A0A087YN83_POEFO Loading...

Regulator of G protein signaling 7 binding protein a

AlphaFold DB , UniProt , Accession A0A087YN83, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 252 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M35.9Very low42.3Very low235 Ų235155.9 Ų155.9100%1.15886%0.862SS**  093.30-59.3177.773.400105.9
2S39.1Very low42.9Very low115 Ų115153.5 Ų153.580%0.80486%0.859SS**  53.6117.5101.3-49.70000110.8
3S40.8Very low43.1Very low121 Ų121156.6 Ų156.685%0.84685%0.849SS**  -165.7149.962.7-59.40000112.5
4A41.3Very low43.1Very low101 Ų101154.1 Ų154.184%0.83585%0.85SS**  trans-82.9158.717100000112.4
5S45.8Very low43.3Very low120 Ų120150.6 Ų150.684%0.83985%0.849SS**  trans-122.2113.916261.50000110.9
6N38.6Very low42.9Very low173 Ų173145.8 Ų145.893%0.92584%0.843SS**  trans-66.1136.3172.8-87.5-38.8000112.1
7G44.3Very low42.9Very low78 Ų78145.8 Ų145.880%0.80484%0.839SS**  trans-143.190.9167.200000111.3
8R48.3Very low42.9Very low245 Ų245145.8 Ų145.893%0.92583%0.834SS**  trans-67.8132.7167.4-86176.8167.9174.2-3.8109.6
9K46.8Very low43.2Very low196 Ų196147.4 Ų147.485%0.85283%0.831SS**  trans-156.8105.5150.4-105165.4-170.4-176.10111.4
10N37.8Very low43.1Very low157 Ų157149.5 Ų149.584%0.8483%0.834SS**  trans42.5125143.6-56.2-18.7000122.2
11R46.9Very low43.3Very low174 Ų174149.2 Ų149.266%0.65783%0.829SS**  trans-66.8159.5164-141.8-174.9-162.8156.96.8111.3R13R11-R13 VanDerWaalsContact NH1-NE 3.15Å
12P49.7Very low43.6Very low127 Ų127141 Ų14183%0.82581%0.805SS**  -127.2138.8109.121.8-6.1000112.5
13R44.4Very low44Very low194 Ų194144.9 Ų144.973%0.73281%0.807SS**  trans-79.2122.6169.1-126.1173.5-166.7-179.17.3106R11R11-R13 VanDerWaalsContact NH1-NE 3.15Å
14S44.1Very low44.4Very low122 Ų122144.3 Ų144.385%0.85380%0.801SS**  trans-112.7119.2155.4-1600000107.5
15A46Very low44.7Very low101 Ų101144.9 Ų144.984%0.83580%0.796SS**  trans-85.8138.1173.100000108.4
16G37.3Very low44.8Very low73 Ų73148.6 Ų148.675%0.75379%0.793SS**  trans165.376.6174.200000114
17N42Very low45.4Very low146 Ų146148.5 Ų148.578%0.78178%0.78SS**  trans39.4131.3135.7-134.25.6000120.5
18I42.2Very low45.3Very low147 Ų147149 Ų14975%0.75476%0.764SS**  150121.2128.4-73153.2000110.1Q20I18-Q20 PolarHBondContact O-N 3.4Å
19F49.1Very low45.6Very low176 Ų176140.7 Ų140.777%0.77274%0.742SS**  trans-32.7121.9169.5-71.1-100.8000114.2I21F19-I21 HydrophobicContact CB-CD1 4.4Å; F19-I21 HydrophobicContact CD1-CD1 4.13Å
20Q42.3Very low45.9Very low189 Ų189138.7 Ų138.788%0.88374%0.735SS**  trans-111.592.9151.1-70.4-16212.400108.3I18 G22I18-Q20 PolarHBondContact O-N 3.4Å; Q20-G22 VanDerWaalsContact C-N 3.27Å; Q20-G22 PolarHBondContact O-N 3.39Å
21I45.8Very low46.7Very low143 Ų143140.7 Ų140.773%0.73373%0.731SS**  trans-57.699.8152.4-84.2105.9000106F19 K23F19-I21 HydrophobicContact CB-CD1 4.4Å; F19-I21 HydrophobicContact CD1-CD1 4.13Å; I21-K23 PolarHBondContact O-N 3.05Å
22G42.1Very low47.1Very low64 Ų64139.3 Ų139.366%0.6673%0.726SS**  trans-64.2121.2167.400000108.2Q20Q20-G22 VanDerWaalsContact C-N 3.27Å; Q20-G22 PolarHBondContact O-N 3.39Å
23K49.2Very low47.4Very low195 Ų195140 Ų14085%0.84872%0.718SS**  trans-45.6138.3174-71.8171.8175.1175.70110.3I21I21-K23 PolarHBondContact O-N 3.05Å
24P47.9Very low48.2Very low110 Ų110134.1 Ų134.171%0.71471%0.707SS**  trans-59.914817227-32.5000108.9Y26P24-Y26 PolarHBondContact O-N 3.22Å
25P47.8Very low49.3Very low113 Ų113131.8 Ų131.873%0.73469%0.688SS**  trans-57.1119170.724.8-31.4000107R27P25-R27 PolarHBondContact O-N 3.1Å
26Y47.7Very low50.5Low197 Ų197130.2 Ų130.277%0.77366%0.663SS**  trans-59.893.8170.4-173.8-93.4000106.6P24 D28P24-Y26 PolarHBondContact O-N 3.22Å; Y26-D28 PolarHBondContact O-N 3.05Å; Y26-D28 VanDerWaalsContact O-N 3.1Å
27R51.1Low52.2Low172 Ų172129.8 Ų129.865%0.64965%0.649SS**  trans-72.8103.7171.4-86.1-164.9179.1-169.25.1105.6P25 P29 R32P25-R27 PolarHBondContact O-N 3.1Å; R27-P29 WeakPolarHBondContact O-CD 3.31Å; R27-R32 VanDerWaalsContact NH1-CZ 3.3Å
28D43.5Very low53.8Low88 Ų88125.7 Ų125.747%0.47163%0.629SS.*  trans-40.4105.7174.9-152.2-23.7000110.9Y26 Q30Y26-D28 PolarHBondContact O-N 3.05Å; Y26-D28 VanDerWaalsContact O-N 3.1Å; D28-Q30 PolarHBondContact O-N 2.8Å
29P54.5Low55.6Low71 Ų71125.2 Ų125.246%0.46162%0.617SS.*Hα-helixtrans-60.6-32.6-177.7-22.232.9000111.5R27 R31 R32 E33R27-P29 WeakPolarHBondContact O-CD 3.31Å; P29-R31 PolarHBondContact O-N 2.82Å; P29-R32 PolarHBondContact O-N 2.87Å; P29-E33 PolarHBondContact O-N 3.23Å; P29-E33 VanDerWaalsContact O-N 3.16Å
30Q52.2Low57.2Low153 Ų153122.8 Ų122.872%0.71561%0.607SS**Hα-helixtrans-68.9-33.7-171.2-161160.9-900112.9D28 S34D28-Q30 PolarHBondContact O-N 2.8Å; Q30-S34 PolarHBondContact O-N 2.89Å
31R54.1Low59.1Low200 Ų200114.7 Ų114.776%0.75557%0.572SS**Hα-helixtrans-71.4-33.3176.4-173.7-179.3-81.3-148.1-2.1112.5P29 T35P29-R31 PolarHBondContact O-N 2.82Å; R31-T35 PolarHBondContact O-OG1 3.49Å
32R55.2Low61Low144 Ų144113.9 Ų113.954%0.54357%0.565SS.*Hα-helixtrans-75.3-37.6177.4-67.9-155.6-153.2167.620.1112.2R27 P29 T35 E36R27-R32 VanDerWaalsContact NH1-CZ 3.3Å; P29-R32 PolarHBondContact O-N 2.87Å; R32-T35 PolarHBondContact O-N 3.26Å; R32-T35 PolarHBondContact O-OG1 3.24Å; R32-E36 PolarHBondContact O-N 3.3Å; R32-E36 VanDerWaalsContact O-N 3.13Å
33E57.3Low63.3Low142 Ų142116.9 Ų116.966%0.66456%0.557SS**Hα-helixtrans-66.8-40.1-178.3-159.3161.1-149.300111.7P29 T35 E36 S37P29-E33 PolarHBondContact O-N 3.23Å; P29-E33 VanDerWaalsContact O-N 3.16Å; E33-T35 PolarHBondContact O-N 3.26Å; E33-E36 PolarHBondContact O-N 2.89Å; E33-S37 PolarHBondContact O-N 2.82Å; E33-S37 PolarHBondContact O-OG 2.85Å
34S60.2Low65.3Low71 Ų71109.2 Ų109.250%0.49753%0.53SS..Hα-helixtrans-61-40.4173178.10000113.1Q30 S37 T38Q30-S34 PolarHBondContact O-N 2.89Å; S34-S37 PolarHBondContact O-OG 2.86Å; S34-T38 PolarHBondContact O-N 3.34Å; S34-T38 PolarHBondContact O-OG1 3.49Å
35T67.3Low67.4Low73 Ų73104.8 Ų104.845%0.44850%0.5SS..Hα-helixtrans-71.7-30.3177.153.20000113.6R31 R32 E33 R39R31-T35 PolarHBondContact O-OG1 3.49Å; R32-T35 PolarHBondContact O-N 3.26Å; R32-T35 PolarHBondContact O-OG1 3.24Å; E33-T35 PolarHBondContact O-N 3.26Å; T35-R39 VanDerWaalsContact O-CG 3.32Å; T35-R39 WeakPolarHBondContact O-CG 3.34Å; T35-R39 PolarHBondContact O-N 3.45Å
36E71.3Confident69.6Low67 Ų67101.6 Ų101.631%0.31348%0.483SS..Hα-helixtrans-79.3-36.6178.9-173.955.3-146.100111.6R32 E33 R39 K40 R43R32-E36 PolarHBondContact O-N 3.3Å; R32-E36 VanDerWaalsContact O-N 3.13Å; E33-E36 PolarHBondContact O-N 2.89Å; E36-R39 PolarHBondContact O-N 3.36Å; E36-K40 HydrophobicContact CG-CD 4.34Å; E36-K40 WeakPolarHBondContact O-CB 3.31Å; E36-K40 WeakPolarHBondContact O-CG 3.37Å; E36-K40 PolarHBondContact O-N 3.17Å; E36-K40 WeakPolarHBondContact OE1-CE 3.34Å; E36-R43 IonicContact OE1-NH1 2.68Å; E36-R43 PolarHBondContact OE1-NH1 3.1Å
37S72.3Confident71.8Confident65 Ų6596 Ų9646%0.45547%0.467SS..Hα-helixtrans-63.5-42.7174.565.30000111.9E33 S34 R39 K40 A41E33-S37 PolarHBondContact O-N 2.82Å; E33-S37 PolarHBondContact O-OG 2.85Å; S34-S37 PolarHBondContact O-OG 2.86Å; S37-R39 PolarHBondContact O-N 3.3Å; S37-K40 PolarHBondContact O-N 3.07Å; S37-A41 WeakPolarHBondContact O-CB 3.41Å; S37-A41 PolarHBondContact O-N 3.19Å
38T76.4Confident74Confident60 Ų6087.8 Ų87.837%0.36844%0.436SS..Hα-helixtrans-61.4-43175.1-53.50000112.1S34 A41 Q42S34-T38 PolarHBondContact O-N 3.34Å; S34-T38 PolarHBondContact O-OG1 3.49Å; T38-A41 PolarHBondContact O-N 3.18Å; T38-Q42 WeakPolarHBondContact O-CG 3.41Å; T38-Q42 PolarHBondContact O-N 3.27Å
39R80.3Confident76.5Confident136 Ų13688.6 Ų88.651%0.51343%0.432SS..Hα-helixtrans-65.2-39.3177.1-73.5173-179.2174.5-0.3112.1T35 E36 S37 Q42 R43T35-R39 VanDerWaalsContact O-CG 3.32Å; T35-R39 WeakPolarHBondContact O-CG 3.34Å; T35-R39 PolarHBondContact O-N 3.45Å; E36-R39 PolarHBondContact O-N 3.36Å; S37-R39 PolarHBondContact O-N 3.3Å; R39-Q42 PolarHBondContact O-N 3.09Å; R39-R43 WeakPolarHBondContact O-CG 3.33Å; R39-R43 PolarHBondContact O-N 2.79Å
40K82.9Confident78.6Confident126 Ų12690.9 Ų90.955%0.54844%0.438SS..Hα-helixtrans-63.9-44.6174.7-74.6174.1177.7178.40111.7E36 S37 Q42 R43 A44E36-K40 HydrophobicContact CG-CD 4.34Å; E36-K40 WeakPolarHBondContact O-CB 3.31Å; E36-K40 WeakPolarHBondContact O-CG 3.37Å; E36-K40 PolarHBondContact O-N 3.17Å; E36-K40 WeakPolarHBondContact OE1-CE 3.34Å; S37-K40 PolarHBondContact O-N 3.07Å; K40-Q42 VanDerWaalsContact C-N 3.35Å; K40-Q42 PolarHBondContact O-N 3.08Å; K40-R43 PolarHBondContact O-N 3.18Å; K40-A44 PolarHBondContact O-N 3.23Å
41A82.6Confident80.8Confident18 Ų1885.5 Ų85.515%0.14941%0.414CS..Hα-helixtrans-61.3-42.7175.800000111.9S37 T38 R43 A44 V45 W108S37-A41 WeakPolarHBondContact O-CB 3.41Å; S37-A41 PolarHBondContact O-N 3.19Å; T38-A41 PolarHBondContact O-N 3.18Å; A41-R43 PolarHBondContact O-N 3.44Å; A41-A44 PolarHBondContact O-N 3.06Å; A41-V45 WeakPolarHBondContact O-CG2 3.47Å; A41-V45 PolarHBondContact O-N 3.45Å; A41-W108 HydrophobicContact CB-CZ2 4.28Å
42Q85.4Confident82.9Confident126 Ų12676 Ų7659%0.58938%0.378SS*.Hα-helixtrans-62.1-41.7175.9-76176.7-15.500112.9T38 R39 K40 V45 A46T38-Q42 WeakPolarHBondContact O-CG 3.41Å; T38-Q42 PolarHBondContact O-N 3.27Å; R39-Q42 PolarHBondContact O-N 3.09Å; K40-Q42 VanDerWaalsContact C-N 3.35Å; K40-Q42 PolarHBondContact O-N 3.08Å; Q42-V45 PolarHBondContact O-N 3.36Å; Q42-A46 PolarHBondContact O-N 2.96Å
43R90.1Very high85Confident128 Ų12873.7 Ų73.748%0.48337%0.374SS..Hα-helixtrans-62.2-46.3174.2-70.1178.1-156.3118.1-2.9111.1E36 R39 K40 A41 V45 A46 D47E36-R43 IonicContact OE1-NH1 2.68Å; E36-R43 PolarHBondContact OE1-NH1 3.1Å; R39-R43 WeakPolarHBondContact O-CG 3.33Å; R39-R43 PolarHBondContact O-N 2.79Å; K40-R43 PolarHBondContact O-N 3.18Å; A41-R43 PolarHBondContact O-N 3.44Å; R43-V45 VanDerWaalsContact C-N 3.31Å; R43-V45 PolarHBondContact O-N 3.22Å; R43-A46 WeakPolarHBondContact O-CA 3.5Å; R43-A46 WeakPolarHBondContact O-CB 3.48Å; R43-A46 PolarHBondContact O-N 3.08Å; R43-D47 VanDerWaalsContact O-CG 3.3Å; R43-D47 PolarHBondContact O-N 3.19Å
44A90.6Very high86.9Confident34 Ų3470.7 Ų70.728%0.28136%0.359SS..Hα-helixtrans-58.9-42177.800000112.3K40 A41 A46 D47 C48 I104K40-A44 PolarHBondContact O-N 3.23Å; A41-A44 PolarHBondContact O-N 3.06Å; A44-A46 VanDerWaalsContact C-N 3.35Å; A44-A46 PolarHBondContact O-N 2.86Å; A44-D47 PolarHBondContact O-N 3.23Å; A44-C48 WeakPolarHBondContact O-CB 3.47Å; A44-C48 PolarHBondContact O-N 3.22Å; A44-I104 HydrophobicContact CB-CD1 4.22Å; A44-I104 HydrophobicContact CB-CG1 3.89Å; A44-I104 WeakPolarHBondContact O-CD1 3.5Å
45V91.9Very high88.8Confident17 Ų1767.3 Ų67.310%0.10334%0.336CS..Hα-helixtrans-62.5-40.4174.2172.50000111.8A41 Q42 R43 R49 I104 E117 I118 L121A41-V45 WeakPolarHBondContact O-CG2 3.47Å; A41-V45 PolarHBondContact O-N 3.45Å; Q42-V45 PolarHBondContact O-N 3.36Å; R43-V45 VanDerWaalsContact C-N 3.31Å; R43-V45 PolarHBondContact O-N 3.22Å; V45-R49 PolarHBondContact O-N 3.17Å; V45-I104 HydrophobicContact CG2-CD1 4.42Å; V45-I104 HydrophobicContact CG2-CG2 3.73Å; V45-E117 HydrophobicContact CG1-CG 4.31Å; V45-I118 HydrophobicContact CG2-CG1 4.43Å; V45-L121 HydrophobicContact CG1-CD1 4.23Å
46A94Very high90.2Very high45 Ų4566.2 Ų66.237%0.37233%0.327SS..Hα-helixtrans-65.3-42.7176.200000111.9Q42 R43 A44 R49 M50Q42-A46 PolarHBondContact O-N 2.96Å; R43-A46 WeakPolarHBondContact O-CA 3.5Å; R43-A46 WeakPolarHBondContact O-CB 3.48Å; R43-A46 PolarHBondContact O-N 3.08Å; A44-A46 VanDerWaalsContact C-N 3.35Å; A44-A46 PolarHBondContact O-N 2.86Å; A46-R49 WeakPolarHBondContact O-CB 3.37Å; A46-R49 PolarHBondContact O-N 3.27Å; A46-M50 WeakPolarHBondContact O-CG 3.4Å; A46-M50 PolarHBondContact O-N 3.21Å; A46-M50 VanDerWaalsContact O-N 3.12Å
47D94.9Very high91.5Very high80 Ų8066.2 Ų66.243%0.42833%0.332SS..Hα-helixtrans-63.1-45.6176.5-64-25.2000111R43 A44 R49 M50 I51R43-D47 VanDerWaalsContact O-CG 3.3Å; R43-D47 PolarHBondContact O-N 3.19Å; A44-D47 PolarHBondContact O-N 3.23Å; D47-R49 VanDerWaalsContact C-N 3.31Å; D47-R49 PolarHBondContact O-N 2.89Å; D47-M50 HydrophobicContact CB-CE 4.49Å; D47-M50 WeakPolarHBondContact O-CB 3.49Å; D47-M50 PolarHBondContact O-N 3.23Å; D47-M50 WeakPolarHBondContact OD1-CE 3.47Å; D47-I51 WeakPolarHBondContact O-CG1 3.45Å; D47-I51 PolarHBondContact O-N 3.46Å
48C96.2Very high92.8Very high0 Ų063.8 Ų63.80%031%0.314CS..Hα-helixtrans-57.3-43.9175.7-173.30000112.3A44 M50 I51 V52 S100 L101 I104 L121A44-C48 WeakPolarHBondContact O-CB 3.47Å; A44-C48 PolarHBondContact O-N 3.22Å; C48-M50 VanDerWaalsContact C-N 3.31Å; C48-M50 PolarHBondContact O-N 3.26Å; C48-I51 PolarHBondContact O-N 3.49Å; C48-V52 WeakPolarHBondContact O-CG2 3.46Å; C48-V52 PolarHBondContact O-N 2.89Å; C48-S100 VanDerWaalsContact CB-OG 3.28Å; C48-S100 WeakPolarHBondContact CB-OG 3.5Å; C48-L101 VanDerWaalsContact SG-CD2 3.58Å; C48-L101 WeakPolarHBondContact SG-CG 3.39Å; C48-I104 HydrophobicContact CB-CD1 3.43Å; C48-I104 VanDerWaalsContact CB-CD1 3.43Å; C48-L121 HydrophobicContact CB-CD1 4.37Å
49R97.3Very high93.9Very high105 Ų10561.3 Ų61.340%0.39630%0.298SS..Hα-helixtrans-57.1-44.4174.4179.4-162.6-56.3-71.2-5.3111.9V45 A46 D47 I51 V52 Q53 E117 L121V45-R49 PolarHBondContact O-N 3.17Å; A46-R49 WeakPolarHBondContact O-CB 3.37Å; A46-R49 PolarHBondContact O-N 3.27Å; D47-R49 VanDerWaalsContact C-N 3.31Å; D47-R49 PolarHBondContact O-N 2.89Å; R49-I51 VanDerWaalsContact C-N 3.33Å; R49-I51 PolarHBondContact O-N 3.45Å; R49-V52 PolarHBondContact O-N 3.23Å; R49-Q53 WeakPolarHBondContact O-CB 3.48Å; R49-Q53 PolarHBondContact O-N 3.02Å; R49-E117 IonicContact CZ-OE1 3.52Å; R49-E117 IonicContact NH1-OE1 2.67Å; R49-E117 PolarHBondContact NH1-OE1 3.2Å; R49-E117 IonicContact NH2-OE1 3.44Å; R49-E117 PolarHBondContact NH2-OE1 3.49Å; R49-L121 HydrophobicContact CB-CD2 4.03Å; R49-L121 HydrophobicContact CG-CD2 4.36Å
