A0A077ZBM6_TRITR Loading...

Hairy:enhancer of split related with YRPW motif

AlphaFold DB , UniProt , Accession A0A077ZBM6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 316 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
1M43.7Very low44.5Very low239 Ų239152.6 Ų152.6100%1.17783%0.825SS**  086.40-70-69.8-176.400108.5
2P45.6Very low44.3Very low106 Ų106147.8 Ų147.869%0.68882%0.821SS**  trans-104.9148.9177.136.2-24.3000111.2
3L49.7Very low44Very low181 Ų181145.6 Ų145.695%0.94882%0.818SS**  trans-136.886.6157.7-79.6177.8000108.7
4D44.5Very low43.1Very low139 Ų139147.8 Ų147.874%0.74382%0.817SS**  trans-63142.6150.5-77.6-64000109.9
5N47Very low42.6Very low143 Ų143144.5 Ų144.577%0.76582%0.817SS**  trans-176.3106.7132.1-93-26.3000109.5
6Q47.2Very low41.9Very low149 Ų149146.7 Ų146.770%0.69682%0.815SS**  66.6104.588.6-111.3-169.659.900114.8
7A48.4Very low41.5Very low91 Ų91143.9 Ų143.975%0.75282%0.816SS**  trans-172.499.5133.500000107.8
8K49.5Very low40.9Very low165 Ų165145.8 Ų145.872%0.71782%0.816SS**  52.8103.787.3-65.8172.7179.1164.40109.8
9G36.2Very low40.4Very low76 Ų76144.7 Ų144.778%0.78482%0.817SS**  cis81.376.249.100000109.4
10T42.1Very low40.2Very low140 Ų140144.8 Ų144.886%0.85982%0.815SS**  trans-140.2105166.636.40000110.5A12T10-A12 PolarHBondContact O-N 3.27Å
11R35.6Very low39.7Very low250 Ų250147.4 Ų147.494%0.94382%0.817SS**  trans-68109.8168.5-162.7179.4-168.6-174.53.1107.3
12A41.9Very low39.4Very low94 Ų94144.9 Ų144.978%0.77780%0.8SS**  trans-76.6138.3175.300000110.5T10T10-A12 PolarHBondContact O-N 3.27Å
13P40.1Very low38.7Very low120 Ų120150.8 Ų150.878%0.77981%0.809SS**  trans-92.3157.5-163.932.8-24.7000113.1A15P13-A15 PolarHBondContact O-N 2.99Å
14H31.9Very low38.4Very low176 Ų176150.5 Ų150.582%0.81580%0.802SS**  trans-40.596.3171.8-146.1-80.3000113.5K16H14-K16 PolarHBondContact O-N 3.24Å; H14-K16 VanDerWaalsContact O-N 3.15Å
15A35.4Very low38Very low99 Ų99150 Ų15082%0.81880%0.799SS**  trans-7996.7172.400000109.9P13 A17P13-A15 PolarHBondContact O-N 2.99Å; A15-A17 PolarHBondContact O-N 2.87Å
16K32.3Very low37.2Very low179 Ų179153.6 Ų153.678%0.77880%0.802SS**  trans-64.8105.2165.5-73.5176.2176.1176.20108.5H14 H18H14-K16 PolarHBondContact O-N 3.24Å; H14-K16 VanDerWaalsContact O-N 3.15Å; K16-H18 PolarHBondContact O-N 2.69Å
17A34Very low36.4Very low100 Ų100155 Ų15583%0.82681%0.809SS**  trans-74.691.4170.200000109.7A15 C19A15-A17 PolarHBondContact O-N 2.87Å; A17-C19 PolarHBondContact O-N 2.71Å
18H31Very low35.5Very low177 Ų177156.8 Ų156.882%0.81981%0.81SS**  trans-78.589.6166.3-136.7-89000107.4K16K16-H18 PolarHBondContact O-N 2.69Å
19C31.8Very low34.6Very low125 Ų125154 Ų15485%0.84581%0.806SS**  trans-94.5117.1176.7-147.80000110.2A17A17-C19 PolarHBondContact O-N 2.71Å
20L35.3Very low34.3Very low146 Ų146155.8 Ų155.876%0.76480%0.797SS**  trans-51.7134.5-174.3-87.975.5000113.2K22L20-K22 PolarHBondContact O-N 3.35Å
21K31.4Very low34Very low200 Ų200159.8 Ų159.887%0.8780%0.796SS**  trans-64.586.2166.4-165100.4175.4-1790110
22K36.4Very low33.9Very low186 Ų186150.9 Ų150.981%0.80977%0.765SS**  trans-98.9109.2160.1-97.7-173.2176.6-176.70109.1L20 H24L20-K22 PolarHBondContact O-N 3.35Å; K22-H24 PolarHBondContact O-N 2.83Å
23R31.1Very low33.6Very low231 Ų231151.4 Ų151.487%0.87276%0.761SS**  trans-62.4118163.8-68.1-177.1-176.1-1731.3107.3
24H44Very low33.5Very low175 Ų175151.8 Ų151.881%0.8176%0.756SS**  trans-139.3141.1157.6-108.4-83.6000109.2K22K22-H24 PolarHBondContact O-N 2.83Å
25D35.3Very low33.6Very low129 Ų129150.5 Ų150.569%0.6975%0.753SS**  trans-49.2137.3-170.9-93.6-58.9000116H27D25-H27 PolarHBondContact O-N 3.31Å
26R29.9Very low33.4Very low217 Ų217151 Ų15182%0.81975%0.746SS**  trans5.2105.4139.7-67.7-177.8-104.6-147.6-3.2116.3
27H30.6Very low33.6Very low180 Ų180149.1 Ų149.183%0.83375%0.749SS**  trans-15390.8139.5-120-97.2000108D25 T29D25-H27 PolarHBondContact O-N 3.31Å; H27-T29 PolarHBondContact O-N 3.33Å
28V29.3Very low33.5Very low128 Ų128147.9 Ų147.978%0.77675%0.747SS**  trans-83.992.5167.9-174.10000106.4I30V28-I30 VanDerWaalsContact C-N 3.26Å; V28-I30 HydrophobicContact CB-CG1 4.5Å; V28-I30 HydrophobicContact CG1-CD1 4.19Å; V28-I30 HydrophobicContact CG1-CG1 3.53Å; V28-I30 PolarHBondContact O-N 3.29Å
29T30.7Very low33.4Very low106 Ų106144.3 Ų144.365%0.6575%0.748SS**  trans-73.186.5168.3-500000107.7H27 R31H27-T29 PolarHBondContact O-N 3.33Å; T29-R31 VanDerWaalsContact C-N 3.33Å; T29-R31 HydrophobicContact CG2-CG 4.33Å; T29-R31 PolarHBondContact O-N 3.34Å
30I30.7Very low33.5Very low113 Ų113142.8 Ų142.858%0.57974%0.744SS**  trans-72.794.1168.9-54.3-176.1000106.6V28 H32V28-I30 VanDerWaalsContact C-N 3.26Å; V28-I30 HydrophobicContact CB-CG1 4.5Å; V28-I30 HydrophobicContact CG1-CD1 4.19Å; V28-I30 HydrophobicContact CG1-CG1 3.53Å; V28-I30 PolarHBondContact O-N 3.29Å; I30-H32 PolarHBondContact O-N 2.89Å
31R34.8Very low33.3Very low225 Ų225143.1 Ų143.185%0.84975%0.747SS**  trans-65.998.9166-75.4-170.6172.8-165.6-1.5107.7T29T29-R31 VanDerWaalsContact C-N 3.33Å; T29-R31 HydrophobicContact CG2-CG 4.33Å; T29-R31 PolarHBondContact O-N 3.34Å
32H33.3Very low33.5Very low62 Ų62140.7 Ų140.729%0.28775%0.748SS.*  trans-65.1129.9175.1-154.4-90.7000108.9I30 L34I30-H32 PolarHBondContact O-N 2.89Å; H32-L34 PolarHBondContact O-N 3.04Å
33P36.8Very low33.2Very low106 Ų106138.6 Ų138.669%0.68875%0.746SS**THydrogen-bonded Turntrans-68.71.4-168.6-18.631000116.1
34L37.7Very low33.5Very low128 Ų128136.1 Ų136.167%0.6774%0.744SS**THydrogen-bonded Turntrans-114.59.3-172.3-71.1168.7000114.4H32 L194H32-L34 PolarHBondContact O-N 3.04Å; L34-L194 HydrophobicContact CD1-CD1 4.04Å
35I34.6Very low32.7Very low148 Ų148132.9 Ų132.976%0.75974%0.739SS**SBendtrans-103.4-7.4172.1-61.6175.7000112V37I35-V37 PolarHBondContact O-N 3.44Å
36T31Very low32.3Very low109 Ų109135.6 Ų135.667%0.66975%0.748SS**  trans-90.782.8169.3-2.30000109.4G38T36-G38 PolarHBondContact O-N 3.23Å
37V36Very low32.4Very low140 Ų140131 Ų13185%0.84875%0.749SS**  trans-68.6113.8164-171.70000107.4I35I35-V37 PolarHBondContact O-N 3.44Å
38G31.5Very low32.3Very low75 Ų75131.2 Ų131.277%0.77375%0.75SS**  trans49.282.2156.100000117.6T36T36-G38 PolarHBondContact O-N 3.23Å
39A30.2Very low32.5Very low102 Ų102135.9 Ų135.984%0.84375%0.754SS**  trans-114.777.2154.400000107.9
40A33.2Very low32.6Very low92 Ų92137.1 Ų137.176%0.7676%0.763SS**  trans-147128.4168.900000108.1
41D31.5Very low32.7Very low154 Ų154142.7 Ų142.782%0.82478%0.779SS**  trans6684.8-178.7-65.9-24.3000117.9
42V34.8Very low32.4Very low148 Ų148137.9 Ų137.990%0.89777%0.77SS**  trans-115.184.5154.8-175.80000107.3
43D31.2Very low32.4Very low142 Ų142146.9 Ų146.976%0.75980%0.801SS**  trans-124.7135.4160.5-87.8-39.6000108
44H36.5Very low32Very low179 Ų179151.8 Ų151.883%0.82981%0.806SS**  trans89.285.8177.3-70.268.7000119.7
45C26.1Very low31.6Very low107 Ų107153.4 Ų153.472%0.72382%0.815SS**  39.4128119.7-73.80000122.9
46H28.5Very low31.3Very low186 Ų186151.1 Ų151.186%0.86181%0.812SS**  trans68.593.2145.9-72.1-64.2000119.3
47S31.5Very low31.1Very low121 Ų121156.3 Ų156.385%0.84682%0.821SS**  -168.9128.1126.2-167.60000110.7R49S47-R49 PolarHBondContact O-N 3.27Å
48E27.5Very low30.6Very low184 Ų184156.3 Ų156.386%0.8682%0.822SS**  trans-68.4118178.9-57-169.1151.600111.4
49R33.8Very low30.5Very low227 Ų227156.4 Ų156.486%0.85781%0.81SS**  trans-162.2135.3140.6-66.1-155.7-172.3-153.1-0.2110.4S47 Y51S47-R49 PolarHBondContact O-N 3.27Å; R49-Y51 PolarHBondContact O-N 3.25Å
50P34.5Very low30.4Very low131 Ų131160.3 Ų160.385%0.85181%0.808SS**  trans-75.7116.2171.930.4-28.4000109D52P50-D52 PolarHBondContact O-N 3.05Å
51Y31.1Very low30.2Very low231 Ų231161.8 Ų161.891%0.90681%0.809SS**  trans-74.7114.3171.1-112.6-91.7000109.4R49 R53R49-Y51 PolarHBondContact O-N 3.25Å; Y51-R53 PolarHBondContact O-N 3.44Å
52D29.5Very low30.4Very low124 Ų124162.2 Ų162.266%0.66381%0.807SS**  trans-68.6120.9173.8-169.5-9.1000110P50 R54P50-D52 PolarHBondContact O-N 3.05Å; D52-R54 VanDerWaalsContact C-N 3.28Å; D52-R54 PolarHBondContact O-N 3.19Å; D52-R54 WeakPolarHBondContact OD1-CB 3.43Å; D52-R54 WeakPolarHBondContact OD1-CG 3.36Å; D52-R54 PolarHBondContact OD1-N 2.93Å; D52-R54 VanDerWaalsContact OD1-N 3.16Å
53R32.8Very low30.4Very low250 Ų250161.7 Ų161.794%0.94379%0.794SS**  trans-92.525.1-178-147.8-176.7-145.4-170.16.9112.5Y51Y51-R53 PolarHBondContact O-N 3.44Å
54R28.7Very low30.4Very low209 Ų209161 Ų16179%0.78979%0.788SS**  trans-100.476.9174-69.6-177.6-178.2-148.51.7110.9D52D52-R54 VanDerWaalsContact C-N 3.28Å; D52-R54 PolarHBondContact O-N 3.19Å; D52-R54 WeakPolarHBondContact OD1-CB 3.43Å; D52-R54 WeakPolarHBondContact OD1-CG 3.36Å; D52-R54 PolarHBondContact OD1-N 2.93Å; D52-R54 VanDerWaalsContact OD1-N 3.16Å
55L30Very low30.2Very low162 Ų162156.2 Ų156.285%0.84878%0.775SS**  trans-154.7127.5158.7-130.973.8000110.2
56S28.1Very low30.6Very low101 Ų101157 Ų15771%0.70678%0.777SS**SBendtrans83.556.3165750000120.3
57Y26.8Very low30.7Very low217 Ų217152.3 Ų152.385%0.85176%0.763SS**  trans-139.780.5143.8-72.7-79.1000109.5C59Y57-C59 PolarHBondContact O-N 3.42Å
58T25.9Very low30.8Very low141 Ų141152.3 Ų152.387%0.86576%0.759SS**  trans-87.384164.652.40000107.9
59C28.3Very low31.1Very low77 Ų77146.9 Ų146.952%0.5275%0.752SS.*  trans-108.3107.3162-81.50000107.4Y57Y57-C59 PolarHBondContact O-N 3.42Å
60F28Very low31.2Very low184 Ų184142.3 Ų142.381%0.80774%0.744SS**  trans1.297.9169.6-90-95.5000117.1
61P29.8Very low31.5Very low122 Ų122141.9 Ų141.979%0.79274%0.741SS**  trans-101.172.3166.836.3-25.2000109.5
62E35.6Very low31.6Very low164 Ų164138.2 Ų138.277%0.76673%0.727SS**SBendtrans-154.2-14.1170.3-121.2163.2-168.200116.5
63E34.2Very low32.5Very low137 Ų137137.9 Ų137.964%0.6473%0.729SS**SBendtrans-1119.4179.9-65.1-168163.300114.6R224E63-R224 VanDerWaalsContact O-CZ 3.32Å; E63-R224 PolarHBondContact O-NH1 3.33Å; E63-R224 PolarHBondContact O-NH2 2.9Å
64M32.3Very low33.5Very low126 Ų126129.4 Ų129.462%0.62171%0.708SS**SBendtrans-96.7-5.2178.7-132135.3151.600113.2T66 C67 R224M64-T66 PolarHBondContact O-N 2.79Å; M64-C67 PolarHBondContact O-N 3.22Å; M64-R224 VanDerWaalsContact CG-NH2 3.3Å; M64-R224 PolarHBondContact SD-NH2 2.88Å; M64-R224 VanDerWaalsContact SD-NH2 3.41Å
65S32.1Very low34.5Very low80 Ų80121.6 Ų121.656%0.55968%0.684SS**THydrogen-bonded Turntrans-69.5-15.3-175.9-30.40000114.3T68S65-T68 WeakPolarHBondContact O-CG2 3.43Å; S65-T68 PolarHBondContact O-OG1 2.8Å
66T33.2Very low35.4Very low124 Ų124121.4 Ų121.476%0.76168%0.679SS**THydrogen-bonded Turntrans-94.50.5179.933.30000114.3M64 T68M64-T66 PolarHBondContact O-N 2.79Å; T66-T68 VanDerWaalsContact C-N 3.33Å
67C31.3Very low36.4Very low86 Ų86125.4 Ų125.458%0.58168%0.678SS**  trans-99.742.7167.4-74.20000111.1M64 G69M64-C67 PolarHBondContact O-N 3.22Å; C67-G69 PolarHBondContact O-N 3.28Å
68T33.3Very low37.8Very low122 Ų122118.6 Ų118.675%0.74866%0.659SS**  trans-96.870.3176.742.40000109.4S65 T66S65-T68 WeakPolarHBondContact O-CG2 3.43Å; S65-T68 PolarHBondContact O-OG1 2.8Å; T66-T68 VanDerWaalsContact C-N 3.33Å
69G34.5Very low39.3Very low70 Ų70115.3 Ų115.372%0.72264%0.635SS**SBendtrans-165.70.3-179.300000117.3C67C67-G69 PolarHBondContact O-N 3.28Å
70L36Very low40.7Very low131 Ų131114.3 Ų114.369%0.68663%0.63SS**SBendtrans-116.3132.9179.7-65.7173.8000110.5Y72L70-Y72 VanDerWaalsContact C-N 3.35Å; L70-Y72 PolarHBondContact O-N 3.21Å
71P39.7Very low42.1Very low121 Ų121110.6 Ų110.679%0.78662%0.618SS**  trans-68.792.1178.828.4-32.2000109.6T73P71-T73 PolarHBondContact O-N 3.49Å
72Y33.7Very low43.4Very low155 Ų155107 Ų10761%0.60860%0.595SS**  trans-87.182.7-172.4-144.6-103.4000110.2L70 T75L70-Y72 VanDerWaalsContact C-N 3.35Å; L70-Y72 PolarHBondContact O-N 3.21Å; Y72-T75 WeakPolarHBondContact CD1-OG1 3.48Å; Y72-T75 HydrophobicContact CD2-CG2 4.27Å; Y72-T75 HydrophobicContact CE1-CG2 4.22Å; Y72-T75 WeakPolarHBondContact CE1-OG1 3.38Å; Y72-T75 HydrophobicContact CE2-CG2 3.61Å; Y72-T75 PolarHBondContact OH-OG1 2.94Å
73T49.4Very low44.5Very low117 Ų117102 Ų10272%0.71857%0.574SS**SBendtrans-127.30.6169.159.40000113.3P71P71-T73 PolarHBondContact O-N 3.49Å
74S53.7Low45.8Very low72 Ų7298.2 Ų98.250%0.50356%0.557SS.*SBendtrans-106.7-32.1-171.9-163.60000114.2E76 R77 V78S74-E76 PolarHBondContact O-N 3.13Å; S74-R77 PolarHBondContact O-N 3.02Å; S74-V78 WeakPolarHBondContact O-CG2 3.19Å; S74-V78 PolarHBondContact O-N 3.21Å
75T49.9Very low47Very low44 Ų4499.5 Ų99.527%0.2756%0.556SS.*Hα-helixtrans-65.8-41.1-174.345.20000113.5Y72 R77 V78 I79Y72-T75 WeakPolarHBondContact CD1-OG1 3.48Å; Y72-T75 HydrophobicContact CD2-CG2 4.27Å; Y72-T75 HydrophobicContact CE1-CG2 4.22Å; Y72-T75 WeakPolarHBondContact CE1-OG1 3.38Å; Y72-T75 HydrophobicContact CE2-CG2 3.61Å; Y72-T75 PolarHBondContact OH-OG1 2.94Å; T75-R77 VanDerWaalsContact C-N 3.27Å; T75-R77 PolarHBondContact O-N 3.26Å; T75-V78 PolarHBondContact O-N 3.25Å; T75-I79 WeakPolarHBondContact O-CB 3.37Å; T75-I79 WeakPolarHBondContact O-CD1 3.44Å; T75-I79 WeakPolarHBondContact O-CG1 3.46Å; T75-I79 PolarHBondContact O-N 3.26Å
76E48.6Very low48.1Very low158 Ų15897 Ų9774%0.73854%0.54SS*.Hα-helixtrans-61.8-36.3175.1-67.7-174154.300111.9S74 S80S74-E76 PolarHBondContact O-N 3.13Å; E76-S80 VanDerWaalsContact O-CB 3.23Å; E76-S80 WeakPolarHBondContact O-CB 3.36Å; E76-S80 PolarHBondContact O-N 3.46Å
77R49Very low49.1Very low186 Ų18692.1 Ų92.170%0.70251%0.51SS*.Hα-helixtrans-70.3-45.7175.8-70.8-175.5-179.9-162.60.3111.8S74 T75 I79 S80 D81S74-R77 PolarHBondContact O-N 3.02Å; T75-R77 VanDerWaalsContact C-N 3.27Å; T75-R77 PolarHBondContact O-N 3.26Å; R77-I79 VanDerWaalsContact C-N 3.31Å; R77-I79 PolarHBondContact O-N 3.37Å; R77-S80 PolarHBondContact O-N 2.95Å; R77-D81 WeakPolarHBondContact O-CB 3.44Å; R77-D81 VanDerWaalsContact O-CG 3.3Å; R77-D81 PolarHBondContact O-N 3.47Å
