A0A096MX61_PAPAN Loading...

Coiled-coil domain containing 63

AlphaFold DB , UniProt , Accession A0A096MX61, Species PAPAN (Papio anubis, Olive baboon), Gene CCDC63, Length 563 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
1M33.9Very low34.1Very low241 Ų241153.1 Ų153.1100%1.18773%0.728SS**  0104.80-65.5-162-169.300107.6
2S32.5Very low33.8Very low110 Ų110147.1 Ų147.177%0.76971%0.714SS**  92.8120.9106.7-174.90000110.5
3V36.7Very low33.6Very low111 Ų111146.4 Ų146.467%0.67372%0.716SS**  cis-175.3141.710.2113.50000108.6
4L36.3Very low33.3Very low136 Ų136145.3 Ų145.371%0.71272%0.722SS**  trans54.5153.3142.5-53.3163000120.8
5K34.6Very low34.2Very low167 Ų167142.9 Ų142.973%0.72672%0.722SS**  cis-168.4132.98.2-120.2159.1177176.70105
6K34.5Very low34.1Very low172 Ų172144.3 Ų144.375%0.74873%0.725SS**  50.5140.185.6-68.2-164.9173.8178.30113.5
7H34.4Very low34.5Very low120 Ų120144.9 Ų144.956%0.55673%0.725SS**  cis-177.3145.618.2-111.822.3000107.2
8R31.8Very low35Very low175 Ų175146.1 Ų146.166%0.6673%0.733SS**  71122.589.9-136.3-170.8180170.75.4112
9R35.1Very low35.7Very low178 Ų178144.2 Ų144.267%0.67274%0.735SS**  169.7140.481.6-91.9-172.4-178.8169.61.6108.1
10K34.3Very low36.5Very low164 Ų164145.1 Ų145.171%0.71374%0.736SS**  74.5127.180.3-122.8-178.7158.8-85.30109.4
11D31.1Very low37.4Very low110 Ų110147.5 Ų147.559%0.58874%0.741SS**  -179.3133.769.6-85.6-51000106.3
12S30.6Very low38.3Very low81 Ų81139.5 Ų139.557%0.56671%0.714SS**  87.2134.981.788.50000115.6
13D31.1Very low39.3Very low138 Ų138142 Ų14274%0.73871%0.711SS**  trans82.5136148.9-52.7-30.9000118.4
14T29.9Very low40.3Very low131 Ų131144.7 Ų144.780%0.80472%0.716SS**  cis-171.1171.418.97.30000108.7
15P46.8Very low41.4Very low110 Ų110145.9 Ų145.971%0.71472%0.718SS**  trans-107.6166.3-151.841.2-35.5000115.1
16Q31.4Very low42.4Very low164 Ų164145.5 Ų145.577%0.76672%0.719SS**  trans-176.5120.9133.3-155.4129.2-2.600112.6
17E42.1Very low43.5Very low155 Ų155140.5 Ų140.572%0.72471%0.709SS**  trans42.7125.7141.4-80168.2166.500121.1
18L42.9Very low44.7Very low166 Ų166140.7 Ų140.787%0.86971%0.711SS**  cis-16215434.1-91.4151.6000112.9
19S47.8Very low46.1Very low111 Ų111134.8 Ų134.878%0.77670%0.699SS**  trans118.3113.8157.3-158.30000117.3K21S19-K21 PolarHBondContact O-N 3.05Å
20E52.3Low47.3Very low161 Ų161133.5 Ų133.575%0.75270%0.7SS**G310 helixtrans-77.15.6-151.9-65.6-171.6129.700119.3A22E20-A22 PolarHBondContact O-N 3.33Å; E20-A22 VanDerWaalsContact O-N 3.09Å
21K56.1Low48.5Very low197 Ų197130.2 Ų130.286%0.85769%0.69SS**G310 helixtrans-71.8-0.8-178.9-77-174.8175.7-179.70115.7S19S19-K21 PolarHBondContact O-N 3.05Å
22A52.9Low49.9Very low73 Ų73133 Ų13360%0.60369%0.692SS**G310 helixtrans-95.8-16.7-175.900000115.4E20 E24E20-A22 PolarHBondContact O-N 3.33Å; E20-A22 VanDerWaalsContact O-N 3.09Å; A22-E24 PolarHBondContact O-N 3.25Å
23K53.1Low51.4Low162 Ų162136.4 Ų136.470%0.70470%0.697SS**Hα-helixtrans-75.1-22.2-173.4-74.1-179.4-179.8170.60114.9
24E57Low52.8Low168 Ų168135.2 Ų135.279%0.78569%0.69SS**Hα-helixtrans-76.6-27.6-179.4-84.5-179.314400114A22A22-E24 PolarHBondContact O-N 3.25Å
25Q60Low54.2Low160 Ų160137.1 Ų137.175%0.74868%0.683SS**Hα-helixtrans-79.7-22.8-173.2-67.6-174.8-5.500114
26Q55.3Low55.1Low160 Ų160137.9 Ų137.975%0.74868%0.677SS**Hα-helixtrans-79-32.3-179.2-123.7171.8-3.700112.8A29Q26-A29 PolarHBondContact O-N 2.83Å
27A57.4Low56.6Low67 Ų67136.9 Ų136.955%0.55467%0.672SS**Hα-helixtrans-70.8-33.6179.900000113.3A29A27-A29 VanDerWaalsContact C-N 3.32Å; A27-A29 PolarHBondContact O-N 3.38Å
28E59.8Low57.5Low124 Ų124135.5 Ų135.558%0.57966%0.664SS**Hα-helixtrans-69-28.8177.2-78.6-159.6148.600113.5R32E28-R32 IonicContact OE2-NH2 2.73Å; E28-R32 PolarHBondContact OE2-NH2 3.4Å
29A60.5Low58.6Low50 Ų50136 Ų13641%0.41365%0.654SS.*Hα-helixtrans-72.4-35.2-176.700000112.9Q26 A27Q26-A29 PolarHBondContact O-N 2.83Å; A27-A29 VanDerWaalsContact C-N 3.32Å; A27-A29 PolarHBondContact O-N 3.38Å
30E60.6Low59.6Low151 Ų151137.5 Ų137.571%0.70665%0.646SS**Hα-helixtrans-72.6-36177.7-65.2-164.7153.700112.2R32 K33 L34E30-R32 VanDerWaalsContact C-N 3.3Å; E30-R32 PolarHBondContact O-N 3.27Å; E30-K33 PolarHBondContact O-N 2.91Å; E30-L34 PolarHBondContact O-N 3.2Å
31L59.8Low60.4Low95 Ų95135.1 Ų135.150%0.49764%0.637SS.*Hα-helixtrans-66.9-30.3-178.8-152.9143.5000112.5R35L31-R35 VanDerWaalsContact CD2-CZ 3.43Å; L31-R35 WeakPolarHBondContact O-CG 3.34Å
32R60.8Low60.8Low169 Ų169129.2 Ų129.264%0.63862%0.617SS**Hα-helixtrans-70.7-38.1173.3-69.4-173.2-153.613410.8113E28 E30 R35 Q36E28-R32 IonicContact OE2-NH2 2.73Å; E28-R32 PolarHBondContact OE2-NH2 3.4Å; E30-R32 VanDerWaalsContact C-N 3.3Å; E30-R32 PolarHBondContact O-N 3.27Å; R32-R35 PolarHBondContact O-N 3.44Å; R32-Q36 PolarHBondContact O-N 3.32Å
33K61Low61.5Low152 Ų152131.5 Ų131.566%0.66162%0.615SS**Hα-helixtrans-65.5-42-179.4-75.4179.8-179.7172.20112.1E30 Q36 Q37E30-K33 PolarHBondContact O-N 2.91Å; K33-Q36 PolarHBondContact O-N 3.38Å; K33-Q37 PolarHBondContact O-N 3.23Å
34L61Low62.2Low113 Ų113126.9 Ų126.959%0.59260%0.603SS**Hα-helixtrans-65.5-40.6179.7-131.384000112.2E30 Q36 Q37 F38E30-L34 PolarHBondContact O-N 3.2Å; L34-Q36 VanDerWaalsContact C-N 3.25Å; L34-Q36 PolarHBondContact O-N 3.35Å; L34-Q37 PolarHBondContact O-N 3.34Å; L34-F38 PolarHBondContact O-N 3.14Å
35R60.2Low62.9Low172 Ų172127.7 Ų127.765%0.64960%0.599SS**Hα-helixtrans-62.9-30.1177.1-75178.6173.11770.3113L31 R32 R39L31-R35 VanDerWaalsContact CD2-CZ 3.43Å; L31-R35 WeakPolarHBondContact O-CG 3.34Å; R32-R35 PolarHBondContact O-N 3.44Å; R35-R39 PolarHBondContact O-N 3.44Å
36Q65Low63.4Low126 Ų126127.1 Ų127.159%0.58959%0.594SS**Hα-helixtrans-77.3-34.3-179.5-152.817723.100112.7R32 K33 L34 K40R32-Q36 PolarHBondContact O-N 3.32Å; K33-Q36 PolarHBondContact O-N 3.38Å; L34-Q36 VanDerWaalsContact C-N 3.25Å; L34-Q36 PolarHBondContact O-N 3.35Å; Q36-K40 PolarHBondContact O-N 3.41Å
37Q62Low64.3Low142 Ų142122.3 Ų122.366%0.66458%0.579SS**Hα-helixtrans-71.5-39.1177.2-72-173.6-11.800112.6K33 L34 R39 K40 M41K33-Q37 PolarHBondContact O-N 3.23Å; L34-Q37 PolarHBondContact O-N 3.34Å; Q37-R39 VanDerWaalsContact C-N 3.3Å; Q37-R39 PolarHBondContact O-N 3.49Å; Q37-K40 PolarHBondContact O-N 3.3Å; Q37-M41 PolarHBondContact O-N 3.36Å
38F61.4Low65.2Low127 Ų127125.8 Ų125.856%0.55758%0.581SS**Hα-helixtrans-63.5-35.3174.7-90.8-78.3000112.7L34 M41 V42L34-F38 PolarHBondContact O-N 3.14Å; F38-M41 HydrophobicContact CD1-CE 4.44Å; F38-M41 HydrophobicContact CE1-CE 4.37Å; F38-V42 VanDerWaalsContact O-CG2 3.28Å; F38-V42 WeakPolarHBondContact O-CG2 3.26Å; F38-V42 PolarHBondContact O-N 3.03Å; F38-V42 VanDerWaalsContact O-N 3.17Å
39R65.7Low66Low176 Ų176124.2 Ų124.266%0.66458%0.577SS**Hα-helixtrans-62.6-48.2175.4-109.6-175.7-112.1-139.7-2.3112.6R35 Q37 M41 V42 E43R35-R39 PolarHBondContact O-N 3.44Å; Q37-R39 VanDerWaalsContact C-N 3.3Å; Q37-R39 PolarHBondContact O-N 3.49Å; R39-M41 VanDerWaalsContact C-N 3.34Å; R39-M41 PolarHBondContact O-N 3.02Å; R39-V42 PolarHBondContact O-N 3.46Å; R39-E43 PolarHBondContact O-N 3Å
40K69.4Low66.8Low142 Ų142128.2 Ų128.262%0.61759%0.585SS**Hα-helixtrans-62.5-37.7-179.6-71.3-176.1177.1-176.80113Q36 Q37 S44Q36-K40 PolarHBondContact O-N 3.41Å; Q37-K40 PolarHBondContact O-N 3.3Å; K40-S44 PolarHBondContact O-N 3.38Å; K40-S44 PolarHBondContact O-OG 3.09Å
41M68.6Low67.7Low112 Ų112129.6 Ų129.655%0.55258%0.584SS**Hα-helixtrans-71-37.3178.5-165.8-142.4-5700112.4Q37 F38 R39 S44 R45Q37-M41 PolarHBondContact O-N 3.36Å; F38-M41 HydrophobicContact CD1-CE 4.44Å; F38-M41 HydrophobicContact CE1-CE 4.37Å; R39-M41 VanDerWaalsContact C-N 3.34Å; R39-M41 PolarHBondContact O-N 3.02Å; M41-S44 PolarHBondContact O-OG 3.45Å; M41-R45 WeakPolarHBondContact O-CB 3.37Å; M41-R45 PolarHBondContact O-N 3.05Å; M41-R45 VanDerWaalsContact O-N 3.14Å
42V64.9Low68.7Low72 Ų72128.6 Ų128.644%0.43658%0.579SS.*Hα-helixtrans-69.6-38.6177.3172.70000110.9F38 R39 K46F38-V42 VanDerWaalsContact O-CG2 3.28Å; F38-V42 WeakPolarHBondContact O-CG2 3.26Å; F38-V42 PolarHBondContact O-N 3.03Å; F38-V42 VanDerWaalsContact O-N 3.17Å; R39-V42 PolarHBondContact O-N 3.46Å; V42-K46 HydrophobicContact CG1-CD 4.34Å; V42-K46 WeakPolarHBondContact O-CG 3.2Å; V42-K46 PolarHBondContact O-N 2.98Å; V42-K46 VanDerWaalsContact O-N 3.1Å
43E68Low69.6Low121 Ų121127 Ų12757%0.56558%0.579SS**Hα-helixtrans-68.3-37.8176-76.9168.6179.400113R39 K46 S47R39-E43 PolarHBondContact O-N 3Å; E43-K46 PolarHBondContact O-N 3.28Å; E43-S47 PolarHBondContact O-N 3.17Å; E43-S47 PolarHBondContact O-OG 3.48Å
44S67.6Low70.5Confident65 Ų65125.7 Ų125.746%0.45558%0.575SS.*Hα-helixtrans-68.3-38.3176.169.80000112.3K40 M41 S47 F48K40-S44 PolarHBondContact O-N 3.38Å; K40-S44 PolarHBondContact O-OG 3.09Å; M41-S44 PolarHBondContact O-OG 3.45Å; S44-S47 WeakPolarHBondContact CA-OG 3.47Å; S44-S47 PolarHBondContact O-N 3.46Å; S44-S47 PolarHBondContact O-OG 3.43Å; S44-F48 WeakPolarHBondContact O-CB 3.4Å; S44-F48 PolarHBondContact O-N 3.33Å
45R71.2Confident71.5Confident185 Ų185127 Ų12770%0.69858%0.576SS**Hα-helixtrans-67.6-37.2176.5-160.1175.5-173.6-179.71.1112.1M41 N49M41-R45 WeakPolarHBondContact O-CB 3.37Å; M41-R45 PolarHBondContact O-N 3.05Å; M41-R45 VanDerWaalsContact O-N 3.14Å; R45-N49 PolarHBondContact O-N 3.38Å
46K70.4Confident72.4Confident148 Ų148122.6 Ų122.664%0.64357%0.565SS**Hα-helixtrans-66.8-45174.5-75.3179179.2-175.20112.2V42 E43 N49 F50V42-K46 HydrophobicContact CG1-CD 4.34Å; V42-K46 WeakPolarHBondContact O-CG 3.2Å; V42-K46 PolarHBondContact O-N 2.98Å; V42-K46 VanDerWaalsContact O-N 3.1Å; E43-K46 PolarHBondContact O-N 3.28Å; K46-N49 PolarHBondContact O-N 3.1Å; K46-F50 WeakPolarHBondContact O-CB 3.38Å; K46-F50 PolarHBondContact O-N 3.04Å
47S75.4Confident73.3Confident60 Ų60119 Ų11942%0.4256%0.556SS.*Hα-helixtrans-69.1-35.5179.854.90000113.4E43 S44 R51E43-S47 PolarHBondContact O-N 3.17Å; E43-S47 PolarHBondContact O-OG 3.48Å; S44-S47 WeakPolarHBondContact CA-OG 3.47Å; S44-S47 PolarHBondContact O-N 3.46Å; S44-S47 PolarHBondContact O-OG 3.43Å; S47-R51 WeakPolarHBondContact O-CG 3.48Å; S47-R51 PolarHBondContact O-N 2.93Å; S47-R51 VanDerWaalsContact O-N 3.14Å
48F75.8Confident74.3Confident140 Ų140115.4 Ų115.461%0.61455%0.547SS*.Hα-helixtrans-65.6-46.3173.9-176-98.2000112.1S44 F50 R51 N52S44-F48 WeakPolarHBondContact O-CB 3.4Å; S44-F48 PolarHBondContact O-N 3.33Å; F48-F50 PolarHBondContact O-N 3.39Å; F48-R51 PolarHBondContact O-N 3.19Å; F48-N52 PolarHBondContact O-N 3.43Å; F48-N52 VanDerWaalsContact O-N 3.09Å
49N75.9Confident75.4Confident90 Ų90114.8 Ų114.848%0.48155%0.546SS..Hα-helixtrans-61.6-41.6176.6-93.3-36.5000112.6R45 K46 N52 Q53R45-N49 PolarHBondContact O-N 3.38Å; K46-N49 PolarHBondContact O-N 3.1Å; N49-N52 PolarHBondContact O-N 3.02Å; N49-Q53 PolarHBondContact O-N 3.31Å
50F78.3Confident76.4Confident135 Ų135113.7 Ų113.759%0.59254%0.543SS*.Hα-helixtrans-62.3-45.1177.8-176.1-98.5000112.3K46 F48 N52 Q53 Q54K46-F50 WeakPolarHBondContact O-CB 3.38Å; K46-F50 PolarHBondContact O-N 3.04Å; F48-F50 PolarHBondContact O-N 3.39Å; F50-N52 VanDerWaalsContact C-N 3.33Å; F50-N52 PolarHBondContact O-N 2.84Å; F50-Q53 PolarHBondContact O-N 3.33Å; F50-Q54 WeakPolarHBondContact O-CB 3.46Å; F50-Q54 PolarHBondContact O-N 3.41Å
51R79.6Confident77.1Confident180 Ų180114.2 Ų114.268%0.67955%0.545SS*.Hα-helixtrans-63.6-37.3176.9-73.5-179.1-179.1-175.31112.6S47 F48 Q54 K55S47-R51 WeakPolarHBondContact O-CG 3.48Å; S47-R51 PolarHBondContact O-N 2.93Å; S47-R51 VanDerWaalsContact O-N 3.14Å; F48-R51 PolarHBondContact O-N 3.19Å; R51-Q54 PolarHBondContact O-N 3.43Å; R51-K55 PolarHBondContact O-N 3Å; R51-K55 VanDerWaalsContact O-N 3.1Å
52N80.1Confident78Confident73 Ų73114.7 Ų114.739%0.3955%0.546SS..Hα-helixtrans-69.7-43.2178.1-122.319.9000111.8F48 N49 F50 Q54 K55 I56F48-N52 PolarHBondContact O-N 3.43Å; F48-N52 VanDerWaalsContact O-N 3.09Å; N49-N52 PolarHBondContact O-N 3.02Å; F50-N52 VanDerWaalsContact C-N 3.33Å; F50-N52 PolarHBondContact O-N 2.84Å; N52-Q54 VanDerWaalsContact C-N 3.3Å; N52-Q54 PolarHBondContact O-N 3.36Å; N52-K55 PolarHBondContact O-N 3.4Å; N52-I56 VanDerWaalsContact O-CG1 3.32Å; N52-I56 WeakPolarHBondContact O-CG1 3.36Å; N52-I56 PolarHBondContact O-N 2.87Å
53Q79.3Confident79Confident137 Ų137115.2 Ų115.264%0.6455%0.545SS*.Hα-helixtrans-60.5-39.4173.2-83.7180-2500112.2N49 F50 I56 A57N49-Q53 PolarHBondContact O-N 3.31Å; F50-Q53 PolarHBondContact O-N 3.33Å; Q53-I56 PolarHBondContact O-N 3.32Å; Q53-A57 WeakPolarHBondContact O-CB 3.28Å; Q53-A57 PolarHBondContact O-N 3.22Å
54Q81.3Confident79.9Confident124 Ų124116 Ų11658%0.57955%0.549SS*.Hα-helixtrans-65.6-40.8177.9-166.6175.813.300112.6F50 R51 N52 A57 S58F50-Q54 WeakPolarHBondContact O-CB 3.46Å; F50-Q54 PolarHBondContact O-N 3.41Å; R51-Q54 PolarHBondContact O-N 3.43Å; N52-Q54 VanDerWaalsContact C-N 3.3Å; N52-Q54 PolarHBondContact O-N 3.36Å; Q54-A57 PolarHBondContact O-N 2.95Å; Q54-S58 PolarHBondContact O-N 3.45Å; Q54-S58 PolarHBondContact O-OG 3.23Å
55K80.8Confident80.9Confident139 Ų139115.6 Ų115.660%0.60455%0.546SS*.Hα-helixtrans-65.8-40.8175-78.2-174.5176.6-173.40112.9R51 N52 A57 S58 Q59R51-K55 PolarHBondContact O-N 3Å; R51-K55 VanDerWaalsContact O-N 3.1Å; N52-K55 PolarHBondContact O-N 3.4Å; K55-A57 VanDerWaalsContact C-N 3.33Å; K55-S58 WeakPolarHBondContact CA-OG 3.32Å; K55-S58 PolarHBondContact O-N 3.01Å; K55-S58 PolarHBondContact O-OG 3.07Å; K55-Q59 WeakPolarHBondContact O-CG 3.2Å; K55-Q59 PolarHBondContact O-N 3.24Å
56I80.6Confident81.7Confident81 Ų81111.4 Ų111.442%0.41554%0.537SS..Hα-helixtrans-63.6-43.9175.8-69.6169.6000109.5N52 Q53 S58 Q59 Y60N52-I56 VanDerWaalsContact O-CG1 3.32Å; N52-I56 WeakPolarHBondContact O-CG1 3.36Å; N52-I56 PolarHBondContact O-N 2.87Å; Q53-I56 PolarHBondContact O-N 3.32Å; I56-S58 PolarHBondContact O-N 3.42Å; I56-Q59 PolarHBondContact O-N 3.47Å; I56-Y60 HydrophobicContact CG2-CD2 3.63Å; I56-Y60 HydrophobicContact CG2-CE2 3.45Å; I56-Y60 VanDerWaalsContact CG2-CE2 3.45Å; I56-Y60 WeakPolarHBondContact O-CD2 3.34Å; I56-Y60 PolarHBondContact O-N 3.07Å
57A82.5Confident82.6Confident50 Ų50110.3 Ų110.341%0.41353%0.532SS..Hα-helixtrans-63.3-37.1176.800000113.2Q53 Q54 K55 K61Q53-A57 WeakPolarHBondContact O-CB 3.28Å; Q53-A57 PolarHBondContact O-N 3.22Å; Q54-A57 PolarHBondContact O-N 2.95Å; K55-A57 VanDerWaalsContact C-N 3.33Å; A57-K61 WeakPolarHBondContact O-CG 3.45Å; A57-K61 PolarHBondContact O-N 3.26Å
58S83.4Confident83.2Confident66 Ų66110.3 Ų110.346%0.46254%0.536SS..Hα-helixtrans-67.8-41.8175.3610000112.1Q54 K55 I56 Y60 K61 E62Q54-S58 PolarHBondContact O-N 3.45Å; Q54-S58 PolarHBondContact O-OG 3.23Å; K55-S58 WeakPolarHBondContact CA-OG 3.32Å; K55-S58 PolarHBondContact O-N 3.01Å; K55-S58 PolarHBondContact O-OG 3.07Å; I56-S58 PolarHBondContact O-N 3.42Å; S58-Y60 PolarHBondContact O-N 2.94Å; S58-K61 PolarHBondContact O-N 3.41Å; S58-E62 PolarHBondContact O-N 3.35Å; S58-E62 VanDerWaalsContact O-N 3.09Å
59Q85.4Confident83.8Confident115 Ų115108.8 Ų108.854%0.53753%0.53SS..Hα-helixtrans-63.2-39.4176.5-73.1176-25.300112.3K55 I56 K61 E62 I63K55-Q59 WeakPolarHBondContact O-CG 3.2Å; K55-Q59 PolarHBondContact O-N 3.24Å; I56-Q59 PolarHBondContact O-N 3.47Å; Q59-K61 VanDerWaalsContact C-N 3.33Å; Q59-K61 PolarHBondContact O-N 2.72Å; Q59-E62 PolarHBondContact O-N 3.34Å; Q59-I63 VanDerWaalsContact O-CG1 3.28Å; Q59-I63 WeakPolarHBondContact O-CG1 3.39Å; Q59-I63 PolarHBondContact O-N 3.34Å
60Y85.2Confident84.4Confident153 Ų153110.6 Ų110.660%0.654%0.536SS*.Hα-helixtrans-64.1-36.3175.1-85.4-67000113I56 S58 Q64I56-Y60 HydrophobicContact CG2-CD2 3.63Å; I56-Y60 HydrophobicContact CG2-CE2 3.45Å; I56-Y60 VanDerWaalsContact CG2-CE2 3.45Å; I56-Y60 WeakPolarHBondContact O-CD2 3.34Å; I56-Y60 PolarHBondContact O-N 3.07Å; S58-Y60 PolarHBondContact O-N 2.94Å; Y60-Q64 WeakPolarHBondContact O-CG 3.36Å; Y60-Q64 PolarHBondContact O-N 3.5Å; Y60-Q64 VanDerWaalsContact O-N 3.07Å
61K85.6Confident84.9Confident152 Ų152109.3 Ų109.366%0.66154%0.535SS*.Hα-helixtrans-66.4-41.8175.1-73.4-178.3178.2-1730112.1A57 S58 Q59 Q64 S65A57-K61 WeakPolarHBondContact O-CG 3.45Å; A57-K61 PolarHBondContact O-N 3.26Å; S58-K61 PolarHBondContact O-N 3.41Å; Q59-K61 VanDerWaalsContact C-N 3.33Å; Q59-K61 PolarHBondContact O-N 2.72Å; K61-Q64 WeakPolarHBondContact O-CB 3.43Å; K61-Q64 PolarHBondContact O-N 3.1Å; K61-S65 PolarHBondContact O-N 2.96Å
62E87.2Confident85.3Confident123 Ų123106.7 Ų106.758%0.57553%0.531SS*.Hα-helixtrans-68.2-37.9178.3-170.3171.4-167.600112.2S58 Q59 Q64 S65 L66S58-E62 PolarHBondContact O-N 3.35Å; S58-E62 VanDerWaalsContact O-N 3.09Å; Q59-E62 PolarHBondContact O-N 3.34Å; E62-Q64 VanDerWaalsContact C-N 3.28Å; E62-Q64 PolarHBondContact O-N 3.5Å; E62-S65 WeakPolarHBondContact CA-OG 3.44Å; E62-S65 PolarHBondContact O-N 2.93Å; E62-S65 PolarHBondContact O-OG 3.38Å; E62-L66 WeakPolarHBondContact O-CG 3.31Å; E62-L66 PolarHBondContact O-N 3.14Å
63I85.1Confident85.7Confident83 Ų83108.1 Ų108.143%0.42654%0.537SS..Hα-helixtrans-63.9-36.5172.1-68.9166.7000110.9Q59 K67Q59-I63 VanDerWaalsContact O-CG1 3.28Å; Q59-I63 WeakPolarHBondContact O-CG1 3.39Å; Q59-I63 PolarHBondContact O-N 3.34Å; I63-K67 HydrophobicContact CG2-CD 4.29Å; I63-K67 WeakPolarHBondContact O-CB 3.31Å; I63-K67 VanDerWaalsContact O-CG 3.31Å; I63-K67 WeakPolarHBondContact O-CG 3.28Å; I63-K67 PolarHBondContact O-N 2.93Å
64Q87.8Confident86.1Confident136 Ų136105.2 Ų105.264%0.63653%0.529SS*.Hα-helixtrans-67.9-40175.8-78.7179.4-10.300112.4Y60 K61 E62 K67 A68Y60-Q64 WeakPolarHBondContact O-CG 3.36Å; Y60-Q64 PolarHBondContact O-N 3.5Å; Y60-Q64 VanDerWaalsContact O-N 3.07Å; K61-Q64 WeakPolarHBondContact O-CB 3.43Å; K61-Q64 PolarHBondContact O-N 3.1Å; E62-Q64 VanDerWaalsContact C-N 3.28Å; E62-Q64 PolarHBondContact O-N 3.5Å; Q64-K67 PolarHBondContact O-N 3.39Å; Q64-A68 PolarHBondContact O-N 3.46Å; Q64-A68 VanDerWaalsContact O-N 3.1Å
65S88.3Confident86.4Confident58 Ų58104 Ų10441%0.40653%0.526SS..Hα-helixtrans-66.3-43.9176.2580000112.1K61 E62 K67 A68 E69K61-S65 PolarHBondContact O-N 2.96Å; E62-S65 WeakPolarHBondContact CA-OG 3.44Å; E62-S65 PolarHBondContact O-N 2.93Å; E62-S65 PolarHBondContact O-OG 3.38Å; S65-K67 VanDerWaalsContact C-N 3.31Å; S65-K67 PolarHBondContact O-N 2.87Å; S65-A68 WeakPolarHBondContact O-CB 3.48Å; S65-A68 PolarHBondContact O-N 3.48Å; S65-A68 VanDerWaalsContact O-N 3.14Å; S65-E69 PolarHBondContact O-N 2.87Å
66L88.3Confident86.7Confident96 Ų96101.8 Ų101.850%0.50352%0.521SS..Hα-helixtrans-64.4-34.6177.6-71.7172.2000112.7E62 E69 Q70E62-L66 WeakPolarHBondContact O-CG 3.31Å; E62-L66 PolarHBondContact O-N 3.14Å; L66-E69 PolarHBondContact O-N 3.46Å; L66-Q70 WeakPolarHBondContact O-CB 3.34Å; L66-Q70 PolarHBondContact O-N 3.45Å
67K88Confident86.9Confident126 Ų126101.6 Ų101.655%0.54852%0.52SS..Hα-helixtrans-65.4-40.9172.6-78.7180178-173.70112I63 Q64 S65 Q70 D71I63-K67 HydrophobicContact CG2-CD 4.29Å; I63-K67 WeakPolarHBondContact O-CB 3.31Å; I63-K67 VanDerWaalsContact O-CG 3.31Å; I63-K67 WeakPolarHBondContact O-CG 3.28Å; I63-K67 PolarHBondContact O-N 2.93Å; Q64-K67 PolarHBondContact O-N 3.39Å; S65-K67 VanDerWaalsContact C-N 3.31Å; S65-K67 PolarHBondContact O-N 2.87Å; K67-Q70 PolarHBondContact O-N 3.29Å; K67-D71 WeakPolarHBondContact O-CB 3.38Å; K67-D71 VanDerWaalsContact O-CG 3.24Å; K67-D71 PolarHBondContact O-N 3.43Å
68A88Confident87Confident59 Ų59102.5 Ų102.549%0.48852%0.523SS..Hα-helixtrans-63.3-42.5176.200000112.1Q64 S65 D71 E72Q64-A68 PolarHBondContact O-N 3.46Å; Q64-A68 VanDerWaalsContact O-N 3.1Å; S65-A68 WeakPolarHBondContact O-CB 3.48Å; S65-A68 PolarHBondContact O-N 3.48Å; S65-A68 VanDerWaalsContact O-N 3.14Å; A68-D71 PolarHBondContact O-N 3.19Å; A68-E72 PolarHBondContact O-N 2.92Å
69E89Confident87.1Confident108 Ų108103.6 Ų103.651%0.50552%0.523SS..Hα-helixtrans-64.4-41.7174.8-71.7177.2-172.800112.1S65 L66 D71 E72 I73S65-E69 PolarHBondContact O-N 2.87Å; L66-E69 PolarHBondContact O-N 3.46Å; E69-D71 VanDerWaalsContact C-N 3.35Å; E69-D71 PolarHBondContact O-N 3.18Å; E69-E72 PolarHBondContact O-N 3.43Å; E69-I73 VanDerWaalsContact O-CG1 3.31Å; E69-I73 WeakPolarHBondContact O-CG1 3.45Å; E69-I73 PolarHBondContact O-N 2.9Å
70Q89Confident86.8Confident129 Ų129103.9 Ų103.960%0.60353%0.526SS*.Hα-helixtrans-58.8-49.7175.2-177.5176.9-1.500110.3L66 K67 E72 I73 T74L66-Q70 WeakPolarHBondContact O-CB 3.34Å; L66-Q70 PolarHBondContact O-N 3.45Å; K67-Q70 PolarHBondContact O-N 3.29Å; Q70-E72 VanDerWaalsContact C-N 3.33Å; Q70-E72 PolarHBondContact O-N 2.92Å; Q70-I73 PolarHBondContact O-N 3.33Å; Q70-T74 PolarHBondContact O-N 2.92Å; Q70-T74 PolarHBondContact O-OG1 3.47Å
71D87.8Confident86.7Confident107 Ų107104 Ų10457%0.57253%0.53SS*.Hα-helixtrans-58.7-43.6179.1-70.8-22.3000111.3K67 A68 E69 T74 L75K67-D71 WeakPolarHBondContact O-CB 3.38Å; K67-D71 VanDerWaalsContact O-CG 3.24Å; K67-D71 PolarHBondContact O-N 3.43Å; A68-D71 PolarHBondContact O-N 3.19Å; E69-D71 VanDerWaalsContact C-N 3.35Å; E69-D71 PolarHBondContact O-N 3.18Å; D71-T74 WeakPolarHBondContact CA-OG1 3.4Å; D71-T74 PolarHBondContact O-N 2.98Å; D71-T74 PolarHBondContact O-OG1 2.91Å; D71-T74 VanDerWaalsContact O-OG1 3.05Å; D71-L75 WeakPolarHBondContact O-CB 3.43Å; D71-L75 PolarHBondContact O-N 3.3Å
