A0A5K4ET08_SCHMA Loading...

Stathmin

AlphaFold DB , UniProt , Accession A0A5K4ET08, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 172 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M40Very low48Very low253 Ų253138.5 Ų138.5100%1.24684%0.844SS**  0131.30-79.2-172.5162.800108.1
2G38.6Very low49Very low86 Ų86139.9 Ų139.989%0.88783%0.831SS**  trans106.299.7164.700000116.3
3S42.6Very low50.1Low119 Ų119143.2 Ų143.283%0.83283%0.832SS**  trans-76.6161.9171.8-58.80000113.7
4S50.7Low51Low124 Ų124141.9 Ų141.987%0.86782%0.818SS**  trans134.4131.7134.767.90000112.1
5G48.6Very low51.2Low65 Ų65139.6 Ų139.667%0.6781%0.811SS**  cis-158.5138.9-6.300000106.7
6L44.2Very low51.6Low145 Ų145140.1 Ų140.176%0.75981%0.807SS**  48.485.497.6-65.9174.8000115.1F8L6-F8 HydrophobicContact CD2-CD2 3.52Å; L6-F8 HydrophobicContact CD2-CE2 3.51Å
7D50.4Low51.6Low170 Ų170145.5 Ų145.591%0.90981%0.811SS**  trans-118.195.3142.1-89.7-28.4000107.7
8F42Very low51.4Low168 Ų168146.2 Ų146.274%0.73781%0.813SS**  trans-85.8101.7167.7-96.2-94.5000108.1L6 V10L6-F8 HydrophobicContact CD2-CD2 3.52Å; L6-F8 HydrophobicContact CD2-CE2 3.51Å; F8-V10 HydrophobicContact CD1-CG2 3.88Å
9N56Low51.2Low172 Ų172148.1 Ų148.192%0.9282%0.815SS**  trans-96.895.9160.1-119.1-8.6000108
10V51.7Low51.1Low99 Ų99147.7 Ų147.760%0.682%0.817SS**  trans-91.7107171.2-176.50000107.3F8 F12F8-V10 HydrophobicContact CD1-CG2 3.88Å; V10-F12 HydrophobicContact CG1-CD1 4.03Å
11S63.3Low51Low123 Ų123149.4 Ų149.486%0.8682%0.819SS**  trans-100.1118.1165.2-174.40000107.9
12F59.4Low51.2Low155 Ų155141.3 Ų141.368%0.6879%0.787SS**  trans-108.4126.9169.345-92.8000109V10 I14V10-F12 HydrophobicContact CG1-CD1 4.03Å; F12-I14 HydrophobicContact CD2-CG1 4.09Å; F12-I14 HydrophobicContact CE2-CG1 4.33Å; F12-I14 PolarHBondContact O-N 3.5Å
13E63.4Low51.7Low182 Ų182143 Ų14385%0.8578%0.783SS**  trans-73.9119.2166.6-171.9166.2-161.900107.2P15E13-P15 VanDerWaalsContact O-CD 3.24Å; E13-P15 WeakPolarHBondContact O-CD 3.24Å
14I63.3Low52Low125 Ų125146.3 Ų146.364%0.64178%0.777SS**  trans-79.5112.5173.6-59.6171.2000106F12 I16F12-I14 HydrophobicContact CD2-CG1 4.09Å; F12-I14 HydrophobicContact CE2-CG1 4.33Å; F12-I14 PolarHBondContact O-N 3.5Å; I14-I16 VanDerWaalsContact C-N 3.32Å; I14-I16 HydrophobicContact CG2-CG1 4.49Å; I14-I16 PolarHBondContact O-N 3.18Å
15P54.5Low51.8Low108 Ų108143.8 Ų143.870%0.70176%0.764SS**  trans-71.795.9171.6-422.4000106.6E13 R17E13-P15 VanDerWaalsContact O-CD 3.24Å; E13-P15 WeakPolarHBondContact O-CD 3.24Å; P15-R17 PolarHBondContact O-N 2.89Å
16I57.5Low51.8Low148 Ų148148.6 Ų148.676%0.75977%0.773SS**  trans-68112.2160.8-55.7176.4000103.7I14 D18I14-I16 VanDerWaalsContact C-N 3.32Å; I14-I16 HydrophobicContact CG2-CG1 4.49Å; I14-I16 PolarHBondContact O-N 3.18Å; I16-D18 PolarHBondContact O-N 2.75Å; I16-D18 VanDerWaalsContact O-N 3.08Å
17R51.5Low52Low231 Ų231150 Ų15087%0.87277%0.768SS**  trans-22.8112.6-178.7-73.3-175.9176-150.5-0.5111.9P15 E19P15-R17 PolarHBondContact O-N 2.89Å; R17-E19 PolarHBondContact O-N 3.08Å
18D47.8Very low51.9Low158 Ų158148.7 Ų148.785%0.84576%0.761SS**SBendtrans-57.174.2175.8-86-45.5000111.7I16I16-D18 PolarHBondContact O-N 2.75Å; I16-D18 VanDerWaalsContact O-N 3.08Å
19E46.9Very low52.3Low182 Ų182149.3 Ų149.385%0.8577%0.771SS**  trans-148.951.6164.9-70.6-162.6-173.500110.7R17R17-E19 PolarHBondContact O-N 3.08Å
20V49.9Very low51.7Low140 Ų140145.1 Ų145.185%0.84876%0.755SS**  trans-132.192.2158.5-169.50000108.3S22V20-S22 PolarHBondContact O-N 3.32Å
21Q48.4Very low51.4Low184 Ų184144.1 Ų144.186%0.8675%0.752SS**  trans-41127.9173.4-69.6172.70.800111
22S45.6Very low50.8Low83 Ų83143.4 Ų143.458%0.5875%0.745SS**  trans-7.4122.8159-177.70000114.7V20 R24V20-S22 PolarHBondContact O-N 3.32Å; S22-R24 PolarHBondContact O-N 2.74Å; S22-R24 PolarHBondContact OG-N 3.35Å
23P48.1Very low50.2Low123 Ų123142 Ų14280%0.79974%0.744SS**  trans-73.663.116431-31.6000109.4A25P23-A25 PolarHBondContact O-N 3.44Å
24R49.1Very low49.7Very low187 Ų187141.8 Ų141.871%0.70674%0.737SS**  trans-82.520.6164.1-130.9179.3-172-172.14.2111.4S22 L26S22-R24 PolarHBondContact O-N 2.74Å; S22-R24 PolarHBondContact OG-N 3.35Å; R24-L26 VanDerWaalsContact C-N 3.32Å
25A47.3Very low49.2Very low72 Ų72143.1 Ų143.160%0.59574%0.744SS**G310 helixtrans-87.16.3179.500000114P23 R27P23-A25 PolarHBondContact O-N 3.44Å; A25-R27 PolarHBondContact O-N 3.38Å
26L48.5Very low48.9Very low165 Ų165144.5 Ų144.586%0.86475%0.745SS**G310 helixtrans-80.16.2169.2-78.4166.6000113.7R24R24-L26 VanDerWaalsContact C-N 3.32Å
27R47.1Very low48.8Very low175 Ų175146.6 Ų146.666%0.6674%0.743SS**G310 helixtrans-111.510.2178.1-72.7-170.4-179.8174.9-0.8115.2A25 L29 S30A25-R27 PolarHBondContact O-N 3.38Å; R27-L29 VanDerWaalsContact C-N 3.29Å; R27-L29 PolarHBondContact O-N 3.45Å; R27-S30 PolarHBondContact O-OG 3.16Å
28L49.1Very low49.3Very low143 Ų143140 Ų14075%0.74973%0.725SS**THydrogen-bonded Turntrans-82.3-3175.1-71.3173.3000114.1S30L28-S30 PolarHBondContact O-N 3.5Å
29L51Low50.1Low181 Ų181140.5 Ų140.595%0.94872%0.722SS**THydrogen-bonded Turntrans-82.72.2171.5-64.6177.8000113.4R27R27-L29 VanDerWaalsContact C-N 3.29Å; R27-L29 PolarHBondContact O-N 3.45Å
30S43Very low51.3Low84 Ų84135.6 Ų135.659%0.58771%0.708SS**  trans-132.564.6-179.951.50000109.9R27 L28 P32R27-S30 PolarHBondContact O-OG 3.16Å; L28-S30 PolarHBondContact O-N 3.5Å; S30-P32 WeakPolarHBondContact O-CD 3.49Å
31S45.8Very low52.9Low77 Ų77131.8 Ų131.854%0.53868%0.683SS.*  trans-100.5106.1163.4-163.20000108.2N33S31-N33 PolarHBondContact O-N 2.99Å
32P49.2Very low54.7Low109 Ų109128.4 Ų128.471%0.70867%0.67SS**THydrogen-bonded Turntrans-68.53.4-178.1-16.730.9000114.4S30S30-P32 WeakPolarHBondContact O-CD 3.49Å
33N48Very low56.7Low124 Ų124128.5 Ų128.566%0.66366%0.664SS**THydrogen-bonded Turntrans-117.213-172.3-76.2-38.4000114.7S31S31-N33 PolarHBondContact O-N 2.99Å
34Y51.6Low58.8Low178 Ų178127.2 Ų127.270%0.69865%0.647SS**SBendtrans-84.6-25.2171.7-149.8-94000112.9L36 R37Y34-L36 VanDerWaalsContact C-N 3.33Å; Y34-R37 PolarHBondContact O-N 3.44Å
35I53.6Low60.8Low154 Ų154126 Ų12679%0.7964%0.643SS**THydrogen-bonded Turntrans-74.2-27.5-177.3-56174.9000111.3
36L49.1Very low63Low137 Ų137126.4 Ų126.472%0.71764%0.635SS**THydrogen-bonded Turntrans-95.79.4178.6-97.9152.5000113.7Y34 N38Y34-L36 VanDerWaalsContact C-N 3.33Å; L36-N38 PolarHBondContact O-N 2.73Å
37R53.6Low65.3Low191 Ų191122.8 Ų122.872%0.72161%0.613SS**SBendtrans-74.470.2166.9-138.1-179.2-178.2-157.9-0.7108.2Y34Y34-R37 PolarHBondContact O-N 3.44Å
38N62Low67.6Low93 Ų93119.1 Ų119.150%0.49760%0.602SS.*  trans49.390.8164.1-70.9-10.4000115L36 S40 D41 L42L36-N38 PolarHBondContact O-N 2.73Å; N38-S40 WeakPolarHBondContact CB-OG 3.26Å; N38-S40 PolarHBondContact O-N 3.41Å; N38-D41 HydrophobicContact CB-CB 3.72Å; N38-D41 WeakPolarHBondContact O-CA 3.49Å; N38-D41 WeakPolarHBondContact O-CB 3.49Å; N38-D41 PolarHBondContact O-N 3.35Å; N38-L42 PolarHBondContact O-N 3.3Å
39E65.2Low69.9Low169 Ų169114.5 Ų114.579%0.7958%0.584SS**Hα-helixtrans-45.7-31.8156.1-70.2-171.7157.800111.2L42 N43E39-L42 PolarHBondContact O-N 2.95Å; E39-N43 WeakPolarHBondContact O-CB 3.38Å; E39-N43 PolarHBondContact O-N 3.05Å
40S72.3Confident72.1Confident78 Ų78111.9 Ų111.955%0.54556%0.562SS.*Hα-helixtrans-63.2-40.3171.153.10000114.5N38 E44N38-S40 WeakPolarHBondContact CB-OG 3.26Å; N38-S40 PolarHBondContact O-N 3.41Å; S40-E44 WeakPolarHBondContact O-CB 3.37Å; S40-E44 PolarHBondContact O-N 3.49Å
41D83.6Confident74.7Confident60 Ų60113.4 Ų113.432%0.32156%0.56SS.*Hα-helixtrans-69.5-41.3174.9175.744.3000110.6N38 E44 R45N38-D41 HydrophobicContact CB-CB 3.72Å; N38-D41 WeakPolarHBondContact O-CA 3.49Å; N38-D41 WeakPolarHBondContact O-CB 3.49Å; N38-D41 PolarHBondContact O-N 3.35Å; D41-E44 PolarHBondContact O-N 3.16Å; D41-R45 WeakPolarHBondContact O-CB 3.16Å; D41-R45 VanDerWaalsContact O-CG 3.26Å; D41-R45 WeakPolarHBondContact O-CG 3.49Å; D41-R45 PolarHBondContact O-N 2.82Å; D41-R45 IonicContact OD1-CZ 3.94Å; D41-R45 IonicContact OD1-NE 3.16Å; D41-R45 PolarHBondContact OD1-NE 3.31Å; D41-R45 VanDerWaalsContact OD1-NE 3.16Å; D41-R45 IonicContact OD1-NH2 3.86Å; D41-R45 IonicContact OD2-CZ 3.58Å; D41-R45 IonicContact OD2-NE 3.35Å; D41-R45 PolarHBondContact OD2-NE 3.08Å; D41-R45 IonicContact OD2-NH2 3.41Å; D41-R45 PolarHBondContact OD2-NH2 2.82Å
42L85Confident77.2Confident114 Ų114117.3 Ų117.360%0.59756%0.563SS**Hα-helixtrans-62.6-45.7174.4-164.197.7000111.1N38 E39 R45 L46N38-L42 PolarHBondContact O-N 3.3Å; E39-L42 PolarHBondContact O-N 2.95Å; L42-R45 PolarHBondContact O-N 2.98Å; L42-L46 HydrophobicContact CD2-CD1 4.2Å; L42-L46 HydrophobicContact CG-CD1 4.49Å; L42-L46 WeakPolarHBondContact O-CG 3.5Å; L42-L46 PolarHBondContact O-N 3.45Å
43N89.6Confident79.5Confident84 Ų84120.8 Ų120.845%0.44956%0.561SS.*Hα-helixtrans-65-41.6179.2-165.759.1000111.3E39 R45 L46 E47E39-N43 WeakPolarHBondContact O-CB 3.38Å; E39-N43 PolarHBondContact O-N 3.05Å; N43-R45 VanDerWaalsContact C-N 3.34Å; N43-R45 PolarHBondContact O-N 3.04Å; N43-L46 PolarHBondContact O-N 3.09Å; N43-E47 WeakPolarHBondContact O-CG 3.48Å; N43-E47 PolarHBondContact O-N 2.95Å