78V56.1Low50.4Low74 Ų7491.3 Ų91.345%0.44851%0.505SS..Hα-helixtrans-60.7-43177.4174.90000110.6S74 T75 D81 C82S74-V78 WeakPolarHBondContact O-CG2 3.19Å; S74-V78 PolarHBondContact O-N 3.21Å; T75-V78 PolarHBondContact O-N 3.25Å; V78-D81 PolarHBondContact O-N 2.95Å; V78-C82 VanDerWaalsContact O-CB 3.27Å; V78-C82 WeakPolarHBondContact O-CB 3.49Å; V78-C82 PolarHBondContact O-N 2.95Å; V78-C82 PolarHBondContact O-SG 2.67Å
79I57.1Low51.3Low71 Ų7190.8 Ų90.836%0.36449%0.494SS..Hα-helixtrans-64.8-44.7176.6-66.8164.6000110.6T75 R77 C82 L83T75-I79 WeakPolarHBondContact O-CB 3.37Å; T75-I79 WeakPolarHBondContact O-CD1 3.44Å; T75-I79 WeakPolarHBondContact O-CG1 3.46Å; T75-I79 PolarHBondContact O-N 3.26Å; R77-I79 VanDerWaalsContact C-N 3.31Å; R77-I79 PolarHBondContact O-N 3.37Å; I79-C82 PolarHBondContact O-N 3.4Å; I79-L83 HydrophobicContact CG2-CD1 3.89Å; I79-L83 HydrophobicContact CG2-CG 4.42Å; I79-L83 WeakPolarHBondContact O-CB 3.5Å; I79-L83 VanDerWaalsContact O-CG 3.24Å; I79-L83 WeakPolarHBondContact O-CG 3.46Å; I79-L83 PolarHBondContact O-N 2.93Å
80S58.3Low52.1Low57 Ų5791.5 Ų91.540%0.39948%0.477SS..Hα-helixtrans-60.6-47.5176.4-179.60000112E76 R77 L83 I84E76-S80 VanDerWaalsContact O-CB 3.23Å; E76-S80 WeakPolarHBondContact O-CB 3.36Å; E76-S80 PolarHBondContact O-N 3.46Å; R77-S80 PolarHBondContact O-N 2.95Å; S80-L83 PolarHBondContact O-N 3.32Å; S80-I84 WeakPolarHBondContact O-CB 3.27Å; S80-I84 WeakPolarHBondContact O-CD1 3.41Å; S80-I84 WeakPolarHBondContact O-CG1 3.28Å; S80-I84 PolarHBondContact O-N 2.85Å
81D56.3Low52.6Low105 Ų10590.8 Ų90.856%0.56147%0.474SS*.Hα-helixtrans-67-39.9-179.3-71.3-15.7000111.4R77 V78 I84 Y85R77-D81 WeakPolarHBondContact O-CB 3.44Å; R77-D81 VanDerWaalsContact O-CG 3.3Å; R77-D81 PolarHBondContact O-N 3.47Å; V78-D81 PolarHBondContact O-N 2.95Å; D81-I84 PolarHBondContact O-N 2.88Å; D81-Y85 VanDerWaalsContact O-CB 3.23Å; D81-Y85 WeakPolarHBondContact O-CB 3.32Å; D81-Y85 PolarHBondContact O-N 3.36Å
82C56.7Low52.8Low47 Ų4787.7 Ų87.732%0.31846%0.463SS..Hα-helixtrans-64.1-41.5173.7-75.80000112.2V78 I79 Y85 A86 C201V78-C82 VanDerWaalsContact O-CB 3.27Å; V78-C82 WeakPolarHBondContact O-CB 3.49Å; V78-C82 PolarHBondContact O-N 2.95Å; V78-C82 PolarHBondContact O-SG 2.67Å; I79-C82 PolarHBondContact O-N 3.4Å; C82-Y85 PolarHBondContact O-N 3.2Å; C82-A86 VanDerWaalsContact O-CB 3.31Å; C82-A86 WeakPolarHBondContact O-CB 3.48Å; C82-A86 PolarHBondContact O-N 3.23Å; C82-C201 VanDerWaalsContact CB-SG 3.55Å
83L58.5Low53.3Low60 Ų6088.1 Ų88.131%0.31447%0.468SS..Hα-helixtrans-65.2-44.6175.8-74.9171.4000111.6I79 S80 Y85 A86 T87 Y198I79-L83 HydrophobicContact CG2-CD1 3.89Å; I79-L83 HydrophobicContact CG2-CG 4.42Å; I79-L83 WeakPolarHBondContact O-CB 3.5Å; I79-L83 VanDerWaalsContact O-CG 3.24Å; I79-L83 WeakPolarHBondContact O-CG 3.46Å; I79-L83 PolarHBondContact O-N 2.93Å; S80-L83 PolarHBondContact O-N 3.32Å; L83-Y85 VanDerWaalsContact C-N 3.34Å; L83-Y85 PolarHBondContact O-N 3.19Å; L83-A86 PolarHBondContact O-N 2.91Å; L83-T87 WeakPolarHBondContact O-CG2 3.34Å; L83-T87 PolarHBondContact O-N 3.27Å; L83-T87 PolarHBondContact O-OG1 2.93Å; L83-T87 VanDerWaalsContact O-OG1 3.13Å; L83-Y198 HydrophobicContact CD2-CD2 3.86Å; L83-Y198 HydrophobicContact CD2-CE2 4.34Å
84I63Low52.9Low56 Ų5691.4 Ų91.429%0.28747%0.469SS..Hα-helixtrans-62.6-42.3176.3-69165.1000110.8S80 D81 T87 S88S80-I84 WeakPolarHBondContact O-CB 3.27Å; S80-I84 WeakPolarHBondContact O-CD1 3.41Å; S80-I84 WeakPolarHBondContact O-CG1 3.28Å; S80-I84 PolarHBondContact O-N 2.85Å; D81-I84 PolarHBondContact O-N 2.88Å; I84-T87 PolarHBondContact O-N 3.44Å; I84-T87 PolarHBondContact O-OG1 3.16Å; I84-T87 VanDerWaalsContact O-OG1 3.13Å; I84-S88 WeakPolarHBondContact O-CB 3.48Å; I84-S88 PolarHBondContact O-N 3.42Å; I84-S88 PolarHBondContact O-OG 2.95Å
85Y56.3Low52.7Low154 Ų15493.5 Ų93.560%0.60448%0.479SS*.Hα-helixtrans-63.7-44.5177.6-174.8-97.6000111.3D81 C82 L83 S88 H89D81-Y85 VanDerWaalsContact O-CB 3.23Å; D81-Y85 WeakPolarHBondContact O-CB 3.32Å; D81-Y85 PolarHBondContact O-N 3.36Å; C82-Y85 PolarHBondContact O-N 3.2Å; L83-Y85 VanDerWaalsContact C-N 3.34Å; L83-Y85 PolarHBondContact O-N 3.19Å; Y85-S88 PolarHBondContact O-N 3Å; Y85-H89 AromaticContact CE2-CD2 3.77Å; Y85-H89 PolarHBondContact O-N 3.47Å
86A55.2Low52.2Low26 Ų26100.5 Ų100.522%0.21551%0.505CS..Hα-helixtrans-63.5-41.1178.300000112.6C82 L83C82-A86 VanDerWaalsContact O-CB 3.31Å; C82-A86 WeakPolarHBondContact O-CB 3.48Å; C82-A86 PolarHBondContact O-N 3.23Å; L83-A86 PolarHBondContact O-N 2.91Å
87T55.6Low51.8Low23 Ų2398.1 Ų98.114%0.14150%0.502CS..Hα-helixtrans-73.9-37.6178.957.10000112.6L83 I84 L91 L194L83-T87 WeakPolarHBondContact O-CG2 3.34Å; L83-T87 PolarHBondContact O-N 3.27Å; L83-T87 PolarHBondContact O-OG1 2.93Å; L83-T87 VanDerWaalsContact O-OG1 3.13Å; I84-T87 PolarHBondContact O-N 3.44Å; I84-T87 PolarHBondContact O-OG1 3.16Å; I84-T87 VanDerWaalsContact O-OG1 3.13Å; T87-L91 WeakPolarHBondContact O-CD1 3.06Å; T87-L194 HydrophobicContact CG2-CD1 4.46Å; T87-L194 HydrophobicContact CG2-CG 4.15Å
88S57.4Low51.4Low68 Ų6894.9 Ų94.948%0.47650%0.502SS..Hα-helixtrans-77.2-38.1-173.4-57.10000113.7I84 Y85I84-S88 WeakPolarHBondContact O-CB 3.48Å; I84-S88 PolarHBondContact O-N 3.42Å; I84-S88 PolarHBondContact O-OG 2.95Å; Y85-S88 PolarHBondContact O-N 3Å
89H52.9Low50.6Low112 Ų11298.9 Ų98.952%0.51952%0.521SS..Hα-helixtrans-81.1-18.7-170.4-123.3-88.6000114.6Y85Y85-H89 AromaticContact CE2-CD2 3.77Å; Y85-H89 PolarHBondContact O-N 3.47Å
90K50.5Low49.8Very low85 Ų85101.4 Ų101.437%0.3754%0.544SS..Hα-helixtrans-91.9-34.7174.9-90.6-176.4177.7161.50113.3G92 K93 E200K90-G92 PolarHBondContact O-N 2.94Å; K90-K93 PolarHBondContact O-N 2.98Å; K90-E200 IonicContact NZ-OE1 2.8Å; K90-E200 PolarHBondContact NZ-OE1 3.05Å; K90-E200 IonicContact NZ-OE2 2.76Å; K90-E200 PolarHBondContact NZ-OE2 3.37Å
91L47.5Very low48.9Very low116 Ų116106.1 Ų106.161%0.60757%0.565SS**Hα-helixtrans-65.3-37.2176.9-76.6167.9000112.7T87 K93 Y94T87-L91 WeakPolarHBondContact O-CD1 3.06Å; L91-K93 PolarHBondContact O-N 3.28Å; L91-Y94 PolarHBondContact O-N 3.47Å
92G44.3Very low48.1Very low55 Ų55107.7 Ų107.757%0.56757%0.573SS**THydrogen-bonded Turntrans-66.3-17.5-178.500000115.5K90K90-G92 PolarHBondContact O-N 2.94Å
93K44.2Very low47.4Very low164 Ų164112 Ų11271%0.71359%0.589SS**THydrogen-bonded Turntrans-83.8-15.8-179.4-71.4-172.8177.4-178.80114K90 L91K90-K93 PolarHBondContact O-N 2.98Å; L91-K93 PolarHBondContact O-N 3.28Å
94Y40.8Very low47Very low186 Ų186114.4 Ų114.473%0.72961%0.606SS**THydrogen-bonded Turntrans-112.6-17.6-174.4-120.4-93.8000114.4L91 K96 T97L91-Y94 PolarHBondContact O-N 3.47Å; Y94-K96 PolarHBondContact O-N 3.37Å; Y94-T97 PolarHBondContact O-OG1 3Å
95V48.2Very low45.9Very low117 Ų117116.7 Ų116.771%0.70963%0.626SS**G310 helixtrans-74.2-11.6177.2173.20000112.7T97V95-T97 PolarHBondContact O-N 3.27Å
96K40.3Very low45.3Very low191 Ų191118.8 Ų118.883%0.8363%0.633SS**G310 helixtrans-89.917.3-171.3-160.6160.2179.9175.10115.6Y94Y94-K96 PolarHBondContact O-N 3.37Å
97T38.8Very low45.1Very low108 Ų108123.3 Ų123.366%0.66365%0.652SS**G310 helixtrans-122.219.3-172.942.30000116Y94 V95Y94-T97 PolarHBondContact O-OG1 3Å; V95-T97 PolarHBondContact O-N 3.27Å
98T41.8Very low44.8Very low117 Ų117127.8 Ų127.872%0.71868%0.681SS**  trans-135.360.1175.263.30000112.4
99D38Very low43.9Very low158 Ų158130.6 Ų130.685%0.84570%0.696SS**  trans-120.395.2155.3-96.7-37.7000105.8
100C41.3Very low43.6Very low125 Ų125134.2 Ų134.285%0.84571%0.713SS**  trans-87.8112.7170.5-66.50000107.7D102C100-D102 PolarHBondContact O-N 2.88Å
101D40Very low43.3Very low156 Ų156134.1 Ų134.183%0.83472%0.723SS**  trans-60.2117.2175.2-52.6-80.2000111.8
102D38.9Very low43.1Very low137 Ų137134.5 Ų134.573%0.73373%0.726SS**  trans-103.581.7161.6-171.820000109.9C100 T104C100-D102 PolarHBondContact O-N 2.88Å; D102-T104 PolarHBondContact O-N 3.41Å; D102-T104 VanDerWaalsContact O-N 3.11Å; D102-T104 WeakPolarHBondContact OD1-CB 3.41Å; D102-T104 PolarHBondContact OD1-OG1 3.33Å
103E42.4Very low43.1Very low138 Ų138140.6 Ų140.665%0.64574%0.739SS**  trans-79.662.7169.7-125.6-59.296.200109.6R106E103-R106 IonicContact OE2-CZ 3.04Å; E103-R106 IonicContact OE2-NE 2.95Å; E103-R106 IonicContact OE2-NH2 3.67Å; E103-R106 PolarHBondContact OE2-NH2 3.46Å
104T50.2Low43.5Very low111 Ų111139.9 Ų139.968%0.68175%0.748SS**  trans-136.252.1176.3-35.40000113.4D102D102-T104 PolarHBondContact O-N 3.41Å; D102-T104 VanDerWaalsContact O-N 3.11Å; D102-T104 WeakPolarHBondContact OD1-CB 3.41Å; D102-T104 PolarHBondContact OD1-OG1 3.33Å
105C39.2Very low44Very low104 Ų104134 Ų13470%0.70373%0.732SS**  trans-135.855.6173.3-123.40000113.6
106R43.5Very low44.3Very low198 Ų198132.5 Ų132.575%0.74772%0.723SS**  trans-98.7115.7165-63-170.9-167.4-177.87.9110.4E103E103-R106 IonicContact OE2-CZ 3.04Å; E103-R106 IonicContact OE2-NE 2.95Å; E103-R106 IonicContact OE2-NH2 3.67Å; E103-R106 PolarHBondContact OE2-NH2 3.46Å
107I50.4Low45.1Very low121 Ų121129.9 Ų129.962%0.62172%0.717SS**  trans-89.9124.3173.4-59.3173000107.7T109I107-T109 PolarHBondContact O-N 2.92Å
108P51.1Low46.1Very low116 Ų116126.4 Ų126.475%0.75370%0.702SS**  trans-73.2122.1171.1-13.928.6000110.8
109T36.9Very low47.1Very low128 Ų128123.2 Ų123.279%0.78568%0.681SS**  trans-101.698.6172.647.70000110.2I107I107-T109 PolarHBondContact O-N 2.92Å
110Q48.1Very low48.3Very low188 Ų188122.9 Ų122.988%0.87967%0.668SS**  trans-157142.7164.4-58.2-176.631.900106
111S42.6Very low49.6Very low82 Ų82127 Ų12757%0.57367%0.665SS**  cis-166160.5-19.147.10000104.4
112D43.6Very low50.8Low125 Ų125128.5 Ų128.567%0.66866%0.659SS**  trans89.7125.2157.3-42.5-45.7000119.9V114D112-V114 PolarHBondContact O-N 2.87Å
113E45.3Very low52.4Low183 Ų183129.3 Ų129.386%0.85565%0.652SS**THydrogen-bonded Turntrans-92.55.6-147.8-68.5-174.5119.100116.6T115E113-T115 VanDerWaalsContact C-N 3.31Å; E113-T115 PolarHBondContact O-N 3.48Å
114V51.1Low54.2Low148 Ų148131.3 Ų131.390%0.89765%0.654SS**THydrogen-bonded Turntrans-89.43.4-175178.90000113.1D112D112-V114 PolarHBondContact O-N 2.87Å
115T51.7Low56Low62 Ų62127.8 Ų127.838%0.3864%0.639SS.*  trans-120.929.1-164.8-21.30000113E113 I117 G118 N119E113-T115 VanDerWaalsContact C-N 3.31Å; E113-T115 PolarHBondContact O-N 3.48Å; T115-I117 PolarHBondContact O-N 2.99Å; T115-G118 PolarHBondContact O-N 3.41Å; T115-N119 WeakPolarHBondContact CB-OD1 3.37Å; T115-N119 WeakPolarHBondContact CG2-OD1 3.49Å; T115-N119 WeakPolarHBondContact O-CA 3.22Å; T115-N119 WeakPolarHBondContact O-CB 3.23Å; T115-N119 PolarHBondContact O-N 2.92Å; T115-N119 PolarHBondContact O-OD1 2.9Å
116T55.7Low58.3Low86 Ų86127.4 Ų127.453%0.52863%0.629SS.*Hα-helixtrans-63.2-38.6-16459.40000115.3R120T116-R120 VanDerWaalsContact O-CG 3.28Å; T116-R120 WeakPolarHBondContact O-CG 3.39Å; T116-R120 PolarHBondContact O-N 2.74Å; T116-R120 VanDerWaalsContact O-N 3.16Å
117I57Low60.4Low137 Ų137123.6 Ų123.670%0.70362%0.622SS**Hα-helixtrans-79.3-42.6177.2-62.9167.5000111.1T115 N119 R120 R121T115-I117 PolarHBondContact O-N 2.99Å; I117-N119 VanDerWaalsContact C-N 3.32Å; I117-N119 PolarHBondContact O-N 3.48Å; I117-R120 PolarHBondContact O-N 3.49Å; I117-R121 PolarHBondContact O-N 3.39Å
118G59.4Low62.4Low34 Ų34120.7 Ų120.735%0.35161%0.606SS.*Hα-helixtrans-60.9-40.5175.300000112.2T115 R121 R122T115-G118 PolarHBondContact O-N 3.41Å; G118-R121 PolarHBondContact O-N 3.45Å; G118-R122 WeakPolarHBondContact O-CB 3.21Å; G118-R122 VanDerWaalsContact O-CG 3.31Å; G118-R122 WeakPolarHBondContact O-CG 3.31Å; G118-R122 PolarHBondContact O-N 3.43Å
119N61.9Low64.3Low51 Ų51121.2 Ų121.227%0.27360%0.597SS.*Hα-helixtrans-73.2-30.8177.4-69.910.4000111.6T115 I117 R123T115-N119 WeakPolarHBondContact CB-OD1 3.37Å; T115-N119 WeakPolarHBondContact CG2-OD1 3.49Å; T115-N119 WeakPolarHBondContact O-CA 3.22Å; T115-N119 WeakPolarHBondContact O-CB 3.23Å; T115-N119 PolarHBondContact O-N 2.92Å; T115-N119 PolarHBondContact O-OD1 2.9Å; I117-N119 VanDerWaalsContact C-N 3.32Å; I117-N119 PolarHBondContact O-N 3.48Å; N119-R123 WeakPolarHBondContact O-CB 3.31Å; N119-R123 WeakPolarHBondContact O-CG 3.31Å; N119-R123 PolarHBondContact O-N 2.94Å; N119-R123 PolarHBondContact O-NE 3.47Å
120R65Low67Low150 Ų150119.8 Ų119.857%0.56658%0.577SS**Hα-helixtrans-65.2-46.1168.6-77.1177.3-157-164.95.9110.9T116 I117 R124T116-R120 VanDerWaalsContact O-CG 3.28Å; T116-R120 WeakPolarHBondContact O-CG 3.39Å; T116-R120 PolarHBondContact O-N 2.74Å; T116-R120 VanDerWaalsContact O-N 3.16Å; I117-R120 PolarHBondContact O-N 3.49Å; R120-R124 VanDerWaalsContact O-CB 3.27Å; R120-R124 WeakPolarHBondContact O-CB 3.44Å; R120-R124 WeakPolarHBondContact O-CG 3.36Å; R120-R124 PolarHBondContact O-N 3.28Å
121R66.8Low69.3Low212 Ų212115.8 Ų115.880%0.855%0.554SS**Hα-helixtrans-66.2-40.8178.7-166.8174.6179.5178.5-0.6112.2I117 G118 G125I117-R121 PolarHBondContact O-N 3.39Å; G118-R121 PolarHBondContact O-N 3.45Å; R121-G125 PolarHBondContact O-N 3.37Å
122R66.1Low71.9Confident187 Ų187117.6 Ų117.671%0.70655%0.548SS*.Hα-helixtrans-67-46174.4-73-177.6-179.2-171.41.6112.2G118 R124 G125 I126G118-R122 WeakPolarHBondContact O-CB 3.21Å; G118-R122 VanDerWaalsContact O-CG 3.31Å; G118-R122 WeakPolarHBondContact O-CG 3.31Å; G118-R122 PolarHBondContact O-N 3.43Å; R122-R124 PolarHBondContact O-N 2.9Å; R122-G125 WeakPolarHBondContact O-CA 3.39Å; R122-G125 PolarHBondContact O-N 3.47Å; R122-G125 VanDerWaalsContact O-N 3.09Å; R122-I126 PolarHBondContact O-N 3.33Å
