A0A087YF10_POEFO Loading...

Charged multivesicular body protein 4C

AlphaFold DB , UniProt , Accession A0A087YF10, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 235 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
1M38.5Very low41.6Very low240 Ų240151.7 Ų151.7100%1.18283%0.826SS**  095.80-63.8176-177.400106.9
2S40.4Very low41.7Very low98 Ų98149 Ų14969%0.68583%0.826SS**  61.2118.9107.6-1420000111.9
3K44.2Very low41.2Very low182 Ų182145.7 Ų145.779%0.79182%0.82SS**  -164.4130.458.7-74.2165-177.5173.20109.1
4I49.1Very low41.4Very low152 Ų152143.6 Ų143.678%0.77982%0.819SS**  63117.993.7-55.7160.7000111.5
5S39.2Very low41Very low108 Ų108139.3 Ų139.376%0.75582%0.82SS**  -166.7139.776.849.90000115.4
6K48.2Very low40.7Very low199 Ų199137.3 Ų137.387%0.86582%0.815SS**  trans-67142.1166.8-68.9160173.9159.90112.7
7L41.2Very low41Very low159 Ų159135.9 Ų135.983%0.83281%0.814SS**  trans-171.9130.9147-88.5126000103.7
8F41.9Very low40.8Very low192 Ų192134.7 Ų134.784%0.84281%0.813SS**  cis-164.1154.545.9-164-99.6000109.4
9K43.8Very low41.2Very low192 Ų192134.1 Ų134.184%0.83582%0.815SS**  trans-104.7129.6-170.8167.1176.2175.9176.10109.5
10G37.4Very low41Very low73 Ų73132.6 Ų132.675%0.75381%0.811SS**  trans67.1157.6139.800000120.1
11G34.2Very low41.1Very low74 Ų74131.3 Ų131.376%0.76381%0.807SS**  trans11896.5150.200000115.8
12S42.9Very low41.2Very low119 Ų119125.1 Ų125.183%0.83279%0.788SS**  trans-27.3137.4151.951.70000116.5
13S35.2Very low41.4Very low106 Ų106129.7 Ų129.774%0.74180%0.795SS**  -179.3134.912754.20000113.3
14S43.8Very low41.5Very low116 Ų116125.2 Ų125.281%0.81179%0.787SS**  trans41110.3142.5610000120.1
15G35.6Very low41.2Very low80 Ų80126.9 Ų126.983%0.82579%0.789SS**  trans-143.897.9158.800000110.1
16S36.4Very low41.2Very low107 Ų107129.8 Ų129.875%0.74879%0.79SS**  trans-56.7138.7176.947.80000114.4
17S45.6Very low41.2Very low114 Ų114128.4 Ų128.480%0.79779%0.786SS**  trans19111.8141.160.20000118.4
18S37.1Very low41.5Very low114 Ų114131.8 Ų131.880%0.79779%0.788SS**  trans-140.9106.513857.60000109.6S20S18-S20 PolarHBondContact O-N 3.47Å
19S47.3Very low41.9Very low122 Ų122127.8 Ų127.885%0.85378%0.784SS**  trans-60.897.2169.9500000110.1S21S19-S21 PolarHBondContact O-N 3.01Å
20S37.6Very low42.6Very low104 Ų104128.5 Ų128.573%0.72779%0.787SS**  trans-86.690.8158.5600000107.6S18 S22S18-S20 PolarHBondContact O-N 3.47Å; S20-S22 PolarHBondContact O-N 3.48Å
21S43Very low43.7Very low106 Ų106128 Ų12874%0.74178%0.782SS**  trans-61.194.6165.270.80000107.6S19 K23S19-S21 PolarHBondContact O-N 3.01Å; S21-K23 PolarHBondContact O-N 3.33Å
22S42.2Very low45.5Very low110 Ų110127.4 Ų127.477%0.76978%0.776SS**  trans-65.288.5166-63.30000106.5S20 S24S20-S22 PolarHBondContact O-N 3.48Å; S22-S24 PolarHBondContact O-N 3.08Å
23K44.6Very low47.2Very low194 Ų194126.2 Ų126.284%0.84377%0.765SS**  trans-59.693.9173.9-142.9168.4-170.21710105.4S21 K25S21-K23 PolarHBondContact O-N 3.33Å; K23-K25 VanDerWaalsContact C-N 3.27Å; K23-K25 PolarHBondContact O-N 3.23Å
24S44.9Very low49.7Very low89 Ų89123.5 Ų123.562%0.62275%0.746SS**  trans-57.598.9169.453.70000105.8S22 H26S22-S24 PolarHBondContact O-N 3.08Å; S24-H26 PolarHBondContact O-N 3.31Å
25K42.9Very low51.7Low187 Ų187121.1 Ų121.181%0.81373%0.728SS**  trans-58.298.2163.4-78.8-179.7177.4174.10104.9K23 H27K23-K25 VanDerWaalsContact C-N 3.27Å; K23-K25 PolarHBondContact O-N 3.23Å; K25-H27 PolarHBondContact O-N 2.71Å
26H40.4Very low54.2Low168 Ų168123 Ų12378%0.77872%0.715SS**  trans-55.392.2156.6-80.3-54.7000105.7S24 R28S24-H26 PolarHBondContact O-N 3.31Å; H26-R28 PolarHBondContact O-N 3.43Å
27H46.6Very low56.8Low170 Ų170121.9 Ų121.979%0.78770%0.698SS**  trans-55.997.6147.4-86.9-83.1000104K25 S29K25-H27 PolarHBondContact O-N 2.71Å; H27-S29 VanDerWaalsContact C-N 3.29Å; H27-S29 PolarHBondContact O-N 2.94Å
28R48.9Very low59Low230 Ų230117.6 Ų117.687%0.86867%0.67SS**  trans-49.1109.2158.1-71.1175.776.9-164.45103.4H26 K30H26-R28 PolarHBondContact O-N 3.43Å; R28-K30 VanDerWaalsContact C-N 3.26Å; R28-K30 PolarHBondContact O-N 3.01Å
29S50.2Low61.6Low108 Ų108112.9 Ų112.976%0.75564%0.636SS**  trans-52.5105.2163.850.90000104.4H27 G31H27-S29 VanDerWaalsContact C-N 3.29Å; H27-S29 PolarHBondContact O-N 2.94Å; S29-G31 PolarHBondContact O-N 2.54Å
30K57.8Low63.9Low207 Ų207112.3 Ų112.390%0.962%0.619SS**  trans-57.1104.4154.3-78.4-172.1174.3-1760102.2R28R28-K30 VanDerWaalsContact C-N 3.26Å; R28-K30 PolarHBondContact O-N 3.01Å
31G60.7Low66.6Low62 Ų62114 Ų11464%0.63961%0.61SS**PPolyproline II helixtrans-49148175.300000107.8S29S29-G31 PolarHBondContact O-N 2.54Å
32G71.5Confident69.1Low62 Ų62110.2 Ų110.264%0.63958%0.581SS**SBendtrans-49164171.700000111.4S34G32-S34 PolarHBondContact O-N 2.87Å
33P79Confident71.7Confident94 Ų94111.3 Ų111.361%0.6157%0.568SS**PPolyproline II helixtrans-48134.3179.821.8-32.8000109.8
34S87.1Confident74.2Confident49 Ų49107 Ų10734%0.34355%0.551SS.*PPolyproline II helixtrans-64.2152.9179.5710000109.3G32 Q36 E37 A38G32-S34 PolarHBondContact O-N 2.87Å; S34-Q36 PolarHBondContact O-N 3.41Å; S34-E37 PolarHBondContact O-N 3.38Å; S34-E37 WeakPolarHBondContact OG-CB 3.28Å; S34-E37 PolarHBondContact OG-N 2.99Å; S34-A38 PolarHBondContact O-N 2.85Å
35P86.1Confident76.6Confident66 Ų66105.1 Ų105.143%0.42954%0.536SS..Hα-helixtrans-52.1-39.4173.7-28.335.6000112.1A38 I39P35-A38 PolarHBondContact O-N 3.46Å; P35-I39 WeakPolarHBondContact O-CB 3.32Å; P35-I39 WeakPolarHBondContact O-CD1 3.49Å; P35-I39 WeakPolarHBondContact O-CG1 3.47Å; P35-I39 PolarHBondContact O-N 3.49Å
36Q87.7Confident79.1Confident120 Ų12097.7 Ų97.756%0.56150%0.504SS*.Hα-helixtrans-64.1-41.1176.7-66.2168.4-15.800112.8S34 H40 H115S34-Q36 PolarHBondContact O-N 3.41Å; Q36-H40 WeakPolarHBondContact O-CB 3.06Å; Q36-H40 PolarHBondContact O-N 3.39Å; Q36-H115 PolarHBondContact NE2-NE2 3.28Å
37E90.8Very high81.8Confident83 Ų8394.9 Ų94.939%0.38849%0.491SS..Hα-helixtrans-67.3-39175.6-171.3-177171.100111.3S34 H40 R41S34-E37 PolarHBondContact O-N 3.38Å; S34-E37 WeakPolarHBondContact OG-CB 3.28Å; S34-E37 PolarHBondContact OG-N 2.99Å; E37-H40 PolarHBondContact O-N 3.28Å; E37-R41 WeakPolarHBondContact O-CG 3.44Å; E37-R41 PolarHBondContact O-N 3.02Å; E37-R41 VanDerWaalsContact O-N 3.1Å; E37-R41 IonicContact OE1-CZ 3.87Å; E37-R41 IonicContact OE1-NE 3.57Å; E37-R41 PolarHBondContact OE1-NE 3Å; E37-R41 IonicContact OE1-NH2 3.37Å; E37-R41 PolarHBondContact OE1-NH2 3.41Å
38A91.8Very high84.2Confident25 Ų2591.8 Ų91.821%0.20748%0.479CS..Hα-helixtrans-64.3-46.9175.500000111.7S34 P35 H40 R41 L42 L111S34-A38 PolarHBondContact O-N 2.85Å; P35-A38 PolarHBondContact O-N 3.46Å; A38-H40 VanDerWaalsContact C-N 3.33Å; A38-H40 PolarHBondContact O-N 3.47Å; A38-R41 PolarHBondContact O-N 2.98Å; A38-L42 WeakPolarHBondContact O-CG 3.34Å; A38-L42 PolarHBondContact O-N 3.16Å; A38-L111 HydrophobicContact CB-CD1 3.94Å
39I92.8Very high86.4Confident15 Ų1581.6 Ų81.68%0.07744%0.441CS..Hα-helixtrans-57.9-45.9176-69.6160.4000110.6P35 R41 L42 R43 R108 L111 E112P35-I39 WeakPolarHBondContact O-CB 3.32Å; P35-I39 WeakPolarHBondContact O-CD1 3.49Å; P35-I39 WeakPolarHBondContact O-CG1 3.47Å; P35-I39 PolarHBondContact O-N 3.49Å; I39-R41 PolarHBondContact O-N 3.18Å; I39-L42 PolarHBondContact O-N 3.04Å; I39-R43 WeakPolarHBondContact O-CG 3.42Å; I39-R43 PolarHBondContact O-N 3.44Å; I39-R108 HydrophobicContact CG2-CG 4.33Å; I39-L111 HydrophobicContact CD1-CB 4.31Å; I39-L111 HydrophobicContact CG1-CB 3.9Å; I39-E112 HydrophobicContact CD1-CG 3.71Å; I39-E112 HydrophobicContact CG1-CG 4.01Å; I39-E112 HydrophobicContact CG2-CG 4.09Å; I39-E112 WeakPolarHBondContact CG2-OE1 3.27Å
40H94.7Very high88.6Confident109 Ų10978.9 Ų78.951%0.50542%0.42SS..Hα-helixtrans-58.5-48.1177.8-174.9-85.1000112.1Q36 E37 A38 L42 R43 E44Q36-H40 WeakPolarHBondContact O-CB 3.06Å; Q36-H40 PolarHBondContact O-N 3.39Å; E37-H40 PolarHBondContact O-N 3.28Å; A38-H40 VanDerWaalsContact C-N 3.33Å; A38-H40 PolarHBondContact O-N 3.47Å; H40-L42 VanDerWaalsContact C-N 3.32Å; H40-L42 PolarHBondContact O-N 3.41Å; H40-R43 PolarHBondContact O-N 3.39Å; H40-E44 IonicContact CE1-OE1 2.74Å; H40-E44 PolarHBondContact CE1-OE1 3.42Å; H40-E44 IonicContact CE1-OE2 3.49Å; H40-E44 IonicContact ND1-OE1 3.53Å; H40-E44 IonicContact ND1-OE2 2.98Å; H40-E44 PolarHBondContact ND1-OE2 3.17Å; H40-E44 WeakPolarHBondContact O-CG 3.38Å; H40-E44 PolarHBondContact O-N 3.47Å
41R94.7Very high90.5Very high140 Ų14074.7 Ų74.753%0.52840%0.402SS..Hα-helixtrans-64.8-35.3179.1-70.8179.5-175.2-147.46.3112.9E37 A38 I39 E44 T45E37-R41 WeakPolarHBondContact O-CG 3.44Å; E37-R41 PolarHBondContact O-N 3.02Å; E37-R41 VanDerWaalsContact O-N 3.1Å; E37-R41 IonicContact OE1-CZ 3.87Å; E37-R41 IonicContact OE1-NE 3.57Å; E37-R41 PolarHBondContact OE1-NE 3Å; E37-R41 IonicContact OE1-NH2 3.37Å; E37-R41 PolarHBondContact OE1-NH2 3.41Å; A38-R41 PolarHBondContact O-N 2.98Å; I39-R41 PolarHBondContact O-N 3.18Å; R41-E44 PolarHBondContact O-N 3.23Å; R41-T45 WeakPolarHBondContact O-CB 3.37Å; R41-T45 PolarHBondContact O-N 3.15Å; R41-T45 PolarHBondContact O-OG1 2.86Å
42L95.8Very high92.1Very high27 Ų2776.9 Ų76.914%0.14139%0.394CS..Hα-helixtrans-64.3-45175-71.7168.9000110.6A38 I39 H40 E44 T45 E46 I104 Q107 R108 L111A38-L42 WeakPolarHBondContact O-CG 3.34Å; A38-L42 PolarHBondContact O-N 3.16Å; I39-L42 PolarHBondContact O-N 3.04Å; H40-L42 VanDerWaalsContact C-N 3.32Å; H40-L42 PolarHBondContact O-N 3.41Å; L42-E44 PolarHBondContact O-N 3.29Å; L42-T45 WeakPolarHBondContact O-CB 3.5Å; L42-T45 PolarHBondContact O-N 3.07Å; L42-T45 VanDerWaalsContact O-N 3.12Å; L42-E46 WeakPolarHBondContact O-CB 3.45Å; L42-E46 PolarHBondContact O-N 2.92Å; L42-I104 HydrophobicContact CB-CG2 4.28Å; L42-I104 HydrophobicContact CD2-CG2 3.99Å; L42-Q107 HydrophobicContact CD1-CB 4.41Å; L42-R108 HydrophobicContact CB-CB 4.19Å; L42-R108 HydrophobicContact CB-CG 4.43Å; L42-R108 HydrophobicContact CD1-CB 4.09Å; L42-L111 HydrophobicContact CD1-CD1 3.67Å
43R96.1Very high93.3Very high132 Ų13275.9 Ų75.950%0.49837%0.373SS..Hα-helixtrans-61.1-42.3175.2-69177.2-178.7-162.7-1.4113I39 H40 T45 E46 E47 R108 E112I39-R43 WeakPolarHBondContact O-CG 3.42Å; I39-R43 PolarHBondContact O-N 3.44Å; H40-R43 PolarHBondContact O-N 3.39Å; R43-T45 VanDerWaalsContact C-N 3.28Å; R43-T45 PolarHBondContact O-N 3.31Å; R43-E46 PolarHBondContact O-N 3.12Å; R43-E47 PolarHBondContact O-N 2.99Å; R43-R108 HydrophobicContact CG-CG 4.49Å; R43-E112 IonicContact CZ-OE1 3.44Å; R43-E112 IonicContact NE-OE1 3.79Å; R43-E112 PolarHBondContact NE-OE1 3.23Å; R43-E112 IonicContact NH2-OE1 3.61Å; R43-E112 PolarHBondContact NH2-OE1 3.34Å
44E97.1Very high94.2Very high103 Ų10375.6 Ų75.648%0.48136%0.363SS..Hα-helixtrans-62-37.8174.4-71.8178.2138.200112H40 R41 L42 M48H40-E44 IonicContact CE1-OE1 2.74Å; H40-E44 PolarHBondContact CE1-OE1 3.42Å; H40-E44 IonicContact CE1-OE2 3.49Å; H40-E44 IonicContact ND1-OE1 3.53Å; H40-E44 IonicContact ND1-OE2 2.98Å; H40-E44 PolarHBondContact ND1-OE2 3.17Å; H40-E44 WeakPolarHBondContact O-CG 3.38Å; H40-E44 PolarHBondContact O-N 3.47Å; R41-E44 PolarHBondContact O-N 3.23Å; L42-E44 PolarHBondContact O-N 3.29Å; E44-M48 WeakPolarHBondContact O-CB 3.4Å; E44-M48 PolarHBondContact O-N 3.25Å; E44-M48 VanDerWaalsContact O-N 3.14Å