50M97.9Very high94.7Very high119 Ų11957.2 Ų57.259%0.58629%0.294SS*.Hα-helixtrans-61.6-43.9178.7-67-168.4-65.200111.2A46 D47 C48 Q53 E54A46-M50 WeakPolarHBondContact O-CG 3.4Å; A46-M50 PolarHBondContact O-N 3.21Å; A46-M50 VanDerWaalsContact O-N 3.12Å; D47-M50 HydrophobicContact CB-CE 4.49Å; D47-M50 WeakPolarHBondContact O-CB 3.49Å; D47-M50 PolarHBondContact O-N 3.23Å; D47-M50 WeakPolarHBondContact OD1-CE 3.47Å; C48-M50 VanDerWaalsContact C-N 3.31Å; C48-M50 PolarHBondContact O-N 3.26Å; M50-Q53 PolarHBondContact O-N 3.36Å; M50-E54 WeakPolarHBondContact O-CB 3.46Å; M50-E54 PolarHBondContact O-N 2.69Å
51I98.3Very high95.5Very high39 Ų3955.5 Ų55.520%0.229%0.29CS..Hα-helixtrans-62.8-46178.7-59.9168.6000110.9D47 C48 R49 Q53 E54 F55 M93 A96 A97D47-I51 WeakPolarHBondContact O-CG1 3.45Å; D47-I51 PolarHBondContact O-N 3.46Å; C48-I51 PolarHBondContact O-N 3.49Å; R49-I51 VanDerWaalsContact C-N 3.33Å; R49-I51 PolarHBondContact O-N 3.45Å; I51-Q53 VanDerWaalsContact C-N 3.32Å; I51-Q53 PolarHBondContact O-N 3.28Å; I51-E54 PolarHBondContact O-N 2.94Å; I51-F55 WeakPolarHBondContact O-CB 3.26Å; I51-F55 PolarHBondContact O-N 3.11Å; I51-M93 HydrophobicContact CB-CE 4.14Å; I51-M93 HydrophobicContact CG1-CE 4.43Å; I51-M93 HydrophobicContact CG2-CE 3.62Å; I51-A96 HydrophobicContact CG2-CB 4Å; I51-A97 HydrophobicContact CG2-CB 3.77Å
52V98.3Very high96.3Very high0 Ų054.7 Ų54.70%028%0.283CS..Hα-helixtrans-61.8-40.5177.31730000111.2C48 R49 F55 N56 A97 L121 Q124 L125C48-V52 WeakPolarHBondContact O-CG2 3.46Å; C48-V52 PolarHBondContact O-N 2.89Å; R49-V52 PolarHBondContact O-N 3.23Å; V52-F55 PolarHBondContact O-N 3.47Å; V52-N56 WeakPolarHBondContact O-CB 3.28Å; V52-N56 PolarHBondContact O-N 3.14Å; V52-A97 HydrophobicContact CG2-CB 3.94Å; V52-L121 HydrophobicContact CB-CD2 4.43Å; V52-L121 HydrophobicContact CG2-CD2 4.35Å; V52-Q124 HydrophobicContact CG1-CB 4.08Å; V52-Q124 HydrophobicContact CG1-CG 3.64Å; V52-L125 HydrophobicContact CG2-CB 4.45Å
53Q98.3Very high96.9Very high97 Ų9754.8 Ų54.845%0.45328%0.278SS..Hα-helixtrans-68.4-40.3178.6-176.662.614.200112.6R49 M50 I51 N56 T57R49-Q53 WeakPolarHBondContact O-CB 3.48Å; R49-Q53 PolarHBondContact O-N 3.02Å; M50-Q53 PolarHBondContact O-N 3.36Å; I51-Q53 VanDerWaalsContact C-N 3.32Å; I51-Q53 PolarHBondContact O-N 3.28Å; Q53-N56 PolarHBondContact O-N 3.18Å; Q53-T57 PolarHBondContact O-N 3.41Å; Q53-T57 PolarHBondContact O-OG1 3.11Å
54E98.5Very high97.3Very high78 Ų7854.1 Ų54.136%0.36428%0.281SS..Hα-helixtrans-66.6-41.1175.3-178.5172.1-172.900110.9M50 I51 N56 T57 L58 K89 M93M50-E54 WeakPolarHBondContact O-CB 3.46Å; M50-E54 PolarHBondContact O-N 2.69Å; I51-E54 PolarHBondContact O-N 2.94Å; E54-N56 PolarHBondContact O-N 2.97Å; E54-T57 WeakPolarHBondContact O-CB 3.49Å; E54-T57 PolarHBondContact O-N 3.34Å; E54-L58 WeakPolarHBondContact O-CG 3.38Å; E54-L58 PolarHBondContact O-N 3.06Å; E54-K89 WeakPolarHBondContact OE1-CE 3.41Å; E54-K89 IonicContact OE1-NZ 3.91Å; E54-K89 PolarHBondContact OE1-NZ 2.95Å; E54-M93 HydrophobicContact CB-CE 3.73Å; E54-M93 HydrophobicContact CG-CE 3.75Å; E54-M93 WeakPolarHBondContact OE2-CE 3.5Å
55F98.8Very high97.6Very high0 Ų053.8 Ų53.80%027%0.274CS..Hα-helixtrans-58.2-47.8171.8177.2-125.9000111.7I51 V52 T57 L58 V59 G90 M93 A94 L125 C128 L129 Y132I51-F55 WeakPolarHBondContact O-CB 3.26Å; I51-F55 PolarHBondContact O-N 3.11Å; V52-F55 PolarHBondContact O-N 3.47Å; F55-T57 PolarHBondContact O-N 3.06Å; F55-L58 WeakPolarHBondContact O-CA 3.48Å; F55-L58 WeakPolarHBondContact O-CB 3.34Å; F55-L58 PolarHBondContact O-N 2.77Å; F55-V59 HydrophobicContact CD2-CG2 4.21Å; F55-V59 HydrophobicContact CE1-CG2 4.13Å; F55-V59 HydrophobicContact CE2-CG2 3.75Å; F55-V59 HydrophobicContact CZ-CG2 3.7Å; F55-V59 WeakPolarHBondContact O-CG2 3.45Å; F55-V59 PolarHBondContact O-N 2.87Å; F55-G90 WeakPolarHBondContact CD2-O 3.5Å; F55-G90 WeakPolarHBondContact CE2-O 3.22Å; F55-M93 HydrophobicContact CB-CB 4.04Å; F55-M93 HydrophobicContact CD2-CB 4.34Å; F55-A94 HydrophobicContact CD1-CB 4.5Å; F55-A94 HydrophobicContact CD2-CB 4.06Å; F55-A94 HydrophobicContact CE1-CB 4.16Å; F55-A94 HydrophobicContact CE2-CB 3.73Å; F55-A94 HydrophobicContact CG-CB 4.45Å; F55-A94 HydrophobicContact CZ-CB 3.78Å; F55-L125 HydrophobicContact CD1-CD1 3.76Å; F55-L125 HydrophobicContact CE1-CD1 3.98Å; F55-C128 HydrophobicContact CD1-CB 3.68Å; F55-C128 HydrophobicContact CE1-CB 3.45Å; F55-C128 VanDerWaalsContact CE1-CB 3.45Å; F55-C128 HydrophobicContact CZ-CB 4.47Å; F55-L129 HydrophobicContact CE1-CD2 4.35Å; F55-L129 HydrophobicContact CE1-CG 4.12Å; F55-L129 HydrophobicContact CZ-CD2 4.15Å; F55-L129 HydrophobicContact CZ-CG 4.4Å; F55-Y132 AromaticContact CE2-CD1 3.72Å; F55-Y132 HydrophobicContact CE2-CD1 3.72Å; F55-Y132 AromaticContact CE2-CE1 3.98Å; F55-Y132 HydrophobicContact CE2-CE1 3.98Å; F55-Y132 HydrophobicContact CE2-CG 4.12Å; F55-Y132 AromaticContact CZ-CD1 3.72Å; F55-Y132 HydrophobicContact CZ-CD1 3.72Å; F55-Y132 HydrophobicContact CZ-CE1 4.42Å; F55-Y132 HydrophobicContact CZ-CG 4.01Å
56N98.4Very high97.9Very high50 Ų5053.1 Ų53.127%0.26727%0.27SS..Hα-helixtrans-56.9-38.9176.8-173.116.5000112.3V52 Q53 E54 V59 A60V52-N56 WeakPolarHBondContact O-CB 3.28Å; V52-N56 PolarHBondContact O-N 3.14Å; Q53-N56 PolarHBondContact O-N 3.18Å; E54-N56 PolarHBondContact O-N 2.97Å; N56-V59 PolarHBondContact O-N 2.76Å; N56-A60 PolarHBondContact O-N 3.41Å
57T98.6Very high98Very high68 Ų6854.2 Ų54.242%0.41727%0.269SS..Hα-helixtrans-64.9-40.4175.4-58.20000111.3Q53 E54 F55 V59 A60 L61Q53-T57 PolarHBondContact O-N 3.41Å; Q53-T57 PolarHBondContact O-OG1 3.11Å; E54-T57 WeakPolarHBondContact O-CB 3.49Å; E54-T57 PolarHBondContact O-N 3.34Å; F55-T57 PolarHBondContact O-N 3.06Å; T57-V59 VanDerWaalsContact C-N 3.35Å; T57-A60 PolarHBondContact O-N 3.25Å; T57-L61 HydrophobicContact CG2-CD1 4.25Å; T57-L61 WeakPolarHBondContact O-CG 3.4Å; T57-L61 PolarHBondContact O-N 3.25Å
58L98.8Very high98.1Very high13 Ų1352.3 Ų52.37%0.06826%0.262CS..Hα-helixtrans-65.5-36.6174.7-68.1165.4000112.3E54 F55 A60 L61 Y62 T86 K89 M93E54-L58 WeakPolarHBondContact O-CG 3.38Å; E54-L58 PolarHBondContact O-N 3.06Å; F55-L58 WeakPolarHBondContact O-CA 3.48Å; F55-L58 WeakPolarHBondContact O-CB 3.34Å; F55-L58 PolarHBondContact O-N 2.77Å; L58-A60 VanDerWaalsContact C-N 3.34Å; L58-L61 HydrophobicContact CD2-CD1 4.49Å; L58-L61 PolarHBondContact O-N 2.94Å; L58-Y62 VanDerWaalsContact O-CB 3.26Å; L58-Y62 WeakPolarHBondContact O-CB 3.43Å; L58-Y62 PolarHBondContact O-N 2.94Å; L58-T86 HydrophobicContact CD2-CG2 4.16Å; L58-K89 HydrophobicContact CD1-CB 4.22Å; L58-K89 HydrophobicContact CD1-CD 4.06Å; L58-K89 HydrophobicContact CD1-CG 3.76Å; L58-K89 HydrophobicContact CD2-CB 4.42Å; L58-K89 HydrophobicContact CD2-CD 4.03Å; L58-K89 HydrophobicContact CD2-CG 4.36Å; L58-M93 HydrophobicContact CD1-CB 4.14Å; L58-M93 HydrophobicContact CD1-CG 3.72Å
59V98.8Very high97.9Very high8 Ų852.5 Ų52.55%0.04826%0.263CS..Hα-helixtrans-62-43.9173.2178.40000110.7F55 N56 T57 Y62 R63 M131 Y132F55-V59 HydrophobicContact CD2-CG2 4.21Å; F55-V59 HydrophobicContact CE1-CG2 4.13Å; F55-V59 HydrophobicContact CE2-CG2 3.75Å; F55-V59 HydrophobicContact CZ-CG2 3.7Å; F55-V59 WeakPolarHBondContact O-CG2 3.45Å; F55-V59 PolarHBondContact O-N 2.87Å; N56-V59 PolarHBondContact O-N 2.76Å; T57-V59 VanDerWaalsContact C-N 3.35Å; V59-Y62 PolarHBondContact O-N 2.88Å; V59-R63 WeakPolarHBondContact O-CB 3.48Å; V59-R63 PolarHBondContact O-N 3.45Å; V59-M131 HydrophobicContact CG1-CB 4.1Å; V59-Y132 HydrophobicContact CB-CD2 4.45Å; V59-Y132 HydrophobicContact CG1-CD2 4.46Å; V59-Y132 HydrophobicContact CG2-CD2 3.89Å; V59-Y132 HydrophobicContact CG2-CG 3.93Å
60A98.7Very high97.5Very high51 Ų5150 Ų5042%0.42127%0.27SS..Hα-helixtrans-63.1-47.617600000111.9N56 T57 L58 Y62 R63 E64N56-A60 PolarHBondContact O-N 3.41Å; T57-A60 PolarHBondContact O-N 3.25Å; L58-A60 VanDerWaalsContact C-N 3.34Å; A60-Y62 VanDerWaalsContact C-N 3.34Å; A60-Y62 PolarHBondContact O-N 2.86Å; A60-R63 WeakPolarHBondContact O-CB 3.26Å; A60-R63 PolarHBondContact O-N 2.89Å; A60-E64 PolarHBondContact O-N 3.48Å; A60-E64 VanDerWaalsContact O-N 3.08Å
61L98.7Very high97.1Very high90 Ų9051.3 Ų51.347%0.47128%0.275SS..Hα-helixtrans-60.6-43.7176.6-71172000111.9T57 L58 R63 E64 L65 T86T57-L61 HydrophobicContact CG2-CD1 4.25Å; T57-L61 WeakPolarHBondContact O-CG 3.4Å; T57-L61 PolarHBondContact O-N 3.25Å; L58-L61 HydrophobicContact CD2-CD1 4.49Å; L58-L61 PolarHBondContact O-N 2.94Å; L61-R63 VanDerWaalsContact C-N 3.3Å; L61-R63 PolarHBondContact O-N 3.43Å; L61-E64 PolarHBondContact O-N 3.2Å; L61-L65 WeakPolarHBondContact O-CG 3.28Å; L61-L65 PolarHBondContact O-N 3.42Å; L61-T86 HydrophobicContact CB-CG2 4.13Å
62Y98.8Very high96.4Very high0 Ų052.1 Ų52.10%028%0.279CS..Hα-helixtrans-62.1-40178-169.8-109.1000111.3L58 V59 A60 E64 L65 V66 M83 T86 R87 Y132 E135 M136 S139L58-Y62 VanDerWaalsContact O-CB 3.26Å; L58-Y62 WeakPolarHBondContact O-CB 3.43Å; L58-Y62 PolarHBondContact O-N 2.94Å; V59-Y62 PolarHBondContact O-N 2.88Å; A60-Y62 VanDerWaalsContact C-N 3.34Å; A60-Y62 PolarHBondContact O-N 2.86Å; Y62-E64 PolarHBondContact O-N 3.44Å; Y62-L65 WeakPolarHBondContact O-CB 3.27Å; Y62-L65 PolarHBondContact O-N 3.29Å; Y62-V66 HydrophobicContact CD1-CG2 4.08Å; Y62-V66 HydrophobicContact CE1-CG2 3.87Å; Y62-V66 VanDerWaalsContact O-CG2 3.3Å; Y62-V66 WeakPolarHBondContact O-CG2 3.49Å; Y62-V66 PolarHBondContact O-N 2.83Å; Y62-M83 HydrophobicContact CE2-CB 4.34Å; Y62-M83 HydrophobicContact CE2-CE 3.92Å; Y62-T86 HydrophobicContact CD2-CG2 4.32Å; Y62-R87 HydrophobicContact CD2-CB 4.4Å; Y62-R87 HydrophobicContact CE2-CB 3.93Å; Y62-R87 HydrophobicContact CE2-CG 4.39Å; Y62-Y132 HydrophobicContact CD1-CD2 4.14Å; Y62-Y132 AromaticContact CD1-CE2 3.8Å; Y62-Y132 HydrophobicContact CD1-CE2 3.8Å; Y62-Y132 HydrophobicContact CE1-CE2 4.37Å; Y62-Y132 AromaticContact CG-CE2 3.93Å; Y62-Y132 HydrophobicContact CG-CE2 3.93Å; Y62-E135 HydrophobicContact CD1-CB 3.91Å; Y62-E135 HydrophobicContact CE1-CB 4.22Å; Y62-M136 HydrophobicContact CE1-CG 4.01Å; Y62-S139 PolarHBondContact OH-OG 3.43Å
63R98.6Very high95.4Very high129 Ų12958.3 Ų58.349%0.48732%0.317SS..Hα-helixtrans-59.8-43.9173.7179.2175.7173.5178.7-1.3112.5V59 A60 L61 L65 V66 I67 E135V59-R63 WeakPolarHBondContact O-CB 3.48Å; V59-R63 PolarHBondContact O-N 3.45Å; A60-R63 WeakPolarHBondContact O-CB 3.26Å; A60-R63 PolarHBondContact O-N 2.89Å; L61-R63 VanDerWaalsContact C-N 3.3Å; L61-R63 PolarHBondContact O-N 3.43Å; R63-L65 VanDerWaalsContact C-N 3.3Å; R63-L65 PolarHBondContact O-N 3.26Å; R63-V66 WeakPolarHBondContact O-CB 3.3Å; R63-V66 PolarHBondContact O-N 3.42Å; R63-I67 HydrophobicContact CG-CD1 4.16Å; R63-I67 WeakPolarHBondContact O-CG1 3.47Å; R63-I67 PolarHBondContact O-N 2.89Å; R63-E135 HydrophobicContact CB-CG 4.12Å; R63-E135 HydrophobicContact CG-CG 4.43Å
64E98.4Very high94.4Very high113 Ų11358.5 Ų58.553%0.52832%0.324SS..Hα-helixtrans-61.8-39.4176.1-66-56130.700111.9A60 L61 Y62 I67 S68A60-E64 PolarHBondContact O-N 3.48Å; A60-E64 VanDerWaalsContact O-N 3.08Å; L61-E64 PolarHBondContact O-N 3.2Å; Y62-E64 PolarHBondContact O-N 3.44Å; E64-I67 PolarHBondContact O-N 3.02Å; E64-S68 PolarHBondContact O-N 2.91Å; E64-S68 PolarHBondContact O-OG 3.48Å
65L97.8Very high93.6Very high27 Ų2756.7 Ų56.714%0.14132%0.317CS..Hα-helixtrans-65.2-39.7173.9-61.9169.9000111.6L61 Y62 R63 S68 I69 L79 D82 M83 T86L61-L65 WeakPolarHBondContact O-CG 3.28Å; L61-L65 PolarHBondContact O-N 3.42Å; Y62-L65 WeakPolarHBondContact O-CB 3.27Å; Y62-L65 PolarHBondContact O-N 3.29Å; R63-L65 VanDerWaalsContact C-N 3.3Å; R63-L65 PolarHBondContact O-N 3.26Å; L65-S68 WeakPolarHBondContact O-CB 3.43Å; L65-S68 PolarHBondContact O-N 3.2Å; L65-I69 PolarHBondContact O-N 3.04Å; L65-I69 VanDerWaalsContact O-N 3.1Å; L65-L79 HydrophobicContact CB-CD1 4.21Å; L65-L79 HydrophobicContact CD2-CD1 3.66Å; L65-D82 HydrophobicContact CD1-CB 4.33Å; L65-D82 HydrophobicContact CD2-CB 4.09Å; L65-M83 HydrophobicContact CB-CG 3.71Å; L65-M83 HydrophobicContact CD1-CG 4.1Å; L65-M83 HydrophobicContact CG-CG 4.43Å; L65-T86 HydrophobicContact CD1-CG2 4.33Å; L65-T86 WeakPolarHBondContact CD1-OG1 3.16Å
66V97.1Very high93.1Very high4 Ų458.5 Ų58.52%0.02433%0.33CS..Hα-helixtrans-63.7-40.7175.4172.10000111.6Y62 R63 S68 I69 G70 M83 K138 L142Y62-V66 HydrophobicContact CD1-CG2 4.08Å; Y62-V66 HydrophobicContact CE1-CG2 3.87Å; Y62-V66 VanDerWaalsContact O-CG2 3.3Å; Y62-V66 WeakPolarHBondContact O-CG2 3.49Å; Y62-V66 PolarHBondContact O-N 2.83Å; R63-V66 WeakPolarHBondContact O-CB 3.3Å; R63-V66 PolarHBondContact O-N 3.42Å; V66-S68 VanDerWaalsContact C-N 3.3Å; V66-S68 PolarHBondContact O-N 3.14Å; V66-I69 WeakPolarHBondContact O-CB 3.33Å; V66-I69 PolarHBondContact O-N 3.45Å; V66-G70 PolarHBondContact O-N 3.41Å; V66-M83 HydrophobicContact CG2-CE 4.18Å; V66-K138 HydrophobicContact CG1-CB 3.93Å; V66-L142 HydrophobicContact CG1-CD1 3.87Å; V66-L142 WeakPolarHBondContact O-CD1 3.48Å
67I96.8Very high92.7Very high68 Ų6859.7 Ų59.735%0.34934%0.34SS..Hα-helixtrans-59.7-45.2172.5-68165.1000109.8R63 E64 I69 G70 E71R63-I67 HydrophobicContact CG-CD1 4.16Å; R63-I67 WeakPolarHBondContact O-CG1 3.47Å; R63-I67 PolarHBondContact O-N 2.89Å; E64-I67 PolarHBondContact O-N 3.02Å; I67-I69 VanDerWaalsContact C-N 3.25Å; I67-I69 PolarHBondContact O-N 3.41Å; I67-G70 WeakPolarHBondContact O-CA 3.32Å; I67-G70 PolarHBondContact O-N 3.21Å; I67-E71 PolarHBondContact O-N 2.69Å
68S96Very high92.4Very high40 Ų4061.1 Ų61.128%0.2835%0.349SS..Hα-helixtrans-59.4-32.7178.9-55.10000112.9E64 L65 V66 G70 E71 I72E64-S68 PolarHBondContact O-N 2.91Å; E64-S68 PolarHBondContact O-OG 3.48Å; L65-S68 WeakPolarHBondContact O-CB 3.43Å; L65-S68 PolarHBondContact O-N 3.2Å; V66-S68 VanDerWaalsContact C-N 3.3Å; V66-S68 PolarHBondContact O-N 3.14Å; S68-G70 VanDerWaalsContact C-N 3.29Å; S68-G70 PolarHBondContact O-N 3.25Å; S68-E71 PolarHBondContact O-N 3.34Å; S68-I72 PolarHBondContact O-N 3.03Å