123R72Confident74.4Confident154 Ų154115.5 Ų115.558%0.58154%0.537SS*.Hα-helixtrans-61.5-42174.6-75.2-171.4-69.1-175.7-1.8111.9N119 G125 I126 I127N119-R123 WeakPolarHBondContact O-CB 3.31Å; N119-R123 WeakPolarHBondContact O-CG 3.31Å; N119-R123 PolarHBondContact O-N 2.94Å; N119-R123 PolarHBondContact O-NE 3.47Å; R123-G125 VanDerWaalsContact C-N 3.29Å; R123-G125 PolarHBondContact O-N 3.19Å; R123-I126 PolarHBondContact O-N 2.8Å; R123-I127 VanDerWaalsContact O-CG1 3.32Å; R123-I127 WeakPolarHBondContact O-CG1 3.23Å; R123-I127 PolarHBondContact O-N 3.46Å
124R80.7Confident76.9Confident181 Ų181114.2 Ų114.268%0.68352%0.524SS*.Hα-helixtrans-58-41.5171.7-75.3172.3-176.2-155.40.5111.4R120 R122 E128R120-R124 VanDerWaalsContact O-CB 3.27Å; R120-R124 WeakPolarHBondContact O-CB 3.44Å; R120-R124 WeakPolarHBondContact O-CG 3.36Å; R120-R124 PolarHBondContact O-N 3.28Å; R122-R124 PolarHBondContact O-N 2.9Å; R124-E128 VanDerWaalsContact O-CB 3.26Å; R124-E128 WeakPolarHBondContact O-CB 3.27Å; R124-E128 PolarHBondContact O-N 3.29Å
125G87.7Confident78.9Confident36 Ų36110.4 Ų110.437%0.37150%0.498SS..Hα-helixtrans-62.2-41.117600000114.2R121 R122 R123 K129R121-G125 PolarHBondContact O-N 3.37Å; R122-G125 WeakPolarHBondContact O-CA 3.39Å; R122-G125 PolarHBondContact O-N 3.47Å; R122-G125 VanDerWaalsContact O-N 3.09Å; R123-G125 VanDerWaalsContact C-N 3.29Å; R123-G125 PolarHBondContact O-N 3.19Å; G125-K129 WeakPolarHBondContact O-CB 3.34Å; G125-K129 PolarHBondContact O-N 3.2Å
126I87.6Confident81Confident96 Ų96111 Ų11149%0.49250%0.499SS..Hα-helixtrans-69.2-45.3178.2-63.9165.6000111.1R122 R123 E128 K129 R130R122-I126 PolarHBondContact O-N 3.33Å; R123-I126 PolarHBondContact O-N 2.8Å; I126-E128 VanDerWaalsContact C-N 3.31Å; I126-E128 PolarHBondContact O-N 2.76Å; I126-K129 PolarHBondContact O-N 3.41Å; I126-R130 WeakPolarHBondContact O-CG 3.4Å; I126-R130 PolarHBondContact O-N 3.5Å
127I88Confident82.9Confident118 Ų118112.7 Ų112.761%0.60550%0.501SS*.Hα-helixtrans-60.7-44.7177.7-66.3166.1000110.1R123 R130 R131R123-I127 VanDerWaalsContact O-CG1 3.32Å; R123-I127 WeakPolarHBondContact O-CG1 3.23Å; R123-I127 PolarHBondContact O-N 3.46Å; I127-R130 PolarHBondContact O-N 3.39Å; I127-R131 PolarHBondContact O-N 2.84Å
128E93Very high84.7Confident61 Ų61109.2 Ų109.229%0.28549%0.487SS..Hα-helixtrans-67.5-38.5178.2177.254.3-158.400112.2R124 I126 R131 R132R124-E128 VanDerWaalsContact O-CB 3.26Å; R124-E128 WeakPolarHBondContact O-CB 3.27Å; R124-E128 PolarHBondContact O-N 3.29Å; I126-E128 VanDerWaalsContact C-N 3.31Å; I126-E128 PolarHBondContact O-N 2.76Å; E128-R131 PolarHBondContact O-N 2.89Å; E128-R131 IonicContact OE1-CZ 3.47Å; E128-R131 IonicContact OE1-NE 3.54Å; E128-R131 PolarHBondContact OE1-NE 2.94Å; E128-R131 IonicContact OE1-NH2 2.72Å; E128-R131 PolarHBondContact OE1-NH2 3.49Å; E128-R131 IonicContact OE2-CZ 3.59Å; E128-R131 IonicContact OE2-NE 3.72Å; E128-R131 PolarHBondContact OE2-NE 3.33Å; E128-R131 IonicContact OE2-NH2 3.93Å; E128-R132 WeakPolarHBondContact O-CG 3.43Å; E128-R132 PolarHBondContact O-N 3.22Å; E128-R132 WeakPolarHBondContact OE1-CG 3.39Å; E128-R132 IonicContact OE1-NH1 2.73Å
129K89.4Confident86.3Confident126 Ų126108.5 Ų108.555%0.54848%0.475SS..Hα-helixtrans-57.3-51171.4-176.8178.1175.8-176.40110.7G125 I126 R131 R132 D133G125-K129 WeakPolarHBondContact O-CB 3.34Å; G125-K129 PolarHBondContact O-N 3.2Å; I126-K129 PolarHBondContact O-N 3.41Å; K129-R131 VanDerWaalsContact C-N 3.31Å; K129-R131 PolarHBondContact O-N 3.41Å; K129-R132 WeakPolarHBondContact O-CB 3.18Å; K129-R132 PolarHBondContact O-N 2.86Å; K129-R132 VanDerWaalsContact O-N 3.08Å; K129-D133 PolarHBondContact O-N 3.01Å
130R93.9Very high87.7Confident98 Ų98107.6 Ų107.637%0.3748%0.478SS..Hα-helixtrans-59-39.7176.9-70-179.8-177.9-176.1-1.9112.8I126 I127 D133 R134I126-R130 WeakPolarHBondContact O-CG 3.4Å; I126-R130 PolarHBondContact O-N 3.5Å; I127-R130 PolarHBondContact O-N 3.39Å; R130-D133 PolarHBondContact O-N 2.87Å; R130-R134 WeakPolarHBondContact O-CG 3.31Å; R130-R134 PolarHBondContact O-N 3.25Å; R130-R134 VanDerWaalsContact O-N 3.08Å; R130-R134 PolarHBondContact O-NH1 2.98Å
131R97.6Very high89Confident105 Ų105105 Ų10540%0.39647%0.473SS..Hα-helixtrans-61.7-45.2174.7-169.5-165.970.786.85.9111.4I127 E128 K129 R134 I135I127-R131 PolarHBondContact O-N 2.84Å; E128-R131 PolarHBondContact O-N 2.89Å; E128-R131 IonicContact OE1-CZ 3.47Å; E128-R131 IonicContact OE1-NE 3.54Å; E128-R131 PolarHBondContact OE1-NE 2.94Å; E128-R131 IonicContact OE1-NH2 2.72Å; E128-R131 PolarHBondContact OE1-NH2 3.49Å; E128-R131 IonicContact OE2-CZ 3.59Å; E128-R131 IonicContact OE2-NE 3.72Å; E128-R131 PolarHBondContact OE2-NE 3.33Å; E128-R131 IonicContact OE2-NH2 3.93Å; K129-R131 VanDerWaalsContact C-N 3.31Å; K129-R131 PolarHBondContact O-N 3.41Å; R131-R134 PolarHBondContact O-N 3.04Å; R131-I135 HydrophobicContact CG-CD1 4.38Å; R131-I135 WeakPolarHBondContact O-CG1 2.8Å; R131-I135 PolarHBondContact O-N 3.35Å; R131-I135 VanDerWaalsContact O-N 3.11Å
132R96.6Very high90.4Very high120 Ų12097.2 Ų97.245%0.45345%0.447SS..Hα-helixtrans-64.2-40.2177.2-72.3-176.2-65.3-133.31.1112.3E128 K129 I135 N136E128-R132 WeakPolarHBondContact O-CG 3.43Å; E128-R132 PolarHBondContact O-N 3.22Å; E128-R132 WeakPolarHBondContact OE1-CG 3.39Å; E128-R132 IonicContact OE1-NH1 2.73Å; K129-R132 WeakPolarHBondContact O-CB 3.18Å; K129-R132 PolarHBondContact O-N 2.86Å; K129-R132 VanDerWaalsContact O-N 3.08Å; R132-I135 PolarHBondContact O-N 3.19Å; R132-N136 VanDerWaalsContact O-CG 3.3Å; R132-N136 PolarHBondContact O-N 3.46Å; R132-N136 PolarHBondContact O-ND2 3.48Å
133D95.9Very high91.6Very high80 Ų8091.1 Ų91.143%0.42842%0.424SS..Hα-helixtrans-62.8-44.8178-62.5-23.3000110.5K129 R130 I135 N136 H137K129-D133 PolarHBondContact O-N 3.01Å; R130-D133 PolarHBondContact O-N 2.87Å; D133-I135 PolarHBondContact O-N 3.38Å; D133-N136 PolarHBondContact O-N 2.92Å; D133-H137 WeakPolarHBondContact O-CB 3.19Å; D133-H137 PolarHBondContact O-N 3.43Å
134R96.8Very high92.5Very high156 Ų15688.1 Ų88.159%0.58943%0.425SS*.Hα-helixtrans-58.9-45.1173-69-164.7-51.7-83.64.8112.8R130 R131 N136 H137 C138R130-R134 WeakPolarHBondContact O-CG 3.31Å; R130-R134 PolarHBondContact O-N 3.25Å; R130-R134 VanDerWaalsContact O-N 3.08Å; R130-R134 PolarHBondContact O-NH1 2.98Å; R131-R134 PolarHBondContact O-N 3.04Å; R134-N136 VanDerWaalsContact C-N 3.35Å; R134-N136 PolarHBondContact O-N 3.17Å; R134-H137 WeakPolarHBondContact O-CB 3.32Å; R134-H137 PolarHBondContact O-N 2.94Å; R134-C138 PolarHBondContact O-N 3.06Å; R134-C138 PolarHBondContact O-SG 2.69Å
135I94.6Very high93Very high69 Ų6985.1 Ų85.135%0.35442%0.422SS..Hα-helixtrans-62.6-42.8178.4-71.2169.5000111.4R131 R132 D133 H137 C138 L139R131-I135 HydrophobicContact CG-CD1 4.38Å; R131-I135 WeakPolarHBondContact O-CG1 2.8Å; R131-I135 PolarHBondContact O-N 3.35Å; R131-I135 VanDerWaalsContact O-N 3.11Å; R132-I135 PolarHBondContact O-N 3.19Å; D133-I135 PolarHBondContact O-N 3.38Å; I135-H137 VanDerWaalsContact C-N 3.32Å; I135-C138 PolarHBondContact O-N 2.72Å; I135-L139 HydrophobicContact CG2-CD1 4.14Å; I135-L139 WeakPolarHBondContact O-CG 3.4Å; I135-L139 PolarHBondContact O-N 3.49Å
136N95Very high93.1Very high74 Ų7483.5 Ų83.540%0.39641%0.405SS..Hα-helixtrans-68.7-33.5178.9-69.1-28.3000111.8R132 D133 R134 L139 G140 K160R132-N136 VanDerWaalsContact O-CG 3.3Å; R132-N136 PolarHBondContact O-N 3.46Å; R132-N136 PolarHBondContact O-ND2 3.48Å; D133-N136 PolarHBondContact O-N 2.92Å; R134-N136 VanDerWaalsContact C-N 3.35Å; R134-N136 PolarHBondContact O-N 3.17Å; N136-L139 PolarHBondContact O-N 2.85Å; N136-G140 PolarHBondContact O-N 3.49Å; N136-K160 PolarHBondContact OD1-NZ 3.36Å
137H95.5Very high93.2Very high122 Ų12282.2 Ų82.257%0.56540%0.403SS*.Hα-helixtrans-60.5-53.8172.1-177.971.1000110.9D133 R134 I135 L139 G140 E141D133-H137 WeakPolarHBondContact O-CB 3.19Å; D133-H137 PolarHBondContact O-N 3.43Å; R134-H137 WeakPolarHBondContact O-CB 3.32Å; R134-H137 PolarHBondContact O-N 2.94Å; I135-H137 VanDerWaalsContact C-N 3.32Å; H137-L139 VanDerWaalsContact C-N 3.28Å; H137-L139 PolarHBondContact O-N 3.34Å; H137-G140 CarbonylContact O-C 3.59Å; H137-G140 WeakPolarHBondContact O-CA 3.41Å; H137-G140 PolarHBondContact O-N 3.45Å; H137-E141 IonicContact CD2-OE2 3.93Å; H137-E141 IonicContact NE2-OE1 3.39Å; H137-E141 IonicContact NE2-OE2 3.6Å; H137-E141 PolarHBondContact O-N 2.8Å
138C94.9Very high93.2Very high63 Ų6378.5 Ų78.543%0.42639%0.39SS..Hα-helixtrans-59.3-37.5178.2-60.60000112.5R134 I135 G140 E141 L142R134-C138 PolarHBondContact O-N 3.06Å; R134-C138 PolarHBondContact O-SG 2.69Å; I135-C138 PolarHBondContact O-N 2.72Å; C138-G140 VanDerWaalsContact C-N 3.29Å; C138-G140 PolarHBondContact O-N 2.88Å; C138-E141 PolarHBondContact O-N 3.31Å; C138-L142 WeakPolarHBondContact O-CG 3.36Å; C138-L142 PolarHBondContact O-N 3.13Å
139L93Very high93Very high19 Ų1975.6 Ų75.610%0.09938%0.376CS..Hα-helixtrans-64.8-33.3174.1-74.5171.3000112.7I135 N136 H137 R143 K160 I163 L164I135-L139 HydrophobicContact CG2-CD1 4.14Å; I135-L139 WeakPolarHBondContact O-CG 3.4Å; I135-L139 PolarHBondContact O-N 3.49Å; N136-L139 PolarHBondContact O-N 2.85Å; H137-L139 VanDerWaalsContact C-N 3.28Å; H137-L139 PolarHBondContact O-N 3.34Å; L139-R143 WeakPolarHBondContact O-CB 3.44Å; L139-R143 WeakPolarHBondContact O-CD 3.38Å; L139-R143 VanDerWaalsContact O-CG 3.29Å; L139-R143 WeakPolarHBondContact O-CG 3.19Å; L139-R143 PolarHBondContact O-N 2.94Å; L139-K160 HydrophobicContact CD1-CD 3.95Å; L139-K160 HydrophobicContact CD1-CG 4.05Å; L139-I163 HydrophobicContact CB-CD1 4.44Å; L139-I163 HydrophobicContact CD2-CB 4.44Å; L139-I163 HydrophobicContact CD2-CD1 4.34Å; L139-I163 HydrophobicContact CD2-CG2 4.13Å; L139-L164 HydrophobicContact CD2-CD2 4.05Å; L139-L164 HydrophobicContact CD2-CG 4.36Å
140G91.8Very high93Very high32 Ų3273.8 Ų73.833%0.3337%0.372SS..Hα-helixtrans-68-38.3172.200000112.5N136 H137 C138 R143 C144N136-G140 PolarHBondContact O-N 3.49Å; H137-G140 CarbonylContact O-C 3.59Å; H137-G140 WeakPolarHBondContact O-CA 3.41Å; H137-G140 PolarHBondContact O-N 3.45Å; C138-G140 VanDerWaalsContact C-N 3.29Å; C138-G140 PolarHBondContact O-N 2.88Å; G140-R143 WeakPolarHBondContact O-CB 3.49Å; G140-C144 PolarHBondContact O-N 2.92Å; G140-C144 PolarHBondContact O-SG 3.48Å
141E93Very high92.6Very high96 Ų9677 Ų7745%0.44939%0.391SS..Hα-helixtrans-65.6-50.2173.7-64.5-176.7104.800111.5H137 C138 R143 C144 L145H137-E141 IonicContact CD2-OE2 3.93Å; H137-E141 IonicContact NE2-OE1 3.39Å; H137-E141 IonicContact NE2-OE2 3.6Å; H137-E141 PolarHBondContact O-N 2.8Å; C138-E141 PolarHBondContact O-N 3.31Å; E141-R143 PolarHBondContact O-N 2.98Å; E141-C144 WeakPolarHBondContact O-CA 3.23Å; E141-C144 PolarHBondContact O-N 3.48Å; E141-L145 WeakPolarHBondContact O-CG 3.41Å; E141-L145 PolarHBondContact O-N 2.84Å; E141-L145 VanDerWaalsContact O-N 3.14Å
142L95Very high91.9Very high49 Ų4976.1 Ų76.126%0.25739%0.39SS..Hα-helixtrans-55-40.8178.6-72.3179.4000112.3C138 C144 L145 V146 I163 L164 T167C138-L142 WeakPolarHBondContact O-CG 3.36Å; C138-L142 PolarHBondContact O-N 3.13Å; L142-C144 PolarHBondContact O-N 2.83Å; L142-L145 PolarHBondContact O-N 3.46Å; L142-L145 VanDerWaalsContact O-N 3.1Å; L142-V146 WeakPolarHBondContact O-CG2 3.43Å; L142-V146 PolarHBondContact O-N 3.23Å; L142-I163 HydrophobicContact CB-CG2 4.02Å; L142-L164 HydrophobicContact CD1-CD2 4.45Å; L142-T167 HydrophobicContact CD1-CG2 4.43Å; L142-T167 HydrophobicContact CD2-CG2 3.85Å
143R90.8Very high90.8Very high58 Ų5874.2 Ų74.222%0.21939%0.386CS..Hα-helixtrans-56-34.8174-94.3173.9167.3-1597.5114.4L139 G140 E141 I150 H153 L158 I163L139-R143 WeakPolarHBondContact O-CB 3.44Å; L139-R143 WeakPolarHBondContact O-CD 3.38Å; L139-R143 VanDerWaalsContact O-CG 3.29Å; L139-R143 WeakPolarHBondContact O-CG 3.19Å; L139-R143 PolarHBondContact O-N 2.94Å; G140-R143 WeakPolarHBondContact O-CB 3.49Å; E141-R143 PolarHBondContact O-N 2.98Å; R143-I150 VanDerWaalsContact O-CG1 3.27Å; R143-I150 WeakPolarHBondContact O-CG1 3.29Å; R143-H153 WeakPolarHBondContact CB-NE2 3.39Å; R143-H153 VanDerWaalsContact CD-CE1 3.44Å; R143-H153 WeakPolarHBondContact CD-CE1 3.49Å; R143-H153 WeakPolarHBondContact CD-NE2 3.21Å; R143-H153 WeakPolarHBondContact CG-NE2 3.45Å; R143-L158 PolarHBondContact NH2-O 3.13Å; R143-I163 HydrophobicContact CG-CD1 3.9Å; R143-I163 HydrophobicContact CG-CG1 3.85Å; R143-I163 HydrophobicContact CG-CG2 4.05Å
144C91.6Very high89.4Confident92 Ų9274.3 Ų74.362%0.62241%0.406SS*.Hα-helixtrans-89.6-9.5179.2-58.10000113.2G140 E141 L142 I150G140-C144 PolarHBondContact O-N 2.92Å; G140-C144 PolarHBondContact O-SG 3.48Å; E141-C144 WeakPolarHBondContact O-CA 3.23Å; E141-C144 PolarHBondContact O-N 3.48Å; L142-C144 PolarHBondContact O-N 2.83Å; C144-I150 VanDerWaalsContact O-CD1 3.24Å; C144-I150 WeakPolarHBondContact O-CD1 3.38Å
145L91.2Very high87.9Confident117 Ų11772.1 Ų72.161%0.61342%0.415SS*.Hα-helixtrans-103.4-26.9-178.5-67.2173.8000113.1E141 L142 P147E141-L145 WeakPolarHBondContact O-CG 3.41Å; E141-L145 PolarHBondContact O-N 2.84Å; E141-L145 VanDerWaalsContact O-N 3.14Å; L142-L145 PolarHBondContact O-N 3.46Å; L142-L145 VanDerWaalsContact O-N 3.1Å; L145-P147 WeakPolarHBondContact O-CD 3.24Å