72E89.1Confident86.5Confident126 Ų12698.5 Ų98.559%0.58951%0.51SS*.Hα-helixtrans-61.8-45.5176.5-172.9175.8-173.300112.7A68 E69 Q70 L75 L76A68-E72 PolarHBondContact O-N 2.92Å; E69-E72 PolarHBondContact O-N 3.43Å; Q70-E72 VanDerWaalsContact C-N 3.33Å; Q70-E72 PolarHBondContact O-N 2.92Å; E72-L75 WeakPolarHBondContact O-CB 3.4Å; E72-L75 PolarHBondContact O-N 3.25Å; E72-L76 HydrophobicContact CG-CD1 4.49Å; E72-L76 PolarHBondContact O-N 2.89Å
73I87.8Confident86.3Confident102 Ų10296.9 Ų96.952%0.52351%0.513SS..Hα-helixtrans-65.2-42.1177.9-67.2168.5000110.7E69 Q70 L75 L76 L77E69-I73 VanDerWaalsContact O-CG1 3.31Å; E69-I73 WeakPolarHBondContact O-CG1 3.45Å; E69-I73 PolarHBondContact O-N 2.9Å; Q70-I73 PolarHBondContact O-N 3.33Å; I73-L75 VanDerWaalsContact C-N 3.28Å; I73-L75 PolarHBondContact O-N 3.38Å; I73-L76 PolarHBondContact O-N 3.5Å; I73-L77 HydrophobicContact CG2-CD1 4.09Å; I73-L77 HydrophobicContact CG2-CG 4.5Å; I73-L77 WeakPolarHBondContact O-CB 3.48Å; I73-L77 WeakPolarHBondContact O-CG 3.23Å; I73-L77 PolarHBondContact O-N 3.11Å
74T88.6Confident86.2Confident76 Ų76100.9 Ų100.947%0.46652%0.522SS..Hα-helixtrans-62.1-37.917415.90000112.1Q70 D71 L77 S78Q70-T74 PolarHBondContact O-N 2.92Å; Q70-T74 PolarHBondContact O-OG1 3.47Å; D71-T74 WeakPolarHBondContact CA-OG1 3.4Å; D71-T74 PolarHBondContact O-N 2.98Å; D71-T74 PolarHBondContact O-OG1 2.91Å; D71-T74 VanDerWaalsContact O-OG1 3.05Å; T74-L77 PolarHBondContact O-N 2.9Å; T74-S78 WeakPolarHBondContact O-CB 3.42Å; T74-S78 PolarHBondContact O-N 3.3Å; T74-S78 PolarHBondContact O-OG 3.4Å
75L86.9Confident86Confident100 Ų10097.4 Ų97.452%0.52451%0.508SS..Hα-helixtrans-63.5-47.7176.3-165.1159.5000110.4D71 E72 I73 L77 S78 L79D71-L75 WeakPolarHBondContact O-CB 3.43Å; D71-L75 PolarHBondContact O-N 3.3Å; E72-L75 WeakPolarHBondContact O-CB 3.4Å; E72-L75 PolarHBondContact O-N 3.25Å; I73-L75 VanDerWaalsContact C-N 3.28Å; I73-L75 PolarHBondContact O-N 3.38Å; L75-L77 PolarHBondContact O-N 3.32Å; L75-S78 PolarHBondContact O-N 2.93Å; L75-S78 PolarHBondContact O-OG 3.4Å; L75-L79 HydrophobicContact CD2-CD1 3.42Å; L75-L79 VanDerWaalsContact CD2-CD1 3.42Å; L75-L79 HydrophobicContact CD2-CG 4Å; L75-L79 PolarHBondContact O-N 2.8Å
76L86.9Confident85.8Confident92 Ų9299.8 Ų99.848%0.48251%0.514SS..Hα-helixtrans-60.9-42.9176-73.8168.8000112.7E72 I73 S78 L79 M80E72-L76 HydrophobicContact CG-CD1 4.49Å; E72-L76 PolarHBondContact O-N 2.89Å; I73-L76 PolarHBondContact O-N 3.5Å; L76-S78 VanDerWaalsContact C-N 3.33Å; L76-S78 PolarHBondContact O-N 3.06Å; L76-L79 PolarHBondContact O-N 2.93Å; L76-M80 PolarHBondContact O-N 3.43Å
77L84.8Confident85.7Confident76 Ų7699.4 Ų99.440%0.39851%0.513SS..Hα-helixtrans-63-40.1175-77.9171.5000111.7I73 T74 L75 M80 K81I73-L77 HydrophobicContact CG2-CD1 4.09Å; I73-L77 HydrophobicContact CG2-CG 4.5Å; I73-L77 WeakPolarHBondContact O-CB 3.48Å; I73-L77 WeakPolarHBondContact O-CG 3.23Å; I73-L77 PolarHBondContact O-N 3.11Å; T74-L77 PolarHBondContact O-N 2.9Å; L75-L77 PolarHBondContact O-N 3.32Å; L77-M80 HydrophobicContact CD2-CE 3.99Å; L77-M80 PolarHBondContact O-N 3.04Å; L77-K81 VanDerWaalsContact O-CB 3.26Å; L77-K81 WeakPolarHBondContact O-CB 3.43Å; L77-K81 WeakPolarHBondContact O-CG 3.2Å; L77-K81 PolarHBondContact O-N 2.68Å
78S84.9Confident85.6Confident69 Ų6999.2 Ų99.248%0.48351%0.509SS..Hα-helixtrans-67.4-35.7176.5790000112.3T74 L75 L76 K81 S82T74-S78 WeakPolarHBondContact O-CB 3.42Å; T74-S78 PolarHBondContact O-N 3.3Å; T74-S78 PolarHBondContact O-OG 3.4Å; L75-S78 PolarHBondContact O-N 2.93Å; L75-S78 PolarHBondContact O-OG 3.4Å; L76-S78 VanDerWaalsContact C-N 3.33Å; L76-S78 PolarHBondContact O-N 3.06Å; S78-K81 CarbonylContact O-C 3.57Å; S78-S82 WeakPolarHBondContact O-CA 3.39Å; S78-S82 WeakPolarHBondContact O-CB 3.45Å; S78-S82 PolarHBondContact O-N 2.69Å
79L85.3Confident85.4Confident90 Ų90100 Ų10047%0.47151%0.51SS..Hα-helixtrans-67.7-44.2174.3-79.4171.6000111.4L75 L76 S82 N85L75-L79 HydrophobicContact CD2-CD1 3.42Å; L75-L79 VanDerWaalsContact CD2-CD1 3.42Å; L75-L79 HydrophobicContact CD2-CG 4Å; L75-L79 PolarHBondContact O-N 2.8Å; L76-L79 PolarHBondContact O-N 2.93Å; L79-S82 VanDerWaalsContact O-CB 3.23Å; L79-S82 WeakPolarHBondContact O-CB 3.21Å; L79-S82 PolarHBondContact O-N 3.41Å; L79-S82 PolarHBondContact O-OG 3.47Å; L79-N85 PolarHBondContact O-ND2 3.38Å
80M80.4Confident85.4Confident121 Ų121100.7 Ų100.760%0.59651%0.514SS*.Hα-helixtrans-65.4-43.6175.8-74.5-165.9-67.300111.9L76 L77 S82L76-M80 PolarHBondContact O-N 3.43Å; L77-M80 HydrophobicContact CD2-CE 3.99Å; L77-M80 PolarHBondContact O-N 3.04Å; M80-S82 PolarHBondContact O-N 3.06Å
81K81.8Confident85.4Confident156 Ų156101.7 Ų101.768%0.67852%0.516SS*.THydrogen-bonded Turntrans-79.62.3176-66.7-178.4177.7-178.20113.5L77 S78 S83L77-K81 VanDerWaalsContact O-CB 3.26Å; L77-K81 WeakPolarHBondContact O-CB 3.43Å; L77-K81 WeakPolarHBondContact O-CG 3.2Å; L77-K81 PolarHBondContact O-N 2.68Å; S78-K81 CarbonylContact O-C 3.57Å; K81-S83 PolarHBondContact O-N 2.88Å
82S82.5Confident85.5Confident35 Ų35101.5 Ų101.525%0.24552%0.515CS..SBendtrans-60.1137.1177.170.60000108.7S78 L79 M80 R84 N85 M86S78-S82 WeakPolarHBondContact O-CA 3.39Å; S78-S82 WeakPolarHBondContact O-CB 3.45Å; S78-S82 PolarHBondContact O-N 2.69Å; L79-S82 VanDerWaalsContact O-CB 3.23Å; L79-S82 WeakPolarHBondContact O-CB 3.21Å; L79-S82 PolarHBondContact O-N 3.41Å; L79-S82 PolarHBondContact O-OG 3.47Å; M80-S82 PolarHBondContact O-N 3.06Å; S82-R84 PolarHBondContact O-N 3.15Å; S82-N85 PolarHBondContact O-N 3.17Å; S82-N85 PolarHBondContact OG-ND2 3.38Å; S82-M86 PolarHBondContact O-N 3.28Å
83S81.9Confident85.6Confident90 Ų90102.9 Ų102.963%0.62952%0.516SS*.Hα-helixtrans-52.9-34.4-178.756.90000112K81 N87K81-S83 PolarHBondContact O-N 2.88Å; S83-N87 WeakPolarHBondContact O-CB 3.47Å; S83-N87 PolarHBondContact O-N 3.48Å; S83-N87 PolarHBondContact O-ND2 3.48Å; S83-N87 PolarHBondContact O-OD1 3.01Å
84R83.2Confident85.8Confident166 Ų166103.6 Ų103.663%0.62652%0.518SS*.Hα-helixtrans-63.5-40.9176.6-168.9176.4-175.81782.2113.1S82 R88S82-R84 PolarHBondContact O-N 3.15Å; R84-R88 WeakPolarHBondContact O-CB 3.44Å; R84-R88 WeakPolarHBondContact O-CD 3.42Å; R84-R88 WeakPolarHBondContact O-CG 3.45Å; R84-R88 PolarHBondContact O-N 3.02Å; R84-R88 VanDerWaalsContact O-N 3.15Å
85N83.6Confident86Confident63 Ų63105.5 Ų105.534%0.33752%0.522SS..Hα-helixtrans-79-37.7-179.6-74.5-18.6000111.9L79 S82 R88 S89L79-N85 PolarHBondContact O-ND2 3.38Å; S82-N85 PolarHBondContact O-N 3.17Å; S82-N85 PolarHBondContact OG-ND2 3.38Å; N85-R88 PolarHBondContact O-N 3.09Å; N85-S89 PolarHBondContact O-N 3.46Å
86M84.3Confident86.2Confident109 Ų109105.8 Ų105.854%0.53752%0.524SS..Hα-helixtrans-61.4-48.3172.2-70.5-60.2-63.300111.6S82 R88 S89 E90S82-M86 PolarHBondContact O-N 3.28Å; M86-R88 VanDerWaalsContact C-N 3.27Å; M86-R88 PolarHBondContact O-N 3.35Å; M86-S89 WeakPolarHBondContact O-CB 3.47Å; M86-S89 PolarHBondContact O-N 3.06Å; M86-S89 VanDerWaalsContact O-N 3.11Å; M86-E90 PolarHBondContact O-N 3.46Å
87N85.6Confident86.5Confident87 Ų87104 Ų10447%0.46552%0.518SS..Hα-helixtrans-63.9-32.3177.5-68.2-9.4000112.3S83 K91S83-N87 WeakPolarHBondContact O-CB 3.47Å; S83-N87 PolarHBondContact O-N 3.48Å; S83-N87 PolarHBondContact O-ND2 3.48Å; S83-N87 PolarHBondContact O-OD1 3.01Å; N87-K91 WeakPolarHBondContact O-CB 3.48Å; N87-K91 WeakPolarHBondContact O-CG 3.47Å; N87-K91 PolarHBondContact O-N 2.97Å
88R86.1Confident86.9Confident123 Ų123105.4 Ų105.446%0.46453%0.525SS..Hα-helixtrans-67.8-44.1172.1-80.3170.3171.4175.2-8.2111.4R84 N85 M86 E90 K91 N92R84-R88 WeakPolarHBondContact O-CB 3.44Å; R84-R88 WeakPolarHBondContact O-CD 3.42Å; R84-R88 WeakPolarHBondContact O-CG 3.45Å; R84-R88 PolarHBondContact O-N 3.02Å; R84-R88 VanDerWaalsContact O-N 3.15Å; N85-R88 PolarHBondContact O-N 3.09Å; M86-R88 VanDerWaalsContact C-N 3.27Å; M86-R88 PolarHBondContact O-N 3.35Å; R88-E90 VanDerWaalsContact C-N 3.34Å; R88-E90 PolarHBondContact O-N 3.14Å; R88-K91 PolarHBondContact O-N 2.98Å; R88-N92 WeakPolarHBondContact O-CB 3.46Å; R88-N92 PolarHBondContact O-N 3.09Å; R88-N92 PolarHBondContact O-OD1 3.01Å
89S84.9Confident87.3Confident74 Ų74107 Ų10752%0.51753%0.528SS..Hα-helixtrans-63.1-41177.6-167.60000112N85 M86 N92 Y93N85-S89 PolarHBondContact O-N 3.46Å; M86-S89 WeakPolarHBondContact O-CB 3.47Å; M86-S89 PolarHBondContact O-N 3.06Å; M86-S89 VanDerWaalsContact O-N 3.11Å; S89-N92 PolarHBondContact O-N 3.03Å; S89-Y93 WeakPolarHBondContact O-CB 3.39Å; S89-Y93 PolarHBondContact O-N 3.1Å
90E88.5Confident87.7Confident124 Ų124107.1 Ų107.158%0.57953%0.529SS*.Hα-helixtrans-67.7-41.6177.7-172.4170.4-158.100111.8M86 R88 Y93 M94M86-E90 PolarHBondContact O-N 3.46Å; R88-E90 VanDerWaalsContact C-N 3.34Å; R88-E90 PolarHBondContact O-N 3.14Å; E90-Y93 PolarHBondContact O-N 3.48Å; E90-M94 WeakPolarHBondContact O-CG 3.48Å; E90-M94 PolarHBondContact O-N 3.17Å
91K89.5Confident88.4Confident149 Ų149106.7 Ų106.765%0.64853%0.525SS*.Hα-helixtrans-59.9-46.5172-76.7176.9-178.9-168.90112.1N87 R88 Y93 M94 E95N87-K91 WeakPolarHBondContact O-CB 3.48Å; N87-K91 WeakPolarHBondContact O-CG 3.47Å; N87-K91 PolarHBondContact O-N 2.97Å; R88-K91 PolarHBondContact O-N 2.98Å; K91-Y93 VanDerWaalsContact C-N 3.28Å; K91-Y93 PolarHBondContact O-N 2.99Å; K91-M94 PolarHBondContact O-N 3.39Å; K91-E95 WeakPolarHBondContact O-CB 3.49Å; K91-E95 PolarHBondContact O-N 2.96Å
92N89.6Confident89Confident104 Ų104102.3 Ų102.356%0.55651%0.511SS*.Hα-helixtrans-62.5-37.3177.2-67.6-3.5000111.6R88 S89 L96R88-N92 WeakPolarHBondContact O-CB 3.46Å; R88-N92 PolarHBondContact O-N 3.09Å; R88-N92 PolarHBondContact O-OD1 3.01Å; S89-N92 PolarHBondContact O-N 3.03Å; N92-L96 VanDerWaalsContact O-CB 3.3Å; N92-L96 WeakPolarHBondContact O-CB 3.33Å; N92-L96 PolarHBondContact O-N 3.41Å
93Y90.3Very high89.6Confident155 Ų155106.4 Ų106.461%0.60853%0.525SS*.Hα-helixtrans-65.8-46.3175.9178.5-99.7000111.7S89 E90 K91 E95 L96 C97S89-Y93 WeakPolarHBondContact O-CB 3.39Å; S89-Y93 PolarHBondContact O-N 3.1Å; E90-Y93 PolarHBondContact O-N 3.48Å; K91-Y93 VanDerWaalsContact C-N 3.28Å; K91-Y93 PolarHBondContact O-N 2.99Å; Y93-E95 VanDerWaalsContact C-N 3.35Å; Y93-E95 PolarHBondContact O-N 2.95Å; Y93-L96 WeakPolarHBondContact O-CB 3.42Å; Y93-L96 PolarHBondContact O-N 3.3Å; Y93-C97 PolarHBondContact O-N 2.92Å; Y93-C97 PolarHBondContact O-SG 3.36Å; Y93-C97 VanDerWaalsContact O-SG 3.4Å
94M91.8Very high90.2Very high117 Ų117107.3 Ų107.358%0.57652%0.519SS*.Hα-helixtrans-62.3-42175.6-70.9-133.570.600112.2E90 K91 L96 C97 L98E90-M94 WeakPolarHBondContact O-CG 3.48Å; E90-M94 PolarHBondContact O-N 3.17Å; K91-M94 PolarHBondContact O-N 3.39Å; M94-L96 VanDerWaalsContact C-N 3.34Å; M94-C97 PolarHBondContact O-N 3.48Å; M94-L98 WeakPolarHBondContact O-CG 3.31Å; M94-L98 PolarHBondContact O-N 3.25Å
95E92.3Very high90.7Very high115 Ų115104.2 Ų104.254%0.53752%0.515SS..Hα-helixtrans-62.3-42.1175-172.1173.5-175.700111.3K91 Y93 C97 L98 L99K91-E95 WeakPolarHBondContact O-CB 3.49Å; K91-E95 PolarHBondContact O-N 2.96Å; Y93-E95 VanDerWaalsContact C-N 3.35Å; Y93-E95 PolarHBondContact O-N 2.95Å; E95-C97 PolarHBondContact O-N 3.31Å; E95-L98 PolarHBondContact O-N 2.9Å; E95-L99 HydrophobicContact CG-CD1 4.25Å; E95-L99 WeakPolarHBondContact O-CB 3.3Å; E95-L99 VanDerWaalsContact O-CG 3.31Å; E95-L99 WeakPolarHBondContact O-CG 3.47Å; E95-L99 PolarHBondContact O-N 3.4Å
96L92.4Very high91.3Very high107 Ų107108.6 Ų108.656%0.5653%0.528SS*.Hα-helixtrans-62.6-41.7175-17666.3000112.1N92 Y93 M94 L99 L100N92-L96 VanDerWaalsContact O-CB 3.3Å; N92-L96 WeakPolarHBondContact O-CB 3.33Å; N92-L96 PolarHBondContact O-N 3.41Å; Y93-L96 WeakPolarHBondContact O-CB 3.42Å; Y93-L96 PolarHBondContact O-N 3.3Å; M94-L96 VanDerWaalsContact C-N 3.34Å; L96-L99 PolarHBondContact O-N 3.03Å; L96-L100 WeakPolarHBondContact O-CB 3.46Å; L96-L100 PolarHBondContact O-N 3.28Å
97C92Very high91.8Very high53 Ų53107.2 Ų107.236%0.35852%0.52SS..Hα-helixtrans-61.7-43.5175.5-72.50000111.9Y93 M94 E95 L100 Q101Y93-C97 PolarHBondContact O-N 2.92Å; Y93-C97 PolarHBondContact O-SG 3.36Å; Y93-C97 VanDerWaalsContact O-SG 3.4Å; M94-C97 PolarHBondContact O-N 3.48Å; E95-C97 PolarHBondContact O-N 3.31Å; C97-L100 PolarHBondContact O-N 2.87Å; C97-Q101 PolarHBondContact O-N 2.99Å
98L93.3Very high92.3Very high107 Ų107105.8 Ų105.856%0.5652%0.52SS*.Hα-helixtrans-64.8-41.3176.4-70.2170.4000111.9M94 E95 L100 Q101 T102M94-L98 WeakPolarHBondContact O-CG 3.31Å; M94-L98 PolarHBondContact O-N 3.25Å; E95-L98 PolarHBondContact O-N 2.9Å; L98-L100 VanDerWaalsContact C-N 3.31Å; L98-L100 PolarHBondContact O-N 2.91Å; L98-Q101 PolarHBondContact O-N 2.88Å; L98-T102 WeakPolarHBondContact O-CG2 3.37Å; L98-T102 PolarHBondContact O-N 3.28Å; L98-T102 PolarHBondContact O-OG1 3.48Å
99L94.2Very high92.8Very high102 Ų102104.3 Ų104.353%0.53452%0.521SS..Hα-helixtrans-65.3-35175.3-72.2173.1000112.1E95 L96 T102 K103E95-L99 HydrophobicContact CG-CD1 4.25Å; E95-L99 WeakPolarHBondContact O-CB 3.3Å; E95-L99 VanDerWaalsContact O-CG 3.31Å; E95-L99 WeakPolarHBondContact O-CG 3.47Å; E95-L99 PolarHBondContact O-N 3.4Å; L96-L99 PolarHBondContact O-N 3.03Å; L99-T102 WeakPolarHBondContact CA-OG1 3.44Å; L99-T102 PolarHBondContact O-OG1 2.95Å; L99-K103 VanDerWaalsContact O-CB 3.3Å; L99-K103 WeakPolarHBondContact O-CB 3.48Å; L99-K103 PolarHBondContact O-N 2.93Å
100L94.3Very high93.3Very high93 Ų93105 Ų10549%0.48752%0.518SS..Hα-helixtrans-67.4-46.6175.6-162.196.5000111L96 C97 L98 K103 E104L96-L100 WeakPolarHBondContact O-CB 3.46Å; L96-L100 PolarHBondContact O-N 3.28Å; C97-L100 PolarHBondContact O-N 2.87Å; L98-L100 VanDerWaalsContact C-N 3.31Å; L98-L100 PolarHBondContact O-N 2.91Å; L100-K103 WeakPolarHBondContact O-CB 3.42Å; L100-K103 PolarHBondContact O-N 3.35Å; L100-E104 WeakPolarHBondContact O-CG 3.3Å; L100-E104 PolarHBondContact O-N 3.29Å
101Q94.2Very high93.6Very high112 Ų112105.6 Ų105.652%0.52352%0.518SS..Hα-helixtrans-63-44.9179.1-172.3173.95.100111.7C97 L98 K103 E104 D105C97-Q101 PolarHBondContact O-N 2.99Å; L98-Q101 PolarHBondContact O-N 2.88Å; Q101-K103 VanDerWaalsContact C-N 3.31Å; Q101-K103 PolarHBondContact O-N 2.95Å; Q101-E104 PolarHBondContact O-N 3.24Å; Q101-D105 PolarHBondContact O-N 2.95Å
102T93.8Very high93.9Very high63 Ų63101.5 Ų101.539%0.38751%0.509SS..Hα-helixtrans-63.1-37.817652.70000111.7L98 L99 D105 Y106L98-T102 WeakPolarHBondContact O-CG2 3.37Å; L98-T102 PolarHBondContact O-N 3.28Å; L98-T102 PolarHBondContact O-OG1 3.48Å; L99-T102 WeakPolarHBondContact CA-OG1 3.44Å; L99-T102 PolarHBondContact O-OG1 2.95Å; T102-D105 PolarHBondContact O-N 3.39Å; T102-Y106 WeakPolarHBondContact O-CD2 3Å; T102-Y106 PolarHBondContact O-N 2.86Å
103K95Very high94.2Very high121 Ų121101 Ų10153%0.52651%0.506SS..Hα-helixtrans-61-46.2172.7-179.8-168.2165.2-167.10111.5L99 L100 Q101 D105 Y106 E107L99-K103 VanDerWaalsContact O-CB 3.3Å; L99-K103 WeakPolarHBondContact O-CB 3.48Å; L99-K103 PolarHBondContact O-N 2.93Å; L100-K103 WeakPolarHBondContact O-CB 3.42Å; L100-K103 PolarHBondContact O-N 3.35Å; Q101-K103 VanDerWaalsContact C-N 3.31Å; Q101-K103 PolarHBondContact O-N 2.95Å; K103-D105 VanDerWaalsContact C-N 3.33Å; K103-D105 PolarHBondContact O-N 2.93Å; K103-Y106 PolarHBondContact O-N 3.32Å; K103-E107 WeakPolarHBondContact CE-OE1 3.36Å; K103-E107 IonicContact NZ-OE1 3.32Å; K103-E107 WeakPolarHBondContact O-CB 3.49Å; K103-E107 WeakPolarHBondContact O-CG 3.4Å; K103-E107 PolarHBondContact O-N 2.89Å
104E95.2Very high94.4Very high110 Ų110100.6 Ų100.651%0.51451%0.507SS..Hα-helixtrans-60.8-41.4177.5-72.2174.4179.200111.7L100 Q101 E107 A108L100-E104 WeakPolarHBondContact O-CG 3.3Å; L100-E104 PolarHBondContact O-N 3.29Å; Q101-E104 PolarHBondContact O-N 3.24Å; E104-E107 PolarHBondContact O-N 3.47Å; E104-A108 WeakPolarHBondContact O-CB 3.43Å; E104-A108 PolarHBondContact O-N 3.32Å
105D94.8Very high94.7Very high100 Ų10099.1 Ų99.154%0.53550%0.504SS..Hα-helixtrans-62.7-45175.7-68.2-28.5000111.8Q101 T102 K103 A108 L109Q101-D105 PolarHBondContact O-N 2.95Å; T102-D105 PolarHBondContact O-N 3.39Å; K103-D105 VanDerWaalsContact C-N 3.33Å; K103-D105 PolarHBondContact O-N 2.93Å; D105-A108 PolarHBondContact O-N 3.23Å; D105-L109 PolarHBondContact O-N 2.99Å
106Y95.1Very high94.9Very high156 Ų15697.9 Ų97.961%0.61250%0.501SS*.Hα-helixtrans-65.7-37.8175.2-75.1-59.4000112.2T102 K103 L109 I110T102-Y106 WeakPolarHBondContact O-CD2 3Å; T102-Y106 PolarHBondContact O-N 2.86Å; K103-Y106 PolarHBondContact O-N 3.32Å; Y106-L109 PolarHBondContact O-N 2.98Å; Y106-I110 WeakPolarHBondContact O-CB 3.47Å; Y106-I110 WeakPolarHBondContact O-CD1 3.41Å; Y106-I110 WeakPolarHBondContact O-CG1 3.44Å; Y106-I110 PolarHBondContact O-N 3.03Å
107E95.5Very high95Very high80 Ų8097.8 Ų97.837%0.37450%0.5SS..Hα-helixtrans-64.3-40.1174.4-78.1-174.3-176.700111.9K103 E104 I110 K111K103-E107 WeakPolarHBondContact CE-OE1 3.36Å; K103-E107 IonicContact NZ-OE1 3.32Å; K103-E107 WeakPolarHBondContact O-CB 3.49Å; K103-E107 WeakPolarHBondContact O-CG 3.4Å; K103-E107 PolarHBondContact O-N 2.89Å; E104-E107 PolarHBondContact O-N 3.47Å; E107-I110 PolarHBondContact O-N 3.3Å; E107-K111 WeakPolarHBondContact O-CB 3.48Å; E107-K111 VanDerWaalsContact O-CG 3.26Å; E107-K111 WeakPolarHBondContact O-CG 3.2Å; E107-K111 PolarHBondContact O-N 3.43Å
108A95.3Very high95.2Very high56 Ų5698 Ų9846%0.46351%0.506SS..Hα-helixtrans-63.3-4417400000111.3E104 D105 K111 S112E104-A108 WeakPolarHBondContact O-CB 3.43Å; E104-A108 PolarHBondContact O-N 3.32Å; D105-A108 PolarHBondContact O-N 3.23Å; A108-K111 PolarHBondContact O-N 3.03Å; A108-S112 PolarHBondContact O-N 3.47Å
109L96.6Very high95.3Very high92 Ų9297.2 Ų97.248%0.48250%0.5SS..Hα-helixtrans-61.7-47.1175.5-174.766000111.4D105 Y106 K111 S112 L113D105-L109 PolarHBondContact O-N 2.99Å; Y106-L109 PolarHBondContact O-N 2.98Å; L109-K111 VanDerWaalsContact C-N 3.3Å; L109-K111 PolarHBondContact O-N 2.9Å; L109-S112 PolarHBondContact O-N 3.29Å; L109-S112 PolarHBondContact O-OG 2.93Å; L109-L113 HydrophobicContact CG-CD1 4.11Å; L109-L113 WeakPolarHBondContact O-CG 3.26Å; L109-L113 PolarHBondContact O-N 2.92Å
110I95.6Very high95.4Very high89 Ų8996.5 Ų96.546%0.45650%0.496SS..Hα-helixtrans-58.9-42.2176.5-71164.4000110.8Y106 E107 L113 K114Y106-I110 WeakPolarHBondContact O-CB 3.47Å; Y106-I110 WeakPolarHBondContact O-CD1 3.41Å; Y106-I110 WeakPolarHBondContact O-CG1 3.44Å; Y106-I110 PolarHBondContact O-N 3.03Å; E107-I110 PolarHBondContact O-N 3.3Å; I110-L113 PolarHBondContact O-N 3.46Å; I110-K114 HydrophobicContact CG2-CD 4.15Å; I110-K114 HydrophobicContact CG2-CG 4.44Å; I110-K114 WeakPolarHBondContact O-CB 2.93Å; I110-K114 VanDerWaalsContact O-CG 3.31Å; I110-K114 WeakPolarHBondContact O-CG 3.31Å; I110-K114 PolarHBondContact O-N 3.47Å
111K95.9Very high95.4Very high136 Ų13696 Ų9659%0.59149%0.494SS*.Hα-helixtrans-61.1-47.2175.8-75168.4-174.8168.20111.1E107 A108 L109 L113 K114 V115E107-K111 WeakPolarHBondContact O-CB 3.48Å; E107-K111 VanDerWaalsContact O-CG 3.26Å; E107-K111 WeakPolarHBondContact O-CG 3.2Å; E107-K111 PolarHBondContact O-N 3.43Å; A108-K111 PolarHBondContact O-N 3.03Å; L109-K111 VanDerWaalsContact C-N 3.3Å; L109-K111 PolarHBondContact O-N 2.9Å; K111-L113 PolarHBondContact O-N 2.84Å; K111-K114 PolarHBondContact O-N 2.72Å; K111-V115 WeakPolarHBondContact O-CG2 3.42Å; K111-V115 PolarHBondContact O-N 3.17Å; K111-V115 VanDerWaalsContact O-N 3.08Å
112S95.4Very high95.5Very high64 Ų6496.8 Ų96.845%0.44850%0.497SS..Hα-helixtrans-62.2-41.5178.2730000112.7A108 L109 V115 L116A108-S112 PolarHBondContact O-N 3.47Å; L109-S112 PolarHBondContact O-N 3.29Å; L109-S112 PolarHBondContact O-OG 2.93Å; S112-V115 PolarHBondContact O-N 3.08Å; S112-L116 PolarHBondContact O-N 3.37Å
113L95.1Very high95.6Very high93 Ų9399.5 Ų99.549%0.48750%0.504SS..Hα-helixtrans-66.3-38.7177.1-72.2172.7000111.8L109 I110 K111 V115 L116 L117L109-L113 HydrophobicContact CG-CD1 4.11Å; L109-L113 WeakPolarHBondContact O-CG 3.26Å; L109-L113 PolarHBondContact O-N 2.92Å; I110-L113 PolarHBondContact O-N 3.46Å; K111-L113 PolarHBondContact O-N 2.84Å; L113-V115 VanDerWaalsContact C-N 3.34Å; L113-V115 PolarHBondContact O-N 3.12Å; L113-L116 PolarHBondContact O-N 3.34Å; L113-L117 WeakPolarHBondContact O-CB 3.42Å; L113-L117 PolarHBondContact O-N 2.98Å
114K95.7Very high95.7Very high147 Ų14797.8 Ų97.864%0.63950%0.499SS*.Hα-helixtrans-62.9-39174.7-78179.5177.2-175.40112.4I110 K111 L117 A118I110-K114 HydrophobicContact CG2-CD 4.15Å; I110-K114 HydrophobicContact CG2-CG 4.44Å; I110-K114 WeakPolarHBondContact O-CB 2.93Å; I110-K114 VanDerWaalsContact O-CG 3.31Å; I110-K114 WeakPolarHBondContact O-CG 3.31Å; I110-K114 PolarHBondContact O-N 3.47Å; K111-K114 PolarHBondContact O-N 2.72Å; K114-L117 PolarHBondContact O-N 3.49Å; K114-A118 PolarHBondContact O-N 3.18Å
