-I63 HydrophobicContact CB-CG1 3.92Å; P61-I63 HydrophobicContact CG-CD1 3.66Å; P61-I63 HydrophobicContact CG-CG1 3.96Å; P61-I63 PolarHBondContact O-N 3.43Å; I63-L104 HydrophobicContact CD1-CD1 4.4Å; I63-K148 HydrophobicContact CG2-CB 3.65Å; I63-V150 HydrophobicContact CG1-CG1 4.14Å
64N87.2Confident91.2Very high61 Ų6155 Ų5533%0.32627%0.265SS..SBendtrans-98.4-2.5-171.1-64-33.8000113.5G30G30-N64 WeakPolarHBondContact CA-O 3.28Å
65T86.7Confident91.1Very high7 Ų755.2 Ų55.24%0.04327%0.266CS..  trans-85.3143.1175.2-1720000111.2G30 P62 N67 V70 K71G30-T65 WeakPolarHBondContact O-CB 3.4Å; P62-T65 HydrophobicContact CB-CG2 3.66Å; T65-N67 VanDerWaalsContact C-N 3.3Å; T65-N67 WeakPolarHBondContact OG1-CB 3.38Å; T65-N67 PolarHBondContact OG1-N 3Å; T65-N67 VanDerWaalsContact OG1-N 3.12Å; T65-V70 HydrophobicContact CG2-CB 4.3Å; T65-V70 HydrophobicContact CG2-CG1 4.43Å; T65-K71 HydrophobicContact CG2-CG 4.31Å; T65-K71 WeakPolarHBondContact O-CE 3.48Å
66K85.4Confident90.9Very high149 Ų14953.8 Ų53.865%0.64827%0.27SS*.  trans-85.3-7.2168.2-61.2-174.9-171.8178.80112.2E27 Q68E27-K66 IonicContact OE1-NZ 3.39Å; E27-K66 PolarHBondContact OE1-NZ 2.93Å; E27-K66 IonicContact OE2-NZ 2.87Å; E27-K66 PolarHBondContact OE2-NZ 3.36Å; K66-Q68 PolarHBondContact O-N 2.7Å; K66-Q68 VanDerWaalsContact O-N 3.13Å
67N88.8Confident90.9Very high74 Ų7453.8 Ų53.840%0.39627%0.269SS..  trans-76.8102.3-176.7-169.8-16.1000111T65 N69 V70 K71T65-N67 VanDerWaalsContact C-N 3.3Å; T65-N67 WeakPolarHBondContact OG1-CB 3.38Å; T65-N67 PolarHBondContact OG1-N 3Å; T65-N67 VanDerWaalsContact OG1-N 3.12Å; N67-N69 PolarHBondContact O-N 3.3Å; N67-N69 WeakPolarHBondContact OD1-CB 3.24Å; N67-N69 PolarHBondContact OD1-N 3.22Å; N67-N69 VanDerWaalsContact OD1-N 3.12Å; N67-V70 HydrophobicContact CB-CG2 4.08Å; N67-V70 PolarHBondContact O-N 3.05Å; N67-V70 VanDerWaalsContact O-N 3.14Å; N67-K71 PolarHBondContact O-N 2.99Å
68Q90.1Very high90.9Very high89 Ų8953.8 Ų53.842%0.41627%0.269SS..Hα-helixtrans-59.2-31.5-179.5-165.559.843.700112.9K66 V70 K71 D72K66-Q68 PolarHBondContact O-N 2.7Å; K66-Q68 VanDerWaalsContact O-N 3.13Å; Q68-V70 VanDerWaalsContact C-N 3.28Å; Q68-V70 PolarHBondContact O-N 2.84Å; Q68-K71 PolarHBondContact O-N 2.99Å; Q68-D72 PolarHBondContact NE2-OD1 3.3Å; Q68-D72 WeakPolarHBondContact O-CB 3.49Å; Q68-D72 PolarHBondContact O-N 3.5Å
69N90.9Very high90.9Very high120 Ų12054.6 Ų54.664%0.64227%0.273SS*.Hα-helixtrans-65.3-32.6-179.9-63.2-45.8000112.5N67 R73N67-N69 PolarHBondContact O-N 3.3Å; N67-N69 WeakPolarHBondContact OD1-CB 3.24Å; N67-N69 PolarHBondContact OD1-N 3.22Å; N67-N69 VanDerWaalsContact OD1-N 3.12Å; N69-R73 WeakPolarHBondContact O-CB 3.43Å; N69-R73 PolarHBondContact O-N 2.83Å; N69-R73 VanDerWaalsContact O-N 3.08Å
70V91.3Very high91.1Very high17 Ų1752 Ų5210%0.10326%0.262CS..Hα-helixtrans-73.3-40.9177.8179.50000110.4L34 P62 T65 N67 Q68 R73 A74L34-V70 VanDerWaalsContact C-CG1 3.49Å; L34-V70 WeakPolarHBondContact O-CG1 3.43Å; P62-V70 HydrophobicContact CB-CG1 3.7Å; P62-V70 HydrophobicContact CG-CG1 4.2Å; T65-V70 HydrophobicContact CG2-CB 4.3Å; T65-V70 HydrophobicContact CG2-CG1 4.43Å; N67-V70 HydrophobicContact CB-CG2 4.08Å; N67-V70 PolarHBondContact O-N 3.05Å; N67-V70 VanDerWaalsContact O-N 3.14Å; Q68-V70 VanDerWaalsContact C-N 3.28Å; Q68-V70 PolarHBondContact O-N 2.84Å; V70-R73 PolarHBondContact O-N 3.39Å; V70-A74 PolarHBondContact O-N 3.1Å
71K92.4Very high91.5Very high31 Ų3147.4 Ų47.414%0.13524%0.237CC..Hα-helixtrans-60.4-49.7174.6-68.1-171.1178.2-159.90111.8P62 T65 N67 Q68 R73 A74 E75 T149 V150P62-K71 HydrophobicContact CB-CG 4.43Å; P62-K71 HydrophobicContact CG-CG 4.18Å; P62-K71 VanDerWaalsContact O-CE 3.31Å; P62-K71 WeakPolarHBondContact O-CE 3.36Å; T65-K71 HydrophobicContact CG2-CG 4.31Å; T65-K71 WeakPolarHBondContact O-CE 3.48Å; N67-K71 PolarHBondContact O-N 2.99Å; Q68-K71 PolarHBondContact O-N 2.99Å; K71-R73 VanDerWaalsContact C-N 3.29Å; K71-R73 PolarHBondContact O-N 3.38Å; K71-A74 PolarHBondContact O-N 3.3Å; K71-E75 WeakPolarHBondContact O-CB 3.34Å; K71-E75 PolarHBondContact O-N 3.2Å; K71-T149 PolarHBondContact NZ-O 3.34Å; K71-V150 WeakPolarHBondContact CB-OXT 3.46Å; K71-V150 WeakPolarHBondContact CD-OXT 3.22Å
72D92.3Very high91.7Very high42 Ų4246.3 Ų46.323%0.22523%0.23CC..Hα-helixtrans-62.2-35.8178.5-74.419.3000111.8Q68 G76 R115Q68-D72 PolarHBondContact NE2-OD1 3.3Å; Q68-D72 WeakPolarHBondContact O-CB 3.49Å; Q68-D72 PolarHBondContact O-N 3.5Å; D72-G76 PolarHBondContact O-N 3.49Å; D72-R115 VanDerWaalsContact CG-NH1 3.3Å; D72-R115 IonicContact OD1-CZ 2.61Å; D72-R115 IonicContact OD1-NH1 2.82Å; D72-R115 IonicContact OD1-NH2 3.92Å; D72-R115 PolarHBondContact OD1-NH2 2.88Å; D72-R115 IonicContact OD2-CZ 2.79Å; D72-R115 VanDerWaalsContact OD2-CZ 3.32Å; D72-R115 IonicContact OD2-NH1 2.7Å; D72-R115 PolarHBondContact OD2-NH1 2.8Å; D72-R115 IonicContact OD2-NH2 3.32Å; D72-R115 PolarHBondContact OD2-NH2 3.33Å
73R92.2Very high91.8Very high155 Ų15549.5 Ų49.559%0.58525%0.252SS*.Hα-helixtrans-66.4-46.6174-174.7-175.7-61170.8-1.2111.8N69 V70 K71 E75 G76 L77N69-R73 WeakPolarHBondContact O-CB 3.43Å; N69-R73 PolarHBondContact O-N 2.83Å; N69-R73 VanDerWaalsContact O-N 3.08Å; V70-R73 PolarHBondContact O-N 3.39Å; K71-R73 VanDerWaalsContact C-N 3.29Å; K71-R73 PolarHBondContact O-N 3.38Å; R73-E75 VanDerWaalsContact C-N 3.34Å; R73-G76 PolarHBondContact O-N 3.27Å; R73-L77 PolarHBondContact O-N 2.99Å
74A93.8Very high92.1Very high2 Ų248.9 Ų48.92%0.01725%0.254CS..Hα-helixtrans-61.5-44.2177.500000111.1P36 P62 V70 K71 L77 V78P36-A74 HydrophobicContact CG-CB 4.05Å; P62-A74 HydrophobicContact CG-CB 3.62Å; V70-A74 PolarHBondContact O-N 3.1Å; K71-A74 PolarHBondContact O-N 3.3Å; A74-L77 PolarHBondContact O-N 3.48Å; A74-V78 WeakPolarHBondContact O-CG2 3.38Å; A74-V78 PolarHBondContact O-N 3.01Å
75E93.1Very high92.5Very high6 Ų646.8 Ų46.83%0.02824%0.242CC..Hα-helixtrans-55.4-52.1173.6-177.2-164.4151.300111.2K71 R73 L77 V78 L79 K111K71-E75 WeakPolarHBondContact O-CB 3.34Å; K71-E75 PolarHBondContact O-N 3.2Å; R73-E75 VanDerWaalsContact C-N 3.34Å; E75-L77 VanDerWaalsContact C-N 3.26Å; E75-L77 PolarHBondContact O-N 3.11Å; E75-V78 PolarHBondContact O-N 3.15Å; E75-V78 VanDerWaalsContact O-N 3.16Å; E75-L79 HydrophobicContact CG-CD1 4.11Å; E75-L79 HydrophobicContact CG-CG 4.42Å; E75-L79 WeakPolarHBondContact O-CG 3.42Å; E75-L79 PolarHBondContact O-N 3.43Å; E75-K111 HydrophobicContact CG-CG 3.84Å; E75-K111 VanDerWaalsContact OE2-CE 3.22Å; E75-K111 WeakPolarHBondContact OE2-CE 3.37Å; E75-K111 WeakPolarHBondContact OE2-CG 3.4Å
76G92.9Very high92.8Very high40 Ų4053.1 Ų53.141%0.41227%0.269SS..Hα-helixtrans-57.9-39.2179.200000112.9D72 R73 K80D72-G76 PolarHBondContact O-N 3.49Å; R73-G76 PolarHBondContact O-N 3.27Å; G76-K80 WeakPolarHBondContact O-CB 3.35Å; G76-K80 PolarHBondContact O-N 3.04Å
