A0A077ZM67_TRITR Loading...

Synapse associated protein 1

AlphaFold DB , UniProt , Accession A0A077ZM67, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 217 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
1M40Very low34.3Very low245 Ų245147 Ų147100%1.20783%0.831SS**  0105.20-134.3166.4-175.300105.9
2E33.4Very low34Very low190 Ų190146.3 Ų146.389%0.88882%0.815SS**  trans-69.2137.4169.5-70.9172.5137.700109
3V38.5Very low34Very low134 Ų134147.9 Ų147.981%0.81281%0.813SS**  trans-151.5100.2150.9-85.50000105.2
4S37.6Very low33.7Very low111 Ų111145.4 Ų145.478%0.77680%0.803SS**  90.697.986.7-70.60000112.2
5S32.8Very low33.8Very low110 Ų110145.1 Ų145.177%0.76980%0.798SS**  trans-11.6138.2144.3-49.40000117.1
6T36.3Very low33.4Very low147 Ų147146.9 Ų146.990%0.90280%0.799SS**  -146.1111.6129.429.40000109.5
7N31.3Very low33.4Very low146 Ų146148.7 Ų148.778%0.78180%0.801SS**  trans-58.1138.2163.6-72-40.8000109.6
8N35.9Very low33.8Very low168 Ų168146.7 Ų146.790%0.89880%0.797SS**  trans-120.992.2150.7-163.29.7000108.1
9S32.4Very low33.6Very low97 Ų97143.2 Ų143.268%0.67880%0.798SS**  trans-97121.1171.4-69.30000109.1
10K29.1Very low33.6Very low149 Ų149145.3 Ų145.365%0.64880%0.802SS**  trans72.3133.8142.8-157.1156.1-176.8-178.40116.8E12K10-E12 WeakPolarHBondContact CE-OE2 3.42Å; K10-E12 IonicContact NZ-OE2 2.66Å; K10-E12 PolarHBondContact NZ-OE2 3.33Å
11P30.6Very low33.6Very low120 Ų120143.8 Ų143.878%0.77980%0.802SS**  -126.2131.676.317.23.8000115.5Q13P11-Q13 PolarHBondContact O-N 3.08Å
12E30.6Very low33.4Very low138 Ų138137.6 Ų137.665%0.64578%0.777SS**  trans-57.4114.9149.5-108.6160.2105.700106.9K10K10-E12 WeakPolarHBondContact CE-OE2 3.42Å; K10-E12 IonicContact NZ-OE2 2.66Å; K10-E12 PolarHBondContact NZ-OE2 3.33Å
13Q33.2Very low33.5Very low168 Ų168135.4 Ų135.479%0.78577%0.771SS**  trans-106.4103.6151.3-85.2-161.5-15.900108P11 I15P11-Q13 PolarHBondContact O-N 3.08Å; Q13-I15 PolarHBondContact O-N 3.41Å; Q13-I15 VanDerWaalsContact O-N 3.14Å
14V30.6Very low33.3Very low112 Ų112136.9 Ų136.968%0.67977%0.769SS**  trans-56.5103.3158.7174.40000107.2E16V14-E16 HydrophobicContact CG1-CG 4.04Å
15I34.2Very low33.4Very low142 Ų142136.1 Ų136.173%0.72876%0.763SS**  trans-100.389.8159.4-62.8175000105.4Q13 Q17Q13-I15 PolarHBondContact O-N 3.41Å; Q13-I15 VanDerWaalsContact O-N 3.14Å; I15-Q17 PolarHBondContact O-N 3.48Å
16E28.5Very low33.7Very low173 Ų173137.4 Ų137.481%0.80876%0.762SS**  trans-63117.6153.6-79.2-171.8160.100107.7V14V14-E16 HydrophobicContact CG1-CG 4.04Å
17Q33.8Very low33.7Very low178 Ų178134.5 Ų134.583%0.83275%0.752SS**  trans-150.3151.8149.9-87.2-135.6-20.400110.7I15I15-Q17 PolarHBondContact O-N 3.48Å
18P39.1Very low33.8Very low112 Ų112136.2 Ų136.273%0.72775%0.753SS**  -106.3146.3-129.936.4-31.3000113.9
19G30.8Very low34.1Very low80 Ų80132.8 Ų132.883%0.82574%0.74SS**  trans4579.4139.300000117.7
20E34.4Very low34.1Very low186 Ų186137 Ų13787%0.86975%0.749SS**  trans-114.888.1150.2-135175.1-168.100109.1V22E20-V22 PolarHBondContact O-N 3.07Å
21S33.2Very low34.8Very low114 Ų114140.6 Ų140.680%0.79776%0.758SS**  trans-65.7105.3167.851.10000110.2
22V36.3Very low35.6Very low115 Ų115139 Ų13970%0.69775%0.748SS**  trans-142.798.7160.7-174.90000110.3E20E20-V22 PolarHBondContact O-N 3.07Å
23L34.8Very low36.2Very low143 Ų143141.8 Ų141.875%0.74976%0.758SS**  trans73.169.5145.6-56.1170.6000117.8S25L23-S25 PolarHBondContact O-N 2.8Å
24E33.6Very low36.9Very low166 Ų166139.3 Ų139.378%0.77676%0.759SS**  trans-55.782.7137.5-168.280.7-143.800109N26E24-N26 PolarHBondContact OE1-ND2 3.34Å
25S39.1Very low37.7Very low94 Ų94141 Ų14166%0.65776%0.759SS**  trans-106.169.6161.864.10000108.5L23 A27L23-S25 PolarHBondContact O-N 2.8Å; S25-A27 PolarHBondContact O-N 2.88Å
26N39.3Very low38.6Very low137 Ų137144.3 Ų144.373%0.73377%0.769SS**  trans-68.867.7161.2-113.5-50.7000108.3E24 K28E24-N26 PolarHBondContact OE1-ND2 3.34Å; N26-K28 PolarHBondContact O-N 3.12Å
27A37Very low40.1Very low86 Ų86141.8 Ų141.871%0.71176%0.756SS**  trans-70.785.5169.700000107.5S25S25-A27 PolarHBondContact O-N 2.88Å
28K34Very low41.5Very low183 Ų183136.4 Ų136.480%0.79674%0.736SS**  trans-48.9121.7166-173.1169.7-172.3169.90107.4N26 E30N26-K28 PolarHBondContact O-N 3.12Å; K28-E30 PolarHBondContact O-N 3.21Å
29P41Very low43Very low95 Ų95134.3 Ų134.362%0.61772%0.724SS**  trans-61.3111.4-178.120.8-29.8000109R31P29-R31 PolarHBondContact O-N 3.38Å
30E34.1Very low45Very low186 Ų186137.4 Ų137.487%0.86972%0.715SS**  trans-56.6105.9169.7-77-85.2142.100107.4K28K28-E30 PolarHBondContact O-N 3.21Å
31R43.7Very low46.8Very low224 Ų224131.6 Ų131.685%0.84570%0.695SS**  trans-57127.7178.3-161.6-171.3-62.2160.5-1.2107.7P29 K33P29-R31 PolarHBondContact O-N 3.38Å; R31-K33 PolarHBondContact O-N 3.28Å
32P45.8Very low48.6Very low87 Ų87129.3 Ų129.357%0.56568%0.676SS**  trans-54.9133.1-179.920.6-31.2000109.6S34P32-S34 PolarHBondContact O-N 3.3Å
33K43.8Very low50Low197 Ų197126 Ų12686%0.85765%0.654SS**  trans-47.6114.6-176.7-68.8171-177.6169.40108.7R31 H35R31-K33 PolarHBondContact O-N 3.28Å; K33-H35 PolarHBondContact O-N 3.41Å
34S47.6Very low51.9Low116 Ų116123.3 Ų123.381%0.81164%0.64SS**  trans-61.699.8-178.855.30000108.9P32 F36P32-S34 PolarHBondContact O-N 3.3Å; S34-F36 PolarHBondContact O-N 2.95Å
35H46.9Very low53.7Low147 Ų147120.5 Ų120.568%0.68163%0.631SS**  trans-57.2138.7156-77.8-78.6000107.5K33 F37K33-H35 PolarHBondContact O-N 3.41Å; H35-F37 HydrophobicContact CB-CD2 4.2Å; H35-F37 HydrophobicContact CB-CE2 3.58Å; H35-F37 HydrophobicContact CB-CZ 3.86Å; H35-F37 WeakPolarHBondContact O-CD2 3.36Å; H35-F37 PolarHBondContact O-N 3.49Å
36F54.1Low55.2Low211 Ų211119.3 Ų119.393%0.92562%0.617SS**  trans-62.681.4-175-179.3-100.6000110.1S34S34-F36 PolarHBondContact O-N 2.95Å
37F59.8Low56.5Low121 Ų121118.1 Ų118.153%0.53161%0.61SS.*PPolyproline II helixtrans-91.8129.7175.8-67.2-66.4000108.9H35 S39 C63H35-F37 HydrophobicContact CB-CD2 4.2Å; H35-F37 HydrophobicContact CB-CE2 3.58Å; H35-F37 HydrophobicContact CB-CZ 3.86Å; H35-F37 WeakPolarHBondContact O-CD2 3.36Å; H35-F37 PolarHBondContact O-N 3.49Å; F37-S39 PolarHBondContact O-N 3.45Å; F37-C63 WeakPolarHBondContact CE1-SG 3.36Å
38P63.5Low58.4Low65 Ų65123 Ų12342%0.42262%0.615SS.*PPolyproline II helixtrans-59.2137.6170.225.1-31.9000109.3T42 L43P38-T42 HydrophobicContact CB-CG2 4.49Å; P38-L43 HydrophobicContact CG-CD2 3.99Å
39S69.4Low60.5Low68 Ų68117.5 Ų117.548%0.47660%0.599SS.*PPolyproline II helixtrans-49.5141.8176.1174.50000111F37 S41 T42 L43F37-S39 PolarHBondContact O-N 3.45Å; S39-S41 PolarHBondContact O-N 2.77Å; S39-S41 VanDerWaalsContact O-N 3.08Å; S39-S41 PolarHBondContact OG-N 3Å; S39-S41 PolarHBondContact OG-OG 3.48Å; S39-T42 WeakPolarHBondContact O-CA 3.43Å; S39-T42 VanDerWaalsContact O-CB 3.25Å; S39-T42 WeakPolarHBondContact O-CB 3.34Å; S39-T42 PolarHBondContact O-N 3.05Å; S39-L43 PolarHBondContact O-N 2.92Å
40F73.7Confident61.8Low145 Ų145116.1 Ų116.164%0.63660%0.602SS**Hα-helixtrans-51.6-32.9173.8179.4-105.9000112.6T42 L43 L44F40-T42 PolarHBondContact O-N 2.9Å; F40-L43 WeakPolarHBondContact O-CB 3.49Å; F40-L43 PolarHBondContact O-N 3.46Å; F40-L43 VanDerWaalsContact O-N 3.14Å; F40-L44 HydrophobicContact CD1-CD1 3.92Å; F40-L44 HydrophobicContact CD1-CG 4.23Å; F40-L44 HydrophobicContact CE1-CD1 3.37Å; F40-L44 HydrophobicContact CE1-CD2 4.31Å; F40-L44 HydrophobicContact CE1-CG 3.74Å; F40-L44 HydrophobicContact CE2-CG 4.47Å; F40-L44 HydrophobicContact CZ-CD1 3.95Å; F40-L44 HydrophobicContact CZ-CD2 4.02Å; F40-L44 HydrophobicContact CZ-CG 3.87Å; F40-L44 PolarHBondContact O-N 3.21Å
41S72.8Confident63.4Low64 Ų64112.2 Ų112.245%0.44859%0.592SS.*Hα-helixtrans-61.7-40.817458.40000112.9S39 L43 L44 N45S39-S41 PolarHBondContact O-N 2.77Å; S39-S41 VanDerWaalsContact O-N 3.08Å; S39-S41 PolarHBondContact OG-N 3Å; S39-S41 PolarHBondContact OG-OG 3.48Å; S41-L43 VanDerWaalsContact C-N 3.26Å; S41-L43 PolarHBondContact O-N 3.02Å; S41-L44 PolarHBondContact O-N 3.37Å; S41-N45 WeakPolarHBondContact O-CB 3.37Å; S41-N45 VanDerWaalsContact O-CG 3.26Å; S41-N45 PolarHBondContact O-N 2.71Å; S41-N45 PolarHBondContact O-ND2 2.88Å
42T70.6Confident64.5Low65 Ų65103.1 Ų103.140%0.39957%0.568SS.*Hα-helixtrans-63.3-35.9174.7-49.10000110.9P38 S39 F40 N46P38-T42 HydrophobicContact CB-CG2 4.49Å; S39-T42 WeakPolarHBondContact O-CA 3.43Å; S39-T42 VanDerWaalsContact O-CB 3.25Å; S39-T42 WeakPolarHBondContact O-CB 3.34Å; S39-T42 PolarHBondContact O-N 3.05Å; F40-T42 PolarHBondContact O-N 2.9Å; T42-N46 PolarHBondContact O-N 3.44Å; T42-N46 VanDerWaalsContact O-N 3.14Å; T42-N46 PolarHBondContact O-ND2 3.4Å; T42-N46 VanDerWaalsContact O-ND2 3.17Å
43L66.4Low66.1Low46 Ų46102.3 Ų102.324%0.24156%0.564CS.*Hα-helixtrans-69-47177.3-59.9-177.8000112.4P38 S39 F40 S41 N45 N46 L47 N60P38-L43 HydrophobicContact CG-CD2 3.99Å; S39-L43 PolarHBondContact O-N 2.92Å; F40-L43 WeakPolarHBondContact O-CB 3.49Å; F40-L43 PolarHBondContact O-N 3.46Å; F40-L43 VanDerWaalsContact O-N 3.14Å; S41-L43 VanDerWaalsContact C-N 3.26Å; S41-L43 PolarHBondContact O-N 3.02Å; L43-N45 VanDerWaalsContact C-N 3.26Å; L43-N45 PolarHBondContact O-N 3.28Å; L43-N46 PolarHBondContact O-N 3.1Å; L43-L47 PolarHBondContact O-N 3.01Å; L43-N60 HydrophobicContact CD1-CB 4.48Å; L43-N60 VanDerWaalsContact CD2-ND2 3.28Å; L43-N60 WeakPolarHBondContact CD2-ND2 3.39Å
44L73.2Confident67.7Low87 Ų87100 Ų10046%0.45556%0.56SS.*Hα-helixtrans-58.9-39.6175-78.6178.2000111.9F40 S41 L47 K48F40-L44 HydrophobicContact CD1-CD1 3.92Å; F40-L44 HydrophobicContact CD1-CG 4.23Å; F40-L44 HydrophobicContact CE1-CD1 3.37Å; F40-L44 HydrophobicContact CE1-CD2 4.31Å; F40-L44 HydrophobicContact CE1-CG 3.74Å; F40-L44 HydrophobicContact CE2-CG 4.47Å; F40-L44 HydrophobicContact CZ-CD1 3.95Å; F40-L44 HydrophobicContact CZ-CD2 4.02Å; F40-L44 HydrophobicContact CZ-CG 3.87Å; F40-L44 PolarHBondContact O-N 3.21Å; S41-L44 PolarHBondContact O-N 3.37Å; L44-L47 PolarHBondContact O-N 2.91Å; L44-K48 WeakPolarHBondContact O-CB 3.41Å; L44-K48 PolarHBondContact O-N 3.23Å
45N72.8Confident69.3Low107 Ų10797.9 Ų97.957%0.57255%0.545SS*.Hα-helixtrans-63.1-45.7177.3-74.1-20.9000111.6S41 L43 L47 K48 S49S41-N45 WeakPolarHBondContact O-CB 3.37Å; S41-N45 VanDerWaalsContact O-CG 3.26Å; S41-N45 PolarHBondContact O-N 2.71Å; S41-N45 PolarHBondContact O-ND2 2.88Å; L43-N45 VanDerWaalsContact C-N 3.26Å; L43-N45 PolarHBondContact O-N 3.28Å; N45-L47 VanDerWaalsContact C-N 3.33Å; N45-L47 PolarHBondContact O-N 3.43Å; N45-K48 PolarHBondContact O-N 3.14Å; N45-S49 WeakPolarHBondContact O-CB 3.23Å; N45-S49 PolarHBondContact O-N 3.37Å; N45-S49 PolarHBondContact O-OG 3.42Å
46N68.8Low70.8Confident69 Ų6994.1 Ų94.137%0.36953%0.533SS..Hα-helixtrans-64.3-34.1176.9-76-39.9000113.4T42 L43 S49 G50T42-N46 PolarHBondContact O-N 3.44Å; T42-N46 VanDerWaalsContact O-N 3.14Å; T42-N46 PolarHBondContact O-ND2 3.4Å; T42-N46 VanDerWaalsContact O-ND2 3.17Å; L43-N46 PolarHBondContact O-N 3.1Å; N46-S49 WeakPolarHBondContact CA-OG 3.43Å; N46-S49 PolarHBondContact O-OG 3.17Å; N46-G50 PolarHBondContact O-N 3Å
47L68.2Low72Confident112 Ų11287.3 Ų87.359%0.58651%0.506SS*.Hα-helixtrans-69.6-43.1174.7-170.670.2000111.1L43 L44 N45 G50 L57L43-L47 PolarHBondContact O-N 3.01Å; L44-L47 PolarHBondContact O-N 2.91Å; N45-L47 VanDerWaalsContact C-N 3.33Å; N45-L47 PolarHBondContact O-N 3.43Å; L47-G50 PolarHBondContact O-N 3.47Å; L47-L57 HydrophobicContact CD1-CD1 4.37Å; L47-L57 HydrophobicContact CD1-CD2 4.02Å
48K75.9Confident73.2Confident189 Ų18986.4 Ų86.482%0.82251%0.506SS*.Hα-helixtrans-69.7-32.7179.6-168171.1-177.7-1770112.7L44 N45L44-K48 WeakPolarHBondContact O-CB 3.41Å; L44-K48 PolarHBondContact O-N 3.23Å; N45-K48 PolarHBondContact O-N 3.14Å
49S78.1Confident74.1Confident66 Ų6687.8 Ų87.846%0.46251%0.513SS..Hα-helixtrans-80.6-14177.260.40000113.7N45 N46 T51N45-S49 WeakPolarHBondContact O-CB 3.23Å; N45-S49 PolarHBondContact O-N 3.37Å; N45-S49 PolarHBondContact O-OG 3.42Å; N46-S49 WeakPolarHBondContact CA-OG 3.43Å; N46-S49 PolarHBondContact O-OG 3.17Å; S49-T51 PolarHBondContact O-N 3.33Å; S49-T51 PolarHBondContact OG-OG1 3.47Å
50G69.4Low74.6Confident66 Ų6686.6 Ų86.668%0.6850%0.501SS*.THydrogen-bonded Turntrans65.116.6-178.200000114.2N46 L47N46-G50 PolarHBondContact O-N 3Å; L47-G50 PolarHBondContact O-N 3.47Å
51T67.2Low75.2Confident105 Ų10584.7 Ų84.764%0.64450%0.497SS*.  trans-93.74.4-174.353.40000113.9S49S49-T51 PolarHBondContact O-N 3.33Å; S49-T51 PolarHBondContact OG-OG1 3.47Å
52G67.4Low75.9Confident33 Ų3386.9 Ų86.934%0.3450%0.503SS..  trans-91.3134.3-176.400000113.7
53S78.1Confident76.5Confident70 Ų7085.4 Ų85.449%0.4950%0.495SS..  trans-61.9138.1167.1174.70000110.6S55 V56 L57S53-S55 PolarHBondContact O-N 3.47Å; S53-S55 VanDerWaalsContact O-N 3.07Å; S53-S55 PolarHBondContact OG-N 3.14Å; S53-S55 PolarHBondContact OG-OG 3.4Å; S53-V56 WeakPolarHBondContact O-CB 3.37Å; S53-V56 PolarHBondContact O-N 2.86Å; S53-L57 PolarHBondContact O-N 2.88Å
54L78.5Confident77.3Confident147 Ų14786.4 Ų86.477%0.7751%0.506SS*.Hα-helixtrans-49.9-35.5175.8-78170000112.5V56 L57 L58L54-V56 VanDerWaalsContact C-N 3.32Å; L54-V56 PolarHBondContact O-N 3.17Å; L54-L57 PolarHBondContact O-N 3.22Å; L54-L58 PolarHBondContact O-N 3.47Å; L54-L58 VanDerWaalsContact O-N 3.08Å
55S81Confident77.9Confident72 Ų7285.8 Ų85.850%0.50351%0.506SS..Hα-helixtrans-60.9-37.5176.557.60000113.2S53 L58 V59S53-S55 PolarHBondContact O-N 3.47Å; S53-S55 VanDerWaalsContact O-N 3.07Å; S53-S55 PolarHBondContact OG-N 3.14Å; S53-S55 PolarHBondContact OG-OG 3.4Å; S55-L58 PolarHBondContact O-N 3.32Å; S55-V59 WeakPolarHBondContact O-CG2 3.28Å; S55-V59 PolarHBondContact O-N 2.95Å; S55-V59 VanDerWaalsContact O-N 3.12Å