44E91Very high81.9Confident97 Ų97118.1 Ų118.145%0.45355%0.553SS.*Hα-helixtrans-60.5-42.8174.4-170.5-170.5156.500111.7S40 D41 L46 E47 K48S40-E44 WeakPolarHBondContact O-CB 3.37Å; S40-E44 PolarHBondContact O-N 3.49Å; D41-E44 PolarHBondContact O-N 3.16Å; E44-L46 VanDerWaalsContact C-N 3.34Å; E44-L46 PolarHBondContact O-N 3.26Å; E44-E47 PolarHBondContact O-N 3.29Å; E44-K48 HydrophobicContact CG-CD 4.43Å; E44-K48 WeakPolarHBondContact O-CB 3.46Å; E44-K48 WeakPolarHBondContact O-CG 3.32Å; E44-K48 PolarHBondContact O-N 2.82Å; E44-K48 WeakPolarHBondContact OE1-CE 3.48Å; E44-K48 IonicContact OE1-NZ 2.64Å; E44-K48 PolarHBondContact OE1-NZ 3.34Å
45R91.3Very high84.1Confident161 Ų161113.4 Ų113.461%0.60854%0.54SS*.Hα-helixtrans-63.7-39.5175.6-72.4170.7-175.7-145.5-0.1112.1D41 L42 N43 A49D41-R45 WeakPolarHBondContact O-CB 3.16Å; D41-R45 VanDerWaalsContact O-CG 3.26Å; D41-R45 WeakPolarHBondContact O-CG 3.49Å; D41-R45 PolarHBondContact O-N 2.82Å; D41-R45 IonicContact OD1-CZ 3.94Å; D41-R45 IonicContact OD1-NE 3.16Å; D41-R45 PolarHBondContact OD1-NE 3.31Å; D41-R45 VanDerWaalsContact OD1-NE 3.16Å; D41-R45 IonicContact OD1-NH2 3.86Å; D41-R45 IonicContact OD2-CZ 3.58Å; D41-R45 IonicContact OD2-NE 3.35Å; D41-R45 PolarHBondContact OD2-NE 3.08Å; D41-R45 IonicContact OD2-NH2 3.41Å; D41-R45 PolarHBondContact OD2-NH2 2.82Å; L42-R45 PolarHBondContact O-N 2.98Å; N43-R45 VanDerWaalsContact C-N 3.34Å; N43-R45 PolarHBondContact O-N 3.04Å; R45-A49 WeakPolarHBondContact O-CB 3.37Å; R45-A49 PolarHBondContact O-N 2.83Å
46L94.2Very high86.3Confident81 Ų81110.3 Ų110.342%0.42453%0.528SS..Hα-helixtrans-67-41.4175.6-73.7172.7000111.6L42 N43 E44 A49 R50L42-L46 HydrophobicContact CD2-CD1 4.2Å; L42-L46 HydrophobicContact CG-CD1 4.49Å; L42-L46 WeakPolarHBondContact O-CG 3.5Å; L42-L46 PolarHBondContact O-N 3.45Å; N43-L46 PolarHBondContact O-N 3.09Å; E44-L46 VanDerWaalsContact C-N 3.34Å; E44-L46 PolarHBondContact O-N 3.26Å; L46-A49 PolarHBondContact O-N 3.48Å; L46-R50 WeakPolarHBondContact O-CB 3.44Å; L46-R50 WeakPolarHBondContact O-CG 3.34Å; L46-R50 PolarHBondContact O-N 2.9Å
47E95.8Very high88.6Confident89 Ų89108 Ų10842%0.41652%0.516SS..Hα-helixtrans-63.4-47.1174.5-73.6-48130.300111.7N43 E44 A49 R50 E51N43-E47 WeakPolarHBondContact O-CG 3.48Å; N43-E47 PolarHBondContact O-N 2.95Å; E44-E47 PolarHBondContact O-N 3.29Å; E47-A49 VanDerWaalsContact C-N 3.25Å; E47-A49 PolarHBondContact O-N 3.21Å; E47-R50 CarbonylContact O-C 3.58Å; E47-R50 WeakPolarHBondContact O-CA 3.37Å; E47-R50 WeakPolarHBondContact O-CB 3.49Å; E47-R50 PolarHBondContact O-N 2.88Å; E47-R50 VanDerWaalsContact O-N 3.08Å; E47-R50 IonicContact OE1-CZ 3.14Å; E47-R50 IonicContact OE1-NE 2.83Å; E47-R50 PolarHBondContact OE1-NE 2.66Å; E47-R50 IonicContact OE1-NH2 2.66Å; E47-R50 PolarHBondContact OE1-NH2 2.83Å; E47-R50 IonicContact OE2-NE 3.53Å; E47-E51 WeakPolarHBondContact O-CB 3.5Å; E47-E51 PolarHBondContact O-N 2.72Å
48K96.4Very high90.7Very high98 Ų98101.5 Ų101.543%0.42650%0.503SS..Hα-helixtrans-60.1-35.5173.8-76.7174.7171.6165.90112.4E44 R52E44-K48 HydrophobicContact CG-CD 4.43Å; E44-K48 WeakPolarHBondContact O-CB 3.46Å; E44-K48 WeakPolarHBondContact O-CG 3.32Å; E44-K48 PolarHBondContact O-N 2.82Å; E44-K48 WeakPolarHBondContact OE1-CE 3.48Å; E44-K48 IonicContact OE1-NZ 2.64Å; E44-K48 PolarHBondContact OE1-NZ 3.34Å; K48-R52 WeakPolarHBondContact O-CG 3.37Å; K48-R52 PolarHBondContact O-N 3.07Å; K48-R52 PolarHBondContact O-NE 3.07Å
49A96.5Very high92.5Very high45 Ų45101.8 Ų101.837%0.37250%0.501SS..Hα-helixtrans-69-41.1173.800000112.1R45 L46 E47 R53R45-A49 WeakPolarHBondContact O-CB 3.37Å; R45-A49 PolarHBondContact O-N 2.83Å; L46-A49 PolarHBondContact O-N 3.48Å; E47-A49 VanDerWaalsContact C-N 3.25Å; E47-A49 PolarHBondContact O-N 3.21Å; A49-R53 WeakPolarHBondContact O-CB 3.36Å; A49-R53 PolarHBondContact O-N 3.44Å; A49-R53 VanDerWaalsContact O-N 3.09Å
50R97.6Very high94Very high126 Ų12696.5 Ų96.548%0.47548%0.48SS..Hα-helixtrans-61.2-46.4173.1-80.4-170-97.1-95.22.4111.4L46 E47 R53 S54L46-R50 WeakPolarHBondContact O-CB 3.44Å; L46-R50 WeakPolarHBondContact O-CG 3.34Å; L46-R50 PolarHBondContact O-N 2.9Å; E47-R50 CarbonylContact O-C 3.58Å; E47-R50 WeakPolarHBondContact O-CA 3.37Å; E47-R50 WeakPolarHBondContact O-CB 3.49Å; E47-R50 PolarHBondContact O-N 2.88Å; E47-R50 VanDerWaalsContact O-N 3.08Å; E47-R50 IonicContact OE1-CZ 3.14Å; E47-R50 IonicContact OE1-NE 2.83Å; E47-R50 PolarHBondContact OE1-NE 2.66Å; E47-R50 IonicContact OE1-NH2 2.66Å; E47-R50 PolarHBondContact OE1-NH2 2.83Å; E47-R50 IonicContact OE2-NE 3.53Å; R50-R53 PolarHBondContact O-N 2.64Å; R50-S54 WeakPolarHBondContact O-CB 3.31Å; R50-S54 PolarHBondContact O-N 3.24Å
51E97.9Very high95.3Very high116 Ų11697.2 Ų97.254%0.54248%0.477SS..Hα-helixtrans-61.2-49.7178.8-173.1-176.9-171.400111.5E47 R53 S54 N55E47-E51 WeakPolarHBondContact O-CB 3.5Å; E47-E51 PolarHBondContact O-N 2.72Å; E51-R53 VanDerWaalsContact C-N 3.3Å; E51-R53 PolarHBondContact O-N 3.03Å; E51-S54 WeakPolarHBondContact O-CA 3.5Å; E51-S54 WeakPolarHBondContact O-CB 3.37Å; E51-S54 PolarHBondContact O-N 3.08Å; E51-S54 VanDerWaalsContact O-N 3.08Å; E51-N55 VanDerWaalsContact O-CG 3.27Å; E51-N55 PolarHBondContact O-N 3.47Å
52R97.8Very high96Very high160 Ų16098.2 Ų98.260%0.60448%0.483SS*.Hα-helixtrans-56.6-44.7175.6-76.8-177.6-68.1-130-1112.2K48 S54 N55 V56K48-R52 WeakPolarHBondContact O-CG 3.37Å; K48-R52 PolarHBondContact O-N 3.07Å; K48-R52 PolarHBondContact O-NE 3.07Å; R52-S54 VanDerWaalsContact C-N 3.35Å; R52-N55 PolarHBondContact O-N 3.41Å; R52-V56 WeakPolarHBondContact O-CG2 3.43Å; R52-V56 PolarHBondContact O-N 3.3Å
53R97.8Very high96.6Very high181 Ų18199.5 Ų99.568%0.68348%0.479SS*.Hα-helixtrans-63-43.3176.4177.4-179.3157.9-155.8-6.6111.1A49 R50 E51 V56 L57A49-R53 WeakPolarHBondContact O-CB 3.36Å; A49-R53 PolarHBondContact O-N 3.44Å; A49-R53 VanDerWaalsContact O-N 3.09Å; R50-R53 PolarHBondContact O-N 2.64Å; E51-R53 VanDerWaalsContact C-N 3.3Å; E51-R53 PolarHBondContact O-N 3.03Å; R53-V56 PolarHBondContact O-N 2.83Å; R53-L57 HydrophobicContact CG-CD1 4.09Å; R53-L57 VanDerWaalsContact O-CG 3.31Å; R53-L57 WeakPolarHBondContact O-CG 3.42Å; R53-L57 PolarHBondContact O-N 2.78Å
54S98.2Very high97Very high69 Ų69100.2 Ų100.248%0.48348%0.483SS..Hα-helixtrans-60.1-45.6177.3-169.50000111.4R50 E51 R52 L57 A58R50-S54 WeakPolarHBondContact O-CB 3.31Å; R50-S54 PolarHBondContact O-N 3.24Å; E51-S54 WeakPolarHBondContact O-CA 3.5Å; E51-S54 WeakPolarHBondContact O-CB 3.37Å; E51-S54 PolarHBondContact O-N 3.08Å; E51-S54 VanDerWaalsContact O-N 3.08Å; R52-S54 VanDerWaalsContact C-N 3.35Å; S54-L57 PolarHBondContact O-N 2.81Å; S54-A58 WeakPolarHBondContact O-CB 3.36Å; S54-A58 PolarHBondContact O-N 3Å
55N98.2Very high97.4Very high78 Ų78101.4 Ų101.442%0.41749%0.489SS..Hα-helixtrans-63.6-45.3179.6-67.2-12.7000111.8E51 R52 L57 A58 E59E51-N55 VanDerWaalsContact O-CG 3.27Å; E51-N55 PolarHBondContact O-N 3.47Å; R52-N55 PolarHBondContact O-N 3.41Å; N55-L57 VanDerWaalsContact C-N 3.3Å; N55-L57 PolarHBondContact O-N 2.81Å; N55-A58 PolarHBondContact O-N 3.33Å; N55-E59 WeakPolarHBondContact O-CB 3.36Å; N55-E59 WeakPolarHBondContact O-CG 3.41Å; N55-E59 PolarHBondContact O-N 3.46Å
56V98.3Very high97.7Very high89 Ų8999.4 Ų99.454%0.53949%0.486SS..Hα-helixtrans-61.4-40.4176172.50000111.4R52 R53 T60R52-V56 WeakPolarHBondContact O-CG2 3.43Å; R52-V56 PolarHBondContact O-N 3.3Å; R53-V56 PolarHBondContact O-N 2.83Å; V56-T60 WeakPolarHBondContact O-CB 3.43Å; V56-T60 PolarHBondContact O-N 2.88Å; V56-T60 PolarHBondContact O-OG1 3.39Å
57L98Very high97.9Very high89 Ų89101.3 Ų101.347%0.46649%0.493SS..Hα-helixtrans-65.4-45.8175.9-72.9171000111.5R53 S54 N55 E59 T60 I61R53-L57 HydrophobicContact CG-CD1 4.09Å; R53-L57 VanDerWaalsContact O-CG 3.31Å; R53-L57 WeakPolarHBondContact O-CG 3.42Å; R53-L57 PolarHBondContact O-N 2.78Å; S54-L57 PolarHBondContact O-N 2.81Å; N55-L57 VanDerWaalsContact C-N 3.3Å; N55-L57 PolarHBondContact O-N 2.81Å; L57-E59 PolarHBondContact O-N 3.2Å; L57-T60 PolarHBondContact O-N 3.5Å; L57-I61 VanDerWaalsContact O-CG1 3.29Å; L57-I61 WeakPolarHBondContact O-CG1 3.49Å; L57-I61 PolarHBondContact O-N 3.45Å
58A98.4Very high98.1Very high54 Ų54100.6 Ų100.645%0.44649%0.494SS..Hα-helixtrans-61.7-44.1178.400000112S54 N55 T60 I61 N62S54-A58 WeakPolarHBondContact O-CB 3.36Å; S54-A58 PolarHBondContact O-N 3Å; N55-A58 PolarHBondContact O-N 3.33Å; A58-T60 VanDerWaalsContact C-N 3.33Å; A58-T60 PolarHBondContact O-N 3.25Å; A58-I61 PolarHBondContact O-N 2.88Å; A58-N62 WeakPolarHBondContact O-CB 3.29Å; A58-N62 PolarHBondContact O-N 3.38Å
59E98.3Very high98.2Very high100 Ų100102.2 Ų102.247%0.46750%0.503SS..Hα-helixtrans-62.2-40.5174.2-74.9-178.5-159.200112.3N55 L57 N62 R63N55-E59 WeakPolarHBondContact O-CB 3.36Å; N55-E59 WeakPolarHBondContact O-CG 3.41Å; N55-E59 PolarHBondContact O-N 3.46Å; L57-E59 PolarHBondContact O-N 3.2Å; E59-N62 PolarHBondContact O-N 2.93Å; E59-R63 WeakPolarHBondContact O-CG 3.5Å; E59-R63 PolarHBondContact O-N 3.43Å; E59-R63 IonicContact OE2-CZ 3.63Å; E59-R63 IonicContact OE2-NH1 3.62Å; E59-R63 IonicContact OE2-NH2 2.81Å; E59-R63 PolarHBondContact OE2-NH2 3.46Å