77L94.6Very high93.2Very high9 Ų949.2 Ų49.25%0.04726%0.261CS..Hα-helixtrans-68.8-41.9177.3-16761000112P36 E38 V41 V57 R73 A74 E75 K80 V81P36-L77 HydrophobicContact CB-CD2 4.13Å; P36-L77 HydrophobicContact CG-CD2 3.95Å; E38-L77 HydrophobicContact CB-CD2 4.32Å; E38-L77 HydrophobicContact CG-CD1 4.23Å; V41-L77 HydrophobicContact CB-CD1 4.01Å; V41-L77 HydrophobicContact CB-CD2 3.95Å; V41-L77 HydrophobicContact CB-CG 4.14Å; V41-L77 HydrophobicContact CG1-CD1 3.67Å; V41-L77 HydrophobicContact CG1-CD2 4.24Å; V41-L77 HydrophobicContact CG1-CG 3.86Å; V41-L77 HydrophobicContact CG2-CD2 3.85Å; V41-L77 HydrophobicContact CG2-CG 4.33Å; V57-L77 HydrophobicContact CG2-CB 4.07Å; V57-L77 HydrophobicContact CG2-CD2 3.99Å; V57-L77 HydrophobicContact CG2-CG 3.79Å; R73-L77 PolarHBondContact O-N 2.99Å; A74-L77 PolarHBondContact O-N 3.48Å; E75-L77 VanDerWaalsContact C-N 3.26Å; E75-L77 PolarHBondContact O-N 3.11Å; L77-K80 HydrophobicContact CD1-CD 4.45Å; L77-K80 WeakPolarHBondContact O-CB 3.28Å; L77-K80 PolarHBondContact O-N 3.44Å; L77-V81 WeakPolarHBondContact O-CG2 3.37Å; L77-V81 PolarHBondContact O-N 3.37Å
78V95.3Very high93.5Very high0 Ų050 Ų500%027%0.271CS..Hα-helixtrans-61-50.2174.5175.10000110.1V57 A74 E75 K80 V81 L82 Y108V57-V78 HydrophobicContact CB-CG2 4.38Å; V57-V78 HydrophobicContact CG1-CG2 4.03Å; V57-V78 HydrophobicContact CG2-CB 4.3Å; V57-V78 HydrophobicContact CG2-CG2 3.49Å; V57-V78 VanDerWaalsContact CG2-CG2 3.49Å; A74-V78 WeakPolarHBondContact O-CG2 3.38Å; A74-V78 PolarHBondContact O-N 3.01Å; E75-V78 PolarHBondContact O-N 3.15Å; E75-V78 VanDerWaalsContact O-N 3.16Å; V78-K80 VanDerWaalsContact C-N 3.26Å; V78-K80 PolarHBondContact O-N 3.26Å; V78-V81 PolarHBondContact O-N 3.19Å; V78-L82 HydrophobicContact CG1-CD1 3.93Å; V78-L82 HydrophobicContact CG1-CG 4Å; V78-L82 WeakPolarHBondContact O-CG 3.38Å; V78-L82 PolarHBondContact O-N 3.05Å; V78-Y108 HydrophobicContact CB-CD1 4.22Å; V78-Y108 HydrophobicContact CB-CG 4.23Å; V78-Y108 HydrophobicContact CG1-CD1 4.42Å; V78-Y108 HydrophobicContact CG1-CD2 4.36Å; V78-Y108 HydrophobicContact CG1-CG 3.97Å; V78-Y108 HydrophobicContact CG2-CD1 3.9Å; V78-Y108 HydrophobicContact CG2-CD2 3.94Å; V78-Y108 HydrophobicContact CG2-CE1 3.91Å; V78-Y108 HydrophobicContact CG2-CE2 3.93Å; V78-Y108 HydrophobicContact CG2-CG 3.91Å
79L93.9Very high93.8Very high30 Ų3048.6 Ų48.616%0.15727%0.267CS..Hα-helixtrans-60.2-36.9179.9-67.5-179.8000112.4E75 L82 S83 L124E75-L79 HydrophobicContact CG-CD1 4.11Å; E75-L79 HydrophobicContact CG-CG 4.42Å; E75-L79 WeakPolarHBondContact O-CG 3.42Å; E75-L79 PolarHBondContact O-N 3.43Å; L79-L82 PolarHBondContact O-N 3.44Å; L79-S83 VanDerWaalsContact O-CB 3.29Å; L79-S83 WeakPolarHBondContact O-CB 3.46Å; L79-S83 PolarHBondContact O-N 2.94Å; L79-S83 PolarHBondContact O-OG 3.46Å; L79-L124 HydrophobicContact CD2-CD1 4.17Å; L79-L124 HydrophobicContact CD2-CD2 3.8Å; L79-L124 HydrophobicContact CD2-CG 4.44Å
80K93.8Very high94.1Very high92 Ų9243 Ų4340%0.424%0.237SC..Hα-helixtrans-60.8-46.1173.2-175.6-177.4-178.4-177.80111.7D42 I45 G76 L77 V78 S83 A84D42-K80 WeakPolarHBondContact OD1-CE 3.26Å; D42-K80 IonicContact OD1-NZ 2.63Å; D42-K80 PolarHBondContact OD1-NZ 3.41Å; D42-K80 IonicContact OD2-NZ 2.93Å; D42-K80 PolarHBondContact OD2-NZ 3.49Å; I45-K80 HydrophobicContact CD1-CD 4.29Å; I45-K80 HydrophobicContact CD1-CG 4.2Å; G76-K80 WeakPolarHBondContact O-CB 3.35Å; G76-K80 PolarHBondContact O-N 3.04Å; L77-K80 HydrophobicContact CD1-CD 4.45Å; L77-K80 WeakPolarHBondContact O-CB 3.28Å; L77-K80 PolarHBondContact O-N 3.44Å; V78-K80 VanDerWaalsContact C-N 3.26Å; V78-K80 PolarHBondContact O-N 3.26Å; K80-S83 PolarHBondContact O-N 3.3Å; K80-A84 PolarHBondContact O-N 3.32Å
81V95.8Very high94.4Very high0 Ų046.7 Ų46.70%025%0.253CS..Hα-helixtrans-62.9-50.9175.9174.50000110.6V41 I45 A53 L54 V57 L77 V78 S83 A84 F85V41-V81 HydrophobicContact CG1-CG2 3.41Å; V41-V81 VanDerWaalsContact CG1-CG2 3.41Å; I45-V81 HydrophobicContact CD1-CG2 3.97Å; I45-V81 HydrophobicContact CG1-CG2 4.45Å; A53-V81 HydrophobicContact CB-CG1 4.28Å; A53-V81 HydrophobicContact CB-CG2 4.31Å; L54-V81 HydrophobicContact CB-CG1 4.25Å; L54-V81 HydrophobicContact CD1-CG1 4.43Å; V57-V81 HydrophobicContact CB-CG2 4.39Å; V57-V81 HydrophobicContact CG1-CB 4.5Å; V57-V81 HydrophobicContact CG1-CG2 4.29Å; L77-V81 WeakPolarHBondContact O-CG2 3.37Å; L77-V81 PolarHBondContact O-N 3.37Å; V78-V81 PolarHBondContact O-N 3.19Å; V81-S83 PolarHBondContact O-N 3.21Å; V81-A84 WeakPolarHBondContact O-CB 3.49Å; V81-A84 PolarHBondContact O-N 3.34Å; V81-F85 HydrophobicContact CG1-CD2 4.45Å; V81-F85 HydrophobicContact CG1-CE2 3.95Å; V81-F85 WeakPolarHBondContact O-CD2 3.34Å
82L95.4Very high94.6Very high1 Ų151.8 Ų51.81%0.00528%0.275CS..Hα-helixtrans-59.1-35.3-178.5-62.2-174000112.4L54 V78 L79 A84 L105 I109 L124 W127L54-L82 HydrophobicContact CD1-CD2 4Å; V78-L82 HydrophobicContact CG1-CD1 3.93Å; V78-L82 HydrophobicContact CG1-CG 4Å; V78-L82 WeakPolarHBondContact O-CG 3.38Å; V78-L82 PolarHBondContact O-N 3.05Å; L79-L82 PolarHBondContact O-N 3.44Å; L82-A84 VanDerWaalsContact C-N 3.35Å; L82-L105 HydrophobicContact CD1-CD1 4.24Å; L82-L105 HydrophobicContact CD2-CD1 3.79Å; L82-I109 HydrophobicContact CD1-CG1 4.42Å; L82-L124 HydrophobicContact CD1-CD2 3.86Å; L82-W127 HydrophobicContact CB-CZ2 4.33Å; L82-W127 HydrophobicContact CD2-CD2 3.67Å; L82-W127 HydrophobicContact CD2-CE3 3.83Å; L82-W127 HydrophobicContact CD2-CG 4.35Å; L82-W127 HydrophobicContact CD2-CH2 3.7Å; L82-W127 HydrophobicContact CD2-CZ2 3.53Å; L82-W127 HydrophobicContact CD2-CZ3 3.84Å; L82-W127 HydrophobicContact CG-CD2 4.47Å; L82-W127 PolarHBondContact O-NE1 3.35Å
83S93.8Very high94.8Very high66 Ų6649.8 Ų49.846%0.46227%0.265SS..Hα-helixtrans-75.8-20.4178.4-560000113.7L79 K80 V81 F85L79-S83 VanDerWaalsContact O-CB 3.29Å; L79-S83 WeakPolarHBondContact O-CB 3.46Å; L79-S83 PolarHBondContact O-N 2.94Å; L79-S83 PolarHBondContact O-OG 3.46Å; K80-S83 PolarHBondContact O-N 3.3Å; V81-S83 PolarHBondContact O-N 3.21Å; S83-F85 VanDerWaalsContact C-N 3.33Å
84A94.3Very high95.1Very high35 Ų3542.5 Ų42.529%0.28924%0.238SC..Hα-helixtrans-78.2-18.8177.900000113L50 K80 V81 L82L50-A84 WeakPolarHBondContact CD1-O 3.34Å; L50-A84 HydrophobicContact CD2-CB 3.98Å; K80-A84 PolarHBondContact O-N 3.32Å; V81-A84 WeakPolarHBondContact O-CB 3.49Å; V81-A84 PolarHBondContact O-N 3.34Å; L82-A84 VanDerWaalsContact C-N 3.35Å