56V77.9Confident78.4Confident69 Ų6988.2 Ų88.242%0.41851%0.508SS..Hα-helixtrans-71-40.8178.9176.50000110.6S53 L54 L58 V59 N60S53-V56 WeakPolarHBondContact O-CB 3.37Å; S53-V56 PolarHBondContact O-N 2.86Å; L54-V56 VanDerWaalsContact C-N 3.32Å; L54-V56 PolarHBondContact O-N 3.17Å; V56-L58 VanDerWaalsContact C-N 3.32Å; V56-L58 PolarHBondContact O-N 3Å; V56-V59 PolarHBondContact O-N 3.02Å; V56-N60 WeakPolarHBondContact CG1-ND2 3.44Å; V56-N60 WeakPolarHBondContact O-CB 3.36Å; V56-N60 PolarHBondContact O-N 3.06Å; V56-N60 PolarHBondContact O-ND2 3.05Å
57L79.9Confident79.3Confident68 Ų6890.4 Ų90.436%0.35651%0.514SS..Hα-helixtrans-61.1-41.9175.7-64179.3000111.5L47 S53 L54 N60 L61L47-L57 HydrophobicContact CD1-CD1 4.37Å; L47-L57 HydrophobicContact CD1-CD2 4.02Å; S53-L57 PolarHBondContact O-N 2.88Å; L54-L57 PolarHBondContact O-N 3.22Å; L57-N60 PolarHBondContact O-N 3.44Å; L57-L61 WeakPolarHBondContact O-CB 3.4Å; L57-L61 PolarHBondContact O-N 3.42Å
58L84.6Confident80.1Confident102 Ų10287.1 Ų87.153%0.53450%0.503SS..Hα-helixtrans-66-46.9179-17563.9000112.3L54 S55 V56 N60 L61 L62L54-L58 PolarHBondContact O-N 3.47Å; L54-L58 VanDerWaalsContact O-N 3.08Å; S55-L58 PolarHBondContact O-N 3.32Å; V56-L58 VanDerWaalsContact C-N 3.32Å; V56-L58 PolarHBondContact O-N 3Å; L58-N60 VanDerWaalsContact C-N 3.3Å; L58-N60 PolarHBondContact O-N 3.28Å; L58-L61 PolarHBondContact O-N 3.11Å; L58-L62 HydrophobicContact CD1-CD1 4.46Å; L58-L62 HydrophobicContact CD1-CG 4.49Å; L58-L62 HydrophobicContact CG-CD1 4.18Å; L58-L62 WeakPolarHBondContact O-CB 3.49Å; L58-L62 WeakPolarHBondContact O-CG 3.27Å; L58-L62 PolarHBondContact O-N 3.39Å
59V83.2Confident80.6Confident94 Ų9483.7 Ų83.757%0.5749%0.49SS*.Hα-helixtrans-60.6-41.6177.21720000110.9S55 V56 C63S55-V59 WeakPolarHBondContact O-CG2 3.28Å; S55-V59 PolarHBondContact O-N 2.95Å; S55-V59 VanDerWaalsContact O-N 3.12Å; V56-V59 PolarHBondContact O-N 3.02Å; V59-C63 VanDerWaalsContact O-CB 3.23Å; V59-C63 WeakPolarHBondContact O-CB 3.4Å; V59-C63 PolarHBondContact O-N 3.48Å
60N79.4Confident81Confident42 Ų4285.1 Ų85.123%0.22549%0.49CS..Hα-helixtrans-68-40.6178.2-69.2-26.6000112.4L43 V56 L57 L58 C63 S64L43-N60 HydrophobicContact CD1-CB 4.48Å; L43-N60 VanDerWaalsContact CD2-ND2 3.28Å; L43-N60 WeakPolarHBondContact CD2-ND2 3.39Å; V56-N60 WeakPolarHBondContact CG1-ND2 3.44Å; V56-N60 WeakPolarHBondContact O-CB 3.36Å; V56-N60 PolarHBondContact O-N 3.06Å; V56-N60 PolarHBondContact O-ND2 3.05Å; L57-N60 PolarHBondContact O-N 3.44Å; L58-N60 VanDerWaalsContact C-N 3.3Å; L58-N60 PolarHBondContact O-N 3.28Å; N60-C63 PolarHBondContact O-N 3.08Å; N60-S64 WeakPolarHBondContact O-CB 3.14Å; N60-S64 PolarHBondContact O-N 3.13Å; N60-S64 PolarHBondContact O-OG 2.74Å
61L85.5Confident82Confident105 Ų10586.6 Ų86.655%0.5548%0.481SS..Hα-helixtrans-60.3-51.3175.3-178.966.3000110.3L57 L58 C63 S64 V65L57-L61 WeakPolarHBondContact O-CB 3.4Å; L57-L61 PolarHBondContact O-N 3.42Å; L58-L61 PolarHBondContact O-N 3.11Å; L61-C63 VanDerWaalsContact C-N 3.32Å; L61-C63 PolarHBondContact O-N 3.42Å; L61-S64 PolarHBondContact O-N 2.85Å; L61-S64 PolarHBondContact O-OG 2.88Å; L61-V65 WeakPolarHBondContact O-CG2 3.43Å; L61-V65 PolarHBondContact O-N 2.78Å; L61-V65 VanDerWaalsContact O-N 3.1Å
62L87.6Confident83Confident111 Ų11186.3 Ų86.358%0.58147%0.474SS*.Hα-helixtrans-58.7-44.1177.5-70.7172.5000111.8L58 S64 V65 Y66L58-L62 HydrophobicContact CD1-CD1 4.46Å; L58-L62 HydrophobicContact CD1-CG 4.49Å; L58-L62 HydrophobicContact CG-CD1 4.18Å; L58-L62 WeakPolarHBondContact O-CB 3.49Å; L58-L62 WeakPolarHBondContact O-CG 3.27Å; L58-L62 PolarHBondContact O-N 3.39Å; L62-S64 PolarHBondContact O-N 3.42Å; L62-V65 PolarHBondContact O-N 3.03Å; L62-Y66 PolarHBondContact O-N 2.87Å
63C83.4Confident84.1Confident34 Ų3487.3 Ų87.323%0.2348%0.479CS..Hα-helixtrans-63.4-39.9177.2-172.90000112.5F37 V59 N60 L61 V65 Y66 F67F37-C63 WeakPolarHBondContact CE1-SG 3.36Å; V59-C63 VanDerWaalsContact O-CB 3.23Å; V59-C63 WeakPolarHBondContact O-CB 3.4Å; V59-C63 PolarHBondContact O-N 3.48Å; N60-C63 PolarHBondContact O-N 3.08Å; L61-C63 VanDerWaalsContact C-N 3.32Å; L61-C63 PolarHBondContact O-N 3.42Å; C63-V65 VanDerWaalsContact C-N 3.31Å; C63-V65 PolarHBondContact O-N 3.27Å; C63-Y66 PolarHBondContact O-N 3.35Å; C63-F67 VanDerWaalsContact O-CB 3.27Å; C63-F67 WeakPolarHBondContact O-CB 3.35Å; C63-F67 PolarHBondContact O-N 3.33Å
64S83Confident84.6Confident67 Ų6785.5 Ų85.547%0.46947%0.472SS..Hα-helixtrans-64.9-36.1178.671.90000112.2N60 L61 L62 A68N60-S64 WeakPolarHBondContact O-CB 3.14Å; N60-S64 PolarHBondContact O-N 3.13Å; N60-S64 PolarHBondContact O-OG 2.74Å; L61-S64 PolarHBondContact O-N 2.85Å; L61-S64 PolarHBondContact O-OG 2.88Å; L62-S64 PolarHBondContact O-N 3.42Å; S64-A68 WeakPolarHBondContact O-CB 3.43Å; S64-A68 PolarHBondContact O-N 3.46Å
65V85.6Confident85.2Confident74 Ų7480.6 Ų80.645%0.44845%0.453SS..Hα-helixtrans-68.6-49.3175175.90000110.5L61 L62 C63 F67 A68 E69L61-V65 WeakPolarHBondContact O-CG2 3.43Å; L61-V65 PolarHBondContact O-N 2.78Å; L61-V65 VanDerWaalsContact O-N 3.1Å; L62-V65 PolarHBondContact O-N 3.03Å; C63-V65 VanDerWaalsContact C-N 3.31Å; C63-V65 PolarHBondContact O-N 3.27Å; V65-F67 VanDerWaalsContact C-N 3.33Å; V65-F67 PolarHBondContact O-N 3Å; V65-A68 WeakPolarHBondContact O-CB 3.25Å; V65-A68 PolarHBondContact O-N 3.49Å; V65-A68 VanDerWaalsContact O-N 3.11Å; V65-E69 PolarHBondContact O-N 2.91Å
66Y83.4Confident85.8Confident158 Ų15880.9 Ų80.962%0.6245%0.449SS*.Hα-helixtrans-61.3-41.3178.7-173.4-96.3000112.4L62 C63 A68 E69 E70L62-Y66 PolarHBondContact O-N 2.87Å; C63-Y66 PolarHBondContact O-N 3.35Å; Y66-A68 VanDerWaalsContact C-N 3.32Å; Y66-A68 PolarHBondContact O-N 3.27Å; Y66-E69 PolarHBondContact O-N 3.43Å; Y66-E70 PolarHBondContact O-N 3.02Å; Y66-E70 VanDerWaalsContact O-N 3.13Å
67F87.8Confident86.5Confident115 Ų11583.5 Ų83.550%0.50445%0.454SS..Hα-helixtrans-65.8-36175.6-171.6-109.5000112.1C63 V65 E70 I71C63-F67 VanDerWaalsContact O-CB 3.27Å; C63-F67 WeakPolarHBondContact O-CB 3.35Å; C63-F67 PolarHBondContact O-N 3.33Å; V65-F67 VanDerWaalsContact C-N 3.33Å; V65-F67 PolarHBondContact O-N 3Å; F67-E70 PolarHBondContact O-N 3.4Å; F67-I71 HydrophobicContact CD1-CD1 3.56Å; F67-I71 HydrophobicContact CD1-CG1 4.35Å; F67-I71 HydrophobicContact CE1-CD1 3.31Å; F67-I71 HydrophobicContact CE1-CG1 4.1Å; F67-I71 HydrophobicContact CG-CD1 4.43Å; F67-I71 HydrophobicContact CZ-CD1 3.98Å; F67-I71 HydrophobicContact CZ-CG1 4.32Å; F67-I71 WeakPolarHBondContact O-CG1 3Å; F67-I71 PolarHBondContact O-N 2.9Å
68A85.3Confident87Confident43 Ų4384.5 Ų84.536%0.35546%0.459SS..Hα-helixtrans-63.7-40.8173.700000111.9S64 V65 Y66 I71 I72S64-A68 WeakPolarHBondContact O-CB 3.43Å; S64-A68 PolarHBondContact O-N 3.46Å; V65-A68 WeakPolarHBondContact O-CB 3.25Å; V65-A68 PolarHBondContact O-N 3.49Å; V65-A68 VanDerWaalsContact O-N 3.11Å; Y66-A68 VanDerWaalsContact C-N 3.32Å; Y66-A68 PolarHBondContact O-N 3.27Å; A68-I71 PolarHBondContact O-N 3.23Å; A68-I72 WeakPolarHBondContact O-CD1 3.35Å; A68-I72 VanDerWaalsContact O-CG1 3.23Å; A68-I72 WeakPolarHBondContact O-CG1 3.39Å; A68-I72 PolarHBondContact O-N 3.35Å
69E86Confident87.3Confident117 Ų11783.7 Ų83.755%0.54746%0.455SS..Hα-helixtrans-60.3-44.5175.1-70.4177.7175.800112.1V65 Y66 I72 A73V65-E69 PolarHBondContact O-N 2.91Å; Y66-E69 PolarHBondContact O-N 3.43Å; E69-I72 PolarHBondContact O-N 2.97Å; E69-A73 WeakPolarHBondContact O-CB 3.23Å; E69-A73 PolarHBondContact O-N 3.2Å
70E86.9Confident87.7Confident96 Ų9685.2 Ų85.245%0.44945%0.454SS..Hα-helixtrans-63.6-41.4177.4-173.264.6-157.700112Y66 F67 I72 A73 G74Y66-E70 PolarHBondContact O-N 3.02Å; Y66-E70 VanDerWaalsContact O-N 3.13Å; F67-E70 PolarHBondContact O-N 3.4Å; E70-I72 VanDerWaalsContact C-N 3.35Å; E70-I72 PolarHBondContact O-N 3.32Å; E70-A73 PolarHBondContact O-N 2.89Å; E70-G74 PolarHBondContact O-N 2.92Å
71I90.3Very high88.2Confident96 Ų9686.5 Ų86.549%0.49246%0.46SS..Hα-helixtrans-60.7-45.8174.8-70.5166.6000110.6F67 A68 G74 A75F67-I71 HydrophobicContact CD1-CD1 3.56Å; F67-I71 HydrophobicContact CD1-CG1 4.35Å; F67-I71 HydrophobicContact CE1-CD1 3.31Å; F67-I71 HydrophobicContact CE1-CG1 4.1Å; F67-I71 HydrophobicContact CG-CD1 4.43Å; F67-I71 HydrophobicContact CZ-CD1 3.98Å; F67-I71 HydrophobicContact CZ-CG1 4.32Å; F67-I71 WeakPolarHBondContact O-CG1 3Å; F67-I71 PolarHBondContact O-N 2.9Å; A68-I71 PolarHBondContact O-N 3.23Å; I71-G74 PolarHBondContact O-N 2.74Å; I71-A75 WeakPolarHBondContact O-CB 3.42Å; I71-A75 PolarHBondContact O-N 3Å
72I89.5Confident88.5Confident99 Ų9985.9 Ų85.951%0.50846%0.461SS..Hα-helixtrans-65-43.2-179.8-67.2163.4000110.4A68 E69 E70 A75 N76A68-I72 WeakPolarHBondContact O-CD1 3.35Å; A68-I72 VanDerWaalsContact O-CG1 3.23Å; A68-I72 WeakPolarHBondContact O-CG1 3.39Å; A68-I72 PolarHBondContact O-N 3.35Å; E69-I72 PolarHBondContact O-N 2.97Å; E70-I72 VanDerWaalsContact C-N 3.35Å; E70-I72 PolarHBondContact O-N 3.32Å; I72-A75 PolarHBondContact O-N 3.02Å; I72-N76 WeakPolarHBondContact O-CB 3.49Å; I72-N76 PolarHBondContact O-N 3.42Å; I72-N76 PolarHBondContact O-ND2 3.01Å
73A89.7Confident88.7Confident54 Ų5485.7 Ų85.745%0.44646%0.458SS..Hα-helixtrans-62.4-46.2177.200000111.8E69 E70 N76 K77E69-A73 WeakPolarHBondContact O-CB 3.23Å; E69-A73 PolarHBondContact O-N 3.2Å; E70-A73 PolarHBondContact O-N 2.89Å; A73-N76 PolarHBondContact O-N 2.88Å; A73-K77 WeakPolarHBondContact O-CB 3.35Å; A73-K77 PolarHBondContact O-N 3.31Å
74G88.9Confident89Confident32 Ų3288.3 Ų88.333%0.3347%0.469SS..Hα-helixtrans-60.9-45.2175.600000112.7E70 I71 K77 L78E70-G74 PolarHBondContact O-N 2.92Å; I71-G74 PolarHBondContact O-N 2.74Å; G74-K77 PolarHBondContact O-N 2.82Å; G74-L78 WeakPolarHBondContact O-CG 3.23Å; G74-L78 PolarHBondContact O-N 2.67Å
75A90.9Very high89.4Confident45 Ų4589.9 Ų89.937%0.37248%0.476SS..Hα-helixtrans-62.2-46.9176.500000111.9I71 I72 K77 L78 I79I71-A75 WeakPolarHBondContact O-CB 3.42Å; I71-A75 PolarHBondContact O-N 3Å; I72-A75 PolarHBondContact O-N 3.02Å; A75-K77 VanDerWaalsContact C-N 3.28Å; A75-K77 PolarHBondContact O-N 3.47Å; A75-L78 PolarHBondContact O-N 2.9Å; A75-I79 VanDerWaalsContact O-CG1 3.26Å; A75-I79 WeakPolarHBondContact O-CG1 3.41Å; A75-I79 PolarHBondContact O-N 2.93Å
76N92.7Very high89.7Confident78 Ų7888.9 Ų88.942%0.41748%0.475SS..Hα-helixtrans-60.7-37.6177.1-74.4-25.2000112.2I72 A73 K80I72-N76 WeakPolarHBondContact O-CB 3.49Å; I72-N76 PolarHBondContact O-N 3.42Å; I72-N76 PolarHBondContact O-ND2 3.01Å; A73-N76 PolarHBondContact O-N 2.88Å; N76-K80 WeakPolarHBondContact O-CB 3.41Å; N76-K80 VanDerWaalsContact O-CG 3.23Å; N76-K80 WeakPolarHBondContact O-CG 3.39Å; N76-K80 PolarHBondContact O-N 3.43Å
77K92.8Very high90Very high124 Ų12486.5 Ų86.554%0.53947%0.473SS..Hα-helixtrans-64.4-47.8174.8-177.8179.7-179.9-61.50111.3A73 G74 A75 I79 K80 D81A73-K77 WeakPolarHBondContact O-CB 3.35Å; A73-K77 PolarHBondContact O-N 3.31Å; G74-K77 PolarHBondContact O-N 2.82Å; A75-K77 VanDerWaalsContact C-N 3.28Å; A75-K77 PolarHBondContact O-N 3.47Å; K77-I79 VanDerWaalsContact C-N 3.33Å; K77-I79 PolarHBondContact O-N 2.8Å; K77-K80 PolarHBondContact O-N 3.47Å; K77-D81 IonicContact NZ-OD2 2.74Å; K77-D81 PolarHBondContact NZ-OD2 3.45Å; K77-D81 WeakPolarHBondContact O-CB 3.32Å; K77-D81 PolarHBondContact O-N 3.25Å
78L90.6Very high90.3Very high88 Ų8886.3 Ų86.346%0.46148%0.477SS..Hα-helixtrans-63.2-39.1178.4-68.2175.6000112.2G74 A75 T82G74-L78 WeakPolarHBondContact O-CG 3.23Å; G74-L78 PolarHBondContact O-N 2.67Å; A75-L78 PolarHBondContact O-N 2.9Å; L78-T82 VanDerWaalsContact O-CB 3.27Å; L78-T82 WeakPolarHBondContact O-CB 3.26Å; L78-T82 PolarHBondContact O-N 2.84Å; L78-T82 PolarHBondContact O-OG1 2.89Å
79I91.8Very high90.7Very high86 Ų8687.5 Ų87.544%0.44148%0.483SS..Hα-helixtrans-61.4-50.8175.4-69.3164000109.8A75 K77 D81 T82 E83A75-I79 VanDerWaalsContact O-CG1 3.26Å; A75-I79 WeakPolarHBondContact O-CG1 3.41Å; A75-I79 PolarHBondContact O-N 2.93Å; K77-I79 VanDerWaalsContact C-N 3.33Å; K77-I79 PolarHBondContact O-N 2.8Å; I79-D81 PolarHBondContact O-N 3.46Å; I79-T82 PolarHBondContact O-N 2.81Å; I79-E83 HydrophobicContact CG2-CG 4.31Å; I79-E83 VanDerWaalsContact CG2-OE1 3.32Å; I79-E83 WeakPolarHBondContact CG2-OE1 3.25Å; I79-E83 WeakPolarHBondContact O-CB 3.32Å; I79-E83 VanDerWaalsContact O-CG 3.29Å; I79-E83 WeakPolarHBondContact O-CG 3.29Å; I79-E83 PolarHBondContact O-N 3.35Å
80K90.1Very high91Very high126 Ų12688.1 Ų88.155%0.54848%0.484SS..Hα-helixtrans-61.6-44.4178.6-73.1174.1-176.7-1770112.8N76 K77 T82 E83 N84N76-K80 WeakPolarHBondContact O-CB 3.41Å; N76-K80 VanDerWaalsContact O-CG 3.23Å; N76-K80 WeakPolarHBondContact O-CG 3.39Å; N76-K80 PolarHBondContact O-N 3.43Å; K77-K80 PolarHBondContact O-N 3.47Å; K80-T82 VanDerWaalsContact C-N 3.33Å; K80-E83 PolarHBondContact O-N 2.89Å; K80-N84 VanDerWaalsContact O-CB 3.32Å; K80-N84 WeakPolarHBondContact O-CB 3.27Å; K80-N84 PolarHBondContact O-N 3.43Å; K80-N84 PolarHBondContact O-ND2 3.05Å
81D91.2Very high91.3Very high68 Ų6886.7 Ų86.736%0.36448%0.484SS..Hα-helixtrans-61.9-44.2177.6-68.8-15.5000109.8K77 I79 N84 T85K77-D81 IonicContact NZ-OD2 2.74Å; K77-D81 PolarHBondContact NZ-OD2 3.45Å; K77-D81 WeakPolarHBondContact O-CB 3.32Å; K77-D81 PolarHBondContact O-N 3.25Å; I79-D81 PolarHBondContact O-N 3.46Å; D81-N84 PolarHBondContact O-N 2.91Å; D81-T85 WeakPolarHBondContact O-CB 3.28Å; D81-T85 PolarHBondContact O-N 2.8Å; D81-T85 PolarHBondContact O-OG1 2.93Å; D81-T85 VanDerWaalsContact O-OG1 3.06Å