115V96.1Very high95.7Very high85 Ų8595.7 Ų95.752%0.51549%0.494SS..Hα-helixtrans-64.1-47.9174.8173.70000110.3K111 S112 L113 L117 A118 E119K111-V115 WeakPolarHBondContact O-CG2 3.42Å; K111-V115 PolarHBondContact O-N 3.17Å; K111-V115 VanDerWaalsContact O-N 3.08Å; S112-V115 PolarHBondContact O-N 3.08Å; L113-V115 VanDerWaalsContact C-N 3.34Å; L113-V115 PolarHBondContact O-N 3.12Å; V115-L117 VanDerWaalsContact C-N 3.28Å; V115-L117 PolarHBondContact O-N 2.98Å; V115-A118 WeakPolarHBondContact O-CB 3.37Å; V115-A118 PolarHBondContact O-N 3.26Å; V115-E119 PolarHBondContact O-N 3.33Å
116L96.4Very high95.7Very high89 Ų8995.5 Ų95.547%0.46649%0.49SS..Hα-helixtrans-59.7-39.2177.1-176.667.7000112.2S112 L113 E119 L120S112-L116 PolarHBondContact O-N 3.37Å; L113-L116 PolarHBondContact O-N 3.34Å; L116-E119 PolarHBondContact O-N 3.04Å; L116-L120 HydrophobicContact CG-CD1 4.43Å; L116-L120 WeakPolarHBondContact O-CG 3.49Å; L116-L120 PolarHBondContact O-N 3.34Å
117L95.4Very high95.7Very high105 Ų10592.9 Ų92.955%0.5549%0.485SS..Hα-helixtrans-65.3-42.1178.2-145.6149.6000110.9L113 K114 V115 E119 L120 D121L113-L117 WeakPolarHBondContact O-CB 3.42Å; L113-L117 PolarHBondContact O-N 2.98Å; K114-L117 PolarHBondContact O-N 3.49Å; V115-L117 VanDerWaalsContact C-N 3.28Å; V115-L117 PolarHBondContact O-N 2.98Å; L117-E119 PolarHBondContact O-N 3.43Å; L117-L120 PolarHBondContact O-N 3.49Å; L117-D121 PolarHBondContact O-N 3.44Å
118A95.9Very high95.7Very high58 Ų5894.7 Ų94.748%0.47949%0.493SS..Hα-helixtrans-62.6-40.5173.900000112.7K114 V115 L120 D121 E122K114-A118 PolarHBondContact O-N 3.18Å; V115-A118 WeakPolarHBondContact O-CB 3.37Å; V115-A118 PolarHBondContact O-N 3.26Å; A118-L120 VanDerWaalsContact C-N 3.35Å; A118-D121 PolarHBondContact O-N 3.23Å; A118-E122 PolarHBondContact O-N 3.02Å
119E96.1Very high95.7Very high91 Ų9198.4 Ų98.443%0.42550%0.499SS..Hα-helixtrans-64.7-37.9175.1-70.8177.5-168.500112.5V115 L116 L117 K123V115-E119 PolarHBondContact O-N 3.33Å; L116-E119 PolarHBondContact O-N 3.04Å; L117-E119 PolarHBondContact O-N 3.43Å; E119-K123 WeakPolarHBondContact O-CG 3.5Å; E119-K123 PolarHBondContact O-N 2.9Å; E119-K123 VanDerWaalsContact O-N 3.12Å
120L95.7Very high95.6Very high87 Ų8799.3 Ų99.346%0.45550%0.499SS..Hα-helixtrans-69.2-42175.7-72.1175000111.4L116 L117 A118 E122 K123 I124L116-L120 HydrophobicContact CG-CD1 4.43Å; L116-L120 WeakPolarHBondContact O-CG 3.49Å; L116-L120 PolarHBondContact O-N 3.34Å; L117-L120 PolarHBondContact O-N 3.49Å; A118-L120 VanDerWaalsContact C-N 3.35Å; L120-E122 VanDerWaalsContact C-N 3.31Å; L120-E122 PolarHBondContact O-N 3.45Å; L120-K123 PolarHBondContact O-N 3.26Å; L120-I124 VanDerWaalsContact O-CG1 3.29Å; L120-I124 WeakPolarHBondContact O-CG1 3.37Å; L120-I124 PolarHBondContact O-N 2.96Å
121D95.4Very high95.6Very high82 Ų8298.8 Ų98.844%0.43950%0.496SS..Hα-helixtrans-60.8-41175-73.6-23.4000111.3L117 A118 K123 I124 V125L117-D121 PolarHBondContact O-N 3.44Å; A118-D121 PolarHBondContact O-N 3.23Å; D121-K123 PolarHBondContact O-N 2.94Å; D121-I124 WeakPolarHBondContact O-CB 3.46Å; D121-I124 PolarHBondContact O-N 3.4Å; D121-V125 WeakPolarHBondContact O-CG2 3.5Å; D121-V125 PolarHBondContact O-N 2.88Å
122E96.1Very high95.5Very high128 Ų12894.8 Ų94.860%0.59849%0.489SS*.Hα-helixtrans-62.6-44175.6-169.5167.5-156.900111.6A118 L120 I124 V125 E126A118-E122 PolarHBondContact O-N 3.02Å; L120-E122 VanDerWaalsContact C-N 3.31Å; L120-E122 PolarHBondContact O-N 3.45Å; E122-I124 VanDerWaalsContact C-N 3.33Å; E122-I124 PolarHBondContact O-N 2.89Å; E122-V125 PolarHBondContact O-N 3.5Å; E122-E126 WeakPolarHBondContact O-CG 3.47Å; E122-E126 PolarHBondContact O-N 3.24Å
123K96.2Very high95.4Very high120 Ų12096.1 Ų96.152%0.52249%0.49SS..Hα-helixtrans-62.9-37.3174.1-75.4172.7-177.8163.30112.7E119 L120 D121 E126 M127E119-K123 WeakPolarHBondContact O-CG 3.5Å; E119-K123 PolarHBondContact O-N 2.9Å; E119-K123 VanDerWaalsContact O-N 3.12Å; L120-K123 PolarHBondContact O-N 3.26Å; D121-K123 PolarHBondContact O-N 2.94Å; K123-E126 PolarHBondContact O-N 2.96Å; K123-M127 WeakPolarHBondContact O-CB 3.35Å; K123-M127 WeakPolarHBondContact O-CG 3.38Å; K123-M127 PolarHBondContact O-N 3.45Å
124I95.3Very high95.2Very high85 Ų8598.2 Ų98.244%0.43650%0.498SS..Hα-helixtrans-61.8-49.3174.9-71.4165.4000109.3L120 D121 E122 E126 M127 E128L120-I124 VanDerWaalsContact O-CG1 3.29Å; L120-I124 WeakPolarHBondContact O-CG1 3.37Å; L120-I124 PolarHBondContact O-N 2.96Å; D121-I124 WeakPolarHBondContact O-CB 3.46Å; D121-I124 PolarHBondContact O-N 3.4Å; E122-I124 VanDerWaalsContact C-N 3.33Å; E122-I124 PolarHBondContact O-N 2.89Å; I124-E126 VanDerWaalsContact C-N 3.33Å; I124-E126 PolarHBondContact O-N 3.45Å; I124-M127 PolarHBondContact O-N 3.49Å; I124-M127 VanDerWaalsContact O-N 3.13Å; I124-E128 HydrophobicContact CG2-CG 4.26Å; I124-E128 WeakPolarHBondContact O-CB 3.29Å; I124-E128 WeakPolarHBondContact O-CG 3.33Å; I124-E128 PolarHBondContact O-N 3.01Å
125V96.3Very high94.9Very high66 Ų6698 Ų9840%0.450%0.497SS..Hα-helixtrans-61-40.1178.81720000111.8D121 E122 E128 K129D121-V125 WeakPolarHBondContact O-CG2 3.5Å; D121-V125 PolarHBondContact O-N 2.88Å; E122-V125 PolarHBondContact O-N 3.5Å; V125-E128 PolarHBondContact O-N 3.43Å; V125-K129 HydrophobicContact CG1-CD 4.34Å; V125-K129 WeakPolarHBondContact O-CB 3.35Å; V125-K129 WeakPolarHBondContact O-CG 3.49Å; V125-K129 PolarHBondContact O-N 3.46Å
126E95.7Very high94.6Very high97 Ų9798.8 Ų98.845%0.45350%0.495SS..Hα-helixtrans-62.1-43.1174.6-74.5-173172.600112.7E122 K123 I124 K129 K130E122-E126 WeakPolarHBondContact O-CG 3.47Å; E122-E126 PolarHBondContact O-N 3.24Å; K123-E126 PolarHBondContact O-N 2.96Å; I124-E126 VanDerWaalsContact C-N 3.33Å; I124-E126 PolarHBondContact O-N 3.45Å; E126-K129 PolarHBondContact O-N 3.47Å; E126-K130 WeakPolarHBondContact O-CG 3.28Å; E126-K130 PolarHBondContact O-N 3.13Å
127M95.1Very high94.2Very high101 Ų10199.2 Ų99.250%0.49850%0.497SS..Hα-helixtrans-68.6-40.5178.1-73.3-60.3-63.200111.7K123 I124 K129 K130 I131K123-M127 WeakPolarHBondContact O-CB 3.35Å; K123-M127 WeakPolarHBondContact O-CG 3.38Å; K123-M127 PolarHBondContact O-N 3.45Å; I124-M127 PolarHBondContact O-N 3.49Å; I124-M127 VanDerWaalsContact O-N 3.13Å; M127-K129 VanDerWaalsContact C-N 3.33Å; M127-K129 PolarHBondContact O-N 2.83Å; M127-K130 PolarHBondContact O-N 3.36Å; M127-K130 HydrophobicContact SD-CD 4Å; M127-I131 VanDerWaalsContact O-CG1 3.29Å; M127-I131 WeakPolarHBondContact O-CG1 3.4Å; M127-I131 PolarHBondContact O-N 3.19Å
128E94Very high93.7Very high118 Ų118100.6 Ų100.655%0.55150%0.498SS*.Hα-helixtrans-59.8-42.9173.1-73.9-178.7160.900111.7I124 V125 K130 I131 A132I124-E128 HydrophobicContact CG2-CG 4.26Å; I124-E128 WeakPolarHBondContact O-CB 3.29Å; I124-E128 WeakPolarHBondContact O-CG 3.33Å; I124-E128 PolarHBondContact O-N 3.01Å; V125-E128 PolarHBondContact O-N 3.43Å; E128-K130 PolarHBondContact O-N 2.88Å; E128-I131 PolarHBondContact O-N 2.94Å; E128-A132 WeakPolarHBondContact O-CB 3.38Å; E128-A132 PolarHBondContact O-N 3.27Å
129K95.1Very high93.1Very high133 Ų133101 Ų10158%0.57850%0.495SS*.Hα-helixtrans-60.4-44.1173.1-76.8173.9-177.9172.50112V125 E126 M127 A132 N133V125-K129 HydrophobicContact CG1-CD 4.34Å; V125-K129 WeakPolarHBondContact O-CB 3.35Å; V125-K129 WeakPolarHBondContact O-CG 3.49Å; V125-K129 PolarHBondContact O-N 3.46Å; E126-K129 PolarHBondContact O-N 3.47Å; M127-K129 VanDerWaalsContact C-N 3.33Å; M127-K129 PolarHBondContact O-N 2.83Å; K129-A132 PolarHBondContact O-N 2.98Å; K129-N133 WeakPolarHBondContact O-CB 3.36Å; K129-N133 VanDerWaalsContact O-CG 3.24Å; K129-N133 PolarHBondContact O-N 3.36Å; K129-N133 PolarHBondContact O-ND2 2.84Å
130K95.8Very high92.5Very high111 Ų111102.4 Ų102.448%0.48350%0.5SS..Hα-helixtrans-61.8-43.4176.3-73.2169.6-175.7163.90111.5E126 M127 E128 N133 Q134E126-K130 WeakPolarHBondContact O-CG 3.28Å; E126-K130 PolarHBondContact O-N 3.13Å; M127-K130 PolarHBondContact O-N 3.36Å; M127-K130 HydrophobicContact SD-CD 4Å; E128-K130 PolarHBondContact O-N 2.88Å; K130-N133 PolarHBondContact O-N 3.43Å; K130-Q134 WeakPolarHBondContact O-CG 3.29Å; K130-Q134 PolarHBondContact O-N 3.3Å
131I94.6Very high91.9Very high78 Ų78102.5 Ų102.540%0.450%0.5SS..Hα-helixtrans-63.7-44.4176.8-68.5166000110.7M127 E128 Q134 K135M127-I131 VanDerWaalsContact O-CG1 3.29Å; M127-I131 WeakPolarHBondContact O-CG1 3.4Å; M127-I131 PolarHBondContact O-N 3.19Å; E128-I131 PolarHBondContact O-N 2.94Å; I131-Q134 PolarHBondContact O-N 2.89Å; I131-K135 HydrophobicContact CG2-CD 4.12Å; I131-K135 HydrophobicContact CG2-CG 4.43Å; I131-K135 WeakPolarHBondContact O-CB 3.46Å; I131-K135 WeakPolarHBondContact O-CG 3.41Å; I131-K135 PolarHBondContact O-N 2.91Å
132A93.8Very high91Very high53 Ų53104 Ų10444%0.43850%0.504SS..Hα-helixtrans-61.1-45.5177.800000111.6E128 K129 Q134 K135 Q136E128-A132 WeakPolarHBondContact O-CB 3.38Å; E128-A132 PolarHBondContact O-N 3.27Å; K129-A132 PolarHBondContact O-N 2.98Å; A132-Q134 PolarHBondContact O-N 2.9Å; A132-K135 PolarHBondContact O-N 3.49Å; A132-Q136 WeakPolarHBondContact O-CB 3.5Å; A132-Q136 PolarHBondContact O-N 3.42Å
133N93.1Very high90Very high91 Ų91104.3 Ų104.349%0.48751%0.506SS..Hα-helixtrans-61.8-44.7176.8-71.3-15.5000111.9K129 K130 Q136 I137K129-N133 WeakPolarHBondContact O-CB 3.36Å; K129-N133 VanDerWaalsContact O-CG 3.24Å; K129-N133 PolarHBondContact O-N 3.36Å; K129-N133 PolarHBondContact O-ND2 2.84Å; K130-N133 PolarHBondContact O-N 3.43Å; N133-Q136 PolarHBondContact O-N 2.95Å; N133-I137 VanDerWaalsContact O-CG1 3.28Å; N133-I137 WeakPolarHBondContact O-CG1 3.3Å; N133-I137 PolarHBondContact O-N 3.35Å
134Q90.8Very high88.9Confident137 Ų137102.4 Ų102.464%0.6451%0.513SS*.Hα-helixtrans-63.6-42.7176.3-75.5179.4-7.300112.2K130 I131 A132 Q136 I137 F138K130-Q134 WeakPolarHBondContact O-CG 3.29Å; K130-Q134 PolarHBondContact O-N 3.3Å; I131-Q134 PolarHBondContact O-N 2.89Å; A132-Q134 PolarHBondContact O-N 2.9Å; Q134-Q136 VanDerWaalsContact C-N 3.3Å; Q134-Q136 PolarHBondContact O-N 3.3Å; Q134-I137 PolarHBondContact O-N 3.3Å; Q134-F138 WeakPolarHBondContact O-CB 3.46Å; Q134-F138 PolarHBondContact O-N 2.91Å
135K89.3Confident87.9Confident143 Ų143104.2 Ų104.262%0.62252%0.523SS*.Hα-helixtrans-60.1-40.9174.3-76.6179.6177.71800111.6I131 A132 F138 T139I131-K135 HydrophobicContact CG2-CD 4.12Å; I131-K135 HydrophobicContact CG2-CG 4.43Å; I131-K135 WeakPolarHBondContact O-CB 3.46Å; I131-K135 WeakPolarHBondContact O-CG 3.41Å; I131-K135 PolarHBondContact O-N 2.91Å; A132-K135 PolarHBondContact O-N 3.49Å; K135-F138 PolarHBondContact O-N 3.43Å; K135-T139 PolarHBondContact O-N 2.95Å; K135-T139 PolarHBondContact O-OG1 2.87Å
136Q90.3Very high87.1Confident101 Ų101103.8 Ų103.847%0.47252%0.519SS..Hα-helixtrans-67-41.3177.5-165.5-174.216.400112.1A132 N133 Q134 T139 K140A132-Q136 WeakPolarHBondContact O-CB 3.5Å; A132-Q136 PolarHBondContact O-N 3.42Å; N133-Q136 PolarHBondContact O-N 2.95Å; Q134-Q136 VanDerWaalsContact C-N 3.3Å; Q134-Q136 PolarHBondContact O-N 3.3Å; Q136-T139 VanDerWaalsContact CA-OG1 3.3Å; Q136-T139 WeakPolarHBondContact CA-OG1 3.45Å; Q136-T139 PolarHBondContact O-OG1 3.31Å; Q136-K140 WeakPolarHBondContact O-CB 3.36Å; Q136-K140 WeakPolarHBondContact O-CG 3.25Å; Q136-K140 PolarHBondContact O-N 3.49Å
137I88.1Confident86.5Confident98 Ų98103.5 Ų103.550%0.50353%0.525SS..Hα-helixtrans-64.7-45175.6-68.3164.2000110N133 Q134 T139 K140 I141N133-I137 VanDerWaalsContact O-CG1 3.28Å; N133-I137 WeakPolarHBondContact O-CG1 3.3Å; N133-I137 PolarHBondContact O-N 3.35Å; Q134-I137 PolarHBondContact O-N 3.3Å; I137-T139 PolarHBondContact O-N 3.06Å; I137-K140 PolarHBondContact O-N 3.03Å; I137-I141 HydrophobicContact CG2-CD1 3.63Å; I137-I141 HydrophobicContact CG2-CG1 4.33Å; I137-I141 VanDerWaalsContact O-CG1 3.25Å; I137-I141 WeakPolarHBondContact O-CG1 3.32Å; I137-I141 PolarHBondContact O-N 3.42Å
138F85.4Confident86Confident134 Ų134108.1 Ų108.159%0.58854%0.537SS*.Hα-helixtrans-62-44179-174.9-96000112.5Q134 K135 I141 Q142Q134-F138 WeakPolarHBondContact O-CB 3.46Å; Q134-F138 PolarHBondContact O-N 2.91Å; K135-F138 PolarHBondContact O-N 3.43Å; F138-I141 PolarHBondContact O-N 3.44Å; F138-Q142 WeakPolarHBondContact O-CB 3.38Å; F138-Q142 PolarHBondContact O-N 3.31Å
139T82.5Confident85.6Confident67 Ų67109.2 Ų109.241%0.41154%0.54SS..Hα-helixtrans-62.2-44.8175.130.20000111.8K135 Q136 I137 I141 Q142 E143K135-T139 PolarHBondContact O-N 2.95Å; K135-T139 PolarHBondContact O-OG1 2.87Å; Q136-T139 VanDerWaalsContact CA-OG1 3.3Å; Q136-T139 WeakPolarHBondContact CA-OG1 3.45Å; Q136-T139 PolarHBondContact O-OG1 3.31Å; I137-T139 PolarHBondContact O-N 3.06Å; T139-I141 VanDerWaalsContact C-N 3.34Å; T139-I141 PolarHBondContact O-N 2.68Å; T139-Q142 PolarHBondContact O-N 2.88Å; T139-E143 WeakPolarHBondContact O-CG 3.34Å; T139-E143 PolarHBondContact O-N 3.46Å
140K85Confident85.2Confident120 Ų120107.9 Ų107.952%0.52254%0.538SS..Hα-helixtrans-60.5-41.1174.7-73.6176180177.30112.6Q136 I137 E143 A144Q136-K140 WeakPolarHBondContact O-CB 3.36Å; Q136-K140 WeakPolarHBondContact O-CG 3.25Å; Q136-K140 PolarHBondContact O-N 3.49Å; I137-K140 PolarHBondContact O-N 3.03Å; K140-E143 PolarHBondContact O-N 3Å; K140-A144 WeakPolarHBondContact O-CB 3.38Å; K140-A144 PolarHBondContact O-N 3.22Å
141I81.3Confident85Confident89 Ų89109.1 Ų109.146%0.45655%0.546SS..Hα-helixtrans-65.1-41.6176.4-69.5167.7000110.7I137 F138 T139 A144 N145I137-I141 HydrophobicContact CG2-CD1 3.63Å; I137-I141 HydrophobicContact CG2-CG1 4.33Å; I137-I141 VanDerWaalsContact O-CG1 3.25Å; I137-I141 WeakPolarHBondContact O-CG1 3.32Å; I137-I141 PolarHBondContact O-N 3.42Å; F138-I141 PolarHBondContact O-N 3.44Å; T139-I141 VanDerWaalsContact C-N 3.34Å; T139-I141 PolarHBondContact O-N 2.68Å; I141-A144 PolarHBondContact O-N 2.82Å; I141-N145 WeakPolarHBondContact O-CB 3Å; I141-N145 PolarHBondContact O-N 2.89Å
142Q76.9Confident85Confident115 Ų115112.5 Ų112.554%0.53756%0.558SS.*Hα-helixtrans-67.4-36.5178-170.9175.65.100112.3F138 T139 N145F138-Q142 WeakPolarHBondContact O-CB 3.38Å; F138-Q142 PolarHBondContact O-N 3.31Å; T139-Q142 PolarHBondContact O-N 2.88Å; Q142-N145 CarbonylContact O-C 3.59Å
143E75.1Confident84.9Confident133 Ų133115.7 Ų115.762%0.62156%0.564SS**Hα-helixtrans-67.4-41.7174.4-75.4176.8177.500112.3T139 K140 N146T139-E143 WeakPolarHBondContact O-CG 3.34Å; T139-E143 PolarHBondContact O-N 3.46Å; K140-E143 PolarHBondContact O-N 3Å; E143-N146 PolarHBondContact O-ND2 2.88Å
144A73.4Confident85Confident81 Ų81115 Ų11567%0.66956%0.559SS**Hα-helixtrans-70.2-47.2177.700000112.2K140 I141 N146K140-A144 WeakPolarHBondContact O-CB 3.38Å; K140-A144 PolarHBondContact O-N 3.22Å; I141-A144 PolarHBondContact O-N 2.82Å; A144-N146 VanDerWaalsContact C-N 3.28Å; A144-N146 PolarHBondContact O-N 3.15Å; A144-N146 VanDerWaalsContact O-N 3.15Å
145N74.1Confident85.3Confident123 Ų123114 Ų11466%0.65855%0.554SS**  trans-89.263.2174.9-76-30.7000110.6I141 Q142 P147I141-N145 WeakPolarHBondContact O-CB 3Å; I141-N145 PolarHBondContact O-N 2.89Å; Q142-N145 CarbonylContact O-C 3.59Å; N145-P147 WeakPolarHBondContact O-CD 3.35Å
146N80.1Confident85.6Confident57 Ų57112.5 Ų112.531%0.30555%0.552SS.*  trans-83.797168.3-101.7-61.5000109.1E143 A144 R148 K149 L150E143-N146 PolarHBondContact O-ND2 2.88Å; A144-N146 VanDerWaalsContact C-N 3.28Å; A144-N146 PolarHBondContact O-N 3.15Å; A144-N146 VanDerWaalsContact O-N 3.15Å; N146-R148 PolarHBondContact O-N 2.93Å; N146-R148 VanDerWaalsContact O-N 3.09Å; N146-K149 HydrophobicContact CB-CB 4.09Å; N146-K149 HydrophobicContact CB-CD 3.96Å; N146-K149 HydrophobicContact CB-CG 3.95Å; N146-K149 PolarHBondContact O-N 3.09Å; N146-L150 PolarHBondContact O-N 3.21Å
147P82.3Confident85.9Confident90 Ų90112.6 Ų112.658%0.58456%0.555SS**Hα-helixtrans-59.5-30.6-175.625.8-36.3000111.6N145 K149 L150 Q151N145-P147 WeakPolarHBondContact O-CD 3.35Å; P147-K149 PolarHBondContact O-N 3.08Å; P147-L150 PolarHBondContact O-N 3.34Å; P147-Q151 WeakPolarHBondContact O-CB 3.19Å; P147-Q151 PolarHBondContact O-N 2.8Å
148R85.6Confident86.3Confident198 Ų198112.6 Ų112.675%0.74755%0.553SS**Hα-helixtrans-64.2-37.6175.4-65-177.4179.4-177.8-0.3113.1N146 K152N146-R148 PolarHBondContact O-N 2.93Å; N146-R148 VanDerWaalsContact O-N 3.09Å; R148-K152 WeakPolarHBondContact O-CB 3.31Å; R148-K152 VanDerWaalsContact O-CG 3.25Å; R148-K152 WeakPolarHBondContact O-CG 3.33Å; R148-K152 PolarHBondContact O-N 2.84Å; R148-K152 VanDerWaalsContact O-N 3.07Å
149K85.9Confident86.9Confident141 Ų141109.5 Ų109.561%0.61355%0.545SS*.Hα-helixtrans-71.1-45177.4-72.1-176.8-177.7175.20110.2N146 P147 Q151 K152 Q153N146-K149 HydrophobicContact CB-CB 4.09Å; N146-K149 HydrophobicContact CB-CD 3.96Å; N146-K149 HydrophobicContact CB-CG 3.95Å; N146-K149 PolarHBondContact O-N 3.09Å; P147-K149 PolarHBondContact O-N 3.08Å; K149-Q151 PolarHBondContact O-N 3.44Å; K149-K152 PolarHBondContact O-N 2.98Å; K149-Q153 WeakPolarHBondContact O-CB 3.35Å; K149-Q153 PolarHBondContact O-N 2.96Å
150L87.1Confident87.6Confident105 Ų105114.9 Ų114.955%0.5556%0.558SS.*Hα-helixtrans-60.7-45.2176.4-175.763.3000111.4N146 P147 K152 Q153 I154N146-L150 PolarHBondContact O-N 3.21Å; P147-L150 PolarHBondContact O-N 3.34Å; L150-K152 PolarHBondContact O-N 3.35Å; L150-Q153 WeakPolarHBondContact O-CB 3.46Å; L150-Q153 PolarHBondContact O-N 3.5Å; L150-Q153 VanDerWaalsContact O-N 3.14Å; L150-I154 HydrophobicContact CG-CD1 4.06Å; L150-I154 WeakPolarHBondContact O-CG1 3.47Å; L150-I154 PolarHBondContact O-N 3.49Å
151Q91.6Very high88.2Confident137 Ų137114.4 Ų114.464%0.6456%0.56SS**Hα-helixtrans-65.1-39178.5-168169.311.700112.6P147 K149 Q153 I154 H155P147-Q151 WeakPolarHBondContact O-CB 3.19Å; P147-Q151 PolarHBondContact O-N 2.8Å; K149-Q151 PolarHBondContact O-N 3.44Å; Q151-Q153 VanDerWaalsContact C-N 3.32Å; Q151-Q153 PolarHBondContact O-N 3.48Å; Q151-I154 PolarHBondContact O-N 2.83Å; Q151-H155 WeakPolarHBondContact O-CB 3.5Å; Q151-H155 PolarHBondContact O-N 3.37Å
152K92.8Very high89Confident149 Ų149114.9 Ų114.965%0.64856%0.564SS**Hα-helixtrans-61.4-41.9170.9-76.4176.7-178.7-170.60111.6R148 K149 L150 H155 I156R148-K152 WeakPolarHBondContact O-CB 3.31Å; R148-K152 VanDerWaalsContact O-CG 3.25Å; R148-K152 WeakPolarHBondContact O-CG 3.33Å; R148-K152 PolarHBondContact O-N 2.84Å; R148-K152 VanDerWaalsContact O-N 3.07Å; K149-K152 PolarHBondContact O-N 2.98Å; L150-K152 PolarHBondContact O-N 3.35Å; K152-H155 PolarHBondContact O-N 3.14Å; K152-I156 WeakPolarHBondContact O-CD1 3.23Å; K152-I156 VanDerWaalsContact O-CG1 3.24Å; K152-I156 WeakPolarHBondContact O-CG1 3.38Å; K152-I156 PolarHBondContact O-N 3.4Å
153Q93.2Very high90Very high121 Ų121115.3 Ų115.357%0.56557%0.569SS**Hα-helixtrans-66.5-42.6178.9-168.1169.95.400111.8K149 L150 Q151 I156 L157K149-Q153 WeakPolarHBondContact O-CB 3.35Å; K149-Q153 PolarHBondContact O-N 2.96Å; L150-Q153 WeakPolarHBondContact O-CB 3.46Å; L150-Q153 PolarHBondContact O-N 3.5Å; L150-Q153 VanDerWaalsContact O-N 3.14Å; Q151-Q153 VanDerWaalsContact C-N 3.32Å; Q151-Q153 PolarHBondContact O-N 3.48Å; Q153-I156 PolarHBondContact O-N 3.34Å; Q153-L157 HydrophobicContact CG-CD1 4.45Å; Q153-L157 VanDerWaalsContact O-CG 3.31Å; Q153-L157 WeakPolarHBondContact O-CG 3.45Å; Q153-L157 PolarHBondContact O-N 3.07Å
154I94Very high91.1Very high77 Ų77113 Ų11340%0.39556%0.564SS.*Hα-helixtrans-57.5-49.7171.8-69.2166.7000109.8L150 Q151 I156 L157 E158L150-I154 HydrophobicContact CG-CD1 4.06Å; L150-I154 WeakPolarHBondContact O-CG1 3.47Å; L150-I154 PolarHBondContact O-N 3.49Å; Q151-I154 PolarHBondContact O-N 2.83Å; I154-I156 VanDerWaalsContact C-N 3.33Å; I154-I156 PolarHBondContact O-N 3.43Å; I154-L157 CarbonylContact O-C 3.48Å; I154-L157 PolarHBondContact O-N 3.48Å; I154-L157 VanDerWaalsContact O-N 3.08Å; I154-E158 HydrophobicContact CG2-CG 4.18Å; I154-E158 WeakPolarHBondContact CG2-OE1 3.33Å; I154-E158 WeakPolarHBondContact O-CB 3.49Å; I154-E158 WeakPolarHBondContact O-CG 3.25Å; I154-E158 PolarHBondContact O-N 2.9Å
155H96.8Very high92.2Very high115 Ų115112.1 Ų112.153%0.53255%0.55SS.*Hα-helixtrans-61.7-38.2-179.8-171.860.7000113.3Q151 K152 E158 T159Q151-H155 WeakPolarHBondContact O-CB 3.5Å; Q151-H155 PolarHBondContact O-N 3.37Å; K152-H155 PolarHBondContact O-N 3.14Å; H155-E158 IonicContact ND1-OE2 3.17Å; H155-T159 VanDerWaalsContact O-CB 3.32Å; H155-T159 WeakPolarHBondContact O-CB 3.37Å; H155-T159 PolarHBondContact O-N 3.36Å; H155-T159 PolarHBondContact O-OG1 3.13Å
156I96.5Very high93.3Very high112 Ų112109.7 Ų109.757%0.57454%0.54SS*.Hα-helixtrans-64.1-43.8174-70.1163.6000110.5K152 Q153 I154 T159 R160K152-I156 WeakPolarHBondContact O-CD1 3.23Å; K152-I156 VanDerWaalsContact O-CG1 3.24Å; K152-I156 WeakPolarHBondContact O-CG1 3.38Å; K152-I156 PolarHBondContact O-N 3.4Å; Q153-I156 PolarHBondContact O-N 3.34Å; I154-I156 VanDerWaalsContact C-N 3.33Å; I154-I156 PolarHBondContact O-N 3.43Å; I156-T159 PolarHBondContact O-N 3.45Å; I156-R160 WeakPolarHBondContact O-CB 3.35Å; I156-R160 PolarHBondContact O-N 3.26Å