45T95Very high94.7Very high50 Ų5079.4 Ų79.431%0.30737%0.371SS..Hα-helixtrans-71.1-41.9179.4-54.50000111.1R41 L42 R43 M48 L49 I104R41-T45 WeakPolarHBondContact O-CB 3.37Å; R41-T45 PolarHBondContact O-N 3.15Å; R41-T45 PolarHBondContact O-OG1 2.86Å; L42-T45 WeakPolarHBondContact O-CB 3.5Å; L42-T45 PolarHBondContact O-N 3.07Å; L42-T45 VanDerWaalsContact O-N 3.12Å; R43-T45 VanDerWaalsContact C-N 3.28Å; R43-T45 PolarHBondContact O-N 3.31Å; T45-M48 HydrophobicContact CG2-CE 4.13Å; T45-M48 PolarHBondContact O-N 2.91Å; T45-L49 HydrophobicContact CG2-CD1 4.24Å; T45-L49 HydrophobicContact CG2-CG 4.5Å; T45-L49 WeakPolarHBondContact O-CG 3.38Å; T45-L49 PolarHBondContact O-N 2.89Å; T45-I104 HydrophobicContact CG2-CD1 3.68Å
46E96.2Very high95.1Very high31 Ų3176.7 Ų76.715%0.14535%0.353CS..Hα-helixtrans-57.2-52.5173.2-175.7-174.5167.500110.9L42 R43 M48 L49 T50 L101 I104 E105 R108L42-E46 WeakPolarHBondContact O-CB 3.45Å; L42-E46 PolarHBondContact O-N 2.92Å; R43-E46 PolarHBondContact O-N 3.12Å; E46-M48 VanDerWaalsContact C-N 3.25Å; E46-M48 PolarHBondContact O-N 3.16Å; E46-L49 CarbonylContact O-C 3.55Å; E46-L49 PolarHBondContact O-N 3.01Å; E46-T50 PolarHBondContact O-N 3.16Å; E46-T50 PolarHBondContact O-OG1 3.37Å; E46-L101 HydrophobicContact CB-CD1 4.42Å; E46-L101 HydrophobicContact CG-CD1 3.91Å; E46-I104 HydrophobicContact CB-CG2 4.33Å; E46-E105 HydrophobicContact CG-CG 4.46Å; E46-R108 IonicContact OE1-CZ 3.37Å; E46-R108 IonicContact OE1-NH1 2.63Å; E46-R108 PolarHBondContact OE1-NH1 2.89Å; E46-R108 IonicContact OE2-CZ 3.75Å; E46-R108 IonicContact OE2-NH1 2.77Å; E46-R108 PolarHBondContact OE2-NH1 2.77Å
47E97.1Very high95.6Very high109 Ų10974.4 Ų74.451%0.50934%0.342SS..Hα-helixtrans-57.7-39.4178.1-168.2-169.9165.300112.1R43 K51R43-E47 PolarHBondContact O-N 2.99Å; E47-K51 WeakPolarHBondContact O-CG 3.48Å; E47-K51 PolarHBondContact O-N 3.19Å; E47-K51 VanDerWaalsContact OE1-CE 3.29Å; E47-K51 WeakPolarHBondContact OE1-CE 3.28Å; E47-K51 IonicContact OE1-NZ 3.11Å; E47-K51 PolarHBondContact OE1-NZ 3.22Å
48M96.4Very high95.9Very high106 Ų10676 Ų7652%0.52235%0.347SS..Hα-helixtrans-66.3-40.7176178.8-107.4-62.800112.4E44 T45 E46 K52E44-M48 WeakPolarHBondContact O-CB 3.4Å; E44-M48 PolarHBondContact O-N 3.25Å; E44-M48 VanDerWaalsContact O-N 3.14Å; T45-M48 HydrophobicContact CG2-CE 4.13Å; T45-M48 PolarHBondContact O-N 2.91Å; E46-M48 VanDerWaalsContact C-N 3.25Å; E46-M48 PolarHBondContact O-N 3.16Å; M48-K52 WeakPolarHBondContact O-CB 3.38Å; M48-K52 PolarHBondContact O-N 3.03Å; M48-K52 VanDerWaalsContact O-N 3.12Å
49L95.7Very high96.1Very high16 Ų1679 Ų798%0.08435%0.353CS..Hα-helixtrans-69.6-41.3177.1-72.1175.8000111.8T45 E46 K51 K52 Q53 I97 T100 L101 I104T45-L49 HydrophobicContact CG2-CD1 4.24Å; T45-L49 HydrophobicContact CG2-CG 4.5Å; T45-L49 WeakPolarHBondContact O-CG 3.38Å; T45-L49 PolarHBondContact O-N 2.89Å; E46-L49 CarbonylContact O-C 3.55Å; E46-L49 PolarHBondContact O-N 3.01Å; L49-K51 PolarHBondContact O-N 3.28Å; L49-K52 CarbonylContact O-C 3.55Å; L49-K52 WeakPolarHBondContact O-CA 3.32Å; L49-K52 WeakPolarHBondContact O-CB 3.48Å; L49-K52 PolarHBondContact O-N 2.84Å; L49-K52 VanDerWaalsContact O-N 3.08Å; L49-Q53 PolarHBondContact O-N 3.4Å; L49-I97 HydrophobicContact CB-CG2 4.32Å; L49-I97 HydrophobicContact CD2-CG2 4.38Å; L49-T100 HydrophobicContact CD1-CG2 3.99Å; L49-L101 HydrophobicContact CB-CD1 3.64Å; L49-L101 HydrophobicContact CD1-CD1 4.31Å; L49-I104 HydrophobicContact CD1-CD1 3.44Å; L49-I104 VanDerWaalsContact CD1-CD1 3.44Å
50T96.7Very high96.3Very high51 Ų5179.2 Ų79.231%0.31336%0.355SS..Hα-helixtrans-59.4-47.2174.3-51.60000111.2E46 K52 Q53 E54E46-T50 PolarHBondContact O-N 3.16Å; E46-T50 PolarHBondContact O-OG1 3.37Å; T50-K52 PolarHBondContact O-N 3.38Å; T50-Q53 WeakPolarHBondContact O-CB 3.47Å; T50-Q53 PolarHBondContact O-N 2.91Å; T50-Q53 VanDerWaalsContact O-N 3.12Å; T50-E54 PolarHBondContact O-N 2.86Å
51K97.7Very high96.4Very high118 Ų11880.4 Ų80.451%0.51336%0.361SS..Hα-helixtrans-59.4-35.9174.7-74172.8-174.41660112.4E47 L49 Y55E47-K51 WeakPolarHBondContact O-CG 3.48Å; E47-K51 PolarHBondContact O-N 3.19Å; E47-K51 VanDerWaalsContact OE1-CE 3.29Å; E47-K51 WeakPolarHBondContact OE1-CE 3.28Å; E47-K51 IonicContact OE1-NZ 3.11Å; E47-K51 PolarHBondContact OE1-NZ 3.22Å; L49-K51 PolarHBondContact O-N 3.28Å; K51-Y55 WeakPolarHBondContact O-CB 3.47Å; K51-Y55 PolarHBondContact O-N 2.82Å; K51-Y55 VanDerWaalsContact O-N 3.17Å
52K94.9Very high96.4Very high108 Ų10879.6 Ų79.647%0.4736%0.363SS..Hα-helixtrans-71.5-38.1177.4-169-179.7173.2-168.70111.6M48 L49 T50 Y55 L56 I97M48-K52 WeakPolarHBondContact O-CB 3.38Å; M48-K52 PolarHBondContact O-N 3.03Å; M48-K52 VanDerWaalsContact O-N 3.12Å; L49-K52 CarbonylContact O-C 3.55Å; L49-K52 WeakPolarHBondContact O-CA 3.32Å; L49-K52 WeakPolarHBondContact O-CB 3.48Å; L49-K52 PolarHBondContact O-N 2.84Å; L49-K52 VanDerWaalsContact O-N 3.08Å; T50-K52 PolarHBondContact O-N 3.38Å; K52-Y55 PolarHBondContact O-N 3.43Å; K52-L56 WeakPolarHBondContact O-CG 3.4Å; K52-L56 PolarHBondContact O-N 2.88Å; K52-I97 HydrophobicContact CB-CD1 4.24Å; K52-I97 HydrophobicContact CD-CD1 3.55Å; K52-I97 HydrophobicContact CD-CG1 4.49Å; K52-I97 HydrophobicContact CG-CD1 3.66Å
53Q96.7Very high96.2Very high42 Ų4279.1 Ų79.120%0.19636%0.36CS..Hα-helixtrans-58.5-55173.3-170.9-171.1-27.800110.3L49 T50 Y55 L56 E57 L94 I97L49-Q53 PolarHBondContact O-N 3.4Å; T50-Q53 WeakPolarHBondContact O-CB 3.47Å; T50-Q53 PolarHBondContact O-N 2.91Å; T50-Q53 VanDerWaalsContact O-N 3.12Å; Q53-Y55 PolarHBondContact O-N 3.28Å; Q53-L56 WeakPolarHBondContact O-CB 3.31Å; Q53-L56 PolarHBondContact O-N 3.08Å; Q53-E57 PolarHBondContact NE2-OE1 3.39Å; Q53-E57 WeakPolarHBondContact O-CG 3.37Å; Q53-E57 PolarHBondContact O-N 3.1Å; Q53-L94 HydrophobicContact CB-CD1 4.27Å; Q53-L94 HydrophobicContact CG-CD1 3.44Å; Q53-L94 VanDerWaalsContact CG-CD1 3.44Å; Q53-L94 HydrophobicContact CG-CG 4.5Å; Q53-I97 HydrophobicContact CB-CG2 4.21Å
54E97.2Very high96Very high88 Ų8874.8 Ų74.841%0.41135%0.348SS..Hα-helixtrans-55.8-39.2177.6-70.5-177.9-157.300112.7T50 K58T50-E54 PolarHBondContact O-N 2.86Å; E54-K58 WeakPolarHBondContact O-CB 3.31Å; E54-K58 WeakPolarHBondContact O-CG 3.42Å; E54-K58 PolarHBondContact O-N 3.46Å; E54-K58 IonicContact OE2-NZ 2.69Å
55Y97.1Very high95.8Very high129 Ų12972.5 Ų72.551%0.50635%0.346SS..Hα-helixtrans-64.3-43.2176.6171.3-97.3000111.9K51 K52 Q53 R59K51-Y55 WeakPolarHBondContact O-CB 3.47Å; K51-Y55 PolarHBondContact O-N 2.82Å; K51-Y55 VanDerWaalsContact O-N 3.17Å; K52-Y55 PolarHBondContact O-N 3.43Å; Q53-Y55 PolarHBondContact O-N 3.28Å; Y55-R59 HydrophobicContact CE1-CG 4.22Å; Y55-R59 HydrophobicContact CE2-CG 4.34Å; Y55-R59 VanDerWaalsContact CZ-CD 3.43Å; Y55-R59 WeakPolarHBondContact O-CG 3.42Å; Y55-R59 PolarHBondContact O-N 3.31Å; Y55-R59 WeakPolarHBondContact OH-CD 3.18Å; Y55-R59 PolarHBondContact OH-NH1 3.13Å
56L96Very high95.4Very high8 Ų872.8 Ų72.84%0.04235%0.348CS..Hα-helixtrans-66.2-41.7177.6-72.3-177.7000111.6K52 Q53 R59 I60 L90 Q93 L94 I97K52-L56 WeakPolarHBondContact O-CG 3.4Å; K52-L56 PolarHBondContact O-N 2.88Å; Q53-L56 WeakPolarHBondContact O-CB 3.31Å; Q53-L56 PolarHBondContact O-N 3.08Å; L56-R59 WeakPolarHBondContact O-CB 3.43Å; L56-R59 PolarHBondContact O-N 3.01Å; L56-I60 VanDerWaalsContact O-CG1 3.31Å; L56-I60 WeakPolarHBondContact O-CG1 3.41Å; L56-I60 PolarHBondContact O-N 3.21Å; L56-L90 HydrophobicContact CD2-CD2 3.72Å; L56-Q93 HydrophobicContact CD1-CB 3.87Å; L56-L94 HydrophobicContact CB-CD1 3.95Å; L56-L94 HydrophobicContact CD1-CD1 4.38Å; L56-I97 HydrophobicContact CD1-CD1 3.49Å; L56-I97 VanDerWaalsContact CD1-CD1 3.49Å
57E96.9Very high95Very high73 Ų7371.9 Ų71.934%0.34135%0.346SS..Hα-helixtrans-58.1-51.6175.4-71.1169.7177.100111.2Q53 R59 I60 E61 L94Q53-E57 PolarHBondContact NE2-OE1 3.39Å; Q53-E57 WeakPolarHBondContact O-CG 3.37Å; Q53-E57 PolarHBondContact O-N 3.1Å; E57-R59 PolarHBondContact O-N 3.17Å; E57-I60 WeakPolarHBondContact O-CB 3.36Å; E57-I60 PolarHBondContact O-N 2.98Å; E57-E61 PolarHBondContact O-N 3.46Å; E57-L94 HydrophobicContact CG-CD1 3.9Å; E57-L94 HydrophobicContact CG-CD2 3.97Å
58K97.9Very high94.6Very high115 Ų11574 Ų7450%0.535%0.354SS..Hα-helixtrans-56.7-38175-74.6167.5-177.6153.50112.2E54 Q62E54-K58 WeakPolarHBondContact O-CB 3.31Å; E54-K58 WeakPolarHBondContact O-CG 3.42Å; E54-K58 PolarHBondContact O-N 3.46Å; E54-K58 IonicContact OE2-NZ 2.69Å; K58-Q62 WeakPolarHBondContact O-CG 3.41Å; K58-Q62 PolarHBondContact O-N 3.23Å
59R96.3Very high94.1Very high88 Ų8875.8 Ų75.833%0.33236%0.359SS..Hα-helixtrans-70.5-37.3175.6-77.4-162.570.7166.24.6113.1Y55 L56 E57 E61 Q62 E63 L90Y55-R59 HydrophobicContact CE1-CG 4.22Å; Y55-R59 HydrophobicContact CE2-CG 4.34Å; Y55-R59 VanDerWaalsContact CZ-CD 3.43Å; Y55-R59 WeakPolarHBondContact O-CG 3.42Å; Y55-R59 PolarHBondContact O-N 3.31Å; Y55-R59 WeakPolarHBondContact OH-CD 3.18Å; Y55-R59 PolarHBondContact OH-NH1 3.13Å; L56-R59 WeakPolarHBondContact O-CB 3.43Å; L56-R59 PolarHBondContact O-N 3.01Å; E57-R59 PolarHBondContact O-N 3.17Å; R59-E61 VanDerWaalsContact C-N 3.32Å; R59-Q62 PolarHBondContact O-N 3.09Å; R59-E63 WeakPolarHBondContact O-CG 3.41Å; R59-E63 PolarHBondContact O-N 3.16Å; R59-L90 HydrophobicContact CB-CD1 3.92Å
60I95.9Very high93.3Very high21 Ų2177 Ų7711%0.10836%0.364CS..Hα-helixtrans-60.5-46.1174.9-74.2161.3000109.4L56 E57 Q62 E63 V64 K87 L90 E91 L94L56-I60 VanDerWaalsContact O-CG1 3.31Å; L56-I60 WeakPolarHBondContact O-CG1 3.41Å; L56-I60 PolarHBondContact O-N 3.21Å; E57-I60 WeakPolarHBondContact O-CB 3.36Å; E57-I60 PolarHBondContact O-N 2.98Å; I60-Q62 VanDerWaalsContact C-N 3.33Å; I60-Q62 PolarHBondContact O-N 3.46Å; I60-E63 PolarHBondContact O-N 3.17Å; I60-V64 HydrophobicContact CG2-CG2 4.42Å; I60-V64 VanDerWaalsContact O-CG2 3.32Å; I60-V64 WeakPolarHBondContact O-CG2 3.39Å; I60-V64 PolarHBondContact O-N 3.08Å; I60-K87 HydrophobicContact CG2-CG 4.22Å; I60-L90 HydrophobicContact CD1-CB 4.06Å; I60-L90 HydrophobicContact CG1-CB 3.57Å; I60-L90 HydrophobicContact CG1-CD1 4.24Å; I60-E91 HydrophobicContact CD1-CG 3.82Å; I60-E91 HydrophobicContact CG1-CG 4.28Å; I60-L94 HydrophobicContact CD1-CD2 4.09Å
61E96.4Very high92.1Very high134 Ų13477.3 Ų77.363%0.62638%0.377SS*.Hα-helixtrans-57.6-43.4176-69.7-179.617100112.6E57 R59 V64 A65E57-E61 PolarHBondContact O-N 3.46Å; R59-E61 VanDerWaalsContact C-N 3.32Å; E61-V64 WeakPolarHBondContact O-CB 3.46Å; E61-V64 PolarHBondContact O-N 3.4Å; E61-A65 WeakPolarHBondContact O-CB 3.41Å; E61-A65 PolarHBondContact O-N 3.47Å
62Q94.9Very high90.7Very high122 Ų12277.1 Ų77.157%0.5739%0.386SS*.Hα-helixtrans-62.6-42.3176.3-71.1172.36.100112.6K58 R59 I60 V64 A65 T66K58-Q62 WeakPolarHBondContact O-CG 3.41Å; K58-Q62 PolarHBondContact O-N 3.23Å; R59-Q62 PolarHBondContact O-N 3.09Å; I60-Q62 VanDerWaalsContact C-N 3.33Å; I60-Q62 PolarHBondContact O-N 3.46Å; Q62-V64 VanDerWaalsContact C-N 3.34Å; Q62-A65 PolarHBondContact O-N 2.99Å; Q62-T66 WeakPolarHBondContact O-CB 3.33Å; Q62-T66 PolarHBondContact O-N 2.88Å; Q62-T66 PolarHBondContact O-OG1 3.06Å