60T98.1Very high98.3Very high58 Ų58105.5 Ų105.536%0.35651%0.514SS..Hα-helixtrans-66.1-42.7178.6-580000111.1V56 L57 A58 R63 N64V56-T60 WeakPolarHBondContact O-CB 3.43Å; V56-T60 PolarHBondContact O-N 2.88Å; V56-T60 PolarHBondContact O-OG1 3.39Å; L57-T60 PolarHBondContact O-N 3.5Å; A58-T60 VanDerWaalsContact C-N 3.33Å; A58-T60 PolarHBondContact O-N 3.25Å; T60-R63 PolarHBondContact O-N 3.46Å; T60-N64 WeakPolarHBondContact O-CB 3.36Å; T60-N64 VanDerWaalsContact O-CG 3.23Å; T60-N64 PolarHBondContact O-N 2.99Å; T60-N64 PolarHBondContact O-ND2 2.99Å
61I98.4Very high98.3Very high93 Ų93103.2 Ų103.248%0.47751%0.514SS..Hα-helixtrans-60.1-49.8174.7-69.5165.9000109.9L57 A58 R63 N64 E65L57-I61 VanDerWaalsContact O-CG1 3.29Å; L57-I61 WeakPolarHBondContact O-CG1 3.49Å; L57-I61 PolarHBondContact O-N 3.45Å; A58-I61 PolarHBondContact O-N 2.88Å; I61-R63 PolarHBondContact O-N 2.96Å; I61-N64 WeakPolarHBondContact O-CB 3.47Å; I61-N64 PolarHBondContact O-N 3.38Å; I61-N64 VanDerWaalsContact O-N 3.12Å; I61-E65 HydrophobicContact CG2-CG 4.33Å; I61-E65 WeakPolarHBondContact O-CG 3.29Å; I61-E65 PolarHBondContact O-N 3.5Å
62N98.5Very high98.4Very high81 Ų81104.5 Ų104.543%0.43352%0.518SS..Hα-helixtrans-59.9-45.2179.6-173.1-0.4000112A58 E59 N64 E65 Q66A58-N62 WeakPolarHBondContact O-CB 3.29Å; A58-N62 PolarHBondContact O-N 3.38Å; E59-N62 PolarHBondContact O-N 2.93Å; N62-N64 VanDerWaalsContact C-N 3.31Å; N62-N64 PolarHBondContact O-N 3.12Å; N62-E65 PolarHBondContact O-N 2.84Å; N62-Q66 VanDerWaalsContact O-CG 3.29Å; N62-Q66 WeakPolarHBondContact O-CG 3.41Å; N62-Q66 PolarHBondContact O-N 3.3Å; N62-Q66 PolarHBondContact OD1-NE2 3.27Å
63R98.3Very high98.4Very high141 Ų141100 Ų10053%0.53251%0.511SS..Hα-helixtrans-60.1-41.1175.2-72.8-177.1-163.2108.28112E59 T60 I61 Q66 H67E59-R63 WeakPolarHBondContact O-CG 3.5Å; E59-R63 PolarHBondContact O-N 3.43Å; E59-R63 IonicContact OE2-CZ 3.63Å; E59-R63 IonicContact OE2-NH1 3.62Å; E59-R63 IonicContact OE2-NH2 2.81Å; E59-R63 PolarHBondContact OE2-NH2 3.46Å; T60-R63 PolarHBondContact O-N 3.46Å; I61-R63 PolarHBondContact O-N 2.96Å; R63-Q66 PolarHBondContact O-N 3.29Å; R63-H67 WeakPolarHBondContact O-CB 3.41Å; R63-H67 PolarHBondContact O-N 3.42Å
64N98.5Very high98.4Very high99 Ų9997.9 Ų97.953%0.52951%0.506SS..Hα-helixtrans-66.7-41.7177.6-72.6-14.1000111.8T60 I61 N62 H67 V68T60-N64 WeakPolarHBondContact O-CB 3.36Å; T60-N64 VanDerWaalsContact O-CG 3.23Å; T60-N64 PolarHBondContact O-N 2.99Å; T60-N64 PolarHBondContact O-ND2 2.99Å; I61-N64 WeakPolarHBondContact O-CB 3.47Å; I61-N64 PolarHBondContact O-N 3.38Å; I61-N64 VanDerWaalsContact O-N 3.12Å; N62-N64 VanDerWaalsContact C-N 3.31Å; N62-N64 PolarHBondContact O-N 3.12Å; N64-H67 PolarHBondContact O-N 3.45Å; N64-V68 WeakPolarHBondContact O-CG2 3.34Å; N64-V68 PolarHBondContact O-N 3.45Å
65E98.5Very high98.5Very high122 Ų12297.7 Ų97.757%0.5750%0.504SS*.Hα-helixtrans-62.4-44.1176-73.6175.1170.400111.7I61 N62 H67 V68 H69I61-E65 HydrophobicContact CG2-CG 4.33Å; I61-E65 WeakPolarHBondContact O-CG 3.29Å; I61-E65 PolarHBondContact O-N 3.5Å; N62-E65 PolarHBondContact O-N 2.84Å; E65-H67 VanDerWaalsContact C-N 3.34Å; E65-H67 PolarHBondContact O-N 2.9Å; E65-V68 PolarHBondContact O-N 2.94Å; E65-H69 WeakPolarHBondContact O-CB 3.4Å; E65-H69 PolarHBondContact O-N 3.43Å
66Q98.5Very high98.5Very high119 Ų11999.2 Ų99.256%0.55651%0.509SS*.Hα-helixtrans-60-43.8174.1-71.2174.21300111.7N62 R63 H69 L70N62-Q66 VanDerWaalsContact O-CG 3.29Å; N62-Q66 WeakPolarHBondContact O-CG 3.41Å; N62-Q66 PolarHBondContact O-N 3.3Å; N62-Q66 PolarHBondContact OD1-NE2 3.27Å; R63-Q66 PolarHBondContact O-N 3.29Å; Q66-H69 PolarHBondContact O-N 2.93Å; Q66-L70 WeakPolarHBondContact O-CB 3.35Å; Q66-L70 PolarHBondContact O-N 3.49Å
67H98.6Very high98.5Very high120 Ų12099.7 Ų99.756%0.55651%0.505SS*.Hα-helixtrans-63.1-44.2176.9-177.1-91.2000111.7R63 N64 E65 H69 L70 V71R63-H67 WeakPolarHBondContact O-CB 3.41Å; R63-H67 PolarHBondContact O-N 3.42Å; N64-H67 PolarHBondContact O-N 3.45Å; E65-H67 VanDerWaalsContact C-N 3.34Å; E65-H67 PolarHBondContact O-N 2.9Å; H67-H69 VanDerWaalsContact C-N 3.33Å; H67-H69 PolarHBondContact O-N 3.29Å; H67-L70 PolarHBondContact O-N 2.86Å; H67-V71 WeakPolarHBondContact O-CG2 3.39Å; H67-V71 PolarHBondContact O-N 2.94Å
68V98.7Very high98.5Very high74 Ų7499.5 Ų99.545%0.44850%0.502SS..Hα-helixtrans-60.9-43.2175.5169.50000111N64 E65 V71 K72N64-V68 WeakPolarHBondContact O-CG2 3.34Å; N64-V68 PolarHBondContact O-N 3.45Å; E65-V68 PolarHBondContact O-N 2.94Å; V68-V71 PolarHBondContact O-N 3.31Å; V68-K72 HydrophobicContact CG1-CD 4.14Å; V68-K72 HydrophobicContact CG1-CG 4.49Å; V68-K72 WeakPolarHBondContact O-CB 3.47Å; V68-K72 WeakPolarHBondContact O-CG 3.35Å; V68-K72 PolarHBondContact O-N 2.88Å
69H98.6Very high98.5Very high133 Ų133102 Ų10262%0.61650%0.503SS*.Hα-helixtrans-61.5-45.1176.7-174.8-82.4000111.6E65 Q66 H67 K72 S73E65-H69 WeakPolarHBondContact O-CB 3.4Å; E65-H69 PolarHBondContact O-N 3.43Å; Q66-H69 PolarHBondContact O-N 2.93Å; H67-H69 VanDerWaalsContact C-N 3.33Å; H67-H69 PolarHBondContact O-N 3.29Å; H69-K72 PolarHBondContact O-N 2.93Å; H69-S73 WeakPolarHBondContact O-CB 3.45Å; H69-S73 PolarHBondContact O-N 3.35Å
70L98.7Very high98.5Very high113 Ų113102.8 Ų102.859%0.59251%0.506SS*.Hα-helixtrans-60.8-46.6177.6-179.364.9000111.9Q66 H67 K72 S73 K74Q66-L70 WeakPolarHBondContact O-CB 3.35Å; Q66-L70 PolarHBondContact O-N 3.49Å; H67-L70 PolarHBondContact O-N 2.86Å; L70-K72 PolarHBondContact O-N 2.91Å; L70-S73 PolarHBondContact O-N 2.88Å; L70-K74 WeakPolarHBondContact O-CB 3.45Å; L70-K74 PolarHBondContact O-N 3.34Å
71V98.7Very high98.6Very high79 Ų79104.9 Ų104.948%0.47951%0.511SS..Hα-helixtrans-63-42.7178.4171.90000111.1H67 V68 K74 C75H67-V71 WeakPolarHBondContact O-CG2 3.39Å; H67-V71 PolarHBondContact O-N 2.94Å; V68-V71 PolarHBondContact O-N 3.31Å; V71-K74 PolarHBondContact O-N 2.88Å; V71-C75 WeakPolarHBondContact O-CB 3.46Å; V71-C75 PolarHBondContact O-N 2.96Å
72K98.7Very high98.6Very high143 Ų143106 Ų10662%0.62252%0.517SS*.Hα-helixtrans-61.6-47.4175.5-76.8179.5178.5-179.30111.8V68 H69 L70 K74 C75 E76V68-K72 HydrophobicContact CG1-CD 4.14Å; V68-K72 HydrophobicContact CG1-CG 4.49Å; V68-K72 WeakPolarHBondContact O-CB 3.47Å; V68-K72 WeakPolarHBondContact O-CG 3.35Å; V68-K72 PolarHBondContact O-N 2.88Å; H69-K72 PolarHBondContact O-N 2.93Å; L70-K72 PolarHBondContact O-N 2.91Å; K72-K74 PolarHBondContact O-N 3.24Å; K72-C75 WeakPolarHBondContact O-CB 3.47Å; K72-C75 PolarHBondContact O-N 3.05Å; K72-E76 PolarHBondContact O-N 3.44Å
73S98.6Very high98.6Very high66 Ų66106 Ų10646%0.46252%0.52SS..Hα-helixtrans-59.9-44.8178.31750000111.7H69 L70 C75 E76 Q77H69-S73 WeakPolarHBondContact O-CB 3.45Å; H69-S73 PolarHBondContact O-N 3.35Å; L70-S73 PolarHBondContact O-N 2.88Å; S73-C75 PolarHBondContact O-N 3.06Å; S73-E76 PolarHBondContact O-N 2.71Å; S73-Q77 WeakPolarHBondContact O-CB 3.39Å; S73-Q77 PolarHBondContact O-N 3.42Å
74K98.7Very high98.6Very high135 Ų135102.8 Ų102.859%0.58751%0.513SS*.Hα-helixtrans-64.1-41176.7-170.4176.1-177.7179.50112.2L70 V71 K72 E76 Q77 E78L70-K74 WeakPolarHBondContact O-CB 3.45Å; L70-K74 PolarHBondContact O-N 3.34Å; V71-K74 PolarHBondContact O-N 2.88Å; K72-K74 PolarHBondContact O-N 3.24Å; K74-E76 VanDerWaalsContact C-N 3.33Å; K74-Q77 PolarHBondContact O-N 3.38Å; K74-E78 WeakPolarHBondContact O-CG 3.46Å; K74-E78 PolarHBondContact O-N 2.94Å
75C98.6Very high98.6Very high65 Ų65106 Ų10644%0.43952%0.518SS..Hα-helixtrans-60.8-44.1175.7-175.70000111.4V71 K72 S73 E78 K79V71-C75 WeakPolarHBondContact O-CB 3.46Å; V71-C75 PolarHBondContact O-N 2.96Å; K72-C75 WeakPolarHBondContact O-CB 3.47Å; K72-C75 PolarHBondContact O-N 3.05Å; S73-C75 PolarHBondContact O-N 3.06Å; C75-E78 PolarHBondContact O-N 3.25Å; C75-K79 WeakPolarHBondContact O-CG 3.41Å; C75-K79 PolarHBondContact O-N 3.34Å
76E98.5Very high98.6Very high110 Ų110103.2 Ų103.251%0.51451%0.512SS..Hα-helixtrans-66.8-40.1178.6-15958.4-152.300112.1K72 S73 K74 E78 K79 E80K72-E76 PolarHBondContact O-N 3.44Å; S73-E76 PolarHBondContact O-N 2.71Å; K74-E76 VanDerWaalsContact C-N 3.33Å; E76-E78 VanDerWaalsContact C-N 3.35Å; E76-E78 PolarHBondContact O-N 3.49Å; E76-K79 WeakPolarHBondContact O-CB 3.49Å; E76-K79 PolarHBondContact O-N 2.95Å; E76-K79 IonicContact OE2-NZ 3.79Å; E76-K79 PolarHBondContact OE2-NZ 3.06Å; E76-E80 PolarHBondContact O-N 2.93Å
77Q98.7Very high98.6Very high99 Ų99102 Ų10246%0.46351%0.509SS..Hα-helixtrans-61-41.6175.2-169.7-176.218.800112.4S73 K74 E80 K81S73-Q77 WeakPolarHBondContact O-CB 3.39Å; S73-Q77 PolarHBondContact O-N 3.42Å; K74-Q77 PolarHBondContact O-N 3.38Å; Q77-E80 PolarHBondContact O-N 3.4Å; Q77-K81 WeakPolarHBondContact O-CG 3.36Å; Q77-K81 PolarHBondContact O-N 3.44Å
78E98.5Very high98.6Very high85 Ų85101.9 Ų101.940%0.39751%0.509SS..Hα-helixtrans-70-35.3177.3-68.1-55.2131.700112.1K74 C75 E76 K81 L82K74-E78 WeakPolarHBondContact O-CG 3.46Å; K74-E78 PolarHBondContact O-N 2.94Å; C75-E78 PolarHBondContact O-N 3.25Å; E76-E78 VanDerWaalsContact C-N 3.35Å; E76-E78 PolarHBondContact O-N 3.49Å; E78-K81 PolarHBondContact O-N 3.46Å; E78-K81 IonicContact OE1-NZ 2.71Å; E78-K81 PolarHBondContact OE1-NZ 2.85Å; E78-L82 WeakPolarHBondContact O-CG 3.38Å; E78-L82 PolarHBondContact O-N 3.3Å