82T91.6Very high91.4Very high93 Ų9386.4 Ų86.457%0.57148%0.483SS*.Hα-helixtrans-63.8-45.1177-54.50000112.3L78 I79 K80 T85 A86L78-T82 VanDerWaalsContact O-CB 3.27Å; L78-T82 WeakPolarHBondContact O-CB 3.26Å; L78-T82 PolarHBondContact O-N 2.84Å; L78-T82 PolarHBondContact O-OG1 2.89Å; I79-T82 PolarHBondContact O-N 2.81Å; K80-T82 VanDerWaalsContact C-N 3.33Å; T82-T85 PolarHBondContact O-N 2.91Å; T82-A86 VanDerWaalsContact O-CB 3.28Å; T82-A86 WeakPolarHBondContact O-CB 3.21Å; T82-A86 PolarHBondContact O-N 3.06Å
83E90.7Very high91.5Very high107 Ų10787.1 Ų87.150%0.549%0.485SS..Hα-helixtrans-61.5-47.9176.7-75.7172.5176.500111.1I79 K80 T85 A86 L87I79-E83 HydrophobicContact CG2-CG 4.31Å; I79-E83 VanDerWaalsContact CG2-OE1 3.32Å; I79-E83 WeakPolarHBondContact CG2-OE1 3.25Å; I79-E83 WeakPolarHBondContact O-CB 3.32Å; I79-E83 VanDerWaalsContact O-CG 3.29Å; I79-E83 WeakPolarHBondContact O-CG 3.29Å; I79-E83 PolarHBondContact O-N 3.35Å; K80-E83 PolarHBondContact O-N 2.89Å; E83-T85 PolarHBondContact O-N 2.93Å; E83-A86 PolarHBondContact O-N 2.86Å; E83-L87 VanDerWaalsContact O-CB 3.25Å; E83-L87 WeakPolarHBondContact O-CB 3.42Å; E83-L87 WeakPolarHBondContact O-CG 3.16Å; E83-L87 PolarHBondContact O-N 3.04Å
84N90.6Very high91.7Very high89 Ų8989.2 Ų89.248%0.47649%0.485SS..Hα-helixtrans-62.3-43.9178-72.2-36.4000111.4K80 D81 N88K80-N84 VanDerWaalsContact O-CB 3.32Å; K80-N84 WeakPolarHBondContact O-CB 3.27Å; K80-N84 PolarHBondContact O-N 3.43Å; K80-N84 PolarHBondContact O-ND2 3.05Å; D81-N84 PolarHBondContact O-N 2.91Å; N84-N88 WeakPolarHBondContact O-CB 3.17Å; N84-N88 PolarHBondContact O-N 3.49Å; N84-N88 PolarHBondContact O-ND2 3.33Å
85T91.9Very high91.8Very high100 Ų10092.6 Ų92.661%0.61349%0.492SS*.Hα-helixtrans-63.4-45.8176.7-64.20000111.7D81 T82 E83 S89D81-T85 WeakPolarHBondContact O-CB 3.28Å; D81-T85 PolarHBondContact O-N 2.8Å; D81-T85 PolarHBondContact O-OG1 2.93Å; D81-T85 VanDerWaalsContact O-OG1 3.06Å; T82-T85 PolarHBondContact O-N 2.91Å; E83-T85 PolarHBondContact O-N 2.93Å; T85-S89 WeakPolarHBondContact O-CB 3.37Å; T85-S89 PolarHBondContact O-N 2.92Å; T85-S89 PolarHBondContact O-OG 3.27Å; T85-S89 VanDerWaalsContact O-OG 3.1Å
86A90.7Very high92Very high52 Ų5295.4 Ų95.443%0.4350%0.496SS..Hα-helixtrans-68.1-40.3-18000000112.7T82 E83 S89 F90T82-A86 VanDerWaalsContact O-CB 3.28Å; T82-A86 WeakPolarHBondContact O-CB 3.21Å; T82-A86 PolarHBondContact O-N 3.06Å; E83-A86 PolarHBondContact O-N 2.86Å; A86-S89 PolarHBondContact O-OG 2.88Å; A86-F90 WeakPolarHBondContact O-CB 3.16Å; A86-F90 PolarHBondContact O-N 3.1Å
87L90.7Very high91.9Very high109 Ų10997.6 Ų97.657%0.57150%0.502SS*.Hα-helixtrans-69.7-39.2176.9-70.4177.5000111.7E83 S91E83-L87 VanDerWaalsContact O-CB 3.25Å; E83-L87 WeakPolarHBondContact O-CB 3.42Å; E83-L87 WeakPolarHBondContact O-CG 3.16Å; E83-L87 PolarHBondContact O-N 3.04Å; L87-S91 WeakPolarHBondContact O-CB 3.23Å; L87-S91 PolarHBondContact O-N 3.48Å
88N93.1Very high91.9Very high111 Ų11196 Ų9659%0.59450%0.499SS*.Hα-helixtrans-68.3-42.8176.5-71.6-24.6000111.5N84 S91 L92N84-N88 WeakPolarHBondContact O-CB 3.17Å; N84-N88 PolarHBondContact O-N 3.49Å; N84-N88 PolarHBondContact O-ND2 3.33Å; N88-S91 PolarHBondContact O-N 2.76Å; N88-L92 WeakPolarHBondContact O-CB 3.17Å; N88-L92 PolarHBondContact O-N 2.81Å
89S93.2Very high91.9Very high68 Ų6896.8 Ų96.848%0.47650%0.5SS..Hα-helixtrans-65.8-41.8176.366.20000111.4T85 A86 L92 E93T85-S89 WeakPolarHBondContact O-CB 3.37Å; T85-S89 PolarHBondContact O-N 2.92Å; T85-S89 PolarHBondContact O-OG 3.27Å; T85-S89 VanDerWaalsContact O-OG 3.1Å; A86-S89 PolarHBondContact O-OG 2.88Å; S89-L92 PolarHBondContact O-N 3.28Å; S89-E93 VanDerWaalsContact O-CB 3.28Å; S89-E93 WeakPolarHBondContact O-CB 3.28Å; S89-E93 PolarHBondContact O-N 3.47Å
90F93.6Very high91.8Very high130 Ų13098 Ų9857%0.5750%0.504SS*.Hα-helixtrans-63.8-47.1174.5179.6-100000112.2A86 L92 E93 Q94A86-F90 WeakPolarHBondContact O-CB 3.16Å; A86-F90 PolarHBondContact O-N 3.1Å; F90-L92 VanDerWaalsContact C-N 3.31Å; F90-L92 PolarHBondContact O-N 2.88Å; F90-E93 PolarHBondContact O-N 2.9Å; F90-Q94 VanDerWaalsContact O-CB 3.23Å; F90-Q94 WeakPolarHBondContact O-CB 3.37Å; F90-Q94 PolarHBondContact O-N 3.28Å
91S91.9Very high91.7Very high65 Ų6597 Ų9746%0.45550%0.501SS..Hα-helixtrans-63.6-38.9178.6-174.80000111.6L87 N88 Q95L87-S91 WeakPolarHBondContact O-CB 3.23Å; L87-S91 PolarHBondContact O-N 3.48Å; N88-S91 PolarHBondContact O-N 2.76Å; S91-Q95 WeakPolarHBondContact O-CB 3.25Å; S91-Q95 PolarHBondContact O-N 2.95Å
92L94Very high91.4Very high90 Ų9096.5 Ų96.547%0.47150%0.503SS..Hα-helixtrans-65.4-45.8175179.964.9000110.9N88 S89 F90 Q95 K96N88-L92 WeakPolarHBondContact O-CB 3.17Å; N88-L92 PolarHBondContact O-N 2.81Å; S89-L92 PolarHBondContact O-N 3.28Å; F90-L92 VanDerWaalsContact C-N 3.31Å; F90-L92 PolarHBondContact O-N 2.88Å; L92-Q95 PolarHBondContact O-N 3.37Å; L92-K96 WeakPolarHBondContact O-CG 3.33Å; L92-K96 PolarHBondContact O-N 3.44Å
93E91Very high91.2Very high114 Ų11494.4 Ų94.453%0.53350%0.495SS..Hα-helixtrans-66.4-39.8178.8-164.959.1-152.400111.5S89 F90 Q95 K96 F97S89-E93 VanDerWaalsContact O-CB 3.28Å; S89-E93 WeakPolarHBondContact O-CB 3.28Å; S89-E93 PolarHBondContact O-N 3.47Å; F90-E93 PolarHBondContact O-N 2.9Å; E93-Q95 VanDerWaalsContact C-N 3.34Å; E93-Q95 PolarHBondContact O-N 2.91Å; E93-K96 PolarHBondContact O-N 3.48Å; E93-F97 WeakPolarHBondContact O-CB 3.38Å; E93-F97 PolarHBondContact O-N 3.37Å
94Q92.8Very high91Very high98 Ų9894.5 Ų94.546%0.45850%0.495SS..Hα-helixtrans-61.8-43173-174.3-178.30.800111F90 F97 I98F90-Q94 VanDerWaalsContact O-CB 3.23Å; F90-Q94 WeakPolarHBondContact O-CB 3.37Å; F90-Q94 PolarHBondContact O-N 3.28Å; Q94-F97 PolarHBondContact O-N 2.85Å; Q94-I98 HydrophobicContact CG-CD1 3.95Å; Q94-I98 VanDerWaalsContact O-CG1 3.25Å; Q94-I98 WeakPolarHBondContact O-CG1 3.46Å; Q94-I98 PolarHBondContact O-N 2.85Å
95Q92.8Very high90.9Very high103 Ų10395.8 Ų95.848%0.48150%0.499SS..Hα-helixtrans-63.4-44.7176.5-178.4179-14.700111.5S91 L92 E93 F97 I98 Q99S91-Q95 WeakPolarHBondContact O-CB 3.25Å; S91-Q95 PolarHBondContact O-N 2.95Å; L92-Q95 PolarHBondContact O-N 3.37Å; E93-Q95 VanDerWaalsContact C-N 3.34Å; E93-Q95 PolarHBondContact O-N 2.91Å; Q95-F97 VanDerWaalsContact C-N 3.34Å; Q95-F97 PolarHBondContact O-N 3.32Å; Q95-I98 PolarHBondContact O-N 2.83Å; Q95-Q99 WeakPolarHBondContact O-CB 3.37Å; Q95-Q99 VanDerWaalsContact O-CG 3.28Å; Q95-Q99 WeakPolarHBondContact O-CG 3.28Å; Q95-Q99 PolarHBondContact O-N 2.77Å
96K93.6Very high90.6Very high105 Ų10593.3 Ų93.346%0.45748%0.481SS..Hα-helixtrans-59.4-45.5175-74175.8-179.3178.70111.3L92 E93 Q99 Q100L92-K96 WeakPolarHBondContact O-CG 3.33Å; L92-K96 PolarHBondContact O-N 3.44Å; E93-K96 PolarHBondContact O-N 3.48Å; K96-Q99 PolarHBondContact O-N 3.06Å; K96-Q100 WeakPolarHBondContact O-CB 3.47Å; K96-Q100 PolarHBondContact O-N 3.49Å
97F92.3Very high90.3Very high124 Ų12494.5 Ų94.554%0.54448%0.483SS..Hα-helixtrans-62.1-44.4178.3-175-97.2000112.1E93 Q94 Q95 Q99 Q100 Q101E93-F97 WeakPolarHBondContact O-CB 3.38Å; E93-F97 PolarHBondContact O-N 3.37Å; Q94-F97 PolarHBondContact O-N 2.85Å; Q95-F97 VanDerWaalsContact C-N 3.34Å; Q95-F97 PolarHBondContact O-N 3.32Å; F97-Q99 VanDerWaalsContact C-N 3.35Å; F97-Q99 PolarHBondContact O-N 2.91Å; F97-Q100 PolarHBondContact O-N 2.84Å; F97-Q101 VanDerWaalsContact O-CB 3.3Å; F97-Q101 WeakPolarHBondContact O-CB 3.3Å; F97-Q101 PolarHBondContact O-N 3.4Å
98I91.2Very high90.1Very high90 Ų9093.6 Ų93.646%0.46249%0.491SS..Hα-helixtrans-62.3-43.3176.3-69.7165.3000110.9Q94 Q95 Q101 S102Q94-I98 HydrophobicContact CG-CD1 3.95Å; Q94-I98 VanDerWaalsContact O-CG1 3.25Å; Q94-I98 WeakPolarHBondContact O-CG1 3.46Å; Q94-I98 PolarHBondContact O-N 2.85Å; Q95-I98 PolarHBondContact O-N 2.83Å; I98-Q101 PolarHBondContact O-N 3.06Å; I98-S102 WeakPolarHBondContact O-CB 3.47Å; I98-S102 PolarHBondContact O-N 3.48Å; I98-S102 PolarHBondContact O-OG 3.34Å
99Q90.2Very high89.8Confident105 Ų10593.5 Ų93.549%0.49149%0.487SS..Hα-helixtrans-62.7-46.4177-73.6175.60.300111.3Q95 K96 F97 S102 A103Q95-Q99 WeakPolarHBondContact O-CB 3.37Å; Q95-Q99 VanDerWaalsContact O-CG 3.28Å; Q95-Q99 WeakPolarHBondContact O-CG 3.28Å; Q95-Q99 PolarHBondContact O-N 2.77Å; K96-Q99 PolarHBondContact O-N 3.06Å; F97-Q99 VanDerWaalsContact C-N 3.35Å; F97-Q99 PolarHBondContact O-N 2.91Å; Q99-S102 PolarHBondContact O-N 2.81Å; Q99-S102 PolarHBondContact O-OG 3.49Å; Q99-A103 WeakPolarHBondContact O-CB 3.27Å; Q99-A103 PolarHBondContact O-N 3.25Å
100Q90.4Very high89.6Confident112 Ų11291.4 Ų91.452%0.52347%0.472SS..Hα-helixtrans-61.5-48.5176.8178.7170.6-4.300111.3K96 F97 S102 A103 E104K96-Q100 WeakPolarHBondContact O-CB 3.47Å; K96-Q100 PolarHBondContact O-N 3.49Å; F97-Q100 PolarHBondContact O-N 2.84Å; Q100-S102 VanDerWaalsContact C-N 3.28Å; Q100-S102 PolarHBondContact O-N 3.35Å; Q100-A103 PolarHBondContact O-N 3.42Å; Q100-A103 VanDerWaalsContact O-N 3.13Å; Q100-E104 HydrophobicContact CG-CG 4.21Å; Q100-E104 VanDerWaalsContact CG-OE1 3.25Å; Q100-E104 WeakPolarHBondContact CG-OE1 3.36Å; Q100-E104 PolarHBondContact NE2-OE1 3.3Å; Q100-E104 WeakPolarHBondContact O-CB 3.34Å; Q100-E104 WeakPolarHBondContact O-CG 3.5Å; Q100-E104 PolarHBondContact O-N 3.34Å
101Q88.3Confident89.6Confident105 Ų10588.4 Ų88.449%0.49146%0.464SS..Hα-helixtrans-59.2-40.9177.3-172.1179.928.900111.5F97 I98 Q105F97-Q101 VanDerWaalsContact O-CB 3.3Å; F97-Q101 WeakPolarHBondContact O-CB 3.3Å; F97-Q101 PolarHBondContact O-N 3.4Å; I98-Q101 PolarHBondContact O-N 3.06Å; Q101-Q105 VanDerWaalsContact O-CB 3.26Å; Q101-Q105 WeakPolarHBondContact O-CB 3.25Å; Q101-Q105 PolarHBondContact O-N 3.07Å
102S85.7Confident89.7Confident57 Ų5787 Ų8740%0.39945%0.453SS..Hα-helixtrans-65.5-40.1176.475.60000112.4I98 Q99 Q100 Q105 I106I98-S102 WeakPolarHBondContact O-CB 3.47Å; I98-S102 PolarHBondContact O-N 3.48Å; I98-S102 PolarHBondContact O-OG 3.34Å; Q99-S102 PolarHBondContact O-N 2.81Å; Q99-S102 PolarHBondContact O-OG 3.49Å; Q100-S102 VanDerWaalsContact C-N 3.28Å; Q100-S102 PolarHBondContact O-N 3.35Å; S102-Q105 PolarHBondContact O-N 3.13Å; S102-I106 WeakPolarHBondContact O-CD1 3.26Å; S102-I106 VanDerWaalsContact O-CG1 3.27Å; S102-I106 WeakPolarHBondContact O-CG1 3.49Å; S102-I106 PolarHBondContact O-N 3.34Å
103A86.1Confident89.7Confident48 Ų4882.8 Ų82.840%0.39743%0.432SS..Hα-helixtrans-68.7-45.6177.200000111.2Q99 Q100 Q105 I106 V107Q99-A103 WeakPolarHBondContact O-CB 3.27Å; Q99-A103 PolarHBondContact O-N 3.25Å; Q100-A103 PolarHBondContact O-N 3.42Å; Q100-A103 VanDerWaalsContact O-N 3.13Å; A103-Q105 VanDerWaalsContact C-N 3.29Å; A103-Q105 PolarHBondContact O-N 2.92Å; A103-I106 PolarHBondContact O-N 2.77Å; A103-V107 WeakPolarHBondContact O-CB 3.44Å; A103-V107 VanDerWaalsContact O-CG2 3.28Å; A103-V107 WeakPolarHBondContact O-CG2 3.38Å; A103-V107 PolarHBondContact O-N 3.29Å
104E88Confident89.8Confident109 Ų10977.4 Ų77.451%0.50941%0.407SS..Hα-helixtrans-59.9-39.5174.5-75176.7-173.600111.5Q100 V107 A108Q100-E104 HydrophobicContact CG-CG 4.21Å; Q100-E104 VanDerWaalsContact CG-OE1 3.25Å; Q100-E104 WeakPolarHBondContact CG-OE1 3.36Å; Q100-E104 PolarHBondContact NE2-OE1 3.3Å; Q100-E104 WeakPolarHBondContact O-CB 3.34Å; Q100-E104 WeakPolarHBondContact O-CG 3.5Å; Q100-E104 PolarHBondContact O-N 3.34Å; E104-V107 PolarHBondContact O-N 3.27Å; E104-A108 VanDerWaalsContact O-CB 3.23Å; E104-A108 WeakPolarHBondContact O-CB 3.4Å; E104-A108 PolarHBondContact O-N 3.39Å
105Q87.3Confident89.8Confident117 Ų11775.6 Ų75.655%0.54740%0.402SS..Hα-helixtrans-64.9-41.4175.7-177.6174.3-12.200112Q101 S102 A103 A108 Q109Q101-Q105 VanDerWaalsContact O-CB 3.26Å; Q101-Q105 WeakPolarHBondContact O-CB 3.25Å; Q101-Q105 PolarHBondContact O-N 3.07Å; S102-Q105 PolarHBondContact O-N 3.13Å; A103-Q105 VanDerWaalsContact C-N 3.29Å; A103-Q105 PolarHBondContact O-N 2.92Å; Q105-A108 PolarHBondContact O-N 2.71Å; Q105-Q109 WeakPolarHBondContact O-CG 3.22Å; Q105-Q109 PolarHBondContact O-N 2.78Å; Q105-Q109 VanDerWaalsContact O-N 3.17Å
106I85.1Confident89.7Confident47 Ų4774.1 Ų74.124%0.24141%0.414CS..Hα-helixtrans-65.9-42.8175.8-67.9164.5000110.6S102 A103 Q109 S110 L155 P156 F159S102-I106 WeakPolarHBondContact O-CD1 3.26Å; S102-I106 VanDerWaalsContact O-CG1 3.27Å; S102-I106 WeakPolarHBondContact O-CG1 3.49Å; S102-I106 PolarHBondContact O-N 3.34Å; A103-I106 PolarHBondContact O-N 2.77Å; I106-Q109 CarbonylContact O-C 3.52Å; I106-Q109 PolarHBondContact O-N 3.21Å; I106-S110 PolarHBondContact O-N 2.87Å; I106-S110 VanDerWaalsContact O-N 3.14Å; I106-L155 HydrophobicContact CD1-CD1 4.37Å; I106-L155 HydrophobicContact CG2-CB 4.11Å; I106-P156 HydrophobicContact CG2-CG 4.19Å; I106-F159 HydrophobicContact CG2-CD2 3.5Å; I106-F159 HydrophobicContact CG2-CE2 3.57Å
107V84.8Confident89.6Confident77 Ų7770 Ų7047%0.46740%0.399SS..Hα-helixtrans-67.7-37177.8172.90000111.4A103 E104 Q109 S110 F159A103-V107 WeakPolarHBondContact O-CB 3.44Å; A103-V107 VanDerWaalsContact O-CG2 3.28Å; A103-V107 WeakPolarHBondContact O-CG2 3.38Å; A103-V107 PolarHBondContact O-N 3.29Å; E104-V107 PolarHBondContact O-N 3.27Å; V107-Q109 PolarHBondContact O-N 3.24Å; V107-S110 WeakPolarHBondContact O-CA 3.46Å; V107-S110 WeakPolarHBondContact O-CB 3.4Å; V107-S110 PolarHBondContact O-N 3.4Å; V107-F159 HydrophobicContact CG2-CD1 4.39Å; V107-F159 HydrophobicContact CG2-CG 4.49Å
108A86Confident89.3Confident90 Ų9072.1 Ų72.174%0.74441%0.408SS*.Hα-helixtrans-65-25.7173.500000112.4E104 Q105 S110E104-A108 VanDerWaalsContact O-CB 3.23Å; E104-A108 WeakPolarHBondContact O-CB 3.4Å; E104-A108 PolarHBondContact O-N 3.39Å; Q105-A108 PolarHBondContact O-N 2.71Å; A108-S110 VanDerWaalsContact C-N 3.33Å