157L96.9Very high94.2Very high102 Ų102112.1 Ų112.153%0.53455%0.549SS..Hα-helixtrans-66.1-41.9178.3-70.5172.1000111.7Q153 I154 R160 L161Q153-L157 HydrophobicContact CG-CD1 4.45Å; Q153-L157 VanDerWaalsContact O-CG 3.31Å; Q153-L157 WeakPolarHBondContact O-CG 3.45Å; Q153-L157 PolarHBondContact O-N 3.07Å; I154-L157 CarbonylContact O-C 3.48Å; I154-L157 PolarHBondContact O-N 3.48Å; I154-L157 VanDerWaalsContact O-N 3.08Å; L157-R160 PolarHBondContact O-N 2.99Å; L157-L161 WeakPolarHBondContact O-CB 3.24Å; L157-L161 PolarHBondContact O-N 3.15Å
158E96.8Very high94.9Very high98 Ų98113.5 Ų113.546%0.45855%0.546SS..Hα-helixtrans-61.4-45.7173.5-73.3172.7170.200111.4I154 H155 R160 L161 N162I154-E158 HydrophobicContact CG2-CG 4.18Å; I154-E158 WeakPolarHBondContact CG2-OE1 3.33Å; I154-E158 WeakPolarHBondContact O-CB 3.49Å; I154-E158 WeakPolarHBondContact O-CG 3.25Å; I154-E158 PolarHBondContact O-N 2.9Å; H155-E158 IonicContact ND1-OE2 3.17Å; E158-R160 VanDerWaalsContact C-N 3.33Å; E158-R160 PolarHBondContact O-N 3.3Å; E158-L161 PolarHBondContact O-N 3.39Å; E158-N162 WeakPolarHBondContact O-CB 3.4Å; E158-N162 PolarHBondContact O-N 2.84Å; E158-N162 PolarHBondContact O-ND2 3.33Å
159T97.4Very high95.5Very high69 Ų69107.7 Ų107.742%0.42353%0.53SS..Hα-helixtrans-63.1-42177.7-570000111H155 I156 N162 L163H155-T159 VanDerWaalsContact O-CB 3.32Å; H155-T159 WeakPolarHBondContact O-CB 3.37Å; H155-T159 PolarHBondContact O-N 3.36Å; H155-T159 PolarHBondContact O-OG1 3.13Å; I156-T159 PolarHBondContact O-N 3.45Å; T159-N162 PolarHBondContact O-N 3.13Å; T159-L163 WeakPolarHBondContact O-CB 3.49Å; T159-L163 PolarHBondContact O-N 2.87Å
160R97.4Very high96.1Very high180 Ų180107 Ų10768%0.67953%0.527SS*.Hα-helixtrans-64.5-42176.1-175.3175.3176.4175.1-1.3111.4I156 L157 E158 L163 V164I156-R160 WeakPolarHBondContact O-CB 3.35Å; I156-R160 PolarHBondContact O-N 3.26Å; L157-R160 PolarHBondContact O-N 2.99Å; E158-R160 VanDerWaalsContact C-N 3.33Å; E158-R160 PolarHBondContact O-N 3.3Å; R160-L163 PolarHBondContact O-N 3.02Å; R160-V164 WeakPolarHBondContact O-CG2 3.49Å; R160-V164 PolarHBondContact O-N 3.26Å
161L97.9Very high96.6Very high110 Ų110106.6 Ų106.658%0.57652%0.524SS*.Hα-helixtrans-60.6-50.1175.4179.462.9000110.4L157 E158 L163 V164 T165L157-L161 WeakPolarHBondContact O-CB 3.24Å; L157-L161 PolarHBondContact O-N 3.15Å; E158-L161 PolarHBondContact O-N 3.39Å; L161-L163 VanDerWaalsContact C-N 3.29Å; L161-L163 PolarHBondContact O-N 3.17Å; L161-V164 PolarHBondContact O-N 3.46Å; L161-V164 VanDerWaalsContact O-N 3.13Å; L161-T165 PolarHBondContact O-N 3.3Å; L161-T165 PolarHBondContact O-OG1 3.41Å
162N97.3Very high96.9Very high99 Ų99104.3 Ų104.353%0.52952%0.515SS..Hα-helixtrans-58.2-41.5177.7-70.8-21.4000111.9E158 T159 V164 T165 V166E158-N162 WeakPolarHBondContact O-CB 3.4Å; E158-N162 PolarHBondContact O-N 2.84Å; E158-N162 PolarHBondContact O-ND2 3.33Å; T159-N162 PolarHBondContact O-N 3.13Å; N162-V164 PolarHBondContact O-N 3.36Å; N162-T165 PolarHBondContact O-N 3.45Å; N162-V166 WeakPolarHBondContact O-CB 3.32Å; N162-V166 VanDerWaalsContact O-CG2 3.28Å; N162-V166 WeakPolarHBondContact O-CG2 3.31Å; N162-V166 PolarHBondContact O-N 2.87Å
163L97.8Very high97.1Very high125 Ų125101 Ų10165%0.65451%0.508SS*.Hα-helixtrans-63.1-41.9177.3-167.8117000111.9T159 R160 L161 H167T159-L163 WeakPolarHBondContact O-CB 3.49Å; T159-L163 PolarHBondContact O-N 2.87Å; R160-L163 PolarHBondContact O-N 3.02Å; L161-L163 VanDerWaalsContact C-N 3.29Å; L161-L163 PolarHBondContact O-N 3.17Å; L163-H167 WeakPolarHBondContact O-CB 3.4Å; L163-H167 PolarHBondContact O-N 2.84Å
164V97.6Very high97.4Very high84 Ų8498.2 Ų98.251%0.50950%0.499SS..Hα-helixtrans-66.6-42.8175.8172.90000111.1R160 L161 N162 H167 F168R160-V164 WeakPolarHBondContact O-CG2 3.49Å; R160-V164 PolarHBondContact O-N 3.26Å; L161-V164 PolarHBondContact O-N 3.46Å; L161-V164 VanDerWaalsContact O-N 3.13Å; N162-V164 PolarHBondContact O-N 3.36Å; V164-H167 PolarHBondContact O-N 2.89Å; V164-F168 WeakPolarHBondContact O-CB 3.42Å; V164-F168 PolarHBondContact O-N 2.93Å
165T97.4Very high97.6Very high62 Ų6297.9 Ų97.938%0.3850%0.498SS..Hα-helixtrans-61-48.2176.3-550000111.1L161 N162 H167 F168 D169L161-T165 PolarHBondContact O-N 3.3Å; L161-T165 PolarHBondContact O-OG1 3.41Å; N162-T165 PolarHBondContact O-N 3.45Å; T165-H167 VanDerWaalsContact C-N 3.3Å; T165-H167 PolarHBondContact O-N 3.41Å; T165-F168 WeakPolarHBondContact O-CB 3.41Å; T165-F168 PolarHBondContact O-N 2.74Å; T165-F168 VanDerWaalsContact O-N 3.1Å; T165-D169 VanDerWaalsContact O-CG 3.3Å; T165-D169 PolarHBondContact O-N 2.74Å
166V97.9Very high97.6Very high73 Ų7394.7 Ų94.744%0.44249%0.491SS..Hα-helixtrans-61.5-39.5176.5169.50000111.5N162 D169 K170N162-V166 WeakPolarHBondContact O-CB 3.32Å; N162-V166 VanDerWaalsContact O-CG2 3.28Å; N162-V166 WeakPolarHBondContact O-CG2 3.31Å; N162-V166 PolarHBondContact O-N 2.87Å; V166-D169 PolarHBondContact O-N 2.93Å; V166-K170 HydrophobicContact CG1-CD 4.22Å; V166-K170 WeakPolarHBondContact O-CB 3.42Å; V166-K170 VanDerWaalsContact O-CG 3.26Å; V166-K170 WeakPolarHBondContact O-CG 3.09Å; V166-K170 PolarHBondContact O-N 3.26Å
167H97.9Very high97.7Very high108 Ų10896.4 Ų96.450%0.550%0.495SS..Hα-helixtrans-63-44.3174.3179.5-81.1000111.4L163 V164 T165 K170 M171L163-H167 WeakPolarHBondContact O-CB 3.4Å; L163-H167 PolarHBondContact O-N 2.84Å; V164-H167 PolarHBondContact O-N 2.89Å; T165-H167 VanDerWaalsContact C-N 3.3Å; T165-H167 PolarHBondContact O-N 3.41Å; H167-K170 WeakPolarHBondContact O-CB 3.47Å; H167-K170 PolarHBondContact O-N 3.15Å; H167-M171 WeakPolarHBondContact O-CG 3.45Å; H167-M171 PolarHBondContact O-N 3.4Å
168F97.8Very high97.8Very high118 Ų11896 Ų9652%0.51849%0.493SS..Hα-helixtrans-61.2-44.8176.4178.4-104.3000111.9V164 T165 K170 M171 L172V164-F168 WeakPolarHBondContact O-CB 3.42Å; V164-F168 PolarHBondContact O-N 2.93Å; T165-F168 WeakPolarHBondContact O-CB 3.41Å; T165-F168 PolarHBondContact O-N 2.74Å; T165-F168 VanDerWaalsContact O-N 3.1Å; F168-K170 VanDerWaalsContact C-N 3.33Å; F168-K170 PolarHBondContact O-N 3.35Å; F168-M171 CarbonylContact O-C 3.44Å; F168-M171 WeakPolarHBondContact O-CA 3.47Å; F168-M171 WeakPolarHBondContact O-CB 3.43Å; F168-M171 PolarHBondContact O-N 3.32Å; F168-M171 VanDerWaalsContact O-N 3.08Å; F168-L172 HydrophobicContact CD1-CD1 3.88Å; F168-L172 HydrophobicContact CD1-CG 4.29Å; F168-L172 HydrophobicContact CE1-CD1 3.32Å; F168-L172 HydrophobicContact CE1-CG 3.92Å; F168-L172 HydrophobicContact CE2-CD2 4.47Å; F168-L172 HydrophobicContact CE2-CG 4.4Å; F168-L172 HydrophobicContact CZ-CD1 3.74Å; F168-L172 HydrophobicContact CZ-CD2 4.1Å; F168-L172 HydrophobicContact CZ-CG 3.97Å; F168-L172 PolarHBondContact O-N 3.37Å
169D97.8Very high97.9Very high77 Ų7799.6 Ų99.641%0.41250%0.502SS..Hα-helixtrans-64.1-37.8176.7-65.4-26.2000112T165 V166 M171 L172 T173T165-D169 VanDerWaalsContact O-CG 3.3Å; T165-D169 PolarHBondContact O-N 2.74Å; V166-D169 PolarHBondContact O-N 2.93Å; D169-M171 VanDerWaalsContact C-N 3.35Å; D169-L172 PolarHBondContact O-N 3.45Å; D169-T173 WeakPolarHBondContact O-CG2 3.43Å; D169-T173 PolarHBondContact O-N 3.34Å; D169-T173 PolarHBondContact O-OG1 2.92Å
170K97.9Very high97.9Very high127 Ų127103.3 Ų103.355%0.55251%0.512SS*.Hα-helixtrans-61.8-41.7170.9-75.6172.9-178.81790111.7V166 H167 F168 T173 T174V166-K170 HydrophobicContact CG1-CD 4.22Å; V166-K170 WeakPolarHBondContact O-CB 3.42Å; V166-K170 VanDerWaalsContact O-CG 3.26Å; V166-K170 WeakPolarHBondContact O-CG 3.09Å; V166-K170 PolarHBondContact O-N 3.26Å; H167-K170 WeakPolarHBondContact O-CB 3.47Å; H167-K170 PolarHBondContact O-N 3.15Å; F168-K170 VanDerWaalsContact C-N 3.33Å; F168-K170 PolarHBondContact O-N 3.35Å; K170-T173 WeakPolarHBondContact CA-OG1 3.49Å; K170-T173 PolarHBondContact O-N 3.06Å; K170-T173 PolarHBondContact O-OG1 2.93Å; K170-T174 WeakPolarHBondContact O-CB 3.48Å; K170-T174 VanDerWaalsContact O-CG2 3.31Å; K170-T174 WeakPolarHBondContact O-CG2 3.38Å; K170-T174 PolarHBondContact O-N 3.49Å; K170-T174 PolarHBondContact O-OG1 3.26Å
171M97.2Very high98Very high96 Ų96100 Ų10047%0.47351%0.505SS..Hα-helixtrans-65.7-39.3175-69-62.611500111.7H167 F168 D169 T174 N175H167-M171 WeakPolarHBondContact O-CG 3.45Å; H167-M171 PolarHBondContact O-N 3.4Å; F168-M171 CarbonylContact O-C 3.44Å; F168-M171 WeakPolarHBondContact O-CA 3.47Å; F168-M171 WeakPolarHBondContact O-CB 3.43Å; F168-M171 PolarHBondContact O-N 3.32Å; F168-M171 VanDerWaalsContact O-N 3.08Å; D169-M171 VanDerWaalsContact C-N 3.35Å; M171-T174 WeakPolarHBondContact CA-OG1 3.49Å; M171-T174 PolarHBondContact O-OG1 2.86Å; M171-N175 VanDerWaalsContact O-CB 3.24Å; M171-N175 WeakPolarHBondContact O-CB 3.43Å; M171-N175 PolarHBondContact O-N 3.18Å
172L98.2Very high98Very high89 Ų8999.2 Ų99.247%0.46650%0.5SS..Hα-helixtrans-65.8-43.7175.9-73.5-177.5000112.4F168 D169 N175 A176F168-L172 HydrophobicContact CD1-CD1 3.88Å; F168-L172 HydrophobicContact CD1-CG 4.29Å; F168-L172 HydrophobicContact CE1-CD1 3.32Å; F168-L172 HydrophobicContact CE1-CG 3.92Å; F168-L172 HydrophobicContact CE2-CD2 4.47Å; F168-L172 HydrophobicContact CE2-CG 4.4Å; F168-L172 HydrophobicContact CZ-CD1 3.74Å; F168-L172 HydrophobicContact CZ-CD2 4.1Å; F168-L172 HydrophobicContact CZ-CG 3.97Å; F168-L172 PolarHBondContact O-N 3.37Å; D169-L172 PolarHBondContact O-N 3.45Å; L172-N175 PolarHBondContact O-N 3.21Å; L172-A176 WeakPolarHBondContact O-CB 3.28Å; L172-A176 PolarHBondContact O-N 3.41Å
173T98.1Very high98Very high79 Ų7998.2 Ų98.249%0.48549%0.492SS..Hα-helixtrans-67.3-39.7178.851.50000112.2D169 K170 A176 K177D169-T173 WeakPolarHBondContact O-CG2 3.43Å; D169-T173 PolarHBondContact O-N 3.34Å; D169-T173 PolarHBondContact O-OG1 2.92Å; K170-T173 WeakPolarHBondContact CA-OG1 3.49Å; K170-T173 PolarHBondContact O-N 3.06Å; K170-T173 PolarHBondContact O-OG1 2.93Å; T173-A176 PolarHBondContact O-N 2.95Å; T173-K177 WeakPolarHBondContact O-CG 3.37Å; T173-K177 PolarHBondContact O-N 3.4Å
174T98.2Very high98Very high62 Ų6296.8 Ų96.838%0.3849%0.485SS..Hα-helixtrans-65.5-42.4172.650.60000111.6K170 M171 A176 K177 L178K170-T174 WeakPolarHBondContact O-CB 3.48Å; K170-T174 VanDerWaalsContact O-CG2 3.31Å; K170-T174 WeakPolarHBondContact O-CG2 3.38Å; K170-T174 PolarHBondContact O-N 3.49Å; K170-T174 PolarHBondContact O-OG1 3.26Å; M171-T174 WeakPolarHBondContact CA-OG1 3.49Å; M171-T174 PolarHBondContact O-OG1 2.86Å; T174-A176 VanDerWaalsContact C-N 3.33Å; T174-A176 PolarHBondContact O-N 3.34Å; T174-K177 WeakPolarHBondContact O-CB 3.3Å; T174-K177 PolarHBondContact O-N 3.43Å; T174-L178 WeakPolarHBondContact O-CG 3.43Å; T174-L178 PolarHBondContact O-N 2.94Å
175N98.2Very high98.1Very high70 Ų7097.5 Ų97.537%0.37449%0.485SS..Hα-helixtrans-61.1-41.6174.5-162.4-66.9000111.8M171 L172 K177 L178 R179M171-N175 VanDerWaalsContact O-CB 3.24Å; M171-N175 WeakPolarHBondContact O-CB 3.43Å; M171-N175 PolarHBondContact O-N 3.18Å; L172-N175 PolarHBondContact O-N 3.21Å; N175-K177 VanDerWaalsContact C-N 3.34Å; N175-K177 PolarHBondContact O-N 3.04Å; N175-L178 PolarHBondContact O-N 2.77Å; N175-R179 WeakPolarHBondContact O-CG 3.48Å; N175-R179 PolarHBondContact O-N 2.94Å; N175-R179 PolarHBondContact OD1-NE 3.4Å; N175-R179 PolarHBondContact OD1-NH2 3.49Å
176A98.4Very high98.1Very high48 Ų48102 Ų10240%0.39750%0.495SS..Hα-helixtrans-62.9-38.4175.700000112.5L172 T173 T174 R179 K180L172-A176 WeakPolarHBondContact O-CB 3.28Å; L172-A176 PolarHBondContact O-N 3.41Å; T173-A176 PolarHBondContact O-N 2.95Å; T174-A176 VanDerWaalsContact C-N 3.33Å; T174-A176 PolarHBondContact O-N 3.34Å; A176-R179 PolarHBondContact O-N 3Å; A176-K180 WeakPolarHBondContact O-CG 3.41Å; A176-K180 PolarHBondContact O-N 3.42Å; A176-K180 VanDerWaalsContact O-N 3.15Å
177K98.2Very high98.1Very high148 Ų148104.8 Ų104.864%0.64350%0.502SS*.Hα-helixtrans-64.3-47.9173.5-71.6174.7-177.8-176.70111.6T173 T174 N175 R179 K180 E181T173-K177 WeakPolarHBondContact O-CG 3.37Å; T173-K177 PolarHBondContact O-N 3.4Å; T174-K177 WeakPolarHBondContact O-CB 3.3Å; T174-K177 PolarHBondContact O-N 3.43Å; N175-K177 VanDerWaalsContact C-N 3.34Å; N175-K177 PolarHBondContact O-N 3.04Å; K177-R179 VanDerWaalsContact C-N 3.29Å; K177-R179 PolarHBondContact O-N 3.33Å; K177-K180 WeakPolarHBondContact O-CB 3.48Å; K177-K180 PolarHBondContact O-N 3.45Å; K177-K180 VanDerWaalsContact O-N 3.1Å; K177-E181 PolarHBondContact O-N 3.28Å
178L98.4Very high98.1Very high95 Ų95104.7 Ų104.750%0.49750%0.502SS..Hα-helixtrans-60.7-38.6177.1-69.6172.3000111.9T174 N175 K180 E181 I182T174-L178 WeakPolarHBondContact O-CG 3.43Å; T174-L178 PolarHBondContact O-N 2.94Å; N175-L178 PolarHBondContact O-N 2.77Å; L178-K180 VanDerWaalsContact C-N 3.33Å; L178-K180 PolarHBondContact O-N 2.93Å; L178-E181 PolarHBondContact O-N 3.31Å; L178-I182 WeakPolarHBondContact O-CB 3.43Å; L178-I182 VanDerWaalsContact O-CG1 3.23Å; L178-I182 WeakPolarHBondContact O-CG1 3.38Å; L178-I182 PolarHBondContact O-N 3.38Å
179R98.4Very high98.1Very high172 Ų172105.4 Ų105.465%0.64951%0.505SS*.Hα-helixtrans-62.4-39.7174.4-74.9178.4-170.4-177.3-0.3112.5N175 A176 K177 E183N175-R179 WeakPolarHBondContact O-CG 3.48Å; N175-R179 PolarHBondContact O-N 2.94Å; N175-R179 PolarHBondContact OD1-NE 3.4Å; N175-R179 PolarHBondContact OD1-NH2 3.49Å; A176-R179 PolarHBondContact O-N 3Å; K177-R179 VanDerWaalsContact C-N 3.29Å; K177-R179 PolarHBondContact O-N 3.33Å; R179-E183 PolarHBondContact O-N 2.64Å; R179-E183 VanDerWaalsContact O-N 3.09Å
180K98.3Very high98.1Very high147 Ų147104.4 Ų104.464%0.63951%0.507SS*.Hα-helixtrans-64.6-47.5174.6-72.8-177.9177.6-172.30111A176 K177 L178 I182 E183 D184A176-K180 WeakPolarHBondContact O-CG 3.41Å; A176-K180 PolarHBondContact O-N 3.42Å; A176-K180 VanDerWaalsContact O-N 3.15Å; K177-K180 WeakPolarHBondContact O-CB 3.48Å; K177-K180 PolarHBondContact O-N 3.45Å; K177-K180 VanDerWaalsContact O-N 3.1Å; L178-K180 VanDerWaalsContact C-N 3.33Å; L178-K180 PolarHBondContact O-N 2.93Å; K180-I182 VanDerWaalsContact C-N 3.31Å; K180-I182 PolarHBondContact O-N 3.37Å; K180-E183 CarbonylContact O-C 3.59Å; K180-E183 WeakPolarHBondContact O-CA 3.41Å; K180-E183 WeakPolarHBondContact O-CB 3.28Å; K180-E183 PolarHBondContact O-N 3.26Å; K180-D184 VanDerWaalsContact O-CG 3.26Å; K180-D184 PolarHBondContact O-N 3.07Å
181E98.5Very high98.1Very high112 Ų112101.1 Ų101.152%0.52350%0.504SS..Hα-helixtrans-59-41.4177.3-173.5179178.100112.2K177 L178 E183 D184 L185K177-E181 PolarHBondContact O-N 3.28Å; L178-E181 PolarHBondContact O-N 3.31Å; E181-E183 VanDerWaalsContact C-N 3.3Å; E181-E183 PolarHBondContact O-N 2.92Å; E181-D184 PolarHBondContact O-N 2.98Å; E181-L185 HydrophobicContact CG-CD1 4.33Å; E181-L185 WeakPolarHBondContact O-CB 3.44Å; E181-L185 VanDerWaalsContact O-CG 3.26Å; E181-L185 WeakPolarHBondContact O-CG 3.29Å; E181-L185 PolarHBondContact O-N 2.87Å
182I98.2Very high98.2Very high92 Ų92104.4 Ų104.447%0.47251%0.512SS..Hα-helixtrans-61.2-40.5173.9-71.5165.4000111.3L178 K180 R186L178-I182 WeakPolarHBondContact O-CB 3.43Å; L178-I182 VanDerWaalsContact O-CG1 3.23Å; L178-I182 WeakPolarHBondContact O-CG1 3.38Å; L178-I182 PolarHBondContact O-N 3.38Å; K180-I182 VanDerWaalsContact C-N 3.31Å; K180-I182 PolarHBondContact O-N 3.37Å; I182-R186 WeakPolarHBondContact O-CB 3.34Å; I182-R186 VanDerWaalsContact O-CG 3.24Å; I182-R186 WeakPolarHBondContact O-CG 3.31Å; I182-R186 PolarHBondContact O-N 2.98Å
183E98.4Very high98.1Very high78 Ų78103.6 Ų103.636%0.36451%0.508SS..Hα-helixtrans-70.9-40.4179.4-164.662.2-160.600111.6R179 K180 E181 L185 R186 F187R179-E183 PolarHBondContact O-N 2.64Å; R179-E183 VanDerWaalsContact O-N 3.09Å; K180-E183 CarbonylContact O-C 3.59Å; K180-E183 WeakPolarHBondContact O-CA 3.41Å; K180-E183 WeakPolarHBondContact O-CB 3.28Å; K180-E183 PolarHBondContact O-N 3.26Å; E181-E183 VanDerWaalsContact C-N 3.3Å; E181-E183 PolarHBondContact O-N 2.92Å; E183-L185 PolarHBondContact O-N 3.42Å; E183-R186 WeakPolarHBondContact O-CB 3.33Å; E183-R186 PolarHBondContact O-N 3.01Å; E183-R186 VanDerWaalsContact O-N 3.13Å; E183-R186 IonicContact OE2-NH1 3.05Å; E183-F187 HydrophobicContact CG-CD2 4.13Å; E183-F187 HydrophobicContact CG-CE2 3.61Å; E183-F187 HydrophobicContact CG-CZ 4.32Å; E183-F187 WeakPolarHBondContact O-CD2 3.33Å; E183-F187 PolarHBondContact O-N 3.48Å
184D98Very high98.1Very high96 Ų96103.8 Ų103.851%0.51351%0.506SS..Hα-helixtrans-60-47.5174.1-64.1-26.7000110.6K180 E181 R186 F187 E188K180-D184 VanDerWaalsContact O-CG 3.26Å; K180-D184 PolarHBondContact O-N 3.07Å; E181-D184 PolarHBondContact O-N 2.98Å; D184-R186 VanDerWaalsContact C-N 3.27Å; D184-R186 PolarHBondContact O-N 3.42Å; D184-F187 PolarHBondContact O-N 2.85Å; D184-F187 VanDerWaalsContact O-N 3.14Å; D184-E188 PolarHBondContact O-N 2.83Å
185L98.2Very high98.1Very high98 Ų98104.4 Ų104.451%0.51351%0.51SS..Hα-helixtrans-62.1-33175-71.9172.5000112.7E181 E183 K189E181-L185 HydrophobicContact CG-CD1 4.33Å; E181-L185 WeakPolarHBondContact O-CB 3.44Å; E181-L185 VanDerWaalsContact O-CG 3.26Å; E181-L185 WeakPolarHBondContact O-CG 3.29Å; E181-L185 PolarHBondContact O-N 2.87Å; E183-L185 PolarHBondContact O-N 3.42Å; L185-K189 WeakPolarHBondContact O-CB 3.3Å; L185-K189 PolarHBondContact O-N 3.04Å
186R98Very high98.1Very high156 Ų156108.2 Ų108.259%0.58952%0.52SS*.Hα-helixtrans-68.2-41.7174.1-80.6170.3155.5-165.8-6.5111.8I182 E183 D184 K189 A190I182-R186 WeakPolarHBondContact O-CB 3.34Å; I182-R186 VanDerWaalsContact O-CG 3.24Å; I182-R186 WeakPolarHBondContact O-CG 3.31Å; I182-R186 PolarHBondContact O-N 2.98Å; E183-R186 WeakPolarHBondContact O-CB 3.33Å; E183-R186 PolarHBondContact O-N 3.01Å; E183-R186 VanDerWaalsContact O-N 3.13Å; E183-R186 IonicContact OE2-NH1 3.05Å; D184-R186 VanDerWaalsContact C-N 3.27Å; D184-R186 PolarHBondContact O-N 3.42Å; R186-K189 PolarHBondContact O-N 3.38Å; R186-A190 WeakPolarHBondContact O-CB 3.3Å; R186-A190 PolarHBondContact O-N 3.42Å
187F98.1Very high98.1Very high132 Ų132110.3 Ų110.358%0.57952%0.521SS*.Hα-helixtrans-63.9-44.6174.7-74.8-57.6000111.6E183 D184 K189 A190 A191E183-F187 HydrophobicContact CG-CD2 4.13Å; E183-F187 HydrophobicContact CG-CE2 3.61Å; E183-F187 HydrophobicContact CG-CZ 4.32Å; E183-F187 WeakPolarHBondContact O-CD2 3.33Å; E183-F187 PolarHBondContact O-N 3.48Å; D184-F187 PolarHBondContact O-N 2.85Å; D184-F187 VanDerWaalsContact O-N 3.14Å; F187-K189 PolarHBondContact O-N 3.08Å; F187-A190 PolarHBondContact O-N 3.1Å; F187-A191 PolarHBondContact O-N 3.34Å
188E97.4Very high98.1Very high107 Ų107107.8 Ų107.850%0.551%0.512SS..Hα-helixtrans-58.9-48.7174.8-73-174174.700111.2D184 A190 A191 Y192D184-E188 PolarHBondContact O-N 2.83Å; E188-A190 VanDerWaalsContact C-N 3.32Å; E188-A190 PolarHBondContact O-N 2.85Å; E188-A191 WeakPolarHBondContact O-CB 3.31Å; E188-A191 PolarHBondContact O-N 3.27Å; E188-A191 VanDerWaalsContact O-N 3.12Å; E188-Y192 HydrophobicContact CB-CD2 4.46Å; E188-Y192 HydrophobicContact CB-CE2 4.3Å; E188-Y192 WeakPolarHBondContact O-CD2 3.2Å; E188-Y192 PolarHBondContact O-N 3.49Å
189K98.2Very high98.1Very high132 Ų132108.6 Ų108.657%0.57452%0.516SS*.Hα-helixtrans-56.6-45.8176-175.7-173.4173-174.90111.7L185 R186 F187 A191 Y192 D193L185-K189 WeakPolarHBondContact O-CB 3.3Å; L185-K189 PolarHBondContact O-N 3.04Å; R186-K189 PolarHBondContact O-N 3.38Å; F187-K189 PolarHBondContact O-N 3.08Å; K189-A191 VanDerWaalsContact C-N 3.29Å; K189-A191 PolarHBondContact O-N 3.06Å; K189-Y192 PolarHBondContact O-N 2.95Å; K189-D193 WeakPolarHBondContact O-CB 3.33Å; K189-D193 PolarHBondContact O-N 2.92Å
190A98.1Very high98Very high56 Ų56105 Ų10546%0.46351%0.507SS..Hα-helixtrans-62.2-37.2178.600000112.2R186 F187 E188 N194R186-A190 WeakPolarHBondContact O-CB 3.3Å; R186-A190 PolarHBondContact O-N 3.42Å; F187-A190 PolarHBondContact O-N 3.1Å; E188-A190 VanDerWaalsContact C-N 3.32Å; E188-A190 PolarHBondContact O-N 2.85Å; A190-N194 WeakPolarHBondContact O-CB 3.3Å; A190-N194 PolarHBondContact O-N 3.36Å; A190-N194 VanDerWaalsContact O-N 3.08Å
191A98Very high98Very high58 Ų58105 Ų10548%0.47950%0.503SS..Hα-helixtrans-65.2-46.1173.800000111.5F187 E188 K189 N194 V195F187-A191 PolarHBondContact O-N 3.34Å; E188-A191 WeakPolarHBondContact O-CB 3.31Å; E188-A191 PolarHBondContact O-N 3.27Å; E188-A191 VanDerWaalsContact O-N 3.12Å; K189-A191 VanDerWaalsContact C-N 3.29Å; K189-A191 PolarHBondContact O-N 3.06Å; A191-N194 PolarHBondContact O-N 3.2Å; A191-V195 WeakPolarHBondContact O-CG2 3.43Å; A191-V195 PolarHBondContact O-N 2.76Å