146V89.4Confident86.7Confident3 Ų375.9 Ų75.92%0.01843%0.431CS..  trans-92.4115.8-175.9175.80000110L142 A148 A149 I150 L166 T167 Y170L142-V146 WeakPolarHBondContact O-CG2 3.43Å; L142-V146 PolarHBondContact O-N 3.23Å; V146-A148 VanDerWaalsContact C-N 3.35Å; V146-A148 PolarHBondContact O-N 3.22Å; V146-A149 HydrophobicContact CB-CB 3.89Å; V146-A149 HydrophobicContact CG1-CB 4.07Å; V146-A149 WeakPolarHBondContact O-CA 3.01Å; V146-A149 WeakPolarHBondContact O-CB 3.44Å; V146-A149 PolarHBondContact O-N 2.91Å; V146-I150 WeakPolarHBondContact O-CG1 3.43Å; V146-I150 PolarHBondContact O-N 3.28Å; V146-L166 HydrophobicContact CG1-CB 3.9Å; V146-L166 WeakPolarHBondContact CG1-O 3.37Å; V146-T167 HydrophobicContact CG2-CG2 4.08Å; V146-Y170 HydrophobicContact CG1-CG 4.47Å; V146-Y170 HydrophobicContact CG2-CD1 4.23Å
147P89.3Confident86.1Confident69 Ų6981.3 Ų81.345%0.44845%0.451SS..Hα-helixtrans-52.8-46.9-173.9-2935.5000114.2L145 A149 I150 E151 Y170L145-P147 WeakPolarHBondContact O-CD 3.24Å; P147-A149 VanDerWaalsContact C-N 3.26Å; P147-A149 PolarHBondContact O-N 2.82Å; P147-I150 PolarHBondContact O-N 3.42Å; P147-E151 PolarHBondContact O-N 3.26Å; P147-Y170 HydrophobicContact CG-CD2 4.36Å; P147-Y170 HydrophobicContact CG-CE2 3.96Å
148A88.9Confident85.5Confident39 Ų3975.8 Ų75.832%0.32243%0.425SS..Hα-helixtrans-66.6-25.4178.900000113.4V146 K152 L166V146-A148 VanDerWaalsContact C-N 3.35Å; V146-A148 PolarHBondContact O-N 3.22Å; A148-K152 WeakPolarHBondContact O-CG 3.38Å; A148-K152 PolarHBondContact O-N 2.93Å; A148-L166 HydrophobicContact CB-CD1 4.45Å; A148-L166 HydrophobicContact CB-CD2 3.87Å
149A89.5Confident85.2Confident0 Ų079.5 Ų79.50%044%0.436CS..Hα-helixtrans-76.9-40174.500000111.1V146 P147 K152 H153 L158 L166V146-A149 HydrophobicContact CB-CB 3.89Å; V146-A149 HydrophobicContact CG1-CB 4.07Å; V146-A149 WeakPolarHBondContact O-CA 3.01Å; V146-A149 WeakPolarHBondContact O-CB 3.44Å; V146-A149 PolarHBondContact O-N 2.91Å; P147-A149 VanDerWaalsContact C-N 3.26Å; P147-A149 PolarHBondContact O-N 2.82Å; A149-K152 PolarHBondContact O-N 2.93Å; A149-H153 PolarHBondContact O-CD2 3.44Å; A149-H153 PolarHBondContact O-N 2.89Å; A149-H153 VanDerWaalsContact O-N 3.13Å; A149-L158 HydrophobicContact CB-CD1 3.98Å; A149-L166 HydrophobicContact CB-CD1 4.02Å
150I87.9Confident85.1Confident88 Ų8884.3 Ų84.345%0.45146%0.456SS..Hα-helixtrans-62-42.9176.4-59.2166.6000110.8R143 C144 V146 P147 K152 H153R143-I150 VanDerWaalsContact O-CG1 3.27Å; R143-I150 WeakPolarHBondContact O-CG1 3.29Å; C144-I150 VanDerWaalsContact O-CD1 3.24Å; C144-I150 WeakPolarHBondContact O-CD1 3.38Å; V146-I150 WeakPolarHBondContact O-CG1 3.43Å; V146-I150 PolarHBondContact O-N 3.28Å; P147-I150 PolarHBondContact O-N 3.42Å; I150-K152 VanDerWaalsContact C-N 3.33Å; I150-K152 PolarHBondContact O-N 3.02Å; I150-H153 WeakPolarHBondContact O-CB 3.44Å; I150-H153 PolarHBondContact O-N 3.36Å
151E86.7Confident85.2Confident166 Ų16686 Ų8678%0.77647%0.467SS*.Hα-helixtrans-61.9-42.5179.1-172.9178.6-179.400111.8P147 H153P147-E151 PolarHBondContact O-N 3.26Å; E151-H153 VanDerWaalsContact C-N 3.28Å; E151-H153 PolarHBondContact O-N 3.08Å
152K81.9Confident85.2Confident87 Ų8784.1 Ų84.138%0.37846%0.458SS..Hα-helixtrans-75.3-14.3179.6-72.4-179.1169.9-173.90114.2A148 A149 I150 G154 S155 Q156 L158 E162 L166A148-K152 WeakPolarHBondContact O-CG 3.38Å; A148-K152 PolarHBondContact O-N 2.93Å; A149-K152 PolarHBondContact O-N 2.93Å; I150-K152 VanDerWaalsContact C-N 3.33Å; I150-K152 PolarHBondContact O-N 3.02Å; K152-G154 PolarHBondContact O-N 2.83Å; K152-G154 VanDerWaalsContact O-N 3.08Å; K152-S155 PolarHBondContact O-N 2.86Å; K152-S155 VanDerWaalsContact O-N 3.09Å; K152-Q156 PolarHBondContact O-N 2.93Å; K152-L158 HydrophobicContact CB-CD1 4.35Å; K152-L158 HydrophobicContact CB-CD2 3.74Å; K152-L158 HydrophobicContact CB-CG 4.32Å; K152-L158 HydrophobicContact CD-CD2 3.8Å; K152-L158 HydrophobicContact CG-CD2 4.45Å; K152-E162 IonicContact NZ-OE1 3.61Å; K152-E162 PolarHBondContact NZ-OE1 2.76Å; K152-L166 HydrophobicContact CD-CD1 4.28Å
153H74Confident85.1Confident79 Ų7981.9 Ų81.937%0.36645%0.447SS..THydrogen-bonded Turntrans-59.6-22.5-176.8-106.2-63.2000114.6R143 A149 I150 E151R143-H153 WeakPolarHBondContact CB-NE2 3.39Å; R143-H153 VanDerWaalsContact CD-CE1 3.44Å; R143-H153 WeakPolarHBondContact CD-CE1 3.49Å; R143-H153 WeakPolarHBondContact CD-NE2 3.21Å; R143-H153 WeakPolarHBondContact CG-NE2 3.45Å; A149-H153 PolarHBondContact O-CD2 3.44Å; A149-H153 PolarHBondContact O-N 2.89Å; A149-H153 VanDerWaalsContact O-N 3.13Å; I150-H153 WeakPolarHBondContact O-CB 3.44Å; I150-H153 PolarHBondContact O-N 3.36Å; E151-H153 VanDerWaalsContact C-N 3.28Å; E151-H153 PolarHBondContact O-N 3.08Å
154G67.5Low85.4Confident82 Ų8283.3 Ų83.385%0.84546%0.458SS*.THydrogen-bonded Turntrans-84.1-19177.700000115.5K152K152-G154 PolarHBondContact O-N 2.83Å; K152-G154 VanDerWaalsContact O-N 3.08Å
155S64.5Low85.5Confident111 Ų11184.6 Ų84.678%0.77646%0.455SS*.THydrogen-bonded Turntrans-113.1-28-168.1-168.10000114.5K152K152-S155 PolarHBondContact O-N 2.86Å; K152-S155 VanDerWaalsContact O-N 3.09Å
156Q69.9Low85.7Confident148 Ų14879.8 Ų79.869%0.69243%0.43SS*.SBendtrans-156.8145-176.9-164.1168.4-17.200111.8K152 L158K152-Q156 PolarHBondContact O-N 2.93Å; Q156-L158 PolarHBondContact O-N 3.32Å
157K82.4Confident85.9Confident187 Ų18780.4 Ų80.481%0.81343%0.434SS*.  trans-66.497.2172.2-176.2178.4179.7179.30109E159K157-E159 PolarHBondContact O-N 3.12Å
158L82.7Confident86.1Confident6 Ų680.1 Ų80.13%0.03143%0.431CS..  trans-52.6132.1178-67.7174.3000111.6R143 A149 K152 Q156 E162 I163R143-L158 PolarHBondContact NH2-O 3.13Å; A149-L158 HydrophobicContact CB-CD1 3.98Å; K152-L158 HydrophobicContact CB-CD1 4.35Å; K152-L158 HydrophobicContact CB-CD2 3.74Å; K152-L158 HydrophobicContact CB-CG 4.32Å; K152-L158 HydrophobicContact CD-CD2 3.8Å; K152-L158 HydrophobicContact CG-CD2 4.45Å; Q156-L158 PolarHBondContact O-N 3.32Å; L158-E162 HydrophobicContact CD2-CG 4.05Å; L158-E162 WeakPolarHBondContact CD2-OE2 3.4Å; L158-I163 HydrophobicContact CB-CG1 4.02Å
159E88.1Confident86.3Confident141 Ų14183.7 Ų83.766%0.65944%0.441SS*.  trans-72.1157.7174.7-64.9-167.4165.300111.4K157 A161 E162 I163K157-E159 PolarHBondContact O-N 3.12Å; E159-A161 VanDerWaalsContact C-N 3.25Å; E159-A161 PolarHBondContact O-N 3.35Å; E159-E162 HydrophobicContact CB-CB 4.35Å; E159-E162 PolarHBondContact O-N 3.47Å; E159-E162 VanDerWaalsContact O-N 3.13Å; E159-I163 WeakPolarHBondContact O-CG1 3.18Å; E159-I163 PolarHBondContact O-N 3.29Å; E159-I163 VanDerWaalsContact O-N 3.11Å
160K91.2Very high86.3Confident120 Ų12087.3 Ų87.352%0.52246%0.455SS..Hα-helixtrans-58.8-39.3178.9-70.8-167.9170.5-166.10112.3N136 L139 L164N136-K160 PolarHBondContact OD1-NZ 3.36Å; L139-K160 HydrophobicContact CD1-CD 3.95Å; L139-K160 HydrophobicContact CD1-CG 4.05Å; K160-L164 WeakPolarHBondContact O-CG 3.33Å; K160-L164 PolarHBondContact O-N 3.37Å
161A93Very high86.4Confident67 Ų6787.7 Ų87.755%0.55446%0.457SS*.Hα-helixtrans-66.6-39.1177.600000111.7E159 L164 Q165E159-A161 VanDerWaalsContact C-N 3.25Å; E159-A161 PolarHBondContact O-N 3.35Å; A161-L164 PolarHBondContact O-N 3.47Å; A161-Q165 WeakPolarHBondContact O-CB 3.44Å; A161-Q165 PolarHBondContact O-N 2.8Å
162E93.6Very high86.4Confident57 Ų5788.2 Ų88.227%0.26645%0.452SS..Hα-helixtrans-65.7-43-180-169.3177.2-171.400112.2K152 L158 E159 L164 Q165 L166K152-E162 IonicContact NZ-OE1 3.61Å; K152-E162 PolarHBondContact NZ-OE1 2.76Å; L158-E162 HydrophobicContact CD2-CG 4.05Å; L158-E162 WeakPolarHBondContact CD2-OE2 3.4Å; E159-E162 HydrophobicContact CB-CB 4.35Å; E159-E162 PolarHBondContact O-N 3.47Å; E159-E162 VanDerWaalsContact O-N 3.13Å; E162-L164 VanDerWaalsContact C-N 3.28Å; E162-L164 PolarHBondContact O-N 3.44Å; E162-Q165 PolarHBondContact O-N 3.37Å; E162-L166 HydrophobicContact CG-CD1 4.22Å; E162-L166 HydrophobicContact CG-CG 4.41Å; E162-L166 WeakPolarHBondContact O-CG 3.18Å; E162-L166 PolarHBondContact O-N 3.21Å
163I93.1Very high86.6Confident2 Ų289.6 Ų89.61%0.0146%0.458CS..Hα-helixtrans-56.3-47174.7-58.5159.9000110.3L139 L142 R143 L158 E159 Q165 T167L139-I163 HydrophobicContact CB-CD1 4.44Å; L139-I163 HydrophobicContact CD2-CB 4.44Å; L139-I163 HydrophobicContact CD2-CD1 4.34Å; L139-I163 HydrophobicContact CD2-CG2 4.13Å; L142-I163 HydrophobicContact CB-CG2 4.02Å; R143-I163 HydrophobicContact CG-CD1 3.9Å; R143-I163 HydrophobicContact CG-CG1 3.85Å; R143-I163 HydrophobicContact CG-CG2 4.05Å; L158-I163 HydrophobicContact CB-CG1 4.02Å; E159-I163 WeakPolarHBondContact O-CG1 3.18Å; E159-I163 PolarHBondContact O-N 3.29Å; E159-I163 VanDerWaalsContact O-N 3.11Å; I163-Q165 VanDerWaalsContact C-N 3.34Å; I163-T167 WeakPolarHBondContact O-CB 3.05Å; I163-T167 PolarHBondContact O-N 2.7Å; I163-T167 PolarHBondContact O-OG1 3.27Å
164L96.4Very high87Confident89 Ų8987.3 Ų87.347%0.46645%0.449SS..Hα-helixtrans-64.7-41.1-179.8-65.3173.6000111.2L139 L142 K160 A161 E162 T167 V168L139-L164 HydrophobicContact CD2-CD2 4.05Å; L139-L164 HydrophobicContact CD2-CG 4.36Å; L142-L164 HydrophobicContact CD1-CD2 4.45Å; K160-L164 WeakPolarHBondContact O-CG 3.33Å; K160-L164 PolarHBondContact O-N 3.37Å; A161-L164 PolarHBondContact O-N 3.47Å; E162-L164 VanDerWaalsContact C-N 3.28Å; E162-L164 PolarHBondContact O-N 3.44Å; L164-T167 WeakPolarHBondContact O-CB 3.45Å; L164-T167 PolarHBondContact O-N 3Å; L164-V168 VanDerWaalsContact O-CG2 3.31Å; L164-V168 WeakPolarHBondContact O-CG2 3.27Å; L164-V168 PolarHBondContact O-N 3.36Å
165Q94.4Very high87.6Confident118 Ų11889 Ų8955%0.55144%0.443SS*.Hα-helixtrans-62.8-50.5177.9-173.262.23100111.8A161 E162 I163 T167 V168 E169A161-Q165 WeakPolarHBondContact O-CB 3.44Å; A161-Q165 PolarHBondContact O-N 2.8Å; E162-Q165 PolarHBondContact O-N 3.37Å; I163-Q165 VanDerWaalsContact C-N 3.34Å; Q165-T167 PolarHBondContact O-N 3.04Å; Q165-V168 PolarHBondContact O-N 3.22Å; Q165-E169 WeakPolarHBondContact O-CB 3.44Å; Q165-E169 PolarHBondContact O-N 2.82Å
166L94.7Very high88.2Confident16 Ų1687.9 Ų87.98%0.08444%0.44CS..Hα-helixtrans-60.6-36.7177.3-66.4175.5000111.3V146 A148 A149 K152 E162 Y170V146-L166 HydrophobicContact CG1-CB 3.9Å; V146-L166 WeakPolarHBondContact CG1-O 3.37Å; A148-L166 HydrophobicContact CB-CD1 4.45Å; A148-L166 HydrophobicContact CB-CD2 3.87Å; A149-L166 HydrophobicContact CB-CD1 4.02Å; K152-L166 HydrophobicContact CD-CD1 4.28Å; E162-L166 HydrophobicContact CG-CD1 4.22Å; E162-L166 HydrophobicContact CG-CG 4.41Å; E162-L166 WeakPolarHBondContact O-CG 3.18Å; E162-L166 PolarHBondContact O-N 3.21Å; L166-Y170 VanDerWaalsContact O-CB 3.27Å; L166-Y170 WeakPolarHBondContact O-CB 3.38Å; L166-Y170 PolarHBondContact O-N 2.7Å
167T94.9Very high88.1Confident16 Ų1683.8 Ų83.810%0.09843%0.428CS..Hα-helixtrans-65-47.4175.3-52.50000111.2L142 V146 I163 L164 Q165 E169 Y170 L171L142-T167 HydrophobicContact CD1-CG2 4.43Å; L142-T167 HydrophobicContact CD2-CG2 3.85Å; V146-T167 HydrophobicContact CG2-CG2 4.08Å; I163-T167 WeakPolarHBondContact O-CB 3.05Å; I163-T167 PolarHBondContact O-N 2.7Å; I163-T167 PolarHBondContact O-OG1 3.27Å; L164-T167 WeakPolarHBondContact O-CB 3.45Å; L164-T167 PolarHBondContact O-N 3Å; Q165-T167 PolarHBondContact O-N 3.04Å; T167-E169 VanDerWaalsContact C-N 3.35Å; T167-E169 PolarHBondContact O-N 2.87Å; T167-Y170 PolarHBondContact O-N 3.01Å; T167-L171 HydrophobicContact CG2-CD1 4.34Å; T167-L171 VanDerWaalsContact O-CG 3.31Å; T167-L171 WeakPolarHBondContact O-CG 3.26Å; T167-L171 PolarHBondContact O-N 3.48Å
168V93.2Very high87Confident63 Ų6377 Ų7738%0.38241%0.412SS..Hα-helixtrans-64.4-41.4179.2170.80000111.1L164 Q165 Y170 L171 R172L164-V168 VanDerWaalsContact O-CG2 3.31Å; L164-V168 WeakPolarHBondContact O-CG2 3.27Å; L164-V168 PolarHBondContact O-N 3.36Å; Q165-V168 PolarHBondContact O-N 3.22Å; V168-Y170 VanDerWaalsContact C-N 3.34Å; V168-L171 PolarHBondContact O-N 3.18Å; V168-R172 WeakPolarHBondContact O-CB 3.27Å; V168-R172 WeakPolarHBondContact O-CG 3.4Å; V168-R172 PolarHBondContact O-N 3.06Å
169E92.2Very high85.7Confident114 Ų11478.6 Ų78.653%0.53342%0.42SS..Hα-helixtrans-62.4-43.1175.2-174.7170.4-164.900111.4Q165 T167 R172 F173Q165-E169 WeakPolarHBondContact O-CB 3.44Å; Q165-E169 PolarHBondContact O-N 2.82Å; T167-E169 VanDerWaalsContact C-N 3.35Å; T167-E169 PolarHBondContact O-N 2.87Å; E169-R172 PolarHBondContact O-N 3.25Å; E169-F173 WeakPolarHBondContact O-CB 3.3Å; E169-F173 PolarHBondContact O-N 3.09Å
170Y90.9Very high84.1Confident77 Ų7776.9 Ų76.930%0.30242%0.415SS..Hα-helixtrans-61.3-45.8173.4-179-123.5000111.8V146 P147 L166 T167 V168 R172 F173 L174V146-Y170 HydrophobicContact CG1-CG 4.47Å; V146-Y170 HydrophobicContact CG2-CD1 4.23Å; P147-Y170 HydrophobicContact CG-CD2 4.36Å; P147-Y170 HydrophobicContact CG-CE2 3.96Å; L166-Y170 VanDerWaalsContact O-CB 3.27Å; L166-Y170 WeakPolarHBondContact O-CB 3.38Å; L166-Y170 PolarHBondContact O-N 2.7Å; T167-Y170 PolarHBondContact O-N 3.01Å; V168-Y170 VanDerWaalsContact C-N 3.34Å; Y170-R172 VanDerWaalsContact C-N 3.33Å; Y170-R172 PolarHBondContact O-N 3.38Å; Y170-F173 HydrophobicContact CD2-CD1 4.37Å; Y170-F173 WeakPolarHBondContact O-CB 3.32Å; Y170-F173 PolarHBondContact O-N 2.81Å; Y170-L174 HydrophobicContact CD1-CD1 4.08Å; Y170-L174 HydrophobicContact CD2-CG 4.34Å; Y170-L174 HydrophobicContact CE1-CD1 3.71Å; Y170-L174 HydrophobicContact CE1-CG 4.27Å; Y170-L174 HydrophobicContact CE2-CD1 4.39Å; Y170-L174 HydrophobicContact CE2-CD2 3.87Å; Y170-L174 HydrophobicContact CE2-CG 4.06Å; Y170-L174 VanDerWaalsContact O-CG 3.26Å; Y170-L174 WeakPolarHBondContact O-CG 3.19Å; Y170-L174 PolarHBondContact O-N 3.12Å
171L89.1Confident82.3Confident96 Ų9674.7 Ų74.750%0.50341%0.409SS..Hα-helixtrans-60.7-41.2175.7-69.5173.7000112.1T167 V168 L174 T175T167-L171 HydrophobicContact CG2-CD1 4.34Å; T167-L171 VanDerWaalsContact O-CG 3.31Å; T167-L171 WeakPolarHBondContact O-CG 3.26Å; T167-L171 PolarHBondContact O-N 3.48Å; V168-L171 PolarHBondContact O-N 3.18Å; L171-L174 HydrophobicContact CD2-CD1 4.37Å; L171-L174 WeakPolarHBondContact O-CB 3.26Å; L171-L174 PolarHBondContact O-N 3.35Å; L171-T175 WeakPolarHBondContact O-CG2 3.25Å; L171-T175 PolarHBondContact O-N 3.37Å; L171-T175 PolarHBondContact O-OG1 3.45Å