79K98.7Very high98.6Very high106 Ų106103 Ų10346%0.46151%0.512SS..Hα-helixtrans-62-45.7171-72.7176.2-172.7169.80111.5C75 E76 K81 L82 V83C75-K79 WeakPolarHBondContact O-CG 3.41Å; C75-K79 PolarHBondContact O-N 3.34Å; E76-K79 WeakPolarHBondContact O-CB 3.49Å; E76-K79 PolarHBondContact O-N 2.95Å; E76-K79 IonicContact OE2-NZ 3.79Å; E76-K79 PolarHBondContact OE2-NZ 3.06Å; K79-K81 VanDerWaalsContact C-N 3.33Å; K79-K81 PolarHBondContact O-N 3.02Å; K79-L82 PolarHBondContact O-N 3.26Å; K79-L82 VanDerWaalsContact O-N 3.16Å; K79-V83 WeakPolarHBondContact O-CG2 3.39Å; K79-V83 PolarHBondContact O-N 2.89Å
80E98.6Very high98.6Very high117 Ų117102.4 Ų102.455%0.54751%0.511SS..Hα-helixtrans-59.8-44.1178.1-174.6178.9-169.500111.2E76 Q77 L82 V83 N84E76-E80 PolarHBondContact O-N 2.93Å; Q77-E80 PolarHBondContact O-N 3.4Å; E80-L82 VanDerWaalsContact C-N 3.33Å; E80-L82 PolarHBondContact O-N 3.41Å; E80-V83 PolarHBondContact O-N 3.38Å; E80-N84 WeakPolarHBondContact O-CB 3.47Å; E80-N84 PolarHBondContact O-N 3.16Å; E80-N84 PolarHBondContact O-ND2 2.98Å
81K98.6Very high98.6Very high102 Ų102103 Ų10344%0.44351%0.511SS..Hα-helixtrans-58.4-42.7174-72.7173.2-173.5170.30112.6Q77 E78 K79 R85Q77-K81 WeakPolarHBondContact O-CG 3.36Å; Q77-K81 PolarHBondContact O-N 3.44Å; E78-K81 PolarHBondContact O-N 3.46Å; E78-K81 IonicContact OE1-NZ 2.71Å; E78-K81 PolarHBondContact OE1-NZ 2.85Å; K79-K81 VanDerWaalsContact C-N 3.33Å; K79-K81 PolarHBondContact O-N 3.02Å; K81-R85 VanDerWaalsContact O-CB 3.32Å; K81-R85 WeakPolarHBondContact O-CB 3.28Å; K81-R85 PolarHBondContact O-N 3.43Å
82L98.6Very high98.6Very high117 Ų117103.8 Ų103.861%0.61351%0.512SS*.Hα-helixtrans-66.3-42.4178-72.7174000111.9E78 K79 E80 S86E78-L82 WeakPolarHBondContact O-CG 3.38Å; E78-L82 PolarHBondContact O-N 3.3Å; K79-L82 PolarHBondContact O-N 3.26Å; K79-L82 VanDerWaalsContact O-N 3.16Å; E80-L82 VanDerWaalsContact C-N 3.33Å; E80-L82 PolarHBondContact O-N 3.41Å; L82-S86 WeakPolarHBondContact O-CB 3.32Å; L82-S86 PolarHBondContact O-N 2.9Å
83V98.7Very high98.6Very high81 Ų81101.9 Ų101.949%0.49151%0.508SS..Hα-helixtrans-63.2-47.6176.6170.70000110.6K79 E80 R85 S86 N87K79-V83 WeakPolarHBondContact O-CG2 3.39Å; K79-V83 PolarHBondContact O-N 2.89Å; E80-V83 PolarHBondContact O-N 3.38Å; V83-R85 PolarHBondContact O-N 3.16Å; V83-S86 WeakPolarHBondContact O-CB 3.29Å; V83-S86 PolarHBondContact O-N 3.01Å; V83-S86 VanDerWaalsContact O-N 3.15Å; V83-N87 VanDerWaalsContact O-CG 3.31Å; V83-N87 PolarHBondContact O-N 3.38Å; V83-N87 PolarHBondContact O-ND2 3.38Å
84N98.6Very high98.5Very high74 Ų74101.6 Ų101.640%0.39651%0.51SS..Hα-helixtrans-61-46.1179-69.6-15000111.4E80 S86 N87 E88E80-N84 WeakPolarHBondContact O-CB 3.47Å; E80-N84 PolarHBondContact O-N 3.16Å; E80-N84 PolarHBondContact O-ND2 2.98Å; N84-S86 VanDerWaalsContact C-N 3.3Å; N84-S86 PolarHBondContact O-N 3.05Å; N84-N87 PolarHBondContact O-N 3.5Å; N84-N87 VanDerWaalsContact O-N 3.16Å; N84-E88 WeakPolarHBondContact O-CG 3.38Å; N84-E88 PolarHBondContact O-N 2.94Å
85R98.6Very high98.5Very high166 Ų166100.6 Ų100.663%0.62651%0.507SS*.Hα-helixtrans-61-39.1175.2-173.4177.6-176.8-168.61112.3K81 V83 L89K81-R85 VanDerWaalsContact O-CB 3.32Å; K81-R85 WeakPolarHBondContact O-CB 3.28Å; K81-R85 PolarHBondContact O-N 3.43Å; V83-R85 PolarHBondContact O-N 3.16Å; R85-L89 HydrophobicContact CG-CD1 4.36Å; R85-L89 VanDerWaalsContact O-CG 3.29Å; R85-L89 WeakPolarHBondContact O-CG 3.32Å; R85-L89 PolarHBondContact O-N 3.36Å
86S98.6Very high98.5Very high64 Ų64100.1 Ų100.145%0.44850%0.5SS..Hα-helixtrans-63.3-42.9176-173.10000111.4L82 V83 N84 L89 M90L82-S86 WeakPolarHBondContact O-CB 3.32Å; L82-S86 PolarHBondContact O-N 2.9Å; V83-S86 WeakPolarHBondContact O-CB 3.29Å; V83-S86 PolarHBondContact O-N 3.01Å; V83-S86 VanDerWaalsContact O-N 3.15Å; N84-S86 VanDerWaalsContact C-N 3.3Å; N84-S86 PolarHBondContact O-N 3.05Å; S86-L89 PolarHBondContact O-N 3.15Å; S86-M90 WeakPolarHBondContact O-CG 3.32Å; S86-M90 PolarHBondContact O-N 3.16Å
87N98.6Very high98.5Very high93 Ų93100.1 Ų100.150%0.49750%0.503SS..Hα-helixtrans-64.7-45.9178.7-68.7-20.1000111.4V83 N84 L89 M90 E91V83-N87 VanDerWaalsContact O-CG 3.31Å; V83-N87 PolarHBondContact O-N 3.38Å; V83-N87 PolarHBondContact O-ND2 3.38Å; N84-N87 PolarHBondContact O-N 3.5Å; N84-N87 VanDerWaalsContact O-N 3.16Å; N87-L89 VanDerWaalsContact C-N 3.31Å; N87-L89 PolarHBondContact O-N 3.45Å; N87-M90 PolarHBondContact O-N 3.47Å; N87-M90 VanDerWaalsContact O-N 3.16Å; N87-E91 PolarHBondContact O-N 2.79Å
88E98.4Very high98.5Very high118 Ų11898.3 Ų98.355%0.55151%0.505SS*.Hα-helixtrans-57.3-43.9175-72.5171.8-170.400111.7N84 M90 E91 N92N84-E88 WeakPolarHBondContact O-CG 3.38Å; N84-E88 PolarHBondContact O-N 2.94Å; E88-M90 PolarHBondContact O-N 2.92Å; E88-E91 PolarHBondContact O-N 2.65Å; E88-N92 WeakPolarHBondContact O-CB 3.46Å; E88-N92 VanDerWaalsContact O-CG 3.3Å; E88-N92 PolarHBondContact O-N 3.3Å; E88-N92 PolarHBondContact O-ND2 3Å
89L98.6Very high98.5Very high96 Ų9699.7 Ų99.750%0.50351%0.512SS..Hα-helixtrans-64.6-39.9177.6-73.2172.7000112.1R85 S86 N87 L93R85-L89 HydrophobicContact CG-CD1 4.36Å; R85-L89 VanDerWaalsContact O-CG 3.29Å; R85-L89 WeakPolarHBondContact O-CG 3.32Å; R85-L89 PolarHBondContact O-N 3.36Å; S86-L89 PolarHBondContact O-N 3.15Å; N87-L89 VanDerWaalsContact C-N 3.31Å; N87-L89 PolarHBondContact O-N 3.45Å; L89-L93 WeakPolarHBondContact O-CB 3.42Å; L89-L93 VanDerWaalsContact O-CG 3.28Å; L89-L93 WeakPolarHBondContact O-CG 3.4Å; L89-L93 PolarHBondContact O-N 2.99Å
90M98.4Very high98.5Very high122 Ų12298.9 Ų98.960%0.60151%0.508SS*.Hα-helixtrans-65.7-41.8177.6-75.1-62.5-6000112.2S86 N87 E88 L93 A94S86-M90 WeakPolarHBondContact O-CG 3.32Å; S86-M90 PolarHBondContact O-N 3.16Å; N87-M90 PolarHBondContact O-N 3.47Å; N87-M90 VanDerWaalsContact O-N 3.16Å; E88-M90 PolarHBondContact O-N 2.92Å; M90-L93 PolarHBondContact O-N 2.99Å; M90-A94 WeakPolarHBondContact O-CB 3.4Å; M90-A94 PolarHBondContact O-N 3Å
91E98.3Very high98.5Very high126 Ų12696.3 Ų96.359%0.58950%0.503SS*.Hα-helixtrans-63.8-49.1176.2-174170.6-157.400111.1N87 E88 L93 A94 E95N87-E91 PolarHBondContact O-N 2.79Å; E88-E91 PolarHBondContact O-N 2.65Å; E91-L93 VanDerWaalsContact C-N 3.3Å; E91-L93 PolarHBondContact O-N 3.45Å; E91-A94 WeakPolarHBondContact O-CB 3.16Å; E91-A94 PolarHBondContact O-N 3.01Å; E91-A94 VanDerWaalsContact O-N 3.08Å; E91-E95 WeakPolarHBondContact O-CG 3.31Å; E91-E95 PolarHBondContact O-N 3.32Å
92N98.5Very high98.6Very high95 Ų9594.4 Ų94.451%0.50850%0.503SS..Hα-helixtrans-58-40.4176.4-76.5-54.2000112.6E88 D96E88-N92 WeakPolarHBondContact O-CB 3.46Å; E88-N92 VanDerWaalsContact O-CG 3.3Å; E88-N92 PolarHBondContact O-N 3.3Å; E88-N92 PolarHBondContact O-ND2 3Å; N92-D96 WeakPolarHBondContact O-CB 3.34Å; N92-D96 PolarHBondContact O-N 3.44Å
93L98.6Very high98.6Very high102 Ų10294.1 Ų94.153%0.53449%0.493SS..Hα-helixtrans-66.5-40.2176.2-77.5171.5000112L89 M90 E91 L97L89-L93 WeakPolarHBondContact O-CB 3.42Å; L89-L93 VanDerWaalsContact O-CG 3.28Å; L89-L93 WeakPolarHBondContact O-CG 3.4Å; L89-L93 PolarHBondContact O-N 2.99Å; M90-L93 PolarHBondContact O-N 2.99Å; E91-L93 VanDerWaalsContact C-N 3.3Å; E91-L93 PolarHBondContact O-N 3.45Å; L93-L97 WeakPolarHBondContact O-CB 3.39Å; L93-L97 VanDerWaalsContact O-CG 3.3Å; L93-L97 WeakPolarHBondContact O-CG 3.3Å; L93-L97 PolarHBondContact O-N 2.93Å
94A98.4Very high98.6Very high60 Ų6096.6 Ų96.650%0.49649%0.494SS..Hα-helixtrans-64.1-43.917700000111.4M90 E91 L97 A98M90-A94 WeakPolarHBondContact O-CB 3.4Å; M90-A94 PolarHBondContact O-N 3Å; E91-A94 WeakPolarHBondContact O-CB 3.16Å; E91-A94 PolarHBondContact O-N 3.01Å; E91-A94 VanDerWaalsContact O-N 3.08Å; A94-L97 PolarHBondContact O-N 3.44Å; A94-A98 WeakPolarHBondContact O-CB 3.41Å; A94-A98 PolarHBondContact O-N 2.86Å
95E98.5Very high98.6Very high115 Ų11597.7 Ų97.754%0.53750%0.497SS..Hα-helixtrans-62.9-46.7176-70.9-173.9175.100112.4E91 L97 A98 Q99E91-E95 WeakPolarHBondContact O-CG 3.31Å; E91-E95 PolarHBondContact O-N 3.32Å; E95-L97 VanDerWaalsContact C-N 3.35Å; E95-L97 PolarHBondContact O-N 3.39Å; E95-A98 PolarHBondContact O-N 2.86Å; E95-Q99 WeakPolarHBondContact O-CB 3.47Å; E95-Q99 PolarHBondContact O-N 3.42Å
96D98.6Very high98.6Very high54 Ų5494.8 Ų94.829%0.28949%0.49SS..Hα-helixtrans-63-41178.5178.955.5000111.6N92 Q99 K100N92-D96 WeakPolarHBondContact O-CB 3.34Å; N92-D96 PolarHBondContact O-N 3.44Å; D96-Q99 PolarHBondContact O-N 3.46Å; D96-K100 WeakPolarHBondContact O-CB 3.46Å; D96-K100 VanDerWaalsContact O-CG 3.31Å; D96-K100 WeakPolarHBondContact O-CG 3.37Å; D96-K100 PolarHBondContact O-N 3.24Å; D96-K100 VanDerWaalsContact OD1-CE 3.32Å; D96-K100 WeakPolarHBondContact OD1-CE 3.49Å; D96-K100 IonicContact OD1-NZ 3.46Å; D96-K100 WeakPolarHBondContact OD2-CE 3.41Å; D96-K100 IonicContact OD2-NZ 3.34Å; D96-K100 PolarHBondContact OD2-NZ 3.08Å
97L98.6Very high98.6Very high111 Ų11196.5 Ų96.558%0.58149%0.493SS*.Hα-helixtrans-62.4-44.7174.6-76.9175.2000111.9L93 A94 E95 K100 S101L93-L97 WeakPolarHBondContact O-CB 3.39Å; L93-L97 VanDerWaalsContact O-CG 3.3Å; L93-L97 WeakPolarHBondContact O-CG 3.3Å; L93-L97 PolarHBondContact O-N 2.93Å; A94-L97 PolarHBondContact O-N 3.44Å; E95-L97 VanDerWaalsContact C-N 3.35Å; E95-L97 PolarHBondContact O-N 3.39Å; L97-K100 PolarHBondContact O-N 2.93Å; L97-S101 WeakPolarHBondContact O-CB 3.42Å; L97-S101 PolarHBondContact O-N 2.96Å