69I93.3Very high92.2Very high4 Ų461.5 Ų61.52%0.02135%0.351CS..Hα-helixtrans-61.4-40.4172.4-57.1167.6000110.8L65 V66 I67 E71 I72 L79 M83 L142 L143 L146L65-I69 PolarHBondContact O-N 3.04Å; L65-I69 VanDerWaalsContact O-N 3.1Å; V66-I69 WeakPolarHBondContact O-CB 3.33Å; V66-I69 PolarHBondContact O-N 3.45Å; I67-I69 VanDerWaalsContact C-N 3.25Å; I67-I69 PolarHBondContact O-N 3.41Å; I69-E71 PolarHBondContact O-N 3.13Å; I69-I72 VanDerWaalsContact O-CG1 3.31Å; I69-I72 WeakPolarHBondContact O-CG1 3.48Å; I69-L79 HydrophobicContact CG1-CD2 3.91Å; I69-M83 HydrophobicContact CD1-CE 3.32Å; I69-M83 HydrophobicContact CD1-SD 3.28Å; I69-M83 WeakPolarHBondContact CD1-SD 3.46Å; I69-M83 HydrophobicContact CG1-CE 4.34Å; I69-M83 HydrophobicContact CG1-SD 3.7Å; I69-L142 HydrophobicContact CB-CB 4.33Å; I69-L142 HydrophobicContact CB-CD1 4.33Å; I69-L142 HydrophobicContact CG2-CB 3.71Å; I69-L143 HydrophobicContact CD1-CD2 4.18Å; I69-L143 HydrophobicContact CD1-CG 4.08Å; I69-L143 HydrophobicContact CG2-CD2 4.27Å; I69-L146 HydrophobicContact CG2-CD1 3.68Å
70G89.2Confident92Very high53 Ų5362.3 Ų62.355%0.54635%0.353SS..Hα-helixtrans-69.6-18.7-179.900000114V66 I67 S68V66-G70 PolarHBondContact O-N 3.41Å; I67-G70 WeakPolarHBondContact O-CA 3.32Å; I67-G70 PolarHBondContact O-N 3.21Å; S68-G70 VanDerWaalsContact C-N 3.29Å; S68-G70 PolarHBondContact O-N 3.25Å
71E88.9Confident91.8Very high146 Ų14662.5 Ų62.568%0.68235%0.354SS*.Hα-helixtrans-90.2-25179.8-65.7-179.4174.300113I67 S68 I69I67-E71 PolarHBondContact O-N 2.69Å; S68-E71 PolarHBondContact O-N 3.34Å; I69-E71 PolarHBondContact O-N 3.13Å
72I84.4Confident91.8Very high55 Ų5562.1 Ų62.128%0.28235%0.353SS..  trans-88142-179.462.8178000111.8S68 I69 V74 C76 L79S68-I72 PolarHBondContact O-N 3.03Å; I69-I72 VanDerWaalsContact O-CG1 3.31Å; I69-I72 WeakPolarHBondContact O-CG1 3.48Å; I72-V74 WeakPolarHBondContact CD1-O 3.34Å; I72-C76 HydrophobicContact CD1-CB 3.76Å; I72-L79 HydrophobicContact CD1-CD2 3.63Å
73T76.9Confident91.7Very high131 Ų13162.3 Ų62.380%0.80435%0.354SS*.SBendtrans-97.2-8.517858.60000113.3
74V77.7Confident91.7Very high101 Ų10159.4 Ų59.461%0.61235%0.347SS*.SBendtrans-135.5153-177.6-62.60000110I72I72-V74 WeakPolarHBondContact CD1-O 3.34Å
75D80.9Confident91.7Very high40 Ų4061.4 Ų61.421%0.21435%0.354CS..  trans-59.7139.7177.3-176.739.1000111.5R80 L186D75-R80 WeakPolarHBondContact OD1-CD 3.42Å; D75-R80 IonicContact OD1-CZ 3.92Å; D75-R80 IonicContact OD1-NE 3.1Å; D75-R80 PolarHBondContact OD1-NE 2.99Å; D75-R80 IonicContact OD2-CZ 2.89Å; D75-R80 IonicContact OD2-NE 2.69Å; D75-R80 PolarHBondContact OD2-NE 2.88Å; D75-R80 VanDerWaalsContact OD2-NE 3.14Å; D75-R80 IonicContact OD2-NH2 3.55Å; D75-R80 PolarHBondContact OD2-NH2 3.08Å; D75-L186 HydrophobicContact CB-CD2 4.17Å; D75-L186 WeakPolarHBondContact OD2-CG 3.46Å
76C88.2Confident91.7Very high38 Ų3861.1 Ų61.126%0.25735%0.354SS..  trans-126.9100.6-179-176.90000109.6I72 T78 L79 R80I72-C76 HydrophobicContact CD1-CB 3.76Å; C76-T78 VanDerWaalsContact C-N 3.28Å; C76-T78 PolarHBondContact O-N 2.64Å; C76-T78 PolarHBondContact SG-OG1 3.43Å; C76-L79 HydrophobicContact CB-CB 3.91Å; C76-L79 PolarHBondContact O-N 2.94Å; C76-R80 PolarHBondContact O-N 3.01Å; C76-R80 VanDerWaalsContact O-N 3.08Å
77P89.3Confident91.8Very high74 Ų7461.3 Ų61.348%0.48135%0.354SS..Hα-helixtrans-60.4-33.2-176.5-27.235.5000114.3R80 A81 L186P77-R80 PolarHBondContact O-N 3.34Å; P77-A81 WeakPolarHBondContact O-CB 3.35Å; P77-A81 PolarHBondContact O-N 3.45Å; P77-L186 HydrophobicContact CG-CD1 4.42Å
78T92.6Very high91.9Very high99 Ų9960.7 Ų60.761%0.60735%0.353SS*.Hα-helixtrans-67.4-43.417749.50000111.4C76 R80 A81 D82C76-T78 VanDerWaalsContact C-N 3.28Å; C76-T78 PolarHBondContact O-N 2.64Å; C76-T78 PolarHBondContact SG-OG1 3.43Å; T78-R80 VanDerWaalsContact C-N 3.34Å; T78-R80 PolarHBondContact O-N 3.14Å; T78-A81 WeakPolarHBondContact O-CB 3.46Å; T78-A81 PolarHBondContact O-N 3.32Å; T78-D82 PolarHBondContact O-N 3.48Å
79L94.4Very high92Very high21 Ų2163 Ų6311%0.1136%0.358CS..Hα-helixtrans-59.9-44.7173.8179.364.2000111L65 I69 I72 C76 A81 D82 M83L65-L79 HydrophobicContact CB-CD1 4.21Å; L65-L79 HydrophobicContact CD2-CD1 3.66Å; I69-L79 HydrophobicContact CG1-CD2 3.91Å; I72-L79 HydrophobicContact CD1-CD2 3.63Å; C76-L79 HydrophobicContact CB-CB 3.91Å; C76-L79 PolarHBondContact O-N 2.94Å; L79-A81 VanDerWaalsContact C-N 3.32Å; L79-A81 PolarHBondContact O-N 3.06Å; L79-D82 PolarHBondContact O-N 2.96Å; L79-M83 HydrophobicContact CG-SD 4.46Å; L79-M83 WeakPolarHBondContact O-CB 3.49Å; L79-M83 VanDerWaalsContact O-CG 3.28Å; L79-M83 WeakPolarHBondContact O-CG 3.45Å; L79-M83 PolarHBondContact O-N 3.1Å
80R94.4Very high92.3Very high25 Ų2562.8 Ų62.89%0.09436%0.357CS..Hα-helixtrans-62.2-38.9176.4-69.8-164.6-69.8108.5-3.3112.5D75 C76 P77 T78 M83 L84 L143 D193D75-R80 WeakPolarHBondContact OD1-CD 3.42Å; D75-R80 IonicContact OD1-CZ 3.92Å; D75-R80 IonicContact OD1-NE 3.1Å; D75-R80 PolarHBondContact OD1-NE 2.99Å; D75-R80 IonicContact OD2-CZ 2.89Å; D75-R80 IonicContact OD2-NE 2.69Å; D75-R80 PolarHBondContact OD2-NE 2.88Å; D75-R80 VanDerWaalsContact OD2-NE 3.14Å; D75-R80 IonicContact OD2-NH2 3.55Å; D75-R80 PolarHBondContact OD2-NH2 3.08Å; C76-R80 PolarHBondContact O-N 3.01Å; C76-R80 VanDerWaalsContact O-N 3.08Å; P77-R80 PolarHBondContact O-N 3.34Å; T78-R80 VanDerWaalsContact C-N 3.34Å; T78-R80 PolarHBondContact O-N 3.14Å; R80-M83 WeakPolarHBondContact O-CB 3.14Å; R80-M83 PolarHBondContact O-N 3.47Å; R80-L84 WeakPolarHBondContact O-CB 3.38Å; R80-L84 PolarHBondContact O-N 3.46Å; R80-L143 HydrophobicContact CG-CD2 4.48Å; R80-D193 WeakPolarHBondContact CD-OD2 3.45Å; R80-D193 IonicContact CZ-OD2 2.69Å; R80-D193 IonicContact NE-OD2 3.45Å; R80-D193 IonicContact NH1-OD2 3.66Å; R80-D193 PolarHBondContact NH1-OD2 3.24Å
81A95.8Very high92.7Very high55 Ų5560.4 Ų60.446%0.45533%0.332SS..Hα-helixtrans-64-43.1174.900000112.1P77 T78 L79 M83 L84 K85P77-A81 WeakPolarHBondContact O-CB 3.35Å; P77-A81 PolarHBondContact O-N 3.45Å; T78-A81 WeakPolarHBondContact O-CB 3.46Å; T78-A81 PolarHBondContact O-N 3.32Å; L79-A81 VanDerWaalsContact C-N 3.32Å; L79-A81 PolarHBondContact O-N 3.06Å; A81-M83 VanDerWaalsContact C-N 3.35Å; A81-L84 PolarHBondContact O-N 3.48Å; A81-K85 WeakPolarHBondContact O-CB 3.1Å; A81-K85 PolarHBondContact O-N 3.38Å
82D97.8Very high93.2Very high81 Ų8158.1 Ų58.143%0.43332%0.322SS..Hα-helixtrans-66-38.5176.4-74.9-26.8000112L65 T78 L79 K85 T86L65-D82 HydrophobicContact CD1-CB 4.33Å; L65-D82 HydrophobicContact CD2-CB 4.09Å; T78-D82 PolarHBondContact O-N 3.48Å; L79-D82 PolarHBondContact O-N 2.96Å; D82-K85 PolarHBondContact O-N 3.32Å; D82-T86 VanDerWaalsContact O-CB 3.26Å; D82-T86 WeakPolarHBondContact O-CB 3.4Å; D82-T86 PolarHBondContact O-N 3.25Å; D82-T86 PolarHBondContact O-OG1 2.67Å
83M97.8Very high93.9Very high4 Ų456.7 Ų56.72%0.0231%0.314CS..Hα-helixtrans-61.7-48.3172.2-76-175.775.600112Y62 L65 V66 I69 L79 R80 A81 K85 T86 R87Y62-M83 HydrophobicContact CE2-CB 4.34Å; Y62-M83 HydrophobicContact CE2-CE 3.92Å; L65-M83 HydrophobicContact CB-CG 3.71Å; L65-M83 HydrophobicContact CD1-CG 4.1Å; L65-M83 HydrophobicContact CG-CG 4.43Å; V66-M83 HydrophobicContact CG2-CE 4.18Å; I69-M83 HydrophobicContact CD1-CE 3.32Å; I69-M83 HydrophobicContact CD1-SD 3.28Å; I69-M83 WeakPolarHBondContact CD1-SD 3.46Å; I69-M83 HydrophobicContact CG1-CE 4.34Å; I69-M83 HydrophobicContact CG1-SD 3.7Å; L79-M83 HydrophobicContact CG-SD 4.46Å; L79-M83 WeakPolarHBondContact O-CB 3.49Å; L79-M83 VanDerWaalsContact O-CG 3.28Å; L79-M83 WeakPolarHBondContact O-CG 3.45Å; L79-M83 PolarHBondContact O-N 3.1Å; R80-M83 WeakPolarHBondContact O-CB 3.14Å; R80-M83 PolarHBondContact O-N 3.47Å; A81-M83 VanDerWaalsContact C-N 3.35Å; M83-K85 PolarHBondContact O-N 3.22Å; M83-T86 PolarHBondContact O-N 2.93Å; M83-R87 WeakPolarHBondContact O-CB 3.47Å; M83-R87 PolarHBondContact O-N 3.48Å
84L97.9Very high94.9Very high68 Ų6850.5 Ų50.536%0.35628%0.276SS..Hα-helixtrans-58-49.7176.7171.762.7000110.8R80 A81 T86 R87 T88R80-L84 WeakPolarHBondContact O-CB 3.38Å; R80-L84 PolarHBondContact O-N 3.46Å; A81-L84 PolarHBondContact O-N 3.48Å; L84-T86 PolarHBondContact O-N 2.82Å; L84-R87 PolarHBondContact O-N 3.44Å; L84-T88 WeakPolarHBondContact O-CB 3.42Å; L84-T88 PolarHBondContact O-N 3.26Å; L84-T88 PolarHBondContact O-OG1 3.08Å
85K98.4Very high95.9Very high155 Ų15551 Ų5167%0.67427%0.267SS*.Hα-helixtrans-59.4-48.8179.8-179.6-178.4176.9-175.60111.7A81 D82 M83 R87 K89A81-K85 WeakPolarHBondContact O-CB 3.1Å; A81-K85 PolarHBondContact O-N 3.38Å; D82-K85 PolarHBondContact O-N 3.32Å; M83-K85 PolarHBondContact O-N 3.22Å; K85-R87 VanDerWaalsContact C-N 3.32Å; K85-K89 PolarHBondContact O-N 3.35Å
86T98.7Very high96.7Very high21 Ų2150.7 Ų50.713%0.12927%0.27CS..Hα-helixtrans-63.9-41.6179.1-56.10000110.6L58 L61 Y62 L65 D82 M83 L84 G90L58-T86 HydrophobicContact CD2-CG2 4.16Å; L61-T86 HydrophobicContact CB-CG2 4.13Å; Y62-T86 HydrophobicContact CD2-CG2 4.32Å; L65-T86 HydrophobicContact CD1-CG2 4.33Å; L65-T86 WeakPolarHBondContact CD1-OG1 3.16Å; D82-T86 VanDerWaalsContact O-CB 3.26Å; D82-T86 WeakPolarHBondContact O-CB 3.4Å; D82-T86 PolarHBondContact O-N 3.25Å; D82-T86 PolarHBondContact O-OG1 2.67Å; M83-T86 PolarHBondContact O-N 2.93Å; L84-T86 PolarHBondContact O-N 2.82Å; T86-G90 PolarHBondContact O-N 2.91Å
87R98.6Very high97.2Very high8 Ų848.9 Ų48.93%0.0326%0.258CS..Hα-helixtrans-64.2-50.8-179.1-172.2-174.475.6-129.41.1112.2Y62 M83 L84 K85 K89 G90 C91 Y132 M136 D200Y62-R87 HydrophobicContact CD2-CB 4.4Å; Y62-R87 HydrophobicContact CE2-CB 3.93Å; Y62-R87 HydrophobicContact CE2-CG 4.39Å; M83-R87 WeakPolarHBondContact O-CB 3.47Å; M83-R87 PolarHBondContact O-N 3.48Å; L84-R87 PolarHBondContact O-N 3.44Å; K85-R87 VanDerWaalsContact C-N 3.32Å; R87-K89 VanDerWaalsContact C-N 3.34Å; R87-K89 PolarHBondContact O-N 3.39Å; R87-G90 PolarHBondContact O-N 3.48Å; R87-G90 VanDerWaalsContact O-N 3.13Å; R87-C91 PolarHBondContact O-N 3.45Å; R87-C91 PolarHBondContact O-SG 3.17Å; R87-Y132 WeakPolarHBondContact CA-OH 3.43Å; R87-Y132 PolarHBondContact O-OH 3.5Å; R87-M136 HydrophobicContact CG-CE 3.7Å; R87-D200 IonicContact CZ-OD2 3.14Å; R87-D200 IonicContact NE-OD2 3.69Å; R87-D200 PolarHBondContact NE-OD2 2.92Å; R87-D200 IonicContact NH2-OD2 2.65Å; R87-D200 PolarHBondContact NH2-OD2 3.35Å
88T98.6Very high97.6Very high55 Ų5546.3 Ų46.334%0.33724%0.239SC..Hα-helixtrans-57.7-48.6179.4-61.70000110.7L84 G90 C91 E92L84-T88 WeakPolarHBondContact O-CB 3.42Å; L84-T88 PolarHBondContact O-N 3.26Å; L84-T88 PolarHBondContact O-OG1 3.08Å; T88-G90 VanDerWaalsContact C-N 3.34Å; T88-G90 PolarHBondContact O-N 2.9Å; T88-C91 PolarHBondContact O-N 3.36Å; T88-E92 WeakPolarHBondContact O-CG 3.41Å; T88-E92 PolarHBondContact O-N 2.95Å
89K98.8Very high97.7Very high88 Ų8847.3 Ų47.338%0.38324%0.237SC..Hα-helixtrans-62.7-40.5176.3-167.3179.8173.8-171.80111.7E54 L58 K85 R87 C91 E92 M93E54-K89 WeakPolarHBondContact OE1-CE 3.41Å; E54-K89 IonicContact OE1-NZ 3.91Å; E54-K89 PolarHBondContact OE1-NZ 2.95Å; L58-K89 HydrophobicContact CD1-CB 4.22Å; L58-K89 HydrophobicContact CD1-CD 4.06Å; L58-K89 HydrophobicContact CD1-CG 3.76Å; L58-K89 HydrophobicContact CD2-CB 4.42Å; L58-K89 HydrophobicContact CD2-CD 4.03Å; L58-K89 HydrophobicContact CD2-CG 4.36Å; K85-K89 PolarHBondContact O-N 3.35Å; R87-K89 VanDerWaalsContact C-N 3.34Å; R87-K89 PolarHBondContact O-N 3.39Å; K89-C91 PolarHBondContact O-N 2.9Å; K89-E92 PolarHBondContact O-N 2.92Å; K89-M93 HydrophobicContact CG-CG 4.3Å; K89-M93 WeakPolarHBondContact O-CB 3.2Å; K89-M93 VanDerWaalsContact O-CG 3.28Å; K89-M93 WeakPolarHBondContact O-CG 3.42Å; K89-M93 PolarHBondContact O-N 3Å
90G98.7Very high97.8Very high0 Ų047.3 Ų47.30%024%0.239CC..Hα-helixtrans-58.9-45175.800000112.4F55 T86 R87 T88 E92 M93 A94F55-G90 WeakPolarHBondContact CD2-O 3.5Å; F55-G90 WeakPolarHBondContact CE2-O 3.22Å; T86-G90 PolarHBondContact O-N 2.91Å; R87-G90 PolarHBondContact O-N 3.48Å; R87-G90 VanDerWaalsContact O-N 3.13Å; T88-G90 VanDerWaalsContact C-N 3.34Å; T88-G90 PolarHBondContact O-N 2.9Å; G90-E92 PolarHBondContact O-N 3.29Å; G90-M93 PolarHBondContact O-N 2.85Å; G90-A94 WeakPolarHBondContact O-CB 3.39Å; G90-A94 PolarHBondContact O-N 3Å
91C98.7Very high97.7Very high3 Ų346.1 Ų46.12%0.0223%0.234CC..Hα-helixtrans-63.6-39.7176.5-67.90000112.5R87 T88 K89 R95 M204R87-C91 PolarHBondContact O-N 3.45Å; R87-C91 PolarHBondContact O-SG 3.17Å; T88-C91 PolarHBondContact O-N 3.36Å; K89-C91 PolarHBondContact O-N 2.9Å; C91-R95 WeakPolarHBondContact O-CG 3.42Å; C91-R95 PolarHBondContact O-N 3.44Å; C91-R95 PolarHBondContact O-NE 3.29Å; C91-M204 HydrophobicContact CB-CE 3.98Å; C91-M204 HydrophobicContact CB-SD 4.41Å
92E98.6Very high97.5Very high98 Ų9845.5 Ų45.546%0.45823%0.226SC..Hα-helixtrans-64.4-48.4175.4-71.5169.9179.400111.8T88 K89 G90 A94 R95 A96T88-E92 WeakPolarHBondContact O-CG 3.41Å; T88-E92 PolarHBondContact O-N 2.95Å; K89-E92 PolarHBondContact O-N 2.92Å; G90-E92 PolarHBondContact O-N 3.29Å; E92-A94 PolarHBondContact O-N 2.9Å; E92-R95 PolarHBondContact O-N 3Å; E92-A96 WeakPolarHBondContact O-CB 3.46Å; E92-A96 PolarHBondContact O-N 3.47Å
93M98.6Very high97.1Very high26 Ų2648 Ų4813%0.12824%0.239CC..Hα-helixtrans-66.1-38.2-179.3-68-56.9-6900112.4I51 E54 F55 L58 K89 G90 A96 A97I51-M93 HydrophobicContact CB-CE 4.14Å; I51-M93 HydrophobicContact CG1-CE 4.43Å; I51-M93 HydrophobicContact CG2-CE 3.62Å; E54-M93 HydrophobicContact CB-CE 3.73Å; E54-M93 HydrophobicContact CG-CE 3.75Å; E54-M93 WeakPolarHBondContact OE2-CE 3.5Å; F55-M93 HydrophobicContact CB-CB 4.04Å; F55-M93 HydrophobicContact CD2-CB 4.34Å; L58-M93 HydrophobicContact CD1-CB 4.14Å; L58-M93 HydrophobicContact CD1-CG 3.72Å; K89-M93 HydrophobicContact CG-CG 4.3Å; K89-M93 WeakPolarHBondContact O-CB 3.2Å; K89-M93 VanDerWaalsContact O-CG 3.28Å; K89-M93 WeakPolarHBondContact O-CG 3.42Å; K89-M93 PolarHBondContact O-N 3Å; G90-M93 PolarHBondContact O-N 2.85Å; M93-A96 PolarHBondContact O-N 3.29Å; M93-A97 VanDerWaalsContact O-CB 3.32Å; M93-A97 WeakPolarHBondContact O-CB 3.39Å; M93-A97 PolarHBondContact O-N 2.8Å