192Y98.1Very high97.9Very high165 Ų165103.7 Ų103.765%0.64751%0.505SS*.Hα-helixtrans-60.9-44.7175.4-76.4-64.1000112.4E188 K189 N194 V195 Y196E188-Y192 HydrophobicContact CB-CD2 4.46Å; E188-Y192 HydrophobicContact CB-CE2 4.3Å; E188-Y192 WeakPolarHBondContact O-CD2 3.2Å; E188-Y192 PolarHBondContact O-N 3.49Å; K189-Y192 PolarHBondContact O-N 2.95Å; Y192-N194 VanDerWaalsContact C-N 3.28Å; Y192-N194 PolarHBondContact O-N 3.41Å; Y192-V195 PolarHBondContact O-N 3.3Å; Y192-Y196 WeakPolarHBondContact O-CB 3.48Å; Y192-Y196 PolarHBondContact O-N 3.38Å
193D97.8Very high97.9Very high73 Ų73103.3 Ų103.339%0.3950%0.504SS..Hα-helixtrans-60.8-38.8178.2-75.2-21.8000111K189 Y196 Q197K189-D193 WeakPolarHBondContact O-CB 3.33Å; K189-D193 PolarHBondContact O-N 2.92Å; D193-Y196 PolarHBondContact O-N 2.87Å; D193-Q197 WeakPolarHBondContact O-CB 3.37Å; D193-Q197 VanDerWaalsContact O-CG 3.29Å; D193-Q197 WeakPolarHBondContact O-CG 3.34Å; D193-Q197 PolarHBondContact O-N 2.7Å
194N98.2Very high97.9Very high82 Ų82103.7 Ų103.744%0.43951%0.508SS..Hα-helixtrans-65-48.5175.5-171-7.9000111.7A190 A191 Y192 Y196 Q197 Q198A190-N194 WeakPolarHBondContact O-CB 3.3Å; A190-N194 PolarHBondContact O-N 3.36Å; A190-N194 VanDerWaalsContact O-N 3.08Å; A191-N194 PolarHBondContact O-N 3.2Å; Y192-N194 VanDerWaalsContact C-N 3.28Å; Y192-N194 PolarHBondContact O-N 3.41Å; N194-Y196 VanDerWaalsContact C-N 3.3Å; N194-Y196 PolarHBondContact O-N 3.48Å; N194-Q197 PolarHBondContact O-N 2.85Å; N194-Q198 WeakPolarHBondContact O-CG 3.27Å; N194-Q198 PolarHBondContact O-N 3.23Å; N194-Q198 PolarHBondContact OD1-NE2 3.36Å
195V97.9Very high97.9Very high76 Ų76104 Ų10446%0.46151%0.507SS..Hα-helixtrans-60.4-42.4176.7174.30000111A191 Y192 Q197 Q198 L199A191-V195 WeakPolarHBondContact O-CG2 3.43Å; A191-V195 PolarHBondContact O-N 2.76Å; Y192-V195 PolarHBondContact O-N 3.3Å; V195-Q197 PolarHBondContact O-N 2.82Å; V195-Q198 PolarHBondContact O-N 3.05Å; V195-L199 HydrophobicContact CG1-CD1 4.01Å; V195-L199 HydrophobicContact CG1-CG 4.43Å; V195-L199 WeakPolarHBondContact O-CG 3.39Å; V195-L199 PolarHBondContact O-N 3.03Å
196Y97.9Very high97.8Very high149 Ų149106 Ų10658%0.58451%0.514SS*.Hα-helixtrans-59.7-46.5176.2-179.4-94.8000111.8Y192 D193 N194 Q198 L199 Q200Y192-Y196 WeakPolarHBondContact O-CB 3.48Å; Y192-Y196 PolarHBondContact O-N 3.38Å; D193-Y196 PolarHBondContact O-N 2.87Å; N194-Y196 VanDerWaalsContact C-N 3.3Å; N194-Y196 PolarHBondContact O-N 3.48Å; Y196-Q198 VanDerWaalsContact C-N 3.32Å; Y196-Q198 PolarHBondContact O-N 3.48Å; Y196-L199 PolarHBondContact O-N 2.94Å; Y196-Q200 WeakPolarHBondContact O-CB 3.34Å; Y196-Q200 PolarHBondContact O-N 2.67Å
197Q98.2Very high97.8Very high92 Ų92104.1 Ų104.143%0.4351%0.51SS..Hα-helixtrans-61.8-39.3175.9-74.4179.81700112.3D193 N194 V195 Q200 R201D193-Q197 WeakPolarHBondContact O-CB 3.37Å; D193-Q197 VanDerWaalsContact O-CG 3.29Å; D193-Q197 WeakPolarHBondContact O-CG 3.34Å; D193-Q197 PolarHBondContact O-N 2.7Å; N194-Q197 PolarHBondContact O-N 2.85Å; V195-Q197 PolarHBondContact O-N 2.82Å; Q197-Q200 PolarHBondContact O-N 2.83Å; Q197-R201 VanDerWaalsContact O-CG 3.3Å; Q197-R201 WeakPolarHBondContact O-CG 3.47Å; Q197-R201 PolarHBondContact O-N 3.41Å
198Q97.8Very high97.8Very high96 Ų96103.9 Ų103.945%0.44951%0.509SS..Hα-helixtrans-63.3-47.7175.7-69.7175.919.100111.4N194 V195 Y196 Q200 R201 C202N194-Q198 WeakPolarHBondContact O-CG 3.27Å; N194-Q198 PolarHBondContact O-N 3.23Å; N194-Q198 PolarHBondContact OD1-NE2 3.36Å; V195-Q198 PolarHBondContact O-N 3.05Å; Y196-Q198 VanDerWaalsContact C-N 3.32Å; Y196-Q198 PolarHBondContact O-N 3.48Å; Q198-Q200 VanDerWaalsContact C-N 3.31Å; Q198-Q200 PolarHBondContact O-N 3.23Å; Q198-R201 WeakPolarHBondContact O-CB 3.31Å; Q198-R201 PolarHBondContact O-N 3.31Å; Q198-C202 PolarHBondContact O-N 2.69Å; Q198-C202 PolarHBondContact O-SG 2.8Å; Q198-C202 VanDerWaalsContact O-SG 3.37Å
199L97.6Very high97.8Very high112 Ų112102.9 Ų102.959%0.58651%0.51SS*.Hα-helixtrans-59.8-42.1176.1-73.6169.6000111.7V195 Y196 R201 C202 L203V195-L199 HydrophobicContact CG1-CD1 4.01Å; V195-L199 HydrophobicContact CG1-CG 4.43Å; V195-L199 WeakPolarHBondContact O-CG 3.39Å; V195-L199 PolarHBondContact O-N 3.03Å; Y196-L199 PolarHBondContact O-N 2.94Å; L199-R201 VanDerWaalsContact C-N 3.34Å; L199-R201 PolarHBondContact O-N 2.65Å; L199-C202 PolarHBondContact O-N 3.2Å; L199-L203 WeakPolarHBondContact O-CB 3.24Å; L199-L203 PolarHBondContact O-N 3.38Å
200Q97.7Very high97.7Very high97 Ų97101.5 Ų101.545%0.45351%0.507SS..Hα-helixtrans-62.5-41.2176.6-170176.411.300111.7Y196 Q197 Q198 L203 L204Y196-Q200 WeakPolarHBondContact O-CB 3.34Å; Y196-Q200 PolarHBondContact O-N 2.67Å; Q197-Q200 PolarHBondContact O-N 2.83Å; Q198-Q200 VanDerWaalsContact C-N 3.31Å; Q198-Q200 PolarHBondContact O-N 3.23Å; Q200-L203 PolarHBondContact O-N 2.86Å; Q200-L204 WeakPolarHBondContact O-CB 3.39Å; Q200-L204 VanDerWaalsContact O-CG 3.3Å; Q200-L204 WeakPolarHBondContact O-CG 3.26Å; Q200-L204 PolarHBondContact O-N 3.07Å
201R97.9Very high97.7Very high146 Ų146103.2 Ų103.255%0.55151%0.508SS*.Hα-helixtrans-63.4-45.3174.1-70.8173.5-161.2160.38.7111.6Q197 Q198 L199 L203 L204 M205Q197-R201 VanDerWaalsContact O-CG 3.3Å; Q197-R201 WeakPolarHBondContact O-CG 3.47Å; Q197-R201 PolarHBondContact O-N 3.41Å; Q198-R201 WeakPolarHBondContact O-CB 3.31Å; Q198-R201 PolarHBondContact O-N 3.31Å; L199-R201 VanDerWaalsContact C-N 3.34Å; L199-R201 PolarHBondContact O-N 2.65Å; R201-L203 VanDerWaalsContact C-N 3.34Å; R201-L203 PolarHBondContact O-N 3.15Å; R201-L204 PolarHBondContact O-N 3.08Å; R201-M205 WeakPolarHBondContact O-CG 3.47Å; R201-M205 PolarHBondContact O-N 3.18Å
202C97.3Very high97.7Very high84 Ų84105.1 Ų105.157%0.56851%0.51SS*.Hα-helixtrans-59.7-44.8176.7-69.80000111.7Q198 L199 L204 M205 Q206Q198-C202 PolarHBondContact O-N 2.69Å; Q198-C202 PolarHBondContact O-SG 2.8Å; Q198-C202 VanDerWaalsContact O-SG 3.37Å; L199-C202 PolarHBondContact O-N 3.2Å; C202-L204 PolarHBondContact O-N 3.04Å; C202-M205 PolarHBondContact O-N 3.36Å; C202-Q206 WeakPolarHBondContact O-CB 3.33Å; C202-Q206 PolarHBondContact O-N 3.32Å
203L97.6Very high97.7Very high85 Ų8599.5 Ų99.545%0.44550%0.498SS..Hα-helixtrans-62.3-42.2177-177.2150.8000111.8L199 Q200 R201 Q206 K207L199-L203 WeakPolarHBondContact O-CB 3.24Å; L199-L203 PolarHBondContact O-N 3.38Å; Q200-L203 PolarHBondContact O-N 2.86Å; R201-L203 VanDerWaalsContact C-N 3.34Å; R201-L203 PolarHBondContact O-N 3.15Å; L203-Q206 PolarHBondContact O-N 3.24Å; L203-K207 HydrophobicContact CD2-CD 3.82Å; L203-K207 HydrophobicContact CD2-CG 4.37Å; L203-K207 WeakPolarHBondContact O-CG 3.39Å; L203-K207 PolarHBondContact O-N 2.88Å
204L97.7Very high97.6Very high86 Ų86100.9 Ų100.945%0.4550%0.504SS..Hα-helixtrans-63.9-41.7175-73.9172.3000112Q200 R201 C202 K207 K208Q200-L204 WeakPolarHBondContact O-CB 3.39Å; Q200-L204 VanDerWaalsContact O-CG 3.3Å; Q200-L204 WeakPolarHBondContact O-CG 3.26Å; Q200-L204 PolarHBondContact O-N 3.07Å; R201-L204 PolarHBondContact O-N 3.08Å; C202-L204 PolarHBondContact O-N 3.04Å; L204-K207 PolarHBondContact O-N 3.08Å; L204-K208 WeakPolarHBondContact O-CG 3.39Å; L204-K208 PolarHBondContact O-N 3.34Å
205M97.5Very high97.6Very high102 Ų102103.2 Ų103.250%0.50251%0.512SS..Hα-helixtrans-62.5-44.5174.9-72-58.610900111.5R201 C202 K207 K208 T209R201-M205 WeakPolarHBondContact O-CG 3.47Å; R201-M205 PolarHBondContact O-N 3.18Å; C202-M205 PolarHBondContact O-N 3.36Å; M205-K207 PolarHBondContact O-N 3.28Å; M205-K208 HydrophobicContact CE-CD 3.89Å; M205-K208 WeakPolarHBondContact O-CB 3.36Å; M205-K208 PolarHBondContact O-N 3.13Å; M205-K208 VanDerWaalsContact O-N 3.15Å; M205-T209 PolarHBondContact O-N 3.5Å; M205-T209 PolarHBondContact O-OG1 3.02Å
206Q97.3Very high97.6Very high140 Ų140105.8 Ų105.865%0.65452%0.519SS*.Hα-helixtrans-63.7-39.3177.9-171.2178.58.900112.4C202 L203 K208 T209 M210C202-Q206 WeakPolarHBondContact O-CB 3.33Å; C202-Q206 PolarHBondContact O-N 3.32Å; L203-Q206 PolarHBondContact O-N 3.24Å; Q206-K208 VanDerWaalsContact C-N 3.32Å; Q206-K208 PolarHBondContact O-N 3.22Å; Q206-T209 WeakPolarHBondContact CA-OG1 3.45Å; Q206-T209 PolarHBondContact O-N 2.86Å; Q206-T209 PolarHBondContact O-OG1 2.8Å; Q206-M210 VanDerWaalsContact O-CB 3.3Å; Q206-M210 WeakPolarHBondContact O-CB 3.34Å; Q206-M210 PolarHBondContact O-N 3.06Å
207K97.7Very high97.5Very high116 Ų116102.5 Ų102.550%0.50452%0.518SS..Hα-helixtrans-62.5-39.9173.2-77-177.4175.9179.70111.9L203 L204 M205 N211L203-K207 HydrophobicContact CD2-CD 3.82Å; L203-K207 HydrophobicContact CD2-CG 4.37Å; L203-K207 WeakPolarHBondContact O-CG 3.39Å; L203-K207 PolarHBondContact O-N 2.88Å; L204-K207 PolarHBondContact O-N 3.08Å; M205-K207 PolarHBondContact O-N 3.28Å; K207-N211 WeakPolarHBondContact O-CB 3.39Å; K207-N211 PolarHBondContact O-N 2.91Å
208K97.8Very high97.5Very high127 Ų127100.9 Ų100.955%0.55252%0.517SS*.Hα-helixtrans-63.8-46.6175.7-72.7-179.8-178.4-171.90111.6L204 M205 Q206 M210 N211 L212L204-K208 WeakPolarHBondContact O-CG 3.39Å; L204-K208 PolarHBondContact O-N 3.34Å; M205-K208 HydrophobicContact CE-CD 3.89Å; M205-K208 WeakPolarHBondContact O-CB 3.36Å; M205-K208 PolarHBondContact O-N 3.13Å; M205-K208 VanDerWaalsContact O-N 3.15Å; Q206-K208 VanDerWaalsContact C-N 3.32Å; Q206-K208 PolarHBondContact O-N 3.22Å; K208-M210 PolarHBondContact O-N 3.2Å; K208-N211 PolarHBondContact O-N 3.34Å; K208-L212 WeakPolarHBondContact O-CG 3.45Å; K208-L212 PolarHBondContact O-N 2.88Å
209T96.9Very high97.5Very high86 Ų86101.4 Ų101.453%0.52852%0.519SS..Hα-helixtrans-64.9-39.8178.5570000111.9M205 Q206 L212 A213M205-T209 PolarHBondContact O-N 3.5Å; M205-T209 PolarHBondContact O-OG1 3.02Å; Q206-T209 WeakPolarHBondContact CA-OG1 3.45Å; Q206-T209 PolarHBondContact O-N 2.86Å; Q206-T209 PolarHBondContact O-OG1 2.8Å; T209-L212 PolarHBondContact O-N 3.32Å; T209-A213 PolarHBondContact O-N 2.85Å
210M97.3Very high97.4Very high103 Ų10398.6 Ų98.651%0.50751%0.513SS..Hα-helixtrans-59.6-48.1173.4-177.6-176.274.300111.7Q206 K208 L212 A213 I214Q206-M210 VanDerWaalsContact O-CB 3.3Å; Q206-M210 WeakPolarHBondContact O-CB 3.34Å; Q206-M210 PolarHBondContact O-N 3.06Å; K208-M210 PolarHBondContact O-N 3.2Å; M210-L212 VanDerWaalsContact C-N 3.35Å; M210-L212 PolarHBondContact O-N 3.45Å; M210-A213 PolarHBondContact O-N 3.42Å; M210-I214 HydrophobicContact CG-CD1 4.08Å; M210-I214 WeakPolarHBondContact O-CG1 3.25Å; M210-I214 PolarHBondContact O-N 2.9Å
211N97.8Very high97.4Very high93 Ų93101.1 Ų101.150%0.49752%0.519SS..Hα-helixtrans-62.8-41.3178.9-72.3-9.4000112K207 K208 A213 I214 E215K207-N211 WeakPolarHBondContact O-CB 3.39Å; K207-N211 PolarHBondContact O-N 2.91Å; K208-N211 PolarHBondContact O-N 3.34Å; N211-A213 VanDerWaalsContact C-N 3.34Å; N211-A213 PolarHBondContact O-N 2.81Å; N211-I214 PolarHBondContact O-N 2.91Å; N211-E215 WeakPolarHBondContact O-CB 3.43Å; N211-E215 PolarHBondContact O-N 2.95Å
212L98Very high97.4Very high97 Ų97100.1 Ų100.151%0.50852%0.52SS..Hα-helixtrans-61.5-41.8174.8-73.4170.2000111.9K208 T209 M210 I214 E215 Q216K208-L212 WeakPolarHBondContact O-CG 3.45Å; K208-L212 PolarHBondContact O-N 2.88Å; T209-L212 PolarHBondContact O-N 3.32Å; M210-L212 VanDerWaalsContact C-N 3.35Å; M210-L212 PolarHBondContact O-N 3.45Å; L212-I214 VanDerWaalsContact C-N 3.34Å; L212-I214 PolarHBondContact O-N 3.3Å; L212-E215 PolarHBondContact O-N 3.5Å; L212-Q216 WeakPolarHBondContact O-CB 3.25Å; L212-Q216 VanDerWaalsContact O-CG 3.31Å; L212-Q216 WeakPolarHBondContact O-CG 3.23Å; L212-Q216 PolarHBondContact O-N 2.96Å
213A97.4Very high97.4Very high47 Ų47101.4 Ų101.439%0.38852%0.518SS..Hα-helixtrans-64.9-38176.600000112.2T209 M210 N211 S217T209-A213 PolarHBondContact O-N 2.85Å; M210-A213 PolarHBondContact O-N 3.42Å; N211-A213 VanDerWaalsContact C-N 3.34Å; N211-A213 PolarHBondContact O-N 2.81Å; A213-S217 VanDerWaalsContact O-CB 3.3Å; A213-S217 WeakPolarHBondContact O-CB 3.24Å; A213-S217 PolarHBondContact O-N 3.42Å; A213-S217 PolarHBondContact O-OG 3.35Å
214I96.9Very high97.4Very high102 Ų102105.1 Ų105.152%0.52353%0.526SS..Hα-helixtrans-64.2-45.9174.4-68.4166.3000110.4M210 N211 L212 S217 S218M210-I214 HydrophobicContact CG-CD1 4.08Å; M210-I214 WeakPolarHBondContact O-CG1 3.25Å; M210-I214 PolarHBondContact O-N 2.9Å; N211-I214 PolarHBondContact O-N 2.91Å; L212-I214 VanDerWaalsContact C-N 3.34Å; L212-I214 PolarHBondContact O-N 3.3Å; I214-S217 PolarHBondContact O-N 2.93Å; I214-S218 WeakPolarHBondContact O-CB 3.36Å; I214-S218 PolarHBondContact O-N 2.85Å
215E97.5Very high97.4Very high131 Ų131104.3 Ų104.361%0.61253%0.525SS*.Hα-helixtrans-61.8-47178.7-172.6175.1-170.900111.5N211 L212 S217 S218 Q219N211-E215 WeakPolarHBondContact O-CB 3.43Å; N211-E215 PolarHBondContact O-N 2.95Å; L212-E215 PolarHBondContact O-N 3.5Å; E215-S217 VanDerWaalsContact C-N 3.31Å; E215-S217 PolarHBondContact O-N 2.99Å; E215-S218 WeakPolarHBondContact O-CB 3.46Å; E215-S218 PolarHBondContact O-N 3.31Å; E215-Q219 WeakPolarHBondContact O-CB 3.49Å; E215-Q219 PolarHBondContact O-N 2.99Å
216Q97.3Very high97.4Very high130 Ų130104.3 Ų104.361%0.60752%0.523SS*.Hα-helixtrans-59.9-40.9174.2-73.4177.3-8.200112.2L212 Q219 A220L212-Q216 WeakPolarHBondContact O-CB 3.25Å; L212-Q216 VanDerWaalsContact O-CG 3.31Å; L212-Q216 WeakPolarHBondContact O-CG 3.23Å; L212-Q216 PolarHBondContact O-N 2.96Å; Q216-Q219 PolarHBondContact O-N 2.87Å; Q216-A220 WeakPolarHBondContact O-CB 3.47Å; Q216-A220 PolarHBondContact O-N 2.68Å
217S96.8Very high97.3Very high80 Ų8099.5 Ų99.556%0.55951%0.508SS*.Hα-helixtrans-66-41177.3-59.70000111.7A213 I214 E215 A220 Y221A213-S217 VanDerWaalsContact O-CB 3.3Å; A213-S217 WeakPolarHBondContact O-CB 3.24Å; A213-S217 PolarHBondContact O-N 3.42Å; A213-S217 PolarHBondContact O-OG 3.35Å; I214-S217 PolarHBondContact O-N 2.93Å; E215-S217 VanDerWaalsContact C-N 3.31Å; E215-S217 PolarHBondContact O-N 2.99Å; S217-A220 PolarHBondContact O-N 3.11Å; S217-Y221 WeakPolarHBondContact O-CB 3.43Å; S217-Y221 PolarHBondContact O-N 3.4Å
218S97.1Very high97.2Very high58 Ų5898.6 Ų98.641%0.40651%0.506SS..Hα-helixtrans-61.8-46.4174.6-166.10000110.9I214 E215 A220 Y221 E222I214-S218 WeakPolarHBondContact O-CB 3.36Å; I214-S218 PolarHBondContact O-N 2.85Å; E215-S218 WeakPolarHBondContact O-CB 3.46Å; E215-S218 PolarHBondContact O-N 3.31Å; S218-A220 PolarHBondContact O-N 2.95Å; S218-Y221 WeakPolarHBondContact O-CB 3.48Å; S218-Y221 PolarHBondContact O-N 3.46Å; S218-E222 WeakPolarHBondContact O-CG 3.48Å; S218-E222 PolarHBondContact O-N 3.47Å
219Q97.8Very high97.2Very high107 Ų10795.3 Ų95.350%0.550%0.503SS..Hα-helixtrans-61.7-44.8177.9-171-177.419.800111.9E215 Q216 Y221 E222 Q223E215-Q219 WeakPolarHBondContact O-CB 3.49Å; E215-Q219 PolarHBondContact O-N 2.99Å; Q216-Q219 PolarHBondContact O-N 2.87Å; Q219-Y221 VanDerWaalsContact C-N 3.28Å; Q219-Y221 PolarHBondContact O-N 3.06Å; Q219-E222 PolarHBondContact O-N 2.81Å; Q219-Q223 VanDerWaalsContact O-CG 3.32Å; Q219-Q223 WeakPolarHBondContact O-CG 3.49Å; Q219-Q223 PolarHBondContact O-N 3.43Å
220A97.1Very high97.2Very high54 Ų5497.9 Ų97.945%0.44650%0.503SS..Hα-helixtrans-63-36.4176.500000111.9Q216 S217 S218 R224Q216-A220 WeakPolarHBondContact O-CB 3.47Å; Q216-A220 PolarHBondContact O-N 2.68Å; S217-A220 PolarHBondContact O-N 3.11Å; S218-A220 PolarHBondContact O-N 2.95Å; A220-R224 WeakPolarHBondContact O-CB 3.44Å; A220-R224 PolarHBondContact O-N 2.87Å
221Y97.3Very high97.1Very high150 Ų15098.2 Ų98.259%0.58850%0.504SS*.Hα-helixtrans-65.9-46.9174.8-176.3-94.8000111.9S217 S218 Q219 Q223 R224 V225S217-Y221 WeakPolarHBondContact O-CB 3.43Å; S217-Y221 PolarHBondContact O-N 3.4Å; S218-Y221 WeakPolarHBondContact O-CB 3.48Å; S218-Y221 PolarHBondContact O-N 3.46Å; Q219-Y221 VanDerWaalsContact C-N 3.28Å; Q219-Y221 PolarHBondContact O-N 3.06Å; Y221-Q223 PolarHBondContact O-N 3.33Å; Y221-R224 WeakPolarHBondContact O-CB 3.37Å; Y221-R224 PolarHBondContact O-N 3.08Å; Y221-V225 HydrophobicContact CD1-CG2 4.05Å; Y221-V225 HydrophobicContact CE1-CG2 3.66Å; Y221-V225 WeakPolarHBondContact O-CG2 3.45Å; Y221-V225 PolarHBondContact O-N 3.18Å
222E97.4Very high97.1Very high124 Ų12496 Ų9658%0.57950%0.5SS*.Hα-helixtrans-58.3-46.5175.6-73.6173.7-166.300111.7S218 Q219 R224 V225 E226S218-E222 WeakPolarHBondContact O-CG 3.48Å; S218-E222 PolarHBondContact O-N 3.47Å; Q219-E222 PolarHBondContact O-N 2.81Å; E222-R224 VanDerWaalsContact C-N 3.33Å; E222-R224 PolarHBondContact O-N 3.23Å; E222-V225 PolarHBondContact O-N 2.89Å; E222-E226 WeakPolarHBondContact O-CB 2.68Å; E222-E226 PolarHBondContact O-N 2.99Å
223Q97.3Very high97Very high111 Ų11194.4 Ų94.452%0.51950%0.5SS..Hα-helixtrans-60-42.2175.9-73176.22.500112.1Q219 Y221 E226 A227Q219-Q223 VanDerWaalsContact O-CG 3.32Å; Q219-Q223 WeakPolarHBondContact O-CG 3.49Å; Q219-Q223 PolarHBondContact O-N 3.43Å; Y221-Q223 PolarHBondContact O-N 3.33Å; Q223-E226 PolarHBondContact O-N 3.12Å; Q223-A227 WeakPolarHBondContact O-CB 3.43Å; Q223-A227 PolarHBondContact O-N 3.09Å
224R97.7Very high96.9Very high163 Ų16398.2 Ų98.262%0.61551%0.512SS*.Hα-helixtrans-62.5-44.6175.7176.9-175.7171.1-175-2.2111.5A220 Y221 E222 E226 A227 M228A220-R224 WeakPolarHBondContact O-CB 3.44Å; A220-R224 PolarHBondContact O-N 2.87Å; Y221-R224 WeakPolarHBondContact O-CB 3.37Å; Y221-R224 PolarHBondContact O-N 3.08Å; E222-R224 VanDerWaalsContact C-N 3.33Å; E222-R224 PolarHBondContact O-N 3.23Å; R224-E226 VanDerWaalsContact C-N 3.34Å; R224-A227 PolarHBondContact O-N 3.43Å; R224-M228 WeakPolarHBondContact O-CB 3.35Å; R224-M228 PolarHBondContact O-N 3Å
225V97.8Very high96.9Very high69 Ų6999.6 Ų99.642%0.41851%0.514SS..Hα-helixtrans-63.1-43.6178.5171.10000110.3Y221 E222 M228 A229Y221-V225 HydrophobicContact CD1-CG2 4.05Å; Y221-V225 HydrophobicContact CE1-CG2 3.66Å; Y221-V225 WeakPolarHBondContact O-CG2 3.45Å; Y221-V225 PolarHBondContact O-N 3.18Å; E222-V225 PolarHBondContact O-N 2.89Å; V225-M228 WeakPolarHBondContact O-CB 3.26Å; V225-M228 PolarHBondContact O-N 2.96Å; V225-A229 WeakPolarHBondContact O-CB 3.43Å; V225-A229 PolarHBondContact O-N 2.89Å
226E96.9Very high96.8Very high102 Ų10297 Ų9748%0.47750%0.504SS..Hα-helixtrans-63.6-45.7177.2-164.6-171.4-168.300111.8E222 Q223 R224 M228 A229 R230E222-E226 WeakPolarHBondContact O-CB 2.68Å; E222-E226 PolarHBondContact O-N 2.99Å; Q223-E226 PolarHBondContact O-N 3.12Å; R224-E226 VanDerWaalsContact C-N 3.34Å; E226-M228 VanDerWaalsContact C-N 3.3Å; E226-M228 PolarHBondContact O-N 3.18Å; E226-A229 PolarHBondContact O-N 3.37Å; E226-R230 VanDerWaalsContact CD-CZ 3.43Å; E226-R230 WeakPolarHBondContact O-CG 3.4Å; E226-R230 PolarHBondContact O-N 3.48Å; E226-R230 IonicContact OE1-CZ 2.68Å; E226-R230 IonicContact OE1-NE 3.38Å; E226-R230 IonicContact OE1-NH2 2.83Å; E226-R230 PolarHBondContact OE1-NH2 3.1Å; E226-R230 IonicContact OE2-CZ 3.59Å; E226-R230 IonicContact OE2-NH1 2.87Å; E226-R230 IonicContact OE2-NH2 3.26Å; E226-R230 PolarHBondContact OE2-NH2 3.19Å
227A96.5Very high96.7Very high39 Ų3998.7 Ų98.732%0.32251%0.505SS..Hα-helixtrans-60.8-40174.900000111.8Q223 R224 R230 M231Q223-A227 WeakPolarHBondContact O-CB 3.43Å; Q223-A227 PolarHBondContact O-N 3.09Å; R224-A227 PolarHBondContact O-N 3.43Å; A227-R230 PolarHBondContact O-N 2.94Å; A227-M231 WeakPolarHBondContact O-CB 3.5Å; A227-M231 WeakPolarHBondContact O-CG 2.99Å; A227-M231 PolarHBondContact O-N 3.01Å
228M95.6Very high96.7Very high97 Ų97100.5 Ų100.548%0.47850%0.504SS..Hα-helixtrans-64-41.9175.7-169-178-60.300111.8R224 V225 E226 M231 A232R224-M228 WeakPolarHBondContact O-CB 3.35Å; R224-M228 PolarHBondContact O-N 3Å; V225-M228 WeakPolarHBondContact O-CB 3.26Å; V225-M228 PolarHBondContact O-N 2.96Å; E226-M228 VanDerWaalsContact C-N 3.3Å; E226-M228 PolarHBondContact O-N 3.18Å; M228-M231 HydrophobicContact CB-CE 4.49Å; M228-M231 PolarHBondContact O-N 3.35Å; M228-A232 WeakPolarHBondContact O-CB 3.26Å; M228-A232 PolarHBondContact O-N 2.83Å
229A97.1Very high96.6Very high58 Ų58103.8 Ų103.848%0.47951%0.512SS..Hα-helixtrans-62.9-44.1174.900000111.7V225 E226 A232 A233V225-A229 WeakPolarHBondContact O-CB 3.43Å; V225-A229 PolarHBondContact O-N 2.89Å; E226-A229 PolarHBondContact O-N 3.37Å; A229-A232 PolarHBondContact O-N 3.5Å; A229-A233 PolarHBondContact O-N 3.35Å
230R96.9Very high96.5Very high140 Ų140105.3 Ų105.353%0.52852%0.517SS..Hα-helixtrans-61.4-44174.4-68.5-175.7-165.5126.4-4.4111.9E226 A227 A232 A233 M234E226-R230 VanDerWaalsContact CD-CZ 3.43Å; E226-R230 WeakPolarHBondContact O-CG 3.4Å; E226-R230 PolarHBondContact O-N 3.48Å; E226-R230 IonicContact OE1-CZ 2.68Å; E226-R230 IonicContact OE1-NE 3.38Å; E226-R230 IonicContact OE1-NH2 2.83Å; E226-R230 PolarHBondContact OE1-NH2 3.1Å; E226-R230 IonicContact OE2-CZ 3.59Å; E226-R230 IonicContact OE2-NH1 2.87Å; E226-R230 IonicContact OE2-NH2 3.26Å; E226-R230 PolarHBondContact OE2-NH2 3.19Å; A227-R230 PolarHBondContact O-N 2.94Å; R230-A232 VanDerWaalsContact C-N 3.34Å; R230-A232 PolarHBondContact O-N 2.96Å; R230-A233 PolarHBondContact O-N 3.03Å; R230-M234 WeakPolarHBondContact O-CG 3.5Å; R230-M234 PolarHBondContact O-N 3.48Å