98A98.5Very high98.6Very high61 Ų6195.9 Ų95.950%0.50449%0.489SS..Hα-helixtrans-61.7-45176.600000111.3A94 E95 S101 S102A94-A98 WeakPolarHBondContact O-CB 3.41Å; A94-A98 PolarHBondContact O-N 2.86Å; E95-A98 PolarHBondContact O-N 2.86Å; A98-S101 PolarHBondContact O-N 3.2Å; A98-S102 WeakPolarHBondContact O-CB 3.34Å; A98-S102 PolarHBondContact O-N 2.95Å
99Q98.7Very high98.6Very high113 Ų11393.5 Ų93.553%0.52848%0.48SS..Hα-helixtrans-66.1-40.2178.9-162.9-169.620.500112.1E95 D96 R103E95-Q99 WeakPolarHBondContact O-CB 3.47Å; E95-Q99 PolarHBondContact O-N 3.42Å; D96-Q99 PolarHBondContact O-N 3.46Å; Q99-R103 WeakPolarHBondContact O-CB 3.37Å; Q99-R103 WeakPolarHBondContact O-CG 3.44Å; Q99-R103 PolarHBondContact O-N 2.97Å; Q99-R103 PolarHBondContact O-NE 3.04Å; Q99-R103 VanDerWaalsContact OE1-NH2 3.14Å
100K98.6Very high98.6Very high89 Ų8996 Ų9639%0.38749%0.487SS..Hα-helixtrans-64.8-40.5174-77.4172.8176.3164.20111.5D96 L97 R103 R104D96-K100 WeakPolarHBondContact O-CB 3.46Å; D96-K100 VanDerWaalsContact O-CG 3.31Å; D96-K100 WeakPolarHBondContact O-CG 3.37Å; D96-K100 PolarHBondContact O-N 3.24Å; D96-K100 VanDerWaalsContact OD1-CE 3.32Å; D96-K100 WeakPolarHBondContact OD1-CE 3.49Å; D96-K100 IonicContact OD1-NZ 3.46Å; D96-K100 WeakPolarHBondContact OD2-CE 3.41Å; D96-K100 IonicContact OD2-NZ 3.34Å; D96-K100 PolarHBondContact OD2-NZ 3.08Å; L97-K100 PolarHBondContact O-N 2.93Å; K100-R103 PolarHBondContact O-N 3.16Å; K100-R104 WeakPolarHBondContact O-CG 3.46Å; K100-R104 PolarHBondContact O-N 3.42Å
101S98.7Very high98.6Very high63 Ų6394.6 Ų94.644%0.44148%0.481SS..Hα-helixtrans-62.3-48175.6-1610000111.7L97 A98 R103 R104 Q105L97-S101 WeakPolarHBondContact O-CB 3.42Å; L97-S101 PolarHBondContact O-N 2.96Å; A98-S101 PolarHBondContact O-N 3.2Å; S101-R103 PolarHBondContact O-N 3.44Å; S101-R104 PolarHBondContact O-N 3.2Å; S101-Q105 PolarHBondContact O-N 2.89Å
102S98.7Very high98.6Very high63 Ų6392 Ų9244%0.44147%0.47SS..Hα-helixtrans-57.9-45.9175.8-176.80000112.1A98 R104 Q105 Q106A98-S102 WeakPolarHBondContact O-CB 3.34Å; A98-S102 PolarHBondContact O-N 2.95Å; S102-R104 PolarHBondContact O-N 3.45Å; S102-Q105 PolarHBondContact O-N 3.27Å; S102-Q106 WeakPolarHBondContact O-CG 3.39Å; S102-Q106 PolarHBondContact O-N 3.15Å
103R98.7Very high98.6Very high110 Ų11091.5 Ų91.542%0.41547%0.468SS..Hα-helixtrans-59.5-43.5176.2-78.2-178.3-83.4-169.2-6.8112.6Q99 K100 S101 Q106 I107Q99-R103 WeakPolarHBondContact O-CB 3.37Å; Q99-R103 WeakPolarHBondContact O-CG 3.44Å; Q99-R103 PolarHBondContact O-N 2.97Å; Q99-R103 PolarHBondContact O-NE 3.04Å; Q99-R103 VanDerWaalsContact OE1-NH2 3.14Å; K100-R103 PolarHBondContact O-N 3.16Å; S101-R103 PolarHBondContact O-N 3.44Å; R103-Q106 PolarHBondContact O-N 3.15Å; R103-I107 WeakPolarHBondContact O-CG1 3.48Å; R103-I107 PolarHBondContact O-N 3.42Å; R103-I107 VanDerWaalsContact O-N 3.15Å
104R98.7Very high98.6Very high134 Ų13489.4 Ų89.451%0.50646%0.462SS..Hα-helixtrans-62.5-44.5175.5-73.7-173.1-61.8-95.30.8111.5K100 S101 S102 Q106 I107 I108K100-R104 WeakPolarHBondContact O-CG 3.46Å; K100-R104 PolarHBondContact O-N 3.42Å; S101-R104 PolarHBondContact O-N 3.2Å; S102-R104 PolarHBondContact O-N 3.45Å; R104-Q106 VanDerWaalsContact C-N 3.33Å; R104-Q106 PolarHBondContact O-N 2.98Å; R104-I107 PolarHBondContact O-N 3.42Å; R104-I107 VanDerWaalsContact O-N 3.16Å; R104-I108 WeakPolarHBondContact O-CG1 3.4Å; R104-I108 PolarHBondContact O-N 2.89Å
105Q98.6Very high98.6Very high97 Ų9790.6 Ų90.645%0.45346%0.46SS..Hα-helixtrans-60.4-44.4178.4-169.758.848.300111.3S101 S102 I107 I108 D109S101-Q105 PolarHBondContact O-N 2.89Å; S102-Q105 PolarHBondContact O-N 3.27Å; Q105-I107 VanDerWaalsContact C-N 3.3Å; Q105-I107 PolarHBondContact O-N 3.46Å; Q105-I108 PolarHBondContact O-N 3.31Å; Q105-D109 PolarHBondContact NE2-OD1 3.02Å; Q105-D109 WeakPolarHBondContact O-CB 3.48Å; Q105-D109 PolarHBondContact O-N 3.06Å
106Q98.7Very high98.6Very high105 Ų10591.4 Ų91.449%0.49146%0.462SS..Hα-helixtrans-59.5-37.9175.9-70.4174.610.800113.1S102 R103 R104 K110S102-Q106 WeakPolarHBondContact O-CG 3.39Å; S102-Q106 PolarHBondContact O-N 3.15Å; R103-Q106 PolarHBondContact O-N 3.15Å; R104-Q106 VanDerWaalsContact C-N 3.33Å; R104-Q106 PolarHBondContact O-N 2.98Å; Q106-K110 VanDerWaalsContact O-CG 3.28Å; Q106-K110 WeakPolarHBondContact O-CG 3.28Å; Q106-K110 PolarHBondContact O-N 3.25Å
107I98.7Very high98.6Very high99 Ų9995.9 Ų95.951%0.50848%0.478SS..Hα-helixtrans-67.5-46.1176.3-67.2165.4000110.3R103 R104 Q105 D109 K110 I111R103-I107 WeakPolarHBondContact O-CG1 3.48Å; R103-I107 PolarHBondContact O-N 3.42Å; R103-I107 VanDerWaalsContact O-N 3.15Å; R104-I107 PolarHBondContact O-N 3.42Å; R104-I107 VanDerWaalsContact O-N 3.16Å; Q105-I107 VanDerWaalsContact C-N 3.3Å; Q105-I107 PolarHBondContact O-N 3.46Å; I107-D109 VanDerWaalsContact C-N 3.33Å; I107-D109 PolarHBondContact O-N 2.83Å; I107-K110 WeakPolarHBondContact O-CB 3.34Å; I107-K110 PolarHBondContact O-N 3.18Å; I107-I111 HydrophobicContact CG2-CD1 3.99Å; I107-I111 WeakPolarHBondContact O-CG1 3.49Å; I107-I111 PolarHBondContact O-N 3.43Å
108I98.7Very high98.5Very high81 Ų8196.2 Ų96.242%0.41548%0.477SS..Hα-helixtrans-58.8-46.8177-69.8167.6000110.2R104 Q105 K110 I111 I112R104-I108 WeakPolarHBondContact O-CG1 3.4Å; R104-I108 PolarHBondContact O-N 2.89Å; Q105-I108 PolarHBondContact O-N 3.31Å; I108-K110 VanDerWaalsContact C-N 3.31Å; I108-K110 PolarHBondContact O-N 2.87Å; I108-I111 PolarHBondContact O-N 2.91Å; I108-I111 VanDerWaalsContact O-N 3.15Å; I108-I112 HydrophobicContact CG2-CD1 3.61Å; I108-I112 HydrophobicContact CG2-CG1 4.25Å; I108-I112 WeakPolarHBondContact O-CG1 3.47Å; I108-I112 PolarHBondContact O-N 3.37Å
109D98.6Very high98.5Very high67 Ų6797.1 Ų97.136%0.35848%0.476SS..Hα-helixtrans-62.5-38.9179.6-66.3-20.7000111.7Q105 I107 I112 N113Q105-D109 PolarHBondContact NE2-OD1 3.02Å; Q105-D109 WeakPolarHBondContact O-CB 3.48Å; Q105-D109 PolarHBondContact O-N 3.06Å; I107-D109 VanDerWaalsContact C-N 3.33Å; I107-D109 PolarHBondContact O-N 2.83Å; D109-I112 PolarHBondContact O-N 2.95Å; D109-N113 VanDerWaalsContact O-CB 3.23Å; D109-N113 WeakPolarHBondContact O-CB 3.35Å; D109-N113 PolarHBondContact O-N 3.43Å; D109-N113 PolarHBondContact O-ND2 2.94Å; D109-N113 VanDerWaalsContact O-ND2 3.12Å
110K98.6Very high98.5Very high148 Ų14896.4 Ų96.464%0.64347%0.473SS*.Hα-helixtrans-61.5-45.2173.6-77.1173.5-178.5179.50111.8Q106 I107 I108 N113 S114Q106-K110 VanDerWaalsContact O-CG 3.28Å; Q106-K110 WeakPolarHBondContact O-CG 3.28Å; Q106-K110 PolarHBondContact O-N 3.25Å; I107-K110 WeakPolarHBondContact O-CB 3.34Å; I107-K110 PolarHBondContact O-N 3.18Å; I108-K110 VanDerWaalsContact C-N 3.31Å; I108-K110 PolarHBondContact O-N 2.87Å; K110-N113 PolarHBondContact O-N 2.88Å; K110-S114 WeakPolarHBondContact O-CB 3.4Å; K110-S114 PolarHBondContact O-N 3.49Å
111I98.6Very high98.4Very high93 Ų9398.8 Ų98.848%0.47748%0.483SS..Hα-helixtrans-63.7-48.8178-66.6166.4000110.2I107 I108 N113 S114 N115I107-I111 HydrophobicContact CG2-CD1 3.99Å; I107-I111 WeakPolarHBondContact O-CG1 3.49Å; I107-I111 PolarHBondContact O-N 3.43Å; I108-I111 PolarHBondContact O-N 2.91Å; I108-I111 VanDerWaalsContact O-N 3.15Å; I111-N113 VanDerWaalsContact C-N 3.31Å; I111-N113 PolarHBondContact O-N 3.39Å; I111-S114 PolarHBondContact O-N 3.18Å; I111-N115 VanDerWaalsContact O-CG 3.31Å; I111-N115 PolarHBondContact O-N 3.38Å; I111-N115 PolarHBondContact O-OD1 2.94Å
112I98.6Very high98.3Very high71 Ų7198.5 Ų98.536%0.36448%0.484SS..Hα-helixtrans-57.5-45.9178-71.1172.8000110.5I108 D109 S114 N115 K116I108-I112 HydrophobicContact CG2-CD1 3.61Å; I108-I112 HydrophobicContact CG2-CG1 4.25Å; I108-I112 WeakPolarHBondContact O-CG1 3.47Å; I108-I112 PolarHBondContact O-N 3.37Å; D109-I112 PolarHBondContact O-N 2.95Å; I112-S114 PolarHBondContact O-N 2.85Å; I112-N115 PolarHBondContact O-N 2.88Å; I112-K116 HydrophobicContact CG2-CD 4.05Å; I112-K116 HydrophobicContact CG2-CG 4.41Å; I112-K116 WeakPolarHBondContact O-CB 3.23Å; I112-K116 VanDerWaalsContact O-CG 3.3Å; I112-K116 WeakPolarHBondContact O-CG 3.3Å; I112-K116 PolarHBondContact O-N 3.49Å
113N98.5Very high98.2Very high86 Ų86101 Ų10146%0.4649%0.488SS..Hα-helixtrans-67.6-34.9-179.8-72.7-26.1000112.5D109 K110 I111 K117D109-N113 VanDerWaalsContact O-CB 3.23Å; D109-N113 WeakPolarHBondContact O-CB 3.35Å; D109-N113 PolarHBondContact O-N 3.43Å; D109-N113 PolarHBondContact O-ND2 2.94Å; D109-N113 VanDerWaalsContact O-ND2 3.12Å; K110-N113 PolarHBondContact O-N 2.88Å; I111-N113 VanDerWaalsContact C-N 3.31Å; I111-N113 PolarHBondContact O-N 3.39Å; N113-K117 WeakPolarHBondContact O-CG 3.35Å; N113-K117 PolarHBondContact O-N 3.45Å
114S98.4Very high98.1Very high58 Ų58100.9 Ų100.941%0.40649%0.494SS..Hα-helixtrans-64-51.1172.5-165.20000111.1K110 I111 I112 K116 K117 E118K110-S114 WeakPolarHBondContact O-CB 3.4Å; K110-S114 PolarHBondContact O-N 3.49Å; I111-S114 PolarHBondContact O-N 3.18Å; I112-S114 PolarHBondContact O-N 2.85Å; S114-K116 VanDerWaalsContact C-N 3.32Å; S114-K116 PolarHBondContact O-N 3.12Å; S114-K117 WeakPolarHBondContact O-CB 3.37Å; S114-K117 PolarHBondContact O-N 3.05Å; S114-E118 PolarHBondContact O-N 3.04Å