94A98.6Very high96.7Very high0 Ų048.1 Ų48.10%024%0.24CC..Hα-helixtrans-60.1-46.3173.500000111.9F55 G90 E92 A97 H98 L129 M204 L207F55-A94 HydrophobicContact CD1-CB 4.5Å; F55-A94 HydrophobicContact CD2-CB 4.06Å; F55-A94 HydrophobicContact CE1-CB 4.16Å; F55-A94 HydrophobicContact CE2-CB 3.73Å; F55-A94 HydrophobicContact CG-CB 4.45Å; F55-A94 HydrophobicContact CZ-CB 3.78Å; G90-A94 WeakPolarHBondContact O-CB 3.39Å; G90-A94 PolarHBondContact O-N 3Å; E92-A94 PolarHBondContact O-N 2.9Å; A94-A97 PolarHBondContact O-N 3.36Å; A94-H98 PolarHBondContact O-N 3.46Å; A94-L129 HydrophobicContact CB-CD2 4.04Å; A94-M204 HydrophobicContact CB-SD 3.86Å; A94-L207 HydrophobicContact CB-CD2 3.93Å
95R98.6Very high95.9Very high112 Ų11247 Ų4742%0.42324%0.237SC..Hα-helixtrans-62.7-44.6176.7-76.5-176-91.2109.1-6.4111.4C91 E92 H98 Q99 L207C91-R95 WeakPolarHBondContact O-CG 3.42Å; C91-R95 PolarHBondContact O-N 3.44Å; C91-R95 PolarHBondContact O-NE 3.29Å; E92-R95 PolarHBondContact O-N 3Å; R95-H98 PolarHBondContact O-N 3.18Å; R95-Q99 WeakPolarHBondContact O-CB 3.29Å; R95-Q99 VanDerWaalsContact O-CG 3.26Å; R95-Q99 WeakPolarHBondContact O-CG 3.43Å; R95-Q99 PolarHBondContact O-N 3.28Å; R95-L207 HydrophobicContact CG-CD2 4.06Å
96A98.3Very high94.9Very high33 Ų3342.9 Ų42.927%0.27324%0.239SC..Hα-helixtrans-62.8-41.6177.300000112I51 E92 M93 Q99 S100I51-A96 HydrophobicContact CG2-CB 4Å; E92-A96 WeakPolarHBondContact O-CB 3.46Å; E92-A96 PolarHBondContact O-N 3.47Å; M93-A96 PolarHBondContact O-N 3.29Å; A96-Q99 PolarHBondContact O-N 3.01Å; A96-S100 VanDerWaalsContact O-CB 3.26Å; A96-S100 WeakPolarHBondContact O-CB 3.24Å; A96-S100 PolarHBondContact O-N 3.37Å
97A98.1Very high93.6Very high0 Ų045.8 Ų45.80%026%0.26CS..Hα-helixtrans-62.1-47.5177.900000111.3I51 V52 M93 A94 S100 L101 L125I51-A97 HydrophobicContact CG2-CB 3.77Å; V52-A97 HydrophobicContact CG2-CB 3.94Å; M93-A97 VanDerWaalsContact O-CB 3.32Å; M93-A97 WeakPolarHBondContact O-CB 3.39Å; M93-A97 PolarHBondContact O-N 2.8Å; A94-A97 PolarHBondContact O-N 3.36Å; A97-S100 PolarHBondContact O-N 3.46Å; A97-L101 WeakPolarHBondContact O-CB 3.43Å; A97-L101 PolarHBondContact O-N 3.26Å; A97-L125 HydrophobicContact CB-CD1 3.75Å; A97-L125 HydrophobicContact CB-CD2 3.85Å; A97-L125 HydrophobicContact CB-CG 4.45Å
98H97.2Very high92.1Very high21 Ų2149.6 Ų49.610%0.09728%0.275CS..Hα-helixtrans-60.5-49.1176.4176.3-78.1000111.5A94 R95 S100 L101 S102 L125 L207A94-H98 PolarHBondContact O-N 3.46Å; R95-H98 PolarHBondContact O-N 3.18Å; H98-S100 VanDerWaalsContact C-N 3.33Å; H98-S100 PolarHBondContact O-N 3.05Å; H98-L101 PolarHBondContact O-N 3.42Å; H98-S102 PolarHBondContact CE1-OG 2.89Å; H98-S102 PolarHBondContact O-N 3.09Å; H98-S102 PolarHBondContact O-OG 3.17Å; H98-L125 HydrophobicContact CB-CD2 4.25Å; H98-L207 HydrophobicContact CB-CD1 3.79Å; H98-L207 HydrophobicContact CB-CD2 4.47Å; H98-L207 HydrophobicContact CB-CG 4.32Å
99Q95.8Very high90.3Very high120 Ų12051.1 Ų51.156%0.56129%0.286SS*.Hα-helixtrans-59.1-44.8178.6-73.1171-0.600111.8R95 A96 L101 S102 L103R95-Q99 WeakPolarHBondContact O-CB 3.29Å; R95-Q99 VanDerWaalsContact O-CG 3.26Å; R95-Q99 WeakPolarHBondContact O-CG 3.43Å; R95-Q99 PolarHBondContact O-N 3.28Å; A96-Q99 PolarHBondContact O-N 3.01Å; Q99-L101 PolarHBondContact O-N 2.65Å; Q99-S102 PolarHBondContact O-N 3.32Å; Q99-L103 VanDerWaalsContact O-CG 3.29Å; Q99-L103 WeakPolarHBondContact O-CG 3.39Å; Q99-L103 PolarHBondContact O-N 3Å
100S95.1Very high88.3Confident21 Ų2156.1 Ų56.115%0.14731%0.311CS..Hα-helixtrans-60.1-45.7176.6-174.70000111.3C48 A96 A97 H98 L103 I104C48-S100 VanDerWaalsContact CB-OG 3.28Å; C48-S100 WeakPolarHBondContact CB-OG 3.5Å; A96-S100 VanDerWaalsContact O-CB 3.26Å; A96-S100 WeakPolarHBondContact O-CB 3.24Å; A96-S100 PolarHBondContact O-N 3.37Å; A97-S100 PolarHBondContact O-N 3.46Å; H98-S100 VanDerWaalsContact C-N 3.33Å; H98-S100 PolarHBondContact O-N 3.05Å; S100-L103 PolarHBondContact O-N 3.49Å; S100-I104 VanDerWaalsContact O-CD1 3.31Å; S100-I104 WeakPolarHBondContact O-CD1 3.44Å; S100-I104 WeakPolarHBondContact O-CG1 3.48Å; S100-I104 PolarHBondContact O-N 3.37Å
101L93.1Very high86.4Confident0 Ų064.4 Ų64.40%036%0.355CS..Hα-helixtrans-62.7-44.3176.1-82.7174.8000113.2C48 A97 H98 Q99 L103 I104 S105 L121 F122 L125 L211C48-L101 VanDerWaalsContact SG-CD2 3.58Å; C48-L101 WeakPolarHBondContact SG-CG 3.39Å; A97-L101 WeakPolarHBondContact O-CB 3.43Å; A97-L101 PolarHBondContact O-N 3.26Å; H98-L101 PolarHBondContact O-N 3.42Å; Q99-L101 PolarHBondContact O-N 2.65Å; L101-L103 VanDerWaalsContact C-N 3.32Å; L101-L103 PolarHBondContact O-N 3.3Å; L101-I104 PolarHBondContact O-N 2.96Å; L101-S105 WeakPolarHBondContact O-CB 3.42Å; L101-S105 PolarHBondContact O-N 3.48Å; L101-L121 HydrophobicContact CD1-CB 4.41Å; L101-L121 HydrophobicContact CD2-CB 3.7Å; L101-L121 HydrophobicContact CD2-CD1 4.17Å; L101-F122 HydrophobicContact CB-CE2 4.38Å; L101-F122 HydrophobicContact CB-CZ 4.27Å; L101-F122 HydrophobicContact CD1-CD2 4.48Å; L101-F122 HydrophobicContact CD1-CG 4.39Å; L101-F122 HydrophobicContact CD2-CD2 4.23Å; L101-F122 HydrophobicContact CD2-CE2 4.22Å; L101-L125 HydrophobicContact CD1-CB 4.21Å; L101-L125 HydrophobicContact CD1-CD2 3.66Å; L101-L211 HydrophobicContact CD1-CD1 4.44Å
102S91.1Very high84.6Confident41 Ų4166 Ų6629%0.28737%0.372SS..Hα-helixtrans-61.5-41.8178.1-56.40000111.6H98 Q99 G106H98-S102 PolarHBondContact CE1-OG 2.89Å; H98-S102 PolarHBondContact O-N 3.09Å; H98-S102 PolarHBondContact O-OG 3.17Å; Q99-S102 PolarHBondContact O-N 3.32Å; S102-G106 PolarHBondContact O-N 3.11Å
103L89.8Confident83.1Confident134 Ų13470.4 Ų70.470%0.70239%0.393SS*.Hα-helixtrans-65-43.4177-71.5172.5000112Q99 S100 L101 S107Q99-L103 VanDerWaalsContact O-CG 3.29Å; Q99-L103 WeakPolarHBondContact O-CG 3.39Å; Q99-L103 PolarHBondContact O-N 3Å; S100-L103 PolarHBondContact O-N 3.49Å; L101-L103 VanDerWaalsContact C-N 3.32Å; L101-L103 PolarHBondContact O-N 3.3Å; L103-S107 WeakPolarHBondContact O-CB 3.17Å; L103-S107 PolarHBondContact O-N 2.94Å; L103-S107 PolarHBondContact O-OG 3.38Å
104I88.7Confident81.9Confident6 Ų672.8 Ų72.83%0.03141%0.405CS..Hα-helixtrans-63.6-49.8178-67.9160.3000109.5A44 V45 C48 S100 L101 G106 S107 W108 I118A44-I104 HydrophobicContact CB-CD1 4.22Å; A44-I104 HydrophobicContact CB-CG1 3.89Å; A44-I104 WeakPolarHBondContact O-CD1 3.5Å; V45-I104 HydrophobicContact CG2-CD1 4.42Å; V45-I104 HydrophobicContact CG2-CG2 3.73Å; C48-I104 HydrophobicContact CB-CD1 3.43Å; C48-I104 VanDerWaalsContact CB-CD1 3.43Å; S100-I104 VanDerWaalsContact O-CD1 3.31Å; S100-I104 WeakPolarHBondContact O-CD1 3.44Å; S100-I104 WeakPolarHBondContact O-CG1 3.48Å; S100-I104 PolarHBondContact O-N 3.37Å; L101-I104 PolarHBondContact O-N 2.96Å; I104-G106 VanDerWaalsContact C-N 3.34Å; I104-G106 PolarHBondContact O-N 3.05Å; I104-S107 PolarHBondContact O-N 3.43Å; I104-S107 PolarHBondContact O-OG 2.86Å; I104-W108 VanDerWaalsContact O-CD1 3.31Å; I104-I118 HydrophobicContact CG2-CD1 3.8Å; I104-I118 HydrophobicContact CG2-CG1 4.16Å
105S82.7Confident81Confident44 Ų4477 Ų7731%0.30843%0.425SS..Hα-helixtrans-63.3-35.9-177.2-166.10000113.2L101 S107L101-S105 WeakPolarHBondContact O-CB 3.42Å; L101-S105 PolarHBondContact O-N 3.48Å; S105-S107 VanDerWaalsContact C-N 3.32Å; S105-S107 PolarHBondContact O-N 3.35Å
106G76.9Confident80.3Confident69 Ų6975.5 Ų75.571%0.71143%0.43SS*.Hα-helixtrans-80.3-7.1179.500000115.1S102 I104S102-G106 PolarHBondContact O-N 3.11Å; I104-G106 VanDerWaalsContact C-N 3.34Å; I104-G106 PolarHBondContact O-N 3.05Å
107S71.8Confident79.9Confident82 Ų8275.2 Ų75.257%0.57342%0.422SS*.THydrogen-bonded Turntrans-99.1-3.9-176.968.70000114.4L103 I104 S105L103-S107 WeakPolarHBondContact O-CB 3.17Å; L103-S107 PolarHBondContact O-N 2.94Å; L103-S107 PolarHBondContact O-OG 3.38Å; I104-S107 PolarHBondContact O-N 3.43Å; I104-S107 PolarHBondContact O-OG 2.86Å; S105-S107 VanDerWaalsContact C-N 3.32Å; S105-S107 PolarHBondContact O-N 3.35Å
108W66.6Low79.4Confident89 Ų8975.4 Ų75.434%0.33742%0.423SS..SBendtrans-86.1141.9179.8-8685.5000111.6A41 I104 E110A41-W108 HydrophobicContact CB-CZ2 4.28Å; I104-W108 VanDerWaalsContact O-CD1 3.31Å; W108-E110 PolarHBondContact O-N 3.31Å
109P60.5Low79.1Confident87 Ų8775.3 Ų75.357%0.56543%0.425SS*.  trans-59.8134.6176.5-17.829.5000110.9D111 G112P109-D111 PolarHBondContact O-N 3.47Å; P109-G112 PolarHBondContact O-N 2.93Å
110E55.9Low79Confident193 Ų19376.8 Ų76.890%0.90243%0.425SS*.THydrogen-bonded Turntrans-56.4-20.7179.6-64-72.2137.600113.7W108W108-E110 PolarHBondContact O-N 3.31Å
111D59.2Low79Confident173 Ų17375.8 Ų75.893%0.92542%0.419SS*.THydrogen-bonded Turntrans-90.2-0.6176.6-77.4-32.8000114.2P109P109-D111 PolarHBondContact O-N 3.47Å
112G60.8Low79Confident38 Ų3875.8 Ų75.839%0.39242%0.419SS..SBendtrans-93.4135.1179.600000112.8P109 I114P109-G112 PolarHBondContact O-N 2.93Å; G112-I114 PolarHBondContact O-N 3.46Å
113E67.3Low79.2Confident189 Ų18977.6 Ų77.688%0.88342%0.424SS*.PPolyproline II helixtrans-55.6129.9166.9-71.7-176.2168.600110.2H115E113-H115 PolarHBondContact O-N 3.27Å; E113-H115 VanDerWaalsContact O-N 3.13Å
114I73.1Confident79.5Confident76 Ų7673.8 Ų73.839%0.3940%0.403SS..PPolyproline II helixtrans-55.8121.7175.2-64.3149.2000108.4G112 C119 P216 P218G112-I114 PolarHBondContact O-N 3.46Å; I114-C119 VanDerWaalsContact CG2-SG 3.59Å; I114-P216 HydrophobicContact CD1-CB 3.64Å; I114-P216 HydrophobicContact CG1-CB 4.41Å; I114-P216 HydrophobicContact CG2-CB 4.22Å; I114-P216 HydrophobicContact CG2-CG 4.22Å; I114-P218 HydrophobicContact CD1-CG 3.87Å
115H79.8Confident79.9Confident89 Ų8973.5 Ų73.541%0.41240%0.401SS..PPolyproline II helixtrans-60.3126.3-178.7-166.8-80.7000109.8E113 E117 I118E113-H115 PolarHBondContact O-N 3.27Å; E113-H115 VanDerWaalsContact O-N 3.13Å; H115-E117 WeakPolarHBondContact ND1-CB 3.39Å; H115-E117 PolarHBondContact ND1-N 3Å; H115-E117 PolarHBondContact O-N 3.45Å; H115-I118 HydrophobicContact CB-CD1 3.97Å; H115-I118 HydrophobicContact CB-CG1 4.23Å; H115-I118 WeakPolarHBondContact O-CB 3.47Å; H115-I118 PolarHBondContact O-N 2.89Å
116P85.3Confident80.6Confident81 Ų8172.4 Ų72.453%0.52639%0.391SS..Hα-helixtrans-59.8-25.1-172.122.2-34.3000113I118 C119 R120P116-I118 VanDerWaalsContact C-N 3.35Å; P116-C119 WeakPolarHBondContact O-CB 3.39Å; P116-C119 PolarHBondContact O-N 3.49Å; P116-R120 PolarHBondContact O-N 2.88Å; P116-R120 VanDerWaalsContact O-N 3.09Å
117E88.6Confident81.6Confident26 Ų2671.7 Ų71.712%0.12138%0.375CS..Hα-helixtrans-66.6-33.5175.2-162.456.4-15600113.8V45 R49 H115 C119 R120 L121V45-E117 HydrophobicContact CG1-CG 4.31Å; R49-E117 IonicContact CZ-OE1 3.52Å; R49-E117 IonicContact NH1-OE1 2.67Å; R49-E117 PolarHBondContact NH1-OE1 3.2Å; R49-E117 IonicContact NH2-OE1 3.44Å; R49-E117 PolarHBondContact NH2-OE1 3.49Å; H115-E117 WeakPolarHBondContact ND1-CB 3.39Å; H115-E117 PolarHBondContact ND1-N 3Å; H115-E117 PolarHBondContact O-N 3.45Å; E117-C119 VanDerWaalsContact C-N 3.34Å; E117-R120 PolarHBondContact O-N 3.39Å; E117-R120 WeakPolarHBondContact OE2-CD 3.37Å; E117-R120 IonicContact OE2-CZ 2.78Å; E117-R120 IonicContact OE2-NH1 2.72Å; E117-R120 PolarHBondContact OE2-NH1 3.2Å; E117-L121 WeakPolarHBondContact O-CG 3.47Å; E117-L121 PolarHBondContact O-N 2.94Å
118I88.8Confident82.8Confident4 Ų468 Ų682%0.02135%0.349CS..Hα-helixtrans-66.3-43.8175.9-63.4170.1000108.8V45 I104 H115 P116 R120 L121 F122V45-I118 HydrophobicContact CG2-CG1 4.43Å; I104-I118 HydrophobicContact CG2-CD1 3.8Å; I104-I118 HydrophobicContact CG2-CG1 4.16Å; H115-I118 HydrophobicContact CB-CD1 3.97Å; H115-I118 HydrophobicContact CB-CG1 4.23Å; H115-I118 WeakPolarHBondContact O-CB 3.47Å; H115-I118 PolarHBondContact O-N 2.89Å; P116-I118 VanDerWaalsContact C-N 3.35Å; I118-R120 VanDerWaalsContact C-N 3.3Å; I118-R120 PolarHBondContact O-N 3.09Å; I118-L121 PolarHBondContact O-N 2.9Å; I118-L121 VanDerWaalsContact O-N 3.09Å; I118-F122 HydrophobicContact CG2-CD2 3.81Å; I118-F122 HydrophobicContact CG2-CE2 3.75Å; I118-F122 WeakPolarHBondContact O-CD2 3.37Å; I118-F122 PolarHBondContact O-N 3.03Å
119C90.1Very high84.3Confident19 Ų1963.7 Ų63.713%0.12833%0.332CS..Hα-helixtrans-57.2-43.4174.1-62.90000112I114 P116 E117 L121 F122 I123 L219I114-C119 VanDerWaalsContact CG2-SG 3.59Å; P116-C119 WeakPolarHBondContact O-CB 3.39Å; P116-C119 PolarHBondContact O-N 3.49Å; E117-C119 VanDerWaalsContact C-N 3.34Å; C119-L121 VanDerWaalsContact C-N 3.33Å; C119-L121 PolarHBondContact O-N 2.88Å; C119-F122 PolarHBondContact O-N 3.42Å; C119-I123 VanDerWaalsContact O-CG1 3.31Å; C119-I123 WeakPolarHBondContact O-CG1 3.28Å; C119-I123 PolarHBondContact O-N 2.68Å; C119-L219 HydrophobicContact CB-CD1 3.96Å; C119-L219 HydrophobicContact CB-CD2 4.31Å; C119-L219 HydrophobicContact CB-CG 4.36Å
120R92.9Very high86.1Confident151 Ų15162.5 Ų62.557%0.5732%0.319SS*.Hα-helixtrans-60.3-41.6175.1-71179.2-174.6147.9-2.4112.3P116 E117 I118 I123 Q124P116-R120 PolarHBondContact O-N 2.88Å; P116-R120 VanDerWaalsContact O-N 3.09Å; E117-R120 PolarHBondContact O-N 3.39Å; E117-R120 WeakPolarHBondContact OE2-CD 3.37Å; E117-R120 IonicContact OE2-CZ 2.78Å; E117-R120 IonicContact OE2-NH1 2.72Å; E117-R120 PolarHBondContact OE2-NH1 3.2Å; I118-R120 VanDerWaalsContact C-N 3.3Å; I118-R120 PolarHBondContact O-N 3.09Å; R120-I123 PolarHBondContact O-N 3.05Å; R120-Q124 VanDerWaalsContact O-CB 3.29Å; R120-Q124 WeakPolarHBondContact O-CB 3.37Å; R120-Q124 PolarHBondContact O-N 3.07Å