231M95.4Very high96.5Very high110 Ų110106.4 Ų106.454%0.54252%0.515SS..Hα-helixtrans-61.9-41.1175.7-76.8-170-68.600112.1A227 M228 M234 K235A227-M231 WeakPolarHBondContact O-CB 3.5Å; A227-M231 WeakPolarHBondContact O-CG 2.99Å; A227-M231 PolarHBondContact O-N 3.01Å; M228-M231 HydrophobicContact CB-CE 4.49Å; M228-M231 PolarHBondContact O-N 3.35Å; M231-M234 PolarHBondContact O-N 3.17Å; M231-K235 WeakPolarHBondContact O-CB 3.44Å; M231-K235 WeakPolarHBondContact O-CG 3.34Å; M231-K235 PolarHBondContact O-N 3.19Å
232A96.5Very high96.4Very high48 Ų48103.3 Ų103.340%0.39751%0.508SS..Hα-helixtrans-62.3-47.3175.900000111.2M228 A229 R230 M234 K235 D236M228-A232 WeakPolarHBondContact O-CB 3.26Å; M228-A232 PolarHBondContact O-N 2.83Å; A229-A232 PolarHBondContact O-N 3.5Å; R230-A232 VanDerWaalsContact C-N 3.34Å; R230-A232 PolarHBondContact O-N 2.96Å; A232-M234 PolarHBondContact O-N 3.26Å; A232-K235 PolarHBondContact O-N 2.85Å; A232-D236 PolarHBondContact O-N 3.15Å
233A96.7Very high96.2Very high63 Ų63100.6 Ų100.652%0.52150%0.502SS..Hα-helixtrans-59.5-42.7176.500000112.6A229 R230 D236 R237A229-A233 PolarHBondContact O-N 3.35Å; R230-A233 PolarHBondContact O-N 3.03Å; A233-D236 PolarHBondContact O-N 2.96Å; A233-R237 PolarHBondContact O-N 3.36Å
234M95.6Very high96.1Very high127 Ų127100.9 Ų100.963%0.62650%0.504SS*.Hα-helixtrans-64.7-42.7175.8-73.1-64.7-71.600112.3R230 M231 A232 D236 R237 Q238R230-M234 WeakPolarHBondContact O-CG 3.5Å; R230-M234 PolarHBondContact O-N 3.48Å; M231-M234 PolarHBondContact O-N 3.17Å; A232-M234 PolarHBondContact O-N 3.26Å; M234-D236 VanDerWaalsContact C-N 3.33Å; M234-D236 PolarHBondContact O-N 2.83Å; M234-R237 PolarHBondContact O-N 3.46Å; M234-Q238 WeakPolarHBondContact O-CB 3.41Å; M234-Q238 PolarHBondContact O-N 2.87Å
235K96.3Very high96Very high130 Ų13099.8 Ų99.857%0.56550%0.501SS*.Hα-helixtrans-61.8-41.2174.9-77.8-179.1178.8-177.90111.7M231 A232 Q238 K239M231-K235 WeakPolarHBondContact O-CB 3.44Å; M231-K235 WeakPolarHBondContact O-CG 3.34Å; M231-K235 PolarHBondContact O-N 3.19Å; A232-K235 PolarHBondContact O-N 2.85Å; K235-Q238 PolarHBondContact O-N 3.07Å; K235-K239 VanDerWaalsContact O-CG 3.31Å; K235-K239 WeakPolarHBondContact O-CG 3.16Å; K235-K239 PolarHBondContact O-N 3.45Å
236D95.8Very high95.9Very high78 Ų7899.6 Ų99.642%0.41750%0.497SS..Hα-helixtrans-70.7-34.5179.1-71.5-18.5000112.2A232 A233 M234 K239 K240A232-D236 PolarHBondContact O-N 3.15Å; A233-D236 PolarHBondContact O-N 2.96Å; M234-D236 VanDerWaalsContact C-N 3.33Å; M234-D236 PolarHBondContact O-N 2.83Å; D236-K239 IonicContact OD1-NZ 2.67Å; D236-K239 PolarHBondContact OD1-NZ 2.9Å; D236-K240 WeakPolarHBondContact O-CG 3.3Å; D236-K240 PolarHBondContact O-N 3.38Å; D236-K240 VanDerWaalsContact O-N 3.13Å
237R95.9Very high95.7Very high164 Ų16499 Ų9962%0.61950%0.496SS*.Hα-helixtrans-62.4-49.4168.5-174.2176.9179.91631.8111.4A233 M234 K239 K240 D241A233-R237 PolarHBondContact O-N 3.36Å; M234-R237 PolarHBondContact O-N 3.46Å; R237-K239 VanDerWaalsContact C-N 3.31Å; R237-K239 PolarHBondContact O-N 2.87Å; R237-K240 WeakPolarHBondContact O-CA 3.33Å; R237-K240 WeakPolarHBondContact O-CB 3.49Å; R237-K240 PolarHBondContact O-N 3.46Å; R237-D241 VanDerWaalsContact O-CG 3.32Å; R237-D241 PolarHBondContact O-N 2.92Å
238Q95.8Very high95.7Very high118 Ų118102.4 Ų102.455%0.55151%0.506SS*.Hα-helixtrans-57.8-41.9177.8-173.6-175.612.100112.1M234 K235 K240 D241 I242M234-Q238 WeakPolarHBondContact O-CB 3.41Å; M234-Q238 PolarHBondContact O-N 2.87Å; K235-Q238 PolarHBondContact O-N 3.07Å; Q238-K240 VanDerWaalsContact C-N 3.33Å; Q238-K240 PolarHBondContact O-N 3.08Å; Q238-D241 PolarHBondContact O-N 3.14Å; Q238-I242 HydrophobicContact CG-CD1 3.94Å; Q238-I242 HydrophobicContact CG-CG1 4.47Å; Q238-I242 WeakPolarHBondContact O-CB 3.45Å; Q238-I242 VanDerWaalsContact O-CG1 3.26Å; Q238-I242 WeakPolarHBondContact O-CG1 3.33Å; Q238-I242 PolarHBondContact O-N 3.41Å
239K95.8Very high95.6Very high128 Ų128100.3 Ų100.356%0.55750%0.496SS*.Hα-helixtrans-60.3-41.8174.4-73.1171.6-166.4159.90111.9K235 D236 R237 S243K235-K239 VanDerWaalsContact O-CG 3.31Å; K235-K239 WeakPolarHBondContact O-CG 3.16Å; K235-K239 PolarHBondContact O-N 3.45Å; D236-K239 IonicContact OD1-NZ 2.67Å; D236-K239 PolarHBondContact OD1-NZ 2.9Å; R237-K239 VanDerWaalsContact C-N 3.31Å; R237-K239 PolarHBondContact O-N 2.87Å; K239-S243 WeakPolarHBondContact O-CB 3.5Å; K239-S243 PolarHBondContact O-N 3.32Å; K239-S243 PolarHBondContact O-OG 2.92Å
240K96.3Very high95.4Very high139 Ų139103.6 Ų103.660%0.60450%0.496SS*.Hα-helixtrans-63.7-46.6176-71.7175.2-178.1-179.10110.9D236 R237 Q238 I242 S243 Q244D236-K240 WeakPolarHBondContact O-CG 3.3Å; D236-K240 PolarHBondContact O-N 3.38Å; D236-K240 VanDerWaalsContact O-N 3.13Å; R237-K240 WeakPolarHBondContact O-CA 3.33Å; R237-K240 WeakPolarHBondContact O-CB 3.49Å; R237-K240 PolarHBondContact O-N 3.46Å; Q238-K240 VanDerWaalsContact C-N 3.33Å; Q238-K240 PolarHBondContact O-N 3.08Å; K240-I242 PolarHBondContact O-N 2.94Å; K240-S243 WeakPolarHBondContact CA-OG 3.25Å; K240-S243 WeakPolarHBondContact O-CA 3.44Å; K240-S243 WeakPolarHBondContact O-CB 3.33Å; K240-S243 PolarHBondContact O-N 3.37Å; K240-S243 VanDerWaalsContact O-N 3.09Å; K240-S243 PolarHBondContact O-OG 3.25Å; K240-Q244 WeakPolarHBondContact O-CG 3.46Å; K240-Q244 PolarHBondContact O-N 3.44Å
241D95.4Very high95.2Very high76 Ų76101.7 Ų101.741%0.40649%0.493SS..Hα-helixtrans-62.7-43.4179.2-60.5-13.6000111.3R237 Q238 S243 Q244 Y245R237-D241 VanDerWaalsContact O-CG 3.32Å; R237-D241 PolarHBondContact O-N 2.92Å; Q238-D241 PolarHBondContact O-N 3.14Å; D241-S243 VanDerWaalsContact C-N 3.31Å; D241-S243 PolarHBondContact O-N 3.13Å; D241-Q244 PolarHBondContact O-N 3.5Å; D241-Y245 WeakPolarHBondContact O-CB 3.07Å; D241-Y245 PolarHBondContact O-N 3.45Å
242I94.8Very high95.1Very high86 Ų86101.9 Ų101.944%0.44150%0.496SS..Hα-helixtrans-60.2-41.8172.8-69.7166.9000110.7Q238 K240 Q244 N246Q238-I242 HydrophobicContact CG-CD1 3.94Å; Q238-I242 HydrophobicContact CG-CG1 4.47Å; Q238-I242 WeakPolarHBondContact O-CB 3.45Å; Q238-I242 VanDerWaalsContact O-CG1 3.26Å; Q238-I242 WeakPolarHBondContact O-CG1 3.33Å; Q238-I242 PolarHBondContact O-N 3.41Å; K240-I242 PolarHBondContact O-N 2.94Å; I242-Q244 VanDerWaalsContact C-N 3.33Å; I242-Q244 PolarHBondContact O-N 3.38Å; I242-N246 WeakPolarHBondContact CG2-ND2 3.29Å; I242-N246 VanDerWaalsContact O-CB 3.29Å; I242-N246 WeakPolarHBondContact O-CB 3.32Å; I242-N246 PolarHBondContact O-N 3.04Å; I242-N246 PolarHBondContact O-ND2 2.93Å; I242-N246 VanDerWaalsContact O-ND2 3.14Å
243S94.9Very high94.9Very high67 Ų67105.1 Ų105.147%0.46950%0.503SS..Hα-helixtrans-65.6-36178.475.90000112.6K239 K240 D241 L247K239-S243 WeakPolarHBondContact O-CB 3.5Å; K239-S243 PolarHBondContact O-N 3.32Å; K239-S243 PolarHBondContact O-OG 2.92Å; K240-S243 WeakPolarHBondContact CA-OG 3.25Å; K240-S243 WeakPolarHBondContact O-CA 3.44Å; K240-S243 WeakPolarHBondContact O-CB 3.33Å; K240-S243 PolarHBondContact O-N 3.37Å; K240-S243 VanDerWaalsContact O-N 3.09Å; K240-S243 PolarHBondContact O-OG 3.25Å; D241-S243 VanDerWaalsContact C-N 3.31Å; D241-S243 PolarHBondContact O-N 3.13Å; S243-L247 PolarHBondContact O-N 2.93Å
244Q95.4Very high94.7Very high116 Ų116110.5 Ų110.554%0.54251%0.51SS..Hα-helixtrans-68.9-50.3174.4-72.8177.3-1000111.2K240 D241 I242 N246 L247 E248K240-Q244 WeakPolarHBondContact O-CG 3.46Å; K240-Q244 PolarHBondContact O-N 3.44Å; D241-Q244 PolarHBondContact O-N 3.5Å; I242-Q244 VanDerWaalsContact C-N 3.33Å; I242-Q244 PolarHBondContact O-N 3.38Å; Q244-N246 VanDerWaalsContact C-N 3.31Å; Q244-N246 PolarHBondContact O-N 3.05Å; Q244-L247 WeakPolarHBondContact O-CA 3.36Å; Q244-L247 VanDerWaalsContact O-CB 3.31Å; Q244-L247 WeakPolarHBondContact O-CB 3.49Å; Q244-L247 PolarHBondContact O-N 3.48Å; Q244-E248 PolarHBondContact O-N 3.31Å
245Y95.1Very high94.6Very high141 Ų141109.8 Ų109.855%0.55351%0.508SS*.Hα-helixtrans-56.6-43.1176177.8-104.9000112.5D241 L247 E248 I249D241-Y245 WeakPolarHBondContact O-CB 3.07Å; D241-Y245 PolarHBondContact O-N 3.45Å; Y245-L247 PolarHBondContact O-N 2.97Å; Y245-E248 PolarHBondContact O-N 2.92Å; Y245-I249 HydrophobicContact CD1-CD1 3.9Å; Y245-I249 HydrophobicContact CD1-CG1 4.41Å; Y245-I249 HydrophobicContact CE1-CD1 3.21Å; Y245-I249 HydrophobicContact CE1-CG1 4.04Å; Y245-I249 HydrophobicContact CE2-CD1 4.19Å; Y245-I249 HydrophobicContact CE2-CG1 4.3Å; Y245-I249 WeakPolarHBondContact O-CG1 3.43Å; Y245-I249 PolarHBondContact O-N 2.86Å
246N94.6Very high94.3Very high65 Ų65111 Ų11135%0.34851%0.51SS..Hα-helixtrans-64.4-29.3174.9-74-27.2000112.7I242 Q244 R250I242-N246 WeakPolarHBondContact CG2-ND2 3.29Å; I242-N246 VanDerWaalsContact O-CB 3.29Å; I242-N246 WeakPolarHBondContact O-CB 3.32Å; I242-N246 PolarHBondContact O-N 3.04Å; I242-N246 PolarHBondContact O-ND2 2.93Å; I242-N246 VanDerWaalsContact O-ND2 3.14Å; Q244-N246 VanDerWaalsContact C-N 3.31Å; Q244-N246 PolarHBondContact O-N 3.05Å; N246-R250 VanDerWaalsContact O-CG 3.26Å; N246-R250 WeakPolarHBondContact O-CG 3.28Å; N246-R250 PolarHBondContact O-N 3.49Å
247L94.5Very high94.1Very high88 Ų88110 Ų11046%0.46151%0.513SS..Hα-helixtrans-73.5-45.8175.2-172.2145.9000110.5S243 Q244 Y245 I249 R250 E251S243-L247 PolarHBondContact O-N 2.93Å; Q244-L247 WeakPolarHBondContact O-CA 3.36Å; Q244-L247 VanDerWaalsContact O-CB 3.31Å; Q244-L247 WeakPolarHBondContact O-CB 3.49Å; Q244-L247 PolarHBondContact O-N 3.48Å; Y245-L247 PolarHBondContact O-N 2.97Å; L247-I249 PolarHBondContact O-N 3.4Å; L247-R250 PolarHBondContact O-N 2.8Å; L247-E251 HydrophobicContact CD2-CG 4.43Å; L247-E251 VanDerWaalsContact CD2-OE1 3.27Å; L247-E251 WeakPolarHBondContact CD2-OE1 3.39Å; L247-E251 WeakPolarHBondContact O-CG 3.23Å; L247-E251 PolarHBondContact O-N 3.47Å
248E94.8Very high93.8Very high112 Ų112108.6 Ų108.652%0.52351%0.513SS..Hα-helixtrans-59-45.2174.5-68.3174.1-174.200112Q244 Y245 R250 E251 L252Q244-E248 PolarHBondContact O-N 3.31Å; Y245-E248 PolarHBondContact O-N 2.92Å; E248-R250 VanDerWaalsContact C-N 3.34Å; E248-R250 PolarHBondContact O-N 3.33Å; E248-E251 WeakPolarHBondContact O-CB 3.35Å; E248-E251 PolarHBondContact O-N 2.87Å; E248-E251 VanDerWaalsContact O-N 3.16Å; E248-L252 WeakPolarHBondContact O-CG 3.44Å; E248-L252 PolarHBondContact O-N 2.94Å
249I94Very high93.4Very high52 Ų52107.8 Ų107.827%0.26751%0.509SS..Hα-helixtrans-57.1-48.1174.2-77-172.4000110.8Y245 L247 E251 L252 E253Y245-I249 HydrophobicContact CD1-CD1 3.9Å; Y245-I249 HydrophobicContact CD1-CG1 4.41Å; Y245-I249 HydrophobicContact CE1-CD1 3.21Å; Y245-I249 HydrophobicContact CE1-CG1 4.04Å; Y245-I249 HydrophobicContact CE2-CD1 4.19Å; Y245-I249 HydrophobicContact CE2-CG1 4.3Å; Y245-I249 WeakPolarHBondContact O-CG1 3.43Å; Y245-I249 PolarHBondContact O-N 2.86Å; L247-I249 PolarHBondContact O-N 3.4Å; I249-E251 PolarHBondContact O-N 2.96Å; I249-L252 PolarHBondContact O-N 3.41Å; I249-E253 HydrophobicContact CG2-CG 4.1Å; I249-E253 WeakPolarHBondContact O-CB 3.34Å; I249-E253 WeakPolarHBondContact O-CG 3.35Å; I249-E253 PolarHBondContact O-N 3.48Å
250R94.1Very high93.1Very high127 Ų127103.1 Ų103.148%0.47949%0.493SS..Hα-helixtrans-62.5-33.8-179.9-74.3-178.3-143.6119.3-3.9111.9N246 L247 E248 R254N246-R250 VanDerWaalsContact O-CG 3.26Å; N246-R250 WeakPolarHBondContact O-CG 3.28Å; N246-R250 PolarHBondContact O-N 3.49Å; L247-R250 PolarHBondContact O-N 2.8Å; E248-R250 VanDerWaalsContact C-N 3.34Å; E248-R250 PolarHBondContact O-N 3.33Å; R250-R254 WeakPolarHBondContact O-CG 3.49Å; R250-R254 PolarHBondContact O-N 3.37Å
251E92.1Very high92.6Very high100 Ų100106.2 Ų106.247%0.46750%0.5SS..Hα-helixtrans-68.6-45174.4-71.4178.417500111.8L247 E248 I249 E253 R254 L255L247-E251 HydrophobicContact CD2-CG 4.43Å; L247-E251 VanDerWaalsContact CD2-OE1 3.27Å; L247-E251 WeakPolarHBondContact CD2-OE1 3.39Å; L247-E251 WeakPolarHBondContact O-CG 3.23Å; L247-E251 PolarHBondContact O-N 3.47Å; E248-E251 WeakPolarHBondContact O-CB 3.35Å; E248-E251 PolarHBondContact O-N 2.87Å; E248-E251 VanDerWaalsContact O-N 3.16Å; I249-E251 PolarHBondContact O-N 2.96Å; E251-E253 PolarHBondContact O-N 3.22Å; E251-R254 WeakPolarHBondContact O-CB 3.01Å; E251-R254 PolarHBondContact O-N 3.23Å; E251-L255 WeakPolarHBondContact O-CG 3.39Å; E251-L255 PolarHBondContact O-N 3.48Å
252L93.1Very high92.1Very high114 Ų114107.7 Ų107.760%0.59751%0.508SS*.Hα-helixtrans-62.1-41.7174.5-70.3174.4000112.1E248 I249 R254 L255 Y256E248-L252 WeakPolarHBondContact O-CG 3.44Å; E248-L252 PolarHBondContact O-N 2.94Å; I249-L252 PolarHBondContact O-N 3.41Å; L252-R254 VanDerWaalsContact C-N 3.33Å; L252-R254 PolarHBondContact O-N 3.28Å; L252-L255 PolarHBondContact O-N 2.82Å; L252-Y256 VanDerWaalsContact O-CB 3.32Å; L252-Y256 WeakPolarHBondContact O-CB 3.37Å; L252-Y256 PolarHBondContact O-N 3.12Å
253E92.8Very high91.6Very high117 Ų117109.7 Ų109.755%0.54751%0.513SS..Hα-helixtrans-61.5-40.5174.3-75.9175.7165.900111.6I249 E251 Y256 A257I249-E253 HydrophobicContact CG2-CG 4.1Å; I249-E253 WeakPolarHBondContact O-CB 3.34Å; I249-E253 WeakPolarHBondContact O-CG 3.35Å; I249-E253 PolarHBondContact O-N 3.48Å; E251-E253 PolarHBondContact O-N 3.22Å; E253-Y256 PolarHBondContact O-N 3.25Å; E253-A257 VanDerWaalsContact O-CB 3.24Å; E253-A257 WeakPolarHBondContact O-CB 3.3Å; E253-A257 PolarHBondContact O-N 3.05Å
254R91.8Very high90.9Very high176 Ų176109.8 Ų109.866%0.66451%0.514SS*.Hα-helixtrans-63.2-44.4174.3-74.2168.5-171.8174.82.9111.7R250 E251 L252 A257 H258R250-R254 WeakPolarHBondContact O-CG 3.49Å; R250-R254 PolarHBondContact O-N 3.37Å; E251-R254 WeakPolarHBondContact O-CB 3.01Å; E251-R254 PolarHBondContact O-N 3.23Å; L252-R254 VanDerWaalsContact C-N 3.33Å; L252-R254 PolarHBondContact O-N 3.28Å; R254-A257 PolarHBondContact O-N 3.47Å; R254-H258 WeakPolarHBondContact O-CB 3.41Å; R254-H258 PolarHBondContact O-N 2.82Å
255L93.2Very high90.1Very high112 Ų112110.5 Ų110.559%0.58652%0.515SS*.Hα-helixtrans-63.3-45.6175.9-70.4174.1000111.3E251 L252 A257 H258 E259E251-L255 WeakPolarHBondContact O-CG 3.39Å; E251-L255 PolarHBondContact O-N 3.48Å; L252-L255 PolarHBondContact O-N 2.82Å; L255-A257 PolarHBondContact O-N 3.22Å; L255-H258 WeakPolarHBondContact O-CB 3.49Å; L255-H258 PolarHBondContact O-N 2.9Å; L255-E259 PolarHBondContact O-N 3.39Å
256Y91.4Very high89.1Confident155 Ų155108.9 Ų108.961%0.60852%0.516SS*.Hα-helixtrans-63.6-41177.6-179.3-96.2000112.4L252 E253 H258 E259 S260L252-Y256 VanDerWaalsContact O-CB 3.32Å; L252-Y256 WeakPolarHBondContact O-CB 3.37Å; L252-Y256 PolarHBondContact O-N 3.12Å; E253-Y256 PolarHBondContact O-N 3.25Å; Y256-H258 VanDerWaalsContact C-N 3.32Å; Y256-E259 PolarHBondContact O-N 2.96Å; Y256-S260 VanDerWaalsContact CE1-OG 3.26Å; Y256-S260 WeakPolarHBondContact CE1-OG 3.32Å; Y256-S260 WeakPolarHBondContact O-CB 3.41Å; Y256-S260 PolarHBondContact O-N 3.5Å; Y256-S260 PolarHBondContact O-OG 2.96Å
257A90.3Very high88.2Confident58 Ų58110.5 Ų110.548%0.47952%0.524SS..Hα-helixtrans-64.5-38.717500000111.3E253 R254 L255 R261E253-A257 VanDerWaalsContact O-CB 3.24Å; E253-A257 WeakPolarHBondContact O-CB 3.3Å; E253-A257 PolarHBondContact O-N 3.05Å; R254-A257 PolarHBondContact O-N 3.47Å; L255-A257 PolarHBondContact O-N 3.22Å; A257-R261 WeakPolarHBondContact O-CB 3.26Å; A257-R261 PolarHBondContact O-N 3.22Å
258H89.3Confident86.9Confident133 Ų133111.9 Ų111.962%0.61654%0.536SS*.Hα-helixtrans-63.9-48.6173.5-176.6-83000111.7R254 L255 Y256 R261 L262R254-H258 WeakPolarHBondContact O-CB 3.41Å; R254-H258 PolarHBondContact O-N 2.82Å; L255-H258 WeakPolarHBondContact O-CB 3.49Å; L255-H258 PolarHBondContact O-N 2.9Å; Y256-H258 VanDerWaalsContact C-N 3.32Å; H258-R261 PolarHBondContact O-N 2.67Å; H258-L262 WeakPolarHBondContact O-CB 3.4Å; H258-L262 PolarHBondContact O-N 2.67Å
259E87.6Confident85.6Confident102 Ų102113.8 Ų113.848%0.47754%0.543SS..Hα-helixtrans-62.4-42.6175.2-76.6-166.8175.900112.9L255 Y256 L262 K263L255-E259 PolarHBondContact O-N 3.39Å; Y256-E259 PolarHBondContact O-N 2.96Å; E259-L262 CarbonylContact O-C 3.6Å; E259-L262 WeakPolarHBondContact O-CB 3.43Å; E259-L262 PolarHBondContact O-N 3.25Å; E259-K263 WeakPolarHBondContact O-CB 3.49Å; E259-K263 WeakPolarHBondContact O-CG 3.37Å; E259-K263 PolarHBondContact O-N 3.31Å
260S88.9Confident83.9Confident30 Ų30117.4 Ų117.421%0.2156%0.562CS.*Hα-helixtrans-65.6-41.4177.8-68.20000110.6Y256 L262 K263 S264Y256-S260 VanDerWaalsContact CE1-OG 3.26Å; Y256-S260 WeakPolarHBondContact CE1-OG 3.32Å; Y256-S260 WeakPolarHBondContact O-CB 3.41Å; Y256-S260 PolarHBondContact O-N 3.5Å; Y256-S260 PolarHBondContact O-OG 2.96Å; S260-L262 VanDerWaalsContact C-N 3.29Å; S260-L262 PolarHBondContact O-N 3.43Å; S260-K263 PolarHBondContact O-N 3.04Å; S260-S264 VanDerWaalsContact O-CB 3.25Å; S260-S264 WeakPolarHBondContact O-CB 3.33Å; S260-S264 PolarHBondContact O-N 3.22Å; S260-S264 PolarHBondContact O-OG 2.85Å
261R85.9Confident81.8Confident203 Ų203116.2 Ų116.277%0.76657%0.565SS**Hα-helixtrans-61-39.8173-173175.6-178.6170.20.4111.4A257 H258 F265A257-R261 WeakPolarHBondContact O-CB 3.26Å; A257-R261 PolarHBondContact O-N 3.22Å; H258-R261 PolarHBondContact O-N 2.67Å; R261-F265 WeakPolarHBondContact O-CB 3.46Å; R261-F265 PolarHBondContact O-N 3.33Å
262L84.9Confident79.8Confident108 Ų108118.8 Ų118.857%0.56558%0.582SS**Hα-helixtrans-64.6-47.3174.3-178.165.7000111.9H258 E259 S260 F265 L266H258-L262 WeakPolarHBondContact O-CB 3.4Å; H258-L262 PolarHBondContact O-N 2.67Å; E259-L262 CarbonylContact O-C 3.6Å; E259-L262 WeakPolarHBondContact O-CB 3.43Å; E259-L262 PolarHBondContact O-N 3.25Å; S260-L262 VanDerWaalsContact C-N 3.29Å; S260-L262 PolarHBondContact O-N 3.43Å; L262-F265 PolarHBondContact O-N 3.07Å; L262-L266 WeakPolarHBondContact O-CB 3.45Å; L262-L266 PolarHBondContact O-N 2.95Å
263K84.4Confident77.7Confident127 Ų127124.7 Ų124.755%0.55260%0.596SS**Hα-helixtrans-62.1-48.4176.6-75.9175.7-178.6166.30111.5E259 S260 F265 L266 L267E259-K263 WeakPolarHBondContact O-CB 3.49Å; E259-K263 WeakPolarHBondContact O-CG 3.37Å; E259-K263 PolarHBondContact O-N 3.31Å; S260-K263 PolarHBondContact O-N 3.04Å; K263-F265 VanDerWaalsContact C-N 3.33Å; K263-F265 PolarHBondContact O-N 3.25Å; K263-L266 CarbonylContact O-C 3.58Å; K263-L266 WeakPolarHBondContact O-CB 3.42Å; K263-L266 PolarHBondContact O-N 3.27Å; K263-L266 VanDerWaalsContact O-N 3.11Å; K263-L267 WeakPolarHBondContact O-CB 3.47Å; K263-L267 PolarHBondContact O-N 3.41Å
264S80.8Confident75.5Confident70 Ų70126.3 Ų126.349%0.4961%0.608SS.*Hα-helixtrans-61.1-40.7176-61.20000111.6S260 L266 L267 V268S260-S264 VanDerWaalsContact O-CB 3.25Å; S260-S264 WeakPolarHBondContact O-CB 3.33Å; S260-S264 PolarHBondContact O-N 3.22Å; S260-S264 PolarHBondContact O-OG 2.85Å; S264-L266 VanDerWaalsContact C-N 3.33Å; S264-L266 PolarHBondContact O-N 2.86Å; S264-L267 PolarHBondContact O-N 3.23Å; S264-V268 WeakPolarHBondContact O-CB 3.44Å; S264-V268 VanDerWaalsContact O-CG2 3.23Å; S264-V268 WeakPolarHBondContact O-CG2 3.42Å; S264-V268 PolarHBondContact O-N 2.67Å
265F78.3Confident73.6Confident130 Ų130125.1 Ų125.157%0.5761%0.61SS**Hα-helixtrans-60.6-43.1172.7177-96.7000111.5R261 L262 K263 K269R261-F265 WeakPolarHBondContact O-CB 3.46Å; R261-F265 PolarHBondContact O-N 3.33Å; L262-F265 PolarHBondContact O-N 3.07Å; K263-F265 VanDerWaalsContact C-N 3.33Å; K263-F265 PolarHBondContact O-N 3.25Å; F265-K269 HydrophobicContact CE1-CG 4.34Å; F265-K269 HydrophobicContact CZ-CG 4.34Å; F265-K269 WeakPolarHBondContact O-CB 3.45Å; F265-K269 VanDerWaalsContact O-CG 3.22Å; F265-K269 WeakPolarHBondContact O-CG 3.38Å; F265-K269 PolarHBondContact O-N 2.95Å; F265-K269 VanDerWaalsContact O-N 3.12Å
266L73.6Confident71.6Confident108 Ų108129 Ų12957%0.56562%0.623SS**Hα-helixtrans-64.6-41.6176-159.374.9000112.1L262 K263 S264 K269 L270L262-L266 WeakPolarHBondContact O-CB 3.45Å; L262-L266 PolarHBondContact O-N 2.95Å; K263-L266 CarbonylContact O-C 3.58Å; K263-L266 WeakPolarHBondContact O-CB 3.42Å; K263-L266 PolarHBondContact O-N 3.27Å; K263-L266 VanDerWaalsContact O-N 3.11Å; S264-L266 VanDerWaalsContact C-N 3.33Å; S264-L266 PolarHBondContact O-N 2.86Å; L266-K269 WeakPolarHBondContact O-CB 3.36Å; L266-K269 PolarHBondContact O-N 3.43Å; L266-L270 HydrophobicContact CG-CD1 4.23Å; L266-L270 WeakPolarHBondContact O-CD1 3.3Å; L266-L270 WeakPolarHBondContact O-CG 3.37Å; L266-L270 PolarHBondContact O-N 3.5Å; L266-L270 VanDerWaalsContact O-N 3.17Å
267L75.8Confident69.7Low99 Ų99129.9 Ų129.952%0.51863%0.633SS.*Hα-helixtrans-72-39.7-177.2-148.3149.2000111.7K263 S264 K269 L270 N271K263-L267 WeakPolarHBondContact O-CB 3.47Å; K263-L267 PolarHBondContact O-N 3.41Å; S264-L267 PolarHBondContact O-N 3.23Å; L267-K269 VanDerWaalsContact C-N 3.26Å; L267-K269 PolarHBondContact O-N 2.72Å; L267-L270 PolarHBondContact O-N 2.99Å; L267-N271 VanDerWaalsContact CD2-ND2 3.33Å; L267-N271 WeakPolarHBondContact CD2-ND2 3.47Å; L267-N271 PolarHBondContact O-N 3.23Å