115N98.4Very high97.9Very high84 Ų8499.5 Ų99.545%0.44950%0.497SS..Hα-helixtrans-62.6-39.2-179-67.5-0.7000111.7I111 I112 K117 E118 V119I111-N115 VanDerWaalsContact O-CG 3.31Å; I111-N115 PolarHBondContact O-N 3.38Å; I111-N115 PolarHBondContact O-OD1 2.94Å; I112-N115 PolarHBondContact O-N 2.88Å; N115-K117 VanDerWaalsContact C-N 3.31Å; N115-K117 PolarHBondContact O-N 3.04Å; N115-E118 PolarHBondContact O-N 3.4Å; N115-V119 WeakPolarHBondContact O-CG2 3.43Å; N115-V119 PolarHBondContact O-N 2.9Å
116K98.3Very high97.7Very high133 Ų13397.5 Ų97.558%0.57850%0.497SS*.Hα-helixtrans-57.3-43.4172.9-79.6177178.6177.60111.9I112 S114 V119 E120I112-K116 HydrophobicContact CG2-CD 4.05Å; I112-K116 HydrophobicContact CG2-CG 4.41Å; I112-K116 WeakPolarHBondContact O-CB 3.23Å; I112-K116 VanDerWaalsContact O-CG 3.3Å; I112-K116 WeakPolarHBondContact O-CG 3.3Å; I112-K116 PolarHBondContact O-N 3.49Å; S114-K116 VanDerWaalsContact C-N 3.32Å; S114-K116 PolarHBondContact O-N 3.12Å; K116-V119 PolarHBondContact O-N 2.97Å; K116-E120 WeakPolarHBondContact O-CB 3.31Å; K116-E120 PolarHBondContact O-N 3.29Å
117K98.1Very high97.4Very high148 Ų14897.8 Ų97.864%0.64350%0.502SS*.Hα-helixtrans-65.6-38.2177.3-71.5175-177.8-177.20112.1N113 S114 N115 K121N113-K117 WeakPolarHBondContact O-CG 3.35Å; N113-K117 PolarHBondContact O-N 3.45Å; S114-K117 WeakPolarHBondContact O-CB 3.37Å; S114-K117 PolarHBondContact O-N 3.05Å; N115-K117 VanDerWaalsContact C-N 3.31Å; N115-K117 PolarHBondContact O-N 3.04Å; K117-K121 VanDerWaalsContact O-CG 3.31Å; K117-K121 WeakPolarHBondContact O-CG 3.41Å; K117-K121 PolarHBondContact O-N 3.21Å
118E97.8Very high97.1Very high117 Ų11796.1 Ų96.155%0.54750%0.503SS..Hα-helixtrans-67.5-43.4176.6-70.2-178.3179.300112.2S114 N115 E120 K121 A122S114-E118 PolarHBondContact O-N 3.04Å; N115-E118 PolarHBondContact O-N 3.4Å; E118-E120 VanDerWaalsContact C-N 3.32Å; E118-E120 PolarHBondContact O-N 3.24Å; E118-K121 PolarHBondContact O-N 3.35Å; E118-A122 PolarHBondContact O-N 3.46Å
119V97.9Very high96.7Very high81 Ų81101.1 Ų101.149%0.49152%0.516SS..Hα-helixtrans-60.6-42.9174.6170.10000110.9N115 K116 K121 A122 K123N115-V119 WeakPolarHBondContact O-CG2 3.43Å; N115-V119 PolarHBondContact O-N 2.9Å; K116-V119 PolarHBondContact O-N 2.97Å; V119-K121 PolarHBondContact O-N 3.41Å; V119-A122 PolarHBondContact O-N 3.49Å; V119-K123 WeakPolarHBondContact O-CG 3.37Å; V119-K123 PolarHBondContact O-N 3.03Å
120E98Very high96.3Very high98 Ų98100.5 Ų100.546%0.45852%0.52SS..Hα-helixtrans-64-41.7178.3-166.358.9-156.700111.9K116 E118 A122 K123 L124K116-E120 WeakPolarHBondContact O-CB 3.31Å; K116-E120 PolarHBondContact O-N 3.29Å; E118-E120 VanDerWaalsContact C-N 3.32Å; E118-E120 PolarHBondContact O-N 3.24Å; E120-A122 VanDerWaalsContact C-N 3.32Å; E120-A122 PolarHBondContact O-N 2.97Å; E120-K123 PolarHBondContact O-N 3.3Å; E120-L124 WeakPolarHBondContact O-CG 3.49Å; E120-L124 PolarHBondContact O-N 3.03Å
121K97.5Very high95.9Very high138 Ų13897 Ų9760%0.651%0.514SS*.Hα-helixtrans-60.3-42.2172.4-72.8173.3-178.6-178.20112K117 E118 V119 K123 L124 L125K117-K121 VanDerWaalsContact O-CG 3.31Å; K117-K121 WeakPolarHBondContact O-CG 3.41Å; K117-K121 PolarHBondContact O-N 3.21Å; E118-K121 PolarHBondContact O-N 3.35Å; V119-K121 PolarHBondContact O-N 3.41Å; K121-K123 VanDerWaalsContact C-N 3.35Å; K121-L124 PolarHBondContact O-N 3.43Å; K121-L125 WeakPolarHBondContact O-CG 3.45Å; K121-L125 PolarHBondContact O-N 3.2Å
122A96.9Very high95.5Very high57 Ų5796.3 Ų96.347%0.47152%0.516SS..Hα-helixtrans-63.9-40178.700000111.9E118 V119 E120 L125 A126E118-A122 PolarHBondContact O-N 3.46Å; V119-A122 PolarHBondContact O-N 3.49Å; E120-A122 VanDerWaalsContact C-N 3.32Å; E120-A122 PolarHBondContact O-N 2.97Å; A122-L125 PolarHBondContact O-N 3.02Å; A122-A126 WeakPolarHBondContact O-CB 3.46Å; A122-A126 PolarHBondContact O-N 3.4Å
123K96.5Very high95.2Very high116 Ų11699.1 Ų99.150%0.50453%0.528SS..Hα-helixtrans-61.3-50.3173.8-73178.2179.5179.30111.8V119 E120 K121 L125 A126 D127V119-K123 WeakPolarHBondContact O-CG 3.37Å; V119-K123 PolarHBondContact O-N 3.03Å; E120-K123 PolarHBondContact O-N 3.3Å; K121-K123 VanDerWaalsContact C-N 3.35Å; K123-L125 VanDerWaalsContact C-N 3.26Å; K123-L125 PolarHBondContact O-N 3.26Å; K123-A126 WeakPolarHBondContact O-CB 3.24Å; K123-A126 PolarHBondContact O-N 2.97Å; K123-D127 PolarHBondContact O-N 3.25Å
124L95.7Very high94.8Very high107 Ų10798.3 Ų98.356%0.5653%0.529SS*.Hα-helixtrans-57.5-39.6177.9-69.9172.9000112.3E120 K121 A128E120-L124 WeakPolarHBondContact O-CG 3.49Å; E120-L124 PolarHBondContact O-N 3.03Å; K121-L124 PolarHBondContact O-N 3.43Å; L124-A128 VanDerWaalsContact O-CB 3.24Å; L124-A128 WeakPolarHBondContact O-CB 3.41Å; L124-A128 PolarHBondContact O-N 2.95Å
125L94.5Very high94.6Very high105 Ų10597.9 Ų97.955%0.5552%0.524SS..Hα-helixtrans-68.7-36.9175.7-72.8172.4000112.9K121 A122 K123 R129K121-L125 WeakPolarHBondContact O-CG 3.45Å; K121-L125 PolarHBondContact O-N 3.2Å; A122-L125 PolarHBondContact O-N 3.02Å; K123-L125 VanDerWaalsContact C-N 3.26Å; K123-L125 PolarHBondContact O-N 3.26Å; L125-R129 VanDerWaalsContact O-CG 3.29Å; L125-R129 WeakPolarHBondContact O-CG 3.39Å; L125-R129 PolarHBondContact O-N 3.47Å
126A94.5Very high94.4Very high56 Ų5698.4 Ų98.446%0.46353%0.526SS..Hα-helixtrans-65.7-46.3175.700000111.1A122 K123 A128 R129 A130A122-A126 WeakPolarHBondContact O-CB 3.46Å; A122-A126 PolarHBondContact O-N 3.4Å; K123-A126 WeakPolarHBondContact O-CB 3.24Å; K123-A126 PolarHBondContact O-N 2.97Å; A126-A128 PolarHBondContact O-N 2.99Å; A126-R129 PolarHBondContact O-N 3.36Å; A126-R129 VanDerWaalsContact O-N 3.14Å; A126-A130 PolarHBondContact O-N 3.48Å
127D93Very high94.3Very high110 Ų11097.3 Ų97.359%0.58853%0.526SS*.Hα-helixtrans-63.3-43178.3-66.9-21.1000111.4K123 R129 A130 S131K123-D127 PolarHBondContact O-N 3.25Å; D127-R129 PolarHBondContact O-N 3.14Å; D127-A130 PolarHBondContact O-N 2.91Å; D127-S131 PolarHBondContact O-N 3.44Å
128A91.9Very high94.2Very high64 Ų6498 Ų9853%0.52953%0.525SS..Hα-helixtrans-62.9-26.217600000113.3L124 A126 P132L124-A128 VanDerWaalsContact O-CB 3.24Å; L124-A128 WeakPolarHBondContact O-CB 3.41Å; L124-A128 PolarHBondContact O-N 2.95Å; A126-A128 PolarHBondContact O-N 2.99Å; A128-P132 WeakPolarHBondContact O-CD 3.29Å; A128-P132 WeakPolarHBondContact O-CG 3.43Å
129R90.3Very high94.1Very high187 Ų18798 Ų9871%0.70652%0.524SS*.Hα-helixtrans-84-35.7175-73.6173179.6-177.30.9112.7L125 A126 D127 S131 P132 Q133L125-R129 VanDerWaalsContact O-CG 3.29Å; L125-R129 WeakPolarHBondContact O-CG 3.39Å; L125-R129 PolarHBondContact O-N 3.47Å; A126-R129 PolarHBondContact O-N 3.36Å; A126-R129 VanDerWaalsContact O-N 3.14Å; D127-R129 PolarHBondContact O-N 3.14Å; R129-S131 PolarHBondContact O-N 3.19Å; R129-P132 WeakPolarHBondContact O-CD 3.46Å; R129-Q133 WeakPolarHBondContact O-CB 3.44Å; R129-Q133 PolarHBondContact O-N 3.26Å
130A91.2Very high94.1Very high53 Ų5398 Ų9844%0.43852%0.521SS..Hα-helixtrans-66.4-35.1-178.600000112.8A126 D127 S134A126-A130 PolarHBondContact O-N 3.48Å; D127-A130 PolarHBondContact O-N 2.91Å; A130-S134 WeakPolarHBondContact O-CB 3.5Å; A130-S134 PolarHBondContact O-N 3.01Å; A130-S134 PolarHBondContact O-OG 3.04Å
131S89.2Confident94.1Very high74 Ų7498.2 Ų98.252%0.51753%0.525SS..Hα-helixtrans-67.3-49.9-178.3171.40000113.8D127 R129 Q133 S134 T135D127-S131 PolarHBondContact O-N 3.44Å; R129-S131 PolarHBondContact O-N 3.19Å; S131-Q133 VanDerWaalsContact C-N 3.33Å; S131-Q133 PolarHBondContact O-N 3.29Å; S131-S134 PolarHBondContact O-N 2.89Å; S131-S134 PolarHBondContact O-OG 3.31Å; S131-T135 WeakPolarHBondContact O-CB 2.95Å; S131-T135 PolarHBondContact O-N 2.91Å; S131-T135 PolarHBondContact O-OG1 2.87Å
132P91.3Very high94.1Very high79 Ų7995.5 Ų95.551%0.51352%0.517SS..Hα-helixtrans-63.1-38.1174-24.234.2000112.7A128 R129 T135 L136A128-P132 WeakPolarHBondContact O-CD 3.29Å; A128-P132 WeakPolarHBondContact O-CG 3.43Å; R129-P132 WeakPolarHBondContact O-CD 3.46Å; P132-T135 PolarHBondContact O-N 3.07Å; P132-L136 WeakPolarHBondContact O-CB 3.43Å; P132-L136 PolarHBondContact O-N 3.48Å
133Q91.9Very high94.2Very high130 Ų13096.2 Ų96.261%0.60751%0.513SS*.Hα-helixtrans-65.6-43.9-179.8-170.6176.15.400111.8R129 S131 T135 L136 L137R129-Q133 WeakPolarHBondContact O-CB 3.44Å; R129-Q133 PolarHBondContact O-N 3.26Å; S131-Q133 VanDerWaalsContact C-N 3.33Å; S131-Q133 PolarHBondContact O-N 3.29Å; Q133-T135 VanDerWaalsContact C-N 3.32Å; Q133-T135 PolarHBondContact O-N 2.96Å; Q133-L136 PolarHBondContact O-N 3.3Å; Q133-L137 HydrophobicContact CG-CD1 4.49Å; Q133-L137 WeakPolarHBondContact O-CG 3.34Å; Q133-L137 PolarHBondContact O-N 3.49Å
134S90.3Very high94.3Very high69 Ų6995.7 Ų95.748%0.48352%0.515SS..Hα-helixtrans-65.2-37.4175.360.30000112A130 S131 L137 R138A130-S134 WeakPolarHBondContact O-CB 3.5Å; A130-S134 PolarHBondContact O-N 3.01Å; A130-S134 PolarHBondContact O-OG 3.04Å; S131-S134 PolarHBondContact O-N 2.89Å; S131-S134 PolarHBondContact O-OG 3.31Å; S134-L137 PolarHBondContact O-N 2.95Å; S134-R138 PolarHBondContact O-N 3.38Å