172R87.8Confident80.6Confident176 Ų17677 Ų7766%0.66442%0.417SS*.Hα-helixtrans-64.4-45.1175-75.4179.8178.8-167-0.4111.6V168 E169 Y170 L174 T175 A176V168-R172 WeakPolarHBondContact O-CB 3.27Å; V168-R172 WeakPolarHBondContact O-CG 3.4Å; V168-R172 PolarHBondContact O-N 3.06Å; E169-R172 PolarHBondContact O-N 3.25Å; Y170-R172 VanDerWaalsContact C-N 3.33Å; Y170-R172 PolarHBondContact O-N 3.38Å; R172-L174 VanDerWaalsContact C-N 3.26Å; R172-L174 PolarHBondContact O-N 3Å; R172-T175 WeakPolarHBondContact CA-OG1 3.24Å; R172-T175 PolarHBondContact O-N 2.7Å; R172-T175 PolarHBondContact O-OG1 2.58Å; R172-A176 VanDerWaalsContact O-CB 3.28Å; R172-A176 WeakPolarHBondContact O-CB 3.01Å; R172-A176 PolarHBondContact O-N 3.42Å
173F85.6Confident78.8Confident116 Ų11677.8 Ų77.851%0.50943%0.425SS..Hα-helixtrans-57.5-42173.5171.2-96.1000110.9E169 Y170 A176 S177E169-F173 WeakPolarHBondContact O-CB 3.3Å; E169-F173 PolarHBondContact O-N 3.09Å; Y170-F173 HydrophobicContact CD2-CD1 4.37Å; Y170-F173 WeakPolarHBondContact O-CB 3.32Å; Y170-F173 PolarHBondContact O-N 2.81Å; F173-A176 PolarHBondContact O-N 2.98Å; F173-S177 WeakPolarHBondContact CD2-OG 3.34Å; F173-S177 WeakPolarHBondContact CE2-OG 2.82Å; F173-S177 WeakPolarHBondContact CZ-OG 2.85Å; F173-S177 WeakPolarHBondContact O-CB 3.24Å; F173-S177 PolarHBondContact O-N 3.02Å; F173-S177 PolarHBondContact O-OG 2.73Å
174L81.5Confident77.3Confident32 Ų3280.5 Ų80.517%0.16844%0.444CS..Hα-helixtrans-61.7-48.3175.5-68.2177.4000111.1Y170 L171 R172 A176 N179Y170-L174 HydrophobicContact CD1-CD1 4.08Å; Y170-L174 HydrophobicContact CD2-CG 4.34Å; Y170-L174 HydrophobicContact CE1-CD1 3.71Å; Y170-L174 HydrophobicContact CE1-CG 4.27Å; Y170-L174 HydrophobicContact CE2-CD1 4.39Å; Y170-L174 HydrophobicContact CE2-CD2 3.87Å; Y170-L174 HydrophobicContact CE2-CG 4.06Å; Y170-L174 VanDerWaalsContact O-CG 3.26Å; Y170-L174 WeakPolarHBondContact O-CG 3.19Å; Y170-L174 PolarHBondContact O-N 3.12Å; L171-L174 HydrophobicContact CD2-CD1 4.37Å; L171-L174 WeakPolarHBondContact O-CB 3.26Å; L171-L174 PolarHBondContact O-N 3.35Å; R172-L174 VanDerWaalsContact C-N 3.26Å; R172-L174 PolarHBondContact O-N 3Å; L174-A176 PolarHBondContact O-N 2.92Å; L174-N179 HydrophobicContact CB-CB 4.25Å; L174-N179 HydrophobicContact CD2-CB 3.78Å; L174-N179 WeakPolarHBondContact CD2-ND2 3.45Å; L174-N179 CarbonylContact O-C 3.59Å; L174-N179 VanDerWaalsContact O-CA 3.31Å; L174-N179 WeakPolarHBondContact O-CA 3.25Å; L174-N179 VanDerWaalsContact O-CB 3.25Å; L174-N179 WeakPolarHBondContact O-CB 3Å; L174-N179 PolarHBondContact O-N 2.88Å
175T80.3Confident75.7Confident116 Ų11679.3 Ų79.371%0.71244%0.438SS*.Hα-helixtrans-65.5-36.9178.855.90000113.4L171 R172L171-T175 WeakPolarHBondContact O-CG2 3.25Å; L171-T175 PolarHBondContact O-N 3.37Å; L171-T175 PolarHBondContact O-OG1 3.45Å; R172-T175 WeakPolarHBondContact CA-OG1 3.24Å; R172-T175 PolarHBondContact O-N 2.7Å; R172-T175 PolarHBondContact O-OG1 2.58Å
176A78.1Confident74.5Confident88 Ų8879.4 Ų79.473%0.72744%0.441SS*.Hα-helixtrans-80.9-33.8-176.900000112.6R172 F173 L174 G178R172-A176 VanDerWaalsContact O-CB 3.28Å; R172-A176 WeakPolarHBondContact O-CB 3.01Å; R172-A176 PolarHBondContact O-N 3.42Å; F173-A176 PolarHBondContact O-N 2.98Å; L174-A176 PolarHBondContact O-N 2.92Å; A176-G178 PolarHBondContact O-N 2.92Å; A176-G178 VanDerWaalsContact O-N 3.13Å
177S67.1Low73.1Confident62 Ų6285 Ų8543%0.43447%0.467SS..THydrogen-bonded Turntrans-75.67.7177.9-54.90000112.8F173 N179F173-S177 WeakPolarHBondContact CD2-OG 3.34Å; F173-S177 WeakPolarHBondContact CE2-OG 2.82Å; F173-S177 WeakPolarHBondContact CZ-OG 2.85Å; F173-S177 WeakPolarHBondContact O-CB 3.24Å; F173-S177 PolarHBondContact O-N 3.02Å; F173-S177 PolarHBondContact O-OG 2.73Å; S177-N179 PolarHBondContact O-N 3.29Å; S177-N179 VanDerWaalsContact O-N 3.13Å
178G59.5Low71.8Confident46 Ų4689.7 Ų89.747%0.47448%0.483SS..THydrogen-bonded Turntrans57.225.1-169.600000111.6A176 D180A176-G178 PolarHBondContact O-N 2.92Å; A176-G178 VanDerWaalsContact O-N 3.13Å; G178-D180 PolarHBondContact O-N 2.95Å
179N55.5Low70.9Confident39 Ų3990.5 Ų90.521%0.20949%0.485CS..  trans-80.456.8-179.8-164.3-16.7000109.3L174 S177 N181L174-N179 HydrophobicContact CB-CB 4.25Å; L174-N179 HydrophobicContact CD2-CB 3.78Å; L174-N179 WeakPolarHBondContact CD2-ND2 3.45Å; L174-N179 CarbonylContact O-C 3.59Å; L174-N179 VanDerWaalsContact O-CA 3.31Å; L174-N179 WeakPolarHBondContact O-CA 3.25Å; L174-N179 VanDerWaalsContact O-CB 3.25Å; L174-N179 WeakPolarHBondContact O-CB 3Å; L174-N179 PolarHBondContact O-N 2.88Å; S177-N179 PolarHBondContact O-N 3.29Å; S177-N179 VanDerWaalsContact O-N 3.13Å; N179-N181 VanDerWaalsContact CA-N 3.3Å; N179-N181 WeakPolarHBondContact CA-OD1 3.38Å; N179-N181 PolarHBondContact ND2-ND2 3.12Å; N179-N181 VanDerWaalsContact ND2-ND2 3.17Å; N179-N181 PolarHBondContact O-N 2.92Å; N179-N181 VanDerWaalsContact OD1-CA 3.25Å; N179-N181 WeakPolarHBondContact OD1-CA 3.42Å; N179-N181 WeakPolarHBondContact OD1-CB 3.48Å; N179-N181 PolarHBondContact OD1-N 3.23Å; N179-N181 PolarHBondContact OD1-ND2 2.94Å
180D54.7Low70.1Confident104 Ų10487.4 Ų87.456%0.55648%0.479SS*.  trans-54.87.7133.6-72-36.9000110.9G178 V182 T183 C184G178-D180 PolarHBondContact O-N 2.95Å; D180-V182 CarbonylContact O-C 3.51Å; D180-V182 PolarHBondContact O-N 3.11Å; D180-T183 VanDerWaalsContact CA-OG1 3.26Å; D180-T183 WeakPolarHBondContact CA-OG1 3.26Å; D180-T183 VanDerWaalsContact CB-OG1 3.26Å; D180-T183 WeakPolarHBondContact CB-OG1 3.26Å; D180-T183 CarbonylContact O-C 3.43Å; D180-T183 WeakPolarHBondContact O-CA 3.24Å; D180-T183 PolarHBondContact O-N 3.38Å; D180-T183 PolarHBondContact O-OG1 3.28Å; D180-T183 PolarHBondContact OD1-OG1 3.26Å; D180-C184 HydrophobicContact CB-CB 3.96Å; D180-C184 WeakPolarHBondContact O-CA 3.44Å; D180-C184 WeakPolarHBondContact O-CB 3.27Å; D180-C184 PolarHBondContact O-N 3.25Å
181N53.8Low69.4Low74 Ų7485.5 Ų85.540%0.39648%0.475SS..Hα-helixtrans-57.1-26.2-169.1-46.4-23.7000112.6N179 D185N179-N181 VanDerWaalsContact CA-N 3.3Å; N179-N181 WeakPolarHBondContact CA-OD1 3.38Å; N179-N181 PolarHBondContact ND2-ND2 3.12Å; N179-N181 VanDerWaalsContact ND2-ND2 3.17Å; N179-N181 PolarHBondContact O-N 2.92Å; N179-N181 VanDerWaalsContact OD1-CA 3.25Å; N179-N181 WeakPolarHBondContact OD1-CA 3.42Å; N179-N181 WeakPolarHBondContact OD1-CB 3.48Å; N179-N181 PolarHBondContact OD1-N 3.23Å; N179-N181 PolarHBondContact OD1-ND2 2.94Å; N181-D185 VanDerWaalsContact O-CA 3.26Å; N181-D185 WeakPolarHBondContact O-CA 3.42Å; N181-D185 WeakPolarHBondContact O-CB 3.47Å; N181-D185 PolarHBondContact O-N 3.1Å
182V55.7Low68.8Low117 Ų11783.9 Ų83.971%0.70947%0.467SS*.Hα-helixtrans-74.2-43.9169.9-176.80000112.5D180 L186D180-V182 CarbonylContact O-C 3.51Å; D180-V182 PolarHBondContact O-N 3.11Å; V182-L186 VanDerWaalsContact O-CB 3.24Å; V182-L186 WeakPolarHBondContact O-CB 3.06Å; V182-L186 PolarHBondContact O-N 2.89Å
183T56.9Low68.4Low72 Ų7281.6 Ų81.644%0.44246%0.46SS..Hα-helixtrans-73.2-44.2177.643.20000111.9D180 L186 Q187D180-T183 VanDerWaalsContact CA-OG1 3.26Å; D180-T183 WeakPolarHBondContact CA-OG1 3.26Å; D180-T183 VanDerWaalsContact CB-OG1 3.26Å; D180-T183 WeakPolarHBondContact CB-OG1 3.26Å; D180-T183 CarbonylContact O-C 3.43Å; D180-T183 WeakPolarHBondContact O-CA 3.24Å; D180-T183 PolarHBondContact O-N 3.38Å; D180-T183 PolarHBondContact O-OG1 3.28Å; D180-T183 PolarHBondContact OD1-OG1 3.26Å; T183-L186 CarbonylContact O-C 3.59Å; T183-L186 PolarHBondContact O-N 2.81Å; T183-Q187 VanDerWaalsContact O-CB 3.24Å; T183-Q187 WeakPolarHBondContact O-CB 3.25Å; T183-Q187 WeakPolarHBondContact O-CG 3.31Å; T183-Q187 PolarHBondContact O-N 2.89Å
184C60.9Low68.1Low60 Ų6078.1 Ų78.141%0.40545%0.446SS..Hα-helixtrans-59.2-42.3166.1-174.70000112.2D180 Q187 R188D180-C184 HydrophobicContact CB-CB 3.96Å; D180-C184 WeakPolarHBondContact O-CA 3.44Å; D180-C184 WeakPolarHBondContact O-CB 3.27Å; D180-C184 PolarHBondContact O-N 3.25Å; C184-Q187 CarbonylContact O-C 3.6Å; C184-Q187 PolarHBondContact O-N 2.98Å; C184-R188 WeakPolarHBondContact O-CA 3.42Å; C184-R188 WeakPolarHBondContact O-CB 3.2Å; C184-R188 PolarHBondContact O-N 3.17Å
185D63.4Low68.3Low64 Ų6478 Ų7834%0.34245%0.445SS..Hα-helixtrans-68.5-40.6172.7-82.9-43.7000110.5N181 Q187 R188 L189N181-D185 VanDerWaalsContact O-CA 3.26Å; N181-D185 WeakPolarHBondContact O-CA 3.42Å; N181-D185 WeakPolarHBondContact O-CB 3.47Å; N181-D185 PolarHBondContact O-N 3.1Å; D185-Q187 VanDerWaalsContact C-N 3.35Å; D185-R188 PolarHBondContact O-N 3.14Å; D185-R188 IonicContact OD1-CZ 3.77Å; D185-R188 IonicContact OD1-NE 3Å; D185-R188 PolarHBondContact OD1-NE 3.19Å; D185-R188 IonicContact OD1-NH2 3.48Å; D185-R188 PolarHBondContact OD1-NH2 2.8Å; D185-L189 VanDerWaalsContact O-CB 3.27Å; D185-L189 WeakPolarHBondContact O-CB 3.45Å; D185-L189 WeakPolarHBondContact O-CG 3.47Å; D185-L189 PolarHBondContact O-N 3.4Å
186L68.4Low68.4Low119 Ų11974 Ų7462%0.62343%0.425SS*.Hα-helixtrans-65.3-39.9175.1-171.266.1000111.4V182 T183 A190V182-L186 VanDerWaalsContact O-CB 3.24Å; V182-L186 WeakPolarHBondContact O-CB 3.06Å; V182-L186 PolarHBondContact O-N 2.89Å; T183-L186 CarbonylContact O-C 3.59Å; T183-L186 PolarHBondContact O-N 2.81Å; L186-A190 WeakPolarHBondContact O-CB 3.35Å; L186-A190 PolarHBondContact O-N 3.46Å
187Q65.8Low68.5Low133 Ų13370 Ų7062%0.62139%0.391SS*.Hα-helixtrans-67.1-37.5173.6-79.4-179.22.500111.6T183 C184 D185 A190 T191T183-Q187 VanDerWaalsContact O-CB 3.24Å; T183-Q187 WeakPolarHBondContact O-CB 3.25Å; T183-Q187 WeakPolarHBondContact O-CG 3.31Å; T183-Q187 PolarHBondContact O-N 2.89Å; C184-Q187 CarbonylContact O-C 3.6Å; C184-Q187 PolarHBondContact O-N 2.98Å; D185-Q187 VanDerWaalsContact C-N 3.35Å; Q187-A190 PolarHBondContact O-N 3.08Å; Q187-T191 VanDerWaalsContact O-CB 3.27Å; Q187-T191 WeakPolarHBondContact O-CB 3.45Å; Q187-T191 PolarHBondContact O-N 3.05Å; Q187-T191 PolarHBondContact O-OG1 2.85Å
188R68Low69.5Low116 Ų11668 Ų6844%0.43837%0.374SS..Hα-helixtrans-66.1-50175.9-176.7175.572.590.1-7.2110.1C184 D185 A190 T191 D192C184-R188 WeakPolarHBondContact O-CA 3.42Å; C184-R188 WeakPolarHBondContact O-CB 3.2Å; C184-R188 PolarHBondContact O-N 3.17Å; D185-R188 PolarHBondContact O-N 3.14Å; D185-R188 IonicContact OD1-CZ 3.77Å; D185-R188 IonicContact OD1-NE 3Å; D185-R188 PolarHBondContact OD1-NE 3.19Å; D185-R188 IonicContact OD1-NH2 3.48Å; D185-R188 PolarHBondContact OD1-NH2 2.8Å; R188-A190 PolarHBondContact O-N 3.38Å; R188-T191 WeakPolarHBondContact O-CB 3.44Å; R188-T191 PolarHBondContact O-N 3.43Å; R188-D192 WeakPolarHBondContact O-CB 3.34Å; R188-D192 PolarHBondContact O-N 3.24Å
189L74.2Confident70.9Confident79 Ų7974.9 Ų74.941%0.41439%0.386SS..Hα-helixtrans-56.8-49.1172.5-72.6171.3000110.4D185 T191 D192 Y193D185-L189 VanDerWaalsContact O-CB 3.27Å; D185-L189 WeakPolarHBondContact O-CB 3.45Å; D185-L189 WeakPolarHBondContact O-CG 3.47Å; D185-L189 PolarHBondContact O-N 3.4Å; L189-T191 VanDerWaalsContact C-N 3.31Å; L189-T191 PolarHBondContact O-N 3.16Å; L189-D192 PolarHBondContact O-N 3.43Å; L189-Y193 HydrophobicContact CB-CD2 4.38Å; L189-Y193 HydrophobicContact CB-CE2 4.32Å; L189-Y193 WeakPolarHBondContact O-CB 3.24Å; L189-Y193 WeakPolarHBondContact O-CD2 3.44Å; L189-Y193 PolarHBondContact O-N 3.13Å
190A74.8Confident72.4Confident50 Ų5078.2 Ų78.241%0.41340%0.4SS..Hα-helixtrans-58.9-42.117800000112.2L186 Q187 R188 Y193 L194L186-A190 WeakPolarHBondContact O-CB 3.35Å; L186-A190 PolarHBondContact O-N 3.46Å; Q187-A190 PolarHBondContact O-N 3.08Å; R188-A190 PolarHBondContact O-N 3.38Å; A190-Y193 PolarHBondContact O-N 3.4Å; A190-L194 VanDerWaalsContact O-CB 3.29Å; A190-L194 WeakPolarHBondContact O-CB 3.45Å; A190-L194 PolarHBondContact O-N 3.25Å
191T76.8Confident74Confident36 Ų3674.2 Ų74.222%0.22138%0.38CS..Hα-helixtrans-63.6-46.5175.5-60.50000111.2Q187 R188 L189 Y193 L194 L195 A240Q187-T191 VanDerWaalsContact O-CB 3.27Å; Q187-T191 WeakPolarHBondContact O-CB 3.45Å; Q187-T191 PolarHBondContact O-N 3.05Å; Q187-T191 PolarHBondContact O-OG1 2.85Å; R188-T191 WeakPolarHBondContact O-CB 3.44Å; R188-T191 PolarHBondContact O-N 3.43Å; L189-T191 VanDerWaalsContact C-N 3.31Å; L189-T191 PolarHBondContact O-N 3.16Å; T191-Y193 VanDerWaalsContact C-N 3.34Å; T191-Y193 PolarHBondContact O-N 3.38Å; T191-L194 PolarHBondContact O-N 3.24Å; T191-L195 HydrophobicContact CG2-CD1 4.02Å; T191-L195 WeakPolarHBondContact O-CB 3.29Å; T191-L195 WeakPolarHBondContact O-CG 3.32Å; T191-L195 PolarHBondContact O-N 2.96Å; T191-A240 HydrophobicContact CG2-CB 3.59Å
192D76.2Confident75.7Confident63 Ų6371.2 Ų71.234%0.33737%0.365SS..Hα-helixtrans-63.9-40.4178.9-68.5-20.4000111R188 L189 L195 A196 R244R188-D192 WeakPolarHBondContact O-CB 3.34Å; R188-D192 PolarHBondContact O-N 3.24Å; L189-D192 PolarHBondContact O-N 3.43Å; D192-L195 PolarHBondContact O-N 3.44Å; D192-A196 WeakPolarHBondContact O-CB 3.35Å; D192-A196 PolarHBondContact O-N 3.05Å; D192-R244 IonicContact OD1-NH2 2.78Å
193Y78.7Confident77.4Confident128 Ų12868.4 Ų68.450%0.50235%0.354SS..Hα-helixtrans-64.8-40.2173.5-81.1-64.8000112.4L189 A190 T191 A196 G197L189-Y193 HydrophobicContact CB-CD2 4.38Å; L189-Y193 HydrophobicContact CB-CE2 4.32Å; L189-Y193 WeakPolarHBondContact O-CB 3.24Å; L189-Y193 WeakPolarHBondContact O-CD2 3.44Å; L189-Y193 PolarHBondContact O-N 3.13Å; A190-Y193 PolarHBondContact O-N 3.4Å; T191-Y193 VanDerWaalsContact C-N 3.34Å; T191-Y193 PolarHBondContact O-N 3.38Å; Y193-A196 PolarHBondContact O-N 2.89Å; Y193-G197 PolarHBondContact O-N 3.3Å