85F95.4Very high95.2Very high18 Ų1848.7 Ų48.78%0.07927%0.266CS..SBendtrans-74.2144.9178.7-85.7-96.4000112.5L50 L54 V81 S83 D89 I90 A93 W127L50-F85 VanDerWaalsContact C-CZ 3.44Å; L50-F85 HydrophobicContact CB-CD1 4.37Å; L50-F85 HydrophobicContact CB-CD2 4.16Å; L50-F85 HydrophobicContact CB-CE1 3.81Å; L50-F85 HydrophobicContact CB-CE2 3.6Å; L50-F85 HydrophobicContact CB-CZ 3.42Å; L50-F85 VanDerWaalsContact CB-CZ 3.42Å; L50-F85 HydrophobicContact CD1-CD1 4.32Å; L50-F85 HydrophobicContact CD1-CD2 4.33Å; L50-F85 HydrophobicContact CD1-CG 4.23Å; L50-F85 WeakPolarHBondContact O-CE2 3.5Å; L50-F85 VanDerWaalsContact O-CZ 3.24Å; L50-F85 WeakPolarHBondContact O-CZ 3.44Å; L54-F85 HydrophobicContact CB-CE2 4.41Å; L54-F85 HydrophobicContact CB-CZ 4.45Å; V81-F85 HydrophobicContact CG1-CD2 4.45Å; V81-F85 HydrophobicContact CG1-CE2 3.95Å; V81-F85 WeakPolarHBondContact O-CD2 3.34Å; S83-F85 VanDerWaalsContact C-N 3.33Å; F85-D89 HydrophobicContact CD1-CB 4.11Å; F85-I90 HydrophobicContact CB-CG1 4.23Å; F85-A93 HydrophobicContact CD1-CB 4.26Å; F85-A93 HydrophobicContact CE1-CB 3.49Å; F85-A93 VanDerWaalsContact CE1-CB 3.49Å; F85-A93 HydrophobicContact CZ-CB 3.76Å; F85-W127 HydrophobicContact CB-CZ2 3.8Å; F85-W127 HydrophobicContact CD1-CH2 4.46Å; F85-W127 HydrophobicContact CD1-CZ2 4.3Å; F85-W127 AromaticContact CD2-CH2 3.98Å; F85-W127 HydrophobicContact CD2-CH2 3.98Å; F85-W127 AromaticContact CD2-CZ2 3.55Å; F85-W127 HydrophobicContact CD2-CZ2 3.55Å; F85-W127 HydrophobicContact CE2-CH2 4.09Å; F85-W127 HydrophobicContact CE2-CZ2 4.13Å; F85-W127 HydrophobicContact CG-CH2 4.15Å; F85-W127 AromaticContact CG-CZ2 3.63Å; F85-W127 HydrophobicContact CG-CZ2 3.63Å; F85-W127 HydrophobicContact CZ-CH2 4.38Å
86K94.1Very high95.4Very high140 Ų14050.7 Ų50.761%0.60928%0.28SS*.  trans-82145.8164.2-62.6177.2-176.51740109.2S88 D89 I90K86-S88 PolarHBondContact O-N 2.77Å; K86-D89 PolarHBondContact O-N 3.12Å; K86-I90 PolarHBondContact O-N 3.34Å
87S93.7Very high95.6Very high67 Ų6749.7 Ų49.747%0.46927%0.266SS..THydrogen-bonded Turntrans-54.3-29.8179.8-47.90000114.1D89 Q126S87-D89 VanDerWaalsContact C-N 3.29Å; S87-D89 PolarHBondContact O-N 3.43Å; S87-Q126 PolarHBondContact OG-NE2 3Å; S87-Q126 VanDerWaalsContact OG-NE2 3.15Å; S87-Q126 PolarHBondContact OG-OE1 3.37Å
88S95.2Very high95.7Very high89 Ų8953.7 Ų53.762%0.62229%0.287SS*.THydrogen-bonded Turntrans-69.6-22.6177.754.40000114.4K86K86-S88 PolarHBondContact O-N 2.77Å
89D95.6Very high95.7Very high60 Ų6062.4 Ų62.432%0.32133%0.325SS..THydrogen-bonded Turntrans-102.5-12.3-172.2-60.6-39.4000112.5F85 K86 S87 E91 K92 A93F85-D89 HydrophobicContact CD1-CB 4.11Å; K86-D89 PolarHBondContact O-N 3.12Å; S87-D89 VanDerWaalsContact C-N 3.29Å; S87-D89 PolarHBondContact O-N 3.43Å; D89-E91 VanDerWaalsContact C-N 3.35Å; D89-E91 PolarHBondContact O-N 3.39Å; D89-K92 PolarHBondContact O-N 3.44Å; D89-A93 PolarHBondContact O-N 2.93Å; D89-A93 VanDerWaalsContact O-N 3.11Å
90I97.2Very high95.8Very high2 Ų266.4 Ų66.41%0.0135%0.347CS..Hα-helixtrans-57.2-46.1-179.3-64177.9000111.3F85 K86 K92 A93 V94 Q126 W127 K130F85-I90 HydrophobicContact CB-CG1 4.23Å; K86-I90 PolarHBondContact O-N 3.34Å; I90-K92 VanDerWaalsContact C-N 3.34Å; I90-K92 PolarHBondContact O-N 3.31Å; I90-A93 WeakPolarHBondContact O-CB 3.34Å; I90-A93 PolarHBondContact O-N 3.48Å; I90-A93 VanDerWaalsContact O-N 3.16Å; I90-V94 HydrophobicContact CG2-CG2 4.29Å; I90-V94 WeakPolarHBondContact O-CG2 3.35Å; I90-V94 PolarHBondContact O-N 3.2Å; I90-Q126 HydrophobicContact CD1-CB 3.91Å; I90-W127 HydrophobicContact CD1-CD2 4.44Å; I90-W127 HydrophobicContact CD1-CG 4.37Å; I90-W127 HydrophobicContact CG1-CD2 4.4Å; I90-W127 HydrophobicContact CG1-CZ2 4.1Å; I90-W127 HydrophobicContact CG2-CD2 3.68Å; I90-W127 HydrophobicContact CG2-CE3 3.67Å; I90-W127 HydrophobicContact CG2-CG 4.19Å; I90-W127 HydrophobicContact CG2-CH2 4.37Å; I90-W127 HydrophobicContact CG2-CZ2 4.37Å; I90-W127 HydrophobicContact CG2-CZ3 4.04Å; I90-K130 HydrophobicContact CG2-CB 4.05Å; I90-K130 HydrophobicContact CG2-CG 3.81Å
91E96.9Very high95.9Very high96 Ų9662.5 Ų62.545%0.44933%0.332SS..Hα-helixtrans-61.2-43.5-176.8-177.6173.2172.900112D89 A93 V94 Q95 K130D89-E91 VanDerWaalsContact C-N 3.35Å; D89-E91 PolarHBondContact O-N 3.39Å; E91-A93 VanDerWaalsContact C-N 3.33Å; E91-A93 PolarHBondContact O-N 3.1Å; E91-V94 PolarHBondContact O-N 3.25Å; E91-Q95 WeakPolarHBondContact O-CB 3.45Å; E91-Q95 VanDerWaalsContact O-CG 3.28Å; E91-Q95 WeakPolarHBondContact O-CG 3.49Å; E91-Q95 PolarHBondContact O-N 2.88Å; E91-Q95 PolarHBondContact OE1-NE2 2.87Å; E91-K130 HydrophobicContact CB-CD 4.31Å; E91-K130 HydrophobicContact CB-CG 4.41Å
92K96.8Very high96Very high137 Ų13762.8 Ų62.860%0.59633%0.334SS*.Hα-helixtrans-64.2-39.7176.5-66.5179.1-177.71720111.6D89 I90 Q95 S96D89-K92 PolarHBondContact O-N 3.44Å; I90-K92 VanDerWaalsContact C-N 3.34Å; I90-K92 PolarHBondContact O-N 3.31Å; K92-Q95 PolarHBondContact O-N 3.28Å; K92-S96 PolarHBondContact O-N 2.96Å; K92-S96 VanDerWaalsContact O-N 3.13Å
93A97.3Very high96.1Very high0 Ų063.7 Ų63.70%034%0.339CS..Hα-helixtrans-63.7-46.7178.200000111.5L54 F85 D89 I90 E91 Q95 S96 W127L54-A93 HydrophobicContact CD2-CB 3.86Å; F85-A93 HydrophobicContact CD1-CB 4.26Å; F85-A93 HydrophobicContact CE1-CB 3.49Å; F85-A93 VanDerWaalsContact CE1-CB 3.49Å; F85-A93 HydrophobicContact CZ-CB 3.76Å; D89-A93 PolarHBondContact O-N 2.93Å; D89-A93 VanDerWaalsContact O-N 3.11Å; I90-A93 WeakPolarHBondContact O-CB 3.34Å; I90-A93 PolarHBondContact O-N 3.48Å; I90-A93 VanDerWaalsContact O-N 3.16Å; E91-A93 VanDerWaalsContact C-N 3.33Å; E91-A93 PolarHBondContact O-N 3.1Å; A93-Q95 PolarHBondContact O-N 3.06Å; A93-S96 WeakPolarHBondContact O-CB 3.29Å; A93-S96 PolarHBondContact O-N 3.23Å; A93-S96 VanDerWaalsContact O-N 3.14Å; A93-S96 PolarHBondContact O-OG 3.17Å; A93-W127 HydrophobicContact CB-CH2 4.04Å; A93-W127 HydrophobicContact CB-CZ3 4.41Å
94V97.8Very high96.3Very high3 Ų361.6 Ų61.62%0.01832%0.322CS..Hα-helixtrans-63.2-40.8176.9175.80000111.5I90 E91 S96 L97 V102 L105 W127 K130 A134I90-V94 HydrophobicContact CG2-CG2 4.29Å; I90-V94 WeakPolarHBondContact O-CG2 3.35Å; I90-V94 PolarHBondContact O-N 3.2Å; E91-V94 PolarHBondContact O-N 3.25Å; V94-S96 PolarHBondContact O-N 3.5Å; V94-L97 WeakPolarHBondContact O-CB 3.43Å; V94-L97 PolarHBondContact O-N 2.96Å; V94-L97 VanDerWaalsContact O-N 3.14Å; V94-V102 HydrophobicContact CG1-CG2 4.3Å; V94-L105 HydrophobicContact CG2-CD2 4.03Å; V94-W127 HydrophobicContact CG2-CE3 3.86Å; V94-W127 HydrophobicContact CG2-CZ3 3.75Å; V94-K130 HydrophobicContact CB-CB 4.44Å; V94-K130 HydrophobicContact CG2-CB 4.02Å; V94-A134 HydrophobicContact CG1-CB 3.6Å
95Q96.9Very high96.5Very high132 Ų13259.9 Ų59.962%0.61731%0.308SS*.Hα-helixtrans-66.2-20176.7-73.3173.85.600113.6E91 K92 A93 L97E91-Q95 WeakPolarHBondContact O-CB 3.45Å; E91-Q95 VanDerWaalsContact O-CG 3.28Å; E91-Q95 WeakPolarHBondContact O-CG 3.49Å; E91-Q95 PolarHBondContact O-N 2.88Å; E91-Q95 PolarHBondContact OE1-NE2 2.87Å; K92-Q95 PolarHBondContact O-N 3.28Å; A93-Q95 PolarHBondContact O-N 3.06Å; Q95-L97 VanDerWaalsContact C-N 3.29Å