63E90.9Very high89.2Confident18 Ų1877.9 Ų77.98%0.08439%0.389CS..Hα-helixtrans-68-35.7176.7-66.5-69174.200111.1R59 I60 T66 A67 A83 R86 K87 L90R59-E63 WeakPolarHBondContact O-CG 3.41Å; R59-E63 PolarHBondContact O-N 3.16Å; I60-E63 PolarHBondContact O-N 3.17Å; E63-T66 PolarHBondContact O-N 3Å; E63-A67 WeakPolarHBondContact O-CB 3.43Å; E63-A67 PolarHBondContact O-N 2.81Å; E63-A83 WeakPolarHBondContact OE2-CA 3.49Å; E63-R86 HydrophobicContact CG-CB 4.27Å; E63-R86 WeakPolarHBondContact OE1-CD 3.42Å; E63-K87 HydrophobicContact CB-CB 4.19Å; E63-L90 HydrophobicContact CG-CD1 4.09Å
64V93.4Very high87.2Confident40 Ų4084.2 Ų84.224%0.24242%0.424CS..Hα-helixtrans-62.8-47.6172171.20000110.9I60 E61 Q62 T66 A67 K68 K87I60-V64 HydrophobicContact CG2-CG2 4.42Å; I60-V64 VanDerWaalsContact O-CG2 3.32Å; I60-V64 WeakPolarHBondContact O-CG2 3.39Å; I60-V64 PolarHBondContact O-N 3.08Å; E61-V64 WeakPolarHBondContact O-CB 3.46Å; E61-V64 PolarHBondContact O-N 3.4Å; Q62-V64 VanDerWaalsContact C-N 3.34Å; V64-T66 VanDerWaalsContact C-N 3.3Å; V64-T66 PolarHBondContact O-N 3.16Å; V64-A67 PolarHBondContact O-N 3.33Å; V64-K68 HydrophobicContact CG1-CD 4.16Å; V64-K68 WeakPolarHBondContact O-CG 3.47Å; V64-K68 PolarHBondContact O-N 3.02Å; V64-K87 HydrophobicContact CG2-CD 3.61Å
65A92.1Very high85.2Confident55 Ų5589.8 Ų89.846%0.45545%0.447SS..Hα-helixtrans-60.7-41.2177.100000111.5E61 Q62 K68 K69E61-A65 WeakPolarHBondContact O-CB 3.41Å; E61-A65 PolarHBondContact O-N 3.47Å; Q62-A65 PolarHBondContact O-N 2.99Å; A65-K68 PolarHBondContact O-N 2.85Å; A65-K69 WeakPolarHBondContact O-CB 3.47Å; A65-K69 PolarHBondContact O-N 2.93Å
66T87.9Confident83.2Confident56 Ų5688.5 Ų88.534%0.34444%0.441SS..Hα-helixtrans-63.6-45.9175.3-580000111.3Q62 E63 V64 K68 K69 H70 A83Q62-T66 WeakPolarHBondContact O-CB 3.33Å; Q62-T66 PolarHBondContact O-N 2.88Å; Q62-T66 PolarHBondContact O-OG1 3.06Å; E63-T66 PolarHBondContact O-N 3Å; V64-T66 VanDerWaalsContact C-N 3.3Å; V64-T66 PolarHBondContact O-N 3.16Å; T66-K68 PolarHBondContact O-N 3.23Å; T66-K69 PolarHBondContact O-N 3.18Å; T66-H70 WeakPolarHBondContact O-CB 3.47Å; T66-H70 PolarHBondContact O-CD2 2.85Å; T66-H70 PolarHBondContact O-N 3.32Å; T66-A83 HydrophobicContact CG2-CB 4.25Å
67A87.9Confident81.6Confident13 Ų1390.9 Ų90.911%0.10747%0.468CS..Hα-helixtrans-59.1-45.5175.800000111.6E63 V64 H70 G71 A83 L84E63-A67 WeakPolarHBondContact O-CB 3.43Å; E63-A67 PolarHBondContact O-N 2.81Å; V64-A67 PolarHBondContact O-N 3.33Å; A67-H70 PolarHBondContact O-N 3.13Å; A67-G71 PolarHBondContact O-N 2.89Å; A67-A83 HydrophobicContact CB-CB 4.09Å; A67-L84 HydrophobicContact CB-CD2 4Å; A67-L84 HydrophobicContact CB-CG 4.13Å
68K87.3Confident80.7Confident152 Ų15292.5 Ų92.566%0.66148%0.483SS*.Hα-helixtrans-60.4-46.7176.2-72.6176.4179178.50112V64 A65 T66 H70 G71V64-K68 HydrophobicContact CG1-CD 4.16Å; V64-K68 WeakPolarHBondContact O-CG 3.47Å; V64-K68 PolarHBondContact O-N 3.02Å; A65-K68 PolarHBondContact O-N 2.85Å; T66-K68 PolarHBondContact O-N 3.23Å; K68-H70 VanDerWaalsContact C-N 3.32Å; K68-H70 PolarHBondContact O-N 2.97Å; K68-G71 PolarHBondContact O-N 3.23Å
69K86.1Confident79.8Confident144 Ų14488.6 Ų88.663%0.62647%0.472SS*.Hα-helixtrans-63.6-34.5180-175.5176.5-177.6175.10113.2A65 T66 T72A65-K69 WeakPolarHBondContact O-CB 3.47Å; A65-K69 PolarHBondContact O-N 2.93Å; T66-K69 PolarHBondContact O-N 3.18Å; K69-T72 PolarHBondContact O-OG1 3.03Å
70H79.9Confident79.1Confident43 Ų4385 Ų8520%0.19946%0.461CS..Hα-helixtrans-90.7-21.8-179.1-73.8-98.8000113.2T66 A67 K68 R76 A79 A80T66-H70 WeakPolarHBondContact O-CB 3.47Å; T66-H70 PolarHBondContact O-CD2 2.85Å; T66-H70 PolarHBondContact O-N 3.32Å; A67-H70 PolarHBondContact O-N 3.13Å; K68-H70 VanDerWaalsContact C-N 3.32Å; K68-H70 PolarHBondContact O-N 2.97Å; H70-R76 VanDerWaalsContact O-CB 3.28Å; H70-R76 WeakPolarHBondContact O-CB 3.44Å; H70-A79 HydrophobicContact CB-CB 4.38Å; H70-A80 HydrophobicContact CB-CB 4.24Å
71G70.3Confident78.6Confident56 Ų5688.3 Ų88.358%0.57748%0.479SS*.Hα-helixtrans-71.2-28176.700000114.6A67 K68 K73A67-G71 PolarHBondContact O-N 2.89Å; K68-G71 PolarHBondContact O-N 3.23Å; G71-K73 VanDerWaalsContact C-N 3.35Å; G71-K73 PolarHBondContact O-N 2.74Å
72T69.1Low78.2Confident115 Ų11587.2 Ų87.271%0.70647%0.473SS*.THydrogen-bonded Turntrans-82.5-5.8-177.755.40000114.6K69K69-T72 PolarHBondContact O-OG1 3.03Å
73K63.2Low77.9Confident124 Ų12481.5 Ų81.554%0.53945%0.447SS..SBendtrans-108.9114.2179.6-68.4-174.8-179.6-174.70110.3G71 K75 R76G71-K73 VanDerWaalsContact C-N 3.35Å; G71-K73 PolarHBondContact O-N 2.74Å; K73-K75 PolarHBondContact O-N 3.12Å; K73-R76 PolarHBondContact O-N 2.78Å
74N53.9Low77.9Confident174 Ų17485.2 Ų85.293%0.9347%0.467SS*.THydrogen-bonded Turntrans-47.53.6-172-102.95.4000119.9
75K55.8Low77.8Confident206 Ų20690.2 Ų90.290%0.89649%0.485SS*.THydrogen-bonded Turntrans-131.120.9-179.2-69.6-173.3176.3-177.10114.5K73K73-K75 PolarHBondContact O-N 3.12Å
76R55.2Low77.8Confident101 Ų10193 Ų9338%0.38149%0.485SS..  trans-129.624.3-162.7-82178.8167173.61.5117.4H70 K73 T78 A79 A80H70-R76 VanDerWaalsContact O-CB 3.28Å; H70-R76 WeakPolarHBondContact O-CB 3.44Å; K73-R76 PolarHBondContact O-N 2.78Å; R76-T78 PolarHBondContact O-N 3.03Å; R76-T78 VanDerWaalsContact O-N 3.08Å; R76-A79 PolarHBondContact O-N 2.97Å; R76-A80 PolarHBondContact O-N 3.17Å
77G62.8Low78.1Confident58 Ų5892.7 Ų92.760%0.59848%0.478SS*.Hα-helixtrans-52.5-33.6178.400000114.3L81G77-L81 WeakPolarHBondContact O-CB 3.41Å; G77-L81 PolarHBondContact O-N 3.22Å
78T76.7Confident78.4Confident107 Ų10798.6 Ų98.666%0.65650%0.501SS*.Hα-helixtrans-70.6-41.9-17952.40000114.1R76 L81 Q82R76-T78 PolarHBondContact O-N 3.03Å; R76-T78 VanDerWaalsContact O-N 3.08Å; T78-L81 PolarHBondContact O-N 2.98Å; T78-Q82 WeakPolarHBondContact O-CB 3.49Å; T78-Q82 VanDerWaalsContact O-CG 3.32Å; T78-Q82 WeakPolarHBondContact O-CG 3.43Å; T78-Q82 PolarHBondContact O-N 3.48Å
79A79.4Confident78.7Confident33 Ų3398.2 Ų98.227%0.27350%0.496SS..Hα-helixtrans-71.3-41.1-179.600000111.8H70 R76 Q82 A83H70-A79 HydrophobicContact CB-CB 4.38Å; R76-A79 PolarHBondContact O-N 2.97Å; A79-Q82 PolarHBondContact O-N 3.43Å; A79-A83 PolarHBondContact O-N 3.43Å
80A82.7Confident79Confident13 Ų1391.7 Ų91.711%0.10747%0.468CS..Hα-helixtrans-64.5-42.2173.600000111.3H70 R76 Q82 A83 L84H70-A80 HydrophobicContact CB-CB 4.24Å; R76-A80 PolarHBondContact O-N 3.17Å; A80-Q82 PolarHBondContact O-N 3.07Å; A80-A83 PolarHBondContact O-N 3.43Å; A80-L84 WeakPolarHBondContact O-CG 3.1Å; A80-L84 PolarHBondContact O-N 3.04Å
81L85.8Confident79.6Confident91 Ų9192.8 Ų92.848%0.47647%0.473SS..Hα-helixtrans-65.6-36.7177.6-170.3153000112.3G77 T78 L84 K85G77-L81 WeakPolarHBondContact O-CB 3.41Å; G77-L81 PolarHBondContact O-N 3.22Å; T78-L81 PolarHBondContact O-N 2.98Å; L81-L84 PolarHBondContact O-N 3.23Å; L81-K85 HydrophobicContact CD2-CD 3.9Å; L81-K85 VanDerWaalsContact CD2-CE 3.48Å; L81-K85 HydrophobicContact CD2-CG 4.35Å; L81-K85 WeakPolarHBondContact O-CG 3.39Å; L81-K85 PolarHBondContact O-N 2.99Å
82Q87.3Confident80.7Confident110 Ų11095.4 Ų95.451%0.51447%0.47SS..Hα-helixtrans-65.4-42.4172.8-77.5-1790.300112.5T78 A79 A80 K85 R86T78-Q82 WeakPolarHBondContact O-CB 3.49Å; T78-Q82 VanDerWaalsContact O-CG 3.32Å; T78-Q82 WeakPolarHBondContact O-CG 3.43Å; T78-Q82 PolarHBondContact O-N 3.48Å; A79-Q82 PolarHBondContact O-N 3.43Å; A80-Q82 PolarHBondContact O-N 3.07Å; Q82-K85 PolarHBondContact O-N 3.49Å; Q82-R86 WeakPolarHBondContact O-CG 3.48Å; Q82-R86 PolarHBondContact O-N 2.92Å
83A88.7Confident81.7Confident2 Ų294 Ų942%0.01746%0.455CS..Hα-helixtrans-61.3-43.8175.200000111.4E63 T66 A67 A79 A80 K85 R86 K87E63-A83 WeakPolarHBondContact OE2-CA 3.49Å; T66-A83 HydrophobicContact CG2-CB 4.25Å; A67-A83 HydrophobicContact CB-CB 4.09Å; A79-A83 PolarHBondContact O-N 3.43Å; A80-A83 PolarHBondContact O-N 3.43Å; A83-K85 PolarHBondContact O-N 3.32Å; A83-R86 PolarHBondContact O-N 3.03Å; A83-R86 VanDerWaalsContact O-N 3.16Å; A83-K87 PolarHBondContact O-N 2.74Å
84L90.4Very high83.2Confident96 Ų9689.3 Ų89.350%0.50344%0.436SS..Hα-helixtrans-62.8-37.9175.5-69.5174.7000113.1A67 A80 L81 K87 K88A67-L84 HydrophobicContact CB-CD2 4Å; A67-L84 HydrophobicContact CB-CG 4.13Å; A80-L84 WeakPolarHBondContact O-CG 3.1Å; A80-L84 PolarHBondContact O-N 3.04Å; L81-L84 PolarHBondContact O-N 3.23Å; L84-K87 HydrophobicContact CD2-CD 4.43Å; L84-K87 WeakPolarHBondContact O-CB 3.35Å; L84-K87 PolarHBondContact O-N 3.36Å; L84-K88 PolarHBondContact O-N 3.49Å
85K91.1Very high85.2Confident145 Ų14585.7 Ų85.763%0.6342%0.421SS*.Hα-helixtrans-63.3-40.7173.3-78.2179.6174.1177.30112L81 Q82 A83 R89L81-K85 HydrophobicContact CD2-CD 3.9Å; L81-K85 VanDerWaalsContact CD2-CE 3.48Å; L81-K85 HydrophobicContact CD2-CG 4.35Å; L81-K85 WeakPolarHBondContact O-CG 3.39Å; L81-K85 PolarHBondContact O-N 2.99Å; Q82-K85 PolarHBondContact O-N 3.49Å; A83-K85 PolarHBondContact O-N 3.32Å; K85-R89 PolarHBondContact O-N 3.39Å
86R91.9Very high86.8Confident115 Ų11582.2 Ų82.243%0.43441%0.408SS..Hα-helixtrans-66.1-46.2176.1-69.5175.6-168.5159.73.1111.3E63 Q82 A83 K88 R89 L90E63-R86 HydrophobicContact CG-CB 4.27Å; E63-R86 WeakPolarHBondContact OE1-CD 3.42Å; Q82-R86 WeakPolarHBondContact O-CG 3.48Å; Q82-R86 PolarHBondContact O-N 2.92Å; A83-R86 PolarHBondContact O-N 3.03Å; A83-R86 VanDerWaalsContact O-N 3.16Å; R86-K88 VanDerWaalsContact C-N 3.34Å; R86-K88 PolarHBondContact O-N 3.07Å; R86-R89 PolarHBondContact O-N 3.1Å; R86-L90 WeakPolarHBondContact O-CG 3.31Å; R86-L90 PolarHBondContact O-N 2.92Å
87K94.4Very high88.7Confident48 Ų4877.9 Ų77.921%0.20939%0.392CS..Hα-helixtrans-49.1-55.2172.3172.4-176.9-178.4-78.90110.8I60 E63 V64 A83 L84 R89 L90 E91I60-K87 HydrophobicContact CG2-CG 4.22Å; E63-K87 HydrophobicContact CB-CB 4.19Å; V64-K87 HydrophobicContact CG2-CD 3.61Å; A83-K87 PolarHBondContact O-N 2.74Å; L84-K87 HydrophobicContact CD2-CD 4.43Å; L84-K87 WeakPolarHBondContact O-CB 3.35Å; L84-K87 PolarHBondContact O-N 3.36Å; K87-R89 VanDerWaalsContact C-N 3.26Å; K87-R89 PolarHBondContact O-N 2.69Å; K87-L90 WeakPolarHBondContact O-CB 3.44Å; K87-L90 PolarHBondContact O-N 3.49Å; K87-E91 VanDerWaalsContact CE-OE1 3.28Å; K87-E91 WeakPolarHBondContact CE-OE1 3.25Å; K87-E91 HydrophobicContact CG-CG 4.35Å; K87-E91 IonicContact NZ-OE1 2.54Å; K87-E91 PolarHBondContact NZ-OE1 2.96Å; K87-E91 IonicContact NZ-OE2 2.87Å; K87-E91 PolarHBondContact NZ-OE2 3Å; K87-E91 WeakPolarHBondContact O-CG 3.33Å; K87-E91 PolarHBondContact O-N 3.27Å
88K94.1Very high90.1Very high137 Ų13777.6 Ų77.660%0.59638%0.377SS*.Hα-helixtrans-60.4-34.5-176.8-169.9160.7-175.1164.60113.2L84 R86 Q92L84-K88 PolarHBondContact O-N 3.49Å; R86-K88 VanDerWaalsContact C-N 3.34Å; R86-K88 PolarHBondContact O-N 3.07Å; K88-Q92 WeakPolarHBondContact O-CG 3.46Å; K88-Q92 PolarHBondContact O-N 3.03Å; K88-Q92 VanDerWaalsContact O-N 3.15Å
89R93.3Very high90.7Very high144 Ų14474.5 Ų74.554%0.54337%0.366SS..Hα-helixtrans-69.5-39.4173.9-174.9179.865.2-173.21.1112.4K85 R86 K87 Q92 Q93K85-R89 PolarHBondContact O-N 3.39Å; R86-R89 PolarHBondContact O-N 3.1Å; K87-R89 VanDerWaalsContact C-N 3.26Å; K87-R89 PolarHBondContact O-N 2.69Å; R89-Q92 PolarHBondContact O-N 3.07Å; R89-Q93 WeakPolarHBondContact O-CG 3.34Å; R89-Q93 PolarHBondContact O-N 3.34Å; R89-Q93 VanDerWaalsContact O-N 3.17Å