109Q87.2Confident89.2Confident110 Ų11071.5 Ų71.551%0.51441%0.406SS..THydrogen-bonded Turntrans-93.511172-64.4-1792.500112.6Q105 I106 V107 V111 P156Q105-Q109 WeakPolarHBondContact O-CG 3.22Å; Q105-Q109 PolarHBondContact O-N 2.78Å; Q105-Q109 VanDerWaalsContact O-N 3.17Å; I106-Q109 CarbonylContact O-C 3.52Å; I106-Q109 PolarHBondContact O-N 3.21Å; V107-Q109 PolarHBondContact O-N 3.24Å; Q109-V111 PolarHBondContact O-N 3.42Å; Q109-P156 HydrophobicContact CB-CB 4.19Å; Q109-P156 VanDerWaalsContact O-CB 3.28Å; Q109-P156 WeakPolarHBondContact O-CB 3.06Å
110S90.2Very high89.4Confident24 Ų2470.4 Ų70.417%0.16840%0.4CS..  trans-61.8110.4178-178.30000109.7I106 V107 A108 P156 G160I106-S110 PolarHBondContact O-N 2.87Å; I106-S110 VanDerWaalsContact O-N 3.14Å; V107-S110 WeakPolarHBondContact O-CA 3.46Å; V107-S110 WeakPolarHBondContact O-CB 3.4Å; V107-S110 PolarHBondContact O-N 3.4Å; A108-S110 VanDerWaalsContact C-N 3.33Å; S110-P156 WeakPolarHBondContact CA-O 3.43Å; S110-G160 WeakPolarHBondContact OG-CA 3.39Å; S110-G160 PolarHBondContact OG-N 2.89Å
111V93.1Very high89.5Confident66 Ų6672.8 Ų72.840%0.441%0.406SS..  trans-134.8122.3179.8177.50000108Q109 T115 P156 Q157Q109-V111 PolarHBondContact O-N 3.42Å; V111-T115 VanDerWaalsContact CG1-CB 3.41Å; V111-T115 HydrophobicContact CG1-CG2 3.63Å; V111-T115 WeakPolarHBondContact CG1-OG1 3.38Å; V111-P156 PolarHBondContact N-O 3.42Å; V111-Q157 VanDerWaalsContact O-CA 3.29Å; V111-Q157 WeakPolarHBondContact O-CA 3.23Å
112P93.8Very high89.8Confident35 Ų3569.2 Ų69.223%0.22739%0.392CS..  trans-56.2148.6178.3-24.332.8000112.8W114 T115P112-W114 HydrophobicContact CB-CD2 3.95Å; P112-W114 HydrophobicContact CB-CG 4.42Å; P112-W114 HydrophobicContact CB-CH2 4.15Å; P112-W114 HydrophobicContact CB-CZ2 3.5Å; P112-W114 VanDerWaalsContact CB-CZ2 3.5Å; P112-W114 HydrophobicContact CG-CZ2 4.24Å; P112-W114 PolarHBondContact O-N 2.69Å; P112-W114 VanDerWaalsContact O-N 3.07Å; P112-T115 WeakPolarHBondContact O-CB 3.41Å; P112-T115 PolarHBondContact O-N 2.73Å; P112-T115 PolarHBondContact O-OG1 2.71Å; P112-T115 VanDerWaalsContact O-OG1 3.11Å
113P93.1Very high90.3Very high2 Ų266.5 Ų66.51%0.01337%0.373CS..THydrogen-bonded Turntrans-72.4-9.1-169.329.4-37.2000115.2Q157 A161 Y189 F190 V193 R197P113-Q157 HydrophobicContact CB-CB 4.3Å; P113-A161 HydrophobicContact CG-CB 4.38Å; P113-Y189 HydrophobicContact CG-CE1 4.32Å; P113-F190 HydrophobicContact CB-CD1 4.33Å; P113-F190 HydrophobicContact CB-CE1 3.92Å; P113-F190 HydrophobicContact CG-CE1 4.25Å; P113-V193 HydrophobicContact CB-CG1 3.94Å; P113-V193 HydrophobicContact CG-CG1 4.18Å; P113-V193 HydrophobicContact CG-CG2 4.45Å; P113-R197 PolarHBondContact O-NH1 3.39Å
114W94.4Very high90.8Very high2 Ų268.3 Ų68.31%0.00837%0.372CS..THydrogen-bonded Turntrans-93.1-7.4174.750.576.5000113.5P112 G116 C117 V123 K124 C127 L128 A164P112-W114 HydrophobicContact CB-CD2 3.95Å; P112-W114 HydrophobicContact CB-CG 4.42Å; P112-W114 HydrophobicContact CB-CH2 4.15Å; P112-W114 HydrophobicContact CB-CZ2 3.5Å; P112-W114 VanDerWaalsContact CB-CZ2 3.5Å; P112-W114 HydrophobicContact CG-CZ2 4.24Å; P112-W114 PolarHBondContact O-N 2.69Å; P112-W114 VanDerWaalsContact O-N 3.07Å; W114-G116 PolarHBondContact O-N 3.12Å; W114-C117 VanDerWaalsContact O-CB 3.28Å; W114-C117 WeakPolarHBondContact O-CB 3.38Å; W114-C117 PolarHBondContact O-N 3.37Å; W114-C117 PolarHBondContact O-SG 3.42Å; W114-V123 HydrophobicContact CB-CB 4.23Å; W114-V123 HydrophobicContact CB-CG1 3.52Å; W114-K124 HydrophobicContact CD2-CB 4.06Å; W114-K124 HydrophobicContact CD2-CG 4.17Å; W114-K124 HydrophobicContact CG-CB 3.95Å; W114-K124 HydrophobicContact CG-CG 4.48Å; W114-K124 HydrophobicContact CZ2-CD 4.33Å; W114-K124 HydrophobicContact CZ2-CG 3.94Å; W114-C127 HydrophobicContact CD2-CB 4.48Å; W114-C127 HydrophobicContact CE3-CB 3.42Å; W114-C127 VanDerWaalsContact CE3-CB 3.42Å; W114-C127 HydrophobicContact CZ3-CB 3.57Å; W114-L128 HydrophobicContact CH2-CD2 4.17Å; W114-A164 HydrophobicContact CH2-CB 3.81Å; W114-A164 HydrophobicContact CZ2-CB 3.63Å
115T93.1Very high91.2Very high60 Ų6070.9 Ų70.937%0.36838%0.377SS..THydrogen-bonded Turntrans-61.2136.8178.2-59.90000110.9V111 P112 C117V111-T115 VanDerWaalsContact CG1-CB 3.41Å; V111-T115 HydrophobicContact CG1-CG2 3.63Å; V111-T115 WeakPolarHBondContact CG1-OG1 3.38Å; P112-T115 WeakPolarHBondContact O-CB 3.41Å; P112-T115 PolarHBondContact O-N 2.73Å; P112-T115 PolarHBondContact O-OG1 2.71Å; P112-T115 VanDerWaalsContact O-OG1 3.11Å; T115-C117 VanDerWaalsContact C-N 3.28Å; T115-C117 PolarHBondContact O-N 3.48Å
116G90.5Very high91.6Very high71 Ų7168.5 Ų68.573%0.73237%0.366SS*.THydrogen-bonded Turntrans82.50.4-177.300000114.5W114W114-G116 PolarHBondContact O-N 3.12Å
117C90.1Very high92.1Very high20 Ų2066.2 Ų66.214%0.13536%0.355CS..  trans-72.5141.2165.5-60.10000109.4W114 T115 E120 V123W114-C117 VanDerWaalsContact O-CB 3.28Å; W114-C117 WeakPolarHBondContact O-CB 3.38Å; W114-C117 PolarHBondContact O-N 3.37Å; W114-C117 PolarHBondContact O-SG 3.42Å; T115-C117 VanDerWaalsContact C-N 3.28Å; T115-C117 PolarHBondContact O-N 3.48Å; C117-E120 PolarHBondContact O-N 3.24Å; C117-V123 HydrophobicContact CB-CB 4.46Å; C117-V123 HydrophobicContact CB-CG2 4.14Å
118K86.5Confident92.7Very high167 Ų16765 Ų6573%0.72635%0.345SS*.THydrogen-bonded Turntrans-63.1-44.8-179.9-67.6172.5178.9176.50112.6E120 E204K118-E120 PolarHBondContact O-N 2.93Å; K118-E204 VanDerWaalsContact CD-CD 3.45Å; K118-E204 WeakPolarHBondContact CD-OE1 3.28Å; K118-E204 WeakPolarHBondContact CD-OE2 3.26Å; K118-E204 WeakPolarHBondContact CE-OE1 3.46Å; K118-E204 IonicContact NZ-OE1 2.77Å; K118-E204 PolarHBondContact NZ-OE1 3.19Å; K118-E204 IonicContact NZ-OE2 2.69Å; K118-E204 PolarHBondContact NZ-OE2 3.44Å
119D89.9Confident93.2Very high78 Ų7863.8 Ų63.842%0.41733%0.331SS..THydrogen-bonded Turntrans-97.766.6168.5-172.4-0.1000110.3Y121 S122 V123D119-Y121 PolarHBondContact O-N 3.42Å; D119-S122 PolarHBondContact O-N 3.29Å; D119-S122 WeakPolarHBondContact OD1-CB 3.28Å; D119-S122 PolarHBondContact OD1-N 3.13Å; D119-S122 WeakPolarHBondContact OD2-CB 3.49Å; D119-V123 VanDerWaalsContact O-CG2 3.29Å; D119-V123 WeakPolarHBondContact O-CG2 3.39Å; D119-V123 PolarHBondContact O-N 3.48Å; D119-V123 VanDerWaalsContact O-N 3.14Å
120E93Very high93.6Very high82 Ų8259.1 Ų59.138%0.38331%0.31SS..Hα-helixtrans-57.6-35179.9-172.5173.9150.900111.9C117 K118 K124C117-E120 PolarHBondContact O-N 3.24Å; K118-E120 PolarHBondContact O-N 2.93Å; E120-K124 WeakPolarHBondContact O-CB 3.15Å; E120-K124 PolarHBondContact O-N 2.81Å
121Y93.5Very high93.8Very high161 Ų16158.3 Ų58.363%0.63130%0.304SS*.Hα-helixtrans-66.1-49.2-177.8-179.4-95.9000112.3D119 R125D119-Y121 PolarHBondContact O-N 3.42Å; Y121-R125 HydrophobicContact CE1-CG 4.18Å; Y121-R125 VanDerWaalsContact O-CG 3.28Å; Y121-R125 WeakPolarHBondContact O-CG 3.38Å; Y121-R125 PolarHBondContact O-N 2.97Å
122S93.7Very high93.8Very high30 Ų3058.7 Ų58.721%0.2131%0.309CS..Hα-helixtrans-65.8-46.1178.2-176.30000111.5D119 K124 R125 Q126D119-S122 PolarHBondContact O-N 3.29Å; D119-S122 WeakPolarHBondContact OD1-CB 3.28Å; D119-S122 PolarHBondContact OD1-N 3.13Å; D119-S122 WeakPolarHBondContact OD2-CB 3.49Å; S122-K124 VanDerWaalsContact C-N 3.35Å; S122-K124 PolarHBondContact O-N 3.32Å; S122-R125 PolarHBondContact O-N 2.62Å; S122-Q126 WeakPolarHBondContact O-CG 3.27Å; S122-Q126 PolarHBondContact O-N 3.17Å; S122-Q126 PolarHBondContact OG-NE2 3.46Å
123V96.4Very high93.7Very high1 Ų160.4 Ų60.41%0.00632%0.319CS..Hα-helixtrans-59.8-46.2178.5176.10000110.4W114 C117 D119 R125 Q126 C127 I196 R197 A200W114-V123 HydrophobicContact CB-CB 4.23Å; W114-V123 HydrophobicContact CB-CG1 3.52Å; C117-V123 HydrophobicContact CB-CB 4.46Å; C117-V123 HydrophobicContact CB-CG2 4.14Å; D119-V123 VanDerWaalsContact O-CG2 3.29Å; D119-V123 WeakPolarHBondContact O-CG2 3.39Å; D119-V123 PolarHBondContact O-N 3.48Å; D119-V123 VanDerWaalsContact O-N 3.14Å; V123-R125 PolarHBondContact O-N 3.25Å; V123-Q126 PolarHBondContact O-N 2.9Å; V123-C127 WeakPolarHBondContact O-CB 3.44Å; V123-C127 PolarHBondContact O-N 3.4Å; V123-C127 PolarHBondContact O-SG 2.76Å; V123-I196 HydrophobicContact CB-CG2 4.39Å; V123-I196 HydrophobicContact CG1-CG2 3.92Å; V123-R197 HydrophobicContact CG1-CG 4.07Å; V123-A200 HydrophobicContact CG2-CB 3.47Å; V123-A200 VanDerWaalsContact CG2-CB 3.47Å
124K96.5Very high93.7Very high86 Ų8663.2 Ų63.237%0.37433%0.332SS..Hα-helixtrans-56.9-48175.8176.9175.1-178175.30111.7W114 E120 S122 Q126 C127 L128W114-K124 HydrophobicContact CD2-CB 4.06Å; W114-K124 HydrophobicContact CD2-CG 4.17Å; W114-K124 HydrophobicContact CG-CB 3.95Å; W114-K124 HydrophobicContact CG-CG 4.48Å; W114-K124 HydrophobicContact CZ2-CD 4.33Å; W114-K124 HydrophobicContact CZ2-CG 3.94Å; E120-K124 WeakPolarHBondContact O-CB 3.15Å; E120-K124 PolarHBondContact O-N 2.81Å; S122-K124 VanDerWaalsContact C-N 3.35Å; S122-K124 PolarHBondContact O-N 3.32Å; K124-Q126 VanDerWaalsContact C-N 3.3Å; K124-Q126 PolarHBondContact O-N 3.48Å; K124-C127 PolarHBondContact O-N 3.38Å; K124-L128 HydrophobicContact CG-CD1 4.03Å; K124-L128 HydrophobicContact CG-CG 4.36Å; K124-L128 VanDerWaalsContact O-CG 3.3Å; K124-L128 WeakPolarHBondContact O-CG 3.45Å; K124-L128 PolarHBondContact O-N 2.83Å
125R96.5Very high93.6Very high162 Ų16268.5 Ų68.561%0.61136%0.361SS*.Hα-helixtrans-59.7-41179.5-75-107.9-77.8-174.5-6.5112.1Y121 S122 V123 S129Y121-R125 HydrophobicContact CE1-CG 4.18Å; Y121-R125 VanDerWaalsContact O-CG 3.28Å; Y121-R125 WeakPolarHBondContact O-CG 3.38Å; Y121-R125 PolarHBondContact O-N 2.97Å; S122-R125 PolarHBondContact O-N 2.62Å; V123-R125 PolarHBondContact O-N 3.25Å; R125-S129 PolarHBondContact O-N 3.27Å
126Q96.1Very high93.5Very high67 Ų6768.2 Ų68.231%0.31336%0.357SS..Hα-helixtrans-70.1-39.4176.5-67.1-17748.500112.1S122 V123 K124 L128 S129 L130 I196S122-Q126 WeakPolarHBondContact O-CG 3.27Å; S122-Q126 PolarHBondContact O-N 3.17Å; S122-Q126 PolarHBondContact OG-NE2 3.46Å; V123-Q126 PolarHBondContact O-N 2.9Å; K124-Q126 VanDerWaalsContact C-N 3.3Å; K124-Q126 PolarHBondContact O-N 3.48Å; Q126-L128 PolarHBondContact O-N 3.03Å; Q126-S129 PolarHBondContact O-N 2.97Å; Q126-S129 PolarHBondContact O-OG 2.88Å; Q126-L130 PolarHBondContact O-N 3.41Å; Q126-I196 HydrophobicContact CB-CD1 3.93Å; Q126-I196 HydrophobicContact CB-CG1 4.21Å; Q126-I196 HydrophobicContact CB-CG2 3.65Å; Q126-I196 HydrophobicContact CG-CG2 4.44Å
127C96.4Very high93.8Very high0 Ų064.9 Ų64.90%032%0.322CS..Hα-helixtrans-64.8-40.3176.2-69.90000112.1W114 V123 K124 S129 L130W114-C127 HydrophobicContact CD2-CB 4.48Å; W114-C127 HydrophobicContact CE3-CB 3.42Å; W114-C127 VanDerWaalsContact CE3-CB 3.42Å; W114-C127 HydrophobicContact CZ3-CB 3.57Å; V123-C127 WeakPolarHBondContact O-CB 3.44Å; V123-C127 PolarHBondContact O-N 3.4Å; V123-C127 PolarHBondContact O-SG 2.76Å; K124-C127 PolarHBondContact O-N 3.38Å; C127-S129 PolarHBondContact O-N 2.86Å; C127-L130 VanDerWaalsContact O-CB 3.26Å; C127-L130 WeakPolarHBondContact O-CB 3.47Å; C127-L130 WeakPolarHBondContact O-CG 3.37Å; C127-L130 PolarHBondContact O-N 3.19Å
128L96.1Very high94Very high50 Ų5066.2 Ų66.226%0.26233%0.328SS..Hα-helixtrans-67.8-22.1174.9-67.4177.8000113W114 K124 Q126 L130 S131 D165W114-L128 HydrophobicContact CH2-CD2 4.17Å; K124-L128 HydrophobicContact CG-CD1 4.03Å; K124-L128 HydrophobicContact CG-CG 4.36Å; K124-L128 VanDerWaalsContact O-CG 3.3Å; K124-L128 WeakPolarHBondContact O-CG 3.45Å; K124-L128 PolarHBondContact O-N 2.83Å; Q126-L128 PolarHBondContact O-N 3.03Å; L128-L130 VanDerWaalsContact C-N 3.31Å; L128-S131 PolarHBondContact O-OG 3.23Å; L128-D165 HydrophobicContact CD2-CB 3.56Å
129S96.4Very high94.5Very high65 Ų6567 Ų6746%0.45533%0.326SS..Hα-helixtrans-78.3-18.6174.980.30000112.4R125 Q126 C127 S131 S132R125-S129 PolarHBondContact O-N 3.27Å; Q126-S129 PolarHBondContact O-N 2.97Å; Q126-S129 PolarHBondContact O-OG 2.88Å; C127-S129 PolarHBondContact O-N 2.86Å; S129-S131 VanDerWaalsContact C-N 3.27Å; S129-S131 PolarHBondContact O-N 2.91Å; S129-S132 WeakPolarHBondContact O-CB 3.15Å; S129-S132 PolarHBondContact O-N 3.09Å
130L95.4Very high94.7Very high13 Ų1369.4 Ų69.47%0.06834%0.335CS..Hα-helixtrans-59.2-38.6176.2-64.8175.8000112Q126 C127 L128 S132 Y189 R192 V193 I196Q126-L130 PolarHBondContact O-N 3.41Å; C127-L130 VanDerWaalsContact O-CB 3.26Å; C127-L130 WeakPolarHBondContact O-CB 3.47Å; C127-L130 WeakPolarHBondContact O-CG 3.37Å; C127-L130 PolarHBondContact O-N 3.19Å; L128-L130 VanDerWaalsContact C-N 3.31Å; L130-S132 PolarHBondContact O-N 3.14Å; L130-Y189 HydrophobicContact CB-CE2 4.44Å; L130-Y189 HydrophobicContact CD1-CD2 4.3Å; L130-Y189 HydrophobicContact CD1-CE2 4.08Å; L130-R192 HydrophobicContact CD1-CB 3.66Å; L130-R192 HydrophobicContact CD2-CB 3.72Å; L130-R192 HydrophobicContact CD2-CG 4.19Å; L130-R192 HydrophobicContact CG-CB 4.35Å; L130-V193 HydrophobicContact CD1-CG2 3.92Å; L130-I196 HydrophobicContact CD1-CD1 3.83Å; L130-I196 HydrophobicContact CD2-CD1 4.07Å; L130-I196 HydrophobicContact CG-CD1 3.98Å
131S94.7Very high94.8Very high6 Ų666.6 Ų66.64%0.04232%0.324CS..THydrogen-bonded Turntrans-75.5-3.7178.265.80000113.9L128 S129 D165 L171L128-S131 PolarHBondContact O-OG 3.23Å; S129-S131 VanDerWaalsContact C-N 3.27Å; S129-S131 PolarHBondContact O-N 2.91Å; S131-D165 WeakPolarHBondContact CB-OD2 3.1Å; S131-D165 PolarHBondContact OG-OD1 3.15Å; S131-D165 PolarHBondContact OG-OD2 3.38Å; S131-L171 WeakPolarHBondContact O-CD1 3.33Å