121L95.2Very high88.1Confident1 Ų157.4 Ų57.41%0.00530%0.297CS..Hα-helixtrans-66.7-38.9177.9-68171000112.2V45 C48 R49 V52 L101 E117 I118 C119 Q124 L125V45-L121 HydrophobicContact CG1-CD1 4.23Å; C48-L121 HydrophobicContact CB-CD1 4.37Å; R49-L121 HydrophobicContact CB-CD2 4.03Å; R49-L121 HydrophobicContact CG-CD2 4.36Å; V52-L121 HydrophobicContact CB-CD2 4.43Å; V52-L121 HydrophobicContact CG2-CD2 4.35Å; L101-L121 HydrophobicContact CD1-CB 4.41Å; L101-L121 HydrophobicContact CD2-CB 3.7Å; L101-L121 HydrophobicContact CD2-CD1 4.17Å; E117-L121 WeakPolarHBondContact O-CG 3.47Å; E117-L121 PolarHBondContact O-N 2.94Å; I118-L121 PolarHBondContact O-N 2.9Å; I118-L121 VanDerWaalsContact O-N 3.09Å; C119-L121 VanDerWaalsContact C-N 3.33Å; C119-L121 PolarHBondContact O-N 2.88Å; L121-Q124 PolarHBondContact O-N 3.12Å; L121-L125 WeakPolarHBondContact O-CB 3.32Å; L121-L125 PolarHBondContact O-N 3.23Å
122F94.6Very high90Very high0 Ų049.2 Ų49.20%025%0.253CS..Hα-helixtrans-60-49.5172.7-91.9-83.6000111.7L101 I118 C119 Q124 L125 Q126 L211 M215 P216 L219L101-F122 HydrophobicContact CB-CE2 4.38Å; L101-F122 HydrophobicContact CB-CZ 4.27Å; L101-F122 HydrophobicContact CD1-CD2 4.48Å; L101-F122 HydrophobicContact CD1-CG 4.39Å; L101-F122 HydrophobicContact CD2-CD2 4.23Å; L101-F122 HydrophobicContact CD2-CE2 4.22Å; I118-F122 HydrophobicContact CG2-CD2 3.81Å; I118-F122 HydrophobicContact CG2-CE2 3.75Å; I118-F122 WeakPolarHBondContact O-CD2 3.37Å; I118-F122 PolarHBondContact O-N 3.03Å; C119-F122 PolarHBondContact O-N 3.42Å; F122-Q124 PolarHBondContact O-N 3.42Å; F122-L125 PolarHBondContact O-N 3.49Å; F122-Q126 WeakPolarHBondContact O-CB 3.35Å; F122-Q126 PolarHBondContact O-N 3.36Å; F122-L211 HydrophobicContact CD1-CD1 3.54Å; F122-L211 HydrophobicContact CD1-CG 4.14Å; F122-L211 HydrophobicContact CE1-CD1 3.64Å; F122-L211 HydrophobicContact CE1-CG 4.48Å; F122-M215 HydrophobicContact CB-CE 4.49Å; F122-M215 HydrophobicContact CB-CG 4.25Å; F122-M215 HydrophobicContact CD1-CB 4.32Å; F122-M215 HydrophobicContact CD1-CE 4.38Å; F122-M215 HydrophobicContact CD1-CG 3.95Å; F122-M215 HydrophobicContact CG-CG 4.22Å; F122-P216 HydrophobicContact CD2-CG 4.09Å; F122-P216 HydrophobicContact CE2-CG 4.05Å; F122-L219 HydrophobicContact CB-CD1 3.99Å
123I94.3Very high91.8Very high78 Ų7848.1 Ų48.140%0.424%0.238SC..Hα-helixtrans-59.8-47.9177.4-65.5162.5000110.2C119 R120 L125 Q126 C127 L219C119-I123 VanDerWaalsContact O-CG1 3.31Å; C119-I123 WeakPolarHBondContact O-CG1 3.28Å; C119-I123 PolarHBondContact O-N 2.68Å; R120-I123 PolarHBondContact O-N 3.05Å; I123-L125 PolarHBondContact O-N 3.34Å; I123-Q126 PolarHBondContact O-N 3.25Å; I123-C127 PolarHBondContact O-N 3.32Å; I123-C127 PolarHBondContact O-SG 3.39Å; I123-L219 HydrophobicContact CD1-CD2 3.85Å; I123-L219 HydrophobicContact CG1-CD1 4.17Å; I123-L219 HydrophobicContact CG1-CD2 4.17Å
124Q96.6Very high93.3Very high55 Ų5542.4 Ų42.426%0.25722%0.216SC..Hα-helixtrans-61.4-46.2-179-172.7177.23.500111.5V52 R120 L121 F122 C127 C128V52-Q124 HydrophobicContact CG1-CB 4.08Å; V52-Q124 HydrophobicContact CG1-CG 3.64Å; R120-Q124 VanDerWaalsContact O-CB 3.29Å; R120-Q124 WeakPolarHBondContact O-CB 3.37Å; R120-Q124 PolarHBondContact O-N 3.07Å; L121-Q124 PolarHBondContact O-N 3.12Å; F122-Q124 PolarHBondContact O-N 3.42Å; Q124-C127 PolarHBondContact O-N 3.02Å; Q124-C128 WeakPolarHBondContact O-CB 3.49Å; Q124-C128 PolarHBondContact O-N 2.94Å; Q124-C128 PolarHBondContact O-SG 2.92Å
125L97.8Very high94.5Very high0 Ų039.4 Ų39.40%020%0.2CC..Hα-helixtrans-65.2-40.9178.4-178.159.8000111.7V52 F55 A97 H98 L101 L121 F122 I123 C128 L129 L211V52-L125 HydrophobicContact CG2-CB 4.45Å; F55-L125 HydrophobicContact CD1-CD1 3.76Å; F55-L125 HydrophobicContact CE1-CD1 3.98Å; A97-L125 HydrophobicContact CB-CD1 3.75Å; A97-L125 HydrophobicContact CB-CD2 3.85Å; A97-L125 HydrophobicContact CB-CG 4.45Å; H98-L125 HydrophobicContact CB-CD2 4.25Å; L101-L125 HydrophobicContact CD1-CB 4.21Å; L101-L125 HydrophobicContact CD1-CD2 3.66Å; L121-L125 WeakPolarHBondContact O-CB 3.32Å; L121-L125 PolarHBondContact O-N 3.23Å; F122-L125 PolarHBondContact O-N 3.49Å; I123-L125 PolarHBondContact O-N 3.34Å; L125-C128 PolarHBondContact O-N 3.21Å; L125-L129 HydrophobicContact CD1-CD1 4.36Å; L125-L129 HydrophobicContact CD1-CG 4.4Å; L125-L129 HydrophobicContact CG-CD1 4.17Å; L125-L129 WeakPolarHBondContact O-CB 3.41Å; L125-L129 PolarHBondContact O-N 3.36Å; L125-L211 HydrophobicContact CB-CD2 4.18Å; L125-L211 HydrophobicContact CD2-CD1 3.85Å; L125-L211 HydrophobicContact CD2-CD2 4.17Å; L125-L211 HydrophobicContact CG-CD1 4.49Å; L125-L211 HydrophobicContact CG-CD2 3.93Å
126Q96.7Very high95.4Very high20 Ų2035.2 Ų35.29%0.09318%0.181CC..Hα-helixtrans-58.8-52.5175.8-179.7-178.8-7.900110.9F122 I123 C128 L129 E130 L208 L211 M215F122-Q126 WeakPolarHBondContact O-CB 3.35Å; F122-Q126 PolarHBondContact O-N 3.36Å; I123-Q126 PolarHBondContact O-N 3.25Å; Q126-C128 VanDerWaalsContact C-N 3.31Å; Q126-C128 PolarHBondContact O-N 3.07Å; Q126-L129 PolarHBondContact O-N 2.84Å; Q126-E130 WeakPolarHBondContact CG-OE1 3.31Å; Q126-E130 PolarHBondContact NE2-OE1 3.27Å; Q126-E130 WeakPolarHBondContact O-CG 3.39Å; Q126-E130 PolarHBondContact O-N 2.91Å; Q126-L208 HydrophobicContact CG-CD1 3.84Å; Q126-L211 HydrophobicContact CB-CD2 3.82Å; Q126-M215 HydrophobicContact CB-CE 4.36Å
127C97Very high96Very high55 Ų5535.5 Ų35.537%0.37218%0.178SC..Hα-helixtrans-60.3-41.8178.6-65.40000111.6I123 Q124 L129 E130 M131I123-C127 PolarHBondContact O-N 3.32Å; I123-C127 PolarHBondContact O-SG 3.39Å; Q124-C127 PolarHBondContact O-N 3.02Å; C127-L129 PolarHBondContact O-N 3.41Å; C127-E130 PolarHBondContact O-N 3.49Å; C127-M131 WeakPolarHBondContact O-CB 3.47Å; C127-M131 WeakPolarHBondContact O-CG 3.46Å; C127-M131 PolarHBondContact O-N 3.46Å
128C98.1Very high96.4Very high3 Ų338.6 Ų38.62%0.0219%0.19CC..Hα-helixtrans-62.4-42.8177.1-680000111.7F55 Q124 L125 Q126 Y132F55-C128 HydrophobicContact CD1-CB 3.68Å; F55-C128 HydrophobicContact CE1-CB 3.45Å; F55-C128 VanDerWaalsContact CE1-CB 3.45Å; F55-C128 HydrophobicContact CZ-CB 4.47Å; Q124-C128 WeakPolarHBondContact O-CB 3.49Å; Q124-C128 PolarHBondContact O-N 2.94Å; Q124-C128 PolarHBondContact O-SG 2.92Å; L125-C128 PolarHBondContact O-N 3.21Å; Q126-C128 VanDerWaalsContact C-N 3.31Å; Q126-C128 PolarHBondContact O-N 3.07Å; C128-Y132 VanDerWaalsContact O-CB 3.22Å; C128-Y132 WeakPolarHBondContact O-CB 3.33Å; C128-Y132 PolarHBondContact O-N 3.49Å
129L98.4Very high96.8Very high0 Ų038.4 Ų38.40%019%0.189CC..Hα-helixtrans-64.3-45.5177.3-86.3168.4000112.3F55 A94 L125 Q126 C127 M131 Y132 I133 M204 L207 L208 L211F55-L129 HydrophobicContact CE1-CD2 4.35Å; F55-L129 HydrophobicContact CE1-CG 4.12Å; F55-L129 HydrophobicContact CZ-CD2 4.15Å; F55-L129 HydrophobicContact CZ-CG 4.4Å; A94-L129 HydrophobicContact CB-CD2 4.04Å; L125-L129 HydrophobicContact CD1-CD1 4.36Å; L125-L129 HydrophobicContact CD1-CG 4.4Å; L125-L129 HydrophobicContact CG-CD1 4.17Å; L125-L129 WeakPolarHBondContact O-CB 3.41Å; L125-L129 PolarHBondContact O-N 3.36Å; Q126-L129 PolarHBondContact O-N 2.84Å; C127-L129 PolarHBondContact O-N 3.41Å; L129-M131 PolarHBondContact O-N 3.27Å; L129-Y132 PolarHBondContact O-N 3.13Å; L129-I133 WeakPolarHBondContact O-CB 3.44Å; L129-I133 WeakPolarHBondContact O-CD1 3.38Å; L129-I133 VanDerWaalsContact O-CG1 3.24Å; L129-I133 WeakPolarHBondContact O-CG1 3.16Å; L129-I133 PolarHBondContact O-N 3.32Å; L129-M204 HydrophobicContact CD2-CB 4.41Å; L129-M204 HydrophobicContact CD2-SD 4.07Å; L129-L207 HydrophobicContact CD1-CD2 4.44Å; L129-L207 HydrophobicContact CD1-CG 4.42Å; L129-L207 HydrophobicContact CD2-CD2 4.25Å; L129-L208 HydrophobicContact CB-CD1 4.07Å; L129-L208 HydrophobicContact CD1-CB 4.46Å; L129-L208 HydrophobicContact CD1-CD1 4.42Å; L129-L211 HydrophobicContact CD1-CD2 4.01Å
130E98.1Very high97.1Very high62 Ų6238.4 Ų38.429%0.2919%0.189SC..Hα-helixtrans-60.1-46.2177.7-73.9172.7-179.500111.4Q126 C127 T134 L208 R212Q126-E130 WeakPolarHBondContact CG-OE1 3.31Å; Q126-E130 PolarHBondContact NE2-OE1 3.27Å; Q126-E130 WeakPolarHBondContact O-CG 3.39Å; Q126-E130 PolarHBondContact O-N 2.91Å; C127-E130 PolarHBondContact O-N 3.49Å; E130-T134 WeakPolarHBondContact O-CB 3.5Å; E130-T134 PolarHBondContact O-N 2.84Å; E130-T134 VanDerWaalsContact O-N 3.09Å; E130-T134 PolarHBondContact O-OG1 3Å; E130-L208 HydrophobicContact CG-CD1 4.09Å; E130-L208 HydrophobicContact CG-CD2 3.67Å; E130-R212 IonicContact OE1-CZ 3.47Å; E130-R212 IonicContact OE1-NE 3.78Å; E130-R212 IonicContact OE1-NH2 2.74Å; E130-R212 PolarHBondContact OE1-NH2 3.05Å
131M98Very high97.1Very high86 Ų8634.7 Ų34.742%0.42419%0.185SC..Hα-helixtrans-60.6-46.8174.2-71.8-172.3-63.700111V59 C127 L129 I133 T134 E135V59-M131 HydrophobicContact CG1-CB 4.1Å; C127-M131 WeakPolarHBondContact O-CB 3.47Å; C127-M131 WeakPolarHBondContact O-CG 3.46Å; C127-M131 PolarHBondContact O-N 3.46Å; L129-M131 PolarHBondContact O-N 3.27Å; M131-I133 PolarHBondContact O-N 2.89Å; M131-T134 WeakPolarHBondContact O-CA 3.34Å; M131-T134 WeakPolarHBondContact O-CB 3.48Å; M131-T134 PolarHBondContact O-N 3.44Å; M131-T134 VanDerWaalsContact O-N 3.08Å; M131-E135 WeakPolarHBondContact O-CG 3.49Å; M131-E135 PolarHBondContact O-N 2.78Å
132Y98.8Very high97.1Very high0 Ų037.4 Ų37.40%020%0.2CC..Hα-helixtrans-63-43.8-176.9-169.2-135.8000113.1F55 V59 Y62 R87 C128 L129 T134 E135 M136 M204F55-Y132 AromaticContact CE2-CD1 3.72Å; F55-Y132 HydrophobicContact CE2-CD1 3.72Å; F55-Y132 AromaticContact CE2-CE1 3.98Å; F55-Y132 HydrophobicContact CE2-CE1 3.98Å; F55-Y132 HydrophobicContact CE2-CG 4.12Å; F55-Y132 AromaticContact CZ-CD1 3.72Å; F55-Y132 HydrophobicContact CZ-CD1 3.72Å; F55-Y132 HydrophobicContact CZ-CE1 4.42Å; F55-Y132 HydrophobicContact CZ-CG 4.01Å; V59-Y132 HydrophobicContact CB-CD2 4.45Å; V59-Y132 HydrophobicContact CG1-CD2 4.46Å; V59-Y132 HydrophobicContact CG2-CD2 3.89Å; V59-Y132 HydrophobicContact CG2-CG 3.93Å; Y62-Y132 HydrophobicContact CD1-CD2 4.14Å; Y62-Y132 AromaticContact CD1-CE2 3.8Å; Y62-Y132 HydrophobicContact CD1-CE2 3.8Å; Y62-Y132 HydrophobicContact CE1-CE2 4.37Å; Y62-Y132 AromaticContact CG-CE2 3.93Å; Y62-Y132 HydrophobicContact CG-CE2 3.93Å; R87-Y132 WeakPolarHBondContact CA-OH 3.43Å; R87-Y132 PolarHBondContact O-OH 3.5Å; C128-Y132 VanDerWaalsContact O-CB 3.22Å; C128-Y132 WeakPolarHBondContact O-CB 3.33Å; C128-Y132 PolarHBondContact O-N 3.49Å; L129-Y132 PolarHBondContact O-N 3.13Å; Y132-T134 VanDerWaalsContact C-N 3.26Å; Y132-T134 PolarHBondContact O-N 3.47Å; Y132-E135 PolarHBondContact O-N 2.72Å; Y132-M136 HydrophobicContact CD1-CE 3.89Å; Y132-M136 HydrophobicContact CD1-SD 4.4Å; Y132-M136 HydrophobicContact CE1-CE 3.24Å; Y132-M136 HydrophobicContact CE1-SD 4.3Å; Y132-M136 HydrophobicContact CE2-CE 4.13Å; Y132-M136 WeakPolarHBondContact O-CG 3.26Å; Y132-M136 PolarHBondContact O-N 3.44Å; Y132-M136 WeakPolarHBondContact OH-CE 3.31Å; Y132-M204 HydrophobicContact CD1-CG 4.18Å; Y132-M204 HydrophobicContact CD1-SD 4.43Å; Y132-M204 HydrophobicContact CE1-CG 4.23Å; Y132-M204 HydrophobicContact CE1-SD 4.35Å
133I98.7Very high96.9Very high16 Ų1637.6 Ų37.68%0.08220%0.201CC..Hα-helixtrans-58.8-40.8172.9-69.5160.6000110.6L129 M131 M136 L137 M201 M204 K205 L208L129-I133 WeakPolarHBondContact O-CB 3.44Å; L129-I133 WeakPolarHBondContact O-CD1 3.38Å; L129-I133 VanDerWaalsContact O-CG1 3.24Å; L129-I133 WeakPolarHBondContact O-CG1 3.16Å; L129-I133 PolarHBondContact O-N 3.32Å; M131-I133 PolarHBondContact O-N 2.89Å; I133-M136 PolarHBondContact O-N 3.36Å; I133-L137 PolarHBondContact O-N 3.03Å; I133-M201 HydrophobicContact CG2-CG 4.02Å; I133-M201 HydrophobicContact CG2-SD 4.48Å; I133-M204 HydrophobicContact CD1-CB 4.19Å; I133-M204 HydrophobicContact CG1-CB 3.72Å; I133-K205 HydrophobicContact CD1-CG 3.9Å; I133-K205 HydrophobicContact CG1-CG 4.31Å; I133-K205 HydrophobicContact CG2-CD 4.4Å; I133-K205 HydrophobicContact CG2-CG 3.92Å; I133-L208 HydrophobicContact CD1-CB 4.21Å; I133-L208 HydrophobicContact CD1-CD2 3.88Å
134T98.3Very high96.7Very high69 Ų6934.8 Ų34.842%0.42319%0.191SC..Hα-helixtrans-65.8-42.6177.7-56.90000111.7E130 M131 Y132 L137 K138E130-T134 WeakPolarHBondContact O-CB 3.5Å; E130-T134 PolarHBondContact O-N 2.84Å; E130-T134 VanDerWaalsContact O-N 3.09Å; E130-T134 PolarHBondContact O-OG1 3Å; M131-T134 WeakPolarHBondContact O-CA 3.34Å; M131-T134 WeakPolarHBondContact O-CB 3.48Å; M131-T134 PolarHBondContact O-N 3.44Å; M131-T134 VanDerWaalsContact O-N 3.08Å; Y132-T134 VanDerWaalsContact C-N 3.26Å; Y132-T134 PolarHBondContact O-N 3.47Å; T134-L137 PolarHBondContact O-N 2.74Å; T134-K138 WeakPolarHBondContact O-CG 3.41Å; T134-K138 PolarHBondContact O-N 3.35Å
135E98.3Very high96.2Very high13 Ų1335 Ų356%0.06120%0.199CC..Hα-helixtrans-67-37.2176.1-62.5-51.5135.300112Y62 R63 M131 Y132 L137 K138 S139Y62-E135 HydrophobicContact CD1-CB 3.91Å; Y62-E135 HydrophobicContact CE1-CB 4.22Å; R63-E135 HydrophobicContact CB-CG 4.12Å; R63-E135 HydrophobicContact CG-CG 4.43Å; M131-E135 WeakPolarHBondContact O-CG 3.49Å; M131-E135 PolarHBondContact O-N 2.78Å; Y132-E135 PolarHBondContact O-N 2.72Å; E135-L137 PolarHBondContact O-N 2.96Å; E135-K138 PolarHBondContact O-N 3.41Å; E135-K138 IonicContact OE1-NZ 2.86Å; E135-K138 PolarHBondContact OE1-NZ 3.3Å; E135-K138 WeakPolarHBondContact OE2-CD 3.34Å; E135-K138 IonicContact OE2-NZ 3.89Å; E135-S139 PolarHBondContact O-N 3.33Å