90L92.8Very high91.3Very high7 Ų776.2 Ų76.24%0.03737%0.373CS..Hα-helixtrans-66.7-40.2176.3-66.6167.7000111L56 R59 I60 E63 R86 K87 Q92 Q93 L94L56-L90 HydrophobicContact CD2-CD2 3.72Å; R59-L90 HydrophobicContact CB-CD1 3.92Å; I60-L90 HydrophobicContact CD1-CB 4.06Å; I60-L90 HydrophobicContact CG1-CB 3.57Å; I60-L90 HydrophobicContact CG1-CD1 4.24Å; E63-L90 HydrophobicContact CG-CD1 4.09Å; R86-L90 WeakPolarHBondContact O-CG 3.31Å; R86-L90 PolarHBondContact O-N 2.92Å; K87-L90 WeakPolarHBondContact O-CB 3.44Å; K87-L90 PolarHBondContact O-N 3.49Å; L90-Q92 VanDerWaalsContact C-N 3.34Å; L90-Q92 PolarHBondContact O-N 3.22Å; L90-Q93 WeakPolarHBondContact O-CB 3.49Å; L90-Q93 PolarHBondContact O-N 3.49Å; L90-Q93 VanDerWaalsContact O-N 3.1Å; L90-L94 PolarHBondContact O-N 3.08Å
91E92.5Very high91.9Very high67 Ų6776.3 Ų76.331%0.31337%0.372SS..Hα-helixtrans-60.6-42.1174.5-70.8176.6138.800111.9I60 K87 Q93 L94 T95I60-E91 HydrophobicContact CD1-CG 3.82Å; I60-E91 HydrophobicContact CG1-CG 4.28Å; K87-E91 VanDerWaalsContact CE-OE1 3.28Å; K87-E91 WeakPolarHBondContact CE-OE1 3.25Å; K87-E91 HydrophobicContact CG-CG 4.35Å; K87-E91 IonicContact NZ-OE1 2.54Å; K87-E91 PolarHBondContact NZ-OE1 2.96Å; K87-E91 IonicContact NZ-OE2 2.87Å; K87-E91 PolarHBondContact NZ-OE2 3Å; K87-E91 WeakPolarHBondContact O-CG 3.33Å; K87-E91 PolarHBondContact O-N 3.27Å; E91-Q93 VanDerWaalsContact C-N 3.28Å; E91-Q93 PolarHBondContact O-N 2.88Å; E91-L94 WeakPolarHBondContact O-CB 3.36Å; E91-L94 PolarHBondContact O-N 2.97Å; E91-L94 VanDerWaalsContact O-N 3.16Å; E91-T95 PolarHBondContact O-N 2.98Å; E91-T95 PolarHBondContact O-OG1 3.25Å
92Q93.9Very high92.2Very high111 Ų11175.3 Ų75.352%0.51937%0.372SS..Hα-helixtrans-61.4-36.8173.8-74.3173.4-15.100112.7K88 R89 L90 Q96K88-Q92 WeakPolarHBondContact O-CG 3.46Å; K88-Q92 PolarHBondContact O-N 3.03Å; K88-Q92 VanDerWaalsContact O-N 3.15Å; R89-Q92 PolarHBondContact O-N 3.07Å; L90-Q92 VanDerWaalsContact C-N 3.34Å; L90-Q92 PolarHBondContact O-N 3.22Å; Q92-Q96 VanDerWaalsContact O-CG 3.31Å; Q92-Q96 WeakPolarHBondContact O-CG 3.47Å; Q92-Q96 PolarHBondContact O-N 3.12Å
93Q90.8Very high92.5Very high84 Ų8473.6 Ų73.639%0.39337%0.369SS..Hα-helixtrans-70.4-35.5175.3-70.8179.5-26.100111.8L56 R89 L90 E91 Q96 I97L56-Q93 HydrophobicContact CD1-CB 3.87Å; R89-Q93 WeakPolarHBondContact O-CG 3.34Å; R89-Q93 PolarHBondContact O-N 3.34Å; R89-Q93 VanDerWaalsContact O-N 3.17Å; L90-Q93 WeakPolarHBondContact O-CB 3.49Å; L90-Q93 PolarHBondContact O-N 3.49Å; L90-Q93 VanDerWaalsContact O-N 3.1Å; E91-Q93 VanDerWaalsContact C-N 3.28Å; E91-Q93 PolarHBondContact O-N 2.88Å; Q93-Q96 PolarHBondContact O-N 3.46Å; Q93-I97 WeakPolarHBondContact O-CG1 3.5Å; Q93-I97 PolarHBondContact O-N 2.82Å; Q93-I97 VanDerWaalsContact O-N 3.08Å
94L94.6Very high92.7Very high27 Ų2774.4 Ų74.414%0.14137%0.373CS..Hα-helixtrans-61.5-54.3176.2-167.970.6000110.2Q53 L56 E57 I60 L90 E91 Q96 I97 D98Q53-L94 HydrophobicContact CB-CD1 4.27Å; Q53-L94 HydrophobicContact CG-CD1 3.44Å; Q53-L94 VanDerWaalsContact CG-CD1 3.44Å; Q53-L94 HydrophobicContact CG-CG 4.5Å; L56-L94 HydrophobicContact CB-CD1 3.95Å; L56-L94 HydrophobicContact CD1-CD1 4.38Å; E57-L94 HydrophobicContact CG-CD1 3.9Å; E57-L94 HydrophobicContact CG-CD2 3.97Å; I60-L94 HydrophobicContact CD1-CD2 4.09Å; L90-L94 PolarHBondContact O-N 3.08Å; E91-L94 WeakPolarHBondContact O-CB 3.36Å; E91-L94 PolarHBondContact O-N 2.97Å; E91-L94 VanDerWaalsContact O-N 3.16Å; L94-Q96 PolarHBondContact O-N 3.18Å; L94-Q96 VanDerWaalsContact O-N 3.13Å; L94-I97 CarbonylContact O-C 3.6Å; L94-I97 WeakPolarHBondContact O-CA 3.32Å; L94-I97 WeakPolarHBondContact O-CB 3.37Å; L94-I97 PolarHBondContact O-N 3.39Å; L94-D98 PolarHBondContact O-N 3.17Å
95T94.1Very high92.8Very high98 Ų9872.7 Ų72.760%0.60136%0.363SS*.Hα-helixtrans-56.4-35.9177.8-52.70000113.2E91 G99E91-T95 PolarHBondContact O-N 2.98Å; E91-T95 PolarHBondContact O-OG1 3.25Å; T95-G99 PolarHBondContact O-N 3.12Å; T95-G99 VanDerWaalsContact O-N 3.12Å
96Q91Very high92.8Very high133 Ų13372.7 Ų72.762%0.62136%0.363SS*.Hα-helixtrans-67.5-39.2175-74.41744.600112.4Q92 Q93 L94 T100Q92-Q96 VanDerWaalsContact O-CG 3.31Å; Q92-Q96 WeakPolarHBondContact O-CG 3.47Å; Q92-Q96 PolarHBondContact O-N 3.12Å; Q93-Q96 PolarHBondContact O-N 3.46Å; L94-Q96 PolarHBondContact O-N 3.18Å; L94-Q96 VanDerWaalsContact O-N 3.13Å; Q96-T100 WeakPolarHBondContact O-CB 3.46Å; Q96-T100 PolarHBondContact O-N 2.91Å; Q96-T100 VanDerWaalsContact O-N 3.12Å; Q96-T100 PolarHBondContact O-OG1 3.5Å
97I93.4Very high92.8Very high10 Ų1071.8 Ų71.85%0.05136%0.364CS..Hα-helixtrans-66.4-46175.9-72.6173000109.9L49 K52 Q53 L56 Q93 L94 G99 T100 L101L49-I97 HydrophobicContact CB-CG2 4.32Å; L49-I97 HydrophobicContact CD2-CG2 4.38Å; K52-I97 HydrophobicContact CB-CD1 4.24Å; K52-I97 HydrophobicContact CD-CD1 3.55Å; K52-I97 HydrophobicContact CD-CG1 4.49Å; K52-I97 HydrophobicContact CG-CD1 3.66Å; Q53-I97 HydrophobicContact CB-CG2 4.21Å; L56-I97 HydrophobicContact CD1-CD1 3.49Å; L56-I97 VanDerWaalsContact CD1-CD1 3.49Å; Q93-I97 WeakPolarHBondContact O-CG1 3.5Å; Q93-I97 PolarHBondContact O-N 2.82Å; Q93-I97 VanDerWaalsContact O-N 3.08Å; L94-I97 CarbonylContact O-C 3.6Å; L94-I97 WeakPolarHBondContact O-CA 3.32Å; L94-I97 WeakPolarHBondContact O-CB 3.37Å; L94-I97 PolarHBondContact O-N 3.39Å; I97-G99 VanDerWaalsContact C-N 3.35Å; I97-G99 PolarHBondContact O-N 2.83Å; I97-T100 CarbonylContact O-C 3.6Å; I97-T100 WeakPolarHBondContact O-CA 3.33Å; I97-T100 WeakPolarHBondContact O-CB 3.47Å; I97-T100 PolarHBondContact O-N 3.16Å; I97-L101 WeakPolarHBondContact O-CB 3.48Å; I97-L101 PolarHBondContact O-N 3.48Å
98D92.2Very high92.8Very high52 Ų5272.2 Ų72.228%0.27836%0.364SS..Hα-helixtrans-57.4-48.5-179.7-54.5-24.3000110.6L94 T100 L101 S102L94-D98 PolarHBondContact O-N 3.17Å; D98-T100 VanDerWaalsContact C-N 3.3Å; D98-T100 PolarHBondContact O-N 2.91Å; D98-L101 WeakPolarHBondContact O-CB 3.47Å; D98-L101 PolarHBondContact O-N 3.3Å; D98-L101 VanDerWaalsContact O-N 3.16Å; D98-S102 PolarHBondContact O-N 2.98Å; D98-S102 PolarHBondContact O-OG 3.13Å
99G91.3Very high92.7Very high41 Ų4170.7 Ų70.742%0.42336%0.359SS..Hα-helixtrans-64.3-32.5176.400000113.8T95 I97 T103T95-G99 PolarHBondContact O-N 3.12Å; T95-G99 VanDerWaalsContact O-N 3.12Å; I97-G99 VanDerWaalsContact C-N 3.35Å; I97-G99 PolarHBondContact O-N 2.83Å; G99-T103 PolarHBondContact O-N 2.99Å; G99-T103 PolarHBondContact O-OG1 2.96Å
100T91.6Very high92.4Very high69 Ų6966.1 Ų66.142%0.42335%0.352SS..Hα-helixtrans-71-39.1174.6-53.90000111.1L49 Q96 I97 D98 T103 I104L49-T100 HydrophobicContact CD1-CG2 3.99Å; Q96-T100 WeakPolarHBondContact O-CB 3.46Å; Q96-T100 PolarHBondContact O-N 2.91Å; Q96-T100 VanDerWaalsContact O-N 3.12Å; Q96-T100 PolarHBondContact O-OG1 3.5Å; I97-T100 CarbonylContact O-C 3.6Å; I97-T100 WeakPolarHBondContact O-CA 3.33Å; I97-T100 WeakPolarHBondContact O-CB 3.47Å; I97-T100 PolarHBondContact O-N 3.16Å; D98-T100 VanDerWaalsContact C-N 3.3Å; D98-T100 PolarHBondContact O-N 2.91Å; T100-T103 PolarHBondContact O-N 3.21Å; T100-I104 HydrophobicContact CG2-CD1 4.06Å; T100-I104 WeakPolarHBondContact O-CG1 3.41Å; T100-I104 PolarHBondContact O-N 3.35Å
101L94.1Very high92.3Very high16 Ų1668.5 Ų68.58%0.08436%0.364CS..Hα-helixtrans-61.5-52.6177.7-166.380.4000110.1E46 L49 I97 D98 T103 I104 E105E46-L101 HydrophobicContact CB-CD1 4.42Å; E46-L101 HydrophobicContact CG-CD1 3.91Å; L49-L101 HydrophobicContact CB-CD1 3.64Å; L49-L101 HydrophobicContact CD1-CD1 4.31Å; I97-L101 WeakPolarHBondContact O-CB 3.48Å; I97-L101 PolarHBondContact O-N 3.48Å; D98-L101 WeakPolarHBondContact O-CB 3.47Å; D98-L101 PolarHBondContact O-N 3.3Å; D98-L101 VanDerWaalsContact O-N 3.16Å; L101-T103 PolarHBondContact O-N 3.35Å; L101-I104 WeakPolarHBondContact O-CA 3.41Å; L101-I104 WeakPolarHBondContact O-CB 3.17Å; L101-I104 PolarHBondContact O-N 2.88Å; L101-E105 WeakPolarHBondContact O-CG 3.35Å; L101-E105 PolarHBondContact O-N 3.49Å
102S92.5Very high92.1Very high69 Ų6967.6 Ų67.648%0.48336%0.36SS..Hα-helixtrans-58.1-36.7176.8-63.20000112.8D98 I104 F106D98-S102 PolarHBondContact O-N 2.98Å; D98-S102 PolarHBondContact O-OG 3.13Å; S102-I104 VanDerWaalsContact C-N 3.35Å; S102-I104 PolarHBondContact O-N 2.96Å; S102-F106 WeakPolarHBondContact O-CB 3.5Å; S102-F106 PolarHBondContact O-N 3.49Å
103T92.9Very high91.8Very high75 Ų7565 Ų6546%0.4635%0.35SS..Hα-helixtrans-64.6-40.1175.7-58.30000111.7G99 T100 L101 Q107G99-T103 PolarHBondContact O-N 2.99Å; G99-T103 PolarHBondContact O-OG1 2.96Å; T100-T103 PolarHBondContact O-N 3.21Å; L101-T103 PolarHBondContact O-N 3.35Å; T103-Q107 VanDerWaalsContact O-CG 3.25Å; T103-Q107 WeakPolarHBondContact O-CG 3.33Å; T103-Q107 PolarHBondContact O-N 3.26Å; T103-Q107 VanDerWaalsContact O-N 3.1Å
104I93.6Very high91.5Very high18 Ų1864 Ų649%0.09235%0.352CS..Hα-helixtrans-71.2-41.9179.1-75166.4000111L42 T45 E46 L49 T100 L101 S102 Q107 R108L42-I104 HydrophobicContact CB-CG2 4.28Å; L42-I104 HydrophobicContact CD2-CG2 3.99Å; T45-I104 HydrophobicContact CG2-CD1 3.68Å; E46-I104 HydrophobicContact CB-CG2 4.33Å; L49-I104 HydrophobicContact CD1-CD1 3.44Å; L49-I104 VanDerWaalsContact CD1-CD1 3.44Å; T100-I104 HydrophobicContact CG2-CD1 4.06Å; T100-I104 WeakPolarHBondContact O-CG1 3.41Å; T100-I104 PolarHBondContact O-N 3.35Å; L101-I104 WeakPolarHBondContact O-CA 3.41Å; L101-I104 WeakPolarHBondContact O-CB 3.17Å; L101-I104 PolarHBondContact O-N 2.88Å; S102-I104 VanDerWaalsContact C-N 3.35Å; S102-I104 PolarHBondContact O-N 2.96Å; I104-Q107 PolarHBondContact O-N 2.93Å; I104-R108 WeakPolarHBondContact O-CB 3.39Å; I104-R108 PolarHBondContact O-N 3.19Å
105E92.1Very high91Very high61 Ų6165.1 Ų65.129%0.28536%0.357SS..Hα-helixtrans-58.5-49.3175.6-71.7168.1167.200110.7E46 L101 Q107 R108 E109E46-E105 HydrophobicContact CG-CG 4.46Å; L101-E105 WeakPolarHBondContact O-CG 3.35Å; L101-E105 PolarHBondContact O-N 3.49Å; E105-Q107 VanDerWaalsContact C-N 3.34Å; E105-Q107 PolarHBondContact O-N 2.91Å; E105-R108 WeakPolarHBondContact O-CB 3.46Å; E105-R108 PolarHBondContact O-N 2.9Å; E105-E109 WeakPolarHBondContact O-CB 3.49Å; E105-E109 PolarHBondContact O-N 3.17Å
106F92.4Very high90.5Very high144 Ų14464.1 Ų64.163%0.63235%0.35SS*.Hα-helixtrans-58.1-44.1175.6178.4-100.4000112.3S102 E109 A110S102-F106 WeakPolarHBondContact O-CB 3.5Å; S102-F106 PolarHBondContact O-N 3.49Å; F106-E109 PolarHBondContact O-N 2.85Å; F106-A110 WeakPolarHBondContact O-CB 3.48Å; F106-A110 PolarHBondContact O-N 3.14Å
107Q91.4Very high90.1Very high97 Ų9760 Ų6045%0.45333%0.333SS..Hα-helixtrans-65.8-38.3177.7-74.8174.5800112.8L42 T103 I104 E105 L111L42-Q107 HydrophobicContact CD1-CB 4.41Å; T103-Q107 VanDerWaalsContact O-CG 3.25Å; T103-Q107 WeakPolarHBondContact O-CG 3.33Å; T103-Q107 PolarHBondContact O-N 3.26Å; T103-Q107 VanDerWaalsContact O-N 3.1Å; I104-Q107 PolarHBondContact O-N 2.93Å; E105-Q107 VanDerWaalsContact C-N 3.34Å; E105-Q107 PolarHBondContact O-N 2.91Å; Q107-L111 WeakPolarHBondContact O-CG 3.41Å; Q107-L111 PolarHBondContact O-N 3.21Å; Q107-L111 VanDerWaalsContact O-N 3.13Å