268V68.2Low67.9Low117 Ų117133.4 Ų133.471%0.70964%0.639SS**Hα-helixtrans-66.7-27.9171.8170.70000111.8S264 L270S264-V268 WeakPolarHBondContact O-CB 3.44Å; S264-V268 VanDerWaalsContact O-CG2 3.23Å; S264-V268 WeakPolarHBondContact O-CG2 3.42Å; S264-V268 PolarHBondContact O-N 2.67Å; V268-L270 VanDerWaalsContact C-N 3.31Å
269K67.6Low66Low152 Ų152134.1 Ų134.166%0.66164%0.643SS**Hα-helixtrans-76.5-16.9171.5-72.9-71.1-176.9-177.60113.4F265 L266 L267F265-K269 HydrophobicContact CE1-CG 4.34Å; F265-K269 HydrophobicContact CZ-CG 4.34Å; F265-K269 WeakPolarHBondContact O-CB 3.45Å; F265-K269 VanDerWaalsContact O-CG 3.22Å; F265-K269 WeakPolarHBondContact O-CG 3.38Å; F265-K269 PolarHBondContact O-N 2.95Å; F265-K269 VanDerWaalsContact O-N 3.12Å; L266-K269 WeakPolarHBondContact O-CB 3.36Å; L266-K269 PolarHBondContact O-N 3.43Å; L267-K269 VanDerWaalsContact C-N 3.26Å; L267-K269 PolarHBondContact O-N 2.72Å
270L58.7Low64.2Low128 Ų128133.2 Ų133.267%0.6765%0.653SS**Hα-helixtrans-103.6-19.3-176.5-76.9166.1000114.3L266 L267 V268L266-L270 HydrophobicContact CG-CD1 4.23Å; L266-L270 WeakPolarHBondContact O-CD1 3.3Å; L266-L270 WeakPolarHBondContact O-CG 3.37Å; L266-L270 PolarHBondContact O-N 3.5Å; L266-L270 VanDerWaalsContact O-N 3.17Å; L267-L270 PolarHBondContact O-N 2.99Å; V268-L270 VanDerWaalsContact C-N 3.31Å
271N49.4Very low62.3Low102 Ų102140.5 Ų140.555%0.54568%0.68SS.*  trans-100.7126.4-175.1-76.76.3000114.2L267L267-N271 VanDerWaalsContact CD2-ND2 3.33Å; L267-N271 WeakPolarHBondContact CD2-ND2 3.47Å; L267-N271 PolarHBondContact O-N 3.23Å
272D50.8Low60.7Low153 Ų153138.7 Ų138.782%0.81867%0.674SS**  trans-77.3149.4173.3-82.9-35.5000113N274D272-N274 VanDerWaalsContact C-N 3.29Å; D272-N274 PolarHBondContact O-N 2.9Å
273R48.3Very low58.9Low239 Ų239142 Ų14290%0.90269%0.687SS**THydrogen-bonded Turntrans-64.46.2-162.4-90.4177.3169.8165.3-3.7119.2
274N46.8Very low57Low150 Ų150144.7 Ų144.780%0.80270%0.701SS**THydrogen-bonded Turntrans-100.9-0.5-162.5-73.3-7.7000117.4D272D272-N274 VanDerWaalsContact C-N 3.29Å; D272-N274 PolarHBondContact O-N 2.9Å
275E51.4Low55.3Low151 Ų151145.9 Ų145.971%0.70672%0.715SS**SBendtrans-101-2.3-170.3-64.7-172.8162.100116
276F51.7Low54.1Low193 Ų193147.4 Ų147.485%0.84673%0.728SS**THydrogen-bonded Turntrans-81.9-12.8-174.2-83.5-79.6000115.9
277E52.2Low52.7Low175 Ų175152.2 Ų152.282%0.81874%0.744SS**THydrogen-bonded Turntrans-88.3-14.5-176.4-78.8-172.8150.400115
278E51.7Low51Low131 Ų131151.9 Ų151.961%0.61276%0.756SS**SBendtrans-84.4-22.7-170.1-96.5-102.3146.700114.7R282E278-R282 IonicContact OE2-NH2 3.61Å; E278-R282 PolarHBondContact OE2-NH2 3.06Å
279Q49.4Very low49.8Very low148 Ų148155.9 Ų155.969%0.69276%0.764SS**SBendtrans-89.1-18.1-170.7-92.6159.1-19.100115.3K281Q279-K281 PolarHBondContact O-N 3.43Å
280A50.2Low48.2Very low83 Ų83158.3 Ų158.369%0.68677%0.774SS**THydrogen-bonded Turntrans-76.2-18.4-179.200000114.2
281K49Very low46.8Very low183 Ų183161.2 Ų161.280%0.79678%0.784SS**THydrogen-bonded Turntrans-86.5-8.7-173.8-71.3179.5-179.3170.20115Q279Q279-K281 PolarHBondContact O-N 3.43Å
282R51.8Low46Very low166 Ų166161.8 Ų161.863%0.62679%0.791SS**SBendtrans-90.1-13.4-175.8-68-173.6-169.5111.512.2114.5E278E278-R282 IonicContact OE2-NH2 3.61Å; E278-R282 PolarHBondContact OE2-NH2 3.06Å
283E48.1Very low45.2Very low178 Ų178164.1 Ų164.183%0.83279%0.794SS**SBendtrans-89.9-10.4-171.2-119.1-179.9162.500115.3
284E44.6Very low44.5Very low183 Ų183162.3 Ų162.386%0.85579%0.793SS**SBendtrans-93.8-8.2-169.7-149.6171.7-172.900114.9
285A44Very low43.7Very low94 Ų94160 Ų16078%0.77779%0.788SS**THydrogen-bonded Turntrans-89.7-1.7-169.400000116.5
286L52.5Low43Very low162 Ų162161.4 Ų161.485%0.84879%0.792SS**THydrogen-bonded Turntrans-101.74-167.1-74.7168.1000116.5
287K44.7Very low42.4Very low210 Ų210154 Ų15491%0.91377%0.769SS**SBendtrans-109.316.6-168.3-76-173.3178.2174.60118.4
288A39.3Very low42.5Very low92 Ų92154.3 Ų154.376%0.7677%0.771SS**  trans-138.959.6-173.100000116.9
289K43Very low42.6Very low200 Ų200153 Ų15387%0.8778%0.776SS**  trans-152.6107159.9-70.9-170.4-179.5171.30111.6
290K35.5Very low42.5Very low203 Ų203154.4 Ų154.488%0.88378%0.78SS**  trans173.595.6142.4-95.4161.5-171.8-174.80111.6
291H29.4Very low42.7Very low190 Ų190153.8 Ų153.888%0.8876%0.763SS**  trans-154.3141.8154.5-110.6-46.9000110.4
292V31Very low43Very low114 Ų114148.4 Ų148.469%0.69175%0.748SS**  trans92.7106.1160.4-176.30000118.4
293K34Very low43.3Very low201 Ų201149.7 Ų149.787%0.87476%0.755SS**  -178.6145.8100-116.4144.5-171.7-170.70114.2
294K34.7Very low43.9Very low202 Ų202146.5 Ų146.588%0.87874%0.74SS**  trans-87.5142.5178.7-77.2178.2176178.90109.4
295S29.6Very low44.9Very low101 Ų101140.4 Ų140.471%0.70672%0.715SS**  115121.879.7173.50000113.1
296K36.3Very low45.9Very low181 Ų181138 Ų13879%0.78770%0.695SS**  138.9114.3129.7-73-157.4-179.8-174.80114.7
297G38.9Very low46.4Very low36 Ų36134.5 Ų134.537%0.37167%0.674SS.*  trans-173.650168.600000111.6S299 E301G297-S299 PolarHBondContact O-N 3.47Å; G297-E301 WeakPolarHBondContact CA-OE1 3.43Å; G297-E301 WeakPolarHBondContact CA-OE2 3.41Å; G297-E301 PolarHBondContact N-OE1 3.46Å; G297-E301 PolarHBondContact N-OE2 3.17Å; G297-E301 WeakPolarHBondContact O-CB 3.44Å; G297-E301 WeakPolarHBondContact O-CG 3.16Å; G297-E301 PolarHBondContact O-N 2.96Å
298E53.9Low47.5Very low183 Ų183128.7 Ų128.786%0.85565%0.652SS**THydrogen-bonded Turntrans-60.3103-180-68.1171.216900111.2E301E298-E301 PolarHBondContact N-OE2 2.98Å
299S54.9Low48.8Very low102 Ų102132.5 Ų132.571%0.71365%0.647SS**THydrogen-bonded Turntrans159.1-19.8145.8-164.90000111.4G297G297-S299 PolarHBondContact O-N 3.47Å
300F48.1Very low50Low178 Ų178126.7 Ų126.778%0.78163%0.625SS**THydrogen-bonded Turntrans-98-26.7159.9-151.7-98.9000111.2S302 E304F300-S302 PolarHBondContact O-N 3.27Å; F300-E304 PolarHBondContact O-N 3.45Å
301E53.5Low51.4Low71 Ų71119.5 Ų119.533%0.33260%0.596SS.*Hα-helixtrans-65.3-15.2170.6-73.6174.4176.100113.3G297 E298 V305G297-E301 WeakPolarHBondContact CA-OE1 3.43Å; G297-E301 WeakPolarHBondContact CA-OE2 3.41Å; G297-E301 PolarHBondContact N-OE1 3.46Å; G297-E301 PolarHBondContact N-OE2 3.17Å; G297-E301 WeakPolarHBondContact O-CB 3.44Å; G297-E301 WeakPolarHBondContact O-CG 3.16Å; G297-E301 PolarHBondContact O-N 2.96Å; E298-E301 PolarHBondContact N-OE2 2.98Å; E301-V305 HydrophobicContact CB-CG2 3.97Å; E301-V305 VanDerWaalsContact O-CA 3.25Å; E301-V305 WeakPolarHBondContact O-CA 3.32Å; E301-V305 WeakPolarHBondContact O-CB 3.44Å; E301-V305 WeakPolarHBondContact O-CG2 3.41Å; E301-V305 PolarHBondContact O-N 2.88Å
302S56.3Low53.2Low69 Ų69118.9 Ų118.948%0.48359%0.591SS.*Hα-helixtrans-72.8-41.5-177.953.90000112.9F300 A306F300-S302 PolarHBondContact O-N 3.27Å; S302-A306 WeakPolarHBondContact O-CB 3.37Å; S302-A306 PolarHBondContact O-N 3.28Å
303Y56.7Low54.8Low194 Ų194119.7 Ų119.776%0.76159%0.591SS**Hα-helixtrans-74.7-39.1172.2-82.5-82.1000111.5A306 H307Y303-A306 PolarHBondContact O-N 2.87Å; Y303-H307 WeakPolarHBondContact O-CB 3.28Å; Y303-H307 PolarHBondContact O-N 3.43Å
304E60.9Low56.1Low111 Ų111110.5 Ų110.552%0.51955%0.552SS.*Hα-helixtrans-71.1-33.9177.1-160.4173.5-168.300111.7F300 L308F300-E304 PolarHBondContact O-N 3.45Å; E304-L308 HydrophobicContact CG-CD1 4.21Å; E304-L308 WeakPolarHBondContact O-CA 3.48Å; E304-L308 WeakPolarHBondContact O-CB 3.35Å; E304-L308 WeakPolarHBondContact O-CD1 3.33Å; E304-L308 WeakPolarHBondContact O-CG 3.32Å; E304-L308 PolarHBondContact O-N 3.42Å
305V65.6Low57.3Low54 Ų54110.6 Ų110.633%0.32756%0.556SS.*Hα-helixtrans-76-32.9171.8174.50000111.1E301 R309E301-V305 HydrophobicContact CB-CG2 3.97Å; E301-V305 VanDerWaalsContact O-CA 3.25Å; E301-V305 WeakPolarHBondContact O-CA 3.32Å; E301-V305 WeakPolarHBondContact O-CB 3.44Å; E301-V305 WeakPolarHBondContact O-CG2 3.41Å; E301-V305 PolarHBondContact O-N 2.88Å; V305-R309 HydrophobicContact CG1-CG 4.22Å; V305-R309 WeakPolarHBondContact O-CA 3.48Å; V305-R309 WeakPolarHBondContact O-CB 3.48Å; V305-R309 WeakPolarHBondContact O-CG 3.49Å; V305-R309 PolarHBondContact O-N 3.37Å
306A64.4Low58.6Low44 Ų44109 Ų10936%0.36455%0.545SS..Hα-helixtrans-66.1-43.7169.300000110.6S302 Y303 R309 L310S302-A306 WeakPolarHBondContact O-CB 3.37Å; S302-A306 PolarHBondContact O-N 3.28Å; Y303-A306 PolarHBondContact O-N 2.87Å; A306-R309 PolarHBondContact O-N 3.41Å; A306-L310 WeakPolarHBondContact O-CB 3.49Å; A306-L310 WeakPolarHBondContact O-CG 3.34Å; A306-L310 PolarHBondContact O-N 2.92Å
307H63.9Low59.7Low89 Ų89102.5 Ų102.541%0.41253%0.529SS..Hα-helixtrans-67.6-37.9176.2-166.1-67.2000111.8Y303 L310 L311 L319Y303-H307 WeakPolarHBondContact O-CB 3.28Å; Y303-H307 PolarHBondContact O-N 3.43Å; H307-L310 PolarHBondContact O-N 3.31Å; H307-L311 VanDerWaalsContact ND1-CD1 3.32Å; H307-L311 WeakPolarHBondContact ND1-CD1 3.31Å; H307-L311 VanDerWaalsContact O-CB 3.28Å; H307-L311 WeakPolarHBondContact O-CB 3.41Å; H307-L311 WeakPolarHBondContact O-CD1 3.43Å; H307-L311 WeakPolarHBondContact O-CG 3.27Å; H307-L311 PolarHBondContact O-N 2.91Å; H307-L319 WeakPolarHBondContact NE2-CD2 3.45Å
308L67.3Low61.3Low87 Ų87104.9 Ų104.946%0.45553%0.533SS..Hα-helixtrans-73.9-30.2172.7-76.9166.4000112.3E304 L311 K312E304-L308 HydrophobicContact CG-CD1 4.21Å; E304-L308 WeakPolarHBondContact O-CA 3.48Å; E304-L308 WeakPolarHBondContact O-CB 3.35Å; E304-L308 WeakPolarHBondContact O-CD1 3.33Å; E304-L308 WeakPolarHBondContact O-CG 3.32Å; E304-L308 PolarHBondContact O-N 3.42Å; L308-L311 HydrophobicContact CD2-CD1 4.3Å; L308-K312 VanDerWaalsContact O-CB 3.27Å; L308-K312 WeakPolarHBondContact O-CB 3.45Å; L308-K312 VanDerWaalsContact O-CG 3.29Å; L308-K312 WeakPolarHBondContact O-CG 3.34Å; L308-K312 PolarHBondContact O-N 3.17Å
309R67.8Low62Low172 Ų17297.9 Ų97.965%0.64950%0.501SS*.Hα-helixtrans-70.4-41.2170.3-84174.4176.61760.4110.6V305 A306 K312 L313V305-R309 HydrophobicContact CG1-CG 4.22Å; V305-R309 WeakPolarHBondContact O-CA 3.48Å; V305-R309 WeakPolarHBondContact O-CB 3.48Å; V305-R309 WeakPolarHBondContact O-CG 3.49Å; V305-R309 PolarHBondContact O-N 3.37Å; A306-R309 PolarHBondContact O-N 3.41Å; R309-K312 PolarHBondContact O-N 3.41Å; R309-L313 WeakPolarHBondContact O-CB 3.45Å; R309-L313 VanDerWaalsContact O-CG 3.26Å; R309-L313 WeakPolarHBondContact O-CG 3.49Å; R309-L313 PolarHBondContact O-N 3.44Å
310L66.3Low63Low78 Ų7898.7 Ų98.741%0.40850%0.497SS..Hα-helixtrans-65.2-40.6172.8-72.2167.3000111A306 H307 K312 L313 A314 L319 L322A306-L310 WeakPolarHBondContact O-CB 3.49Å; A306-L310 WeakPolarHBondContact O-CG 3.34Å; A306-L310 PolarHBondContact O-N 2.92Å; H307-L310 PolarHBondContact O-N 3.31Å; L310-K312 VanDerWaalsContact C-N 3.35Å; L310-K312 PolarHBondContact O-N 3.5Å; L310-L313 PolarHBondContact O-N 3.41Å; L310-A314 VanDerWaalsContact O-CB 3.23Å; L310-A314 WeakPolarHBondContact O-CB 3.49Å; L310-A314 PolarHBondContact O-N 3.12Å; L310-L319 HydrophobicContact CB-CD1 3.63Å; L310-L319 HydrophobicContact CD1-CD1 4.31Å; L310-L322 HydrophobicContact CB-CD2 4.23Å; L310-L322 HydrophobicContact CD2-CD2 3.9Å
311L66.9Low64.3Low52 Ų5294.3 Ų94.327%0.27248%0.479SS..Hα-helixtrans-66-31.3170.9-85.3160.8000113.4H307 L308 G317H307-L311 VanDerWaalsContact ND1-CD1 3.32Å; H307-L311 WeakPolarHBondContact ND1-CD1 3.31Å; H307-L311 VanDerWaalsContact O-CB 3.28Å; H307-L311 WeakPolarHBondContact O-CB 3.41Å; H307-L311 WeakPolarHBondContact O-CD1 3.43Å; H307-L311 WeakPolarHBondContact O-CG 3.27Å; H307-L311 PolarHBondContact O-N 2.91Å; L308-L311 HydrophobicContact CD2-CD1 4.3Å; L311-G317 WeakPolarHBondContact CD2-O 3.37Å
312K67.1Low65.4Low177 Ų17793.1 Ų93.177%0.7748%0.475SS*.Hα-helixtrans-78-29.4174.3-84.7178.4177.8177.20113.1L308 R309 L310L308-K312 VanDerWaalsContact O-CB 3.27Å; L308-K312 WeakPolarHBondContact O-CB 3.45Å; L308-K312 VanDerWaalsContact O-CG 3.29Å; L308-K312 WeakPolarHBondContact O-CG 3.34Å; L308-K312 PolarHBondContact O-N 3.17Å; R309-K312 PolarHBondContact O-N 3.41Å; L310-K312 VanDerWaalsContact C-N 3.35Å; L310-K312 PolarHBondContact O-N 3.5Å
313L63.7Low66.5Low132 Ų13293.8 Ų93.869%0.69147%0.473SS*.Hα-helixtrans-80.6-27.7173.6-73168.1000111.5R309 L310 E315R309-L313 WeakPolarHBondContact O-CB 3.45Å; R309-L313 VanDerWaalsContact O-CG 3.26Å; R309-L313 WeakPolarHBondContact O-CG 3.49Å; R309-L313 PolarHBondContact O-N 3.44Å; L310-L313 PolarHBondContact O-N 3.41Å; L313-E315 PolarHBondContact O-N 3.5Å
314A61.1Low67.7Low7 Ų790.8 Ų90.86%0.05847%0.465CS..SBendtrans-76.492.7167.400000109L310 S316 G317 L322L310-A314 VanDerWaalsContact O-CB 3.23Å; L310-A314 WeakPolarHBondContact O-CB 3.49Å; L310-A314 PolarHBondContact O-N 3.12Å; A314-S316 PolarHBondContact O-N 3.04Å; A314-G317 PolarHBondContact O-N 3.16Å; A314-L322 HydrophobicContact CB-CB 4.28Å; A314-L322 HydrophobicContact CB-CD2 4.27Å
315E59.8Low68.7Low204 Ų20489.9 Ų89.995%0.95346%0.464SS*.THydrogen-bonded Turntrans-53.6-17.2177-67.2179.6162.700113.4L313L313-E315 PolarHBondContact O-N 3.5Å
316S57.1Low69.6Low69 Ų6993.6 Ų93.648%0.48348%0.476SS..THydrogen-bonded Turntrans-98.5-0.6179.2620000116.1A314 N318 Q321A314-S316 PolarHBondContact O-N 3.04Å; S316-N318 PolarHBondContact O-N 3.07Å; S316-N318 VanDerWaalsContact O-N 3.15Å; S316-Q321 PolarHBondContact OG-OE1 3.03Å
317G60.6Low70.6Confident43 Ų4395.5 Ų95.544%0.44348%0.48SS..SBendtrans69.17.2174.600000116.6L311 A314L311-G317 WeakPolarHBondContact CD2-O 3.37Å; A314-G317 PolarHBondContact O-N 3.16Å
318N71.9Confident71.7Confident86 Ų8692.9 Ų92.946%0.4647%0.473SS..  trans-116.3112.7178.5-71.9-40.2000111.3S316 N320 Q321 L322S316-N318 PolarHBondContact O-N 3.07Å; S316-N318 VanDerWaalsContact O-N 3.15Å; N318-N320 VanDerWaalsContact C-N 3.34Å; N318-N320 PolarHBondContact O-N 3.06Å; N318-Q321 HydrophobicContact CB-CB 4.24Å; N318-Q321 HydrophobicContact CB-CG 4.1Å; N318-Q321 PolarHBondContact O-N 3.37Å; N318-L322 PolarHBondContact O-N 3.44Å
319L68Low72.6Confident37 Ų3795.4 Ų95.419%0.19448%0.481CS..Hα-helixtrans-64.6-36.1-178.4-16582.5000112.8H307 L310 Q321 L322 I323H307-L319 WeakPolarHBondContact NE2-CD2 3.45Å; L310-L319 HydrophobicContact CB-CD1 3.63Å; L310-L319 HydrophobicContact CD1-CD1 4.31Å; L319-Q321 VanDerWaalsContact C-N 3.3Å; L319-Q321 PolarHBondContact O-N 2.86Å; L319-L322 PolarHBondContact O-N 2.97Å; L319-L322 VanDerWaalsContact O-N 3.16Å; L319-I323 HydrophobicContact CD2-CD1 4.27Å; L319-I323 HydrophobicContact CG-CD1 4.3Å; L319-I323 WeakPolarHBondContact O-CG1 3.4Å; L319-I323 PolarHBondContact O-N 3.13Å
320N75.4Confident73.6Confident118 Ų11892.1 Ų92.163%0.63147%0.473SS*.Hα-helixtrans-63.1-37-179.9-65-17.6000111.9N318 I323 E324N318-N320 VanDerWaalsContact C-N 3.34Å; N318-N320 PolarHBondContact O-N 3.06Å; N320-I323 PolarHBondContact O-N 3.48Å; N320-E324 WeakPolarHBondContact O-CG 3.39Å; N320-E324 PolarHBondContact O-N 3.38Å
321Q76.1Confident74.5Confident86 Ų8695 Ų9540%0.40248%0.484SS..Hα-helixtrans-67.1-36.7175.6-72.9177.8-15.400111.9S316 N318 L319 E324 D325S316-Q321 PolarHBondContact OG-OE1 3.03Å; N318-Q321 HydrophobicContact CB-CB 4.24Å; N318-Q321 HydrophobicContact CB-CG 4.1Å; N318-Q321 PolarHBondContact O-N 3.37Å; L319-Q321 VanDerWaalsContact C-N 3.3Å; L319-Q321 PolarHBondContact O-N 2.86Å; Q321-E324 PolarHBondContact O-N 2.87Å; Q321-D325 WeakPolarHBondContact O-CB 3.43Å; Q321-D325 VanDerWaalsContact O-CG 3.31Å; Q321-D325 PolarHBondContact O-N 3.18Å
322L76.8Confident75.6Confident46 Ų4699 Ų9924%0.24150%0.5CS..Hα-helixtrans-67.3-36.9175.6-176.268.1000112L310 A314 N318 L319 D325 F326L310-L322 HydrophobicContact CB-CD2 4.23Å; L310-L322 HydrophobicContact CD2-CD2 3.9Å; A314-L322 HydrophobicContact CB-CB 4.28Å; A314-L322 HydrophobicContact CB-CD2 4.27Å; N318-L322 PolarHBondContact O-N 3.44Å; L319-L322 PolarHBondContact O-N 2.97Å; L319-L322 VanDerWaalsContact O-N 3.16Å; L322-D325 PolarHBondContact O-N 2.98Å; L322-F326 VanDerWaalsContact O-CB 3.3Å; L322-F326 WeakPolarHBondContact O-CB 3.43Å; L322-F326 PolarHBondContact O-N 2.98Å
323I79.6Confident76.6Confident84 Ų8495.8 Ų95.843%0.43149%0.49SS..Hα-helixtrans-68.4-43.9175.4-65.6168.9000110.1L319 N320 D325 F326 L327L319-I323 HydrophobicContact CD2-CD1 4.27Å; L319-I323 HydrophobicContact CG-CD1 4.3Å; L319-I323 WeakPolarHBondContact O-CG1 3.4Å; L319-I323 PolarHBondContact O-N 3.13Å; N320-I323 PolarHBondContact O-N 3.48Å; I323-D325 VanDerWaalsContact C-N 3.35Å; I323-D325 PolarHBondContact O-N 3.42Å; I323-F326 PolarHBondContact O-N 2.86Å; I323-L327 HydrophobicContact CG2-CD1 4Å; I323-L327 HydrophobicContact CG2-CG 4.36Å; I323-L327 WeakPolarHBondContact O-CB 3.42Å; I323-L327 WeakPolarHBondContact O-CG 3.3Å; I323-L327 PolarHBondContact O-N 2.75Å
324E82.3Confident77.9Confident130 Ų13096.5 Ų96.561%0.60749%0.488SS*.Hα-helixtrans-60.4-43.1173.3-76.7176.9-177.900111.7N320 Q321 F326 L327 A328N320-E324 WeakPolarHBondContact O-CG 3.39Å; N320-E324 PolarHBondContact O-N 3.38Å; Q321-E324 PolarHBondContact O-N 2.87Å; E324-F326 VanDerWaalsContact C-N 3.33Å; E324-F326 PolarHBondContact O-N 3.24Å; E324-L327 PolarHBondContact O-N 3.15Å; E324-A328 VanDerWaalsContact O-CB 3.24Å; E324-A328 WeakPolarHBondContact O-CB 3.31Å; E324-A328 PolarHBondContact O-N 2.86Å
325D81Confident79.3Confident92 Ų9299 Ų9949%0.49251%0.509SS..Hα-helixtrans-65.4-35.5175.2-79.9-19.3000112.5Q321 L322 I323 K329Q321-D325 WeakPolarHBondContact O-CB 3.43Å; Q321-D325 VanDerWaalsContact O-CG 3.31Å; Q321-D325 PolarHBondContact O-N 3.18Å; L322-D325 PolarHBondContact O-N 2.98Å; I323-D325 VanDerWaalsContact C-N 3.35Å; I323-D325 PolarHBondContact O-N 3.42Å; D325-K329 WeakPolarHBondContact O-CB 3.49Å; D325-K329 WeakPolarHBondContact O-CD 3.39Å; D325-K329 WeakPolarHBondContact O-CG 3.32Å; D325-K329 PolarHBondContact O-N 3.32Å
326F83.9Confident80.8Confident132 Ų13297.6 Ų97.658%0.57950%0.495SS*.Hα-helixtrans-70.3-46.3175.9-175.9-91.8000111.1L322 I323 E324 A328 K329 E330L322-F326 VanDerWaalsContact O-CB 3.3Å; L322-F326 WeakPolarHBondContact O-CB 3.43Å; L322-F326 PolarHBondContact O-N 2.98Å; I323-F326 PolarHBondContact O-N 2.86Å; E324-F326 VanDerWaalsContact C-N 3.33Å; E324-F326 PolarHBondContact O-N 3.24Å; F326-A328 VanDerWaalsContact C-N 3.35Å; F326-A328 PolarHBondContact O-N 3.46Å; F326-K329 CarbonylContact O-C 3.52Å; F326-K329 WeakPolarHBondContact O-CB 3.34Å; F326-K329 PolarHBondContact O-N 3.4Å; F326-K329 VanDerWaalsContact O-N 3.13Å; F326-E330 WeakPolarHBondContact O-CB 3.36Å; F326-E330 PolarHBondContact O-N 2.95Å
327L85.8Confident82.5Confident84 Ų84101 Ų10144%0.4450%0.501SS..Hα-helixtrans-60.5-44.2174.4-73.1172.1000110.7I323 E324 K329 E330 E331I323-L327 HydrophobicContact CG2-CD1 4Å; I323-L327 HydrophobicContact CG2-CG 4.36Å; I323-L327 WeakPolarHBondContact O-CB 3.42Å; I323-L327 WeakPolarHBondContact O-CG 3.3Å; I323-L327 PolarHBondContact O-N 2.75Å; E324-L327 PolarHBondContact O-N 3.15Å; L327-K329 VanDerWaalsContact C-N 3.29Å; L327-K329 PolarHBondContact O-N 2.98Å; L327-E330 CarbonylContact O-C 3.58Å; L327-E330 PolarHBondContact O-N 3.5Å; L327-E330 VanDerWaalsContact O-N 3.12Å; L327-E331 WeakPolarHBondContact O-CB 3.41Å; L327-E331 WeakPolarHBondContact O-CG 3.39Å; L327-E331 PolarHBondContact O-N 3.47Å
328A87.3Confident84Confident34 Ų34101.3 Ų101.328%0.28149%0.494SS..Hα-helixtrans-63.8-33.9175.200000112.5E324 F326 K332E324-A328 VanDerWaalsContact O-CB 3.24Å; E324-A328 WeakPolarHBondContact O-CB 3.31Å; E324-A328 PolarHBondContact O-N 2.86Å; F326-A328 VanDerWaalsContact C-N 3.35Å; F326-A328 PolarHBondContact O-N 3.46Å; A328-K332 WeakPolarHBondContact O-CB 3.4Å; A328-K332 WeakPolarHBondContact O-CD 3.43Å; A328-K332 WeakPolarHBondContact O-CG 3.36Å; A328-K332 PolarHBondContact O-N 3.45Å; A328-K332 VanDerWaalsContact O-N 3.15Å
329K86.2Confident85.1Confident140 Ų140103.8 Ų103.861%0.60950%0.498SS*.Hα-helixtrans-72.1-37.2172.1-77.9169.4-176.6167.80111.7D325 F326 L327 K332 N333D325-K329 WeakPolarHBondContact O-CB 3.49Å; D325-K329 WeakPolarHBondContact O-CD 3.39Å; D325-K329 WeakPolarHBondContact O-CG 3.32Å; D325-K329 PolarHBondContact O-N 3.32Å; F326-K329 CarbonylContact O-C 3.52Å; F326-K329 WeakPolarHBondContact O-CB 3.34Å; F326-K329 PolarHBondContact O-N 3.4Å; F326-K329 VanDerWaalsContact O-N 3.13Å; L327-K329 VanDerWaalsContact C-N 3.29Å; L327-K329 PolarHBondContact O-N 2.98Å; K329-K332 PolarHBondContact O-N 2.94Å; K329-N333 VanDerWaalsContact O-CB 3.3Å; K329-N333 WeakPolarHBondContact O-CB 3.48Å; K329-N333 PolarHBondContact O-N 3.4Å
330E88.1Confident86.4Confident103 Ų103106.3 Ų106.348%0.48152%0.515SS..Hα-helixtrans-68-44.2177.4-171.3177.1-167.600111F326 L327 K332 N333 F334F326-E330 WeakPolarHBondContact O-CB 3.36Å; F326-E330 PolarHBondContact O-N 2.95Å; L327-E330 CarbonylContact O-C 3.58Å; L327-E330 PolarHBondContact O-N 3.5Å; L327-E330 VanDerWaalsContact O-N 3.12Å; E330-K332 PolarHBondContact O-N 2.92Å; E330-N333 CarbonylContact O-C 3.52Å; E330-N333 WeakPolarHBondContact O-CA 3.49Å; E330-N333 WeakPolarHBondContact O-CB 3.42Å; E330-N333 PolarHBondContact O-N 2.92Å; E330-F334 WeakPolarHBondContact O-CB 3.46Å; E330-F334 PolarHBondContact O-N 2.87Å