135T93.4Very high94.4Very high50 Ų5093.2 Ų93.231%0.30751%0.507SS..Hα-helixtrans-63.4-45.5175.4-57.40000111.8S131 P132 Q133 R138 Q139S131-T135 WeakPolarHBondContact O-CB 2.95Å; S131-T135 PolarHBondContact O-N 2.91Å; S131-T135 PolarHBondContact O-OG1 2.87Å; P132-T135 PolarHBondContact O-N 3.07Å; Q133-T135 VanDerWaalsContact C-N 3.32Å; Q133-T135 PolarHBondContact O-N 2.96Å; T135-R138 PolarHBondContact O-N 3.4Å; T135-Q139 WeakPolarHBondContact O-CG 3.35Å; T135-Q139 PolarHBondContact O-N 2.96Å
136L94.8Very high94.5Very high95 Ų9592.5 Ų92.550%0.49750%0.504SS..Hα-helixtrans-63.9-43.4178.118063.2000111.7P132 Q133 R138 Q139 I140P132-L136 WeakPolarHBondContact O-CB 3.43Å; P132-L136 PolarHBondContact O-N 3.48Å; Q133-L136 PolarHBondContact O-N 3.3Å; L136-R138 VanDerWaalsContact C-N 3.29Å; L136-R138 PolarHBondContact O-N 3.49Å; L136-Q139 PolarHBondContact O-N 3.06Å; L136-I140 HydrophobicContact CD1-CD1 4.33Å; L136-I140 HydrophobicContact CD1-CG1 4.44Å; L136-I140 HydrophobicContact CG-CD1 4.03Å; L136-I140 WeakPolarHBondContact O-CG1 3.23Å; L136-I140 PolarHBondContact O-N 3.47Å
137L95.5Very high94.7Very high109 Ų10995.7 Ų95.757%0.57151%0.507SS*.Hα-helixtrans-60.2-40.8176-74.1171.7000111.8Q133 S134 I140 N141Q133-L137 HydrophobicContact CG-CD1 4.49Å; Q133-L137 WeakPolarHBondContact O-CG 3.34Å; Q133-L137 PolarHBondContact O-N 3.49Å; S134-L137 PolarHBondContact O-N 2.95Å; L137-I140 PolarHBondContact O-N 2.91Å; L137-N141 WeakPolarHBondContact O-CB 3.39Å; L137-N141 PolarHBondContact O-N 3.47Å
138R95.7Very high94.9Very high164 Ų16493.4 Ų93.462%0.61949%0.493SS*.Hα-helixtrans-63-46.2174.1-172.5177.965.9178.5-0.1111.6S134 T135 L136 I140 N141 D142S134-R138 PolarHBondContact O-N 3.38Å; T135-R138 PolarHBondContact O-N 3.4Å; L136-R138 VanDerWaalsContact C-N 3.29Å; L136-R138 PolarHBondContact O-N 3.49Å; R138-I140 VanDerWaalsContact C-N 3.34Å; R138-I140 PolarHBondContact O-N 3.42Å; R138-N141 WeakPolarHBondContact O-CB 3.47Å; R138-N141 PolarHBondContact O-N 2.68Å; R138-D142 VanDerWaalsContact O-CG 3.27Å; R138-D142 PolarHBondContact O-N 2.9Å
139Q97.1Very high95.2Very high115 Ų11593.7 Ų93.754%0.53749%0.485SS..Hα-helixtrans-60.1-41.9177.7-74.3174-14.300112.6T135 L136 N141 D142 D143T135-Q139 WeakPolarHBondContact O-CG 3.35Å; T135-Q139 PolarHBondContact O-N 2.96Å; L136-Q139 PolarHBondContact O-N 3.06Å; Q139-N141 VanDerWaalsContact C-N 3.34Å; Q139-D142 PolarHBondContact O-N 3.18Å; Q139-D143 WeakPolarHBondContact O-CB 3.39Å; Q139-D143 PolarHBondContact O-N 2.96Å
140I97.5Very high95.6Very high82 Ų8290.2 Ų90.242%0.42148%0.481SS..Hα-helixtrans-62-44.6175.6-69.1166.5000110.4L136 L137 R138 D142 D143 L144L136-I140 HydrophobicContact CD1-CD1 4.33Å; L136-I140 HydrophobicContact CD1-CG1 4.44Å; L136-I140 HydrophobicContact CG-CD1 4.03Å; L136-I140 WeakPolarHBondContact O-CG1 3.23Å; L136-I140 PolarHBondContact O-N 3.47Å; L137-I140 PolarHBondContact O-N 2.91Å; R138-I140 VanDerWaalsContact C-N 3.34Å; R138-I140 PolarHBondContact O-N 3.42Å; I140-D142 PolarHBondContact O-N 3.2Å; I140-D143 PolarHBondContact O-N 3.41Å; I140-L144 HydrophobicContact CG2-CD1 3.97Å; I140-L144 HydrophobicContact CG2-CG 4.38Å; I140-L144 WeakPolarHBondContact O-CB 3.31Å; I140-L144 VanDerWaalsContact O-CG 3.31Å; I140-L144 WeakPolarHBondContact O-CG 3.49Å; I140-L144 PolarHBondContact O-N 3.04Å
141N97.7Very high95.9Very high103 Ų10393.7 Ų93.755%0.55148%0.483SS*.Hα-helixtrans-62.9-42.4179-174.276.3000112.1L137 R138 Q139 L144 S145L137-N141 WeakPolarHBondContact O-CB 3.39Å; L137-N141 PolarHBondContact O-N 3.47Å; R138-N141 WeakPolarHBondContact O-CB 3.47Å; R138-N141 PolarHBondContact O-N 2.68Å; Q139-N141 VanDerWaalsContact C-N 3.34Å; N141-L144 PolarHBondContact O-N 3.41Å; N141-S145 WeakPolarHBondContact O-CB 3.47Å; N141-S145 PolarHBondContact O-N 2.97Å
142D97.7Very high96.3Very high80 Ų8095.6 Ų95.643%0.42848%0.479SS..Hα-helixtrans-64.9-43.3177.4-65.3-19.1000111.3R138 Q139 I140 S145 N146R138-D142 VanDerWaalsContact O-CG 3.27Å; R138-D142 PolarHBondContact O-N 2.9Å; Q139-D142 PolarHBondContact O-N 3.18Å; I140-D142 PolarHBondContact O-N 3.2Å; D142-S145 PolarHBondContact O-N 3.32Å; D142-N146 WeakPolarHBondContact O-CB 3.47Å; D142-N146 PolarHBondContact O-N 3.5Å; D142-N146 PolarHBondContact O-ND2 3.46Å
143D98.1Very high96.6Very high72 Ų7295.3 Ų95.339%0.38548%0.478SS..Hα-helixtrans-61.6-45.5175.8179.762.5000112.2Q139 I140 S145 N146 K147Q139-D143 WeakPolarHBondContact O-CB 3.39Å; Q139-D143 PolarHBondContact O-N 2.96Å; I140-D143 PolarHBondContact O-N 3.41Å; D143-S145 PolarHBondContact O-N 3.18Å; D143-N146 PolarHBondContact O-N 2.92Å; D143-K147 WeakPolarHBondContact O-CB 3.44Å; D143-K147 WeakPolarHBondContact O-CG 3.4Å; D143-K147 PolarHBondContact O-N 3.38Å; D143-K147 WeakPolarHBondContact OD1-CE 3.49Å; D143-K147 IonicContact OD1-NZ 2.65Å; D143-K147 VanDerWaalsContact OD2-CE 3.23Å; D143-K147 WeakPolarHBondContact OD2-CE 3.42Å; D143-K147 IonicContact OD2-NZ 3.65Å; D143-K147 PolarHBondContact OD2-NZ 2.76Å
144L98Very high96.9Very high105 Ų10594.9 Ų94.955%0.5548%0.476SS..Hα-helixtrans-62.9-42.7177-72.3175.8000111.9I140 N141 K147 E148I140-L144 HydrophobicContact CG2-CD1 3.97Å; I140-L144 HydrophobicContact CG2-CG 4.38Å; I140-L144 WeakPolarHBondContact O-CB 3.31Å; I140-L144 VanDerWaalsContact O-CG 3.31Å; I140-L144 WeakPolarHBondContact O-CG 3.49Å; I140-L144 PolarHBondContact O-N 3.04Å; N141-L144 PolarHBondContact O-N 3.41Å; L144-K147 PolarHBondContact O-N 2.96Å; L144-E148 WeakPolarHBondContact O-CB 3.36Å; L144-E148 PolarHBondContact O-N 2.94Å
145S98Very high97.2Very high55 Ų5595.4 Ų95.439%0.38547%0.473SS..Hα-helixtrans-61.7-44.1175.9-172.80000111.5N141 D142 D143 E148 N149N141-S145 WeakPolarHBondContact O-CB 3.47Å; N141-S145 PolarHBondContact O-N 2.97Å; D142-S145 PolarHBondContact O-N 3.32Å; D143-S145 PolarHBondContact O-N 3.18Å; S145-E148 PolarHBondContact O-N 3.28Å; S145-N149 WeakPolarHBondContact O-CB 3.43Å; S145-N149 VanDerWaalsContact O-CG 3.22Å; S145-N149 PolarHBondContact O-N 3.3Å; S145-N149 PolarHBondContact O-ND2 3.38Å
146N97.8Very high97.3Very high91 Ų9199.7 Ų99.749%0.48749%0.49SS..Hα-helixtrans-64.8-43.8177.6-72.2-25.8000112.2D142 D143 E148 N149 N150D142-N146 WeakPolarHBondContact O-CB 3.47Å; D142-N146 PolarHBondContact O-N 3.5Å; D142-N146 PolarHBondContact O-ND2 3.46Å; D143-N146 PolarHBondContact O-N 2.92Å; N146-E148 VanDerWaalsContact C-N 3.33Å; N146-E148 PolarHBondContact O-N 3.42Å; N146-N149 PolarHBondContact O-N 2.92Å; N146-N150 WeakPolarHBondContact O-CB 3.42Å; N146-N150 VanDerWaalsContact O-CG 3.26Å; N146-N150 PolarHBondContact O-N 3Å; N146-N150 PolarHBondContact O-ND2 3.36Å
147K98.3Very high97.4Very high123 Ų12399 Ų9954%0.53549%0.486SS..Hα-helixtrans-59.9-43.2174.8-77.5171.7176.9164.80111.7D143 L144 N150 R151D143-K147 WeakPolarHBondContact O-CB 3.44Å; D143-K147 WeakPolarHBondContact O-CG 3.4Å; D143-K147 PolarHBondContact O-N 3.38Å; D143-K147 WeakPolarHBondContact OD1-CE 3.49Å; D143-K147 IonicContact OD1-NZ 2.65Å; D143-K147 VanDerWaalsContact OD2-CE 3.23Å; D143-K147 WeakPolarHBondContact OD2-CE 3.42Å; D143-K147 IonicContact OD2-NZ 3.65Å; D143-K147 PolarHBondContact OD2-NZ 2.76Å; L144-K147 PolarHBondContact O-N 2.96Å; K147-N150 PolarHBondContact O-N 3.5Å; K147-R151 WeakPolarHBondContact O-CB 3.46Å; K147-R151 PolarHBondContact O-N 2.92Å
148E98Very high97.3Very high62 Ų6297 Ų9729%0.2948%0.476SS..Hα-helixtrans-66.2-40.7176.9175.354.8-160.100112L144 S145 N146 R151 R152L144-E148 WeakPolarHBondContact O-CB 3.36Å; L144-E148 PolarHBondContact O-N 2.94Å; S145-E148 PolarHBondContact O-N 3.28Å; N146-E148 VanDerWaalsContact C-N 3.33Å; N146-E148 PolarHBondContact O-N 3.42Å; E148-R151 PolarHBondContact O-N 3.4Å; E148-R151 IonicContact OE1-CZ 3.68Å; E148-R151 IonicContact OE1-NE 3.6Å; E148-R151 IonicContact OE1-NH2 2.76Å; E148-R151 PolarHBondContact OE1-NH2 3.34Å; E148-R151 IonicContact OE2-CZ 2.68Å; E148-R151 IonicContact OE2-NE 3.43Å; E148-R151 PolarHBondContact OE2-NE 3.46Å; E148-R151 IonicContact OE2-NH2 3.8Å; E148-R151 PolarHBondContact OE2-NH2 3.43Å; E148-R152 WeakPolarHBondContact O-CG 3.46Å; E148-R152 PolarHBondContact O-N 3.23Å; E148-R152 WeakPolarHBondContact OE1-CG 3.47Å; E148-R152 IonicContact OE1-CZ 3.68Å; E148-R152 IonicContact OE1-NE 2.71Å; E148-R152 IonicContact OE1-NH1 3.28Å; E148-R152 PolarHBondContact OE1-NH1 2.74Å
149N97.7Very high97.2Very high69 Ų6993.1 Ų93.137%0.36947%0.47SS..Hα-helixtrans-61.8-44.8174-71.9-26.8000112S145 N146 R151 R152 S153S145-N149 WeakPolarHBondContact O-CB 3.43Å; S145-N149 VanDerWaalsContact O-CG 3.22Å; S145-N149 PolarHBondContact O-N 3.3Å; S145-N149 PolarHBondContact O-ND2 3.38Å; N146-N149 PolarHBondContact O-N 2.92Å; N149-R151 PolarHBondContact O-N 2.89Å; N149-R152 PolarHBondContact O-N 2.71Å; N149-R152 PolarHBondContact OD1-NH2 3.46Å; N149-S153 WeakPolarHBondContact O-CB 3.48Å; N149-S153 PolarHBondContact O-N 3.41Å