136M98.6Very high95.2Very high0 Ų036.9 Ų36.90%021%0.208CC..Hα-helixtrans-59.1-45.5171.6-75.5174.5164.300111.5Y62 R87 Y132 I133 K138 S139 V140 I197 D200 M201 M204Y62-M136 HydrophobicContact CE1-CG 4.01Å; R87-M136 HydrophobicContact CG-CE 3.7Å; Y132-M136 HydrophobicContact CD1-CE 3.89Å; Y132-M136 HydrophobicContact CD1-SD 4.4Å; Y132-M136 HydrophobicContact CE1-CE 3.24Å; Y132-M136 HydrophobicContact CE1-SD 4.3Å; Y132-M136 HydrophobicContact CE2-CE 4.13Å; Y132-M136 WeakPolarHBondContact O-CG 3.26Å; Y132-M136 PolarHBondContact O-N 3.44Å; Y132-M136 WeakPolarHBondContact OH-CE 3.31Å; I133-M136 PolarHBondContact O-N 3.36Å; M136-K138 PolarHBondContact O-N 2.98Å; M136-S139 WeakPolarHBondContact O-CB 3.49Å; M136-S139 PolarHBondContact O-N 3.09Å; M136-S139 PolarHBondContact O-OG 3.02Å; M136-V140 PolarHBondContact O-N 3.3Å; M136-V140 VanDerWaalsContact O-N 3.08Å; M136-I197 HydrophobicContact CB-CG2 3.98Å; M136-I197 HydrophobicContact CG-CG2 4.29Å; M136-D200 HydrophobicContact CE-CB 4.06Å; M136-M201 HydrophobicContact CB-CB 4.24Å; M136-M201 HydrophobicContact CB-CG 4.34Å; M136-M201 HydrophobicContact SD-CB 3.99Å; M136-M204 HydrophobicContact CE-CG 4.04Å; M136-M204 HydrophobicContact SD-CG 4.18Å
137L98.1Very high94.1Very high88 Ų8838.1 Ų38.146%0.46121%0.214SC..Hα-helixtrans-60.3-46177179.763.4000111.8I133 T134 E135 S139 V140 C141 M201I133-L137 PolarHBondContact O-N 3.03Å; T134-L137 PolarHBondContact O-N 2.74Å; E135-L137 PolarHBondContact O-N 2.96Å; L137-S139 VanDerWaalsContact C-N 3.27Å; L137-S139 PolarHBondContact O-N 3.36Å; L137-V140 PolarHBondContact O-N 2.95Å; L137-C141 PolarHBondContact O-N 3.44Å; L137-C141 VanDerWaalsContact O-N 3.1Å; L137-C141 PolarHBondContact O-SG 2.95Å; L137-C141 VanDerWaalsContact O-SG 3.35Å; L137-M201 HydrophobicContact CB-SD 4.05Å; L137-M201 HydrophobicContact CD1-SD 4.39Å
138K97.2Very high92.4Very high90 Ų9041.3 Ų41.339%0.39123%0.227SC..Hα-helixtrans-58.6-42.1176.2-70.4170.8-176170.60111.5V66 T134 E135 M136 V140 C141 L142V66-K138 HydrophobicContact CG1-CB 3.93Å; T134-K138 WeakPolarHBondContact O-CG 3.41Å; T134-K138 PolarHBondContact O-N 3.35Å; E135-K138 PolarHBondContact O-N 3.41Å; E135-K138 IonicContact OE1-NZ 2.86Å; E135-K138 PolarHBondContact OE1-NZ 3.3Å; E135-K138 WeakPolarHBondContact OE2-CD 3.34Å; E135-K138 IonicContact OE2-NZ 3.89Å; M136-K138 PolarHBondContact O-N 2.98Å; K138-V140 PolarHBondContact O-N 2.88Å; K138-C141 PolarHBondContact O-N 3.09Å; K138-L142 WeakPolarHBondContact O-CG 3.5Å; K138-L142 PolarHBondContact O-N 3.4Å
139S96.9Very high90.6Very high0 Ų048.7 Ų48.70%026%0.261CS..Hα-helixtrans-62.3-41.1179.282.10000112.7Y62 E135 M136 L137 L142 L143Y62-S139 PolarHBondContact OH-OG 3.43Å; E135-S139 PolarHBondContact O-N 3.33Å; M136-S139 WeakPolarHBondContact O-CB 3.49Å; M136-S139 PolarHBondContact O-N 3.09Å; M136-S139 PolarHBondContact O-OG 3.02Å; L137-S139 VanDerWaalsContact C-N 3.27Å; L137-S139 PolarHBondContact O-N 3.36Å; S139-L142 PolarHBondContact O-N 3.02Å; S139-L143 WeakPolarHBondContact O-CB 3.49Å; S139-L143 VanDerWaalsContact O-CG 3.27Å; S139-L143 WeakPolarHBondContact O-CG 3.35Å; S139-L143 PolarHBondContact O-N 3.38Å
140V96.1Very high88.7Confident19 Ų1952.8 Ų52.812%0.11528%0.276CS..Hα-helixtrans-60.7-47.2174.5167.10000110.4M136 L137 K138 G144 I194 I197 E198M136-V140 PolarHBondContact O-N 3.3Å; M136-V140 VanDerWaalsContact O-N 3.08Å; L137-V140 PolarHBondContact O-N 2.95Å; K138-V140 PolarHBondContact O-N 2.88Å; V140-G144 PolarHBondContact O-N 3.28Å; V140-I194 HydrophobicContact CG1-CG2 3.91Å; V140-I194 HydrophobicContact CG2-CG2 4.47Å; V140-I197 HydrophobicContact CG2-CB 3.89Å; V140-I197 HydrophobicContact CG2-CG2 3.54Å; V140-E198 HydrophobicContact CG1-CG 4.35Å; V140-E198 HydrophobicContact CG2-CG 4Å
141C94.7Very high86.6Confident74 Ų7457.8 Ų57.850%0.530%0.297SS..Hα-helixtrans-60.6-47.9178.9-64.50000112.1L137 K138 G144 S145L137-C141 PolarHBondContact O-N 3.44Å; L137-C141 VanDerWaalsContact O-N 3.1Å; L137-C141 PolarHBondContact O-SG 2.95Å; L137-C141 VanDerWaalsContact O-SG 3.35Å; K138-C141 PolarHBondContact O-N 3.09Å; C141-G144 PolarHBondContact O-N 2.9Å; C141-S145 PolarHBondContact O-N 2.89Å; C141-S145 PolarHBondContact O-OG 3.09Å
142L93.3Very high84.4Confident58 Ų5856 Ų5630%0.30430%0.3SS..Hα-helixtrans-66.6-45.4-177.9-70.3171.4000112.3V66 I69 K138 S139 G144 S145 L146V66-L142 HydrophobicContact CG1-CD1 3.87Å; V66-L142 WeakPolarHBondContact O-CD1 3.48Å; I69-L142 HydrophobicContact CB-CB 4.33Å; I69-L142 HydrophobicContact CB-CD1 4.33Å; I69-L142 HydrophobicContact CG2-CB 3.71Å; K138-L142 WeakPolarHBondContact O-CG 3.5Å; K138-L142 PolarHBondContact O-N 3.4Å; S139-L142 PolarHBondContact O-N 3.02Å; L142-G144 VanDerWaalsContact C-N 3.28Å; L142-G144 PolarHBondContact O-N 3.29Å; L142-S145 WeakPolarHBondContact O-CB 3.34Å; L142-S145 PolarHBondContact O-N 3.48Å; L142-L146 PolarHBondContact O-N 3.01Å; L142-L146 VanDerWaalsContact O-N 3.11Å
143L91.5Very high82Confident4 Ų464.5 Ų64.52%0.02134%0.337CS..Hα-helixtrans-62.5-37.9175.4-70.3170.9000111.4I69 R80 S139 L146 Q147 V190 I194 I197I69-L143 HydrophobicContact CD1-CD2 4.18Å; I69-L143 HydrophobicContact CD1-CG 4.08Å; I69-L143 HydrophobicContact CG2-CD2 4.27Å; R80-L143 HydrophobicContact CG-CD2 4.48Å; S139-L143 WeakPolarHBondContact O-CB 3.49Å; S139-L143 VanDerWaalsContact O-CG 3.27Å; S139-L143 WeakPolarHBondContact O-CG 3.35Å; S139-L143 PolarHBondContact O-N 3.38Å; L143-L146 PolarHBondContact O-N 2.94Å; L143-Q147 PolarHBondContact O-N 3.31Å; L143-V190 HydrophobicContact CB-CG1 4.17Å; L143-V190 HydrophobicContact CD2-CG1 4.34Å; L143-I194 HydrophobicContact CB-CD1 4.04Å; L143-I194 HydrophobicContact CB-CG1 3.93Å; L143-I194 HydrophobicContact CD1-CG1 4.48Å; L143-I197 HydrophobicContact CD1-CD1 3.64Å
144G89.7Confident79.5Confident19 Ų1969 Ų6920%0.19636%0.362CS..Hα-helixtrans-61.9-41.7173.400000112.7V140 C141 L142 L146 Q147 L148V140-G144 PolarHBondContact O-N 3.28Å; C141-G144 PolarHBondContact O-N 2.9Å; L142-G144 VanDerWaalsContact C-N 3.28Å; L142-G144 PolarHBondContact O-N 3.29Å; G144-L146 PolarHBondContact O-N 3.41Å; G144-Q147 WeakPolarHBondContact O-CB 3.28Å; G144-Q147 PolarHBondContact O-N 3.46Å; G144-L148 WeakPolarHBondContact O-CG 3.32Å; G144-L148 PolarHBondContact O-N 2.83Å; G144-L148 VanDerWaalsContact O-N 3.11Å
145S86.3Confident76.7Confident60 Ų6070 Ų7042%0.4237%0.371SS..Hα-helixtrans-62.8-39.1175.6-61.70000112.8C141 L142 Q147 L148 H149C141-S145 PolarHBondContact O-N 2.89Å; C141-S145 PolarHBondContact O-OG 3.09Å; L142-S145 WeakPolarHBondContact O-CB 3.34Å; L142-S145 PolarHBondContact O-N 3.48Å; S145-Q147 VanDerWaalsContact C-N 3.32Å; S145-Q147 PolarHBondContact O-N 2.81Å; S145-L148 PolarHBondContact O-N 3.44Å; S145-H149 PolarHBondContact O-N 3.21Å
146L77.8Confident73.8Confident39 Ų3975 Ų7520%0.20441%0.406CS..Hα-helixtrans-62.8-37174.9-68.6175.6000112.1I69 L142 L143 G144I69-L146 HydrophobicContact CG2-CD1 3.68Å; L142-L146 PolarHBondContact O-N 3.01Å; L142-L146 VanDerWaalsContact O-N 3.11Å; L143-L146 PolarHBondContact O-N 2.94Å; G144-L146 PolarHBondContact O-N 3.41Å
147Q72.4Confident70.8Confident46 Ų4680.1 Ų80.122%0.21544%0.441CS..Hα-helixtrans-65.7-41.8173.8-68.2-171.720.900112.6L143 G144 S145 R150 K151 V190 I194L143-Q147 PolarHBondContact O-N 3.31Å; G144-Q147 WeakPolarHBondContact O-CB 3.28Å; G144-Q147 PolarHBondContact O-N 3.46Å; S145-Q147 VanDerWaalsContact C-N 3.32Å; S145-Q147 PolarHBondContact O-N 2.81Å; Q147-R150 PolarHBondContact O-N 3.02Å; Q147-K151 PolarHBondContact O-N 3.42Å; Q147-V190 HydrophobicContact CG-CB 4.13Å; Q147-V190 HydrophobicContact CG-CG1 3.83Å; Q147-V190 VanDerWaalsContact NE2-CG1 3.26Å; Q147-V190 PolarHBondContact NE2-O 3.2Å; Q147-I194 VanDerWaalsContact NE2-CD1 3.31Å
148L61.9Low67.8Low122 Ų12280.8 Ų80.864%0.63945%0.45SS*.Hα-helixtrans-67.8-41-177.9-68.5172.3000112.5G144 S145 R150 K151 G152G144-L148 WeakPolarHBondContact O-CG 3.32Å; G144-L148 PolarHBondContact O-N 2.83Å; G144-L148 VanDerWaalsContact O-N 3.11Å; S145-L148 PolarHBondContact O-N 3.44Å; L148-R150 PolarHBondContact O-N 3.38Å; L148-K151 PolarHBondContact O-N 2.97Å; L148-G152 PolarHBondContact O-N 3.48Å
149H60.5Low65.2Low157 Ų15782.5 Ų82.573%0.72747%0.471SS*.Hα-helixtrans-60.2-31.3176.5-95.8-76.1000112.9S145S145-H149 PolarHBondContact O-N 3.21Å
150R57.1Low62.4Low87 Ų8785.9 Ų85.933%0.32851%0.506SS..Hα-helixtrans-73.1-46.9175-166.3179.5-169.3166.110.1111.8Q147 L148 G152 K153 D154 C183Q147-R150 PolarHBondContact O-N 3.02Å; L148-R150 PolarHBondContact O-N 3.38Å; R150-G152 PolarHBondContact O-N 3.05Å; R150-K153 PolarHBondContact O-N 3.35Å; R150-D154 PolarHBondContact O-N 3.29Å; R150-C183 PolarHBondContact NE-SG 2.87Å; R150-C183 PolarHBondContact NH1-O 3.03Å; R150-C183 VanDerWaalsContact NH2-CA 3.34Å; R150-C183 PolarHBondContact NH2-SG 3.48Å
151K54.6Low59.9Low167 Ų16792.7 Ų92.773%0.72654%0.54SS*.Hα-helixtrans-62.1-30.5179.8-167.4169.1179.7177.80113.1Q147 L148Q147-K151 PolarHBondContact O-N 3.42Å; L148-K151 PolarHBondContact O-N 2.97Å
152G52.7Low57.5Low48 Ų4896.3 Ų96.350%0.49556%0.555SS.*Hα-helixtrans-77.2-19.4174.300000115.1L148 R150 S155L148-G152 PolarHBondContact O-N 3.48Å; R150-G152 PolarHBondContact O-N 3.05Å; G152-S155 PolarHBondContact O-OG 2.89Å; G152-S155 VanDerWaalsContact O-OG 3.09Å
153K48.1Very low54.6Low178 Ų17899 Ų9977%0.77458%0.578SS**Hα-helixtrans-87-26178.7-159.5166.8-179178.20112.5R150R150-K153 PolarHBondContact O-N 3.35Å
154D46.8Very low52.1Low111 Ų111108 Ų10859%0.59462%0.617SS**THydrogen-bonded Turntrans-85.7-6.9175.1-62.8-33.5000113.4R150R150-D154 PolarHBondContact O-N 3.29Å
155S39Very low49.6Very low90 Ų90112.5 Ų112.563%0.62964%0.641SS**THydrogen-bonded Turntrans-91.510.3-179.9600000115G152G152-S155 PolarHBondContact O-OG 2.89Å; G152-S155 VanDerWaalsContact O-OG 3.09Å
156C37.5Very low47.3Very low118 Ų118118.1 Ų118.180%0.79766%0.661SS**  trans-105.253.8177.4-165.60000112.1
157C34Very low45.6Very low108 Ų108123.1 Ų123.173%0.7369%0.688SS**  trans-118.5116.5156.5-159.60000107
158P36.9Very low43.9Very low101 Ų101126.6 Ų126.666%0.65672%0.717SS**  trans-60.4145.4172.925.5-30.3000108.7G160P158-G160 PolarHBondContact O-N 3.34Å
159P42.6Very low43.3Very low126 Ų126128.1 Ų128.182%0.81873%0.726SS**  trans-66.194.6167.725-25.2000107I161P159-I161 PolarHBondContact O-N 3.38Å
160G37.3Very low42.5Very low72 Ų72127.3 Ų127.374%0.74273%0.725SS**  trans-57.9117.3174.900000108.9P158P158-G160 PolarHBondContact O-N 3.34Å
161I44.1Very low42Very low162 Ų162129.2 Ų129.283%0.83175%0.749SS**  trans-57.6137175.1-73.3160.9000110P159P159-I161 PolarHBondContact O-N 3.38Å
162D43.4Very low41.5Very low150 Ų150127.8 Ų127.880%0.80275%0.748SS**  trans-43.3133.6172.5-149.1-0.3000113.6
163S33.4Very low41.5Very low115 Ų115132.7 Ų132.780%0.80476%0.762SS**  trans-158.5126163.6-77.20000111.9
164K39Very low41.3Very low193 Ų193132.4 Ų132.484%0.83976%0.763SS**  trans-63.6155.5-178.3-69.7175.9165.4179.60114.6
165T37.4Very low41Very low113 Ų113134 Ų13469%0.69377%0.772SS**  trans84121.6135.9-73.90000120.7
166E37Very low41.3Very low177 Ų177135.3 Ų135.383%0.82778%0.776SS**  trans82.9112.8145.1-75.9168.3168.500123.1
167D41.1Very low41.3Very low145 Ų145135.2 Ų135.278%0.77578%0.777SS**  46.1113.7127-154.934000120.2
168S38.3Very low41.7Very low119 Ų119134.6 Ų134.683%0.83277%0.774SS**  trans-174.3120.3144.6-82.50000112.2
169D49.1Very low41.8Very low153 Ų153133.3 Ų133.382%0.81877%0.767SS**  trans-64.9124.1171.1-77.4-50.2000113.6
170I44.3Very low42Very low140 Ų140132.8 Ų132.872%0.71876%0.764SS**  trans-151.8125.6148.7-48.3177.9000109.3I172I170-I172 HydrophobicContact CG2-CD1 4.26Å; I170-I172 HydrophobicContact CG2-CG1 3.96Å
171P45.9Very low42.5Very low127 Ų127134.2 Ų134.283%0.82576%0.758SS**  trans-94.7108167.233.5-23.3000109.7
172I43.1Very low42.7Very low138 Ų138131.8 Ų131.871%0.70875%0.747SS**  trans-115.9108.5161.1-61177000107.2I170 E174I170-I172 HydrophobicContact CG2-CD1 4.26Å; I170-I172 HydrophobicContact CG2-CG1 3.96Å; I172-E174 HydrophobicContact CG2-CG 4.49Å; I172-E174 PolarHBondContact O-N 2.88Å
173L53.9Low43.3Very low150 Ų150126.6 Ų126.679%0.78572%0.722SS**  trans-72100175.4-136.6165.3000107.4
174E42.9Very low44.5Very low172 Ų172125.4 Ų125.480%0.80471%0.711SS**  trans-112.6102.6159.2-79.7-171.3131.500108.2I172 T176I172-E174 HydrophobicContact CG2-CG 4.49Å; I172-E174 PolarHBondContact O-N 2.88Å; E174-T176 VanDerWaalsContact C-N 3.31Å; E174-T176 PolarHBondContact O-N 3.41Å
175D41.4Very low45.7Very low145 Ų145122.6 Ų122.678%0.77570%0.701SS**  trans-5790.2167.1-94.7-39.4000109.6
176T45.8Very low47.1Very low117 Ų117119.5 Ų119.572%0.71868%0.68SS**  trans-130.777.9152.6-37.50000107.9E174 S178E174-T176 VanDerWaalsContact C-N 3.31Å; E174-T176 PolarHBondContact O-N 3.41Å; T176-S178 PolarHBondContact O-N 2.91Å
177S36.3Very low48.4Very low117 Ų117113.5 Ų113.582%0.81866%0.658SS**  trans-64.783164.8173.80000109
178S42.1Very low49.9Very low94 Ų94115.7 Ų115.766%0.65766%0.655SS**  trans-9597.1158.357.60000107.3T176 P180T176-S178 PolarHBondContact O-N 2.91Å; S178-P180 VanDerWaalsContact O-CD 3.31Å; S178-P180 WeakPolarHBondContact O-CD 3.34Å
179S39.7Very low52Low75 Ų75114 Ų11452%0.52464%0.636SS.*  trans-60.5122170.447.10000109.8T181S179-T181 PolarHBondContact O-N 3.27Å
180P47Very low53.9Low115 Ų115107.1 Ų107.175%0.74760%0.6SS**THydrogen-bonded Turntrans-76.36178.5-12.528.8000114.3S178S178-P180 VanDerWaalsContact O-CD 3.31Å; S178-P180 WeakPolarHBondContact O-CD 3.34Å
181T46.8Very low56Low102 Ų102102.6 Ų102.663%0.62658%0.583SS**THydrogen-bonded Turntrans-86.4-17.8-160.5-42.20000114.5S179 C183 P184S179-T181 PolarHBondContact O-N 3.27Å; T181-C183 VanDerWaalsContact C-N 3.34Å; T181-C183 PolarHBondContact O-N 3.29Å; T181-P184 WeakPolarHBondContact O-CD 3.26Å
182D49.9Very low58.2Low110 Ų11098.7 Ų98.759%0.58856%0.557SS**Hα-helixtrans-84.4-6.6-175.5-61.8-44.9000114
183C54.4Low60.6Low41 Ų4193.1 Ų93.128%0.27753%0.529SS..Hα-helixtrans-71.6-47.6-174.3-166.50000114.4R150 T181R150-C183 PolarHBondContact NE-SG 2.87Å; R150-C183 PolarHBondContact NH1-O 3.03Å; R150-C183 VanDerWaalsContact NH2-CA 3.34Å; R150-C183 PolarHBondContact NH2-SG 3.48Å; T181-C183 VanDerWaalsContact C-N 3.34Å; T181-C183 PolarHBondContact O-N 3.29Å