96S96.9Very high96.6Very high47 Ų4759 Ų5933%0.32931%0.305SS..THydrogen-bonded Turntrans-78.1-14.4175.281.10000113.5H55 K92 A93 V94H55-S96 PolarHBondContact CE1-O 3.47Å; H55-S96 VanDerWaalsContact CE1-O 3.24Å; H55-S96 PolarHBondContact NE2-O 3.02Å; H55-S96 PolarHBondContact NE2-OG 3.31Å; H55-S96 VanDerWaalsContact NE2-OG 3.08Å; K92-S96 PolarHBondContact O-N 2.96Å; K92-S96 VanDerWaalsContact O-N 3.13Å; A93-S96 WeakPolarHBondContact O-CB 3.29Å; A93-S96 PolarHBondContact O-N 3.23Å; A93-S96 VanDerWaalsContact O-N 3.14Å; A93-S96 PolarHBondContact O-OG 3.17Å; V94-S96 PolarHBondContact O-N 3.5Å
97L97.1Very high96.8Very high19 Ų1953.7 Ų53.710%0.09928%0.281CS..SBendtrans-83.6148178.8-61.1175.9000110.9L54 L58 V94 Q95 V102 L105L54-L97 HydrophobicContact CD2-CD1 4.16Å; L54-L97 HydrophobicContact CD2-CD2 4.34Å; L54-L97 HydrophobicContact CD2-CG 4.36Å; L54-L97 HydrophobicContact CG-CD2 4.39Å; L58-L97 HydrophobicContact CD1-CD1 3.89Å; L58-L97 HydrophobicContact CD1-CD2 3.83Å; V94-L97 WeakPolarHBondContact O-CB 3.43Å; V94-L97 PolarHBondContact O-N 2.96Å; V94-L97 VanDerWaalsContact O-N 3.14Å; Q95-L97 VanDerWaalsContact C-N 3.29Å; L97-V102 HydrophobicContact CB-CG2 3.91Å; L97-L105 HydrophobicContact CD1-CB 4.29Å; L97-L105 HydrophobicContact CD1-CD2 3.82Å
98D96.4Very high97Very high94 Ų9450.5 Ų50.550%0.50326%0.259SS..  trans-75.6172.7166.478.5-39.9000110.8N100 G101 V102D98-N100 PolarHBondContact O-N 3.34Å; D98-N100 WeakPolarHBondContact OD2-CB 3.36Å; D98-N100 PolarHBondContact OD2-ND2 3.31Å; D98-N100 VanDerWaalsContact OD2-ND2 3.11Å; D98-G101 PolarHBondContact O-N 3.07Å; D98-G101 VanDerWaalsContact O-N 3.09Å; D98-G101 WeakPolarHBondContact OD1-CA 3.33Å; D98-G101 PolarHBondContact OD1-N 2.95Å; D98-V102 WeakPolarHBondContact O-CG2 3.29Å; D98-V102 PolarHBondContact O-N 2.91Å
99K95.7Very high97.1Very high182 Ų18246.3 Ų46.379%0.79123%0.23SC*.Hα-helixtrans-56.7-38.6-178.8-69.9-178.2178.2178.20112.5V102 D103K99-V102 PolarHBondContact O-N 3.45Å; K99-D103 VanDerWaalsContact O-CG 3.28Å; K99-D103 PolarHBondContact O-N 3.23Å; K99-D103 VanDerWaalsContact O-N 3.14Å
100N95.8Very high97.1Very high115 Ų11547 Ų4762%0.61523%0.228SC*.Hα-helixtrans-70.1-39.2178.9-57-52.5000111.4D98 D103 L104D98-N100 PolarHBondContact O-N 3.34Å; D98-N100 WeakPolarHBondContact OD2-CB 3.36Å; D98-N100 PolarHBondContact OD2-ND2 3.31Å; D98-N100 VanDerWaalsContact OD2-ND2 3.11Å; N100-D103 PolarHBondContact O-N 3.43Å; N100-L104 WeakPolarHBondContact O-CB 3.44Å; N100-L104 PolarHBondContact O-N 3.37Å
101G96.5Very high97Very high9 Ų948.3 Ų48.39%0.09323%0.234CC..Hα-helixtrans-61.4-41.6174.100000112.7D98 L104 L105D98-G101 PolarHBondContact O-N 3.07Å; D98-G101 VanDerWaalsContact O-N 3.09Å; D98-G101 WeakPolarHBondContact OD1-CA 3.33Å; D98-G101 PolarHBondContact OD1-N 2.95Å; G101-L104 PolarHBondContact O-N 3.5Å; G101-L105 VanDerWaalsContact O-CB 3.29Å; G101-L105 WeakPolarHBondContact O-CB 3.47Å; G101-L105 PolarHBondContact O-N 3.04Å
102V97.9Very high96.9Very high6 Ų643.7 Ų43.74%0.03621%0.212CC..Hα-helixtrans-63.7-41.3175.1176.70000111.5V94 L97 D98 K99 L105 M106 A134V94-V102 HydrophobicContact CG1-CG2 4.3Å; L97-V102 HydrophobicContact CB-CG2 3.91Å; D98-V102 WeakPolarHBondContact O-CG2 3.29Å; D98-V102 PolarHBondContact O-N 2.91Å; K99-V102 PolarHBondContact O-N 3.45Å; V102-L105 PolarHBondContact O-N 3.22Å; V102-M106 PolarHBondContact O-N 3.26Å; V102-A134 HydrophobicContact CG1-CB 4.19Å; V102-A134 HydrophobicContact CG2-CB 4.24Å
103D97.8Very high96.8Very high20 Ų2040.3 Ų40.311%0.10720%0.198CC..Hα-helixtrans-65-41176.7-69.7-24.1000112.4K99 N100 M106 K107 S139 R142K99-D103 VanDerWaalsContact O-CG 3.28Å; K99-D103 PolarHBondContact O-N 3.23Å; K99-D103 VanDerWaalsContact O-N 3.14Å; N100-D103 PolarHBondContact O-N 3.43Å; D103-M106 WeakPolarHBondContact O-CB 3.43Å; D103-M106 PolarHBondContact O-N 3.28Å; D103-K107 PolarHBondContact O-N 3.1Å; D103-S139 VanDerWaalsContact OD1-CA 3.31Å; D103-S139 WeakPolarHBondContact OD1-CA 3.38Å; D103-S139 WeakPolarHBondContact OD1-CB 3.36Å; D103-R142 IonicContact OD1-CZ 3.47Å; D103-R142 IonicContact OD1-NE 3.39Å; D103-R142 PolarHBondContact OD1-NE 3.45Å; D103-R142 IonicContact OD1-NH2 2.72Å; D103-R142 PolarHBondContact OD1-NH2 3.49Å; D103-R142 IonicContact OD2-CZ 3.18Å; D103-R142 IonicContact OD2-NE 2.69Å; D103-R142 PolarHBondContact OD2-NE 3.22Å; D103-R142 IonicContact OD2-NH2 2.97Å; D103-R142 PolarHBondContact OD2-NH2 3.29Å
104L97.4Very high96.6Very high22 Ų2246.4 Ų46.412%0.11523%0.226CC..Hα-helixtrans-67.2-42.2176.2-177.962.1000111.6L58 P61 I63 N100 G101 M106 K107 Y108 V150L58-L104 HydrophobicContact CB-CD2 4.13Å; L58-L104 HydrophobicContact CD2-CD2 4.04Å; L58-L104 HydrophobicContact CD2-CG 4.08Å; L58-L104 VanDerWaalsContact O-CD2 3.24Å; L58-L104 WeakPolarHBondContact O-CD2 3.25Å; P61-L104 HydrophobicContact CB-CD1 3.9Å; P61-L104 HydrophobicContact CB-CD2 4.01Å; P61-L104 HydrophobicContact CG-CD1 4.05Å; P61-L104 HydrophobicContact CG-CD2 3.73Å; I63-L104 HydrophobicContact CD1-CD1 4.4Å; N100-L104 WeakPolarHBondContact O-CB 3.44Å; N100-L104 PolarHBondContact O-N 3.37Å; G101-L104 PolarHBondContact O-N 3.5Å; L104-M106 VanDerWaalsContact C-N 3.27Å; L104-M106 PolarHBondContact O-N 3.2Å; L104-K107 HydrophobicContact CD1-CD 4.4Å; L104-K107 WeakPolarHBondContact O-CB 3.36Å; L104-K107 PolarHBondContact O-N 2.99Å; L104-K107 VanDerWaalsContact O-N 3.12Å; L104-Y108 HydrophobicContact CD1-CD2 4.33Å; L104-Y108 HydrophobicContact CD1-CE2 3.94Å; L104-Y108 HydrophobicContact CD2-CE2 4.44Å; L104-Y108 HydrophobicContact CG-CD2 4.19Å; L104-Y108 HydrophobicContact CG-CE2 3.97Å; L104-Y108 WeakPolarHBondContact O-CD2 3.32Å; L104-Y108 PolarHBondContact O-N 3.11Å; L104-V150 HydrophobicContact CD1-CG1 3.82Å
105L97.8Very high96Very high0 Ų051.9 Ų51.90%025%0.246CC..Hα-helixtrans-57.1-43.7173.3174.462.3000110.7L58 L82 V94 L97 G101 V102 K107 Y108 I109 W127 A131L58-L105 HydrophobicContact CD1-CB 4.38Å; L82-L105 HydrophobicContact CD1-CD1 4.24Å; L82-L105 HydrophobicContact CD2-CD1 3.79Å; V94-L105 HydrophobicContact CG2-CD2 4.03Å; L97-L105 HydrophobicContact CD1-CB 4.29Å; L97-L105 HydrophobicContact CD1-CD2 3.82Å; G101-L105 VanDerWaalsContact O-CB 3.29Å; G101-L105 WeakPolarHBondContact O-CB 3.47Å; G101-L105 PolarHBondContact O-N 3.04Å; V102-L105 PolarHBondContact O-N 3.22Å; L105-K107 VanDerWaalsContact C-N 3.28Å; L105-K107 PolarHBondContact O-N 3.06Å; L105-Y108 PolarHBondContact O-N 3.22Å; L105-Y108 VanDerWaalsContact O-N 3.17Å; L105-I109 HydrophobicContact CD1-CD1 4.19Å; L105-I109 HydrophobicContact CD1-CG1 4.26Å; L105-I109 HydrophobicContact CG-CD1 3.88Å; L105-I109 HydrophobicContact CG-CG1 4.41Å; L105-I109 WeakPolarHBondContact O-CG1 3.48Å; L105-I109 PolarHBondContact O-N 3Å; L105-W127 HydrophobicContact CD1-CE3 4.4Å; L105-W127 HydrophobicContact CD2-CE3 3.96Å; L105-W127 HydrophobicContact CD2-CZ3 4.07Å; L105-A131 HydrophobicContact CD2-CB 4.32Å