108R94.3Very high89.8Confident56 Ų5663.6 Ų63.621%0.21136%0.355CS..Hα-helixtrans-63.9-49.6176.8-178-163.768.1-164.7-5.1110I39 L42 R43 E46 I104 E105 A110 L111 E112I39-R108 HydrophobicContact CG2-CG 4.33Å; L42-R108 HydrophobicContact CB-CB 4.19Å; L42-R108 HydrophobicContact CB-CG 4.43Å; L42-R108 HydrophobicContact CD1-CB 4.09Å; R43-R108 HydrophobicContact CG-CG 4.49Å; E46-R108 IonicContact OE1-CZ 3.37Å; E46-R108 IonicContact OE1-NH1 2.63Å; E46-R108 PolarHBondContact OE1-NH1 2.89Å; E46-R108 IonicContact OE2-CZ 3.75Å; E46-R108 IonicContact OE2-NH1 2.77Å; E46-R108 PolarHBondContact OE2-NH1 2.77Å; I104-R108 WeakPolarHBondContact O-CB 3.39Å; I104-R108 PolarHBondContact O-N 3.19Å; E105-R108 WeakPolarHBondContact O-CB 3.46Å; E105-R108 PolarHBondContact O-N 2.9Å; R108-A110 PolarHBondContact O-N 2.87Å; R108-L111 PolarHBondContact O-N 3Å; R108-L111 VanDerWaalsContact O-N 3.17Å; R108-E112 WeakPolarHBondContact O-CG 3.4Å; R108-E112 PolarHBondContact O-N 3.39Å
109E91Very high89.5Confident105 Ų10565.9 Ų65.949%0.49136%0.364SS..Hα-helixtrans-60.7-45.6179-172.9-178.1169.200111.5E105 F106 L111 E112 N113E105-E109 WeakPolarHBondContact O-CB 3.49Å; E105-E109 PolarHBondContact O-N 3.17Å; F106-E109 PolarHBondContact O-N 2.85Å; E109-L111 VanDerWaalsContact C-N 3.26Å; E109-L111 PolarHBondContact O-N 3.13Å; E109-E112 PolarHBondContact O-N 2.98Å; E109-E112 VanDerWaalsContact O-N 3.14Å; E109-N113 WeakPolarHBondContact O-CB 3.47Å; E109-N113 VanDerWaalsContact O-CG 3.28Å; E109-N113 PolarHBondContact O-N 2.91Å
110A88.4Confident89.4Confident48 Ų4866.4 Ų66.440%0.39736%0.359SS..Hα-helixtrans-57.7-38.5175.800000112.5F106 R108 S114F106-A110 WeakPolarHBondContact O-CB 3.48Å; F106-A110 PolarHBondContact O-N 3.14Å; R108-A110 PolarHBondContact O-N 2.87Å; A110-S114 VanDerWaalsContact O-CB 3.27Å; A110-S114 WeakPolarHBondContact O-CB 3.41Å; A110-S114 PolarHBondContact O-N 2.98Å
111L89.8Confident89Confident57 Ų5767.9 Ų67.930%0.29836%0.364SS..Hα-helixtrans-71.7-39.3175.7-78.5172.7000112.9A38 I39 L42 Q107 R108 E109 S114 H115A38-L111 HydrophobicContact CB-CD1 3.94Å; I39-L111 HydrophobicContact CD1-CB 4.31Å; I39-L111 HydrophobicContact CG1-CB 3.9Å; L42-L111 HydrophobicContact CD1-CD1 3.67Å; Q107-L111 WeakPolarHBondContact O-CG 3.41Å; Q107-L111 PolarHBondContact O-N 3.21Å; Q107-L111 VanDerWaalsContact O-N 3.13Å; R108-L111 PolarHBondContact O-N 3Å; R108-L111 VanDerWaalsContact O-N 3.17Å; E109-L111 VanDerWaalsContact C-N 3.26Å; E109-L111 PolarHBondContact O-N 3.13Å; L111-S114 PolarHBondContact O-N 3.12Å; L111-H115 WeakPolarHBondContact O-CB 3.41Å; L111-H115 PolarHBondContact O-N 3.43Å
112E88.6Confident88.8Confident48 Ų4874.8 Ų74.822%0.22439%0.393CS..Hα-helixtrans-64.1-43.7176.2-73.9175.2173.800111I39 R43 R108 E109 H115 T116I39-E112 HydrophobicContact CD1-CG 3.71Å; I39-E112 HydrophobicContact CG1-CG 4.01Å; I39-E112 HydrophobicContact CG2-CG 4.09Å; I39-E112 WeakPolarHBondContact CG2-OE1 3.27Å; R43-E112 IonicContact CZ-OE1 3.44Å; R43-E112 IonicContact NE-OE1 3.79Å; R43-E112 PolarHBondContact NE-OE1 3.23Å; R43-E112 IonicContact NH2-OE1 3.61Å; R43-E112 PolarHBondContact NH2-OE1 3.34Å; R108-E112 WeakPolarHBondContact O-CG 3.4Å; R108-E112 PolarHBondContact O-N 3.39Å; E109-E112 PolarHBondContact O-N 2.98Å; E109-E112 VanDerWaalsContact O-N 3.14Å; E112-H115 PolarHBondContact O-N 3Å; E112-T116 PolarHBondContact O-N 2.83Å; E112-T116 PolarHBondContact O-OG1 3.07Å
113N87.8Confident88.7Confident58 Ų5876.6 Ų76.631%0.3140%0.397SS..Hα-helixtrans-64.3-44.7175.1-69.1-14.2000111.2E109 H115 T116 N117E109-N113 WeakPolarHBondContact O-CB 3.47Å; E109-N113 VanDerWaalsContact O-CG 3.28Å; E109-N113 PolarHBondContact O-N 2.91Å; N113-H115 VanDerWaalsContact C-N 3.32Å; N113-H115 PolarHBondContact O-N 3.47Å; N113-T116 PolarHBondContact O-N 2.86Å; N113-N117 WeakPolarHBondContact O-CB 3.47Å; N113-N117 VanDerWaalsContact O-CG 3.22Å; N113-N117 PolarHBondContact O-N 2.77Å; N113-N117 PolarHBondContact O-OD1 3.02Å
114S84.4Confident88.1Confident63 Ų6376 Ų7644%0.44139%0.39SS..Hα-helixtrans-61.2-39.5175.5-179.70000112.5A110 L111 T118A110-S114 VanDerWaalsContact O-CB 3.27Å; A110-S114 WeakPolarHBondContact O-CB 3.41Å; A110-S114 PolarHBondContact O-N 2.98Å; L111-S114 PolarHBondContact O-N 3.12Å; S114-T118 WeakPolarHBondContact O-CB 3.4Å; S114-T118 PolarHBondContact O-N 3.41Å; S114-T118 PolarHBondContact O-OG1 3.41Å
115H83.8Confident87.6Confident50 Ų5076.7 Ų76.723%0.23140%0.402CS..Hα-helixtrans-62.8-49176.1-173.240.7000111Q36 L111 E112 N113 T118 E119Q36-H115 PolarHBondContact NE2-NE2 3.28Å; L111-H115 WeakPolarHBondContact O-CB 3.41Å; L111-H115 PolarHBondContact O-N 3.43Å; E112-H115 PolarHBondContact O-N 3Å; N113-H115 VanDerWaalsContact C-N 3.32Å; N113-H115 PolarHBondContact O-N 3.47Å; H115-T118 WeakPolarHBondContact O-CB 3.43Å; H115-T118 PolarHBondContact O-N 3.31Å; H115-E119 IonicContact CE1-OE1 3.74Å; H115-E119 IonicContact NE2-OE1 2.6Å; H115-E119 PolarHBondContact O-N 3.14Å
116T83.9Confident87.3Confident76 Ų7681.1 Ų81.147%0.46642%0.42SS..Hα-helixtrans-59.7-47.8178-54.80000111.4E112 N113 T118 E119 V120E112-T116 PolarHBondContact O-N 2.83Å; E112-T116 PolarHBondContact O-OG1 3.07Å; N113-T116 PolarHBondContact O-N 2.86Å; T116-T118 VanDerWaalsContact C-N 3.29Å; T116-T118 PolarHBondContact O-N 2.96Å; T116-E119 PolarHBondContact O-N 3.5Å; T116-E119 VanDerWaalsContact O-N 3.1Å; T116-V120 WeakPolarHBondContact O-CG2 3.35Å; T116-V120 PolarHBondContact O-N 3.48Å
117N83.5Confident86.9Confident48 Ų4876.8 Ų76.826%0.25741%0.411SS..Hα-helixtrans-60.3-39.2177.4-71.4-4000111.9N113 V120 L121 I164N113-N117 WeakPolarHBondContact O-CB 3.47Å; N113-N117 VanDerWaalsContact O-CG 3.22Å; N113-N117 PolarHBondContact O-N 2.77Å; N113-N117 PolarHBondContact O-OD1 3.02Å; N117-V120 PolarHBondContact O-N 3.5Å; N117-L121 WeakPolarHBondContact O-CG 3.48Å; N117-L121 PolarHBondContact O-N 3.17Å; N117-I164 WeakPolarHBondContact OD1-CG2 3.45Å
118T86Confident86.3Confident84 Ų8475 Ų7552%0.51541%0.413SS..Hα-helixtrans-63.9-40.7175.7-57.20000111.7S114 H115 T116 K122S114-T118 WeakPolarHBondContact O-CB 3.4Å; S114-T118 PolarHBondContact O-N 3.41Å; S114-T118 PolarHBondContact O-OG1 3.41Å; H115-T118 WeakPolarHBondContact O-CB 3.43Å; H115-T118 PolarHBondContact O-N 3.31Å; T116-T118 VanDerWaalsContact C-N 3.29Å; T116-T118 PolarHBondContact O-N 2.96Å; T118-K122 WeakPolarHBondContact O-CB 3.33Å; T118-K122 PolarHBondContact O-N 2.83Å
119E86.4Confident85.7Confident101 Ų10179.6 Ų79.647%0.47243%0.434SS..Hα-helixtrans-67.2-42.1176.4-69-162.4149.300112.3H115 T116 L121 K122 N123H115-E119 IonicContact CE1-OE1 3.74Å; H115-E119 IonicContact NE2-OE1 2.6Å; H115-E119 PolarHBondContact O-N 3.14Å; T116-E119 PolarHBondContact O-N 3.5Å; T116-E119 VanDerWaalsContact O-N 3.1Å; E119-L121 PolarHBondContact O-N 3.46Å; E119-K122 WeakPolarHBondContact O-CB 3.46Å; E119-K122 PolarHBondContact O-N 2.9Å; E119-N123 VanDerWaalsContact O-CG 3.28Å; E119-N123 PolarHBondContact O-N 3.46Å
120V88.3Confident85.3Confident51 Ų5176.5 Ų76.531%0.30943%0.427SS..Hα-helixtrans-56.6-51.6173.8171.50000110.3T116 N117 K122 N123 M124 I164T116-V120 WeakPolarHBondContact O-CG2 3.35Å; T116-V120 PolarHBondContact O-N 3.48Å; N117-V120 PolarHBondContact O-N 3.5Å; V120-K122 VanDerWaalsContact C-N 3.3Å; V120-K122 PolarHBondContact O-N 3.07Å; V120-N123 PolarHBondContact O-N 3.1Å; V120-N123 VanDerWaalsContact O-N 3.14Å; V120-M124 HydrophobicContact CG1-CG 4.38Å; V120-M124 HydrophobicContact CG1-SD 3.96Å; V120-M124 WeakPolarHBondContact O-CG 3.46Å; V120-M124 PolarHBondContact O-N 2.84Å; V120-I164 HydrophobicContact CG1-CD1 4.37Å
121L84.4Confident84.8Confident101 Ų10178.3 Ų78.353%0.52943%0.428SS..Hα-helixtrans-61-38178.9-71.8174.8000112.6N117 E119 M124 G125N117-L121 WeakPolarHBondContact O-CG 3.48Å; N117-L121 PolarHBondContact O-N 3.17Å; E119-L121 PolarHBondContact O-N 3.46Å; L121-M124 HydrophobicContact CD2-SD 4.45Å; L121-M124 PolarHBondContact O-N 3.32Å; L121-G125 PolarHBondContact O-N 3.45Å
122K89.3Confident84.2Confident160 Ų16081.6 Ų81.670%0.69644%0.44SS*.Hα-helixtrans-63.9-42.6176.1-174.5-177.2174.9-170.90111.5T118 E119 V120 G125 F126T118-K122 WeakPolarHBondContact O-CB 3.33Å; T118-K122 PolarHBondContact O-N 2.83Å; E119-K122 WeakPolarHBondContact O-CB 3.46Å; E119-K122 PolarHBondContact O-N 2.9Å; V120-K122 VanDerWaalsContact C-N 3.3Å; V120-K122 PolarHBondContact O-N 3.07Å; K122-G125 PolarHBondContact O-N 2.84Å; K122-F126 PolarHBondContact O-N 2.87Å
123N89.8Confident83.8Confident108 Ų10885.3 Ų85.358%0.57846%0.457SS*.Hα-helixtrans-68.6-41.7178.3-69.2-14.2000111.5E119 V120 G125 F126 A127E119-N123 VanDerWaalsContact O-CG 3.28Å; E119-N123 PolarHBondContact O-N 3.46Å; V120-N123 PolarHBondContact O-N 3.1Å; V120-N123 VanDerWaalsContact O-N 3.14Å; N123-G125 VanDerWaalsContact C-N 3.32Å; N123-G125 PolarHBondContact O-N 3.38Å; N123-F126 WeakPolarHBondContact O-CB 3.43Å; N123-F126 PolarHBondContact O-N 2.82Å; N123-F126 VanDerWaalsContact O-N 3.16Å; N123-A127 PolarHBondContact O-N 3.48Å
124M81.8Confident83.2Confident63 Ų6386.6 Ų86.631%0.3147%0.467SS..Hα-helixtrans-58.7-43.9172-70.8177.27400111.4V120 L121 F126 A127 A128 A157V120-M124 HydrophobicContact CG1-CG 4.38Å; V120-M124 HydrophobicContact CG1-SD 3.96Å; V120-M124 WeakPolarHBondContact O-CG 3.46Å; V120-M124 PolarHBondContact O-N 2.84Å; L121-M124 HydrophobicContact CD2-SD 4.45Å; L121-M124 PolarHBondContact O-N 3.32Å; M124-F126 VanDerWaalsContact C-N 3.31Å; M124-F126 PolarHBondContact O-N 3Å; M124-A127 PolarHBondContact O-N 3.33Å; M124-A128 WeakPolarHBondContact O-CB 3.28Å; M124-A128 PolarHBondContact O-N 3.21Å; M124-A157 HydrophobicContact CE-CB 4.31Å
125G82.1Confident82.5Confident32 Ų3285.8 Ų85.833%0.3346%0.456SS..Hα-helixtrans-63.6-33.717600000113.5L121 K122 N123 K129L121-G125 PolarHBondContact O-N 3.45Å; K122-G125 PolarHBondContact O-N 2.84Å; N123-G125 VanDerWaalsContact C-N 3.32Å; N123-G125 PolarHBondContact O-N 3.38Å; G125-K129 VanDerWaalsContact O-CG 3.3Å; G125-K129 WeakPolarHBondContact O-CG 3.43Å; G125-K129 PolarHBondContact O-N 2.98Å
126F85.9Confident81.7Confident154 Ų15489.6 Ų89.668%0.67547%0.474SS*.Hα-helixtrans-69.3-46172.6-178.7-98.2000111.6K122 N123 M124 A128 K129 A130K122-F126 PolarHBondContact O-N 2.87Å; N123-F126 WeakPolarHBondContact O-CB 3.43Å; N123-F126 PolarHBondContact O-N 2.82Å; N123-F126 VanDerWaalsContact O-N 3.16Å; M124-F126 VanDerWaalsContact C-N 3.31Å; M124-F126 PolarHBondContact O-N 3Å; F126-A128 PolarHBondContact O-N 2.89Å; F126-K129 PolarHBondContact O-N 3.29Å; F126-A130 PolarHBondContact O-N 2.85Å
127A84Confident80.9Confident52 Ų5292.7 Ų92.743%0.4349%0.488SS..Hα-helixtrans-59.3-45.217600000111.7N123 M124 K129 A130 M131N123-A127 PolarHBondContact O-N 3.48Å; M124-A127 PolarHBondContact O-N 3.33Å; A127-K129 VanDerWaalsContact C-N 3.31Å; A127-K129 PolarHBondContact O-N 3.35Å; A127-A130 PolarHBondContact O-N 3.47Å; A127-A130 VanDerWaalsContact O-N 3.15Å; A127-M131 WeakPolarHBondContact O-CB 3.25Å; A127-M131 WeakPolarHBondContact O-CG 3.32Å; A127-M131 PolarHBondContact O-N 3.04Å
128A79.1Confident79.9Confident61 Ų6193.4 Ų93.450%0.50449%0.49SS..Hα-helixtrans-60.3-38.8176.800000112.5M124 F126 K132M124-A128 WeakPolarHBondContact O-CB 3.28Å; M124-A128 PolarHBondContact O-N 3.21Å; F126-A128 PolarHBondContact O-N 2.89Å; A128-K132 WeakPolarHBondContact O-CB 3.37Å; A128-K132 PolarHBondContact O-N 2.99Å