150N97.8Very high97Very high115 Ų11592.3 Ų92.362%0.61547%0.466SS*.Hα-helixtrans-62.4-43176.4-71.7-18.8000111.6N146 K147 S153 H154N146-N150 WeakPolarHBondContact O-CB 3.42Å; N146-N150 VanDerWaalsContact O-CG 3.26Å; N146-N150 PolarHBondContact O-N 3Å; N146-N150 PolarHBondContact O-ND2 3.36Å; K147-N150 PolarHBondContact O-N 3.5Å; N150-S153 PolarHBondContact O-N 3Å; N150-H154 WeakPolarHBondContact O-CB 3.47Å; N150-H154 PolarHBondContact O-N 2.9Å
151R98.1Very high96.7Very high125 Ų12593.5 Ų93.547%0.47247%0.47SS..Hα-helixtrans-59.4-47.3175-171.2-166.569.980.34.4111.3K147 E148 N149 H154 L155K147-R151 WeakPolarHBondContact O-CB 3.46Å; K147-R151 PolarHBondContact O-N 2.92Å; E148-R151 PolarHBondContact O-N 3.4Å; E148-R151 IonicContact OE1-CZ 3.68Å; E148-R151 IonicContact OE1-NE 3.6Å; E148-R151 IonicContact OE1-NH2 2.76Å; E148-R151 PolarHBondContact OE1-NH2 3.34Å; E148-R151 IonicContact OE2-CZ 2.68Å; E148-R151 IonicContact OE2-NE 3.43Å; E148-R151 PolarHBondContact OE2-NE 3.46Å; E148-R151 IonicContact OE2-NH2 3.8Å; E148-R151 PolarHBondContact OE2-NH2 3.43Å; N149-R151 PolarHBondContact O-N 2.89Å; R151-H154 PolarHBondContact O-N 3.29Å; R151-L155 HydrophobicContact CG-CD1 4.43Å; R151-L155 WeakPolarHBondContact O-CG 3.4Å; R151-L155 PolarHBondContact O-N 2.88Å
152R97.9Very high96.2Very high115 Ų11592.9 Ų92.943%0.43447%0.473SS..Hα-helixtrans-60-45.3176.6-76.2-169.6-77.1-129.37.6111.9E148 N149 L155 Q156E148-R152 WeakPolarHBondContact O-CG 3.46Å; E148-R152 PolarHBondContact O-N 3.23Å; E148-R152 WeakPolarHBondContact OE1-CG 3.47Å; E148-R152 IonicContact OE1-CZ 3.68Å; E148-R152 IonicContact OE1-NE 2.71Å; E148-R152 IonicContact OE1-NH1 3.28Å; E148-R152 PolarHBondContact OE1-NH1 2.74Å; N149-R152 PolarHBondContact O-N 2.71Å; N149-R152 PolarHBondContact OD1-NH2 3.46Å; R152-L155 PolarHBondContact O-N 2.9Å; R152-Q156 WeakPolarHBondContact O-CB 3.31Å; R152-Q156 WeakPolarHBondContact O-CG 3.35Å; R152-Q156 PolarHBondContact O-N 3.44Å
153S97.8Very high95.7Very high72 Ų7295.8 Ų95.850%0.50348%0.484SS..Hα-helixtrans-62.4-44.1177.9-179.40000112.1N149 N150 Q156 N157N149-S153 WeakPolarHBondContact O-CB 3.48Å; N149-S153 PolarHBondContact O-N 3.41Å; N150-S153 PolarHBondContact O-N 3Å; S153-Q156 PolarHBondContact O-N 3.21Å; S153-N157 PolarHBondContact O-N 3.49Å
154H97.5Very high94.9Very high121 Ų12197.9 Ų97.956%0.5649%0.494SS*.Hα-helixtrans-62.6-45.1177.2-17365.5000112.1N150 R151 Q156 N157 I158N150-H154 WeakPolarHBondContact O-CB 3.47Å; N150-H154 PolarHBondContact O-N 2.9Å; R151-H154 PolarHBondContact O-N 3.29Å; H154-Q156 PolarHBondContact O-N 2.97Å; H154-N157 WeakPolarHBondContact O-CB 3.46Å; H154-N157 PolarHBondContact O-N 3.31Å; H154-I158 WeakPolarHBondContact O-CG1 3.46Å; H154-I158 PolarHBondContact O-N 3.33Å
155L96.7Very high93.5Very high80 Ų80100.1 Ų100.142%0.41950%0.502SS..Hα-helixtrans-63.4-40.6176.1-73.6176000112.3R151 R152 N157 I158 V159R151-L155 HydrophobicContact CG-CD1 4.43Å; R151-L155 WeakPolarHBondContact O-CG 3.4Å; R151-L155 PolarHBondContact O-N 2.88Å; R152-L155 PolarHBondContact O-N 2.9Å; L155-N157 VanDerWaalsContact C-N 3.29Å; L155-N157 PolarHBondContact O-N 2.91Å; L155-I158 PolarHBondContact O-N 2.93Å; L155-V159 VanDerWaalsContact O-CG2 3.31Å; L155-V159 WeakPolarHBondContact O-CG2 3.46Å; L155-V159 PolarHBondContact O-N 3.3Å
156Q96.2Very high91.5Very high141 Ų141101.4 Ų101.466%0.65951%0.509SS*.Hα-helixtrans-60.8-40174.2-78.6178.1-13.600111.8R152 S153 H154 V159 H160R152-Q156 WeakPolarHBondContact O-CB 3.31Å; R152-Q156 WeakPolarHBondContact O-CG 3.35Å; R152-Q156 PolarHBondContact O-N 3.44Å; S153-Q156 PolarHBondContact O-N 3.21Å; H154-Q156 PolarHBondContact O-N 2.97Å; Q156-V159 PolarHBondContact O-N 3.39Å; Q156-H160 WeakPolarHBondContact O-CB 3.38Å; Q156-H160 PolarHBondContact O-N 3.46Å
157N95.7Very high89.6Confident80 Ų80102.8 Ų102.843%0.42852%0.524SS..Hα-helixtrans-64.3-44.3175.9-168.34.7000111.7S153 H154 L155 V159 H160 Q161S153-N157 PolarHBondContact O-N 3.49Å; H154-N157 WeakPolarHBondContact O-CB 3.46Å; H154-N157 PolarHBondContact O-N 3.31Å; L155-N157 VanDerWaalsContact C-N 3.29Å; L155-N157 PolarHBondContact O-N 2.91Å; N157-V159 PolarHBondContact O-N 2.96Å; N157-H160 WeakPolarHBondContact O-CB 3.46Å; N157-H160 PolarHBondContact O-N 3.17Å; N157-Q161 WeakPolarHBondContact O-CG 3.26Å; N157-Q161 PolarHBondContact O-N 3.33Å; N157-Q161 PolarHBondContact OD1-NE2 3.48Å
158I94.5Very high87.4Confident68 Ų68104.6 Ų104.635%0.34953%0.534SS..Hα-helixtrans-59-48.7174.7-67.4167.7000110.7H154 L155 H160 Q161 C162H154-I158 WeakPolarHBondContact O-CG1 3.46Å; H154-I158 PolarHBondContact O-N 3.33Å; L155-I158 PolarHBondContact O-N 2.93Å; I158-H160 VanDerWaalsContact C-N 3.26Å; I158-H160 PolarHBondContact O-N 3.25Å; I158-Q161 PolarHBondContact O-N 3.21Å; I158-Q161 VanDerWaalsContact O-N 3.17Å; I158-C162 PolarHBondContact O-N 3.41Å; I158-C162 PolarHBondContact O-SG 2.96Å; I158-C162 VanDerWaalsContact O-SG 3.39Å
159V94.3Very high85.2Confident81 Ų81109.6 Ų109.649%0.49156%0.562SS.*Hα-helixtrans-56.6-43.8177.3169.20000110.7L155 Q156 N157 C162 Q163L155-V159 VanDerWaalsContact O-CG2 3.31Å; L155-V159 WeakPolarHBondContact O-CG2 3.46Å; L155-V159 PolarHBondContact O-N 3.3Å; Q156-V159 PolarHBondContact O-N 3.39Å; N157-V159 PolarHBondContact O-N 2.96Å; V159-C162 PolarHBondContact O-N 3.15Å; V159-Q163 VanDerWaalsContact O-CG 3.26Å; V159-Q163 WeakPolarHBondContact O-CG 3.09Å; V159-Q163 PolarHBondContact O-N 3.1Å; V159-Q163 VanDerWaalsContact O-N 3.15Å
160H92.6Very high82.9Confident99 Ų99114.9 Ų114.946%0.45858%0.582SS.*Hα-helixtrans-63.6-42.9177.6-174.158.4000112.5Q156 N157 I158 Q163 L164Q156-H160 WeakPolarHBondContact O-CB 3.38Å; Q156-H160 PolarHBondContact O-N 3.46Å; N157-H160 WeakPolarHBondContact O-CB 3.46Å; N157-H160 PolarHBondContact O-N 3.17Å; I158-H160 VanDerWaalsContact C-N 3.26Å; I158-H160 PolarHBondContact O-N 3.25Å; H160-Q163 WeakPolarHBondContact O-CB 3.36Å; H160-Q163 PolarHBondContact O-N 2.89Å; H160-L164 WeakPolarHBondContact NE2-CD1 3.48Å; H160-L164 WeakPolarHBondContact O-CG 3.46Å; H160-L164 PolarHBondContact O-N 3.06Å
161Q90.9Very high80.6Confident106 Ų106120.7 Ų120.750%0.49560%0.596SS.*Hα-helixtrans-62.8-44.7176.6-72.21769.600112.1N157 I158 Q163 L164 E165N157-Q161 WeakPolarHBondContact O-CG 3.26Å; N157-Q161 PolarHBondContact O-N 3.33Å; N157-Q161 PolarHBondContact OD1-NE2 3.48Å; I158-Q161 PolarHBondContact O-N 3.21Å; I158-Q161 VanDerWaalsContact O-N 3.17Å; Q161-Q163 PolarHBondContact O-N 2.91Å; Q161-L164 PolarHBondContact O-N 3.23Å; Q161-L164 VanDerWaalsContact O-N 3.1Å; Q161-E165 PolarHBondContact O-N 3.17Å
162C87.3Confident77.9Confident91 Ų91126 Ų12662%0.61563%0.631SS**Hα-helixtrans-63.8-22.8175.8-66.10000113.4I158 V159I158-C162 PolarHBondContact O-N 3.41Å; I158-C162 PolarHBondContact O-SG 2.96Å; I158-C162 VanDerWaalsContact O-SG 3.39Å; V159-C162 PolarHBondContact O-N 3.15Å
163Q86.4Confident76.9Confident141 Ų141126.6 Ų126.666%0.65964%0.641SS**Hα-helixtrans-83.7-28174.4-71.8169.8-8.900112.7V159 H160 Q161V159-Q163 VanDerWaalsContact O-CG 3.26Å; V159-Q163 WeakPolarHBondContact O-CG 3.09Å; V159-Q163 PolarHBondContact O-N 3.1Å; V159-Q163 VanDerWaalsContact O-N 3.15Å; H160-Q163 WeakPolarHBondContact O-CB 3.36Å; H160-Q163 PolarHBondContact O-N 2.89Å; Q161-Q163 PolarHBondContact O-N 2.91Å
164L82.4Confident75.8Confident115 Ų115129.5 Ų129.560%0.60265%0.648SS**Hα-helixtrans-84.1-31.7179-74.1176.5000113.1H160 Q161 P166H160-L164 WeakPolarHBondContact NE2-CD1 3.48Å; H160-L164 WeakPolarHBondContact O-CG 3.46Å; H160-L164 PolarHBondContact O-N 3.06Å; Q161-L164 PolarHBondContact O-N 3.23Å; Q161-L164 VanDerWaalsContact O-N 3.1Å; L164-P166 WeakPolarHBondContact O-CD 3.41Å; L164-P166 VanDerWaalsContact O-N 3.14Å
165E67.1Low74.6Confident152 Ų152129.9 Ų129.971%0.7165%0.653SS**SBendtrans-66.6104.6168.1-71.5-113.1143.100107.8Q161 C167Q161-E165 PolarHBondContact O-N 3.17Å; E165-C167 PolarHBondContact O-N 3.33Å
166P56.6Low73.3Confident82 Ų82132.9 Ų132.953%0.53267%0.667SS.*  trans-65.6141.7175.5-2.921.2000106.2L164 H168L164-P166 WeakPolarHBondContact O-CD 3.41Å; L164-P166 VanDerWaalsContact O-N 3.14Å; P166-H168 WeakPolarHBondContact CB-CD2 3.5Å; P166-H168 VanDerWaalsContact CG-CD2 3.5Å; P166-H168 WeakPolarHBondContact CG-CD2 3.39Å; P166-H168 PolarHBondContact O-N 2.62Å
167C57.6Low71.9Confident121 Ų121132.4 Ų132.482%0.81867%0.667SS**  trans-6162.2172.7-62.90000112E165 L169E165-C167 PolarHBondContact O-N 3.33Å; C167-L169 PolarHBondContact O-N 3.43Å
168H53.6Low70.3Confident161 Ų161135.9 Ų135.975%0.74568%0.683SS**THydrogen-bonded Turntrans-82.87.8-178.4-86.7-56.7000113.1P166P166-H168 WeakPolarHBondContact CB-CD2 3.5Å; P166-H168 VanDerWaalsContact CG-CD2 3.5Å; P166-H168 WeakPolarHBondContact CG-CD2 3.39Å; P166-H168 PolarHBondContact O-N 2.62Å
169L51.6Low68.6Low166 Ų166140.7 Ų140.787%0.86971%0.707SS**THydrogen-bonded Turntrans-132.314.2-176.4-86.9160.9000115.5C167C167-L169 PolarHBondContact O-N 3.43Å
170F49.3Very low66.6Low180 Ų180145.3 Ų145.379%0.78972%0.724SS**SBendtrans-123.6129.5164.7-96.5-98.3000108
171W47.8Very low64.4Low238 Ų238149.2 Ų149.290%0.90275%0.746SS**  trans9277.6-166.7-5786.8000115.8
172I42.7Very low62Low237 Ų237153.1 Ų153.1100%1.21577%0.769SS**  trans85.20151.2-48.5174.5000117.3

Retrieved 172 of 172 residues in 215.3 ms (Link to these results)