106M98.4Very high95.4Very high0 Ų049.6 Ų49.60%024%0.243CC..Hα-helixtrans-58.8-40176.9-166.860.678.700111.8V102 D103 L104 Y108 I109 Y110 A131 L132 S139 I140 V143V102-M106 PolarHBondContact O-N 3.26Å; D103-M106 WeakPolarHBondContact O-CB 3.43Å; D103-M106 PolarHBondContact O-N 3.28Å; L104-M106 VanDerWaalsContact C-N 3.27Å; L104-M106 PolarHBondContact O-N 3.2Å; M106-Y108 PolarHBondContact O-N 2.79Å; M106-I109 PolarHBondContact O-N 3.32Å; M106-Y110 HydrophobicContact CG-CD2 4.07Å; M106-Y110 HydrophobicContact CG-CE2 4.05Å; M106-Y110 WeakPolarHBondContact O-CD2 3.17Å; M106-Y110 PolarHBondContact O-N 3.17Å; M106-Y110 VanDerWaalsContact O-N 3.1Å; M106-Y110 HydrophobicContact SD-CD2 4.05Å; M106-Y110 HydrophobicContact SD-CE2 3.77Å; M106-A131 HydrophobicContact CE-CB 3.58Å; M106-L132 HydrophobicContact CE-CB 4.34Å; M106-S139 WeakPolarHBondContact CE-OG 3.5Å; M106-I140 HydrophobicContact CE-CG1 4.13Å; M106-I140 HydrophobicContact CG-CG1 4.19Å; M106-I140 HydrophobicContact SD-CG1 4.13Å; M106-V143 HydrophobicContact CB-CG2 4.15Å; M106-V143 HydrophobicContact CG-CG2 3.76Å
107K97.8Very high94.6Very high27 Ų2751.2 Ų51.212%0.11725%0.254CS..Hα-helixtrans-59.7-46.7175.1-66.1176.2179.7-61.20112.2D103 L104 L105 Y110 K111 R142 V143 V150D103-K107 PolarHBondContact O-N 3.1Å; L104-K107 HydrophobicContact CD1-CD 4.4Å; L104-K107 WeakPolarHBondContact O-CB 3.36Å; L104-K107 PolarHBondContact O-N 2.99Å; L104-K107 VanDerWaalsContact O-N 3.12Å; L105-K107 VanDerWaalsContact C-N 3.28Å; L105-K107 PolarHBondContact O-N 3.06Å; K107-Y110 PolarHBondContact O-N 3.41Å; K107-K111 WeakPolarHBondContact O-CB 3.46Å; K107-K111 PolarHBondContact O-N 2.67Å; K107-R142 PolarHBondContact NZ-O 3.26Å; K107-V143 HydrophobicContact CG-CG2 3.91Å; K107-V150 HydrophobicContact CB-CG2 3.81Å
108Y97.2Very high93.9Very high1 Ų158.9 Ų58.90%0.00429%0.29CS..Hα-helixtrans-67.8-32.9178.3-77.2-67.2000113.3L58 P61 V78 L104 L105 M106 K111 G112 V150L58-Y108 HydrophobicContact CD2-CD2 3.82Å; L58-Y108 HydrophobicContact CD2-CE2 3.95Å; P61-Y108 HydrophobicContact CB-CE2 4.44Å; V78-Y108 HydrophobicContact CB-CD1 4.22Å; V78-Y108 HydrophobicContact CB-CG 4.23Å; V78-Y108 HydrophobicContact CG1-CD1 4.42Å; V78-Y108 HydrophobicContact CG1-CD2 4.36Å; V78-Y108 HydrophobicContact CG1-CG 3.97Å; V78-Y108 HydrophobicContact CG2-CD1 3.9Å; V78-Y108 HydrophobicContact CG2-CD2 3.94Å; V78-Y108 HydrophobicContact CG2-CE1 3.91Å; V78-Y108 HydrophobicContact CG2-CE2 3.93Å; V78-Y108 HydrophobicContact CG2-CG 3.91Å; L104-Y108 HydrophobicContact CD1-CD2 4.33Å; L104-Y108 HydrophobicContact CD1-CE2 3.94Å; L104-Y108 HydrophobicContact CD2-CE2 4.44Å; L104-Y108 HydrophobicContact CG-CD2 4.19Å; L104-Y108 HydrophobicContact CG-CE2 3.97Å; L104-Y108 WeakPolarHBondContact O-CD2 3.32Å; L104-Y108 PolarHBondContact O-N 3.11Å; L105-Y108 PolarHBondContact O-N 3.22Å; L105-Y108 VanDerWaalsContact O-N 3.17Å; M106-Y108 PolarHBondContact O-N 2.79Å; Y108-K111 PolarHBondContact O-N 2.87Å; Y108-G112 PolarHBondContact O-N 3.34Å; Y108-V150 HydrophobicContact CD1-CB 4.09Å; Y108-V150 HydrophobicContact CD1-CG1 4.5Å; Y108-V150 HydrophobicContact CD1-CG2 3.78Å; Y108-V150 HydrophobicContact CD2-CG1 4.44Å; Y108-V150 HydrophobicContact CE1-CB 3.61Å; Y108-V150 HydrophobicContact CE1-CG1 3.88Å; Y108-V150 HydrophobicContact CE1-CG2 3.86Å; Y108-V150 HydrophobicContact CE2-CB 4.44Å; Y108-V150 HydrophobicContact CE2-CG1 3.83Å; Y108-V150 HydrophobicContact CG-CG2 4.15Å
109I97.1Very high93.1Very high0 Ų060.4 Ų60.40%030%0.298CS..Hα-helixtrans-61.9-49174-70166.7000110.4L82 L105 M106 K111 G112 F113 L124 W127 H128 A131L82-I109 HydrophobicContact CD1-CG1 4.42Å; L105-I109 HydrophobicContact CD1-CD1 4.19Å; L105-I109 HydrophobicContact CD1-CG1 4.26Å; L105-I109 HydrophobicContact CG-CD1 3.88Å; L105-I109 HydrophobicContact CG-CG1 4.41Å; L105-I109 WeakPolarHBondContact O-CG1 3.48Å; L105-I109 PolarHBondContact O-N 3Å; M106-I109 PolarHBondContact O-N 3.32Å; I109-K111 VanDerWaalsContact C-N 3.3Å; I109-K111 PolarHBondContact O-N 3.28Å; I109-G112 PolarHBondContact O-N 3.27Å; I109-F113 HydrophobicContact CG2-CD2 4.23Å; I109-F113 HydrophobicContact CG2-CE2 3.62Å; I109-F113 HydrophobicContact CG2-CZ 4.09Å; I109-F113 WeakPolarHBondContact O-CD2 3.44Å; I109-F113 PolarHBondContact O-N 2.67Å; I109-F113 VanDerWaalsContact O-N 3.17Å; I109-L124 HydrophobicContact CG1-CD2 4.48Å; I109-W127 HydrophobicContact CD1-CB 3.85Å; I109-W127 HydrophobicContact CG1-CB 4.28Å; I109-H128 HydrophobicContact CG2-CB 4.03Å; I109-A131 HydrophobicContact CD1-CB 3.98Å
110Y96.9Very high92.7Very high76 Ų7652.2 Ų52.230%0.29826%0.263SS..Hα-helixtrans-62.5-39.3176.7-88.9-91.1000112.1M106 K107 F113 I140 V143M106-Y110 HydrophobicContact CG-CD2 4.07Å; M106-Y110 HydrophobicContact CG-CE2 4.05Å; M106-Y110 WeakPolarHBondContact O-CD2 3.17Å; M106-Y110 PolarHBondContact O-N 3.17Å; M106-Y110 VanDerWaalsContact O-N 3.1Å; M106-Y110 HydrophobicContact SD-CD2 4.05Å; M106-Y110 HydrophobicContact SD-CE2 3.77Å; K107-Y110 PolarHBondContact O-N 3.41Å; Y110-F113 PolarHBondContact O-N 3.16Å; Y110-I140 HydrophobicContact CE2-CG1 4.12Å; Y110-I140 HydrophobicContact CE2-CG2 4.12Å; Y110-I140 VanDerWaalsContact OH-CG2 3.29Å; Y110-I140 WeakPolarHBondContact OH-CG2 3.42Å; Y110-V143 HydrophobicContact CD2-CG1 4.32Å; Y110-V143 HydrophobicContact CD2-CG2 4.17Å; Y110-V143 HydrophobicContact CG-CG1 4.12Å
111K94.6Very high92.5Very high28 Ų2848.8 Ų48.812%0.12225%0.248CC..Hα-helixtrans-60.9-45.3174.7-173.365.4-176.5168.70111.8E75 K107 Y108 I109 F113 E114E75-K111 HydrophobicContact CG-CG 3.84Å; E75-K111 VanDerWaalsContact OE2-CE 3.22Å; E75-K111 WeakPolarHBondContact OE2-CE 3.37Å; E75-K111 WeakPolarHBondContact OE2-CG 3.4Å; K107-K111 WeakPolarHBondContact O-CB 3.46Å; K107-K111 PolarHBondContact O-N 2.67Å; Y108-K111 PolarHBondContact O-N 2.87Å; I109-K111 VanDerWaalsContact C-N 3.3Å; I109-K111 PolarHBondContact O-N 3.28Å; K111-F113 PolarHBondContact O-N 2.88Å; K111-E114 IonicContact NZ-OE1 2.68Å; K111-E114 IonicContact NZ-OE2 3.92Å; K111-E114 PolarHBondContact NZ-OE2 3.36Å; K111-E114 VanDerWaalsContact O-CB 3.27Å; K111-E114 WeakPolarHBondContact O-CB 3.36Å; K111-E114 PolarHBondContact O-N 3.07Å
112G94.4Very high92.3Very high0 Ų051.1 Ų51.10%027%0.267CS..Hα-helixtrans-60.5-31.1177.300000114.1Y108 I109 E114 R115Y108-G112 PolarHBondContact O-N 3.34Å; I109-G112 PolarHBondContact O-N 3.27Å; G112-E114 PolarHBondContact O-N 2.99Å; G112-R115 CarbonylContact O-C 3.53Å; G112-R115 PolarHBondContact O-N 2.9Å