129K82.4Confident78.7Confident152 Ų15295.5 Ų95.566%0.66150%0.498SS*.Hα-helixtrans-66.8-41.5174.6-74.1171.5-175.8176.60112.2G125 F126 A127 K132 Q133G125-K129 VanDerWaalsContact O-CG 3.3Å; G125-K129 WeakPolarHBondContact O-CG 3.43Å; G125-K129 PolarHBondContact O-N 2.98Å; F126-K129 PolarHBondContact O-N 3.29Å; A127-K129 VanDerWaalsContact C-N 3.31Å; A127-K129 PolarHBondContact O-N 3.35Å; K129-K132 PolarHBondContact O-N 2.94Å; K129-Q133 PolarHBondContact O-N 2.94Å
130A82.4Confident77.4Confident40 Ų4097.3 Ų97.333%0.33151%0.51SS..Hα-helixtrans-63.5-45.4176.100000111.2F126 A127 K132 Q133 V134F126-A130 PolarHBondContact O-N 2.85Å; A127-A130 PolarHBondContact O-N 3.47Å; A127-A130 VanDerWaalsContact O-N 3.15Å; A130-K132 VanDerWaalsContact C-N 3.34Å; A130-K132 PolarHBondContact O-N 3.47Å; A130-Q133 PolarHBondContact O-N 3.4Å; A130-V134 WeakPolarHBondContact O-CG2 2.99Å; A130-V134 PolarHBondContact O-N 3Å
131M76.5Confident76.2Confident85 Ų85102.2 Ų102.242%0.41953%0.534SS..Hα-helixtrans-57.3-46.3173.8-67.4-106.7-78.800111.2A127 Q133 V134 H135A127-M131 WeakPolarHBondContact O-CB 3.25Å; A127-M131 WeakPolarHBondContact O-CG 3.32Å; A127-M131 PolarHBondContact O-N 3.04Å; M131-Q133 VanDerWaalsContact C-N 3.34Å; M131-Q133 PolarHBondContact O-N 2.88Å; M131-V134 WeakPolarHBondContact O-CB 3.43Å; M131-V134 PolarHBondContact O-N 3.42Å; M131-V134 VanDerWaalsContact O-N 3.14Å; M131-H135 PolarHBondContact O-CD2 3.31Å; M131-H135 PolarHBondContact O-N 3.26Å
132K77.4Confident75.3Confident127 Ų127104 Ų10455%0.55254%0.538SS*.Hα-helixtrans-59-42.3176.4-170.8-176.4179.7-157.30112.7A128 K129 A130 V134 H135 E136A128-K132 WeakPolarHBondContact O-CB 3.37Å; A128-K132 PolarHBondContact O-N 2.99Å; K129-K132 PolarHBondContact O-N 2.94Å; A130-K132 VanDerWaalsContact C-N 3.34Å; A130-K132 PolarHBondContact O-N 3.47Å; K132-V134 VanDerWaalsContact C-N 3.33Å; K132-H135 PolarHBondContact O-N 2.86Å; K132-E136 WeakPolarHBondContact CE-OE1 3.37Å; K132-E136 IonicContact NZ-OE1 3.46Å; K132-E136 PolarHBondContact NZ-OE1 3.4Å; K132-E136 PolarHBondContact O-N 3.29Å
133Q80.8Confident74.1Confident125 Ų12599.3 Ų99.358%0.58452%0.52SS*.Hα-helixtrans-66-35.2177-76.1-178.7-18.600112.7K129 A130 M131 H135 N137K129-Q133 PolarHBondContact O-N 2.94Å; A130-Q133 PolarHBondContact O-N 3.4Å; M131-Q133 VanDerWaalsContact C-N 3.34Å; M131-Q133 PolarHBondContact O-N 2.88Å; Q133-H135 VanDerWaalsContact C-N 3.32Å; Q133-N137 PolarHBondContact O-ND2 2.96Å
134V75.2Confident72.9Confident86 Ų86100.5 Ų100.552%0.52153%0.526SS..Hα-helixtrans-63.1-43.1171.4173.90000109.9A130 M131 K132 N137 M138A130-V134 WeakPolarHBondContact O-CG2 2.99Å; A130-V134 PolarHBondContact O-N 3Å; M131-V134 WeakPolarHBondContact O-CB 3.43Å; M131-V134 PolarHBondContact O-N 3.42Å; M131-V134 VanDerWaalsContact O-N 3.14Å; K132-V134 VanDerWaalsContact C-N 3.33Å; V134-N137 PolarHBondContact O-N 2.6Å; V134-M138 PolarHBondContact O-N 3.21Å
135H68.8Low72.3Confident45 Ų45103.3 Ų103.321%0.20854%0.543CS..Hα-helixtrans-69-38.3-179-59.1176000113.4M131 K132 Q133 N137 M138 L146 I150M131-H135 PolarHBondContact O-CD2 3.31Å; M131-H135 PolarHBondContact O-N 3.26Å; K132-H135 PolarHBondContact O-N 2.86Å; Q133-H135 VanDerWaalsContact C-N 3.32Å; H135-N137 PolarHBondContact O-N 2.75Å; H135-N137 VanDerWaalsContact O-N 3.15Å; H135-M138 PolarHBondContact O-N 2.9Å; H135-M138 VanDerWaalsContact O-N 3.16Å; H135-L146 HydrophobicContact CB-CD2 4.25Å; H135-I150 WeakPolarHBondContact CE1-CD1 3.37Å; H135-I150 WeakPolarHBondContact ND1-CD1 3.42Å
136E68.8Low71.4Confident130 Ų130103.5 Ų103.561%0.60754%0.536SS*.Hα-helixtrans-61.6-20174.9-78.7177.3-178.600112.7K132K132-E136 WeakPolarHBondContact CE-OE1 3.37Å; K132-E136 IonicContact NZ-OE1 3.46Å; K132-E136 PolarHBondContact NZ-OE1 3.4Å; K132-E136 PolarHBondContact O-N 3.29Å
137N65.6Low70.3Confident141 Ų141101.3 Ų101.375%0.75453%0.529SS*.THydrogen-bonded Turntrans-102.95.6179.5-66.2-48.7000113.9Q133 V134 H135Q133-N137 PolarHBondContact O-ND2 2.96Å; V134-N137 PolarHBondContact O-N 2.6Å; H135-N137 PolarHBondContact O-N 2.75Å; H135-N137 VanDerWaalsContact O-N 3.15Å
138M63.8Low69.8Low63 Ų63105.6 Ų105.631%0.3154%0.54SS..SBendtrans-98.5136175.5-73.8-164-47.600111.8V134 H135 L146V134-M138 PolarHBondContact O-N 3.21Å; H135-M138 PolarHBondContact O-N 2.9Å; H135-M138 VanDerWaalsContact O-N 3.16Å; M138-L146 HydrophobicContact CE-CD1 3.79Å; M138-L146 HydrophobicContact CE-CD2 3.19Å; M138-L146 HydrophobicContact CE-CG 4Å
139D59.3Low69.3Low128 Ų128107 Ų10768%0.68454%0.539SS*.  trans-55.5142.1178.5-78.2-44.9000112.6D141 K142D139-D141 PolarHBondContact O-N 3.44Å; D139-K142 PolarHBondContact O-N 2.7Å
140I59.1Low68.4Low139 Ų139101.9 Ų101.971%0.71352%0.518SS*.G310 helixtrans-51.7-32.2-174.2-75.7167000113.6K142 I143I140-K142 PolarHBondContact O-N 3.37Å; I140-I143 HydrophobicContact CG1-CD1 4.21Å; I140-I143 WeakPolarHBondContact O-CB 3.4Å; I140-I143 PolarHBondContact O-N 3.18Å
141D64.9Low67.8Low154 Ų154103.6 Ų103.682%0.82453%0.525SS*.G310 helixtrans-71.5-12.3-177.9-59.6-38.5000113.9D139D139-D141 PolarHBondContact O-N 3.44Å
142K64.3Low67.6Low140 Ų140106.2 Ų106.261%0.60954%0.536SS*.G310 helixtrans-1040.4176.1-63.9-178.6-178.2176.70113.2D139 I140 L146D139-K142 PolarHBondContact O-N 2.7Å; I140-K142 PolarHBondContact O-N 3.37Å; K142-L146 VanDerWaalsContact O-CB 3.32Å; K142-L146 WeakPolarHBondContact O-CB 3.37Å; K142-L146 PolarHBondContact O-N 3.01Å
143I63.8Low66.7Low60 Ų60105.4 Ų105.431%0.30853%0.534SS..Hα-helixtrans-75.4-32.4-175.7-68.3-178.8000111.8I140 L146 M147I140-I143 HydrophobicContact CG1-CD1 4.21Å; I140-I143 WeakPolarHBondContact O-CB 3.4Å; I140-I143 PolarHBondContact O-N 3.18Å; I143-L146 PolarHBondContact O-N 3.3Å; I143-M147 HydrophobicContact CG2-CG 3.9Å; I143-M147 VanDerWaalsContact O-CB 3.29Å; I143-M147 WeakPolarHBondContact O-CB 3.34Å; I143-M147 WeakPolarHBondContact O-CG 3.37Å; I143-M147 PolarHBondContact O-N 3.02Å
144D65.4Low66Low133 Ų133104.8 Ų104.871%0.71153%0.531SS*.Hα-helixtrans-68.9-46.1-178.1-79.8-15.3000112.5L146 M147 Q148D144-L146 VanDerWaalsContact C-N 3.3Å; D144-L146 PolarHBondContact O-N 2.88Å; D144-M147 PolarHBondContact O-N 3.26Å; D144-Q148 PolarHBondContact O-N 3.43Å
145D69.8Low65.8Low123 Ų123104.9 Ų104.966%0.65853%0.529SS*.Hα-helixtrans-63.1-38.7174-72.1-16.4000111Q148 D149D145-Q148 PolarHBondContact O-N 3.45Å; D145-D149 PolarHBondContact O-N 3.48Å
146L62.2Low65.8Low36 Ų36106.2 Ų106.219%0.18854%0.54CS..Hα-helixtrans-71.1-35.7178.7-170.282.3000113.1H135 M138 K142 I143 D144 Q148 D149 I150H135-L146 HydrophobicContact CB-CD2 4.25Å; M138-L146 HydrophobicContact CE-CD1 3.79Å; M138-L146 HydrophobicContact CE-CD2 3.19Å; M138-L146 HydrophobicContact CE-CG 4Å; K142-L146 VanDerWaalsContact O-CB 3.32Å; K142-L146 WeakPolarHBondContact O-CB 3.37Å; K142-L146 PolarHBondContact O-N 3.01Å; I143-L146 PolarHBondContact O-N 3.3Å; D144-L146 VanDerWaalsContact C-N 3.3Å; D144-L146 PolarHBondContact O-N 2.88Å; L146-Q148 PolarHBondContact O-N 3.1Å; L146-D149 PolarHBondContact O-N 2.63Å; L146-I150 HydrophobicContact CD2-CD1 3.98Å; L146-I150 HydrophobicContact CG-CD1 3.94Å; L146-I150 HydrophobicContact CG-CG1 4.33Å; L146-I150 WeakPolarHBondContact O-CB 3.24Å; L146-I150 VanDerWaalsContact O-CG1 3.22Å; L146-I150 WeakPolarHBondContact O-CG1 3.41Å; L146-I150 PolarHBondContact O-N 3.26Å
147M64.1Low65.6Low108 Ų108101.8 Ų101.853%0.53253%0.526SS..Hα-helixtrans-63-33.2176.2-82.4-82.7-70.400111I143 D144 T151I143-M147 HydrophobicContact CG2-CG 3.9Å; I143-M147 VanDerWaalsContact O-CB 3.29Å; I143-M147 WeakPolarHBondContact O-CB 3.34Å; I143-M147 WeakPolarHBondContact O-CG 3.37Å; I143-M147 PolarHBondContact O-N 3.02Å; D144-M147 PolarHBondContact O-N 3.26Å; M147-T151 PolarHBondContact O-N 2.94Å; M147-T151 VanDerWaalsContact O-N 3.15Å; M147-T151 PolarHBondContact O-OG1 3.06Å
148Q73.3Confident66Low142 Ų142101.9 Ų101.966%0.66452%0.516SS*.Hα-helixtrans-66.5-47.2172.9-166.5162.9-3.400111.3D144 D145 L146 I150 T151 E152D144-Q148 PolarHBondContact O-N 3.43Å; D145-Q148 PolarHBondContact O-N 3.45Å; L146-Q148 PolarHBondContact O-N 3.1Å; Q148-I150 PolarHBondContact O-N 2.99Å; Q148-T151 PolarHBondContact O-N 3.02Å; Q148-E152 PolarHBondContact O-N 3.49Å
149D67.1Low66.4Low91 Ų91105.2 Ų105.249%0.48753%0.531SS..Hα-helixtrans-63.9-36.5176.7-72.2-8.4000113.2D145 L146 E152 Q153D145-D149 PolarHBondContact O-N 3.48Å; L146-D149 PolarHBondContact O-N 2.63Å; D149-E152 PolarHBondContact O-N 3.44Å; D149-Q153 WeakPolarHBondContact O-CG 3.4Å; D149-Q153 PolarHBondContact O-N 2.87Å
150I64.6Low66.6Low43 Ų43102.8 Ų102.822%0.22152%0.517CS..Hα-helixtrans-68.5-38.9177.9-70.6165.1000111.3H135 L146 Q148 E152 Q153 Q154H135-I150 WeakPolarHBondContact CE1-CD1 3.37Å; H135-I150 WeakPolarHBondContact ND1-CD1 3.42Å; L146-I150 HydrophobicContact CD2-CD1 3.98Å; L146-I150 HydrophobicContact CG-CD1 3.94Å; L146-I150 HydrophobicContact CG-CG1 4.33Å; L146-I150 WeakPolarHBondContact O-CB 3.24Å; L146-I150 VanDerWaalsContact O-CG1 3.22Å; L146-I150 WeakPolarHBondContact O-CG1 3.41Å; L146-I150 PolarHBondContact O-N 3.26Å; Q148-I150 PolarHBondContact O-N 2.99Å; I150-E152 VanDerWaalsContact C-N 3.29Å; I150-Q153 PolarHBondContact O-N 2.74Å; I150-Q154 WeakPolarHBondContact O-CB 3.2Å; I150-Q154 PolarHBondContact O-N 2.82Å
151T68.9Low67Low76 Ų7698.6 Ų98.647%0.46650%0.5SS..Hα-helixtrans-65.7-40.4-179.8-48.20000109.7M147 Q148 Q154 D155M147-T151 PolarHBondContact O-N 2.94Å; M147-T151 VanDerWaalsContact O-N 3.15Å; M147-T151 PolarHBondContact O-OG1 3.06Å; Q148-T151 PolarHBondContact O-N 3.02Å; T151-Q154 PolarHBondContact O-N 3.28Å; T151-D155 PolarHBondContact O-N 2.88Å
152E72.8Confident67.4Low141 Ų14198.2 Ų98.266%0.65949%0.493SS*.Hα-helixtrans-65.3-40.6174.6-145.3169.4-143.600111.8Q148 D149 I150 D155 V156Q148-E152 PolarHBondContact O-N 3.49Å; D149-E152 PolarHBondContact O-N 3.44Å; I150-E152 VanDerWaalsContact C-N 3.29Å; E152-D155 PolarHBondContact O-N 2.86Å; E152-V156 WeakPolarHBondContact O-CG2 3.39Å; E152-V156 PolarHBondContact O-N 3.11Å
153Q58.5Low67.4Low109 Ų10995.1 Ų95.151%0.50949%0.494SS..Hα-helixtrans-73.2-29.2175.8-76.3-174.51.100114.6D149 I150 D155 V156 A157D149-Q153 WeakPolarHBondContact O-CG 3.4Å; D149-Q153 PolarHBondContact O-N 2.87Å; I150-Q153 PolarHBondContact O-N 2.74Å; Q153-D155 VanDerWaalsContact C-N 3.28Å; Q153-V156 PolarHBondContact O-N 2.83Å; Q153-A157 WeakPolarHBondContact O-CB 3.47Å; Q153-A157 PolarHBondContact O-N 2.79Å
154Q66.1Low67.4Low112 Ų11294.8 Ų94.852%0.52349%0.492SS..Hα-helixtrans-65.8-34.3174.5-102.7-167.1-28.900111.7I150 T151 R158I150-Q154 WeakPolarHBondContact O-CB 3.2Å; I150-Q154 PolarHBondContact O-N 2.82Å; T151-Q154 PolarHBondContact O-N 3.28Å; Q154-R158 WeakPolarHBondContact O-CB 3.48Å; Q154-R158 PolarHBondContact O-N 3.36Å
155D70.6Confident67.3Low89 Ų8992.8 Ų92.848%0.47649%0.488SS..Hα-helixtrans-70.2-40.7175-72.4-19.3000111.1T151 E152 Q153 A157 R158 E159T151-D155 PolarHBondContact O-N 2.88Å; E152-D155 PolarHBondContact O-N 2.86Å; Q153-D155 VanDerWaalsContact C-N 3.28Å; D155-A157 PolarHBondContact O-N 2.76Å; D155-R158 PolarHBondContact O-N 2.79Å; D155-R158 IonicContact OD1-NH1 3.49Å; D155-R158 PolarHBondContact OD1-NH1 2.8Å; D155-E159 WeakPolarHBondContact O-CB 3.42Å; D155-E159 PolarHBondContact O-N 3.05Å