194L80.7Confident78.9Confident43 Ų4370 Ų7023%0.22536%0.356CS..Hα-helixtrans-67.7-42.7177.7-158.1170.4000110.1L34 T87 A190 T191 A196 G197 Y198 W236L34-L194 HydrophobicContact CD1-CD1 4.04Å; T87-L194 HydrophobicContact CG2-CD1 4.46Å; T87-L194 HydrophobicContact CG2-CG 4.15Å; A190-L194 VanDerWaalsContact O-CB 3.29Å; A190-L194 WeakPolarHBondContact O-CB 3.45Å; A190-L194 PolarHBondContact O-N 3.25Å; T191-L194 PolarHBondContact O-N 3.24Å; L194-A196 PolarHBondContact O-N 3.26Å; L194-G197 PolarHBondContact O-N 2.9Å; L194-Y198 WeakPolarHBondContact O-CB 3.33Å; L194-Y198 PolarHBondContact O-N 3.21Å; L194-W236 HydrophobicContact CB-CH2 3.6Å; L194-W236 HydrophobicContact CB-CZ2 4.26Å; L194-W236 HydrophobicContact CD1-CH2 4.1Å; L194-W236 HydrophobicContact CD1-CZ2 4.05Å; L194-W236 HydrophobicContact CD2-CE3 4.45Å; L194-W236 HydrophobicContact CD2-CH2 2.95Å; L194-W236 HydrophobicContact CD2-CZ2 3.55Å; L194-W236 HydrophobicContact CD2-CZ3 3.41Å; L194-W236 VanDerWaalsContact CD2-CZ3 3.41Å; L194-W236 HydrophobicContact CG-CH2 3.61Å; L194-W236 HydrophobicContact CG-CZ2 4.09Å; L194-W236 HydrophobicContact CG-CZ3 4.44Å
195L84.6Confident80.4Confident28 Ų2868.4 Ų68.415%0.14735%0.345CS..Hα-helixtrans-61.6-41.7173-75.3168.2000112.2T191 D192 Y198 R199 W236 A237T191-L195 HydrophobicContact CG2-CD1 4.02Å; T191-L195 WeakPolarHBondContact O-CB 3.29Å; T191-L195 WeakPolarHBondContact O-CG 3.32Å; T191-L195 PolarHBondContact O-N 2.96Å; D192-L195 PolarHBondContact O-N 3.44Å; L195-Y198 PolarHBondContact O-N 3.01Å; L195-R199 WeakPolarHBondContact O-CG 3.09Å; L195-R199 PolarHBondContact O-N 2.91Å; L195-W236 HydrophobicContact CB-CH2 4.37Å; L195-W236 HydrophobicContact CB-CZ3 4.2Å; L195-W236 HydrophobicContact CD2-CD2 4.03Å; L195-W236 HydrophobicContact CD2-CE3 3.34Å; L195-W236 HydrophobicContact CD2-CH2 3.76Å; L195-W236 HydrophobicContact CD2-CZ3 3.23Å; L195-W236 HydrophobicContact CG-CE3 4.18Å; L195-W236 HydrophobicContact CG-CH2 3.64Å; L195-W236 HydrophobicContact CG-CZ2 4.46Å; L195-W236 HydrophobicContact CG-CZ3 3.6Å; L195-A237 HydrophobicContact CD1-CB 4.12Å; L195-A237 HydrophobicContact CD2-CB 3.83Å
196A82.1Confident81.7Confident34 Ų3466.2 Ų66.228%0.28134%0.335SS..Hα-helixtrans-62.7-46.3174.700000111.7D192 Y193 L194 Y198 R199 E200D192-A196 WeakPolarHBondContact O-CB 3.35Å; D192-A196 PolarHBondContact O-N 3.05Å; Y193-A196 PolarHBondContact O-N 2.89Å; L194-A196 PolarHBondContact O-N 3.26Å; A196-Y198 VanDerWaalsContact C-N 3.32Å; A196-Y198 PolarHBondContact O-N 3.12Å; A196-R199 PolarHBondContact O-N 3.44Å; A196-E200 WeakPolarHBondContact O-CG 3.47Å; A196-E200 PolarHBondContact O-N 3.05Å
197G81.8Confident82.7Confident3 Ų365.9 Ų65.93%0.03133%0.329CS..Hα-helixtrans-62.8-37.217600000112.8Y193 L194 E200 C201Y193-G197 PolarHBondContact O-N 3.3Å; L194-G197 PolarHBondContact O-N 2.9Å; G197-E200 PolarHBondContact O-N 3.21Å; G197-C201 WeakPolarHBondContact O-CB 3.12Å; G197-C201 PolarHBondContact O-N 3.31Å
198Y87Confident83.8Confident20 Ų2065.1 Ų65.18%0.07832%0.321CS..Hα-helixtrans-61.7-45.6173-176.2-95000111.5L83 L194 L195 A196 E200 C201 V202 L229 Y232 W236L83-Y198 HydrophobicContact CD2-CD2 3.86Å; L83-Y198 HydrophobicContact CD2-CE2 4.34Å; L194-Y198 WeakPolarHBondContact O-CB 3.33Å; L194-Y198 PolarHBondContact O-N 3.21Å; L195-Y198 PolarHBondContact O-N 3.01Å; A196-Y198 VanDerWaalsContact C-N 3.32Å; A196-Y198 PolarHBondContact O-N 3.12Å; Y198-E200 PolarHBondContact O-N 3.37Å; Y198-C201 VanDerWaalsContact O-CB 3.31Å; Y198-C201 WeakPolarHBondContact O-CB 3.49Å; Y198-C201 PolarHBondContact O-N 2.91Å; Y198-V202 HydrophobicContact CD1-CG2 4.09Å; Y198-V202 HydrophobicContact CE1-CG2 3.64Å; Y198-V202 WeakPolarHBondContact O-CG2 3.26Å; Y198-V202 PolarHBondContact O-N 3.4Å; Y198-L229 WeakPolarHBondContact CE1-O 3.34Å; Y198-L229 PolarHBondContact OH-O 3.21Å; Y198-Y232 HydrophobicContact CE2-CD1 4.4Å; Y198-W236 HydrophobicContact CG-CZ3 4.49Å
199R88.2Confident84.9Confident191 Ų19159.9 Ų59.972%0.72130%0.302SS*.Hα-helixtrans-63.4-41177.5-70.7178.467.6-135.3-2112.5L195 A196 C201 V202 A203L195-R199 WeakPolarHBondContact O-CG 3.09Å; L195-R199 PolarHBondContact O-N 2.91Å; A196-R199 PolarHBondContact O-N 3.44Å; R199-C201 VanDerWaalsContact C-N 3.33Å; R199-V202 PolarHBondContact O-N 3.24Å; R199-A203 PolarHBondContact O-N 2.8Å
200E87.3Confident85.7Confident108 Ų10862.8 Ų62.851%0.50531%0.308SS..Hα-helixtrans-60.9-43173.2-71.9170.2166.300111K90 A196 G197 Y198 A203 E204K90-E200 IonicContact NZ-OE1 2.8Å; K90-E200 PolarHBondContact NZ-OE1 3.05Å; K90-E200 IonicContact NZ-OE2 2.76Å; K90-E200 PolarHBondContact NZ-OE2 3.37Å; A196-E200 WeakPolarHBondContact O-CG 3.47Å; A196-E200 PolarHBondContact O-N 3.05Å; G197-E200 PolarHBondContact O-N 3.21Å; Y198-E200 PolarHBondContact O-N 3.37Å; E200-A203 WeakPolarHBondContact O-CB 3.38Å; E200-A203 PolarHBondContact O-N 3.13Å; E200-E204 PolarHBondContact O-N 3.46Å
201C88.5Confident86.4Confident20 Ų2064.1 Ų64.114%0.13532%0.315CS..Hα-helixtrans-59.1-48.4174.8175.50000112C82 G197 Y198 R199 A203 E204 V205C82-C201 VanDerWaalsContact CB-SG 3.55Å; G197-C201 WeakPolarHBondContact O-CB 3.12Å; G197-C201 PolarHBondContact O-N 3.31Å; Y198-C201 VanDerWaalsContact O-CB 3.31Å; Y198-C201 WeakPolarHBondContact O-CB 3.49Å; Y198-C201 PolarHBondContact O-N 2.91Å; R199-C201 VanDerWaalsContact C-N 3.33Å; C201-A203 VanDerWaalsContact C-N 3.27Å; C201-A203 PolarHBondContact O-N 3.23Å; C201-E204 PolarHBondContact O-N 2.84Å; C201-E204 VanDerWaalsContact O-N 3.16Å; C201-V205 WeakPolarHBondContact O-CG2 3.27Å; C201-V205 PolarHBondContact O-N 3.09Å
202V90.3Very high86.9Confident11 Ų1166.8 Ų66.87%0.06733%0.33CS..Hα-helixtrans-61-38.5178.1176.30000111.4Y198 R199 V205 A206 I226 L229 Q230Y198-V202 HydrophobicContact CD1-CG2 4.09Å; Y198-V202 HydrophobicContact CE1-CG2 3.64Å; Y198-V202 WeakPolarHBondContact O-CG2 3.26Å; Y198-V202 PolarHBondContact O-N 3.4Å; R199-V202 PolarHBondContact O-N 3.24Å; V202-V205 PolarHBondContact O-N 3.49Å; V202-A206 WeakPolarHBondContact O-CB 3.47Å; V202-A206 PolarHBondContact O-N 2.72Å; V202-I226 HydrophobicContact CG1-CG2 4.46Å; V202-L229 HydrophobicContact CG1-CB 4.1Å; V202-L229 HydrophobicContact CG2-CB 3.83Å; V202-L229 HydrophobicContact CG2-CD1 4.48Å; V202-Q230 HydrophobicContact CG1-CG 4.11Å
203A90.2Very high87.5Confident59 Ų5968.4 Ų68.449%0.48834%0.336SS..Hα-helixtrans-64.5-41.6175.100000112.1R199 E200 C201 A206 K207R199-A203 PolarHBondContact O-N 2.8Å; E200-A203 WeakPolarHBondContact O-CB 3.38Å; E200-A203 PolarHBondContact O-N 3.13Å; C201-A203 VanDerWaalsContact C-N 3.27Å; C201-A203 PolarHBondContact O-N 3.23Å; A203-A206 WeakPolarHBondContact O-CB 3.46Å; A203-A206 PolarHBondContact O-N 2.93Å; A203-K207 PolarHBondContact O-N 3.2Å
204E90.2Very high87.9Confident104 Ų10465.1 Ų65.149%0.48634%0.341SS..Hα-helixtrans-68.6-37.3177.2-162.662-15500111.7E200 C201 A206 K207 Y208E200-E204 PolarHBondContact O-N 3.46Å; C201-E204 PolarHBondContact O-N 2.84Å; C201-E204 VanDerWaalsContact O-N 3.16Å; E204-A206 VanDerWaalsContact C-N 3.35Å; E204-A206 PolarHBondContact O-N 3.34Å; E204-K207 CarbonylContact O-C 3.6Å; E204-K207 WeakPolarHBondContact O-CB 3.4Å; E204-K207 PolarHBondContact O-N 3.37Å; E204-K207 IonicContact OE1-NZ 2.79Å; E204-K207 PolarHBondContact OE1-NZ 3.44Å; E204-K207 IonicContact OE2-NZ 3.42Å; E204-K207 PolarHBondContact OE2-NZ 3.13Å; E204-Y208 WeakPolarHBondContact O-CB 3.19Å; E204-Y208 PolarHBondContact O-N 3.4Å
205V90.4Very high88.3Confident28 Ų2864.5 Ų64.517%0.1734%0.338CS..Hα-helixtrans-58.7-47.8170172.60000110C201 V202 K207 Y208 L209 L225 I226 L229C201-V205 WeakPolarHBondContact O-CG2 3.27Å; C201-V205 PolarHBondContact O-N 3.09Å; V202-V205 PolarHBondContact O-N 3.49Å; V205-K207 PolarHBondContact O-N 2.85Å; V205-Y208 PolarHBondContact O-N 2.81Å; V205-Y208 VanDerWaalsContact O-N 3.13Å; V205-L209 HydrophobicContact CG1-CD1 4.07Å; V205-L209 HydrophobicContact CG1-CG 4.27Å; V205-L209 VanDerWaalsContact O-CG 3.27Å; V205-L209 WeakPolarHBondContact O-CG 3.44Å; V205-L209 PolarHBondContact O-N 2.99Å; V205-L225 HydrophobicContact CG1-CD2 4.41Å; V205-I226 HydrophobicContact CG1-CD1 4.05Å; V205-L229 HydrophobicContact CB-CD1 4.48Å; V205-L229 HydrophobicContact CG1-CD1 4.04Å
206A90.9Very high88.5Confident17 Ų1767 Ų6714%0.1435%0.352CS..Hα-helixtrans-60.1-31.8178.500000113.4V202 A203 E204 R222 I226V202-A206 WeakPolarHBondContact O-CB 3.47Å; V202-A206 PolarHBondContact O-N 2.72Å; A203-A206 WeakPolarHBondContact O-CB 3.46Å; A203-A206 PolarHBondContact O-N 2.93Å; E204-A206 VanDerWaalsContact C-N 3.35Å; E204-A206 PolarHBondContact O-N 3.34Å; A206-R222 PolarHBondContact O-NH2 3.41Å; A206-I226 HydrophobicContact CB-CD1 3.62Å; A206-I226 HydrophobicContact CB-CG1 4.03Å
207K90.7Very high88.8Confident113 Ų11372.1 Ų72.149%0.49137%0.37SS..Hα-helixtrans-77.5-39.5174.9177.7-179.2157.9-139.10112.2A203 E204 V205 Y210 S211A203-K207 PolarHBondContact O-N 3.2Å; E204-K207 CarbonylContact O-C 3.6Å; E204-K207 WeakPolarHBondContact O-CB 3.4Å; E204-K207 PolarHBondContact O-N 3.37Å; E204-K207 IonicContact OE1-NZ 2.79Å; E204-K207 PolarHBondContact OE1-NZ 3.44Å; E204-K207 IonicContact OE2-NZ 3.42Å; E204-K207 PolarHBondContact OE2-NZ 3.13Å; V205-K207 PolarHBondContact O-N 2.85Å; K207-Y210 PolarHBondContact O-N 3.03Å; K207-S211 WeakPolarHBondContact O-CB 3.46Å; K207-S211 PolarHBondContact O-N 3.18Å; K207-S211 PolarHBondContact O-OG 3.48Å
208Y89.4Confident89.1Confident117 Ų11780 Ų8046%0.45941%0.406SS..Hα-helixtrans-62.3-47.1175.4178.6-90.3000111.3E204 V205 Y210 S211 V212 E213E204-Y208 WeakPolarHBondContact O-CB 3.19Å; E204-Y208 PolarHBondContact O-N 3.4Å; V205-Y208 PolarHBondContact O-N 2.81Å; V205-Y208 VanDerWaalsContact O-N 3.13Å; Y208-Y210 PolarHBondContact O-N 3.47Å; Y208-S211 PolarHBondContact O-N 3.41Å; Y208-V212 HydrophobicContact CD2-CB 3.89Å; Y208-V212 HydrophobicContact CD2-CG1 4.38Å; Y208-V212 HydrophobicContact CD2-CG2 3.59Å; Y208-V212 HydrophobicContact CE1-CB 4.38Å; Y208-V212 HydrophobicContact CE1-CG1 4.46Å; Y208-V212 HydrophobicContact CE2-CB 3.7Å; Y208-V212 HydrophobicContact CE2-CG1 3.67Å; Y208-V212 HydrophobicContact CE2-CG2 3.67Å; Y208-V212 HydrophobicContact CG-CB 4.32Å; Y208-V212 HydrophobicContact CG-CG2 4.32Å; Y208-V212 WeakPolarHBondContact O-CB 3.45Å; Y208-V212 PolarHBondContact O-N 3.08Å; Y208-E213 HydrophobicContact CD1-CG 4.35Å; Y208-E213 HydrophobicContact CE1-CG 3.87Å; Y208-E213 WeakPolarHBondContact CE1-OE1 3.41Å; Y208-E213 PolarHBondContact O-N 3.44Å
209L90.4Very high89.3Confident5 Ų581.1 Ų81.13%0.02641%0.413CS..Hα-helixtrans-56.8-37176.1-63.9174.3000111.7V205 E213 G214 L215 R222 L225 I226V205-L209 HydrophobicContact CG1-CD1 4.07Å; V205-L209 HydrophobicContact CG1-CG 4.27Å; V205-L209 VanDerWaalsContact O-CG 3.27Å; V205-L209 WeakPolarHBondContact O-CG 3.44Å; V205-L209 PolarHBondContact O-N 2.99Å; L209-E213 WeakPolarHBondContact CD2-OE2 3.5Å; L209-E213 WeakPolarHBondContact O-CB 3.36Å; L209-G214 PolarHBondContact O-N 3.29Å; L209-L215 HydrophobicContact CB-CD1 4.42Å; L209-L215 HydrophobicContact CD2-CD1 4.19Å; L209-L215 WeakPolarHBondContact O-CB 3.4Å; L209-L215 PolarHBondContact O-N 3.28Å; L209-R222 HydrophobicContact CB-CG 4.17Å; L209-R222 HydrophobicContact CD1-CB 4.44Å; L209-R222 HydrophobicContact CD1-CG 3.87Å; L209-L225 HydrophobicContact CD1-CD2 3.75Å; L209-L225 HydrophobicContact CD1-CG 4.49Å; L209-L225 HydrophobicContact CD2-CD2 4.14Å; L209-I226 HydrophobicContact CD1-CD1 4Å; L209-I226 HydrophobicContact CD1-CG1 4.25Å
210Y91.2Very high89.3Confident141 Ų14176.9 Ų76.955%0.55341%0.411SS*.Hα-helixtrans-77.6-48.8178.3179.7-103.4000113.3K207 Y208 G214 L215K207-Y210 PolarHBondContact O-N 3.03Å; Y208-Y210 PolarHBondContact O-N 3.47Å; Y210-G214 WeakPolarHBondContact O-CA 3.35Å; Y210-L215 WeakPolarHBondContact CA-O 3.11Å
211S89.5Confident89.3Confident78 Ų7875.3 Ų75.355%0.54541%0.405SS..Hα-helixtrans-85.6-29.5-169.9580000114.6K207 Y208K207-S211 WeakPolarHBondContact O-CB 3.46Å; K207-S211 PolarHBondContact O-N 3.18Å; K207-S211 PolarHBondContact O-OG 3.48Å; Y208-S211 PolarHBondContact O-N 3.41Å
212V86.9Confident89.4Confident91 Ų9176 Ų7655%0.55241%0.405SS*.THydrogen-bonded Turntrans-106.5-48.2-175.4-177.70000111.1Y208 G214Y208-V212 HydrophobicContact CD2-CB 3.89Å; Y208-V212 HydrophobicContact CD2-CG1 4.38Å; Y208-V212 HydrophobicContact CD2-CG2 3.59Å; Y208-V212 HydrophobicContact CE1-CB 4.38Å; Y208-V212 HydrophobicContact CE1-CG1 4.46Å; Y208-V212 HydrophobicContact CE2-CB 3.7Å; Y208-V212 HydrophobicContact CE2-CG1 3.67Å; Y208-V212 HydrophobicContact CE2-CG2 3.67Å; Y208-V212 HydrophobicContact CG-CB 4.32Å; Y208-V212 HydrophobicContact CG-CG2 4.32Å; Y208-V212 WeakPolarHBondContact O-CB 3.45Å; Y208-V212 PolarHBondContact O-N 3.08Å; V212-G214 VanDerWaalsContact C-N 3.33Å
213E88.3Confident89.4Confident97 Ų9778.4 Ų78.445%0.45342%0.417SS..SBendtrans-82.9-12.7179.6-60.2-174.2176.400113Y208 L209 L215Y208-E213 HydrophobicContact CD1-CG 4.35Å; Y208-E213 HydrophobicContact CE1-CG 3.87Å; Y208-E213 WeakPolarHBondContact CE1-OE1 3.41Å; Y208-E213 PolarHBondContact O-N 3.44Å; L209-E213 WeakPolarHBondContact CD2-OE2 3.5Å; L209-E213 WeakPolarHBondContact O-CB 3.36Å; E213-L215 HydrophobicContact CB-CD1 4.35Å; E213-L215 HydrophobicContact CB-CG 3.92Å; E213-L215 PolarHBondContact O-N 2.9Å; E213-L215 VanDerWaalsContact OE2-CD1 3.32Å; E213-L215 WeakPolarHBondContact OE2-CD1 3.21Å
214G88.2Confident89.4Confident60 Ų6080.4 Ų80.462%0.61941%0.412SS*.  trans68.418.5-178.600000113.6L209 Y210 V212 D216L209-G214 PolarHBondContact O-N 3.29Å; Y210-G214 WeakPolarHBondContact O-CA 3.35Å; V212-G214 VanDerWaalsContact C-N 3.33Å; G214-D216 PolarHBondContact O-N 3.45Å