113F95.1Very high92.2Very high66 Ų6652.5 Ų52.529%0.28928%0.276SS..Hα-helixtrans-67.7-18.8174.7-71.3-45.3000113.8I109 Y110 K111 R115 L124 L125I109-F113 HydrophobicContact CG2-CD2 4.23Å; I109-F113 HydrophobicContact CG2-CE2 3.62Å; I109-F113 HydrophobicContact CG2-CZ 4.09Å; I109-F113 WeakPolarHBondContact O-CD2 3.44Å; I109-F113 PolarHBondContact O-N 2.67Å; I109-F113 VanDerWaalsContact O-N 3.17Å; Y110-F113 PolarHBondContact O-N 3.16Å; K111-F113 PolarHBondContact O-N 2.88Å; F113-R115 VanDerWaalsContact C-N 3.29Å; F113-L124 HydrophobicContact CD1-CB 4.08Å; F113-L124 HydrophobicContact CD1-CD1 3.98Å; F113-L124 HydrophobicContact CE1-CB 3.38Å; F113-L124 HydrophobicContact CE1-CD1 4.15Å; F113-L124 HydrophobicContact CE1-CG 4.42Å; F113-L124 HydrophobicContact CZ-CB 3.73Å; F113-L125 HydrophobicContact CE1-CD2 4.28Å; F113-L125 HydrophobicContact CE1-CG 4.13Å; F113-L125 HydrophobicContact CZ-CD2 3.85Å; F113-L125 HydrophobicContact CZ-CG 4.06Å
114E92.8Very high92.1Very high127 Ų12751.8 Ų51.859%0.59327%0.272SS*.Hα-helixtrans-70.3-27.2174.6-60.7178.9-175.200112.4K111 G112 P116K111-E114 IonicContact NZ-OE1 2.68Å; K111-E114 IonicContact NZ-OE2 3.92Å; K111-E114 PolarHBondContact NZ-OE2 3.36Å; K111-E114 VanDerWaalsContact O-CB 3.27Å; K111-E114 WeakPolarHBondContact O-CB 3.36Å; K111-E114 PolarHBondContact O-N 3.07Å; G112-E114 PolarHBondContact O-N 2.99Å; E114-P116 VanDerWaalsContact C-CD 3.48Å; E114-P116 WeakPolarHBondContact O-CD 3.46Å
115R85.2Confident92.1Very high118 Ų11855.6 Ų55.645%0.44529%0.292SS..SBendtrans-127.866.3-173.1-62.8-179.6-178.3-172.73111.2D72 G112 F113 S117D72-R115 VanDerWaalsContact CG-NH1 3.3Å; D72-R115 IonicContact OD1-CZ 2.61Å; D72-R115 IonicContact OD1-NH1 2.82Å; D72-R115 IonicContact OD1-NH2 3.92Å; D72-R115 PolarHBondContact OD1-NH2 2.88Å; D72-R115 IonicContact OD2-CZ 2.79Å; D72-R115 VanDerWaalsContact OD2-CZ 3.32Å; D72-R115 IonicContact OD2-NH1 2.7Å; D72-R115 PolarHBondContact OD2-NH1 2.8Å; D72-R115 IonicContact OD2-NH2 3.32Å; D72-R115 PolarHBondContact OD2-NH2 3.33Å; G112-R115 CarbonylContact O-C 3.53Å; G112-R115 PolarHBondContact O-N 2.9Å; F113-R115 VanDerWaalsContact C-N 3.29Å; R115-S117 PolarHBondContact O-N 3.35Å
116P85Confident92.1Very high85 Ų8559 Ų5955%0.55231%0.308SS*.  trans-64.5125.2-179.427.7-34.3000110.9E114 S121E114-P116 VanDerWaalsContact C-CD 3.48Å; E114-P116 WeakPolarHBondContact O-CD 3.46Å; P116-S121 WeakPolarHBondContact CB-OG 3.45Å
117S80.8Confident92.1Very high80 Ų8059 Ų5956%0.55931%0.308SS*.  trans-109.7172.2165.466.30000110.7R115 N119 S120R115-S117 PolarHBondContact O-N 3.35Å; S117-N119 PolarHBondContact O-N 2.97Å; S117-N119 VanDerWaalsContact O-N 3.16Å; S117-S120 PolarHBondContact N-OG 2.73Å; S117-S120 WeakPolarHBondContact O-CB 3.35Å; S117-S120 PolarHBondContact O-N 3.16Å; S117-S120 PolarHBondContact O-OG 3.36Å; S117-S120 WeakPolarHBondContact OG-CB 3.49Å; S117-S120 PolarHBondContact OG-OG 2.98Å
118E81.3Confident92.1Very high180 Ų18059.4 Ų59.484%0.84131%0.31SS*.THydrogen-bonded Turntrans-53.5122-174.4-165.2171.1-164.800112S120E118-S120 PolarHBondContact O-N 3.29Å
119N79.3Confident92.2Very high126 Ų12664.5 Ų64.567%0.67433%0.334SS*.THydrogen-bonded Turntrans60.8-3-176.5-60-40.5000117.6S117 S121 A122 V123S117-N119 PolarHBondContact O-N 2.97Å; S117-N119 VanDerWaalsContact O-N 3.16Å; N119-S121 PolarHBondContact O-N 2.85Å; N119-A122 PolarHBondContact O-N 2.93Å; N119-V123 PolarHBondContact O-N 3.03Å
120S86.8Confident92.2Very high10 Ų1067.1 Ų67.17%0.0735%0.345CS..Hα-helixtrans-60.1-43.1179.362.40000112.8S117 E118 A122 V123 L124S117-S120 PolarHBondContact N-OG 2.73Å; S117-S120 WeakPolarHBondContact O-CB 3.35Å; S117-S120 PolarHBondContact O-N 3.16Å; S117-S120 PolarHBondContact O-OG 3.36Å; S117-S120 WeakPolarHBondContact OG-CB 3.49Å; S117-S120 PolarHBondContact OG-OG 2.98Å; E118-S120 PolarHBondContact O-N 3.29Å; S120-A122 VanDerWaalsContact C-N 3.3Å; S120-A122 PolarHBondContact O-N 3.25Å; S120-V123 PolarHBondContact O-N 3.26Å; S120-L124 WeakPolarHBondContact O-CB 3.28Å; S120-L124 WeakPolarHBondContact O-CG 3.45Å; S120-L124 PolarHBondContact O-N 3.31Å
121S92Very high92.3Very high43 Ų4363.5 Ų63.530%0.30133%0.331SS..Hα-helixtrans-63.4-34.8-178.2-52.80000113P116 N119 L124 L125P116-S121 WeakPolarHBondContact CB-OG 3.45Å; N119-S121 PolarHBondContact O-N 2.85Å; S121-L124 PolarHBondContact O-N 2.86Å; S121-L125 WeakPolarHBondContact O-CB 3.27Å; S121-L125 VanDerWaalsContact O-CG 3.26Å; S121-L125 WeakPolarHBondContact O-CG 3.45Å; S121-L125 PolarHBondContact O-N 3.12Å
122A93.8Very high92.5Very high59 Ų5965.2 Ų65.249%0.48834%0.341SS..Hα-helixtrans-65.6-44177.700000110.9N119 S120 L125 Q126N119-A122 PolarHBondContact O-N 2.93Å; S120-A122 VanDerWaalsContact C-N 3.3Å; S120-A122 PolarHBondContact O-N 3.25Å; A122-L125 PolarHBondContact O-N 3.48Å; A122-Q126 PolarHBondContact O-N 2.63Å
123V94.6Very high92.6Very high35 Ų3569.3 Ų69.321%0.21238%0.375CS..Hα-helixtrans-63.9-46.9175174.30000110.4N119 S120 L125 Q126 W127N119-V123 PolarHBondContact O-N 3.03Å; S120-V123 PolarHBondContact O-N 3.26Å; V123-L125 VanDerWaalsContact C-N 3.28Å; V123-L125 PolarHBondContact O-N 2.93Å; V123-Q126 WeakPolarHBondContact O-CB 3.22Å; V123-Q126 PolarHBondContact O-N 2.87Å; V123-W127 VanDerWaalsContact O-CD1 3.25Å; V123-W127 PolarHBondContact O-N 2.99Å
124L96.8Very high92.8Very high4 Ų469 Ų692%0.02138%0.384CS..Hα-helixtrans-60.7-34.7179-72.4175.4000113.1L79 L82 I109 F113 S120 S121 W127 H128L79-L124 HydrophobicContact CD2-CD1 4.17Å; L79-L124 HydrophobicContact CD2-CD2 3.8Å; L79-L124 HydrophobicContact CD2-CG 4.44Å; L82-L124 HydrophobicContact CD1-CD2 3.86Å; I109-L124 HydrophobicContact CG1-CD2 4.48Å; F113-L124 HydrophobicContact CD1-CB 4.08Å; F113-L124 HydrophobicContact CD1-CD1 3.98Å; F113-L124 HydrophobicContact CE1-CB 3.38Å; F113-L124 HydrophobicContact CE1-CD1 4.15Å; F113-L124 HydrophobicContact CE1-CG 4.42Å; F113-L124 HydrophobicContact CZ-CB 3.73Å; S120-L124 WeakPolarHBondContact O-CB 3.28Å; S120-L124 WeakPolarHBondContact O-CG 3.45Å; S120-L124 PolarHBondContact O-N 3.31Å; S121-L124 PolarHBondContact O-N 2.86Å; L124-W127 PolarHBondContact O-N 3.47Å; L124-H128 WeakPolarHBondContact O-CB 3.05Å; L124-H128 PolarHBondContact O-N 2.9Å
125L97Very high92.9Very high103 Ų10364 Ų6454%0.53937%0.367SS..Hα-helixtrans-65.8-37.6173.7-74.4168.5000112.3F113 S121 A122 V123 H128 E129F113-L125 HydrophobicContact CE1-CD2 4.28Å; F113-L125 HydrophobicContact CE1-CG 4.13Å; F113-L125 HydrophobicContact CZ-CD2 3.85Å; F113-L125 HydrophobicContact CZ-CG 4.06Å; S121-L125 WeakPolarHBondContact O-CB 3.27Å; S121-L125 VanDerWaalsContact O-CG 3.26Å; S121-L125 WeakPolarHBondContact O-CG 3.45Å; S121-L125 PolarHBondContact O-N 3.12Å; A122-L125 PolarHBondContact O-N 3.48Å; V123-L125 VanDerWaalsContact C-N 3.28Å; V123-L125 PolarHBondContact O-N 2.93Å; L125-H128 PolarHBondContact O-N 3.15Å; L125-E129 PolarHBondContact O-N 2.73Å
126Q97Very high93.5Very high71 Ų7159.9 Ų59.933%0.33236%0.361SS..Hα-helixtrans-65.7-42.3173.6-64.7-177.4-32.200111.6S87 I90 A122 V123 E129 K130S87-Q126 PolarHBondContact OG-NE2 3Å; S87-Q126 VanDerWaalsContact OG-NE2 3.15Å; S87-Q126 PolarHBondContact OG-OE1 3.37Å; I90-Q126 HydrophobicContact CD1-CB 3.91Å; A122-Q126 PolarHBondContact O-N 2.63Å; V123-Q126 WeakPolarHBondContact O-CB 3.22Å; V123-Q126 PolarHBondContact O-N 2.87Å; Q126-E129 PolarHBondContact O-N 3.26Å; Q126-K130 PolarHBondContact O-N 2.76Å