132S93.1Very high94.8Very high74 Ų7462.9 Ų62.952%0.51732%0.319SS..THydrogen-bonded Turntrans-83.3-16.1176.1-59.30000113.1S129 L130S129-S132 WeakPolarHBondContact O-CB 3.15Å; S129-S132 PolarHBondContact O-N 3.09Å; L130-S132 PolarHBondContact O-N 3.14Å
133V91.6Very high94.7Very high71 Ų7166.7 Ų66.743%0.4335%0.352SS..  trans-130.3114.5179.9-178.90000109.2D135 N136V133-D135 VanDerWaalsContact C-N 3.3Å; V133-D135 HydrophobicContact CG1-CB 4.22Å; V133-D135 PolarHBondContact O-N 3.45Å; V133-N136 WeakPolarHBondContact O-CB 3.46Å; V133-N136 PolarHBondContact O-N 3.25Å
134E92.9Very high94.4Very high62 Ų6270.6 Ų70.629%0.2939%0.393SS..THydrogen-bonded Turntrans-56.2-42.2-177.3-168.4-173.5143.600112.8N136 L137 L138 L175 K179E134-N136 PolarHBondContact O-N 3.14Å; E134-N136 VanDerWaalsContact O-N 3.09Å; E134-L137 PolarHBondContact O-N 3.05Å; E134-L138 HydrophobicContact CG-CD1 4.15Å; E134-L138 HydrophobicContact CG-CG 4.44Å; E134-L138 PolarHBondContact O-N 3.32Å; E134-L175 VanDerWaalsContact CD-CD2 3.48Å; E134-L175 HydrophobicContact CG-CD1 3.9Å; E134-L175 HydrophobicContact CG-CD2 3.7Å; E134-L175 HydrophobicContact CG-CG 4.37Å; E134-L175 WeakPolarHBondContact OE1-CD2 3.12Å; E134-K179 IonicContact OE1-NZ 3.08Å; E134-K179 PolarHBondContact OE1-NZ 3.04Å; E134-K179 IonicContact OE2-NZ 2.85Å
135D93.4Very high94.1Very high113 Ų11368.8 Ų68.860%0.60439%0.391SS*.Hα-helixtrans-59.1-26.8-176.6-68.3-15.8000113.5V133 L137 L138 R139V133-D135 VanDerWaalsContact C-N 3.3Å; V133-D135 HydrophobicContact CG1-CB 4.22Å; V133-D135 PolarHBondContact O-N 3.45Å; D135-L137 PolarHBondContact O-N 3.39Å; D135-L138 PolarHBondContact O-N 2.85Å; D135-R139 WeakPolarHBondContact O-CB 3.21Å; D135-R139 PolarHBondContact O-N 2.84Å
136N91.9Very high93.8Very high54 Ų5468.7 Ų68.729%0.28940%0.402SS..Hα-helixtrans-61.4-35.8177-74.3-26.4000111.9V133 E134 R192V133-N136 WeakPolarHBondContact O-CB 3.46Å; V133-N136 PolarHBondContact O-N 3.25Å; E134-N136 PolarHBondContact O-N 3.14Å; E134-N136 VanDerWaalsContact O-N 3.09Å; N136-R192 PolarHBondContact O-NH2 3.36Å
137L95.5Very high93.7Very high0 Ų067 Ų670%039%0.394CS..Hα-helixtrans-89.3-20.5-176.2-52.9-178.1000112.7E134 D135 L168 L171 F185 N188 Y189E134-L137 PolarHBondContact O-N 3.05Å; D135-L137 PolarHBondContact O-N 3.39Å; L137-L168 HydrophobicContact CD1-CD1 3.86Å; L137-L168 HydrophobicContact CD2-CD1 4.44Å; L137-L171 HydrophobicContact CD1-CB 4.29Å; L137-L171 HydrophobicContact CD1-CD1 3.7Å; L137-F185 HydrophobicContact CB-CD2 4.43Å; L137-F185 HydrophobicContact CB-CE2 4.25Å; L137-F185 HydrophobicContact CD1-CE2 3.61Å; L137-F185 HydrophobicContact CD1-CZ 3.98Å; L137-F185 HydrophobicContact CG-CE2 4.47Å; L137-N188 WeakPolarHBondContact O-CB 3.4Å; L137-N188 PolarHBondContact O-ND2 3.18Å; L137-Y189 HydrophobicContact CD2-CD2 3.73Å; L137-Y189 HydrophobicContact CD2-CG 4.45Å
138L95.8Very high93.5Very high48 Ų4872 Ų7225%0.25143%0.429SS..Hα-helixtrans-85-26.1176.9-65.5-179.7000113E134 D135 E140 L175 K179 I180 N188E134-L138 HydrophobicContact CG-CD1 4.15Å; E134-L138 HydrophobicContact CG-CG 4.44Å; E134-L138 PolarHBondContact O-N 3.32Å; D135-L138 PolarHBondContact O-N 2.85Å; L138-E140 PolarHBondContact O-N 3.36Å; L138-L175 HydrophobicContact CD2-CD1 4.26Å; L138-L175 HydrophobicContact CD2-CD2 4.37Å; L138-K179 HydrophobicContact CD1-CD 4.26Å; L138-K179 HydrophobicContact CD2-CB 4.18Å; L138-K179 HydrophobicContact CD2-CD 4.41Å; L138-I180 HydrophobicContact CD2-CD1 3.89Å; L138-I180 HydrophobicContact CD2-CG1 4.11Å; L138-I180 HydrophobicContact CD2-CG2 3.92Å; L138-N188 PolarHBondContact O-ND2 3.48Å
139R96.1Very high93.4Very high184 Ų18470.3 Ų70.369%0.69442%0.42SS*.SBendtrans-82.7119.3-175.4178.8178-173.1173.83.6112.3D135 R192D135-R139 WeakPolarHBondContact O-CB 3.21Å; D135-R139 PolarHBondContact O-N 2.84Å; R139-R192 VanDerWaalsContact CB-NH2 3.35Å; R139-R192 PolarHBondContact O-NH2 3.13Å
140E94.8Very high93.4Very high128 Ų12871.5 Ų71.560%0.59842%0.421SS*.PPolyproline II helixtrans-65.7154179.1-62.8-175.1162.700113.5L138 T184 N188L138-E140 PolarHBondContact O-N 3.36Å; E140-T184 HydrophobicContact CG-CG2 4.42Å; E140-N188 WeakPolarHBondContact CA-OD1 3.45Å
141P94.5Very high93.3Very high24 Ų2473.5 Ų73.516%0.15643%0.429CS..PPolyproline II helixtrans-56.8142.3167.2-20.832000110.8F147 R187 N188 F191P141-F147 HydrophobicContact CG-CD1 4.15Å; P141-F147 HydrophobicContact CG-CE1 4.41Å; P141-R187 HydrophobicContact CG-CG 4.29Å; P141-N188 WeakPolarHBondContact CD-OD1 3.26Å; P141-F191 HydrophobicContact CB-CB 4.4Å; P141-F191 HydrophobicContact CB-CD1 3.79Å; P141-F191 HydrophobicContact CB-CD2 3.94Å; P141-F191 HydrophobicContact CB-CE1 3.98Å; P141-F191 HydrophobicContact CB-CE2 4.11Å; P141-F191 HydrophobicContact CB-CG 3.78Å; P141-F191 HydrophobicContact CB-CZ 4.13Å; P141-F191 HydrophobicContact CG-CB 3.73Å; P141-F191 HydrophobicContact CG-CD1 3.85Å; P141-F191 HydrophobicContact CG-CD2 4.18Å; P141-F191 HydrophobicContact CG-CG 3.66Å
142P94.3Very high93.2Very high82 Ų8277.2 Ų77.253%0.53246%0.455SS..PPolyproline II helixtrans-56.1141.7174.7-23.934000112G144 C145P142-G144 PolarHBondContact O-N 3.2Å; P142-C145 WeakPolarHBondContact O-CB 3.38Å; P142-C145 PolarHBondContact O-N 3.42Å; P142-C145 PolarHBondContact O-SG 3.05Å
143A91.5Very high93.2Very high110 Ų11076.6 Ų76.691%0.90945%0.454SS*.THydrogen-bonded Turntrans-58.2135.5176.500000110.9C145A143-C145 VanDerWaalsContact C-N 3.31Å; A143-C145 PolarHBondContact O-N 2.98Å
144G90Very high93.4Very high84 Ų8476 Ų7687%0.86645%0.445SS*.THydrogen-bonded Turntrans75.311.5179.600000115.3P142P142-G144 PolarHBondContact O-N 3.2Å
145C90.3Very high93.5Very high48 Ų4875 Ų7532%0.32444%0.441SS..  trans-71.8148.8171.269.40000111.9P142 A143 F147P142-C145 WeakPolarHBondContact O-CB 3.38Å; P142-C145 PolarHBondContact O-N 3.42Å; P142-C145 PolarHBondContact O-SG 3.05Å; A143-C145 VanDerWaalsContact C-N 3.31Å; A143-C145 PolarHBondContact O-N 2.98Å; C145-F147 PolarHBondContact O-N 3.38Å
146D89.6Confident93.6Very high159 Ų15970.7 Ų70.785%0.8542%0.42SS*.SBendtrans-75.567.2174.9-60.4-39.6000111
147F93.3Very high93.7Very high31 Ų3171 Ų7114%0.13642%0.419CS..  trans-134.4103.7175.9178.7-111.5000110.1P141 C145 F149 R187 F190 F191P141-F147 HydrophobicContact CG-CD1 4.15Å; P141-F147 HydrophobicContact CG-CE1 4.41Å; C145-F147 PolarHBondContact O-N 3.38Å; F147-F149 HydrophobicContact CD1-CB 4.34Å; F147-F149 HydrophobicContact CE1-CB 3.66Å; F147-F149 HydrophobicContact CE1-CD2 4.49Å; F147-F149 HydrophobicContact CE1-CG 4.31Å; F147-F149 HydrophobicContact CZ-CB 3.99Å; F147-F149 HydrophobicContact CZ-CD2 4.21Å; F147-F149 HydrophobicContact CZ-CG 4.45Å; F147-R187 HydrophobicContact CE1-CG 4.1Å; F147-R187 WeakPolarHBondContact CE1-O 3.45Å; F147-F190 HydrophobicContact CZ-CB 4.05Å; F147-F191 HydrophobicContact CB-CD2 3.79Å; F147-F191 HydrophobicContact CB-CE2 4.1Å; F147-F191 HydrophobicContact CD1-CB 3.93Å; F147-F191 AromaticContact CD1-CD2 3.77Å; F147-F191 HydrophobicContact CD1-CD2 3.77Å; F147-F191 HydrophobicContact CD1-CG 4.23Å; F147-F191 AromaticContact CD2-CD2 3.95Å; F147-F191 HydrophobicContact CD2-CD2 3.95Å; F147-F191 HydrophobicContact CE1-CB 3.64Å; F147-F191 HydrophobicContact CE1-CD2 4.33Å; F147-F191 HydrophobicContact CE1-CG 4.42Å; F147-F191 HydrophobicContact CE2-CB 4.3Å; F147-F191 HydrophobicContact CG-CB 4.37Å; F147-F191 AromaticContact CG-CD2 3.55Å; F147-F191 HydrophobicContact CG-CD2 3.55Å; F147-F191 HydrophobicContact CG-CE2 4.36Å; F147-F191 HydrophobicContact CG-CG 4.4Å; F147-F191 HydrophobicContact CZ-CB 3.85Å; F147-F191 VanDerWaalsContact CZ-N 3.33Å
148S92.9Very high93.8Very high106 Ų10671.1 Ų71.174%0.74142%0.42SS*.  trans-87133170.5-174.80000109.7
149F94.4Very high93.7Very high15 Ų1572.7 Ų72.77%0.06643%0.425CS..  trans-135.4124.5178.3175.9-102.1000110.1F147 F151 Y154 E183 W186 R187 F190F147-F149 HydrophobicContact CD1-CB 4.34Å; F147-F149 HydrophobicContact CE1-CB 3.66Å; F147-F149 HydrophobicContact CE1-CD2 4.49Å; F147-F149 HydrophobicContact CE1-CG 4.31Å; F147-F149 HydrophobicContact CZ-CB 3.99Å; F147-F149 HydrophobicContact CZ-CD2 4.21Å; F147-F149 HydrophobicContact CZ-CG 4.45Å; F149-F151 HydrophobicContact CE1-CB 4.08Å; F149-F151 HydrophobicContact CZ-CB 4.19Å; F149-F151 HydrophobicContact CZ-CD2 4.09Å; F149-Y154 AromaticContact CD2-CD2 3.95Å; F149-Y154 HydrophobicContact CD2-CD2 3.95Å; F149-Y154 HydrophobicContact CD2-CE2 4.17Å; F149-Y154 HydrophobicContact CD2-CG 4.18Å; F149-Y154 HydrophobicContact CE2-CD1 4.48Å; F149-Y154 HydrophobicContact CE2-CD2 4.07Å; F149-Y154 AromaticContact CE2-CG 3.92Å; F149-Y154 HydrophobicContact CE2-CG 3.92Å; F149-E183 HydrophobicContact CE1-CG 3.92Å; F149-W186 HydrophobicContact CE2-CB 4.28Å; F149-W186 HydrophobicContact CZ-CB 3.68Å; F149-R187 HydrophobicContact CB-CG 4.13Å; F149-R187 HydrophobicContact CD1-CB 3.54Å; F149-R187 HydrophobicContact CD1-CG 3.76Å; F149-R187 HydrophobicContact CE1-CB 3.67Å; F149-R187 HydrophobicContact CE1-CG 4.4Å; F149-R187 HydrophobicContact CG-CB 4.02Å; F149-R187 HydrophobicContact CG-CG 3.98Å; F149-R187 HydrophobicContact CZ-CB 4.27Å; F149-F190 HydrophobicContact CD2-CB 4.44Å; F149-F190 HydrophobicContact CD2-CD2 4.41Å; F149-F190 HydrophobicContact CE2-CB 4.42Å; F149-F190 AromaticContact CE2-CD2 3.62Å; F149-F190 HydrophobicContact CE2-CD2 3.62Å; F149-F190 HydrophobicContact CE2-CE2 4.35Å; F149-F190 HydrophobicContact CE2-CG 4.4Å; F149-F190 HydrophobicContact CZ-CD2 4.44Å
150D95.2Very high93.7Very high89 Ų8964 Ų6448%0.47639%0.393SS..  trans-121.9116.1171.317118.8000108.6S152 A153 Y154D150-S152 VanDerWaalsContact C-N 3.3Å; D150-S152 PolarHBondContact O-N 3.39Å; D150-S152 PolarHBondContact OD1-N 3.2Å; D150-A153 HydrophobicContact CB-CB 4.16Å; D150-A153 PolarHBondContact O-N 3.09Å; D150-A153 WeakPolarHBondContact OD2-CB 3.22Å; D150-Y154 WeakPolarHBondContact O-CD2 3.48Å; D150-Y154 PolarHBondContact O-N 2.75Å
151F94.6Very high93.8Very high56 Ų5657.9 Ų57.925%0.24636%0.364CS..Hα-helixtrans-58.5-42.2-174.2-178.9-128.6000112.8F149 A153 Y154 L155 E182 E183 W186F149-F151 HydrophobicContact CE1-CB 4.08Å; F149-F151 HydrophobicContact CZ-CB 4.19Å; F149-F151 HydrophobicContact CZ-CD2 4.09Å; F151-A153 PolarHBondContact O-N 3.02Å; F151-Y154 PolarHBondContact O-N 3.2Å; F151-L155 HydrophobicContact CD2-CD2 4.42Å; F151-L155 HydrophobicContact CE1-CD2 4.11Å; F151-L155 HydrophobicContact CE2-CD2 3.74Å; F151-L155 HydrophobicContact CZ-CD2 3.58Å; F151-L155 PolarHBondContact O-N 3.33Å; F151-E182 HydrophobicContact CE1-CG 4.37Å; F151-E182 HydrophobicContact CE2-CG 4.2Å; F151-E182 HydrophobicContact CZ-CG 3.65Å; F151-E183 HydrophobicContact CB-CG 4.24Å; F151-W186 HydrophobicContact CD2-CB 4.24Å; F151-W186 HydrophobicContact CD2-CG 4.36Å; F151-W186 HydrophobicContact CE2-CB 4.28Å; F151-W186 AromaticContact CE2-CD1 3.26Å; F151-W186 AromaticContact CE2-CG 3.92Å; F151-W186 HydrophobicContact CE2-CG 3.92Å; F151-W186 AromaticContact CE2-NE1 3.93Å
152S92.4Very high93.8Very high83 Ų8357.7 Ų57.758%0.5836%0.362SS*.Hα-helixtrans-65.6-41.6-177-65.60000112.4D150 Y154 L155D150-S152 VanDerWaalsContact C-N 3.3Å; D150-S152 PolarHBondContact O-N 3.39Å; D150-S152 PolarHBondContact OD1-N 3.2Å; S152-Y154 VanDerWaalsContact C-N 3.27Å; S152-Y154 PolarHBondContact O-N 3.35Å; S152-L155 PolarHBondContact O-N 2.99Å
153A92.9Very high93.8Very high61 Ų6161 Ų6150%0.50437%0.37SS..Hα-helixtrans-66.8-27.8177.500000113.2D150 F151D150-A153 HydrophobicContact CB-CB 4.16Å; D150-A153 PolarHBondContact O-N 3.09Å; D150-A153 WeakPolarHBondContact OD2-CB 3.22Å; F151-A153 PolarHBondContact O-N 3.02Å
154Y95.3Very high93.9Very high60 Ų6057.5 Ų57.524%0.23534%0.341CS..Hα-helixtrans-91.1-6.8-178.8-82.2-97.2000114.1F149 D150 F151 S152 Q157 A158 F190F149-Y154 AromaticContact CD2-CD2 3.95Å; F149-Y154 HydrophobicContact CD2-CD2 3.95Å; F149-Y154 HydrophobicContact CD2-CE2 4.17Å; F149-Y154 HydrophobicContact CD2-CG 4.18Å; F149-Y154 HydrophobicContact CE2-CD1 4.48Å; F149-Y154 HydrophobicContact CE2-CD2 4.07Å; F149-Y154 AromaticContact CE2-CG 3.92Å; F149-Y154 HydrophobicContact CE2-CG 3.92Å; D150-Y154 WeakPolarHBondContact O-CD2 3.48Å; D150-Y154 PolarHBondContact O-N 2.75Å; F151-Y154 PolarHBondContact O-N 3.2Å; S152-Y154 VanDerWaalsContact C-N 3.27Å; S152-Y154 PolarHBondContact O-N 3.35Å; Y154-Q157 PolarHBondContact O-N 3.05Å; Y154-Q157 VanDerWaalsContact O-N 3.09Å; Y154-A158 PolarHBondContact O-N 3.35Å; Y154-F190 HydrophobicContact CD1-CB 4.19Å; Y154-F190 AromaticContact CD1-CD1 3.64Å; Y154-F190 HydrophobicContact CD1-CD1 3.64Å; Y154-F190 AromaticContact CD1-CD2 3.74Å; Y154-F190 HydrophobicContact CD1-CD2 3.74Å; Y154-F190 AromaticContact CD1-CE1 3.87Å; Y154-F190 HydrophobicContact CD1-CE1 3.87Å; Y154-F190 AromaticContact CD1-CE2 3.94Å; Y154-F190 HydrophobicContact CD1-CE2 3.94Å; Y154-F190 AromaticContact CD1-CG 3.57Å; Y154-F190 HydrophobicContact CD1-CG 3.57Å; Y154-F190 HydrophobicContact CD1-CZ 4Å; Y154-F190 HydrophobicContact CE1-CB 4.14Å; Y154-F190 AromaticContact CE1-CD1 3.99Å; Y154-F190 HydrophobicContact CE1-CD1 3.99Å; Y154-F190 AromaticContact CE1-CG 3.97Å; Y154-F190 HydrophobicContact CE1-CG 3.97Å; Y154-F190 HydrophobicContact CG-CD2 4.17Å; Y154-F190 HydrophobicContact CG-CE2 4.26Å; Y154-F190 HydrophobicContact CG-CG 4.42Å