215L87.9Confident89.5Confident30 Ų3077.8 Ų77.816%0.15740%0.401CS..  trans-76.2110.4176.2-56.6-177.5000109.2L209 Y210 E213 N219 L221 R222L209-L215 HydrophobicContact CB-CD1 4.42Å; L209-L215 HydrophobicContact CD2-CD1 4.19Å; L209-L215 WeakPolarHBondContact O-CB 3.4Å; L209-L215 PolarHBondContact O-N 3.28Å; Y210-L215 WeakPolarHBondContact CA-O 3.11Å; E213-L215 HydrophobicContact CB-CD1 4.35Å; E213-L215 HydrophobicContact CB-CG 3.92Å; E213-L215 PolarHBondContact O-N 2.9Å; E213-L215 VanDerWaalsContact OE2-CD1 3.32Å; E213-L215 WeakPolarHBondContact OE2-CD1 3.21Å; L215-N219 HydrophobicContact CB-CB 4.18Å; L215-L221 HydrophobicContact CD1-CD2 3.87Å; L215-R222 HydrophobicContact CB-CB 4.19Å; L215-R222 HydrophobicContact CD1-CB 4.37Å; L215-R222 WeakPolarHBondContact O-CD 3.31Å
216D88.7Confident89.5Confident81 Ų8177.2 Ų77.243%0.43340%0.397SS..  trans-62.2169.9176.568.721.6000112.4G214 Q218 N219 R222G214-D216 PolarHBondContact O-N 3.45Å; D216-Q218 PolarHBondContact O-N 2.92Å; D216-Q218 VanDerWaalsContact OD1-C 3.32Å; D216-Q218 WeakPolarHBondContact OD1-CA 3.42Å; D216-Q218 PolarHBondContact OD1-N 3.11Å; D216-N219 WeakPolarHBondContact O-CB 3.35Å; D216-N219 PolarHBondContact O-N 3.29Å; D216-N219 WeakPolarHBondContact OD1-CA 3.36Å; D216-N219 WeakPolarHBondContact OD1-CB 3.5Å; D216-N219 PolarHBondContact OD1-N 3.46Å; D216-R222 WeakPolarHBondContact O-CD 3.28Å
217Q88.3Confident89.5Confident140 Ų14079.5 Ų79.565%0.65441%0.412SS*.THydrogen-bonded Turntrans-66.7-17.8178.3-66.6180-23.400113.2N223Q217-N223 PolarHBondContact O-ND2 2.9Å; Q217-N223 PolarHBondContact O-OD1 3.33Å
218Q89.8Confident89.4Confident169 Ų16979 Ų7979%0.7941%0.412SS*.THydrogen-bonded Turntrans-89.8-10.8-179.7-62.4-171.3-6.500112D216D216-Q218 PolarHBondContact O-N 2.92Å; D216-Q218 VanDerWaalsContact OD1-C 3.32Å; D216-Q218 WeakPolarHBondContact OD1-CA 3.42Å; D216-Q218 PolarHBondContact OD1-N 3.11Å
219N89.3Confident89.5Confident43 Ų4374.4 Ų74.423%0.2340%0.395CS..  trans-64.5121.4-174.6-167.7-74000110.5L215 D216 L221 R222 N223L215-N219 HydrophobicContact CB-CB 4.18Å; D216-N219 WeakPolarHBondContact O-CB 3.35Å; D216-N219 PolarHBondContact O-N 3.29Å; D216-N219 WeakPolarHBondContact OD1-CA 3.36Å; D216-N219 WeakPolarHBondContact OD1-CB 3.5Å; D216-N219 PolarHBondContact OD1-N 3.46Å; N219-L221 VanDerWaalsContact C-N 3.25Å; N219-L221 PolarHBondContact O-N 3.03Å; N219-L221 VanDerWaalsContact OD1-CB 3.28Å; N219-L221 WeakPolarHBondContact OD1-CB 3.4Å; N219-L221 PolarHBondContact OD1-N 3.03Å; N219-R222 HydrophobicContact CB-CB 4.1Å; N219-R222 PolarHBondContact O-N 3.3Å; N219-R222 PolarHBondContact OD1-N 3.46Å; N219-N223 PolarHBondContact O-N 3.43Å; N219-N223 PolarHBondContact O-ND2 3.47Å
220P89.8Confident89.6Confident103 Ų10379.4 Ų79.467%0.66942%0.418SS*.Hα-helixtrans-64.3-31.1-174.824.6-33.9000112.4R224P220-R224 VanDerWaalsContact O-CB 3.23Å; P220-R224 WeakPolarHBondContact O-CB 3.36Å; P220-R224 PolarHBondContact O-N 2.97Å
221L86.6Confident89.5Confident74 Ų7478 Ų7839%0.38741%0.412SS..Hα-helixtrans-67.5-47.2177.4-175.7153.7000110.7L215 N219 N223 R224 L225L215-L221 HydrophobicContact CD1-CD2 3.87Å; N219-L221 VanDerWaalsContact C-N 3.25Å; N219-L221 PolarHBondContact O-N 3.03Å; N219-L221 VanDerWaalsContact OD1-CB 3.28Å; N219-L221 WeakPolarHBondContact OD1-CB 3.4Å; N219-L221 PolarHBondContact OD1-N 3.03Å; L221-N223 VanDerWaalsContact C-N 3.35Å; L221-N223 PolarHBondContact O-N 3.19Å; L221-R224 PolarHBondContact O-N 2.68Å; L221-L225 WeakPolarHBondContact O-CB 3.34Å; L221-L225 PolarHBondContact O-N 2.67Å
222R89.9Confident89.2Confident34 Ų3480.7 Ų80.713%0.12841%0.412CS..Hα-helixtrans-57.4-50.1175.8-179.5-176.1178.9-84.8-0.8110.6A206 L209 L215 D216 N219 R224 L225 I226A206-R222 PolarHBondContact O-NH2 3.41Å; L209-R222 HydrophobicContact CB-CG 4.17Å; L209-R222 HydrophobicContact CD1-CB 4.44Å; L209-R222 HydrophobicContact CD1-CG 3.87Å; L215-R222 HydrophobicContact CB-CB 4.19Å; L215-R222 HydrophobicContact CD1-CB 4.37Å; L215-R222 WeakPolarHBondContact O-CD 3.31Å; D216-R222 WeakPolarHBondContact O-CD 3.28Å; N219-R222 HydrophobicContact CB-CB 4.1Å; N219-R222 PolarHBondContact O-N 3.3Å; N219-R222 PolarHBondContact OD1-N 3.46Å; R222-R224 PolarHBondContact O-N 2.92Å; R222-L225 PolarHBondContact O-N 3.41Å; R222-I226 HydrophobicContact CG-CG1 4.41Å; R222-I226 WeakPolarHBondContact O-CG1 3.35Å; R222-I226 PolarHBondContact O-N 3.11Å
223N91.1Very high89.2Confident62 Ų6276.9 Ų76.933%0.33239%0.391SS..Hα-helixtrans-64.1-41.5-177.3-70.6-25000112Q217 N219 L221 S227Q217-N223 PolarHBondContact O-ND2 2.9Å; Q217-N223 PolarHBondContact O-OD1 3.33Å; N219-N223 PolarHBondContact O-N 3.43Å; N219-N223 PolarHBondContact O-ND2 3.47Å; L221-N223 VanDerWaalsContact C-N 3.35Å; L221-N223 PolarHBondContact O-N 3.19Å; N223-S227 VanDerWaalsContact O-CB 3.22Å; N223-S227 WeakPolarHBondContact O-CB 3.46Å; N223-S227 PolarHBondContact O-N 3.36Å; N223-S227 PolarHBondContact O-OG 3.29Å
224R91Very high89Confident101 Ų10176 Ų7638%0.38139%0.392SS..Hα-helixtrans-62.1-46.1174.7-174.4177.8-177.8165.34.4112.4E63 M64 P220 L221 R222 S227 H228E63-R224 VanDerWaalsContact O-CZ 3.32Å; E63-R224 PolarHBondContact O-NH1 3.33Å; E63-R224 PolarHBondContact O-NH2 2.9Å; M64-R224 VanDerWaalsContact CG-NH2 3.3Å; M64-R224 PolarHBondContact SD-NH2 2.88Å; M64-R224 VanDerWaalsContact SD-NH2 3.41Å; P220-R224 VanDerWaalsContact O-CB 3.23Å; P220-R224 WeakPolarHBondContact O-CB 3.36Å; P220-R224 PolarHBondContact O-N 2.97Å; L221-R224 PolarHBondContact O-N 2.68Å; R222-R224 PolarHBondContact O-N 2.92Å; R224-S227 PolarHBondContact O-N 2.87Å; R224-H228 VanDerWaalsContact O-CB 3.31Å; R224-H228 WeakPolarHBondContact O-CB 3.42Å; R224-H228 PolarHBondContact O-N 3.27Å
225L90.3Very high88.5Confident50 Ų5077 Ų7726%0.26238%0.381SS..Hα-helixtrans-63.7-49.1179.8177.860000111.6V205 L209 L221 R222 S227 H228 L229V205-L225 HydrophobicContact CG1-CD2 4.41Å; L209-L225 HydrophobicContact CD1-CD2 3.75Å; L209-L225 HydrophobicContact CD1-CG 4.49Å; L209-L225 HydrophobicContact CD2-CD2 4.14Å; L221-L225 WeakPolarHBondContact O-CB 3.34Å; L221-L225 PolarHBondContact O-N 2.67Å; R222-L225 PolarHBondContact O-N 3.41Å; L225-S227 VanDerWaalsContact C-N 3.35Å; L225-S227 PolarHBondContact O-N 3.18Å; L225-H228 PolarHBondContact O-N 3.31Å; L225-L229 HydrophobicContact CD1-CD1 4.25Å; L225-L229 HydrophobicContact CD1-CG 4.31Å; L225-L229 HydrophobicContact CG-CD1 4.26Å; L225-L229 WeakPolarHBondContact O-CG 3.44Å; L225-L229 PolarHBondContact O-N 2.86Å
226I92.1Very high87.9Confident15 Ų1578.6 Ų78.68%0.07739%0.385CS..Hα-helixtrans-63.3-42.1179.1-63.8-51.3000111.1V202 V205 A206 L209 R222 H228 L229 Q230V202-I226 HydrophobicContact CG1-CG2 4.46Å; V205-I226 HydrophobicContact CG1-CD1 4.05Å; A206-I226 HydrophobicContact CB-CD1 3.62Å; A206-I226 HydrophobicContact CB-CG1 4.03Å; L209-I226 HydrophobicContact CD1-CD1 4Å; L209-I226 HydrophobicContact CD1-CG1 4.25Å; R222-I226 HydrophobicContact CG-CG1 4.41Å; R222-I226 WeakPolarHBondContact O-CG1 3.35Å; R222-I226 PolarHBondContact O-N 3.11Å; I226-H228 VanDerWaalsContact C-N 3.34Å; I226-H228 PolarHBondContact O-N 3.29Å; I226-L229 PolarHBondContact O-N 3.5Å; I226-Q230 HydrophobicContact CG2-CG 4.26Å; I226-Q230 WeakPolarHBondContact O-CB 3.31Å; I226-Q230 WeakPolarHBondContact O-CG 3.04Å; I226-Q230 PolarHBondContact O-N 3.31Å
227S90.9Very high87.3Confident65 Ų6576.1 Ų76.146%0.45538%0.375SS..Hα-helixtrans-63.3-40.5177-56.70000111.8N223 R224 L225 Q230 Y231N223-S227 VanDerWaalsContact O-CB 3.22Å; N223-S227 WeakPolarHBondContact O-CB 3.46Å; N223-S227 PolarHBondContact O-N 3.36Å; N223-S227 PolarHBondContact O-OG 3.29Å; R224-S227 PolarHBondContact O-N 2.87Å; L225-S227 VanDerWaalsContact C-N 3.35Å; L225-S227 PolarHBondContact O-N 3.18Å; S227-Q230 PolarHBondContact O-N 2.76Å; S227-Y231 VanDerWaalsContact O-CB 3.31Å; S227-Y231 WeakPolarHBondContact O-CB 3.46Å; S227-Y231 PolarHBondContact O-N 2.91Å
228H88.8Confident86.3Confident104 Ų10473.2 Ų73.248%0.48137%0.367SS..Hα-helixtrans-63.2-44.8176.1178.6-94.4000112.1R224 L225 I226 Y231 Y232R224-H228 VanDerWaalsContact O-CB 3.31Å; R224-H228 WeakPolarHBondContact O-CB 3.42Å; R224-H228 PolarHBondContact O-N 3.27Å; L225-H228 PolarHBondContact O-N 3.31Å; I226-H228 VanDerWaalsContact C-N 3.34Å; I226-H228 PolarHBondContact O-N 3.29Å; H228-Y231 PolarHBondContact O-N 2.81Å; H228-Y232 WeakPolarHBondContact O-CB 3.34Å; H228-Y232 PolarHBondContact O-N 3.15Å
229L91.5Very high85.2Confident20 Ų2068.7 Ų68.711%0.10535%0.351CS..Hα-helixtrans-65.3-41.6176.4-67.3173.9000111.7Y198 V202 V205 L225 I226 Y232 G233Y198-L229 WeakPolarHBondContact CE1-O 3.34Å; Y198-L229 PolarHBondContact OH-O 3.21Å; V202-L229 HydrophobicContact CG1-CB 4.1Å; V202-L229 HydrophobicContact CG2-CB 3.83Å; V202-L229 HydrophobicContact CG2-CD1 4.48Å; V205-L229 HydrophobicContact CB-CD1 4.48Å; V205-L229 HydrophobicContact CG1-CD1 4.04Å; L225-L229 HydrophobicContact CD1-CD1 4.25Å; L225-L229 HydrophobicContact CD1-CG 4.31Å; L225-L229 HydrophobicContact CG-CD1 4.26Å; L225-L229 WeakPolarHBondContact O-CG 3.44Å; L225-L229 PolarHBondContact O-N 2.86Å; I226-L229 PolarHBondContact O-N 3.5Å; L229-Y232 PolarHBondContact O-N 3.03Å; L229-G233 PolarHBondContact O-N 3.29Å
230Q91.2Very high83.9Confident109 Ų10967.2 Ų67.251%0.50935%0.345SS..Hα-helixtrans-62.4-45.6175.8-73.1172.1-1900111.5V202 I226 S227 G233 T234V202-Q230 HydrophobicContact CG1-CG 4.11Å; I226-Q230 HydrophobicContact CG2-CG 4.26Å; I226-Q230 WeakPolarHBondContact O-CB 3.31Å; I226-Q230 WeakPolarHBondContact O-CG 3.04Å; I226-Q230 PolarHBondContact O-N 3.31Å; S227-Q230 PolarHBondContact O-N 2.76Å; Q230-G233 PolarHBondContact O-N 2.93Å; Q230-T234 WeakPolarHBondContact O-CG2 3.19Å; Q230-T234 PolarHBondContact O-N 2.73Å
231Y89.7Confident82.1Confident111 Ų11164.4 Ų64.444%0.43533%0.327SS..Hα-helixtrans-58.5-49175.1176.1-105000111.4S227 H228 G233 T234 Q235S227-Y231 VanDerWaalsContact O-CB 3.31Å; S227-Y231 WeakPolarHBondContact O-CB 3.46Å; S227-Y231 PolarHBondContact O-N 2.91Å; H228-Y231 PolarHBondContact O-N 2.81Å; Y231-G233 VanDerWaalsContact C-N 3.29Å; Y231-G233 PolarHBondContact O-N 3.33Å; Y231-T234 PolarHBondContact O-N 3.08Å; Y231-T234 PolarHBondContact O-OG1 2.93Å; Y231-Q235 HydrophobicContact CD1-CG 4.23Å; Y231-Q235 HydrophobicContact CD2-CG 4.39Å; Y231-Q235 HydrophobicContact CE1-CG 3.86Å; Y231-Q235 HydrophobicContact CE2-CG 4.01Å; Y231-Q235 HydrophobicContact CG-CG 4.5Å; Y231-Q235 WeakPolarHBondContact O-CG 3.31Å; Y231-Q235 PolarHBondContact O-N 3.11Å; Y231-Q235 PolarHBondContact OH-NE2 2.84Å; Y231-Q235 VanDerWaalsContact OH-NE2 3.12Å
232Y84.1Confident80.1Confident136 Ų13665.7 Ų65.753%0.53333%0.331SS..Hα-helixtrans-58.4-41.6177.2-171-93000112.2Y198 H228 L229 T234 Q235 W236Y198-Y232 HydrophobicContact CE2-CD1 4.4Å; H228-Y232 WeakPolarHBondContact O-CB 3.34Å; H228-Y232 PolarHBondContact O-N 3.15Å; L229-Y232 PolarHBondContact O-N 3.03Å; Y232-T234 VanDerWaalsContact C-N 3.34Å; Y232-T234 PolarHBondContact O-N 3.04Å; Y232-Q235 PolarHBondContact O-N 3.46Å; Y232-W236 WeakPolarHBondContact O-CB 3.46Å; Y232-W236 PolarHBondContact O-N 2.95Å
233G85.8Confident77.9Confident11 Ų1170.4 Ų70.411%0.11336%0.358CS..Hα-helixtrans-59.1-40.8173.900000113.5L229 Q230 Y231 A237L229-G233 PolarHBondContact O-N 3.29Å; Q230-G233 PolarHBondContact O-N 2.93Å; Y231-G233 VanDerWaalsContact C-N 3.29Å; Y231-G233 PolarHBondContact O-N 3.33Å; G233-A237 WeakPolarHBondContact O-CB 3.14Å; G233-A237 PolarHBondContact O-N 2.87Å
234T83.8Confident75.8Confident78 Ų7873.3 Ų73.348%0.47936%0.364SS..Hα-helixtrans-69.7-36176.958.90000112.9Q230 Y231 Y232 A237 T238Q230-T234 WeakPolarHBondContact O-CG2 3.19Å; Q230-T234 PolarHBondContact O-N 2.73Å; Y231-T234 PolarHBondContact O-N 3.08Å; Y231-T234 PolarHBondContact O-OG1 2.93Å; Y232-T234 VanDerWaalsContact C-N 3.34Å; Y232-T234 PolarHBondContact O-N 3.04Å; T234-A237 PolarHBondContact O-N 3.13Å; T234-T238 PolarHBondContact O-N 3.3Å; T234-T238 PolarHBondContact O-OG1 3.33Å
235Q78.7Confident73.5Confident82 Ų8273.8 Ų73.838%0.38337%0.373SS..Hα-helixtrans-69.6-38.8175.8-64.3-63.265.800111.7Y231 Y232 T238 T239Y231-Q235 HydrophobicContact CD1-CG 4.23Å; Y231-Q235 HydrophobicContact CD2-CG 4.39Å; Y231-Q235 HydrophobicContact CE1-CG 3.86Å; Y231-Q235 HydrophobicContact CE2-CG 4.01Å; Y231-Q235 HydrophobicContact CG-CG 4.5Å; Y231-Q235 WeakPolarHBondContact O-CG 3.31Å; Y231-Q235 PolarHBondContact O-N 3.11Å; Y231-Q235 PolarHBondContact OH-NE2 2.84Å; Y231-Q235 VanDerWaalsContact OH-NE2 3.12Å; Y232-Q235 PolarHBondContact O-N 3.46Å; Q235-T238 PolarHBondContact O-N 3.46Å; Q235-T239 PolarHBondContact O-N 3.29Å; Q235-T239 PolarHBondContact O-OG1 3.3Å
236W74.1Confident71.2Confident63 Ų6376.9 Ų76.924%0.23939%0.39CS..Hα-helixtrans-67.9-39.3174.7-179.246.8000112.1L194 L195 Y198 Y232 T238 T239 A240L194-W236 HydrophobicContact CB-CH2 3.6Å; L194-W236 HydrophobicContact CB-CZ2 4.26Å; L194-W236 HydrophobicContact CD1-CH2 4.1Å; L194-W236 HydrophobicContact CD1-CZ2 4.05Å; L194-W236 HydrophobicContact CD2-CE3 4.45Å; L194-W236 HydrophobicContact CD2-CH2 2.95Å; L194-W236 HydrophobicContact CD2-CZ2 3.55Å; L194-W236 HydrophobicContact CD2-CZ3 3.41Å; L194-W236 VanDerWaalsContact CD2-CZ3 3.41Å; L194-W236 HydrophobicContact CG-CH2 3.61Å; L194-W236 HydrophobicContact CG-CZ2 4.09Å; L194-W236 HydrophobicContact CG-CZ3 4.44Å; L195-W236 HydrophobicContact CB-CH2 4.37Å; L195-W236 HydrophobicContact CB-CZ3 4.2Å; L195-W236 HydrophobicContact CD2-CD2 4.03Å; L195-W236 HydrophobicContact CD2-CE3 3.34Å; L195-W236 HydrophobicContact CD2-CH2 3.76Å; L195-W236 HydrophobicContact CD2-CZ3 3.23Å; L195-W236 HydrophobicContact CG-CE3 4.18Å; L195-W236 HydrophobicContact CG-CH2 3.64Å; L195-W236 HydrophobicContact CG-CZ2 4.46Å; L195-W236 HydrophobicContact CG-CZ3 3.6Å; Y198-W236 HydrophobicContact CG-CZ3 4.49Å; Y232-W236 WeakPolarHBondContact O-CB 3.46Å; Y232-W236 PolarHBondContact O-N 2.95Å; W236-T238 VanDerWaalsContact C-N 3.26Å; W236-T238 PolarHBondContact O-N 3.4Å; W236-T239 WeakPolarHBondContact CA-OG1 3.11Å; W236-T239 PolarHBondContact O-N 3.25Å; W236-T239 PolarHBondContact O-OG1 3.4Å; W236-T239 VanDerWaalsContact O-OG1 3.12Å; W236-A240 VanDerWaalsContact O-CB 3.25Å; W236-A240 WeakPolarHBondContact O-CB 3.26Å; W236-A240 PolarHBondContact O-N 3.02Å