127W98.3Very high94.2Very high0 Ų060.8 Ų60.80%037%0.365CS..Hα-helixtrans-62-43.8173.7-81.599.2000111.9L54 L82 F85 I90 A93 V94 L105 I109 V123 L124 E129 K130 A131L54-W127 HydrophobicContact CD1-CH2 4.48Å; L54-W127 HydrophobicContact CD2-CH2 4.02Å; L54-W127 HydrophobicContact CD2-CZ3 4.11Å; L82-W127 HydrophobicContact CB-CZ2 4.33Å; L82-W127 HydrophobicContact CD2-CD2 3.67Å; L82-W127 HydrophobicContact CD2-CE3 3.83Å; L82-W127 HydrophobicContact CD2-CG 4.35Å; L82-W127 HydrophobicContact CD2-CH2 3.7Å; L82-W127 HydrophobicContact CD2-CZ2 3.53Å; L82-W127 HydrophobicContact CD2-CZ3 3.84Å; L82-W127 HydrophobicContact CG-CD2 4.47Å; L82-W127 PolarHBondContact O-NE1 3.35Å; F85-W127 HydrophobicContact CB-CZ2 3.8Å; F85-W127 HydrophobicContact CD1-CH2 4.46Å; F85-W127 HydrophobicContact CD1-CZ2 4.3Å; F85-W127 AromaticContact CD2-CH2 3.98Å; F85-W127 HydrophobicContact CD2-CH2 3.98Å; F85-W127 AromaticContact CD2-CZ2 3.55Å; F85-W127 HydrophobicContact CD2-CZ2 3.55Å; F85-W127 HydrophobicContact CE2-CH2 4.09Å; F85-W127 HydrophobicContact CE2-CZ2 4.13Å; F85-W127 HydrophobicContact CG-CH2 4.15Å; F85-W127 AromaticContact CG-CZ2 3.63Å; F85-W127 HydrophobicContact CG-CZ2 3.63Å; F85-W127 HydrophobicContact CZ-CH2 4.38Å; I90-W127 HydrophobicContact CD1-CD2 4.44Å; I90-W127 HydrophobicContact CD1-CG 4.37Å; I90-W127 HydrophobicContact CG1-CD2 4.4Å; I90-W127 HydrophobicContact CG1-CZ2 4.1Å; I90-W127 HydrophobicContact CG2-CD2 3.68Å; I90-W127 HydrophobicContact CG2-CE3 3.67Å; I90-W127 HydrophobicContact CG2-CG 4.19Å; I90-W127 HydrophobicContact CG2-CH2 4.37Å; I90-W127 HydrophobicContact CG2-CZ2 4.37Å; I90-W127 HydrophobicContact CG2-CZ3 4.04Å; A93-W127 HydrophobicContact CB-CH2 4.04Å; A93-W127 HydrophobicContact CB-CZ3 4.41Å; V94-W127 HydrophobicContact CG2-CE3 3.86Å; V94-W127 HydrophobicContact CG2-CZ3 3.75Å; L105-W127 HydrophobicContact CD1-CE3 4.4Å; L105-W127 HydrophobicContact CD2-CE3 3.96Å; L105-W127 HydrophobicContact CD2-CZ3 4.07Å; I109-W127 HydrophobicContact CD1-CB 3.85Å; I109-W127 HydrophobicContact CG1-CB 4.28Å; V123-W127 VanDerWaalsContact O-CD1 3.25Å; V123-W127 PolarHBondContact O-N 2.99Å; L124-W127 PolarHBondContact O-N 3.47Å; W127-E129 VanDerWaalsContact C-N 3.35Å; W127-E129 PolarHBondContact O-N 3.18Å; W127-K130 PolarHBondContact O-N 2.9Å; W127-A131 VanDerWaalsContact O-CB 3.3Å; W127-A131 WeakPolarHBondContact O-CB 3.31Å; W127-A131 PolarHBondContact O-N 3.34Å
128H98.4Very high95Very high35 Ų3558 Ų5816%0.16235%0.35CS..Hα-helixtrans-58.6-45.9177.1-179.8-83.7000111.4I109 L124 L125 K130 A131 L132I109-H128 HydrophobicContact CG2-CB 4.03Å; L124-H128 WeakPolarHBondContact O-CB 3.05Å; L124-H128 PolarHBondContact O-N 2.9Å; L125-H128 PolarHBondContact O-N 3.15Å; H128-K130 VanDerWaalsContact C-N 3.32Å; H128-K130 PolarHBondContact O-N 3.17Å; H128-A131 PolarHBondContact O-N 3.24Å; H128-L132 WeakPolarHBondContact O-CB 3.41Å; H128-L132 PolarHBondContact O-N 2.86Å
129E98.3Very high95.8Very high109 Ų10949.5 Ų49.551%0.50931%0.31SS..Hα-helixtrans-53.8-48.5177-172.2-159.3135.200111.5L125 Q126 W127 A133L125-E129 PolarHBondContact O-N 2.73Å; Q126-E129 PolarHBondContact O-N 3.26Å; W127-E129 VanDerWaalsContact C-N 3.35Å; W127-E129 PolarHBondContact O-N 3.18Å; E129-A133 PolarHBondContact O-N 2.98Å
130K98.4Very high96.7Very high54 Ų5444.7 Ų44.724%0.23528%0.284CS..Hα-helixtrans-74.5-39.5-177.6-56.9-46.7-179.8-167.90112.6I90 E91 V94 Q126 W127 H128 L132 A133 A134I90-K130 HydrophobicContact CG2-CB 4.05Å; I90-K130 HydrophobicContact CG2-CG 3.81Å; E91-K130 HydrophobicContact CB-CD 4.31Å; E91-K130 HydrophobicContact CB-CG 4.41Å; V94-K130 HydrophobicContact CB-CB 4.44Å; V94-K130 HydrophobicContact CG2-CB 4.02Å; Q126-K130 PolarHBondContact O-N 2.76Å; W127-K130 PolarHBondContact O-N 2.9Å; H128-K130 VanDerWaalsContact C-N 3.32Å; H128-K130 PolarHBondContact O-N 3.17Å; K130-L132 VanDerWaalsContact C-N 3.31Å; K130-L132 PolarHBondContact O-N 3.12Å; K130-A133 PolarHBondContact O-N 3.35Å; K130-A134 PolarHBondContact O-N 3.14Å
131A98.2Very high97.2Very high0 Ų047.6 Ų47.60%030%0.301CS..Hα-helixtrans-64.1-36.9174.900000111.8L105 M106 I109 W127 H128 A134 G135L105-A131 HydrophobicContact CD2-CB 4.32Å; M106-A131 HydrophobicContact CE-CB 3.58Å; I109-A131 HydrophobicContact CD1-CB 3.98Å; W127-A131 VanDerWaalsContact O-CB 3.3Å; W127-A131 WeakPolarHBondContact O-CB 3.31Å; W127-A131 PolarHBondContact O-N 3.34Å; H128-A131 PolarHBondContact O-N 3.24Å; A131-A134 PolarHBondContact O-N 3.21Å; A131-G135 PolarHBondContact O-N 3.08Å
132L98.4Very high97.5Very high64 Ų6450.6 Ų50.634%0.33531%0.305SS..Hα-helixtrans-66.7-42173.9177.661.3000111.5M106 H128 K130 A134 G136 I140M106-L132 HydrophobicContact CE-CB 4.34Å; H128-L132 WeakPolarHBondContact O-CB 3.41Å; H128-L132 PolarHBondContact O-N 2.86Å; K130-L132 VanDerWaalsContact C-N 3.31Å; K130-L132 PolarHBondContact O-N 3.12Å; L132-A134 VanDerWaalsContact C-N 3.29Å; L132-A134 PolarHBondContact O-N 3.44Å; L132-G136 WeakPolarHBondContact O-CA 3.36Å; L132-G136 PolarHBondContact O-N 3.42Å; L132-I140 HydrophobicContact CD1-CD1 3.91Å
133A98.1Very high97.7Very high87 Ų8748.9 Ų48.972%0.71929%0.289SS*.Hα-helixtrans-61.4-38176.100000112.2E129 K130E129-A133 PolarHBondContact O-N 2.98Å; K130-A133 PolarHBondContact O-N 3.35Å
134A97.7Very high97.8Very high58 Ų5853.7 Ų53.748%0.47931%0.313SS..Hα-helixtrans-79.9-44.6179.700000113.8V94 V102 K130 A131 L132V94-A134 HydrophobicContact CG1-CB 3.6Å; V102-A134 HydrophobicContact CG1-CB 4.19Å; V102-A134 HydrophobicContact CG2-CB 4.24Å; K130-A134 PolarHBondContact O-N 3.14Å; A131-A134 PolarHBondContact O-N 3.21Å; L132-A134 VanDerWaalsContact C-N 3.29Å; L132-A134 PolarHBondContact O-N 3.44Å
135G96.5Very high97.8Very high23 Ų2358 Ų5824%0.23734%0.339CS..Hα-helixtrans-95-13-173.600000115A131A131-G135 PolarHBondContact O-N 3.08Å
136G97.9Very high97.6Very high31 Ų3154.7 Ų54.732%0.3233%0.327SS..Hα-helixtrans62.8-176.4-171.300000113L132 G138 S139L132-G136 WeakPolarHBondContact O-CA 3.36Å; L132-G136 PolarHBondContact O-N 3.42Å; G136-G138 PolarHBondContact O-N 3.19Å; G136-G138 VanDerWaalsContact O-N 3.11Å; G136-S139 PolarHBondContact O-N 3.35Å; G136-S139 PolarHBondContact O-OG 2.87Å
137V97.9Very high97.3Very high104 Ų10459.4 Ų59.463%0.6334%0.342SS*.Hα-helixtrans-61-22.7177.669.50000112.7S139 I140 V141V137-S139 VanDerWaalsContact C-N 3.26Å; V137-S139 PolarHBondContact O-N 2.79Å; V137-I140 WeakPolarHBondContact O-CB 3.39Å; V137-I140 PolarHBondContact O-N 3.14Å; V137-I140 VanDerWaalsContact O-N 3.15Å; V137-V141 WeakPolarHBondContact O-CG2 3.42Å; V137-V141 PolarHBondContact O-N 3.07Å