156V70.1Confident67Low72 Ų7288.3 Ų88.344%0.43647%0.471SS..Hα-helixtrans-61.8-43.1172.21760000111.9E152 Q153 R158 E159 I160E152-V156 WeakPolarHBondContact O-CG2 3.39Å; E152-V156 PolarHBondContact O-N 3.11Å; Q153-V156 PolarHBondContact O-N 2.83Å; V156-R158 VanDerWaalsContact C-N 3.28Å; V156-R158 PolarHBondContact O-N 2.83Å; V156-E159 PolarHBondContact O-N 2.67Å; V156-I160 HydrophobicContact CG1-CD1 3.8Å; V156-I160 HydrophobicContact CG1-CG1 4.41Å; V156-I160 WeakPolarHBondContact O-CB 3.48Å; V156-I160 VanDerWaalsContact O-CG1 3.22Å; V156-I160 WeakPolarHBondContact O-CG1 3.36Å; V156-I160 PolarHBondContact O-N 2.99Å
157A63.1Low66.5Low38 Ų3892.6 Ų92.631%0.31450%0.501SS..Hα-helixtrans-65.7-32.8177.600000112.5M124 Q153 D155 S161M124-A157 HydrophobicContact CE-CB 4.31Å; Q153-A157 WeakPolarHBondContact O-CB 3.47Å; Q153-A157 PolarHBondContact O-N 2.79Å; D155-A157 PolarHBondContact O-N 2.76Å; A157-S161 WeakPolarHBondContact O-CB 3.4Å; A157-S161 PolarHBondContact O-N 3.31Å
158R75Confident66Low142 Ų14295 Ų9554%0.53651%0.509SS..Hα-helixtrans-72.4-42.3176-160.8179.1-76.5123.5-5.1110.7Q154 D155 V156 S161 E162Q154-R158 WeakPolarHBondContact O-CB 3.48Å; Q154-R158 PolarHBondContact O-N 3.36Å; D155-R158 PolarHBondContact O-N 2.79Å; D155-R158 IonicContact OD1-NH1 3.49Å; D155-R158 PolarHBondContact OD1-NH1 2.8Å; V156-R158 VanDerWaalsContact C-N 3.28Å; V156-R158 PolarHBondContact O-N 2.83Å; R158-S161 PolarHBondContact O-N 3.31Å; R158-E162 WeakPolarHBondContact O-CB 3.22Å; R158-E162 PolarHBondContact O-N 3.49Å
159E70.8Confident65Low134 Ų13490.4 Ų90.463%0.62650%0.5SS*.Hα-helixtrans-60-44.4172.7-174.1179.2-176.100111.8D155 V156 E162 A163D155-E159 WeakPolarHBondContact O-CB 3.42Å; D155-E159 PolarHBondContact O-N 3.05Å; V156-E159 PolarHBondContact O-N 2.67Å; E159-E162 PolarHBondContact O-N 3.47Å; E159-A163 WeakPolarHBondContact O-CB 3.29Å; E159-A163 PolarHBondContact O-N 3.34Å
160I65Low64.3Low77 Ų7793.4 Ų93.440%0.39551%0.511SS..Hα-helixtrans-63.7-44.1175.3-68.7166000111V156 E162 A163 I164V156-I160 HydrophobicContact CG1-CD1 3.8Å; V156-I160 HydrophobicContact CG1-CG1 4.41Å; V156-I160 WeakPolarHBondContact O-CB 3.48Å; V156-I160 VanDerWaalsContact O-CG1 3.22Å; V156-I160 WeakPolarHBondContact O-CG1 3.36Å; V156-I160 PolarHBondContact O-N 2.99Å; I160-E162 VanDerWaalsContact C-N 3.28Å; I160-E162 PolarHBondContact O-N 3.24Å; I160-A163 PolarHBondContact O-N 3.41Å; I160-I164 HydrophobicContact CG2-CD1 3.59Å; I160-I164 HydrophobicContact CG2-CG1 4.38Å; I160-I164 WeakPolarHBondContact O-CB 3.48Å; I160-I164 VanDerWaalsContact O-CG1 3.24Å; I160-I164 WeakPolarHBondContact O-CG1 3.42Å; I160-I164 PolarHBondContact O-N 3.32Å
161S66.7Low63.8Low50 Ų50100.3 Ų100.335%0.3554%0.542SS..Hα-helixtrans-64.5-34.8177.8-174.20000112A157 R158 S165A157-S161 WeakPolarHBondContact O-CB 3.4Å; A157-S161 PolarHBondContact O-N 3.31Å; R158-S161 PolarHBondContact O-N 3.31Å; S161-S165 WeakPolarHBondContact O-CB 3.48Å; S161-S165 PolarHBondContact O-N 3.15Å
162E73.6Confident63.6Low146 Ų146103.3 Ų103.368%0.68255%0.549SS*.Hα-helixtrans-75.8-37.4178.7-160163.7-154.400111.3R158 E159 I160 S165 G166R158-E162 WeakPolarHBondContact O-CB 3.22Å; R158-E162 PolarHBondContact O-N 3.49Å; E159-E162 PolarHBondContact O-N 3.47Å; I160-E162 VanDerWaalsContact C-N 3.28Å; I160-E162 PolarHBondContact O-N 3.24Å; E162-S165 PolarHBondContact O-N 3.38Å; E162-G166 PolarHBondContact O-N 3.4Å
163A63.9Low63.8Low76 Ų76100.9 Ų100.963%0.62854%0.541SS*.Hα-helixtrans-65.1-38.5172.200000112.8E159 I160E159-A163 WeakPolarHBondContact O-CB 3.29Å; E159-A163 PolarHBondContact O-N 3.34Å; I160-A163 PolarHBondContact O-N 3.41Å
164I63.6Low64.6Low53 Ų53103 Ų10327%0.27255%0.551SS.*Hα-helixtrans-80.2-30.6178.3-65.6170.8000111.9N117 V120 I160 F168N117-I164 WeakPolarHBondContact OD1-CG2 3.45Å; V120-I164 HydrophobicContact CG1-CD1 4.37Å; I160-I164 HydrophobicContact CG2-CD1 3.59Å; I160-I164 HydrophobicContact CG2-CG1 4.38Å; I160-I164 WeakPolarHBondContact O-CB 3.48Å; I160-I164 VanDerWaalsContact O-CG1 3.24Å; I160-I164 WeakPolarHBondContact O-CG1 3.42Å; I160-I164 PolarHBondContact O-N 3.32Å; I164-F168 WeakPolarHBondContact O-CE2 3.36Å
165S64Low65.3Low91 Ų91103.3 Ų103.364%0.63656%0.556SS**Hα-helixtrans-92.9-4.9-179.2-170.10000113.7S161 E162S161-S165 WeakPolarHBondContact O-CB 3.48Å; S161-S165 PolarHBondContact O-N 3.15Å; E162-S165 PolarHBondContact O-N 3.38Å
166G63Low66.1Low29 Ų29105.6 Ų105.630%0.29956%0.564SS.*SBendtrans-52.9142168.200000109.5E162 F168E162-G166 PolarHBondContact O-N 3.4Å; G166-F168 PolarHBondContact O-N 2.8Å
167P50.9Low66.9Low125 Ų125106.1 Ų106.181%0.81256%0.564SS**  trans-57.9112.6177.423.6-29.4000107.9G169P167-G169 PolarHBondContact O-N 2.9Å
168F53.6Low67.9Low158 Ų158109.3 Ų109.369%0.69358%0.575SS**SBendtrans-68.258169.1-90.7-88.4000109.8I164 G166I164-F168 WeakPolarHBondContact O-CE2 3.36Å; G166-F168 PolarHBondContact O-N 2.8Å
169G52.3Low68.6Low47 Ų47105.3 Ų105.349%0.48557%0.572SS.*  trans-142.660.7175.700000105.4P167 Q171P167-G169 PolarHBondContact O-N 2.9Å; G169-Q171 PolarHBondContact O-N 2.98Å; G169-Q171 VanDerWaalsContact O-N 3.08Å
170E53.9Low69.4Low153 Ų153104.1 Ų104.172%0.71557%0.567SS**  trans-53.6116152.5-162.9160.3-146.600104.6F172E170-F172 HydrophobicContact CB-CE1 4.33Å; E170-F172 HydrophobicContact CB-CZ 4.46Å; E170-F172 WeakPolarHBondContact O-CD2 3.4Å; E170-F172 PolarHBondContact O-N 3.49Å
171Q53.8Low70.5Confident188 Ų188104.7 Ų104.788%0.87957%0.57SS**  trans-69.384.5173.7-73.6146.6-6.500104.6G169 D173G169-Q171 PolarHBondContact O-N 2.98Å; G169-Q171 VanDerWaalsContact O-N 3.08Å; Q171-D173 PolarHBondContact O-N 3.14Å
172F65.5Low71.6Confident139 Ų139108.7 Ų108.761%0.6158%0.583SS**  trans-52.5126.7175.2-60.2-71000107.3E170 E174 L177E170-F172 HydrophobicContact CB-CE1 4.33Å; E170-F172 HydrophobicContact CB-CZ 4.46Å; E170-F172 WeakPolarHBondContact O-CD2 3.4Å; E170-F172 PolarHBondContact O-N 3.49Å; F172-E174 PolarHBondContact O-N 2.91Å; F172-L177 HydrophobicContact CB-CD1 3.62Å; F172-L177 HydrophobicContact CB-CD2 4.44Å; F172-L177 HydrophobicContact CB-CG 4.06Å; F172-L177 HydrophobicContact CG-CD1 4.38Å
173D76.3Confident72.4Confident90 Ų90107.6 Ų107.648%0.48158%0.578SS.*  trans-68.2119.1177-167.7-19.2000107.4Q171 D175 E176 L177Q171-D173 PolarHBondContact O-N 3.14Å; D173-D175 PolarHBondContact O-N 3.33Å; D173-D175 VanDerWaalsContact O-N 3.16Å; D173-D175 PolarHBondContact OD1-N 3.41Å; D173-D175 VanDerWaalsContact OD1-N 3.09Å; D173-E176 HydrophobicContact CB-CB 3.95Å; D173-E176 WeakPolarHBondContact O-CB 3.39Å; D173-E176 PolarHBondContact O-N 3.1Å; D173-L177 PolarHBondContact O-N 2.87Å
174E74.9Confident73.4Confident154 Ų154108.2 Ų108.272%0.7257%0.57SS**Hα-helixtrans-56.4-31.7179-68.9-178.1179.400110.7F172 L178F172-E174 PolarHBondContact O-N 2.91Å; E174-L178 WeakPolarHBondContact O-CB 3.22Å; E174-L178 WeakPolarHBondContact O-CG 3.49Å; E174-L178 PolarHBondContact O-N 3Å
175D81.3Confident74.5Confident119 Ų119111.6 Ų111.664%0.63659%0.585SS**Hα-helixtrans-70.7-34.6177.5-70.8-20.4000112.2D173 A179D173-D175 PolarHBondContact O-N 3.33Å; D173-D175 VanDerWaalsContact O-N 3.16Å; D173-D175 PolarHBondContact OD1-N 3.41Å; D173-D175 VanDerWaalsContact OD1-N 3.09Å; D175-A179 PolarHBondContact O-N 3.35Å; D175-A179 VanDerWaalsContact O-N 3.13Å
176E87.4Confident75.6Confident137 Ų137112 Ų11264%0.6458%0.577SS**Hα-helixtrans-69.9-45.6176.1-176174-168.600110.9D173 L178 A179 E180D173-E176 HydrophobicContact CB-CB 3.95Å; D173-E176 WeakPolarHBondContact O-CB 3.39Å; D173-E176 PolarHBondContact O-N 3.1Å; E176-L178 VanDerWaalsContact C-N 3.33Å; E176-L178 PolarHBondContact O-N 3.33Å; E176-A179 PolarHBondContact O-N 3.44Å; E176-E180 PolarHBondContact O-N 3.38Å
177L86.6Confident76.5Confident82 Ų82115.7 Ų115.743%0.42959%0.586SS.*Hα-helixtrans-64-36.8176.8-67.9179.1000112.5F172 D173 E180 L181F172-L177 HydrophobicContact CB-CD1 3.62Å; F172-L177 HydrophobicContact CB-CD2 4.44Å; F172-L177 HydrophobicContact CB-CG 4.06Å; F172-L177 HydrophobicContact CG-CD1 4.38Å; D173-L177 PolarHBondContact O-N 2.87Å; L177-E180 PolarHBondContact O-N 3.34Å; L177-L181 WeakPolarHBondContact O-CB 3.44Å; L177-L181 PolarHBondContact O-N 2.91Å
178L83.3Confident78Confident106 Ų106114.6 Ų114.656%0.55557%0.573SS**Hα-helixtrans-66.6-38.6175.2-77.4170.9000112E174 E176 L181 E182E174-L178 WeakPolarHBondContact O-CB 3.22Å; E174-L178 WeakPolarHBondContact O-CG 3.49Å; E174-L178 PolarHBondContact O-N 3Å; E176-L178 VanDerWaalsContact C-N 3.33Å; E176-L178 PolarHBondContact O-N 3.33Å; L178-L181 PolarHBondContact O-N 3.24Å; L178-E182 PolarHBondContact O-N 3.03Å
179A90.7Very high79.3Confident57 Ų57112.6 Ų112.647%0.47157%0.569SS.*Hα-helixtrans-65.7-42.9175.500000111.6D175 E176 E182 E183D175-A179 PolarHBondContact O-N 3.35Å; D175-A179 VanDerWaalsContact O-N 3.13Å; E176-A179 PolarHBondContact O-N 3.44Å; A179-E182 PolarHBondContact O-N 3.44Å; A179-E183 PolarHBondContact O-N 2.87Å
180E87.8Confident80.7Confident110 Ų110116 Ų11651%0.51457%0.571SS.*Hα-helixtrans-63.5-41.8175.3-172179.5178.200111.6E176 L177 E182 E183 L184E176-E180 PolarHBondContact O-N 3.38Å; L177-E180 PolarHBondContact O-N 3.34Å; E180-E182 PolarHBondContact O-N 3.39Å; E180-E183 WeakPolarHBondContact O-CB 3.16Å; E180-E183 PolarHBondContact O-N 2.79Å; E180-L184 WeakPolarHBondContact O-CG 3.29Å; E180-L184 PolarHBondContact O-N 3.49Å
181L88.1Confident81.9Confident88 Ų88115.2 Ų115.246%0.46157%0.567SS.*Hα-helixtrans-62.3-43175.6-177.464.8000111.9L177 L178 E183 L184 E185L177-L181 WeakPolarHBondContact O-CB 3.44Å; L177-L181 PolarHBondContact O-N 2.91Å; L178-L181 PolarHBondContact O-N 3.24Å; L181-E183 VanDerWaalsContact C-N 3.29Å; L181-E183 PolarHBondContact O-N 3.47Å; L181-L184 PolarHBondContact O-N 3.24Å; L181-E185 WeakPolarHBondContact O-CG 3.47Å; L181-E185 PolarHBondContact O-N 3.3Å
182E88.8Confident82.8Confident134 Ų134110.9 Ų110.963%0.62655%0.55SS**Hα-helixtrans-62.4-37.6176.2-176.2173.9-170.400111.6L178 A179 E180 Q186L178-E182 PolarHBondContact O-N 3.03Å; A179-E182 PolarHBondContact O-N 3.44Å; E180-E182 PolarHBondContact O-N 3.39Å; E182-Q186 VanDerWaalsContact O-CB 3.31Å; E182-Q186 WeakPolarHBondContact O-CB 3.4Å; E182-Q186 PolarHBondContact O-N 3.39Å
183E90.8Very high83.2Confident123 Ų123111.2 Ų111.258%0.57556%0.555SS**Hα-helixtrans-62.8-49.2174.6-175.7166-157.800111.4A179 E180 L181 E185 Q186 E187A179-E183 PolarHBondContact O-N 2.87Å; E180-E183 WeakPolarHBondContact O-CB 3.16Å; E180-E183 PolarHBondContact O-N 2.79Å; L181-E183 VanDerWaalsContact C-N 3.29Å; L181-E183 PolarHBondContact O-N 3.47Å; E183-E185 PolarHBondContact O-N 2.84Å; E183-Q186 PolarHBondContact O-N 3.27Å; E183-Q186 VanDerWaalsContact O-N 3.16Å; E183-E187 WeakPolarHBondContact O-CG 3.49Å; E183-E187 PolarHBondContact O-N 3.4Å
184L84.9Confident83Confident89 Ų89115.8 Ų115.847%0.46657%0.571SS.*Hα-helixtrans-60.7-45.1177.6-72.5172.6000112.5E180 L181 Q186 E187 D188E180-L184 WeakPolarHBondContact O-CG 3.29Å; E180-L184 PolarHBondContact O-N 3.49Å; L181-L184 PolarHBondContact O-N 3.24Å; L184-Q186 VanDerWaalsContact C-N 3.26Å; L184-Q186 PolarHBondContact O-N 3.16Å; L184-E187 PolarHBondContact O-N 3.37Å; L184-D188 PolarHBondContact O-N 3.23Å