184P59.7Low62.6Low90 Ų9087.1 Ų87.158%0.58450%0.497SS*.Hα-helixtrans-70.7-37.2-178.4-1832.5000113.1T181 C187 W188T181-P184 WeakPolarHBondContact O-CD 3.26Å; P184-C187 PolarHBondContact O-N 3.23Å; P184-W188 PolarHBondContact O-N 3.21Å; P184-W188 VanDerWaalsContact O-N 3.13Å
185Q64.4Low65.2Low134 Ų13485 Ų8563%0.62649%0.487SS*.Hα-helixtrans-70.4-37.8-173-168.1163.71.100112.3W188 L189Q185-W188 PolarHBondContact O-N 3.05Å; Q185-L189 WeakPolarHBondContact O-CG 3.4Å; Q185-L189 PolarHBondContact O-N 2.87Å
186L65.5Low67.9Low49 Ų4980.9 Ų80.926%0.25747%0.465SS..Hα-helixtrans-69.2-37.8176.4-161.675.5000112D75 P77 W188 L189 V190D75-L186 HydrophobicContact CB-CD2 4.17Å; D75-L186 WeakPolarHBondContact OD2-CG 3.46Å; P77-L186 HydrophobicContact CG-CD1 4.42Å; L186-W188 VanDerWaalsContact C-N 3.33Å; L186-W188 PolarHBondContact O-N 3.31Å; L186-L189 PolarHBondContact O-N 2.92Å; L186-V190 WeakPolarHBondContact O-CG2 3.31Å; L186-V190 PolarHBondContact O-N 3.5Å
187C65.1Low70.4Confident51 Ų5175.4 Ų75.435%0.34543%0.431SS..Hα-helixtrans-61.8-41.8174.5-170.60000111.7P184 L189 V190 A191P184-C187 PolarHBondContact O-N 3.23Å; C187-L189 VanDerWaalsContact C-N 3.35Å; C187-L189 PolarHBondContact O-N 3.25Å; C187-V190 PolarHBondContact O-N 2.93Å; C187-A191 PolarHBondContact O-N 3.44Å; C187-A191 VanDerWaalsContact O-N 3.14Å
188W72.8Confident73.3Confident191 Ų19173.4 Ų73.472%0.72341%0.409SS*.Hα-helixtrans-62.3-40.6177.5-14391.7000112.2P184 Q185 L186 A191 T192P184-W188 PolarHBondContact O-N 3.21Å; P184-W188 VanDerWaalsContact O-N 3.13Å; Q185-W188 PolarHBondContact O-N 3.05Å; L186-W188 VanDerWaalsContact C-N 3.33Å; L186-W188 PolarHBondContact O-N 3.31Å; W188-A191 PolarHBondContact O-N 3.4Å; W188-T192 WeakPolarHBondContact CZ3-OG1 3.49Å; W188-T192 PolarHBondContact O-N 2.97Å; W188-T192 PolarHBondContact O-OG1 3.13Å
189L83.1Confident76Confident84 Ų8474.2 Ų74.244%0.4440%0.401SS..Hα-helixtrans-62.6-43.2177.1-75161.1000112.7Q185 L186 C187 A191 T192 D193Q185-L189 WeakPolarHBondContact O-CG 3.4Å; Q185-L189 PolarHBondContact O-N 2.87Å; L186-L189 PolarHBondContact O-N 2.92Å; C187-L189 VanDerWaalsContact C-N 3.35Å; C187-L189 PolarHBondContact O-N 3.25Å; L189-A191 VanDerWaalsContact C-N 3.3Å; L189-A191 PolarHBondContact O-N 2.89Å; L189-T192 PolarHBondContact O-N 3.28Å; L189-D193 PolarHBondContact O-N 3.5Å
190V87.3Confident78.8Confident8 Ų872.1 Ų72.15%0.04838%0.384CS..Hα-helixtrans-66.3-35.6177.2-172.80000110.8L143 Q147 L186 C187 D193 I194L143-V190 HydrophobicContact CB-CG1 4.17Å; L143-V190 HydrophobicContact CD2-CG1 4.34Å; Q147-V190 HydrophobicContact CG-CB 4.13Å; Q147-V190 HydrophobicContact CG-CG1 3.83Å; Q147-V190 VanDerWaalsContact NE2-CG1 3.26Å; Q147-V190 PolarHBondContact NE2-O 3.2Å; L186-V190 WeakPolarHBondContact O-CG2 3.31Å; L186-V190 PolarHBondContact O-N 3.5Å; C187-V190 PolarHBondContact O-N 2.93Å; V190-D193 PolarHBondContact O-N 3.32Å; V190-I194 HydrophobicContact CG1-CD1 4.44Å; V190-I194 WeakPolarHBondContact O-CG1 3.26Å; V190-I194 PolarHBondContact O-N 3.21Å
191A89.8Confident81.3Confident44 Ų4467.5 Ų67.536%0.36435%0.352SS..Hα-helixtrans-64.4-43176.600000111.7C187 W188 L189 D193 I194 E195C187-A191 PolarHBondContact O-N 3.44Å; C187-A191 VanDerWaalsContact O-N 3.14Å; W188-A191 PolarHBondContact O-N 3.4Å; L189-A191 VanDerWaalsContact C-N 3.3Å; L189-A191 PolarHBondContact O-N 2.89Å; A191-D193 VanDerWaalsContact C-N 3.33Å; A191-D193 PolarHBondContact O-N 3.25Å; A191-I194 PolarHBondContact O-N 3.08Å; A191-E195 PolarHBondContact O-N 3.43Å
192T92.2Very high83.8Confident45 Ų4568.5 Ų68.528%0.27635%0.345SS..Hα-helixtrans-61-41172.8-56.40000112W188 L189 I194 E195 N196W188-T192 WeakPolarHBondContact CZ3-OG1 3.49Å; W188-T192 PolarHBondContact O-N 2.97Å; W188-T192 PolarHBondContact O-OG1 3.13Å; L189-T192 PolarHBondContact O-N 3.28Å; T192-I194 PolarHBondContact O-N 3.1Å; T192-E195 PolarHBondContact O-N 3.13Å; T192-N196 WeakPolarHBondContact O-CB 3.42Å; T192-N196 VanDerWaalsContact O-CG 3.3Å; T192-N196 PolarHBondContact O-N 3Å; T192-N196 PolarHBondContact O-ND2 3.15Å
193D93.6Very high86.1Confident22 Ų2266.9 Ų66.912%0.11834%0.336CS..Hα-helixtrans-62.1-43.1176.6-75-30.6000112R80 L189 V190 A191 N196 I197R80-D193 WeakPolarHBondContact CD-OD2 3.45Å; R80-D193 IonicContact CZ-OD2 2.69Å; R80-D193 IonicContact NE-OD2 3.45Å; R80-D193 IonicContact NH1-OD2 3.66Å; R80-D193 PolarHBondContact NH1-OD2 3.24Å; L189-D193 PolarHBondContact O-N 3.5Å; V190-D193 PolarHBondContact O-N 3.32Å; A191-D193 VanDerWaalsContact C-N 3.33Å; A191-D193 PolarHBondContact O-N 3.25Å; D193-N196 PolarHBondContact O-N 3.02Å; D193-I197 WeakPolarHBondContact O-CD1 3.47Å; D193-I197 WeakPolarHBondContact O-CG1 3.41Å; D193-I197 PolarHBondContact O-N 2.95Å
194I95.8Very high88.2Confident23 Ų2365 Ų6512%0.11832%0.323CS..Hα-helixtrans-59.6-50.4176-70.9173.8000110.8V140 L143 Q147 V190 A191 T192 N196 I197 E198V140-I194 HydrophobicContact CG1-CG2 3.91Å; V140-I194 HydrophobicContact CG2-CG2 4.47Å; L143-I194 HydrophobicContact CB-CD1 4.04Å; L143-I194 HydrophobicContact CB-CG1 3.93Å; L143-I194 HydrophobicContact CD1-CG1 4.48Å; Q147-I194 VanDerWaalsContact NE2-CD1 3.31Å; V190-I194 HydrophobicContact CG1-CD1 4.44Å; V190-I194 WeakPolarHBondContact O-CG1 3.26Å; V190-I194 PolarHBondContact O-N 3.21Å; A191-I194 PolarHBondContact O-N 3.08Å; T192-I194 PolarHBondContact O-N 3.1Å; I194-N196 VanDerWaalsContact C-N 3.28Å; I194-N196 PolarHBondContact O-N 3.36Å; I194-I197 PolarHBondContact O-N 3.38Å; I194-I197 VanDerWaalsContact O-N 3.11Å; I194-E198 HydrophobicContact CG2-CG 4.37Å; I194-E198 WeakPolarHBondContact O-CG 3.5Å; I194-E198 PolarHBondContact O-N 3.28Å
195E96.7Very high90Very high127 Ų12765.3 Ų65.359%0.59332%0.315SS*.Hα-helixtrans-58.3-42179.8-175.1-177.7-179.300111.7A191 T192 E198 K199A191-E195 PolarHBondContact O-N 3.43Å; T192-E195 PolarHBondContact O-N 3.13Å; E195-E198 PolarHBondContact O-N 3.02Å; E195-K199 WeakPolarHBondContact O-CB 3.47Å; E195-K199 PolarHBondContact O-N 3.45Å
196N97.8Very high91.6Very high60 Ų6063.3 Ų63.332%0.32131%0.309SS..Hα-helixtrans-63.6-42.8176.2-74.2-42.4000112.1T192 D193 I194 E198 K199 D200T192-N196 WeakPolarHBondContact O-CB 3.42Å; T192-N196 VanDerWaalsContact O-CG 3.3Å; T192-N196 PolarHBondContact O-N 3Å; T192-N196 PolarHBondContact O-ND2 3.15Å; D193-N196 PolarHBondContact O-N 3.02Å; I194-N196 VanDerWaalsContact C-N 3.28Å; I194-N196 PolarHBondContact O-N 3.36Å; N196-E198 VanDerWaalsContact C-N 3.35Å; N196-K199 PolarHBondContact O-N 3.24Å; N196-D200 PolarHBondContact O-N 3.22Å
197I98.3Very high93.2Very high2 Ų261.8 Ų61.81%0.0130%0.301CS..Hα-helixtrans-63.2-43.4176.2-63.5159.2000110.4M136 V140 L143 D193 I194 K199 D200 M201M136-I197 HydrophobicContact CB-CG2 3.98Å; M136-I197 HydrophobicContact CG-CG2 4.29Å; V140-I197 HydrophobicContact CG2-CB 3.89Å; V140-I197 HydrophobicContact CG2-CG2 3.54Å; L143-I197 HydrophobicContact CD1-CD1 3.64Å; D193-I197 WeakPolarHBondContact O-CD1 3.47Å; D193-I197 WeakPolarHBondContact O-CG1 3.41Å; D193-I197 PolarHBondContact O-N 2.95Å; I194-I197 PolarHBondContact O-N 3.38Å; I194-I197 VanDerWaalsContact O-N 3.11Å; I197-K199 VanDerWaalsContact C-N 3.31Å; I197-K199 PolarHBondContact O-N 2.87Å; I197-D200 PolarHBondContact O-N 3.22Å; I197-M201 VanDerWaalsContact O-CB 3.26Å; I197-M201 WeakPolarHBondContact O-CB 3.44Å; I197-M201 PolarHBondContact O-N 3.44Å
198E98.4Very high94.7Very high74 Ų7460 Ų6035%0.34629%0.288SS..Hα-helixtrans-62.5-39.8178.3-71.6-174.2153.300112.3V140 I194 E195 N196 M201 R202V140-E198 HydrophobicContact CG1-CG 4.35Å; V140-E198 HydrophobicContact CG2-CG 4Å; I194-E198 HydrophobicContact CG2-CG 4.37Å; I194-E198 WeakPolarHBondContact O-CG 3.5Å; I194-E198 PolarHBondContact O-N 3.28Å; E195-E198 PolarHBondContact O-N 3.02Å; N196-E198 VanDerWaalsContact C-N 3.35Å; E198-M201 PolarHBondContact O-N 2.96Å; E198-R202 WeakPolarHBondContact O-CG 3.49Å; E198-R202 PolarHBondContact O-N 3.04Å
199K98.5Very high95.8Very high111 Ų11153.9 Ų53.948%0.48327%0.274SS..Hα-helixtrans-61.2-53173.6-179.7-175.8172.6-179.60111.1E195 N196 I197 M201 R202 D203E195-K199 WeakPolarHBondContact O-CB 3.47Å; E195-K199 PolarHBondContact O-N 3.45Å; N196-K199 PolarHBondContact O-N 3.24Å; I197-K199 VanDerWaalsContact C-N 3.31Å; I197-K199 PolarHBondContact O-N 2.87Å; K199-M201 PolarHBondContact O-N 3.27Å; K199-R202 WeakPolarHBondContact O-CB 3.44Å; K199-R202 PolarHBondContact O-N 3Å; K199-R202 VanDerWaalsContact O-N 3.09Å; K199-D203 PolarHBondContact O-N 3.37Å
200D98.6Very high96.4Very high31 Ų3155.4 Ų55.417%0.16628%0.277CS..Hα-helixtrans-59.6-38.5179-73.6-23.6000111.2R87 M136 N196 I197 R202 D203 M204R87-D200 IonicContact CZ-OD2 3.14Å; R87-D200 IonicContact NE-OD2 3.69Å; R87-D200 PolarHBondContact NE-OD2 2.92Å; R87-D200 IonicContact NH2-OD2 2.65Å; R87-D200 PolarHBondContact NH2-OD2 3.35Å; M136-D200 HydrophobicContact CE-CB 4.06Å; N196-D200 PolarHBondContact O-N 3.22Å; I197-D200 PolarHBondContact O-N 3.22Å; D200-R202 PolarHBondContact O-N 2.95Å; D200-D203 PolarHBondContact O-N 3.26Å; D200-M204 VanDerWaalsContact O-CG 3.31Å; D200-M204 WeakPolarHBondContact O-CG 3.39Å; D200-M204 PolarHBondContact O-N 3.21Å
201M98.6Very high96.7Very high18 Ų1855 Ų559%0.08928%0.275CS..Hα-helixtrans-62.4-42.1175.6-177.1-175.853.100112I133 M136 L137 I197 E198 K199 D203 M204 K205I133-M201 HydrophobicContact CG2-CG 4.02Å; I133-M201 HydrophobicContact CG2-SD 4.48Å; M136-M201 HydrophobicContact CB-CB 4.24Å; M136-M201 HydrophobicContact CB-CG 4.34Å; M136-M201 HydrophobicContact SD-CB 3.99Å; L137-M201 HydrophobicContact CB-SD 4.05Å; L137-M201 HydrophobicContact CD1-SD 4.39Å; I197-M201 VanDerWaalsContact O-CB 3.26Å; I197-M201 WeakPolarHBondContact O-CB 3.44Å; I197-M201 PolarHBondContact O-N 3.44Å; E198-M201 PolarHBondContact O-N 2.96Å; K199-M201 PolarHBondContact O-N 3.27Å; M201-D203 VanDerWaalsContact C-N 3.32Å; M201-M204 PolarHBondContact O-N 3.46Å; M201-K205 WeakPolarHBondContact O-CG 3.5Å; M201-K205 PolarHBondContact O-N 2.85Å
202R98.6Very high96.8Very high124 Ų12458.1 Ų58.147%0.46828%0.277SS..Hα-helixtrans-61.5-43.4173.8-72.8-175.7-64.7-92.95.3110.8E198 K199 D200 M204 K205 N206E198-R202 WeakPolarHBondContact O-CG 3.49Å; E198-R202 PolarHBondContact O-N 3.04Å; K199-R202 WeakPolarHBondContact O-CB 3.44Å; K199-R202 PolarHBondContact O-N 3Å; K199-R202 VanDerWaalsContact O-N 3.09Å; D200-R202 PolarHBondContact O-N 2.95Å; R202-M204 PolarHBondContact O-N 3.45Å; R202-K205 PolarHBondContact O-N 3.22Å; R202-N206 VanDerWaalsContact O-CG 3.24Å; R202-N206 PolarHBondContact O-N 3.47Å; R202-N206 PolarHBondContact O-ND2 3.38Å
203D98.4Very high96.6Very high75 Ų7562.6 Ų62.640%0.40130%0.295SS..Hα-helixtrans-64.7-40.1178.3-70.7-15.2000112K199 D200 M201 N206 L207K199-D203 PolarHBondContact O-N 3.37Å; D200-D203 PolarHBondContact O-N 3.26Å; M201-D203 VanDerWaalsContact C-N 3.32Å; D203-N206 WeakPolarHBondContact O-CB 3.41Å; D203-N206 PolarHBondContact O-N 2.9Å; D203-L207 PolarHBondContact O-N 2.86Å
204M98.6Very high96.3Very high3 Ų364.4 Ų64.42%0.01531%0.307CS..Hα-helixtrans-67.5-37.1175.2-67.7-54.196.700112.2C91 A94 L129 Y132 I133 M136 D200 M201 R202 L207 L208C91-M204 HydrophobicContact CB-CE 3.98Å; C91-M204 HydrophobicContact CB-SD 4.41Å; A94-M204 HydrophobicContact CB-SD 3.86Å; L129-M204 HydrophobicContact CD2-CB 4.41Å; L129-M204 HydrophobicContact CD2-SD 4.07Å; Y132-M204 HydrophobicContact CD1-CG 4.18Å; Y132-M204 HydrophobicContact CD1-SD 4.43Å; Y132-M204 HydrophobicContact CE1-CG 4.23Å; Y132-M204 HydrophobicContact CE1-SD 4.35Å; I133-M204 HydrophobicContact CD1-CB 4.19Å; I133-M204 HydrophobicContact CG1-CB 3.72Å; M136-M204 HydrophobicContact CE-CG 4.04Å; M136-M204 HydrophobicContact SD-CG 4.18Å; D200-M204 VanDerWaalsContact O-CG 3.31Å; D200-M204 WeakPolarHBondContact O-CG 3.39Å; D200-M204 PolarHBondContact O-N 3.21Å; M201-M204 PolarHBondContact O-N 3.46Å; R202-M204 PolarHBondContact O-N 3.45Å; M204-L207 HydrophobicContact CE-CD2 4.4Å; M204-L207 WeakPolarHBondContact O-CB 3.45Å; M204-L207 PolarHBondContact O-N 3.28Å; M204-L207 HydrophobicContact SD-CD2 4.37Å; M204-L208 WeakPolarHBondContact O-CB 3.44Å; M204-L208 PolarHBondContact O-N 2.98Å
205K98.2Very high95.7Very high96 Ų9663.8 Ų63.842%0.41730%0.304SS..Hα-helixtrans-62.1-43.8171.6-75.8174.7179.3177.40111.6I133 M201 R202 L207 L208 S209I133-K205 HydrophobicContact CD1-CG 3.9Å; I133-K205 HydrophobicContact CG1-CG 4.31Å; I133-K205 HydrophobicContact CG2-CD 4.4Å; I133-K205 HydrophobicContact CG2-CG 3.92Å; M201-K205 WeakPolarHBondContact O-CG 3.5Å; M201-K205 PolarHBondContact O-N 2.85Å; R202-K205 PolarHBondContact O-N 3.22Å; K205-L207 VanDerWaalsContact C-N 3.29Å; K205-L207 PolarHBondContact O-N 3.32Å; K205-L208 WeakPolarHBondContact O-CB 3.48Å; K205-L208 PolarHBondContact O-N 3.38Å; K205-S209 PolarHBondContact O-N 3.02Å; K205-S209 PolarHBondContact O-OG 2.88Å
206N98.1Very high94.8Very high91 Ų9158.3 Ų58.349%0.48728%0.279SS..Hα-helixtrans-62-39.1175.5-68.7-27.5000111.6R202 D203 S209 K210R202-N206 VanDerWaalsContact O-CG 3.24Å; R202-N206 PolarHBondContact O-N 3.47Å; R202-N206 PolarHBondContact O-ND2 3.38Å; D203-N206 WeakPolarHBondContact O-CB 3.41Å; D203-N206 PolarHBondContact O-N 2.9Å; N206-S209 PolarHBondContact O-N 3.03Å; N206-K210 WeakPolarHBondContact O-CG 3.32Å; N206-K210 PolarHBondContact O-N 3.42Å; N206-K210 VanDerWaalsContact O-N 3.13Å
207L98.3Very high93.3Very high17 Ų1761 Ų619%0.08929%0.293CS..Hα-helixtrans-65.9-41175.4-171.165.4000112.1A94 R95 H98 L129 D203 M204 K205 S209 K210 L211A94-L207 HydrophobicContact CB-CD2 3.93Å; R95-L207 HydrophobicContact CG-CD2 4.06Å; H98-L207 HydrophobicContact CB-CD1 3.79Å; H98-L207 HydrophobicContact CB-CD2 4.47Å; H98-L207 HydrophobicContact CB-CG 4.32Å; L129-L207 HydrophobicContact CD1-CD2 4.44Å; L129-L207 HydrophobicContact CD1-CG 4.42Å; L129-L207 HydrophobicContact CD2-CD2 4.25Å; D203-L207 PolarHBondContact O-N 2.86Å; M204-L207 HydrophobicContact CE-CD2 4.4Å; M204-L207 WeakPolarHBondContact O-CB 3.45Å; M204-L207 PolarHBondContact O-N 3.28Å; M204-L207 HydrophobicContact SD-CD2 4.37Å; K205-L207 VanDerWaalsContact C-N 3.29Å; K205-L207 PolarHBondContact O-N 3.32Å; L207-S209 VanDerWaalsContact C-N 3.35Å; L207-K210 PolarHBondContact O-N 2.99Å; L207-L211 PolarHBondContact O-N 3.45Å