138G97.8Very high96.8Very high23 Ų2363.1 Ų63.124%0.23736%0.358CS..Hα-helixtrans-61.1-31178.500000113.7G136 V141 R142G136-G138 PolarHBondContact O-N 3.19Å; G136-G138 VanDerWaalsContact O-N 3.11Å; G138-V141 PolarHBondContact O-N 2.68Å; G138-R142 WeakPolarHBondContact O-CG 3.45Å; G138-R142 VanDerWaalsContact O-CZ 3.26Å; G138-R142 PolarHBondContact O-N 2.82Å; G138-R142 PolarHBondContact O-NH1 3.22Å
139S97.8Very high96.5Very high0 Ų063.9 Ų63.90%037%0.365CS..Hα-helixtrans-65.8-40.2175.8640000111.2D103 M106 G136 V137 R142 V143D103-S139 VanDerWaalsContact OD1-CA 3.31Å; D103-S139 WeakPolarHBondContact OD1-CA 3.38Å; D103-S139 WeakPolarHBondContact OD1-CB 3.36Å; M106-S139 WeakPolarHBondContact CE-OG 3.5Å; G136-S139 PolarHBondContact O-N 3.35Å; G136-S139 PolarHBondContact O-OG 2.87Å; V137-S139 VanDerWaalsContact C-N 3.26Å; V137-S139 PolarHBondContact O-N 2.79Å; S139-R142 PolarHBondContact O-N 3.12Å; S139-V143 PolarHBondContact O-N 2.61Å
140I98.3Very high96.1Very high25 Ų2559 Ų5913%0.12834%0.343CS..Hα-helixtrans-66.1-45.4173.8-58176.1000110.8M106 Y110 L132 V137 R142 V143 L144M106-I140 HydrophobicContact CE-CG1 4.13Å; M106-I140 HydrophobicContact CG-CG1 4.19Å; M106-I140 HydrophobicContact SD-CG1 4.13Å; Y110-I140 HydrophobicContact CE2-CG1 4.12Å; Y110-I140 HydrophobicContact CE2-CG2 4.12Å; Y110-I140 VanDerWaalsContact OH-CG2 3.29Å; Y110-I140 WeakPolarHBondContact OH-CG2 3.42Å; L132-I140 HydrophobicContact CD1-CD1 3.91Å; V137-I140 WeakPolarHBondContact O-CB 3.39Å; V137-I140 PolarHBondContact O-N 3.14Å; V137-I140 VanDerWaalsContact O-N 3.15Å; I140-R142 PolarHBondContact O-N 3.15Å; I140-V143 WeakPolarHBondContact O-CA 3.14Å; I140-V143 VanDerWaalsContact O-CB 3.26Å; I140-V143 WeakPolarHBondContact O-CB 3.39Å; I140-V143 PolarHBondContact O-N 3.39Å; I140-L144 PolarHBondContact O-N 2.7Å; I140-L144 VanDerWaalsContact O-N 3.13Å
141V98.3Very high96Very high71 Ų7159.3 Ų59.343%0.4335%0.348SS..Hα-helixtrans-54.8-42.5176.6173.10000110.4V137 G138 V143 L144 T145V137-V141 WeakPolarHBondContact O-CG2 3.42Å; V137-V141 PolarHBondContact O-N 3.07Å; G138-V141 PolarHBondContact O-N 2.68Å; V141-V143 VanDerWaalsContact C-N 3.29Å; V141-V143 PolarHBondContact O-N 3.13Å; V141-L144 PolarHBondContact O-N 3.26Å; V141-L144 VanDerWaalsContact O-N 3.1Å; V141-T145 HydrophobicContact CG1-CG2 4.1Å; V141-T145 WeakPolarHBondContact O-CG2 3.16Å; V141-T145 PolarHBondContact O-N 3.33Å; V141-T145 PolarHBondContact O-OG1 3.18Å
142R97.8Very high95.8Very high106 Ų10662.4 Ų62.440%0.437%0.366SS..Hα-helixtrans-68.9-20.4176.1-73.7-175-69.8-80.31.8114.3D103 K107 G138 S139 I140 A146D103-R142 IonicContact OD1-CZ 3.47Å; D103-R142 IonicContact OD1-NE 3.39Å; D103-R142 PolarHBondContact OD1-NE 3.45Å; D103-R142 IonicContact OD1-NH2 2.72Å; D103-R142 PolarHBondContact OD1-NH2 3.49Å; D103-R142 IonicContact OD2-CZ 3.18Å; D103-R142 IonicContact OD2-NE 2.69Å; D103-R142 PolarHBondContact OD2-NE 3.22Å; D103-R142 IonicContact OD2-NH2 2.97Å; D103-R142 PolarHBondContact OD2-NH2 3.29Å; K107-R142 PolarHBondContact NZ-O 3.26Å; G138-R142 WeakPolarHBondContact O-CG 3.45Å; G138-R142 VanDerWaalsContact O-CZ 3.26Å; G138-R142 PolarHBondContact O-N 2.82Å; G138-R142 PolarHBondContact O-NH1 3.22Å; S139-R142 PolarHBondContact O-N 3.12Å; I140-R142 PolarHBondContact O-N 3.15Å; R142-A146 WeakPolarHBondContact O-CB 3.1Å
143V97.6Very high95.7Very high24 Ų2462.3 Ų62.315%0.14537%0.368CS..Hα-helixtrans-66.2-51.4165.5-178.90000109.5M106 K107 Y110 S139 I140 V141 T145 A146M106-V143 HydrophobicContact CB-CG2 4.15Å; M106-V143 HydrophobicContact CG-CG2 3.76Å; K107-V143 HydrophobicContact CG-CG2 3.91Å; Y110-V143 HydrophobicContact CD2-CG1 4.32Å; Y110-V143 HydrophobicContact CD2-CG2 4.17Å; Y110-V143 HydrophobicContact CG-CG1 4.12Å; S139-V143 PolarHBondContact O-N 2.61Å; I140-V143 WeakPolarHBondContact O-CA 3.14Å; I140-V143 VanDerWaalsContact O-CB 3.26Å; I140-V143 WeakPolarHBondContact O-CB 3.39Å; I140-V143 PolarHBondContact O-N 3.39Å; V141-V143 VanDerWaalsContact C-N 3.29Å; V141-V143 PolarHBondContact O-N 3.13Å; V143-T145 PolarHBondContact O-N 2.93Å; V143-A146 PolarHBondContact O-N 3.38Å
144L96.9Very high95.6Very high136 Ų13660.8 Ų60.871%0.71235%0.348SS*.Hα-helixtrans-67-32.5-175.1-59.2176.3000113.6I140 V141I140-L144 PolarHBondContact O-N 2.7Å; I140-L144 VanDerWaalsContact O-N 3.13Å; V141-L144 PolarHBondContact O-N 3.26Å; V141-L144 VanDerWaalsContact O-N 3.1Å
145T96.5Very high95.4Very high94 Ų9461 Ų6158%0.57734%0.339SS*.THydrogen-bonded Turntrans-93-4.2-175.361.90000114V141 V143 R147V141-T145 HydrophobicContact CG1-CG2 4.1Å; V141-T145 WeakPolarHBondContact O-CG2 3.16Å; V141-T145 PolarHBondContact O-N 3.33Å; V141-T145 PolarHBondContact O-OG1 3.18Å; V143-T145 PolarHBondContact O-N 2.93Å; T145-R147 PolarHBondContact O-N 3.17Å
146A94Very high95.3Very high34 Ų3463.5 Ų63.528%0.28135%0.346SS..  trans-78121.8-176.800000111.8R142 V143R142-A146 WeakPolarHBondContact O-CB 3.1Å; V143-A146 PolarHBondContact O-N 3.38Å
147R90.5Very high95.2Very high170 Ų17065.9 Ų65.964%0.64235%0.348SS*.SBendtrans-76.6-33.2173.9-58.1-65.4-72.9-151.20.5112.5D25 T145D25-R147 IonicContact OD1-CZ 3.29Å; D25-R147 VanDerWaalsContact OD1-CZ 3.29Å; D25-R147 IonicContact OD1-NE 2.79Å; D25-R147 PolarHBondContact OD1-NE 2.79Å; D25-R147 IonicContact OD1-NH2 3.11Å; D25-R147 PolarHBondContact OD1-NH2 3.06Å; D25-R147 VanDerWaalsContact OD1-NH2 3.11Å; D25-R147 IonicContact OD2-CZ 3.35Å; D25-R147 IonicContact OD2-NE 3.22Å; D25-R147 PolarHBondContact OD2-NE 3.24Å; D25-R147 IonicContact OD2-NH2 2.67Å; D25-R147 PolarHBondContact OD2-NH2 3.22Å; T145-R147 PolarHBondContact O-N 3.17Å
148K88Confident95Very high77 Ų7762.9 Ų62.934%0.33533%0.326SS..SBendtrans-111.5122.4172.2-59-179.6-171.8176.40108.4E26 D28 I63E26-K148 WeakPolarHBondContact O-CE 3.46Å; E26-K148 PolarHBondContact O-NZ 2.92Å; D28-K148 VanDerWaalsContact CB-NZ 3.34Å; I63-K148 HydrophobicContact CG2-CB 3.65Å
149T91.3Very high94.7Very high52 Ų5266.3 Ų66.332%0.31933%0.334SS..  trans-140.1163-177-166.40000111.4K71K71-T149 PolarHBondContact NZ-O 3.34Å
150V89.7Confident94.4Very high6 Ų672.3 Ų72.34%0.03636%0.364CS..  trans-60.80173.5-59.20000112.5P61 I63 K71 L104 K107 Y108P61-V150 HydrophobicContact CB-CG1 4.08Å; I63-V150 HydrophobicContact CG1-CG1 4.14Å; K71-V150 WeakPolarHBondContact CB-OXT 3.46Å; K71-V150 WeakPolarHBondContact CD-OXT 3.22Å; L104-V150 HydrophobicContact CD1-CG1 3.82Å; K107-V150 HydrophobicContact CB-CG2 3.81Å; Y108-V150 HydrophobicContact CD1-CB 4.09Å; Y108-V150 HydrophobicContact CD1-CG1 4.5Å; Y108-V150 HydrophobicContact CD1-CG2 3.78Å; Y108-V150 HydrophobicContact CD2-CG1 4.44Å; Y108-V150 HydrophobicContact CE1-CB 3.61Å; Y108-V150 HydrophobicContact CE1-CG1 3.88Å; Y108-V150 HydrophobicContact CE1-CG2 3.86Å; Y108-V150 HydrophobicContact CE2-CB 4.44Å; Y108-V150 HydrophobicContact CE2-CG1 3.83Å; Y108-V150 HydrophobicContact CG-CG2 4.15Å

Retrieved 150 of 150 residues in 503.8 ms (Link to these results)

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