155L94.7Very high94.2Very high40 Ų4053.8 Ų53.821%0.20930%0.302CS..Hα-helixtrans-52.6-47.2-179.9-77.6177.8000114.1I106 F151 S152 Q157 A158 F159I106-L155 HydrophobicContact CD1-CD1 4.37Å; I106-L155 HydrophobicContact CG2-CB 4.11Å; F151-L155 HydrophobicContact CD2-CD2 4.42Å; F151-L155 HydrophobicContact CE1-CD2 4.11Å; F151-L155 HydrophobicContact CE2-CD2 3.74Å; F151-L155 HydrophobicContact CZ-CD2 3.58Å; F151-L155 PolarHBondContact O-N 3.33Å; S152-L155 PolarHBondContact O-N 2.99Å; L155-Q157 PolarHBondContact O-N 3.44Å; L155-A158 WeakPolarHBondContact O-CB 2.9Å; L155-A158 PolarHBondContact O-N 2.84Å; L155-F159 HydrophobicContact CB-CE2 4.48Å; L155-F159 WeakPolarHBondContact O-CD2 3.45Å; L155-F159 PolarHBondContact O-N 3.14Å
156P94.7Very high94.5Very high23 Ų2355.5 Ų55.515%0.14931%0.312CS..Hα-helixtrans-60-37.1179.3-19.830.6000112.4I106 Q109 S110 V111 G160I106-P156 HydrophobicContact CG2-CG 4.19Å; Q109-P156 HydrophobicContact CB-CB 4.19Å; Q109-P156 VanDerWaalsContact O-CB 3.28Å; Q109-P156 WeakPolarHBondContact O-CB 3.06Å; S110-P156 WeakPolarHBondContact CA-O 3.43Å; V111-P156 PolarHBondContact N-O 3.42Å; P156-G160 PolarHBondContact O-N 2.94Å; P156-G160 VanDerWaalsContact O-N 3.12Å
157Q95.8Very high94.7Very high59 Ų5953.5 Ų53.528%0.27630%0.296SS..Hα-helixtrans-71.8-33175.2-68.2177.549.900112.9V111 P113 Y154 L155 G160 A161 F190V111-Q157 VanDerWaalsContact O-CA 3.29Å; V111-Q157 WeakPolarHBondContact O-CA 3.23Å; P113-Q157 HydrophobicContact CB-CB 4.3Å; Y154-Q157 PolarHBondContact O-N 3.05Å; Y154-Q157 VanDerWaalsContact O-N 3.09Å; L155-Q157 PolarHBondContact O-N 3.44Å; Q157-G160 PolarHBondContact O-N 3.06Å; Q157-A161 WeakPolarHBondContact O-CB 3.28Å; Q157-A161 PolarHBondContact O-N 3.17Å; Q157-F190 HydrophobicContact CB-CE1 3.82Å; Q157-F190 HydrophobicContact CB-CZ 3.93Å
158A96.4Very high94.9Very high3 Ų352 Ų523%0.02529%0.289CS..Hα-helixtrans-65.7-44176.700000110.6Y154 L155 A161 L162 W186 F190Y154-A158 PolarHBondContact O-N 3.35Å; L155-A158 WeakPolarHBondContact O-CB 2.9Å; L155-A158 PolarHBondContact O-N 2.84Å; A158-A161 PolarHBondContact O-N 3.38Å; A158-L162 WeakPolarHBondContact O-CG 2.85Å; A158-L162 PolarHBondContact O-N 2.93Å; A158-W186 HydrophobicContact CB-CD2 3.91Å; A158-W186 HydrophobicContact CB-CE3 3.89Å; A158-W186 HydrophobicContact CB-CH2 3.84Å; A158-W186 HydrophobicContact CB-CZ2 3.83Å; A158-W186 HydrophobicContact CB-CZ3 3.86Å; A158-F190 HydrophobicContact CB-CE2 4.15Å; A158-F190 HydrophobicContact CB-CZ 3.99Å
159F94.7Very high95Very high82 Ų8252.3 Ų52.336%0.3628%0.279SS..Hα-helixtrans-60-45.6172.8-76.5-70.1000111.7I106 V107 L155 A161 L162 E163I106-F159 HydrophobicContact CG2-CD2 3.5Å; I106-F159 HydrophobicContact CG2-CE2 3.57Å; V107-F159 HydrophobicContact CG2-CD1 4.39Å; V107-F159 HydrophobicContact CG2-CG 4.49Å; L155-F159 HydrophobicContact CB-CE2 4.48Å; L155-F159 WeakPolarHBondContact O-CD2 3.45Å; L155-F159 PolarHBondContact O-N 3.14Å; F159-A161 VanDerWaalsContact C-N 3.29Å; F159-A161 PolarHBondContact O-N 3.3Å; F159-L162 PolarHBondContact O-N 3.28Å; F159-E163 PolarHBondContact O-N 2.55Å
160G95.2Very high95.1Very high1 Ų158 Ų581%0.0131%0.306CS..Hα-helixtrans-63.3-35177.900000113S110 P156 Q157 A164S110-G160 WeakPolarHBondContact OG-CA 3.39Å; S110-G160 PolarHBondContact OG-N 2.89Å; P156-G160 PolarHBondContact O-N 2.94Å; P156-G160 VanDerWaalsContact O-N 3.12Å; Q157-G160 PolarHBondContact O-N 3.06Å; G160-A164 WeakPolarHBondContact O-CB 3.37Å; G160-A164 PolarHBondContact O-N 3.17Å
161A96.3Very high95.1Very high0 Ų055.2 Ų55.20%029%0.29CS..Hα-helixtrans-68.5-42.117400000112.4P113 Q157 A158 F159 A164 D165 L168 W186 Y189P113-A161 HydrophobicContact CG-CB 4.38Å; Q157-A161 WeakPolarHBondContact O-CB 3.28Å; Q157-A161 PolarHBondContact O-N 3.17Å; A158-A161 PolarHBondContact O-N 3.38Å; F159-A161 VanDerWaalsContact C-N 3.29Å; F159-A161 PolarHBondContact O-N 3.3Å; A161-A164 PolarHBondContact O-N 3.35Å; A161-D165 WeakPolarHBondContact O-CB 3.5Å; A161-D165 PolarHBondContact O-N 3.12Å; A161-L168 HydrophobicContact CB-CD2 3.96Å; A161-W186 HydrophobicContact CB-CZ3 4.5Å; A161-Y189 HydrophobicContact CB-CE1 3.95Å
162L95.7Very high95.2Very high19 Ų1956.6 Ų56.610%0.09929%0.294CS..Hα-helixtrans-65.9-40.7177.8-70.3174.1000112.4A158 F159 A164 D165 L168 Q169 W186A158-L162 WeakPolarHBondContact O-CG 2.85Å; A158-L162 PolarHBondContact O-N 2.93Å; F159-L162 PolarHBondContact O-N 3.28Å; L162-A164 VanDerWaalsContact C-N 3.33Å; L162-D165 CarbonylContact O-C 3.57Å; L162-D165 PolarHBondContact O-N 2.95Å; L162-L168 HydrophobicContact CD2-CD2 4.46Å; L162-L168 HydrophobicContact CD2-CG 4.36Å; L162-Q169 HydrophobicContact CD2-CB 4.03Å; L162-W186 HydrophobicContact CD1-CH2 4.21Å; L162-W186 HydrophobicContact CD1-CZ2 3.95Å; L162-W186 HydrophobicContact CD2-CH2 3.81Å; L162-W186 HydrophobicContact CD2-CZ2 4.05Å; L162-W186 HydrophobicContact CG-CH2 3.73Å; L162-W186 HydrophobicContact CG-CZ2 3.98Å
163E93.9Very high95.3Very high152 Ų15260.8 Ų60.871%0.7130%0.302SS*.Hα-helixtrans-65-39.4177.6-173.7178.5-177.700111.6F159F159-E163 PolarHBondContact O-N 2.55Å
164A94.1Very high95.4Very high36 Ų3661.2 Ų61.230%0.29830%0.299SS..Hα-helixtrans-78.6-23.7179.400000114.3W114 G160 A161 L162W114-A164 HydrophobicContact CH2-CB 3.81Å; W114-A164 HydrophobicContact CZ2-CB 3.63Å; G160-A164 WeakPolarHBondContact O-CB 3.37Å; G160-A164 PolarHBondContact O-N 3.17Å; A161-A164 PolarHBondContact O-N 3.35Å; L162-A164 VanDerWaalsContact C-N 3.33Å
165D96.2Very high95.4Very high7 Ų758.4 Ų58.44%0.03729%0.288CS..  trans-130.391.7-175.6-167.3-10.2000113L128 S131 A161 L162 K167 L168 Q169L128-D165 HydrophobicContact CD2-CB 3.56Å; S131-D165 WeakPolarHBondContact CB-OD2 3.1Å; S131-D165 PolarHBondContact OG-OD1 3.15Å; S131-D165 PolarHBondContact OG-OD2 3.38Å; A161-D165 WeakPolarHBondContact O-CB 3.5Å; A161-D165 PolarHBondContact O-N 3.12Å; L162-D165 CarbonylContact O-C 3.57Å; L162-D165 PolarHBondContact O-N 2.95Å; D165-K167 PolarHBondContact O-N 2.66Å; D165-K167 VanDerWaalsContact O-N 3.16Å; D165-K167 VanDerWaalsContact OD1-CB 3.3Å; D165-K167 WeakPolarHBondContact OD1-CB 3.29Å; D165-K167 PolarHBondContact OD1-N 2.87Å; D165-L168 HydrophobicContact CB-CB 3.79Å; D165-L168 WeakPolarHBondContact O-CB 3.44Å; D165-L168 PolarHBondContact O-N 3.47Å; D165-L168 VanDerWaalsContact O-N 3.09Å; D165-L168 PolarHBondContact OD1-N 3.41Å; D165-Q169 PolarHBondContact O-N 3.43Å
166P95.3Very high95.5Very high83 Ų8357.6 Ų57.654%0.53928%0.284SS..Hα-helixtrans-59.2-26.7175-25.835000114Q169 Q170P166-Q169 PolarHBondContact O-N 3.32Å; P166-Q170 WeakPolarHBondContact O-CG 3.45Å; P166-Q170 PolarHBondContact O-N 3.07Å; P166-Q170 VanDerWaalsContact O-N 3.13Å
167K95.5Very high95.5Very high118 Ų11862 Ų6251%0.51331%0.313SS..Hα-helixtrans-72-38.1177.9-62.6178.6179.8174.40110.7D165 Q169 Q170 L171D165-K167 PolarHBondContact O-N 2.66Å; D165-K167 VanDerWaalsContact O-N 3.16Å; D165-K167 VanDerWaalsContact OD1-CB 3.3Å; D165-K167 WeakPolarHBondContact OD1-CB 3.29Å; D165-K167 PolarHBondContact OD1-N 2.87Å; K167-Q169 VanDerWaalsContact C-N 3.27Å; K167-Q169 PolarHBondContact O-N 3.28Å; K167-Q170 PolarHBondContact O-N 3.29Å; K167-L171 PolarHBondContact O-N 3.42Å
168L96.6Very high95.4Very high0 Ų066.7 Ų66.70%033%0.332CS..Hα-helixtrans-60.1-40.6174-170.867.3000111L137 A161 L162 D165 L171 R172 F185 W186 Y189L137-L168 HydrophobicContact CD1-CD1 3.86Å; L137-L168 HydrophobicContact CD2-CD1 4.44Å; A161-L168 HydrophobicContact CB-CD2 3.96Å; L162-L168 HydrophobicContact CD2-CD2 4.46Å; L162-L168 HydrophobicContact CD2-CG 4.36Å; D165-L168 HydrophobicContact CB-CB 3.79Å; D165-L168 WeakPolarHBondContact O-CB 3.44Å; D165-L168 PolarHBondContact O-N 3.47Å; D165-L168 VanDerWaalsContact O-N 3.09Å; D165-L168 PolarHBondContact OD1-N 3.41Å; L168-L171 PolarHBondContact O-N 2.99Å; L168-R172 WeakPolarHBondContact O-CB 3.45Å; L168-R172 PolarHBondContact O-N 3.09Å; L168-F185 HydrophobicContact CD1-CE1 4.36Å; L168-F185 HydrophobicContact CD1-CZ 3.73Å; L168-F185 HydrophobicContact CG-CZ 4.25Å; L168-W186 HydrophobicContact CD2-CH2 4.12Å; L168-W186 HydrophobicContact CD2-CZ3 4.11Å; L168-Y189 HydrophobicContact CD1-CD2 3.77Å; L168-Y189 HydrophobicContact CD1-CE2 3.76Å; L168-Y189 HydrophobicContact CD2-CD2 4.19Å; L168-Y189 HydrophobicContact CD2-CE1 4.29Å; L168-Y189 HydrophobicContact CD2-CE2 3.64Å; L168-Y189 HydrophobicContact CG-CE2 4.37Å
169Q95.3Very high95.3Very high111 Ų11172.5 Ų72.552%0.51936%0.357SS..Hα-helixtrans-62.3-44.2174.7-174.9179.3-15.600112.3L162 D165 P166 K167 R172 F173L162-Q169 HydrophobicContact CD2-CB 4.03Å; D165-Q169 PolarHBondContact O-N 3.43Å; P166-Q169 PolarHBondContact O-N 3.32Å; K167-Q169 VanDerWaalsContact C-N 3.27Å; K167-Q169 PolarHBondContact O-N 3.28Å; Q169-R172 PolarHBondContact O-N 3.46Å; Q169-F173 PolarHBondContact O-N 2.94Å
170Q95.6Very high95.4Very high135 Ų13569.9 Ų69.963%0.63135%0.347SS*.Hα-helixtrans-63.5-42.7176.6-70.7176.4400112.3P166 K167 F173 T174P166-Q170 WeakPolarHBondContact O-CG 3.45Å; P166-Q170 PolarHBondContact O-N 3.07Å; P166-Q170 VanDerWaalsContact O-N 3.13Å; K167-Q170 PolarHBondContact O-N 3.29Å; Q170-F173 PolarHBondContact O-N 2.86Å; Q170-T174 WeakPolarHBondContact O-CB 3.48Å; Q170-T174 PolarHBondContact O-N 3.09Å; Q170-T174 PolarHBondContact O-OG1 3.42Å
171L95.5Very high95.5Very high30 Ų3072.5 Ų72.516%0.15737%0.365CS..Hα-helixtrans-63.4-45.5174.7-76.7-177000111.3S131 L137 K167 L168 F173 T174 L175S131-L171 WeakPolarHBondContact O-CD1 3.33Å; L137-L171 HydrophobicContact CD1-CB 4.29Å; L137-L171 HydrophobicContact CD1-CD1 3.7Å; K167-L171 PolarHBondContact O-N 3.42Å; L168-L171 PolarHBondContact O-N 2.99Å; L171-F173 VanDerWaalsContact C-N 3.32Å; L171-F173 PolarHBondContact O-N 3.22Å; L171-T174 CarbonylContact O-C 3.35Å; L171-T174 PolarHBondContact O-N 3.24Å; L171-L175 HydrophobicContact CB-CD1 4.35Å; L171-L175 WeakPolarHBondContact O-CB 3.37Å; L171-L175 WeakPolarHBondContact O-CG 3.42Å; L171-L175 PolarHBondContact O-N 3.31Å
172R96.4Very high95.5Very high86 Ų8674.6 Ų74.633%0.32538%0.375SS..Hα-helixtrans-54.2-48.9175.9-179.7-179.4170.1-125.83.6111.5L168 Q169 T174 L175 V176 E182 F185L168-R172 WeakPolarHBondContact O-CB 3.45Å; L168-R172 PolarHBondContact O-N 3.09Å; Q169-R172 PolarHBondContact O-N 3.46Å; R172-T174 PolarHBondContact O-N 3.41Å; R172-L175 PolarHBondContact O-N 3.32Å; R172-V176 HydrophobicContact CG-CG2 4.46Å; R172-V176 WeakPolarHBondContact O-CB 3.44Å; R172-V176 PolarHBondContact O-N 2.91Å; R172-E182 IonicContact CZ-OE1 3.97Å; R172-E182 IonicContact CZ-OE2 2.71Å; R172-E182 VanDerWaalsContact NE-CD 3.33Å; R172-E182 IonicContact NE-OE1 2.62Å; R172-E182 PolarHBondContact NE-OE1 2.92Å; R172-E182 IonicContact NE-OE2 2.55Å; R172-E182 PolarHBondContact NE-OE2 2.94Å; R172-E182 VanDerWaalsContact NE-OE2 3.13Å; R172-E182 IonicContact NH2-OE1 3.76Å; R172-E182 PolarHBondContact NH2-OE1 3.11Å; R172-E182 IonicContact NH2-OE2 3.86Å; R172-F185 HydrophobicContact CB-CE1 4.1Å; R172-F185 HydrophobicContact CB-CE2 4.28Å; R172-F185 HydrophobicContact CB-CZ 3.82Å; R172-F185 HydrophobicContact CG-CE1 4.26Å; R172-F185 HydrophobicContact CG-CZ 4.42Å
173F95.7Very high95.5Very high170 Ų17078.1 Ų78.175%0.74639%0.39SS*.Hα-helixtrans-63.1-30.6177.7-175.5-101.9000113.3Q169 Q170 L171Q169-F173 PolarHBondContact O-N 2.94Å; Q170-F173 PolarHBondContact O-N 2.86Å; L171-F173 VanDerWaalsContact C-N 3.32Å; L171-F173 PolarHBondContact O-N 3.22Å
174T95Very high95.7Very high71 Ų7172.4 Ų72.444%0.43637%0.366SS..Hα-helixtrans-81.9-35.7-179.7-56.80000112.3Q170 L171 R172 K178Q170-T174 WeakPolarHBondContact O-CB 3.48Å; Q170-T174 PolarHBondContact O-N 3.09Å; Q170-T174 PolarHBondContact O-OG1 3.42Å; L171-T174 CarbonylContact O-C 3.35Å; L171-T174 PolarHBondContact O-N 3.24Å; R172-T174 PolarHBondContact O-N 3.41Å; T174-K178 WeakPolarHBondContact O-CD 3.37Å
175L95.2Very high95.8Very high0 Ų070.7 Ų70.70%035%0.352CS..Hα-helixtrans-94.6-28.9-173.1-58.1177.8000113.6E134 L138 L171 R172 P177 K178 K179 I180 F185E134-L175 VanDerWaalsContact CD-CD2 3.48Å; E134-L175 HydrophobicContact CG-CD1 3.9Å; E134-L175 HydrophobicContact CG-CD2 3.7Å; E134-L175 HydrophobicContact CG-CG 4.37Å; E134-L175 WeakPolarHBondContact OE1-CD2 3.12Å; L138-L175 HydrophobicContact CD2-CD1 4.26Å; L138-L175 HydrophobicContact CD2-CD2 4.37Å; L171-L175 HydrophobicContact CB-CD1 4.35Å; L171-L175 WeakPolarHBondContact O-CB 3.37Å; L171-L175 WeakPolarHBondContact O-CG 3.42Å; L171-L175 PolarHBondContact O-N 3.31Å; R172-L175 PolarHBondContact O-N 3.32Å; L175-P177 CarbonylContact O-C 3.59Å; L175-K178 PolarHBondContact O-N 3.22Å; L175-K179 HydrophobicContact CD2-CD 3.85Å; L175-K179 HydrophobicContact CD2-CG 4.47Å; L175-K179 PolarHBondContact O-N 3.13Å; L175-I180 PolarHBondContact O-N 3.07Å; L175-F185 HydrophobicContact CD1-CD2 4.41Å; L175-F185 HydrophobicContact CD1-CE2 4.25Å
176V96.7Very high95.9Very high23 Ų2370.4 Ų70.414%0.13935%0.35CS..THydrogen-bonded Turntrans-109.4129.7-175.6-174.50000110.4R172 K178 I180 E182 F185R172-V176 HydrophobicContact CG-CG2 4.46Å; R172-V176 WeakPolarHBondContact O-CB 3.44Å; R172-V176 PolarHBondContact O-N 2.91Å; V176-K178 VanDerWaalsContact C-N 3.3Å; V176-I180 HydrophobicContact CG2-CG1 4.43Å; V176-E182 HydrophobicContact CG1-CB 4.03Å; V176-E182 WeakPolarHBondContact CG1-OE2 3.42Å; V176-F185 HydrophobicContact CG2-CB 3.81Å; V176-F185 HydrophobicContact CG2-CD2 4.18Å; V176-F185 HydrophobicContact CG2-CG 4.04Å
177P94.3Very high96Very high115 Ų11570.2 Ų70.275%0.74734%0.339SS*.THydrogen-bonded Turncis-85.710.8-5.535.6-36.1000113.6L175 K179 I180L175-P177 CarbonylContact O-C 3.59Å; P177-K179 PolarHBondContact O-N 3.42Å; P177-I180 WeakPolarHBondContact CA-O 3.26Å
178K94.8Very high96Very high159 Ų15964.6 Ų64.669%0.69131%0.314SS*.THydrogen-bonded Turntrans-60.5-40.1-166.4-63.6-170.2-171.4166.80114.6T174 L175 V176T174-K178 WeakPolarHBondContact O-CD 3.37Å; L175-K178 PolarHBondContact O-N 3.22Å; V176-K178 VanDerWaalsContact C-N 3.3Å