208L97.6Very high91.7Very high15 Ų1564.4 Ų64.48%0.07932%0.315CS..Hα-helixtrans-61.4-41.9175.1178.563.5000111.7Q126 L129 E130 I133 M204 K205 L211 R212Q126-L208 HydrophobicContact CG-CD1 3.84Å; L129-L208 HydrophobicContact CB-CD1 4.07Å; L129-L208 HydrophobicContact CD1-CB 4.46Å; L129-L208 HydrophobicContact CD1-CD1 4.42Å; E130-L208 HydrophobicContact CG-CD1 4.09Å; E130-L208 HydrophobicContact CG-CD2 3.67Å; I133-L208 HydrophobicContact CD1-CB 4.21Å; I133-L208 HydrophobicContact CD1-CD2 3.88Å; M204-L208 WeakPolarHBondContact O-CB 3.44Å; M204-L208 PolarHBondContact O-N 2.98Å; K205-L208 WeakPolarHBondContact O-CB 3.48Å; K205-L208 PolarHBondContact O-N 3.38Å; L208-L211 WeakPolarHBondContact O-CB 3.2Å; L208-L211 PolarHBondContact O-N 3.03Å; L208-R212 WeakPolarHBondContact O-CG 3.35Å; L208-R212 PolarHBondContact O-N 3.31Å; L208-R212 VanDerWaalsContact O-N 3.08Å
209S95.4Very high89.9Confident61 Ų6161.7 Ų61.743%0.42730%0.303SS..Hα-helixtrans-59.6-47.4174-60.70000111.7K205 N206 L207 L211 R212 E213K205-S209 PolarHBondContact O-N 3.02Å; K205-S209 PolarHBondContact O-OG 2.88Å; N206-S209 PolarHBondContact O-N 3.03Å; L207-S209 VanDerWaalsContact C-N 3.35Å; S209-L211 VanDerWaalsContact C-N 3.31Å; S209-L211 PolarHBondContact O-N 3.15Å; S209-R212 PolarHBondContact O-N 3.45Å; S209-E213 WeakPolarHBondContact O-CG 3.35Å; S209-E213 PolarHBondContact O-N 3.37Å
210K95.5Very high88Confident116 Ų11661.1 Ų61.150%0.50430%0.3SS..Hα-helixtrans-61.5-37.5176.3-69.5173.9-177.2-1790112.7N206 L207 E213 T214N206-K210 WeakPolarHBondContact O-CG 3.32Å; N206-K210 PolarHBondContact O-N 3.42Å; N206-K210 VanDerWaalsContact O-N 3.13Å; L207-K210 PolarHBondContact O-N 2.99Å; K210-E213 PolarHBondContact O-N 3.04Å; K210-T214 WeakPolarHBondContact O-CG2 3.29Å; K210-T214 PolarHBondContact O-N 3.37Å; K210-T214 PolarHBondContact O-OG1 3.48Å
211L94.5Very high86Confident0 Ų065.7 Ų65.70%033%0.325CS..Hα-helixtrans-62.3-44.5176.5-174.969.2000111.3L101 F122 L125 Q126 L129 L207 L208 S209 E213 T214 M215L101-L211 HydrophobicContact CD1-CD1 4.44Å; F122-L211 HydrophobicContact CD1-CD1 3.54Å; F122-L211 HydrophobicContact CD1-CG 4.14Å; F122-L211 HydrophobicContact CE1-CD1 3.64Å; F122-L211 HydrophobicContact CE1-CG 4.48Å; L125-L211 HydrophobicContact CB-CD2 4.18Å; L125-L211 HydrophobicContact CD2-CD1 3.85Å; L125-L211 HydrophobicContact CD2-CD2 4.17Å; L125-L211 HydrophobicContact CG-CD1 4.49Å; L125-L211 HydrophobicContact CG-CD2 3.93Å; Q126-L211 HydrophobicContact CB-CD2 3.82Å; L129-L211 HydrophobicContact CD1-CD2 4.01Å; L207-L211 PolarHBondContact O-N 3.45Å; L208-L211 WeakPolarHBondContact O-CB 3.2Å; L208-L211 PolarHBondContact O-N 3.03Å; S209-L211 VanDerWaalsContact C-N 3.31Å; S209-L211 PolarHBondContact O-N 3.15Å; L211-E213 VanDerWaalsContact C-N 3.34Å; L211-T214 PolarHBondContact O-N 2.87Å; L211-T214 PolarHBondContact O-OG1 2.82Å; L211-M215 PolarHBondContact O-N 3.33Å; L211-M215 VanDerWaalsContact O-N 3.1Å
212R91.4Very high84Confident110 Ų11070.9 Ų70.942%0.41535%0.349SS..Hα-helixtrans-66.9-35.8178.3-69.5175.6179.8176.7-0112.1E130 L208 S209 M215E130-R212 IonicContact OE1-CZ 3.47Å; E130-R212 IonicContact OE1-NE 3.78Å; E130-R212 IonicContact OE1-NH2 2.74Å; E130-R212 PolarHBondContact OE1-NH2 3.05Å; L208-R212 WeakPolarHBondContact O-CG 3.35Å; L208-R212 PolarHBondContact O-N 3.31Å; L208-R212 VanDerWaalsContact O-N 3.08Å; S209-R212 PolarHBondContact O-N 3.45Å; R212-M215 WeakPolarHBondContact O-CB 3.39Å; R212-M215 PolarHBondContact O-N 3.13Å
213E88.5Confident82Confident138 Ų13868 Ų6865%0.64534%0.343SS*.Hα-helixtrans-65.3-38.8175.3-73.8171.7-173.400112.7S209 K210 L211 M215S209-E213 WeakPolarHBondContact O-CG 3.35Å; S209-E213 PolarHBondContact O-N 3.37Å; K210-E213 PolarHBondContact O-N 3.04Å; L211-E213 VanDerWaalsContact C-N 3.34Å; E213-M215 VanDerWaalsContact C-N 3.32Å
214T86.8Confident79.7Confident61 Ų6171.7 Ų71.737%0.37436%0.362SS..THydrogen-bonded Turntrans-87.50.6-178.855.70000113.7K210 L211K210-T214 WeakPolarHBondContact O-CG2 3.29Å; K210-T214 PolarHBondContact O-N 3.37Å; K210-T214 PolarHBondContact O-OG1 3.48Å; L211-T214 PolarHBondContact O-N 2.87Å; L211-T214 PolarHBondContact O-OG1 2.82Å
215M82.5Confident77.4Confident10 Ų1076.4 Ų76.45%0.04940%0.395CS..SBendtrans-69.2138-176.7-157.3173.6-72.200111.4F122 Q126 L211 R212 E213 L219F122-M215 HydrophobicContact CB-CE 4.49Å; F122-M215 HydrophobicContact CB-CG 4.25Å; F122-M215 HydrophobicContact CD1-CB 4.32Å; F122-M215 HydrophobicContact CD1-CE 4.38Å; F122-M215 HydrophobicContact CD1-CG 3.95Å; F122-M215 HydrophobicContact CG-CG 4.22Å; Q126-M215 HydrophobicContact CB-CE 4.36Å; L211-M215 PolarHBondContact O-N 3.33Å; L211-M215 VanDerWaalsContact O-N 3.1Å; R212-M215 WeakPolarHBondContact O-CB 3.39Å; R212-M215 PolarHBondContact O-N 3.13Å; E213-M215 VanDerWaalsContact C-N 3.32Å; M215-L219 HydrophobicContact CG-CB 3.68Å; M215-L219 HydrophobicContact CG-CD1 3.59Å; M215-L219 HydrophobicContact CG-CG 4.25Å; M215-L219 HydrophobicContact SD-CB 3.5Å; M215-L219 WeakPolarHBondContact SD-CB 3.44Å; M215-L219 HydrophobicContact SD-CD1 3.74Å; M215-L219 HydrophobicContact SD-CG 4.25Å
216P78.2Confident75.1Confident11 Ų1175.8 Ų75.87%0.07140%0.403CS..  trans-56.9142.2178.6-22.328.5000112.9I114 F122 P218 L219 K220I114-P216 HydrophobicContact CD1-CB 3.64Å; I114-P216 HydrophobicContact CG1-CB 4.41Å; I114-P216 HydrophobicContact CG2-CB 4.22Å; I114-P216 HydrophobicContact CG2-CG 4.22Å; F122-P216 HydrophobicContact CD2-CG 4.09Å; F122-P216 HydrophobicContact CE2-CG 4.05Å; P216-P218 VanDerWaalsContact C-N 3.31Å; P216-P218 VanDerWaalsContact O-N 3.13Å; P216-L219 WeakPolarHBondContact O-CB 3.32Å; P216-L219 PolarHBondContact O-N 3.37Å; P216-K220 PolarHBondContact O-N 3.32Å
217L67.4Low72.7Confident118 Ų11877.3 Ų77.362%0.61841%0.411SS*.Hα-helixtrans-49.3-37.5-177-67.9172.3000115.5L219 K220 N221L217-L219 PolarHBondContact O-N 3.46Å; L217-L219 VanDerWaalsContact O-N 3.15Å; L217-K220 PolarHBondContact O-N 3.27Å; L217-N221 PolarHBondContact O-N 3.35Å; L217-N221 PolarHBondContact O-ND2 3.33Å
218P63Low70.3Confident72 Ų7284.2 Ų84.247%0.46845%0.447SS..Hα-helixtrans-58.1-25.9175.1-2635.6000114.2I114 P216I114-P218 HydrophobicContact CD1-CG 3.87Å; P216-P218 VanDerWaalsContact C-N 3.31Å; P216-P218 VanDerWaalsContact O-N 3.13Å
219L60.7Low67.6Low17 Ų1789.2 Ų89.29%0.08947%0.474CS..Hα-helixtrans-90.5-41.2176.6-59.9179.5000111.6C119 F122 I123 M215 P216 L217 N221 Q222C119-L219 HydrophobicContact CB-CD1 3.96Å; C119-L219 HydrophobicContact CB-CD2 4.31Å; C119-L219 HydrophobicContact CB-CG 4.36Å; F122-L219 HydrophobicContact CB-CD1 3.99Å; I123-L219 HydrophobicContact CD1-CD2 3.85Å; I123-L219 HydrophobicContact CG1-CD1 4.17Å; I123-L219 HydrophobicContact CG1-CD2 4.17Å; M215-L219 HydrophobicContact CG-CB 3.68Å; M215-L219 HydrophobicContact CG-CD1 3.59Å; M215-L219 HydrophobicContact CG-CG 4.25Å; M215-L219 HydrophobicContact SD-CB 3.5Å; M215-L219 WeakPolarHBondContact SD-CB 3.44Å; M215-L219 HydrophobicContact SD-CD1 3.74Å; M215-L219 HydrophobicContact SD-CG 4.25Å; P216-L219 WeakPolarHBondContact O-CB 3.32Å; P216-L219 PolarHBondContact O-N 3.37Å; L217-L219 PolarHBondContact O-N 3.46Å; L217-L219 VanDerWaalsContact O-N 3.15Å; L219-N221 PolarHBondContact O-N 3.25Å; L219-Q222 WeakPolarHBondContact O-CB 3.49Å; L219-Q222 PolarHBondContact O-N 2.96Å
220K59.7Low65Low99 Ų9994.1 Ų94.143%0.4349%0.494SS..Hα-helixtrans-59.9-32.7-178.4-166.3169.3-175.21690113.5P216 L217 Q222P216-K220 PolarHBondContact O-N 3.32Å; L217-K220 PolarHBondContact O-N 3.27Å; K220-Q222 VanDerWaalsContact C-N 3.26Å; K220-Q222 PolarHBondContact O-N 2.93Å
221N56.3Low62.2Low128 Ų12892.9 Ų92.968%0.68450%0.496SS*.THydrogen-bonded Turntrans-79.1-1.5178.8-64.3-33.9000114.1L217 L219L217-N221 PolarHBondContact O-N 3.35Å; L217-N221 PolarHBondContact O-ND2 3.33Å; L219-N221 PolarHBondContact O-N 3.25Å
222Q56.2Low59.6Low127 Ų12799 Ų9959%0.59354%0.536SS*.THydrogen-bonded Turntrans-94.7-19.4177.9-65.2-169.3-600113.6L219 K220 S226L219-Q222 WeakPolarHBondContact O-CB 3.49Å; L219-Q222 PolarHBondContact O-N 2.96Å; K220-Q222 VanDerWaalsContact C-N 3.26Å; K220-Q222 PolarHBondContact O-N 2.93Å; Q222-S226 PolarHBondContact O-OG 3.49Å
223D55.8Low56.9Low64 Ų64103 Ų10334%0.34255%0.553SS.*THydrogen-bonded Turntrans-81.4-16.7-167.7-77.9-36.7000115.1L227D223-L227 WeakPolarHBondContact OD1-CD1 3.43Å
224D52.1Low54.7Low151 Ų151101.5 Ų101.581%0.80756%0.555SS**THydrogen-bonded Turntrans-89.5-1.4-171.2-79.7-36.3000115.7
225S49.4Very low53Low102 Ų102107.2 Ų107.271%0.71358%0.582SS**THydrogen-bonded Turntrans-143.9-6.7-176.3-74.40000118.4N229S225-N229 PolarHBondContact O-ND2 3.3Å
226S48.8Very low51.2Low83 Ų83112 Ų11258%0.5861%0.612SS**SBendtrans-128.6-18-169600000117.3Q222Q222-S226 PolarHBondContact O-OG 3.49Å
227L49.1Very low49.7Very low124 Ų124122.9 Ų122.965%0.64965%0.651SS**SBendtrans-93.9-14.4-173.8-64.7-179.9000115.5D223D223-L227 WeakPolarHBondContact OD1-CD1 3.43Å
228L46.6Very low48.6Very low162 Ų162125.8 Ų125.885%0.84866%0.662SS**SBendtrans-111.40.2-179.9-65.8178.6000114.8L230L228-L230 PolarHBondContact O-N 3.37Å
229N41.2Very low47.8Very low119 Ų119133.5 Ų133.564%0.63668%0.682SS**  trans-7972.3170.2-79.1-53.9000110.1S225 T231S225-N229 PolarHBondContact O-ND2 3.3Å; N229-T231 PolarHBondContact O-N 3.44Å
230L41.8Very low47Very low165 Ų165142.2 Ų142.286%0.86472%0.719SS**  trans-70.153.4159.8-75.6165.4000110.2L228L228-L230 PolarHBondContact O-N 3.37Å
231T36.5Very low46.5Very low89 Ų89148.6 Ų148.655%0.54674%0.74SS.*  trans-77.2126154.220.40000106.4N229 Y233N229-T231 PolarHBondContact O-N 3.44Å; T231-Y233 PolarHBondContact O-N 2.9Å
232P39.3Very low46.4Very low129 Ų129153 Ų15384%0.83875%0.747SS**  trans-71.386-179.829.4-31.9000108.3P234P232-P234 WeakPolarHBondContact O-CD 3.19Å
233Y34.4Very low45.6Very low194 Ų194156.8 Ų156.876%0.76176%0.762SS**  trans-75.4120.1163.8-99.1-86.6000107.5T231 L235T231-Y233 PolarHBondContact O-N 2.9Å; Y233-L235 PolarHBondContact O-N 3.03Å
234P42.9Very low45Very low106 Ų106162.3 Ų162.369%0.68878%0.784SS**  trans-67.9114.8-176.526.8-31.6000108.9P232 V236P232-P234 WeakPolarHBondContact O-CD 3.19Å; P234-V236 HydrophobicContact CB-CG2 4.23Å; P234-V236 PolarHBondContact O-N 3.26Å
235L50.5Low45Very low181 Ų181158.6 Ų158.695%0.94878%0.781SS**  trans-71.759.1166.6-68.1174.4000110.1Y233 R237Y233-L235 PolarHBondContact O-N 3.03Å; L235-R237 PolarHBondContact O-N 3.43Å
236V44.7Very low44.8Very low112 Ų112161.1 Ų161.168%0.67979%0.786SS**  trans-83.297.6164.2-178.20000106.6P234 Q238P234-V236 HydrophobicContact CB-CG2 4.23Å; P234-V236 PolarHBondContact O-N 3.26Å; V236-Q238 VanDerWaalsContact C-N 3.3Å; V236-Q238 PolarHBondContact O-N 3.16Å
237R46.3Very low44.5Very low238 Ų238163.6 Ų163.690%0.89880%0.801SS**  trans-58.298.4159.7-166.9177.3-176.4172.81.9106.5L235 R239L235-R237 PolarHBondContact O-N 3.43Å; R237-R239 VanDerWaalsContact C-N 3.34Å; R237-R239 PolarHBondContact O-N 3.29Å
238Q44.2Very low44Very low179 Ų179163.2 Ų163.284%0.83681%0.808SS**  trans-59.399.3173.8-88.1-166.6-1000108.3V236 K240V236-Q238 VanDerWaalsContact C-N 3.3Å; V236-Q238 PolarHBondContact O-N 3.16Å; Q238-K240 PolarHBondContact O-N 3.27Å
239R47.2Very low43.9Very low235 Ų235163.8 Ų163.889%0.88781%0.811SS**  trans-66.4106.7164.8-163.9177.9-171.5175.62.3105.6R237 R241R237-R239 VanDerWaalsContact C-N 3.34Å; R237-R239 PolarHBondContact O-N 3.29Å; R239-R241 PolarHBondContact O-N 3.1Å
240K43.9Very low43.7Very low200 Ų200164.3 Ų164.387%0.8782%0.818SS**  trans-44.7100.3175.2-162.2173.3-173.6176.60108.6Q238 R242Q238-K240 PolarHBondContact O-N 3.27Å; K240-R242 PolarHBondContact O-N 2.76Å; K240-R242 VanDerWaalsContact O-N 3.1Å
241R49.9Very low43.3Very low233 Ų233163 Ų16388%0.87982%0.817SS**  trans-61.4115.4174.3-81.4-171.3-178.7-1691.4105.9R239 F243R239-R241 PolarHBondContact O-N 3.1Å; R241-F243 PolarHBondContact O-N 3Å
242R52.9Low43.2Very low220 Ų220167.6 Ų167.683%0.8385%0.853SS**  trans-64.6117.8161.7-66.1-175.9-169.7175.92.4105.4K240 F244K240-R242 PolarHBondContact O-N 2.76Å; K240-R242 VanDerWaalsContact O-N 3.1Å; R242-F244 PolarHBondContact O-N 2.98Å
243F40.1Very low43.4Very low206 Ų206169.5 Ų169.590%0.90485%0.853SS**  trans-56.9110170.1-88.4-97.6000107.9R241R241-F243 PolarHBondContact O-N 3Å
244F42.5Very low43.9Very low181 Ų181168.2 Ų168.279%0.79486%0.858SS**  trans-94107.2155.6-83.4-82.3000106R242 L246R242-F244 PolarHBondContact O-N 2.98Å; F244-L246 PolarHBondContact O-N 3.34Å
245G52.7Low44Very low73 Ų73171.7 Ų171.775%0.75387%0.868SS**  trans-63.1123.9169.800000109.4
246L44.6Very low43.6Very low155 Ų155171.1 Ų171.181%0.81286%0.863SS**  trans-131.292.1164-93144.9000106.1F244 C248F244-L246 PolarHBondContact O-N 3.34Å; L246-C248 PolarHBondContact O-N 3.39Å
247C44.2Very low43.5Very low134 Ų134174.8 Ų174.891%0.90587%0.874SS**  trans-73.1108.4161.7-70.90000107.7
248C37.1Very low43.3Very low116 Ų116170.6 Ų170.678%0.78487%0.873SS**  trans-136.987.5156.5-69.70000107.7L246L246-C248 PolarHBondContact O-N 3.39Å
249L46Very low43.3Very low175 Ų175170 Ų17092%0.91688%0.875SS**  trans-86.8105157.5-82.7163.2000106.7
250V35.3Very low43Very low129 Ų129165 Ų16578%0.78287%0.874SS**  trans-150.6105.6154.4-179.10000109.3
251T34.6Very low42.9Very low138 Ų138162.1 Ų162.185%0.84788%0.875SS**  trans-162.7114.5133.547.10000103.2
252S34.7Very low42.2Very low185 Ų185155.6 Ų155.6100%1.29487%0.874SS**  -82.1056.4-44.70000117.7

Retrieved 252 of 252 residues in 47.8 ms (Link to these results)