185E87.3Confident82.7Confident124 Ų124113.2 Ų113.258%0.57957%0.57SS**Hα-helixtrans-61-37.7176-75-173.2170.900111.6L181 E183 L189L181-E185 WeakPolarHBondContact O-CG 3.47Å; L181-E185 PolarHBondContact O-N 3.3Å; E183-E185 PolarHBondContact O-N 2.84Å; E185-L189 WeakPolarHBondContact O-CB 3.3Å; E185-L189 PolarHBondContact O-N 2.88Å
186Q86.2Confident81.8Confident101 Ų101115.1 Ų115.147%0.47258%0.577SS.*Hα-helixtrans-72-34.2178.3-160-178.885.700112.1E182 E183 L184 K190E182-Q186 VanDerWaalsContact O-CB 3.31Å; E182-Q186 WeakPolarHBondContact O-CB 3.4Å; E182-Q186 PolarHBondContact O-N 3.39Å; E183-Q186 PolarHBondContact O-N 3.27Å; E183-Q186 VanDerWaalsContact O-N 3.16Å; L184-Q186 VanDerWaalsContact C-N 3.26Å; L184-Q186 PolarHBondContact O-N 3.16Å; Q186-K190 WeakPolarHBondContact O-CB 3.38Å; Q186-K190 WeakPolarHBondContact O-CD 3.32Å; Q186-K190 WeakPolarHBondContact O-CG 3.45Å; Q186-K190 PolarHBondContact O-N 3.44Å
187E82.7Confident80.3Confident105 Ų105111.7 Ų111.749%0.49158%0.579SS.*Hα-helixtrans-63.2-48.6170.9-72.7-168161.700111.6E183 L184 L189 K190 E191E183-E187 WeakPolarHBondContact O-CG 3.49Å; E183-E187 PolarHBondContact O-N 3.4Å; L184-E187 PolarHBondContact O-N 3.37Å; E187-L189 VanDerWaalsContact C-N 3.3Å; E187-L189 PolarHBondContact O-N 3.01Å; E187-K190 WeakPolarHBondContact O-CB 3.5Å; E187-K190 PolarHBondContact O-N 2.94Å; E187-K190 VanDerWaalsContact O-N 3.13Å; E187-E191 PolarHBondContact O-N 3.23Å
188D81.8Confident79.1Confident102 Ų102111.1 Ų111.155%0.54559%0.593SS.*Hα-helixtrans-59.2-40.6175.7-88-1.3000111.8L184 E191 N192L184-D188 PolarHBondContact O-N 3.23Å; D188-E191 PolarHBondContact O-N 3.13Å; D188-N192 VanDerWaalsContact O-CB 3.25Å; D188-N192 WeakPolarHBondContact O-CB 3.14Å; D188-N192 PolarHBondContact O-N 3.37Å; D188-N192 PolarHBondContact O-ND2 2.93Å
189L80.4Confident78.1Confident116 Ų116114.3 Ų114.361%0.60761%0.609SS**Hα-helixtrans-67.2-40.1177-142.787.3000111.8E185 E187 M193E185-L189 WeakPolarHBondContact O-CB 3.3Å; E185-L189 PolarHBondContact O-N 2.88Å; E187-L189 VanDerWaalsContact C-N 3.3Å; E187-L189 PolarHBondContact O-N 3.01Å; L189-M193 WeakPolarHBondContact O-CB 3.3Å; L189-M193 PolarHBondContact O-N 3.37Å
190K81.6Confident76.9Confident118 Ų118117.2 Ų117.251%0.51362%0.623SS.*Hα-helixtrans-65.3-42.3175.6-75.4164.6-172.9152.40110.6Q186 E187 M193 K194Q186-K190 WeakPolarHBondContact O-CB 3.38Å; Q186-K190 WeakPolarHBondContact O-CD 3.32Å; Q186-K190 WeakPolarHBondContact O-CG 3.45Å; Q186-K190 PolarHBondContact O-N 3.44Å; E187-K190 WeakPolarHBondContact O-CB 3.5Å; E187-K190 PolarHBondContact O-N 2.94Å; E187-K190 VanDerWaalsContact O-N 3.13Å; K190-M193 PolarHBondContact O-N 3.42Å; K190-K194 VanDerWaalsContact O-CB 3.28Å; K190-K194 WeakPolarHBondContact O-CB 3.5Å; K190-K194 PolarHBondContact O-N 3.41Å
191E80.2Confident76.1Confident137 Ų137117.6 Ų117.664%0.6464%0.638SS**Hα-helixtrans-65.4-45.7176.4-169.8173.9179.600111.1E187 D188 M193 K194 S195E187-E191 PolarHBondContact O-N 3.23Å; D188-E191 PolarHBondContact O-N 3.13Å; E191-M193 PolarHBondContact O-N 3.18Å; E191-K194 CarbonylContact O-C 3.56Å; E191-K194 WeakPolarHBondContact O-CB 3.41Å; E191-K194 PolarHBondContact O-N 2.87Å; E191-S195 WeakPolarHBondContact O-CB 3.46Å; E191-S195 PolarHBondContact O-N 3.43Å
192N73.3Confident74.7Confident97 Ų97119.4 Ų119.452%0.51965%0.653SS.*Hα-helixtrans-63.2-38.9175.1-82.2-32.8000112.7D188 S195 M196D188-N192 VanDerWaalsContact O-CB 3.25Å; D188-N192 WeakPolarHBondContact O-CB 3.14Å; D188-N192 PolarHBondContact O-N 3.37Å; D188-N192 PolarHBondContact O-ND2 2.93Å; N192-S195 PolarHBondContact O-N 2.95Å; N192-M196 WeakPolarHBondContact O-CB 3.2Å; N192-M196 PolarHBondContact O-N 3.37Å
193M74Confident73.7Confident146 Ų146118.8 Ų118.872%0.71966%0.66SS**Hα-helixtrans-66.2-38.4172.9-90.9-155.4170.800112.3L189 K190 E191 S195 M196L189-M193 WeakPolarHBondContact O-CB 3.3Å; L189-M193 PolarHBondContact O-N 3.37Å; K190-M193 PolarHBondContact O-N 3.42Å; E191-M193 PolarHBondContact O-N 3.18Å; M193-S195 VanDerWaalsContact C-N 3.26Å; M193-S195 PolarHBondContact O-N 3.14Å; M193-M196 CarbonylContact O-C 3.59Å; M193-M196 PolarHBondContact O-N 2.85Å
194K70.4Confident72.2Confident186 Ų186119 Ų11981%0.80968%0.675SS**Hα-helixtrans-66.8-32.4175.4-167.7177.1-179.6-1760111.4K190 E191K190-K194 VanDerWaalsContact O-CB 3.28Å; K190-K194 WeakPolarHBondContact O-CB 3.5Å; K190-K194 PolarHBondContact O-N 3.41Å; E191-K194 CarbonylContact O-C 3.56Å; E191-K194 WeakPolarHBondContact O-CB 3.41Å; E191-K194 PolarHBondContact O-N 2.87Å
195S69.7Low71.1Confident101 Ų101119.3 Ų119.371%0.70669%0.685SS**Hα-helixtrans-75.7-36.2174.6-1620000112.5E191 N192 M193 G197E191-S195 WeakPolarHBondContact O-CB 3.46Å; E191-S195 PolarHBondContact O-N 3.43Å; N192-S195 PolarHBondContact O-N 2.95Å; M193-S195 VanDerWaalsContact C-N 3.26Å; M193-S195 PolarHBondContact O-N 3.14Å; S195-G197 PolarHBondContact O-N 3.15Å
196M63.1Low69.7Low158 Ų158123 Ų12378%0.77870%0.699SS**SBendtrans-80.148172.7-75.7-157.7-154.900113.4N192 M193 G198N192-M196 WeakPolarHBondContact O-CB 3.2Å; N192-M196 PolarHBondContact O-N 3.37Å; M193-M196 CarbonylContact O-C 3.59Å; M193-M196 PolarHBondContact O-N 2.85Å; M196-G198 PolarHBondContact O-N 3.36Å; M196-G198 VanDerWaalsContact O-N 3.1Å
197G54.8Low68.1Low66 Ų66126 Ų12668%0.6872%0.718SS**  trans-43.6117.8-179.200000114.3S195S195-G197 PolarHBondContact O-N 3.15Å
198G62.1Low66.7Low70 Ų70127.1 Ų127.172%0.72273%0.734SS**  trans71.290.7159.500000116.4M196M196-G198 PolarHBondContact O-N 3.36Å; M196-G198 VanDerWaalsContact O-N 3.1Å
199L61.6Low65.3Low172 Ų172128.2 Ų128.290%0.90175%0.75SS**PPolyproline II helixtrans-59.2128.7162.6-72.4165.8000109.8
200P64.6Low63.4Low118 Ų118127.8 Ų127.877%0.76676%0.756SS**PPolyproline II helixtrans-66139.6177.425.3-32.3000111V202P200-V202 PolarHBondContact O-N 3.02Å
201S71.1Confident61.3Low119 Ų119133.4 Ų133.483%0.83277%0.774SS**PPolyproline II helixtrans-55.7125.1-179.6-173.80000111.6
202V59.9Low59.7Low126 Ų126132.8 Ų132.876%0.76478%0.782SS**PPolyproline II helixtrans-63.7131.1177.3-89.90000110.6P200 S204P200-V202 PolarHBondContact O-N 3.02Å; V202-S204 PolarHBondContact O-N 2.99Å
203P66.5Low57.9Low120 Ų120133.7 Ų133.778%0.77980%0.796SS**PPolyproline II helixtrans-65.4119.8178.9-17.129000111.5S205P203-S205 PolarHBondContact O-N 3.21Å
204S60.8Low56.1Low127 Ų127138.2 Ų138.289%0.88881%0.805SS**  trans-8144.8179.3-173.80000113.5V202V202-S204 PolarHBondContact O-N 2.99Å
205S61.4Low54.8Low96 Ų96133.5 Ų133.567%0.67180%0.801SS**  trans-89.7115.6177.4176.90000110.9P203 L207P203-S205 PolarHBondContact O-N 3.21Å; S205-L207 PolarHBondContact O-N 3.05Å
206K56.7Low53.2Low203 Ų203135.6 Ų135.688%0.88381%0.81SS**PPolyproline II helixtrans-66.7118172.2-75-178.8178.8179.70109.5
207L54.3Low52.3Low164 Ų164134.5 Ų134.586%0.85981%0.812SS**PPolyproline II helixtrans-68.7134.2174.1-69.9165.2000110.8S205S205-L207 PolarHBondContact O-N 3.05Å
208P51.9Low51.7Low128 Ų128141.3 Ų141.383%0.83182%0.823SS**PPolyproline II helixtrans-72130172.527.5-30.7000111
209S53.3Low50.6Low125 Ų125145.9 Ų145.987%0.87482%0.823SS**PPolyproline II helixtrans-77.4123173.2177.80000110.6
210S40Very low49.7Very low107 Ų107148.8 Ų148.875%0.74882%0.822SS**  trans-179.7104148.9164.80000113.6
211R36.8Very low49Very low235 Ų235148.3 Ų148.389%0.88782%0.817SS**  64.6137.7128.7-149.3169165.6-166.4-5.8121.3
212P46.5Very low47.9Very low125 Ų125148.3 Ų148.381%0.81280%0.804SS**  trans-92.5142.2-168.136.1-32.9000114
213S36.7Very low47.4Very low116 Ų116148.2 Ų148.281%0.81180%0.798SS**  trans-131.8106.3164.163.80000112.4
214R36.3Very low46.8Very low241 Ų241148.2 Ų148.291%0.90979%0.792SS**  trans32.9113.3135.7-163169.6-176.7-177.20.2120.2
215A42.4Very low46.5Very low87 Ų87147 Ų14772%0.71978%0.776SS**  trans52126.313600000121.6
216T36.5Very low46.3Very low145 Ų145147.5 Ų147.589%0.8977%0.771SS**  -155.3132.5126.341.70000111.9
217T44.2Very low46.4Very low134 Ų134142.5 Ų142.582%0.82276%0.757SS**  trans-72.713416537.30000111.5
218K41.9Very low46.9Very low210 Ų210143.9 Ų143.991%0.91375%0.751SS**  trans173.7112.5146.3-102171.5-176.4-176.40112.1
219K38.3Very low47.4Very low166 Ų166144.3 Ų144.372%0.72274%0.743SS**  trans177110.1132.3-118.6-173.3173.7-167.90109.5E222K219-E222 IonicContact NZ-OE1 2.7Å; K219-E222 PolarHBondContact NZ-OE1 3Å
220R44.5Very low47.6Very low232 Ų232145.4 Ų145.488%0.87574%0.739SS**  trans-141.180.9163.5-176.5-178.7-176.3-110.5-4.4106.2
221V48.2Very low48.9Very low109 Ų109144 Ų14466%0.66173%0.733SS**  trans-144.4-9.6172.1-164.60000112
222E49.3Very low50.5Low119 Ų119136.4 Ų136.456%0.55672%0.716SS**G310 helixtrans-81.6-16.6-174.5-81.8165.8-17900115K219 D224K219-E222 IonicContact NZ-OE1 2.7Å; K219-E222 PolarHBondContact NZ-OE1 3Å; E222-D224 PolarHBondContact O-N 3.24Å
223D49.4Very low51.3Low123 Ų123141.7 Ų141.766%0.65872%0.72SS**G310 helixtrans-79.6-8.8-175.1-74.7-23.6000114.6V227D223-V227 WeakPolarHBondContact O-CG2 3.47Å
224D53.8Low52.6Low120 Ų120139.3 Ų139.364%0.64271%0.714SS**G310 helixtrans-92.1-21.8-177.2-80.6-20.9000113.4E222E222-D224 PolarHBondContact O-N 3.24Å
225D53.4Low53.1Low103 Ų103137.4 Ų137.455%0.55173%0.729SS**Hα-helixtrans-80.4-32.3-178.7-69.9-36.8000111.9R228 M229D225-R228 PolarHBondContact O-N 3.16Å; D225-M229 PolarHBondContact O-N 3.47Å
226D56.9Low53.6Low106 Ų106140 Ų14057%0.56773%0.73SS**Hα-helixtrans-70.9-31.9178.2-69-22.7000112.6R228 M229 L230D226-R228 VanDerWaalsContact C-N 3.31Å; D226-M229 PolarHBondContact O-N 3.15Å; D226-L230 PolarHBondContact O-N 3.24Å
227V59.6Low54.5Low98 Ų98139.7 Ų139.759%0.59472%0.721SS**Hα-helixtrans-73-28.1177.2-152.30000111.4D223D223-V227 WeakPolarHBondContact O-CG2 3.47Å
228R64.1Low55.1Low193 Ų193140 Ų14073%0.72872%0.716SS**Hα-helixtrans-77.2-31.4176.4-77.4178.4170.2174.2-1.4112.5D225 D226 L230 A231D225-R228 PolarHBondContact O-N 3.16Å; D226-R228 VanDerWaalsContact C-N 3.31Å; R228-L230 VanDerWaalsContact C-N 3.32Å; R228-L230 PolarHBondContact O-N 3.19Å; R228-A231 PolarHBondContact O-N 2.81Å
229M63.3Low55.8Low136 Ų136135.9 Ų135.967%0.6770%0.704SS**Hα-helixtrans-68.9-27.3173.5-99.5-139.7-109.400113.6D225 D226 S232D225-M229 PolarHBondContact O-N 3.47Å; D226-M229 PolarHBondContact O-N 3.15Å; M229-S232 PolarHBondContact O-OG 3.02Å; M229-S232 VanDerWaalsContact O-OG 3.07Å
230L58.1Low56.9Low149 Ų149134 Ų13478%0.7870%0.703SS**Hα-helixtrans-77.6-20.7178.4-115.2132.7000113.8D226 R228D226-L230 PolarHBondContact O-N 3.24Å; R228-L230 VanDerWaalsContact C-N 3.32Å; R228-L230 PolarHBondContact O-N 3.19Å
231A67.3Low57.8Low76 Ų76127.5 Ų127.563%0.62869%0.692SS**SBendtrans-83.9-15.318000000113.7R228R228-A231 PolarHBondContact O-N 2.81Å
232S70.6Confident58.4Low77 Ų77128.8 Ų128.854%0.53869%0.694SS.*THydrogen-bonded Turntrans-89.5-6.8-17859.80000114.5M229M229-S232 PolarHBondContact O-OG 3.02Å; M229-S232 VanDerWaalsContact O-OG 3.07Å
233W62.8Low59.1Low236 Ų236129.5 Ų129.589%0.89471%0.705SS**THydrogen-bonded Turntrans-999.3178.3-81.574000113.7
234G64.4Low60Low65 Ų65130.1 Ų130.167%0.6771%0.708SS**  trans-121.634.4-173.200000115
235T45.1Very low60.5Low202 Ų202131 Ų131100%1.23972%0.715SS**  trans-126.80166.255.70000110.8

Retrieved 235 of 235 residues in 45.2 ms (Link to these results)