179K94.2Very high96.1Very high125 Ų12564.6 Ų64.654%0.54331%0.314SS..THydrogen-bonded Turntrans-115.3-39.4-178.2-66.3-166.5-178.3178.10112.2E134 L138 L175 P177E134-K179 IonicContact OE1-NZ 3.08Å; E134-K179 PolarHBondContact OE1-NZ 3.04Å; E134-K179 IonicContact OE2-NZ 2.85Å; L138-K179 HydrophobicContact CD1-CD 4.26Å; L138-K179 HydrophobicContact CD2-CB 4.18Å; L138-K179 HydrophobicContact CD2-CD 4.41Å; L175-K179 HydrophobicContact CD2-CD 3.85Å; L175-K179 HydrophobicContact CD2-CG 4.47Å; L175-K179 PolarHBondContact O-N 3.13Å; P177-K179 PolarHBondContact O-N 3.42Å
180I96.7Very high96.2Very high27 Ų2759.6 Ų59.614%0.13829%0.291CS..SBendtrans-142.5159.3-178.157.9172.3000111.2L138 L175 V176 P177 T184 F185L138-I180 HydrophobicContact CD2-CD1 3.89Å; L138-I180 HydrophobicContact CD2-CG1 4.11Å; L138-I180 HydrophobicContact CD2-CG2 3.92Å; L175-I180 PolarHBondContact O-N 3.07Å; V176-I180 HydrophobicContact CG2-CG1 4.43Å; P177-I180 WeakPolarHBondContact CA-O 3.26Å; I180-T184 HydrophobicContact CB-CG2 4.33Å; I180-T184 HydrophobicContact CG2-CG2 4.43Å; I180-F185 HydrophobicContact CD1-CB 3.66Å; I180-F185 HydrophobicContact CD1-CD2 4.08Å; I180-F185 HydrophobicContact CD1-CG 4.37Å; I180-F185 HydrophobicContact CG1-CB 4.2Å
181S97.1Very high96.3Very high56 Ų5653.9 Ų53.939%0.39226%0.264SS..  trans-71.8159.9174.581.20000111.6E183 T184 F185S181-E183 VanDerWaalsContact C-N 3.3Å; S181-E183 PolarHBondContact O-N 3.25Å; S181-T184 PolarHBondContact O-N 3.19Å; S181-T184 WeakPolarHBondContact OG-CB 3.44Å; S181-T184 PolarHBondContact OG-N 3.11Å; S181-T184 PolarHBondContact OG-OG1 3.5Å; S181-F185 WeakPolarHBondContact O-CB 3.46Å; S181-F185 PolarHBondContact O-N 2.92Å
182E96.5Very high96.3Very high44 Ų4454 Ų5421%0.20626%0.262CS..Hα-helixtrans-56.3-45.4174.1-173.570.3-172.200111.1F151 R172 V176 T184 F185 W186F151-E182 HydrophobicContact CE1-CG 4.37Å; F151-E182 HydrophobicContact CE2-CG 4.2Å; F151-E182 HydrophobicContact CZ-CG 3.65Å; R172-E182 IonicContact CZ-OE1 3.97Å; R172-E182 IonicContact CZ-OE2 2.71Å; R172-E182 VanDerWaalsContact NE-CD 3.33Å; R172-E182 IonicContact NE-OE1 2.62Å; R172-E182 PolarHBondContact NE-OE1 2.92Å; R172-E182 IonicContact NE-OE2 2.55Å; R172-E182 PolarHBondContact NE-OE2 2.94Å; R172-E182 VanDerWaalsContact NE-OE2 3.13Å; R172-E182 IonicContact NH2-OE1 3.76Å; R172-E182 PolarHBondContact NH2-OE1 3.11Å; R172-E182 IonicContact NH2-OE2 3.86Å; V176-E182 HydrophobicContact CG1-CB 4.03Å; V176-E182 WeakPolarHBondContact CG1-OE2 3.42Å; E182-T184 PolarHBondContact O-N 3.06Å; E182-F185 PolarHBondContact O-N 3.43Å; E182-W186 PolarHBondContact O-N 3.05Å; E182-W186 VanDerWaalsContact O-N 3.12Å; E182-W186 PolarHBondContact OE1-NE1 3.38Å
183E96Very high96.3Very high92 Ų9250.1 Ų50.143%0.4325%0.248SC..Hα-helixtrans-61.6-46.2178.6-171.8-173.415600111.6F149 F151 S181 W186 R187F149-E183 HydrophobicContact CE1-CG 3.92Å; F151-E183 HydrophobicContact CB-CG 4.24Å; S181-E183 VanDerWaalsContact C-N 3.3Å; S181-E183 PolarHBondContact O-N 3.25Å; E183-W186 PolarHBondContact O-N 3Å; E183-R187 VanDerWaalsContact O-CB 3.26Å; E183-R187 WeakPolarHBondContact O-CB 3.4Å; E183-R187 PolarHBondContact O-N 3.25Å; E183-R187 IonicContact OE1-CZ 3.52Å; E183-R187 IonicContact OE1-NH2 3.13Å; E183-R187 PolarHBondContact OE1-NH2 3.45Å
184T96.3Very high96.3Very high32 Ų3243.1 Ų43.120%0.19622%0.22CC..Hα-helixtrans-63.3-43179.1-51.90000111.3E140 I180 S181 E182 W186 R187 N188E140-T184 HydrophobicContact CG-CG2 4.42Å; I180-T184 HydrophobicContact CB-CG2 4.33Å; I180-T184 HydrophobicContact CG2-CG2 4.43Å; S181-T184 PolarHBondContact O-N 3.19Å; S181-T184 WeakPolarHBondContact OG-CB 3.44Å; S181-T184 PolarHBondContact OG-N 3.11Å; S181-T184 PolarHBondContact OG-OG1 3.5Å; E182-T184 PolarHBondContact O-N 3.06Å; T184-W186 PolarHBondContact O-N 2.96Å; T184-R187 PolarHBondContact O-N 3.03Å; T184-N188 WeakPolarHBondContact O-CB 3.37Å; T184-N188 PolarHBondContact O-N 3.37Å; T184-N188 PolarHBondContact O-ND2 3.18Å; T184-N188 PolarHBondContact O-OD1 2.58Å
185F97.5Very high96.3Very high0 Ų043.4 Ų43.40%022%0.219CC..Hα-helixtrans-56-50.4177.1174.2-88.9000111.2L137 L168 R172 L175 V176 I180 S181 E182 N188 Y189L137-F185 HydrophobicContact CB-CD2 4.43Å; L137-F185 HydrophobicContact CB-CE2 4.25Å; L137-F185 HydrophobicContact CD1-CE2 3.61Å; L137-F185 HydrophobicContact CD1-CZ 3.98Å; L137-F185 HydrophobicContact CG-CE2 4.47Å; L168-F185 HydrophobicContact CD1-CE1 4.36Å; L168-F185 HydrophobicContact CD1-CZ 3.73Å; L168-F185 HydrophobicContact CG-CZ 4.25Å; R172-F185 HydrophobicContact CB-CE1 4.1Å; R172-F185 HydrophobicContact CB-CE2 4.28Å; R172-F185 HydrophobicContact CB-CZ 3.82Å; R172-F185 HydrophobicContact CG-CE1 4.26Å; R172-F185 HydrophobicContact CG-CZ 4.42Å; L175-F185 HydrophobicContact CD1-CD2 4.41Å; L175-F185 HydrophobicContact CD1-CE2 4.25Å; V176-F185 HydrophobicContact CG2-CB 3.81Å; V176-F185 HydrophobicContact CG2-CD2 4.18Å; V176-F185 HydrophobicContact CG2-CG 4.04Å; I180-F185 HydrophobicContact CD1-CB 3.66Å; I180-F185 HydrophobicContact CD1-CD2 4.08Å; I180-F185 HydrophobicContact CD1-CG 4.37Å; I180-F185 HydrophobicContact CG1-CB 4.2Å; S181-F185 WeakPolarHBondContact O-CB 3.46Å; S181-F185 PolarHBondContact O-N 2.92Å; E182-F185 PolarHBondContact O-N 3.43Å; F185-N188 PolarHBondContact O-N 3.02Å; F185-Y189 WeakPolarHBondContact O-CB 3.47Å; F185-Y189 PolarHBondContact O-N 3.04Å
186W97.7Very high96.4Very high2 Ų244.2 Ų44.21%0.00822%0.223CC..Hα-helixtrans-70.2-40.6-179.6-71.6114.5000112.8F149 F151 A158 A161 L162 L168 E182 E183 T184 N188 Y189 F190F149-W186 HydrophobicContact CE2-CB 4.28Å; F149-W186 HydrophobicContact CZ-CB 3.68Å; F151-W186 HydrophobicContact CD2-CB 4.24Å; F151-W186 HydrophobicContact CD2-CG 4.36Å; F151-W186 HydrophobicContact CE2-CB 4.28Å; F151-W186 AromaticContact CE2-CD1 3.26Å; F151-W186 AromaticContact CE2-CG 3.92Å; F151-W186 HydrophobicContact CE2-CG 3.92Å; F151-W186 AromaticContact CE2-NE1 3.93Å; A158-W186 HydrophobicContact CB-CD2 3.91Å; A158-W186 HydrophobicContact CB-CE3 3.89Å; A158-W186 HydrophobicContact CB-CH2 3.84Å; A158-W186 HydrophobicContact CB-CZ2 3.83Å; A158-W186 HydrophobicContact CB-CZ3 3.86Å; A161-W186 HydrophobicContact CB-CZ3 4.5Å; L162-W186 HydrophobicContact CD1-CH2 4.21Å; L162-W186 HydrophobicContact CD1-CZ2 3.95Å; L162-W186 HydrophobicContact CD2-CH2 3.81Å; L162-W186 HydrophobicContact CD2-CZ2 4.05Å; L162-W186 HydrophobicContact CG-CH2 3.73Å; L162-W186 HydrophobicContact CG-CZ2 3.98Å; L168-W186 HydrophobicContact CD2-CH2 4.12Å; L168-W186 HydrophobicContact CD2-CZ3 4.11Å; E182-W186 PolarHBondContact O-N 3.05Å; E182-W186 VanDerWaalsContact O-N 3.12Å; E182-W186 PolarHBondContact OE1-NE1 3.38Å; E183-W186 PolarHBondContact O-N 3Å; T184-W186 PolarHBondContact O-N 2.96Å; W186-N188 VanDerWaalsContact C-N 3.26Å; W186-N188 PolarHBondContact O-N 2.95Å; W186-Y189 AromaticContact CE3-CD1 3.9Å; W186-Y189 HydrophobicContact CE3-CD1 3.9Å; W186-Y189 HydrophobicContact CE3-CG 4.31Å; W186-Y189 AromaticContact CZ3-CD1 3.83Å; W186-Y189 HydrophobicContact CZ3-CD1 3.83Å; W186-Y189 HydrophobicContact CZ3-CE1 4.2Å; W186-Y189 HydrophobicContact CZ3-CG 4.3Å; W186-Y189 PolarHBondContact O-N 3.42Å; W186-F190 HydrophobicContact CB-CD2 4.09Å; W186-F190 HydrophobicContact CB-CE2 4.09Å; W186-F190 HydrophobicContact CD2-CE2 4.13Å; W186-F190 HydrophobicContact CE3-CD2 4.18Å; W186-F190 AromaticContact CE3-CE2 3.52Å; W186-F190 HydrophobicContact CE3-CE2 3.52Å; W186-F190 HydrophobicContact CE3-CZ 4.02Å; W186-F190 HydrophobicContact CG-CE2 4.39Å; W186-F190 HydrophobicContact CZ3-CE2 4.32Å; W186-F190 HydrophobicContact CZ3-CZ 4.39Å; W186-F190 WeakPolarHBondContact O-CB 3.34Å; W186-F190 WeakPolarHBondContact O-CD2 3.14Å; W186-F190 PolarHBondContact O-N 3.16Å
187R97.2Very high96.3Very high78 Ų7847.2 Ų47.229%0.29423%0.231SC..Hα-helixtrans-53.9-46.2174-174.7-179-68.2-89.8-0.9111P141 F147 F149 E183 T184 F191P141-R187 HydrophobicContact CG-CG 4.29Å; F147-R187 HydrophobicContact CE1-CG 4.1Å; F147-R187 WeakPolarHBondContact CE1-O 3.45Å; F149-R187 HydrophobicContact CB-CG 4.13Å; F149-R187 HydrophobicContact CD1-CB 3.54Å; F149-R187 HydrophobicContact CD1-CG 3.76Å; F149-R187 HydrophobicContact CE1-CB 3.67Å; F149-R187 HydrophobicContact CE1-CG 4.4Å; F149-R187 HydrophobicContact CG-CB 4.02Å; F149-R187 HydrophobicContact CG-CG 3.98Å; F149-R187 HydrophobicContact CZ-CB 4.27Å; E183-R187 VanDerWaalsContact O-CB 3.26Å; E183-R187 WeakPolarHBondContact O-CB 3.4Å; E183-R187 PolarHBondContact O-N 3.25Å; E183-R187 IonicContact OE1-CZ 3.52Å; E183-R187 IonicContact OE1-NH2 3.13Å; E183-R187 PolarHBondContact OE1-NH2 3.45Å; T184-R187 PolarHBondContact O-N 3.03Å; R187-F191 VanDerWaalsContact O-CB 3.27Å; R187-F191 WeakPolarHBondContact O-CB 3.3Å; R187-F191 PolarHBondContact O-N 3.33Å
188N96.7Very high96.3Very high0 Ų046.1 Ų46.10%022%0.215CC..Hα-helixtrans-67.2-47179.6-64.7-5.7000111.6L137 L138 E140 P141 T184 F185 W186 F191 R192L137-N188 WeakPolarHBondContact O-CB 3.4Å; L137-N188 PolarHBondContact O-ND2 3.18Å; L138-N188 PolarHBondContact O-ND2 3.48Å; E140-N188 WeakPolarHBondContact CA-OD1 3.45Å; P141-N188 WeakPolarHBondContact CD-OD1 3.26Å; T184-N188 WeakPolarHBondContact O-CB 3.37Å; T184-N188 PolarHBondContact O-N 3.37Å; T184-N188 PolarHBondContact O-ND2 3.18Å; T184-N188 PolarHBondContact O-OD1 2.58Å; F185-N188 PolarHBondContact O-N 3.02Å; W186-N188 VanDerWaalsContact C-N 3.26Å; W186-N188 PolarHBondContact O-N 2.95Å; N188-F191 PolarHBondContact O-N 3.46Å; N188-R192 WeakPolarHBondContact O-CG 3.46Å; N188-R192 PolarHBondContact O-N 3.49Å
189Y97.6Very high96.2Very high0 Ų041 Ų410%020%0.202CC..Hα-helixtrans-57.9-55.2177.5177.8-98.8000111.8P113 L130 L137 A161 L168 F185 W186 F191 R192 V193P113-Y189 HydrophobicContact CG-CE1 4.32Å; L130-Y189 HydrophobicContact CB-CE2 4.44Å; L130-Y189 HydrophobicContact CD1-CD2 4.3Å; L130-Y189 HydrophobicContact CD1-CE2 4.08Å; L137-Y189 HydrophobicContact CD2-CD2 3.73Å; L137-Y189 HydrophobicContact CD2-CG 4.45Å; A161-Y189 HydrophobicContact CB-CE1 3.95Å; L168-Y189 HydrophobicContact CD1-CD2 3.77Å; L168-Y189 HydrophobicContact CD1-CE2 3.76Å; L168-Y189 HydrophobicContact CD2-CD2 4.19Å; L168-Y189 HydrophobicContact CD2-CE1 4.29Å; L168-Y189 HydrophobicContact CD2-CE2 3.64Å; L168-Y189 HydrophobicContact CG-CE2 4.37Å; F185-Y189 WeakPolarHBondContact O-CB 3.47Å; F185-Y189 PolarHBondContact O-N 3.04Å; W186-Y189 AromaticContact CE3-CD1 3.9Å; W186-Y189 HydrophobicContact CE3-CD1 3.9Å; W186-Y189 HydrophobicContact CE3-CG 4.31Å; W186-Y189 AromaticContact CZ3-CD1 3.83Å; W186-Y189 HydrophobicContact CZ3-CD1 3.83Å; W186-Y189 HydrophobicContact CZ3-CE1 4.2Å; W186-Y189 HydrophobicContact CZ3-CG 4.3Å; W186-Y189 PolarHBondContact O-N 3.42Å; Y189-F191 VanDerWaalsContact C-N 3.27Å; Y189-F191 PolarHBondContact O-N 3.25Å; Y189-R192 WeakPolarHBondContact O-CB 3.36Å; Y189-R192 PolarHBondContact O-N 3.15Å; Y189-V193 HydrophobicContact CD1-CG2 4.09Å; Y189-V193 HydrophobicContact CE1-CG2 3.68Å; Y189-V193 HydrophobicContact CE2-CG2 4.36Å; Y189-V193 WeakPolarHBondContact O-CG2 3.36Å; Y189-V193 PolarHBondContact O-N 3.36Å
190F97.6Very high96.1Very high6 Ų635.7 Ų35.73%0.02618%0.182CC..Hα-helixtrans-67.4-28.3-177.4-73.7-63000113.1P113 F147 F149 Y154 Q157 A158 W186 V193 S194P113-F190 HydrophobicContact CB-CD1 4.33Å; P113-F190 HydrophobicContact CB-CE1 3.92Å; P113-F190 HydrophobicContact CG-CE1 4.25Å; F147-F190 HydrophobicContact CZ-CB 4.05Å; F149-F190 HydrophobicContact CD2-CB 4.44Å; F149-F190 HydrophobicContact CD2-CD2 4.41Å; F149-F190 HydrophobicContact CE2-CB 4.42Å; F149-F190 AromaticContact CE2-CD2 3.62Å; F149-F190 HydrophobicContact CE2-CD2 3.62Å; F149-F190 HydrophobicContact CE2-CE2 4.35Å; F149-F190 HydrophobicContact CE2-CG 4.4Å; F149-F190 HydrophobicContact CZ-CD2 4.44Å; Y154-F190 HydrophobicContact CD1-CB 4.19Å; Y154-F190 AromaticContact CD1-CD1 3.64Å; Y154-F190 HydrophobicContact CD1-CD1 3.64Å; Y154-F190 AromaticContact CD1-CD2 3.74Å; Y154-F190 HydrophobicContact CD1-CD2 3.74Å; Y154-F190 AromaticContact CD1-CE1 3.87Å; Y154-F190 HydrophobicContact CD1-CE1 3.87Å; Y154-F190 AromaticContact CD1-CE2 3.94Å; Y154-F190 HydrophobicContact CD1-CE2 3.94Å; Y154-F190 AromaticContact CD1-CG 3.57Å; Y154-F190 HydrophobicContact CD1-CG 3.57Å; Y154-F190 HydrophobicContact CD1-CZ 4Å; Y154-F190 HydrophobicContact CE1-CB 4.14Å; Y154-F190 AromaticContact CE1-CD1 3.99Å; Y154-F190 HydrophobicContact CE1-CD1 3.99Å; Y154-F190 AromaticContact CE1-CG 3.97Å; Y154-F190 HydrophobicContact CE1-CG 3.97Å; Y154-F190 HydrophobicContact CG-CD2 4.17Å; Y154-F190 HydrophobicContact CG-CE2 4.26Å; Y154-F190 HydrophobicContact CG-CG 4.42Å; Q157-F190 HydrophobicContact CB-CE1 3.82Å; Q157-F190 HydrophobicContact CB-CZ 3.93Å; A158-F190 HydrophobicContact CB-CE2 4.15Å; A158-F190 HydrophobicContact CB-CZ 3.99Å; W186-F190 HydrophobicContact CB-CD2 4.09Å; W186-F190 HydrophobicContact CB-CE2 4.09Å; W186-F190 HydrophobicContact CD2-CE2 4.13Å; W186-F190 HydrophobicContact CE3-CD2 4.18Å; W186-F190 AromaticContact CE3-CE2 3.52Å; W186-F190 HydrophobicContact CE3-CE2 3.52Å; W186-F190 HydrophobicContact CE3-CZ 4.02Å; W186-F190 HydrophobicContact CG-CE2 4.39Å; W186-F190 HydrophobicContact CZ3-CE2 4.32Å; W186-F190 HydrophobicContact CZ3-CZ 4.39Å; W186-F190 WeakPolarHBondContact O-CB 3.34Å; W186-F190 WeakPolarHBondContact O-CD2 3.14Å; W186-F190 PolarHBondContact O-N 3.16Å; F190-V193 PolarHBondContact O-N 2.97Å; F190-S194 WeakPolarHBondContact O-CB 3.28Å; F190-S194 PolarHBondContact O-N 3.19Å