237A76.2Confident68.9Low28 Ų2880.4 Ų80.423%0.23142%0.421CS..Hα-helixtrans-58.6-40.3170.800000111.7L195 G233 T234 C241L195-A237 HydrophobicContact CD1-CB 4.12Å; L195-A237 HydrophobicContact CD2-CB 3.83Å; G233-A237 WeakPolarHBondContact O-CB 3.14Å; G233-A237 PolarHBondContact O-N 2.87Å; T234-A237 PolarHBondContact O-N 3.13Å; A237-C241 PolarHBondContact O-N 2.91Å; A237-C241 PolarHBondContact O-SG 3.3Å
238T68.7Low66.7Low80 Ų8080.9 Ų80.949%0.49143%0.429SS..Hα-helixtrans-70.7-40.3-179.9-550000112.4T234 Q235 W236 C241 H242T234-T238 PolarHBondContact O-N 3.3Å; T234-T238 PolarHBondContact O-OG1 3.33Å; Q235-T238 PolarHBondContact O-N 3.46Å; W236-T238 VanDerWaalsContact C-N 3.26Å; W236-T238 PolarHBondContact O-N 3.4Å; T238-C241 CarbonylContact O-C 3.38Å; T238-C241 WeakPolarHBondContact O-CA 3.32Å; T238-C241 VanDerWaalsContact O-CB 3.26Å; T238-C241 WeakPolarHBondContact O-CB 3.34Å; T238-C241 PolarHBondContact O-N 3.09Å; T238-H242 PolarHBondContact O-N 3.48Å
239T66.1Low64.2Low74 Ų7479.4 Ų79.445%0.45444%0.435SS..Hα-helixtrans-71-35.2175.235.40000112.3Q235 W236 C241 H242 L243Q235-T239 PolarHBondContact O-N 3.29Å; Q235-T239 PolarHBondContact O-OG1 3.3Å; W236-T239 WeakPolarHBondContact CA-OG1 3.11Å; W236-T239 PolarHBondContact O-N 3.25Å; W236-T239 PolarHBondContact O-OG1 3.4Å; W236-T239 VanDerWaalsContact O-OG1 3.12Å; T239-C241 PolarHBondContact O-N 3.47Å; T239-H242 PolarHBondContact O-N 3.46Å; T239-L243 PolarHBondContact O-N 2.84Å; T239-L243 VanDerWaalsContact O-N 3.09Å
240A62.3Low62Low11 Ų1184 Ų849%0.09147%0.465CS..Hα-helixtrans-63.8-27.6167.600000111.9T191 W236 R244T191-A240 HydrophobicContact CG2-CB 3.59Å; W236-A240 VanDerWaalsContact O-CB 3.25Å; W236-A240 WeakPolarHBondContact O-CB 3.26Å; W236-A240 PolarHBondContact O-N 3.02Å; A240-R244 WeakPolarHBondContact O-CG 3.28Å
241C50.9Low59.7Low44 Ų4489.5 Ų89.530%0.29748%0.483SS..Hα-helixtrans-76.5-28.8167.4-64.50000113.5A237 T238 T239 R244 I245A237-C241 PolarHBondContact O-N 2.91Å; A237-C241 PolarHBondContact O-SG 3.3Å; T238-C241 CarbonylContact O-C 3.38Å; T238-C241 WeakPolarHBondContact O-CA 3.32Å; T238-C241 VanDerWaalsContact O-CB 3.26Å; T238-C241 WeakPolarHBondContact O-CB 3.34Å; T238-C241 PolarHBondContact O-N 3.09Å; T239-C241 PolarHBondContact O-N 3.47Å; C241-R244 VanDerWaalsContact O-CA 3.3Å; C241-R244 WeakPolarHBondContact O-CA 3.11Å; C241-R244 WeakPolarHBondContact O-CB 3.48Å; C241-R244 WeakPolarHBondContact O-CG 3.13Å; C241-R244 PolarHBondContact O-N 2.89Å; C241-R244 PolarHBondContact SG-NH1 2.97Å; C241-I245 PolarHBondContact O-N 2.97Å
242H44.4Very low57.3Low102 Ų10293.3 Ų93.347%0.47251%0.505SS..Hα-helixtrans-74.8-29.2-179.9-148.1-71000112.6T238 T239 R244 I245 N246T238-H242 PolarHBondContact O-N 3.48Å; T239-H242 PolarHBondContact O-N 3.46Å; H242-R244 PolarHBondContact O-N 3.42Å; H242-I245 PolarHBondContact O-N 2.78Å; H242-I245 VanDerWaalsContact O-N 3.12Å; H242-N246 PolarHBondContact O-N 3.27Å
243L44Very low55.6Low132 Ų13292.8 Ų92.869%0.69152%0.516SS*.Hα-helixtrans-59.2-25.3162.6-77.9151.9000111.9T239T239-L243 PolarHBondContact O-N 2.84Å; T239-L243 VanDerWaalsContact O-N 3.09Å
244R47.2Very low53.3Low124 Ų12496.4 Ų96.447%0.46854%0.538SS..Hα-helixtrans-75.3-21.9175.3-47.1174-175.8-179.4-9.2113.1D192 A240 C241 H242D192-R244 IonicContact OD1-NH2 2.78Å; A240-R244 WeakPolarHBondContact O-CG 3.28Å; C241-R244 VanDerWaalsContact O-CA 3.3Å; C241-R244 WeakPolarHBondContact O-CA 3.11Å; C241-R244 WeakPolarHBondContact O-CB 3.48Å; C241-R244 WeakPolarHBondContact O-CG 3.13Å; C241-R244 PolarHBondContact O-N 2.89Å; C241-R244 PolarHBondContact SG-NH1 2.97Å; H242-R244 PolarHBondContact O-N 3.42Å
245I41.9Very low51.1Low111 Ų11199.3 Ų99.357%0.56956%0.558SS**Hα-helixtrans-92.2-37.6-178.2-58.9174.7000110.6C241 H242 A248C241-I245 PolarHBondContact O-N 2.97Å; H242-I245 PolarHBondContact O-N 2.78Å; H242-I245 VanDerWaalsContact O-N 3.12Å; I245-A248 PolarHBondContact O-N 3.39Å
246N42.3Very low49.1Very low115 Ų115104.8 Ų104.862%0.61558%0.575SS**Hα-helixtrans-79.2-19.2-177.4-74.7-2.4000114.3H242 A248H242-N246 PolarHBondContact O-N 3.27Å; N246-A248 PolarHBondContact O-N 2.72Å
247A44.4Very low47.5Very low88 Ų88107.6 Ų107.673%0.72761%0.605SS**THydrogen-bonded Turntrans-71.9-15172.300000113.2
248A44.2Very low45.8Very low75 Ų75112.4 Ų112.462%0.6263%0.631SS**THydrogen-bonded Turntrans-97.79.4-177.200000114.1I245 N246 P250I245-A248 PolarHBondContact O-N 3.39Å; N246-A248 PolarHBondContact O-N 2.72Å; A248-P250 WeakPolarHBondContact O-CD 3.27Å
249A38Very low44.4Very low73 Ų73115.7 Ų115.760%0.60365%0.646SS**  trans-77.6109.6177.200000110.1Y251A249-Y251 PolarHBondContact O-N 3.05Å
250P43.9Very low43.5Very low116 Ų116118.5 Ų118.575%0.75366%0.662SS**  trans-72.4133.2178.3-219.9000108.4A248 Q252A248-P250 WeakPolarHBondContact O-CD 3.27Å; P250-Q252 PolarHBondContact O-N 3.41Å
251Y44Very low42.8Very low225 Ų225124.2 Ų124.288%0.88270%0.697SS**  trans-46.8111.4166.2-65.5-87.9000110A249 T253A249-Y251 PolarHBondContact O-N 3.05Å; Y251-T253 PolarHBondContact O-N 2.74Å; Y251-T253 VanDerWaalsContact O-N 3.11Å
252Q38.8Very low42.2Very low192 Ų192127.6 Ų127.690%0.89772%0.718SS**  trans-65.7105.2160.8-75.8179.70.700107P250P250-Q252 PolarHBondContact O-N 3.41Å
253T48.8Very low42.2Very low125 Ų125129.9 Ų129.977%0.76774%0.738SS**  trans-65.9128.9169.550.70000109.1Y251Y251-T253 PolarHBondContact O-N 2.74Å; Y251-T253 VanDerWaalsContact O-N 3.11Å
254P37.9Very low41.6Very low87 Ų87129.1 Ų129.157%0.56574%0.743SS**  trans-72.7148.4-179.830.3-34.1000111.3W256P254-W256 PolarHBondContact O-N 3.44Å
255P36.1Very low41.4Very low138 Ų138128.1 Ų128.190%0.89676%0.761SS**SBendtrans-83.683.4-176.933.6-32000110.2
256W36.2Very low41.3Very low197 Ų197128 Ų12875%0.74678%0.777SS**  trans-150.587.6164.861.7-78.4000110.5P254P254-W256 PolarHBondContact O-N 3.44Å
257S42.4Very low41.1Very low123 Ų123125.4 Ų125.486%0.8678%0.777SS**  trans-151.686154.4-85.20000108.3
258T39.8Very low41.3Very low128 Ų128130.2 Ų130.279%0.78578%0.784SS**  trans-61.7126.4164.142.30000111.1
259N38.7Very low41.3Very low149 Ų149132.6 Ų132.680%0.79779%0.794SS**  147.9108.3129.8-89.1-16.3000110.8
260V46.9Very low41.6Very low133 Ų133133.9 Ų133.981%0.80680%0.804SS**  -168.8113.1112.2-96.60000111.3
261T48.3Very low41.4Very low132 Ų132133.7 Ų133.781%0.8181%0.812SS**  trans59.9126.2144.851.80000122.1
262P37.8Very low41.1Very low114 Ų114126.9 Ų126.974%0.7481%0.81SS**  trans-97.4145.3173.437.4-29.1000112.5
263V43.9Very low41.3Very low150 Ų150126.4 Ų126.491%0.90981%0.81SS**  trans-134.7123.3153.3165.20000108.3
264C32.8Very low40.9Very low116 Ų116126.5 Ų126.578%0.78482%0.815SS**  trans-87.9137.4-177.1-37.50000109.8
265A41.6Very low40.9Very low103 Ų103127.8 Ų127.885%0.85183%0.826SS**  trans-160.6110.5149.800000111.2
266A40.6Very low41.3Very low108 Ų108127 Ų12789%0.89382%0.82SS**  trans-15.7148.5163.100000120.5
267G37.8Very low41.2Very low61 Ų61123.9 Ų123.963%0.62982%0.819SS**  trans144.591.5131.200000118.9
268H48Very low40.7Very low190 Ų190126.4 Ų126.488%0.8882%0.819SS**  trans81.4132.5143.8-59.6-78.1000122.5
269P45.8Very low40.5Very low125 Ų125125.4 Ų125.481%0.81282%0.817SS**  trans-104.6154.6176.739.6-30.7000113.1
270A42.8Very low40.2Very low100 Ų100128.6 Ų128.683%0.82682%0.824SS**  trans-158.9110.3159.900000113
271A39.9Very low39.6Very low112 Ų112125.7 Ų125.793%0.92682%0.821SS**  trans39.7128.5135.200000122
272G39.1Very low38.9Very low81 Ų81125.6 Ų125.684%0.83582%0.816SS**  trans177.499.3158.200000112.6
273M43.1Very low38.7Very low182 Ų182126.1 Ų126.190%0.89782%0.819SS**  trans-75.5146-171.7-62.1152.660.600113.9
274C39.6Very low38.1Very low128 Ų128125.2 Ų125.287%0.86581%0.81SS**  172.8113.9118.9-980000112
275S38.2Very low38.1Very low114 Ų114124 Ų12480%0.79780%0.802SS**  trans-79.3-170.8161.7-46.70000109.9
276P45.1Very low37.7Very low120 Ų120128.6 Ų128.678%0.77980%0.799SS**  cis-136.5170.8-535.1-14.1000114.1
277D34.1Very low37.2Very low133 Ų133130 Ų13071%0.71180%0.801SS**  163.7123.5112.3-155.2-5.6000109.7
278M31.6Very low36.9Very low176 Ų176130.8 Ų130.887%0.86780%0.801SS**  trans-123.2104.8177.9-78.1-76.8155.900105.7
279S36Very low36Very low106 Ų106127.9 Ų127.974%0.74180%0.797SS**  trans-131.2123.8169.8-75.20000110.4
280F32Very low35.3Very low216 Ų216129.3 Ų129.395%0.94780%0.797SS**  trans-55.8142.7-179.5-76-106.5000113
281G33.6Very low34.8Very low73 Ų73130.1 Ų130.175%0.75380%0.797SS**  trans-176.785.8171.200000116.3
282N34.1Very low34.4Very low129 Ų129129.4 Ų129.469%0.6979%0.786SS**  trans59115.5138.5-162.48.5000120.7N284N282-N284 PolarHBondContact O-N 3.31Å
283P33.3Very low34Very low125 Ų125131.8 Ų131.881%0.81279%0.786SS**SBendtrans-87.380.7167.735.8-27.3000109.7
284N30.7Very low33.5Very low132 Ų132131 Ų13171%0.70679%0.785SS**  trans-157.278.3165.3-97-26.8000109.4N282N282-N284 PolarHBondContact O-N 3.31Å
285S34Very low33.1Very low89 Ų89129.8 Ų129.862%0.62278%0.775SS**  trans-145.793.3164.9-158.60000111.3
286Y31.5Very low32.6Very low201 Ų201129.5 Ų129.579%0.78877%0.773SS**  trans-5.9116.7143.138.7-87.7000115
287C31.7Very low32.1Very low138 Ų138133.7 Ų133.793%0.93278%0.78SS**  trans-106.9104.6156.6-120.30000108.1
288A30.1Very low32Very low77 Ų77135.7 Ų135.764%0.63679%0.785SS**  trans-80.8154.5172.800000110.9
289T30.7Very low31.8Very low128 Ų128134.6 Ų134.679%0.78578%0.782SS**  trans68.1109.5151.662.70000119.7
290N30.6Very low31.4Very low155 Ų155134.6 Ų134.683%0.82978%0.782SS**  -163.788.1106-125.83.9000111.4S292N290-S292 PolarHBondContact O-N 3.36Å
291S31.3Very low31.3Very low117 Ų117129.9 Ų129.982%0.81877%0.772SS**  trans-81.5103.416753.90000109.2
292S31.5Very low31.3Very low98 Ų98137 Ų13769%0.68578%0.776SS**PPolyproline II helixtrans-77.1136.1166.2-640000109.8N290 L294N290-S292 PolarHBondContact O-N 3.36Å; S292-L294 PolarHBondContact O-N 3.16Å
293P30.5Very low31.2Very low131 Ų131137.6 Ų137.685%0.85178%0.778SS**PPolyproline II helixtrans-80.9117.8174.730.7-28.1000109.5
294L33.2Very low31.5Very low165 Ų165137.5 Ų137.586%0.86477%0.774SS**PPolyproline II helixtrans-92148.2168.3-80.3165.2000110.4S292S292-L294 PolarHBondContact O-N 3.16Å
295P31.4Very low31.8Very low103 Ų103138.2 Ų138.267%0.66978%0.778SS**PPolyproline II helixtrans-84.4155.3-1537.99.3000113.2F297P295-F297 PolarHBondContact O-N 2.8Å
296S28.7Very low31.5Very low108 Ų108137.2 Ų137.276%0.75578%0.782SS**  trans-52.8114.8171.9550000112.4Q298S296-Q298 PolarHBondContact O-N 3.3Å
297F33.2Very low31.7Very low208 Ų208133.6 Ų133.691%0.91279%0.786SS**  trans-74.3102.5162.4-98.2-90.1000109P295 N299P295-F297 PolarHBondContact O-N 2.8Å; F297-N299 PolarHBondContact O-N 2.97Å
298Q32Very low31.8Very low174 Ų174136.1 Ų136.181%0.81378%0.781SS**  trans-68.4119.1166.2-80.3-177.3-39.700109.4S296 S300S296-Q298 PolarHBondContact O-N 3.3Å; Q298-S300 PolarHBondContact O-N 3.22Å
299N28.6Very low32.1Very low153 Ų153141.3 Ų141.382%0.81879%0.792SS**  trans-65.3110.8166.8-160.812.3000108.2F297F297-N299 PolarHBondContact O-N 2.97Å
300S27.3Very low32.1Very low106 Ų106145.9 Ų145.974%0.74180%0.795SS**  trans-11886.3174.7-144.10000109.9Q298 R302Q298-S300 PolarHBondContact O-N 3.22Å; S300-R302 PolarHBondContact O-N 2.87Å
301T29.7Very low32.6Very low118 Ų118148.4 Ų148.472%0.72480%0.799SS**  trans-73.7100.6163.2-37.50000107.4
302R33.5Very low32.9Very low221 Ų221147.4 Ų147.483%0.83479%0.792SS**  trans-103.4105.1170.5-141.9-174-135.1-152.55.9109.7S300S300-R302 PolarHBondContact O-N 2.87Å
303I32.3Very low33.2Very low143 Ų143151 Ų15173%0.73380%0.804SS**  trans-69.7129.8162-64.2-174.2000107.5
304V39.1Very low33.5Very low123 Ų123155.4 Ų155.475%0.74580%0.803SS**  trans-128107.5163.8177.60000108.3
305N35.9Very low34.1Very low147 Ų147152.6 Ų152.679%0.78680%0.797SS**  trans-74.1146.3164.6-94.9-20000110.3
306G29.6Very low34.9Very low67 Ų67162.2 Ų162.269%0.69182%0.822SS**  trans46.7125.7150.100000118.3
307S35.6Very low35.2Very low126 Ų126164.9 Ų164.988%0.88183%0.826SS**  -177.5144.976.4-59.10000109.6
308K34.1Very low35.3Very low190 Ų190162.6 Ų162.683%0.82682%0.821SS**  trans-55.2144172.2-62.5168.4175.4178.70111.7
309Q36.3Very low35.5Very low187 Ų187162 Ų16287%0.87482%0.822SS**  -169.7141.7120.4-101.6178.937.500111.7
310W30.8Very low35.9Very low224 Ų224162.5 Ų162.585%0.84882%0.822SS**  trans-73.5153.8-176.2-67.465.9000111
311F39.3Very low36.4Very low208 Ų208166.1 Ų166.191%0.91283%0.827SS**  -164.3135.2122.6-98.6-70.6000110.9
312S38Very low36.9Very low95 Ų95169.3 Ų169.366%0.66483%0.834SS**  trans-65.8144.8-178.9-167.30000112.2
313N39.3Very low37.1Very low174 Ų174165.6 Ų165.693%0.9383%0.834SS**  trans-148.6106.4143.3-104.6-17.4000109.9
314R36.1Very low37.5Very low224 Ų224167.3 Ų167.385%0.84584%0.841SS**  trans-103.6134.6165.7178.9175.9-133-117.4-2.4106.3
315S44.6Very low37.3Very low106 Ų106171 Ų17174%0.74185%0.849SS**  trans159.598.4141.9-72.20000109.7
316Y48.5Very low37.5Very low304 Ų304173.2 Ų173.2100%1.19286%0.855SS**  -168.60100.5-106.6-85.6000108.4

Retrieved 316 of 316 residues in 45.5 ms (Link to these results)