191F97.2Very high95.9Very high15 Ų1539.4 Ų39.47%0.06620%0.198CC..Hα-helixtrans-61.3-47.4170.1177.4-115.7000111.1P141 F147 R187 N188 Y189 V193 S194 L195P141-F191 HydrophobicContact CB-CB 4.4Å; P141-F191 HydrophobicContact CB-CD1 3.79Å; P141-F191 HydrophobicContact CB-CD2 3.94Å; P141-F191 HydrophobicContact CB-CE1 3.98Å; P141-F191 HydrophobicContact CB-CE2 4.11Å; P141-F191 HydrophobicContact CB-CG 3.78Å; P141-F191 HydrophobicContact CB-CZ 4.13Å; P141-F191 HydrophobicContact CG-CB 3.73Å; P141-F191 HydrophobicContact CG-CD1 3.85Å; P141-F191 HydrophobicContact CG-CD2 4.18Å; P141-F191 HydrophobicContact CG-CG 3.66Å; F147-F191 HydrophobicContact CB-CD2 3.79Å; F147-F191 HydrophobicContact CB-CE2 4.1Å; F147-F191 HydrophobicContact CD1-CB 3.93Å; F147-F191 AromaticContact CD1-CD2 3.77Å; F147-F191 HydrophobicContact CD1-CD2 3.77Å; F147-F191 HydrophobicContact CD1-CG 4.23Å; F147-F191 AromaticContact CD2-CD2 3.95Å; F147-F191 HydrophobicContact CD2-CD2 3.95Å; F147-F191 HydrophobicContact CE1-CB 3.64Å; F147-F191 HydrophobicContact CE1-CD2 4.33Å; F147-F191 HydrophobicContact CE1-CG 4.42Å; F147-F191 HydrophobicContact CE2-CB 4.3Å; F147-F191 HydrophobicContact CG-CB 4.37Å; F147-F191 AromaticContact CG-CD2 3.55Å; F147-F191 HydrophobicContact CG-CD2 3.55Å; F147-F191 HydrophobicContact CG-CE2 4.36Å; F147-F191 HydrophobicContact CG-CG 4.4Å; F147-F191 HydrophobicContact CZ-CB 3.85Å; F147-F191 VanDerWaalsContact CZ-N 3.33Å; R187-F191 VanDerWaalsContact O-CB 3.27Å; R187-F191 WeakPolarHBondContact O-CB 3.3Å; R187-F191 PolarHBondContact O-N 3.33Å; N188-F191 PolarHBondContact O-N 3.46Å; Y189-F191 VanDerWaalsContact C-N 3.27Å; Y189-F191 PolarHBondContact O-N 3.25Å; F191-V193 PolarHBondContact O-N 3.01Å; F191-S194 WeakPolarHBondContact O-CB 3.3Å; F191-S194 PolarHBondContact O-N 2.86Å; F191-S194 VanDerWaalsContact O-N 3.15Å; F191-S194 PolarHBondContact O-OG 2.87Å; F191-L195 HydrophobicContact CD1-CD1 4.36Å; F191-L195 HydrophobicContact CE1-CD1 3.82Å; F191-L195 HydrophobicContact CE1-CG 4.43Å; F191-L195 HydrophobicContact CE2-CD2 4.31Å; F191-L195 HydrophobicContact CE2-CG 4.47Å; F191-L195 HydrophobicContact CZ-CD1 3.99Å; F191-L195 HydrophobicContact CZ-CD2 4.19Å; F191-L195 HydrophobicContact CZ-CG 4.26Å; F191-L195 WeakPolarHBondContact O-CG 3.34Å; F191-L195 PolarHBondContact O-N 3.32Å; F191-L195 VanDerWaalsContact O-N 3.09Å
192R96.8Very high95.5Very high34 Ų3445.8 Ų45.813%0.12821%0.214CC..Hα-helixtrans-61.9-42.7175.9-62.7-63.3-175.8-95.6-26.5112.2L130 N136 R139 N188 Y189 S194 L195 I196L130-R192 HydrophobicContact CD1-CB 3.66Å; L130-R192 HydrophobicContact CD2-CB 3.72Å; L130-R192 HydrophobicContact CD2-CG 4.19Å; L130-R192 HydrophobicContact CG-CB 4.35Å; N136-R192 PolarHBondContact O-NH2 3.36Å; R139-R192 VanDerWaalsContact CB-NH2 3.35Å; R139-R192 PolarHBondContact O-NH2 3.13Å; N188-R192 WeakPolarHBondContact O-CG 3.46Å; N188-R192 PolarHBondContact O-N 3.49Å; Y189-R192 WeakPolarHBondContact O-CB 3.36Å; Y189-R192 PolarHBondContact O-N 3.15Å; R192-S194 VanDerWaalsContact C-N 3.27Å; R192-S194 PolarHBondContact O-N 3.42Å; R192-L195 WeakPolarHBondContact O-CB 3.29Å; R192-L195 PolarHBondContact O-N 3.25Å; R192-L195 VanDerWaalsContact O-N 3.11Å; R192-I196 WeakPolarHBondContact O-CG1 3.43Å; R192-I196 PolarHBondContact O-N 3.19Å
193V96.3Very high95.1Very high4 Ų449.7 Ų49.72%0.02423%0.232CC..Hα-helixtrans-59.1-40.9174.6176.80000111.1P113 L130 Y189 F190 F191 L195 I196 R197P113-V193 HydrophobicContact CB-CG1 3.94Å; P113-V193 HydrophobicContact CG-CG1 4.18Å; P113-V193 HydrophobicContact CG-CG2 4.45Å; L130-V193 HydrophobicContact CD1-CG2 3.92Å; Y189-V193 HydrophobicContact CD1-CG2 4.09Å; Y189-V193 HydrophobicContact CE1-CG2 3.68Å; Y189-V193 HydrophobicContact CE2-CG2 4.36Å; Y189-V193 WeakPolarHBondContact O-CG2 3.36Å; Y189-V193 PolarHBondContact O-N 3.36Å; F190-V193 PolarHBondContact O-N 2.97Å; F191-V193 PolarHBondContact O-N 3.01Å; V193-L195 VanDerWaalsContact C-N 3.3Å; V193-L195 PolarHBondContact O-N 3.43Å; V193-I196 PolarHBondContact O-N 3.21Å; V193-R197 HydrophobicContact CG1-CG 4.39Å; V193-R197 WeakPolarHBondContact O-CG 3.3Å; V193-R197 PolarHBondContact O-N 3.23Å
194S95.4Very high94.3Very high22 Ų2249.5 Ų49.515%0.15423%0.231CC..Hα-helixtrans-62.9-35.7176.684.10000112.6F190 F191 R192 K198F190-S194 WeakPolarHBondContact O-CB 3.28Å; F190-S194 PolarHBondContact O-N 3.19Å; F191-S194 WeakPolarHBondContact O-CB 3.3Å; F191-S194 PolarHBondContact O-N 2.86Å; F191-S194 VanDerWaalsContact O-N 3.15Å; F191-S194 PolarHBondContact O-OG 2.87Å; R192-S194 VanDerWaalsContact C-N 3.27Å; R192-S194 PolarHBondContact O-N 3.42Å; S194-K198 WeakPolarHBondContact O-CB 3.49Å; S194-K198 VanDerWaalsContact O-CG 3.26Å; S194-K198 WeakPolarHBondContact O-CG 3.21Å; S194-K198 PolarHBondContact O-N 3.01Å
195L95.4Very high93.4Very high78 Ų7852.1 Ų52.141%0.40825%0.247SC..Hα-helixtrans-67.9-43.2175.5-63.7178.9000111.3F191 R192 V193 K198 A199F191-L195 HydrophobicContact CD1-CD1 4.36Å; F191-L195 HydrophobicContact CE1-CD1 3.82Å; F191-L195 HydrophobicContact CE1-CG 4.43Å; F191-L195 HydrophobicContact CE2-CD2 4.31Å; F191-L195 HydrophobicContact CE2-CG 4.47Å; F191-L195 HydrophobicContact CZ-CD1 3.99Å; F191-L195 HydrophobicContact CZ-CD2 4.19Å; F191-L195 HydrophobicContact CZ-CG 4.26Å; F191-L195 WeakPolarHBondContact O-CG 3.34Å; F191-L195 PolarHBondContact O-N 3.32Å; F191-L195 VanDerWaalsContact O-N 3.09Å; R192-L195 WeakPolarHBondContact O-CB 3.29Å; R192-L195 PolarHBondContact O-N 3.25Å; R192-L195 VanDerWaalsContact O-N 3.11Å; V193-L195 VanDerWaalsContact C-N 3.3Å; V193-L195 PolarHBondContact O-N 3.43Å; L195-K198 PolarHBondContact O-N 3.19Å; L195-A199 WeakPolarHBondContact O-CB 3.08Å; L195-A199 PolarHBondContact O-N 3.31Å
196I96Very high92.6Very high17 Ų1754.4 Ų54.49%0.08727%0.266CS..Hα-helixtrans-60.1-47.1176.6-67.3166.2000110.3V123 Q126 L130 R192 V193 A199 A200V123-I196 HydrophobicContact CB-CG2 4.39Å; V123-I196 HydrophobicContact CG1-CG2 3.92Å; Q126-I196 HydrophobicContact CB-CD1 3.93Å; Q126-I196 HydrophobicContact CB-CG1 4.21Å; Q126-I196 HydrophobicContact CB-CG2 3.65Å; Q126-I196 HydrophobicContact CG-CG2 4.44Å; L130-I196 HydrophobicContact CD1-CD1 3.83Å; L130-I196 HydrophobicContact CD2-CD1 4.07Å; L130-I196 HydrophobicContact CG-CD1 3.98Å; R192-I196 WeakPolarHBondContact O-CG1 3.43Å; R192-I196 PolarHBondContact O-N 3.19Å; V193-I196 PolarHBondContact O-N 3.21Å; I196-A199 PolarHBondContact O-N 2.66Å; I196-A200 PolarHBondContact O-N 3.28Å
197R94.9Very high91.6Very high85 Ų8557.3 Ų57.332%0.32129%0.29SS..Hα-helixtrans-59.8-49.3178.4-71.9177.661.1163.8-3.2112.1P113 V123 V193 A199 A200 E201P113-R197 PolarHBondContact O-NH1 3.39Å; V123-R197 HydrophobicContact CG1-CG 4.07Å; V193-R197 HydrophobicContact CG1-CG 4.39Å; V193-R197 WeakPolarHBondContact O-CG 3.3Å; V193-R197 PolarHBondContact O-N 3.23Å; R197-A199 VanDerWaalsContact C-N 3.25Å; R197-A199 PolarHBondContact O-N 2.82Å; R197-A200 PolarHBondContact O-N 3.42Å; R197-E201 WeakPolarHBondContact O-CG 3.1Å; R197-E201 PolarHBondContact O-N 3.47Å
198K94.1Very high90.1Very high93 Ų9355.5 Ų55.540%0.40430%0.296SS..Hα-helixtrans-60.4-34.5176.2-72.9172.8-178.8177.50112.4S194 L195 R202S194-K198 WeakPolarHBondContact O-CB 3.49Å; S194-K198 VanDerWaalsContact O-CG 3.26Å; S194-K198 WeakPolarHBondContact O-CG 3.21Å; S194-K198 PolarHBondContact O-N 3.01Å; L195-K198 PolarHBondContact O-N 3.19Å; K198-R202 VanDerWaalsContact O-CG 3.3Å; K198-R202 WeakPolarHBondContact O-CG 2.92Å; K198-R202 PolarHBondContact O-N 3.41Å
199A93.8Very high88.7Confident50 Ų5061.9 Ų61.941%0.41333%0.326SS..Hα-helixtrans-69.8-44.7177.200000111.7L195 I196 R197 E201 R202 E203L195-A199 WeakPolarHBondContact O-CB 3.08Å; L195-A199 PolarHBondContact O-N 3.31Å; I196-A199 PolarHBondContact O-N 2.66Å; R197-A199 VanDerWaalsContact C-N 3.25Å; R197-A199 PolarHBondContact O-N 2.82Å; A199-E201 PolarHBondContact O-N 3.33Å; A199-R202 PolarHBondContact O-N 3.26Å; A199-R202 VanDerWaalsContact O-N 3.13Å; A199-E203 PolarHBondContact O-N 2.77Å
200A92.4Very high86.9Confident15 Ų1567.9 Ų67.912%0.12436%0.358CS..Hα-helixtrans-63.3-39.5177.800000112.5V123 I196 R197 R202 E203 E204V123-A200 HydrophobicContact CG2-CB 3.47Å; V123-A200 VanDerWaalsContact CG2-CB 3.47Å; I196-A200 PolarHBondContact O-N 3.28Å; R197-A200 PolarHBondContact O-N 3.42Å; A200-R202 VanDerWaalsContact C-N 3.25Å; A200-R202 PolarHBondContact O-N 3.37Å; A200-E203 PolarHBondContact O-N 3Å; A200-E204 PolarHBondContact O-N 3.44Å
201E90.9Very high85.1Confident104 Ų10471.9 Ų71.949%0.48639%0.387SS..Hα-helixtrans-61.2-33.8174.1-71.9165.7-170.900112.4R197 A199R197-E201 WeakPolarHBondContact O-CG 3.1Å; R197-E201 PolarHBondContact O-N 3.47Å; A199-E201 PolarHBondContact O-N 3.33Å
202R89.5Confident83.2Confident191 Ų19173.8 Ų73.872%0.72141%0.411SS*.Hα-helixtrans-77.4-40.4178.1-71.4173.5-175.5-1610.2112.8K198 A199 A200 E204 V205 A206K198-R202 VanDerWaalsContact O-CG 3.3Å; K198-R202 WeakPolarHBondContact O-CG 2.92Å; K198-R202 PolarHBondContact O-N 3.41Å; A199-R202 PolarHBondContact O-N 3.26Å; A199-R202 VanDerWaalsContact O-N 3.13Å; A200-R202 VanDerWaalsContact C-N 3.25Å; A200-R202 PolarHBondContact O-N 3.37Å; R202-E204 PolarHBondContact O-N 3.21Å; R202-V205 PolarHBondContact O-N 3.37Å; R202-A206 PolarHBondContact O-N 3.14Å
203E87.1Confident81.3Confident126 Ų12677.6 Ų77.659%0.58944%0.438SS*.Hα-helixtrans-59.9-36.6177.2-174.4172.9-176.800111.2A199 A200 A206 A207A199-E203 PolarHBondContact O-N 2.77Å; A200-E203 PolarHBondContact O-N 3Å; E203-A206 PolarHBondContact O-N 3.48Å; E203-A207 WeakPolarHBondContact O-CB 3.36Å; E203-A207 PolarHBondContact O-N 2.99Å
204E79.7Confident79.4Confident87 Ų8786.8 Ų86.841%0.40748%0.478SS..Hα-helixtrans-59.8-48.9175.1-170.6-162.3176.100112.8K118 A200 R202 A206 A207 G208K118-E204 VanDerWaalsContact CD-CD 3.45Å; K118-E204 WeakPolarHBondContact CD-OE1 3.28Å; K118-E204 WeakPolarHBondContact CD-OE2 3.26Å; K118-E204 WeakPolarHBondContact CE-OE1 3.46Å; K118-E204 IonicContact NZ-OE1 2.77Å; K118-E204 PolarHBondContact NZ-OE1 3.19Å; K118-E204 IonicContact NZ-OE2 2.69Å; K118-E204 PolarHBondContact NZ-OE2 3.44Å; A200-E204 PolarHBondContact O-N 3.44Å; R202-E204 PolarHBondContact O-N 3.21Å; E204-A206 VanDerWaalsContact C-N 3.28Å; E204-A206 PolarHBondContact O-N 3.05Å; E204-A207 PolarHBondContact O-N 3.26Å; E204-G208 PolarHBondContact O-N 3.43Å
205V78.4Confident77.5Confident87 Ų8790.8 Ų90.853%0.52751%0.506SS..Hα-helixtrans-60.2-42.8-179.5177.60000110.3R202 A207 G208 E209R202-V205 PolarHBondContact O-N 3.37Å; V205-A207 PolarHBondContact O-N 2.97Å; V205-G208 PolarHBondContact O-N 3.43Å; V205-E209 WeakPolarHBondContact O-CG 3.49Å; V205-E209 PolarHBondContact O-N 3.31Å
206A81Confident75.3Confident49 Ų4996 Ų9641%0.40553%0.525SS..Hα-helixtrans-66.1-36.3177.900000112.9R202 E203 E204 N210R202-A206 PolarHBondContact O-N 3.14Å; E203-A206 PolarHBondContact O-N 3.48Å; E204-A206 VanDerWaalsContact C-N 3.28Å; E204-A206 PolarHBondContact O-N 3.05Å; A206-N210 PolarHBondContact O-N 3.18Å; A206-N210 PolarHBondContact O-ND2 3.39Å
207A75.4Confident73.2Confident62 Ų62105 Ų10551%0.51258%0.581SS.*Hα-helixtrans-69.4-38.4176.200000112.3E203 E204 V205 S211E203-A207 WeakPolarHBondContact O-CB 3.36Å; E203-A207 PolarHBondContact O-N 2.99Å; E204-A207 PolarHBondContact O-N 3.26Å; V205-A207 PolarHBondContact O-N 2.97Å; A207-S211 PolarHBondContact O-N 2.8Å
208G66.6Low72.1Confident41 Ų41106.1 Ų106.142%0.42359%0.594SS.*Hα-helixtrans-61.6-45.9176.100000112.9E204 V205 N210 S211 G212E204-G208 PolarHBondContact O-N 3.43Å; V205-G208 PolarHBondContact O-N 3.43Å; G208-N210 PolarHBondContact O-N 3.4Å; G208-S211 PolarHBondContact O-N 3.28Å; G208-S211 PolarHBondContact O-OG 3.37Å; G208-G212 PolarHBondContact O-N 3.46Å
209E66.8Low70.9Confident133 Ų133106.7 Ų106.762%0.62160%0.604SS**Hα-helixtrans-62.4-41.1-179.8-71.8176.7168.500112.9V205 S211 G212V205-E209 WeakPolarHBondContact O-CG 3.49Å; V205-E209 PolarHBondContact O-N 3.31Å; E209-S211 VanDerWaalsContact C-N 3.31Å; E209-S211 PolarHBondContact O-N 3.32Å; E209-G212 PolarHBondContact O-N 3.2Å
210N59.6Low69.7Low126 Ų126109.9 Ų109.967%0.67462%0.615SS**Hα-helixtrans-68.6-27.9179.1-73.6-23.5000113.3A206 G208 T213A206-N210 PolarHBondContact O-N 3.18Å; A206-N210 PolarHBondContact O-ND2 3.39Å; G208-N210 PolarHBondContact O-N 3.4Å; N210-T213 PolarHBondContact O-OG1 3.39Å
211S59.7Low68.3Low91 Ų91115.5 Ų115.564%0.63664%0.644SS**Hα-helixtrans-77.8-26.1176.873.30000113.3A207 G208 E209A207-S211 PolarHBondContact O-N 2.8Å; G208-S211 PolarHBondContact O-N 3.28Å; G208-S211 PolarHBondContact O-OG 3.37Å; E209-S211 VanDerWaalsContact C-N 3.31Å; E209-S211 PolarHBondContact O-N 3.32Å
212G57.9Low66.9Low54 Ų54116.2 Ų116.256%0.55765%0.654SS**Hα-helixtrans-75.3-25.2-18000000114.1G208 E209 F214G208-G212 PolarHBondContact O-N 3.46Å; E209-G212 PolarHBondContact O-N 3.2Å; G212-F214 PolarHBondContact O-N 3.43Å
213T56.2Low65.4Low115 Ų115111.2 Ų111.271%0.70665%0.649SS**THydrogen-bonded Turntrans-79.6-8.2-176.445.40000115.5N210N210-T213 PolarHBondContact O-OG1 3.39Å
214F57.6Low63.9Low196 Ų196110.1 Ų110.186%0.8665%0.654SS**THydrogen-bonded Turntrans-987.1178.2-155.3-100.4000114.4G212G212-F214 PolarHBondContact O-N 3.43Å
215S54.2Low62.7Low106 Ų106111.9 Ų111.974%0.74167%0.673SS**  trans-102.256.1173.4172.80000111.5
216F48.8Very low61.4Low187 Ų187114 Ų11482%0.8269%0.685SS**  trans-156.793161.1-161.2-98.9000109.8
217V52.6Low59.6Low208 Ų208119.9 Ų119.9100%1.26171%0.71SS**  trans169.70135169.20000107.8

Retrieved 217 of 217 residues in 36.5 ms (Link to these results)