331E86.1Confident87.2Confident140 Ų140103.4 Ų103.465%0.65450%0.502SS*.Hα-helixtrans-59.2-45.2171.9-74.5177.9177.400111.4L327 N333 F334 A335L327-E331 WeakPolarHBondContact O-CB 3.41Å; L327-E331 WeakPolarHBondContact O-CG 3.39Å; L327-E331 PolarHBondContact O-N 3.47Å; E331-N333 VanDerWaalsContact C-N 3.27Å; E331-N333 PolarHBondContact O-N 3.15Å; E331-F334 PolarHBondContact O-N 3.45Å; E331-A335 WeakPolarHBondContact O-CB 3.35Å; E331-A335 PolarHBondContact O-N 3Å
332K88.8Confident88.1Confident136 Ų136104.5 Ų104.559%0.59151%0.507SS*.Hα-helixtrans-62-36.1173.3-75.9170.2-174171.50111.9A328 K329 E330 R336A328-K332 WeakPolarHBondContact O-CB 3.4Å; A328-K332 WeakPolarHBondContact O-CD 3.43Å; A328-K332 WeakPolarHBondContact O-CG 3.36Å; A328-K332 PolarHBondContact O-N 3.45Å; A328-K332 VanDerWaalsContact O-N 3.15Å; K329-K332 PolarHBondContact O-N 2.94Å; E330-K332 PolarHBondContact O-N 2.92Å; K332-R336 VanDerWaalsContact O-CG 3.23Å; K332-R336 WeakPolarHBondContact O-CG 3.37Å; K332-R336 PolarHBondContact O-N 2.75Å; K332-R336 VanDerWaalsContact O-N 3.08Å
333N89.5Confident88.9Confident108 Ų108105.8 Ų105.858%0.57851%0.513SS*.Hα-helixtrans-73.2-39.5178.6-159.913.7000111.4K329 E330 E331 R336 F337K329-N333 VanDerWaalsContact O-CB 3.3Å; K329-N333 WeakPolarHBondContact O-CB 3.48Å; K329-N333 PolarHBondContact O-N 3.4Å; E330-N333 CarbonylContact O-C 3.52Å; E330-N333 WeakPolarHBondContact O-CA 3.49Å; E330-N333 WeakPolarHBondContact O-CB 3.42Å; E330-N333 PolarHBondContact O-N 2.92Å; E331-N333 VanDerWaalsContact C-N 3.27Å; E331-N333 PolarHBondContact O-N 3.15Å; N333-R336 WeakPolarHBondContact O-CB 3.37Å; N333-R336 PolarHBondContact O-N 2.94Å; N333-F337 WeakPolarHBondContact O-CB 3.49Å; N333-F337 PolarHBondContact O-N 3.39Å
334F90.3Very high89.6Confident147 Ų147106.5 Ų106.565%0.64552%0.518SS*.Hα-helixtrans-62.8-47.4174.1-172.4-97.5000110.8E330 E331 R336 F337 T338E330-F334 WeakPolarHBondContact O-CB 3.46Å; E330-F334 PolarHBondContact O-N 2.87Å; E331-F334 PolarHBondContact O-N 3.45Å; F334-R336 VanDerWaalsContact C-N 3.27Å; F334-R336 PolarHBondContact O-N 3.39Å; F334-F337 WeakPolarHBondContact O-CB 3.46Å; F334-F337 PolarHBondContact O-N 3.04Å; F334-T338 PolarHBondContact O-N 3.12Å; F334-T338 PolarHBondContact O-OG1 3.47Å; F334-T338 VanDerWaalsContact O-OG1 3.07Å
335A91.2Very high90.2Very high59 Ų59104.6 Ų104.649%0.48851%0.512SS..Hα-helixtrans-58.2-39.5174.300000112.3E331 Y339E331-A335 WeakPolarHBondContact O-CB 3.35Å; E331-A335 PolarHBondContact O-N 3Å; A335-Y339 WeakPolarHBondContact O-CB 3.35Å; A335-Y339 PolarHBondContact O-N 3.36Å
336R90.5Very high90.9Very high176 Ų176104.2 Ų104.266%0.66451%0.51SS*.Hα-helixtrans-65.8-41.5173.4-75.1171.4-177.3-158.30.1112.1K332 N333 F334 Y339 V340K332-R336 VanDerWaalsContact O-CG 3.23Å; K332-R336 WeakPolarHBondContact O-CG 3.37Å; K332-R336 PolarHBondContact O-N 2.75Å; K332-R336 VanDerWaalsContact O-N 3.08Å; N333-R336 WeakPolarHBondContact O-CB 3.37Å; N333-R336 PolarHBondContact O-N 2.94Å; F334-R336 VanDerWaalsContact C-N 3.27Å; F334-R336 PolarHBondContact O-N 3.39Å; R336-Y339 PolarHBondContact O-N 3.15Å; R336-V340 WeakPolarHBondContact O-CB 3.49Å; R336-V340 VanDerWaalsContact O-CG2 3.26Å; R336-V340 WeakPolarHBondContact O-CG2 3.42Å; R336-V340 PolarHBondContact O-N 3.41Å
337F92.8Very high91.3Very high139 Ų139102.9 Ų102.961%0.6151%0.507SS*.Hα-helixtrans-65.7-43178.6-173.4-93.2000111.8N333 F334 V340 T341N333-F337 WeakPolarHBondContact O-CB 3.49Å; N333-F337 PolarHBondContact O-N 3.39Å; F334-F337 WeakPolarHBondContact O-CB 3.46Å; F334-F337 PolarHBondContact O-N 3.04Å; F337-V340 PolarHBondContact O-N 3.24Å; F337-T341 WeakPolarHBondContact O-CB 3.25Å; F337-T341 PolarHBondContact O-N 3.37Å; F337-T341 PolarHBondContact O-OG1 2.88Å
338T92.4Very high91.8Very high50 Ų50103.5 Ų103.531%0.30751%0.508SS..Hα-helixtrans-59.1-48172.6-54.10000110.5F334 V340 T341 E342F334-T338 PolarHBondContact O-N 3.12Å; F334-T338 PolarHBondContact O-OG1 3.47Å; F334-T338 VanDerWaalsContact O-OG1 3.07Å; T338-V340 PolarHBondContact O-N 3.43Å; T338-T341 WeakPolarHBondContact O-CB 3.45Å; T338-T341 PolarHBondContact O-N 3.13Å; T338-T341 VanDerWaalsContact O-N 3.09Å; T338-E342 WeakPolarHBondContact O-CG 3.31Å; T338-E342 PolarHBondContact O-N 3.47Å
339Y94.7Very high92.1Very high139 Ų139105.9 Ų105.955%0.54551%0.514SS..Hα-helixtrans-61.2-41.9177.7-179.7-112.7000113A335 R336 T341 E342 L343A335-Y339 WeakPolarHBondContact O-CB 3.35Å; A335-Y339 PolarHBondContact O-N 3.36Å; R336-Y339 PolarHBondContact O-N 3.15Å; Y339-T341 VanDerWaalsContact C-N 3.29Å; Y339-T341 PolarHBondContact O-N 3.19Å; Y339-E342 PolarHBondContact O-N 3.06Å; Y339-L343 HydrophobicContact CD1-CD1 3.86Å; Y339-L343 HydrophobicContact CD1-CG 4.43Å; Y339-L343 HydrophobicContact CE1-CD1 3.3Å; Y339-L343 HydrophobicContact CE1-CG 4.02Å; Y339-L343 HydrophobicContact CE2-CD1 4.28Å; Y339-L343 HydrophobicContact CE2-CD2 4.4Å; Y339-L343 HydrophobicContact CE2-CG 4.09Å; Y339-L343 WeakPolarHBondContact O-CB 3.36Å; Y339-L343 WeakPolarHBondContact O-CG 3.41Å; Y339-L343 PolarHBondContact O-N 2.94Å
340V95.3Very high92.4Very high89 Ų89104.1 Ų104.154%0.53951%0.509SS..Hα-helixtrans-63.2-37.9174.6168.70000111R336 F337 T338 L343 N344R336-V340 WeakPolarHBondContact O-CB 3.49Å; R336-V340 VanDerWaalsContact O-CG2 3.26Å; R336-V340 WeakPolarHBondContact O-CG2 3.42Å; R336-V340 PolarHBondContact O-N 3.41Å; F337-V340 PolarHBondContact O-N 3.24Å; T338-V340 PolarHBondContact O-N 3.43Å; V340-L343 PolarHBondContact O-N 3.34Å; V340-N344 WeakPolarHBondContact O-CB 3.45Å; V340-N344 PolarHBondContact O-N 2.78Å
341T93Very high92.7Very high58 Ų58104.7 Ų104.736%0.35651%0.512SS..Hα-helixtrans-67.9-43.2177.5-53.70000111.4F337 T338 Y339 N344 N345F337-T341 WeakPolarHBondContact O-CB 3.25Å; F337-T341 PolarHBondContact O-N 3.37Å; F337-T341 PolarHBondContact O-OG1 2.88Å; T338-T341 WeakPolarHBondContact O-CB 3.45Å; T338-T341 PolarHBondContact O-N 3.13Å; T338-T341 VanDerWaalsContact O-N 3.09Å; Y339-T341 VanDerWaalsContact C-N 3.29Å; Y339-T341 PolarHBondContact O-N 3.19Å; T341-N344 PolarHBondContact O-N 3.12Å; T341-N345 VanDerWaalsContact O-CG 3.31Å; T341-N345 PolarHBondContact O-N 3.36Å; T341-N345 PolarHBondContact O-ND2 3.21Å
342E93.9Very high93.1Very high108 Ų108102.6 Ų102.651%0.50550%0.5SS..Hα-helixtrans-60.8-47.5173.6-72.7174.8178.500111.4T338 Y339 N344 N345 D346T338-E342 WeakPolarHBondContact O-CG 3.31Å; T338-E342 PolarHBondContact O-N 3.47Å; Y339-E342 PolarHBondContact O-N 3.06Å; E342-N344 VanDerWaalsContact C-N 3.27Å; E342-N344 PolarHBondContact O-N 3.03Å; E342-N345 WeakPolarHBondContact O-CB 3.4Å; E342-N345 PolarHBondContact O-N 3.26Å; E342-D346 PolarHBondContact O-N 2.94Å
343L93.6Very high93.4Very high73 Ų73101.5 Ų101.538%0.38249%0.493SS..Hα-helixtrans-59.4-37.8175-79.4179.2000112.5Y339 V340 D346 M347Y339-L343 HydrophobicContact CD1-CD1 3.86Å; Y339-L343 HydrophobicContact CD1-CG 4.43Å; Y339-L343 HydrophobicContact CE1-CD1 3.3Å; Y339-L343 HydrophobicContact CE1-CG 4.02Å; Y339-L343 HydrophobicContact CE2-CD1 4.28Å; Y339-L343 HydrophobicContact CE2-CD2 4.4Å; Y339-L343 HydrophobicContact CE2-CG 4.09Å; Y339-L343 WeakPolarHBondContact O-CB 3.36Å; Y339-L343 WeakPolarHBondContact O-CG 3.41Å; Y339-L343 PolarHBondContact O-N 2.94Å; V340-L343 PolarHBondContact O-N 3.34Å; L343-D346 PolarHBondContact O-N 2.84Å; L343-M347 WeakPolarHBondContact O-CB 3.46Å; L343-M347 PolarHBondContact O-N 3.39Å
344N94.5Very high93.6Very high100 Ų10099.6 Ų99.654%0.53549%0.485SS..Hα-helixtrans-69.8-39.5178.5-158.743.6000111.4V340 T341 E342 M347 E348V340-N344 WeakPolarHBondContact O-CB 3.45Å; V340-N344 PolarHBondContact O-N 2.78Å; T341-N344 PolarHBondContact O-N 3.12Å; E342-N344 VanDerWaalsContact C-N 3.27Å; E342-N344 PolarHBondContact O-N 3.03Å; N344-M347 WeakPolarHBondContact O-CB 3.38Å; N344-M347 PolarHBondContact O-N 2.84Å; N344-E348 PolarHBondContact O-N 3.43Å
345N94.9Very high93.9Very high90 Ų9098 Ų9848%0.48148%0.48SS..Hα-helixtrans-63-42.5172.6-70.8-23.7000111.6T341 E342 M347 E348 M349T341-N345 VanDerWaalsContact O-CG 3.31Å; T341-N345 PolarHBondContact O-N 3.36Å; T341-N345 PolarHBondContact O-ND2 3.21Å; E342-N345 WeakPolarHBondContact O-CB 3.4Å; E342-N345 PolarHBondContact O-N 3.26Å; N345-M347 VanDerWaalsContact C-N 3.35Å; N345-E348 PolarHBondContact O-N 3.44Å; N345-M349 WeakPolarHBondContact O-CB 3.43Å; N345-M349 PolarHBondContact O-N 2.87Å
346D95.1Very high94.1Very high84 Ų84103.5 Ų103.545%0.44949%0.488SS..Hα-helixtrans-64-41175.4-80.3-10.4000111.4E342 L343 M349 M350E342-D346 PolarHBondContact O-N 2.94Å; L343-D346 PolarHBondContact O-N 2.84Å; D346-M349 WeakPolarHBondContact O-CB 3.36Å; D346-M349 PolarHBondContact O-N 3.49Å; D346-M350 VanDerWaalsContact O-CG 3.3Å; D346-M350 WeakPolarHBondContact O-CG 3.28Å; D346-M350 PolarHBondContact O-N 3.18Å
347M94.3Very high94.3Very high103 Ų10399.7 Ų99.751%0.50748%0.479SS..Hα-helixtrans-61.1-45.3175.4-167.1-175.5-54.500111.2L343 N344 N345 M349 M350 H351L343-M347 WeakPolarHBondContact O-CB 3.46Å; L343-M347 PolarHBondContact O-N 3.39Å; N344-M347 WeakPolarHBondContact O-CB 3.38Å; N344-M347 PolarHBondContact O-N 2.84Å; N345-M347 VanDerWaalsContact C-N 3.35Å; M347-M349 VanDerWaalsContact C-N 3.34Å; M347-M349 PolarHBondContact O-N 3.34Å; M347-M350 PolarHBondContact O-N 3.05Å; M347-H351 PolarHBondContact O-CD2 3.23Å; M347-H351 PolarHBondContact O-N 2.91Å
348E94.4Very high94.3Very high98 Ų9898.2 Ų98.246%0.45847%0.474SS..Hα-helixtrans-63.5-40.1176-163.5-171.6156.100111.6N344 N345 H351 K352N344-E348 PolarHBondContact O-N 3.43Å; N345-E348 PolarHBondContact O-N 3.44Å; E348-H351 PolarHBondContact O-N 3.34Å; E348-K352 WeakPolarHBondContact O-CG 3.48Å; E348-K352 PolarHBondContact O-N 3.29Å; E348-K352 WeakPolarHBondContact OE1-CE 3.4Å; E348-K352 IonicContact OE1-NZ 3.25Å; E348-K352 PolarHBondContact OE1-NZ 3.26Å
349M94.8Very high94.5Very high83 Ų83100.7 Ų100.741%0.40949%0.486SS..Hα-helixtrans-62.4-43.4175.4-166.9-168.2-55.900111.5N345 D346 M347 K352 R353N345-M349 WeakPolarHBondContact O-CB 3.43Å; N345-M349 PolarHBondContact O-N 2.87Å; D346-M349 WeakPolarHBondContact O-CB 3.36Å; D346-M349 PolarHBondContact O-N 3.49Å; M347-M349 VanDerWaalsContact C-N 3.34Å; M347-M349 PolarHBondContact O-N 3.34Å; M349-K352 PolarHBondContact O-N 2.94Å; M349-R353 WeakPolarHBondContact O-CG 3.5Å; M349-R353 PolarHBondContact O-N 3.3Å; M349-R353 PolarHBondContact SD-NH2 3.33Å
350M92.3Very high94.5Very high104 Ų10499.6 Ų99.651%0.51249%0.486SS..Hα-helixtrans-66.9-37.6176.5-68.6-56.5178.800112D346 M347 R353 T354D346-M350 VanDerWaalsContact O-CG 3.3Å; D346-M350 WeakPolarHBondContact O-CG 3.28Å; D346-M350 PolarHBondContact O-N 3.18Å; M347-M350 PolarHBondContact O-N 3.05Å; M350-R353 VanDerWaalsContact CE-NH1 3.32Å; M350-R353 PolarHBondContact O-N 2.89Å; M350-R353 PolarHBondContact SD-NH1 3.4Å; M350-R353 VanDerWaalsContact SD-NH1 3.45Å; M350-T354 WeakPolarHBondContact O-CB 3.33Å; M350-T354 PolarHBondContact O-N 3.41Å; M350-T354 PolarHBondContact O-OG1 3.23Å
351H93.9Very high94.4Very high114 Ų11498.9 Ų98.953%0.52848%0.478SS..Hα-helixtrans-63-45172.8-81.4-57.2000112.1M347 E348 R353 T354 Q355M347-H351 PolarHBondContact O-CD2 3.23Å; M347-H351 PolarHBondContact O-N 2.91Å; E348-H351 PolarHBondContact O-N 3.34Å; H351-R353 VanDerWaalsContact C-N 3.34Å; H351-R353 PolarHBondContact O-N 2.84Å; H351-T354 WeakPolarHBondContact O-CB 3.31Å; H351-T354 PolarHBondContact O-N 2.96Å; H351-Q355 PolarHBondContact O-N 3.01Å
352K95.1Very high94.5Very high96 Ų96101.2 Ų101.242%0.41749%0.487SS..Hα-helixtrans-61.2-41.2174.8-74.3173.6-176164.40112E348 M349 Q355 R356E348-K352 WeakPolarHBondContact O-CG 3.48Å; E348-K352 PolarHBondContact O-N 3.29Å; E348-K352 WeakPolarHBondContact OE1-CE 3.4Å; E348-K352 IonicContact OE1-NZ 3.25Å; E348-K352 PolarHBondContact OE1-NZ 3.26Å; M349-K352 PolarHBondContact O-N 2.94Å; K352-Q355 PolarHBondContact O-N 2.91Å; K352-R356 VanDerWaalsContact O-CG 3.3Å; K352-R356 WeakPolarHBondContact O-CG 3.42Å; K352-R356 PolarHBondContact O-N 2.7Å
353R95Very high94.6Very high114 Ų114101.3 Ų101.343%0.4349%0.49SS..Hα-helixtrans-63.2-43.1174.2-74.9175.7-179.9153.80.1111.6M349 M350 H351 Q355 R356 I357M349-R353 WeakPolarHBondContact O-CG 3.5Å; M349-R353 PolarHBondContact O-N 3.3Å; M349-R353 PolarHBondContact SD-NH2 3.33Å; M350-R353 VanDerWaalsContact CE-NH1 3.32Å; M350-R353 PolarHBondContact O-N 2.89Å; M350-R353 PolarHBondContact SD-NH1 3.4Å; M350-R353 VanDerWaalsContact SD-NH1 3.45Å; H351-R353 VanDerWaalsContact C-N 3.34Å; H351-R353 PolarHBondContact O-N 2.84Å; R353-Q355 PolarHBondContact O-N 3.49Å; R353-R356 PolarHBondContact O-N 2.98Å; R353-I357 WeakPolarHBondContact O-CG1 3.39Å; R353-I357 PolarHBondContact O-N 3.48Å
354T93.9Very high94.6Very high67 Ų67102.3 Ų102.341%0.41150%0.496SS..Hα-helixtrans-62.2-44178.1-55.80000111M350 H351 I357 Q358M350-T354 WeakPolarHBondContact O-CB 3.33Å; M350-T354 PolarHBondContact O-N 3.41Å; M350-T354 PolarHBondContact O-OG1 3.23Å; H351-T354 WeakPolarHBondContact O-CB 3.31Å; H351-T354 PolarHBondContact O-N 2.96Å; T354-I357 PolarHBondContact O-N 2.93Å; T354-Q358 WeakPolarHBondContact O-CB 3.5Å; T354-Q358 VanDerWaalsContact O-CG 3.3Å; T354-Q358 WeakPolarHBondContact O-CG 3.48Å; T354-Q358 PolarHBondContact O-N 3.17Å
355Q95.8Very high94.6Very high115 Ų115105.9 Ų105.954%0.53750%0.502SS..Hα-helixtrans-60.5-47.4174.4-77.5176.6-16.100111.8H351 K352 R353 I357 Q358 D359H351-Q355 PolarHBondContact O-N 3.01Å; K352-Q355 PolarHBondContact O-N 2.91Å; R353-Q355 PolarHBondContact O-N 3.49Å; Q355-I357 VanDerWaalsContact C-N 3.3Å; Q355-I357 PolarHBondContact O-N 3.23Å; Q355-Q358 WeakPolarHBondContact O-CB 3.45Å; Q355-Q358 PolarHBondContact O-N 3.02Å; Q355-Q358 VanDerWaalsContact O-N 3.07Å; Q355-D359 VanDerWaalsContact O-CG 3.28Å; Q355-D359 PolarHBondContact O-N 3.31Å
356R95.5Very high94.4Very high174 Ų174104.7 Ų104.766%0.65750%0.501SS*.Hα-helixtrans-57.2-43.6176.6-71173.1-168.5-178.32.7112.4K352 R353 Q358 D359 E360K352-R356 VanDerWaalsContact O-CG 3.3Å; K352-R356 WeakPolarHBondContact O-CG 3.42Å; K352-R356 PolarHBondContact O-N 2.7Å; R353-R356 PolarHBondContact O-N 2.98Å; R356-Q358 VanDerWaalsContact C-N 3.35Å; R356-D359 PolarHBondContact O-N 3.45Å; R356-E360 WeakPolarHBondContact O-CB 3.5Å; R356-E360 PolarHBondContact O-N 2.87Å
357I94.3Very high94.4Very high95 Ų95106.4 Ų106.449%0.48751%0.506SS..Hα-helixtrans-65.8-40.1177.2-67.5167.3000110.5R353 T354 Q355 E360 I361R353-I357 WeakPolarHBondContact O-CG1 3.39Å; R353-I357 PolarHBondContact O-N 3.48Å; T354-I357 PolarHBondContact O-N 2.93Å; Q355-I357 VanDerWaalsContact C-N 3.3Å; Q355-I357 PolarHBondContact O-N 3.23Å; I357-E360 PolarHBondContact O-N 2.98Å; I357-I361 HydrophobicContact CG2-CD1 3.9Å; I357-I361 HydrophobicContact CG2-CG1 4.45Å; I357-I361 WeakPolarHBondContact O-CB 3.38Å; I357-I361 VanDerWaalsContact O-CG1 3.22Å; I357-I361 WeakPolarHBondContact O-CG1 3.39Å; I357-I361 PolarHBondContact O-N 3.41Å
358Q94.6Very high94.2Very high108 Ų108108.2 Ų108.251%0.50551%0.513SS..Hα-helixtrans-63.2-43.8175.5-74.9174.1-8.400111.8T354 Q355 R356 E360 I361 I362T354-Q358 WeakPolarHBondContact O-CB 3.5Å; T354-Q358 VanDerWaalsContact O-CG 3.3Å; T354-Q358 WeakPolarHBondContact O-CG 3.48Å; T354-Q358 PolarHBondContact O-N 3.17Å; Q355-Q358 WeakPolarHBondContact O-CB 3.45Å; Q355-Q358 PolarHBondContact O-N 3.02Å; Q355-Q358 VanDerWaalsContact O-N 3.07Å; R356-Q358 VanDerWaalsContact C-N 3.35Å; Q358-E360 VanDerWaalsContact C-N 3.34Å; Q358-I361 PolarHBondContact O-N 2.83Å; Q358-I362 VanDerWaalsContact O-CG1 3.32Å; Q358-I362 WeakPolarHBondContact O-CG1 3.47Å; Q358-I362 PolarHBondContact O-N 3.37Å
359D95.3Very high94.1Very high103 Ų103108.8 Ų108.855%0.55152%0.515SS*.Hα-helixtrans-63.3-41.3176.7-65.9-24.5000111.3Q355 R356 I362 L363Q355-D359 VanDerWaalsContact O-CG 3.28Å; Q355-D359 PolarHBondContact O-N 3.31Å; R356-D359 PolarHBondContact O-N 3.45Å; D359-I362 PolarHBondContact O-N 2.73Å; D359-L363 WeakPolarHBondContact O-CB 3.45Å; D359-L363 PolarHBondContact O-N 3.17Å
360E95.4Very high94Very high116 Ų116107.5 Ų107.554%0.54252%0.515SS..Hα-helixtrans-64.2-41.4175-171.4175.7-170.500111.7R356 I357 Q358 I362 L363 L364R356-E360 WeakPolarHBondContact O-CB 3.5Å; R356-E360 PolarHBondContact O-N 2.87Å; I357-E360 PolarHBondContact O-N 2.98Å; Q358-E360 VanDerWaalsContact C-N 3.34Å; E360-I362 VanDerWaalsContact C-N 3.31Å; E360-I362 PolarHBondContact O-N 2.97Å; E360-L363 PolarHBondContact O-N 3.4Å; E360-L364 HydrophobicContact CG-CD1 4.16Å; E360-L364 HydrophobicContact CG-CG 4.49Å; E360-L364 WeakPolarHBondContact O-CB 3.26Å; E360-L364 VanDerWaalsContact O-CG 3.31Å; E360-L364 WeakPolarHBondContact O-CG 3.45Å; E360-L364 PolarHBondContact O-N 2.89Å
361I93Very high93.8Very high73 Ų73105.7 Ų105.737%0.37451%0.512SS..Hα-helixtrans-61-41.4173.8-71.4165.4000110.8I357 Q358 R365I357-I361 HydrophobicContact CG2-CD1 3.9Å; I357-I361 HydrophobicContact CG2-CG1 4.45Å; I357-I361 WeakPolarHBondContact O-CB 3.38Å; I357-I361 VanDerWaalsContact O-CG1 3.22Å; I357-I361 WeakPolarHBondContact O-CG1 3.39Å; I357-I361 PolarHBondContact O-N 3.41Å; Q358-I361 PolarHBondContact O-N 2.83Å; I361-R365 HydrophobicContact CG2-CG 4.48Å; I361-R365 WeakPolarHBondContact O-CB 3.31Å; I361-R365 VanDerWaalsContact O-CG 3.23Å; I361-R365 WeakPolarHBondContact O-CG 3.36Å; I361-R365 PolarHBondContact O-N 3.49Å
362I95.5Very high93.7Very high107 Ų107105.5 Ų105.555%0.54951%0.511SS..Hα-helixtrans-65-43.9178-68.8164.9000110.5Q358 D359 E360 R365 S366Q358-I362 VanDerWaalsContact O-CG1 3.32Å; Q358-I362 WeakPolarHBondContact O-CG1 3.47Å; Q358-I362 PolarHBondContact O-N 3.37Å; D359-I362 PolarHBondContact O-N 2.73Å; E360-I362 VanDerWaalsContact C-N 3.31Å; E360-I362 PolarHBondContact O-N 2.97Å; I362-R365 PolarHBondContact O-N 2.91Å; I362-S366 PolarHBondContact O-N 3.41Å; I362-S366 PolarHBondContact O-OG 3.46Å
363L95.3Very high93.5Very high110 Ų110104.5 Ų104.558%0.57651%0.511SS*.Hα-helixtrans-63-45.9177.2-176.270.4000112D359 E360 R365 S366 Q367D359-L363 WeakPolarHBondContact O-CB 3.45Å; D359-L363 PolarHBondContact O-N 3.17Å; E360-L363 PolarHBondContact O-N 3.4Å; L363-R365 VanDerWaalsContact C-N 3.31Å; L363-R365 PolarHBondContact O-N 2.64Å; L363-S366 PolarHBondContact O-N 2.95Å; L363-S366 PolarHBondContact O-OG 3.33Å; L363-Q367 WeakPolarHBondContact O-CB 3.22Å; L363-Q367 PolarHBondContact O-N 2.91Å
364L93.6Very high93.4Very high94 Ų94104.1 Ų104.149%0.49252%0.517SS..Hα-helixtrans-63.6-38.5177.6-72.5172.5000111.4E360 Q368E360-L364 HydrophobicContact CG-CD1 4.16Å; E360-L364 HydrophobicContact CG-CG 4.49Å; E360-L364 WeakPolarHBondContact O-CB 3.26Å; E360-L364 VanDerWaalsContact O-CG 3.31Å; E360-L364 WeakPolarHBondContact O-CG 3.45Å; E360-L364 PolarHBondContact O-N 2.89Å; L364-Q368 VanDerWaalsContact O-CB 3.28Å; L364-Q368 WeakPolarHBondContact O-CB 3.49Å; L364-Q368 PolarHBondContact O-N 2.98Å
365R93.6Very high93.2Very high176 Ų176103.9 Ų103.966%0.66452%0.518SS*.Hα-helixtrans-65.7-42.1175-77.2176.2179.2-172.71.5112.3I361 I362 L363 Q368 Q369I361-R365 HydrophobicContact CG2-CG 4.48Å; I361-R365 WeakPolarHBondContact O-CB 3.31Å; I361-R365 VanDerWaalsContact O-CG 3.23Å; I361-R365 WeakPolarHBondContact O-CG 3.36Å; I361-R365 PolarHBondContact O-N 3.49Å; I362-R365 PolarHBondContact O-N 2.91Å; L363-R365 VanDerWaalsContact C-N 3.31Å; L363-R365 PolarHBondContact O-N 2.64Å; R365-Q368 PolarHBondContact O-N 3.21Å; R365-Q369 WeakPolarHBondContact O-CB 3.23Å; R365-Q369 PolarHBondContact O-N 2.99Å
366S92.5Very high93.1Very high65 Ų65104.7 Ų104.746%0.45552%0.516SS..Hα-helixtrans-67.6-39.6178.267.40000111.6I362 L363 Q369 S370I362-S366 PolarHBondContact O-N 3.41Å; I362-S366 PolarHBondContact O-OG 3.46Å; L363-S366 PolarHBondContact O-N 2.95Å; L363-S366 PolarHBondContact O-OG 3.33Å; S366-Q369 PolarHBondContact O-N 2.92Å; S366-S370 PolarHBondContact O-N 3.37Å; S366-S370 PolarHBondContact O-OG 2.95Å
367Q93.3Very high92.9Very high120 Ų12099 Ų9956%0.56150%0.503SS*.Hα-helixtrans-65.5-39.8174.1-172.7178.17.100112.4L363 Q369 S370 S371L363-Q367 WeakPolarHBondContact O-CB 3.22Å; L363-Q367 PolarHBondContact O-N 2.91Å; Q367-Q369 VanDerWaalsContact C-N 3.34Å; Q367-S370 PolarHBondContact O-N 3.41Å; Q367-S370 PolarHBondContact O-OG 3.18Å; Q367-S371 WeakPolarHBondContact O-CB 3.37Å; Q367-S371 PolarHBondContact O-N 3.47Å
368Q91.7Very high92.9Very high141 Ų14196.6 Ų96.666%0.65950%0.498SS*.Hα-helixtrans-63.4-42.6174.2-175.9177.75.600111L364 R365 S371 H372L364-Q368 VanDerWaalsContact O-CB 3.28Å; L364-Q368 WeakPolarHBondContact O-CB 3.49Å; L364-Q368 PolarHBondContact O-N 2.98Å; R365-Q368 PolarHBondContact O-N 3.21Å; Q368-S371 PolarHBondContact O-N 3.39Å; Q368-H372 VanDerWaalsContact O-CB 3.31Å; Q368-H372 WeakPolarHBondContact O-CB 3.3Å; Q368-H372 PolarHBondContact O-N 3.38Å
369Q92.6Very high92.7Very high109 Ų10996.4 Ų96.451%0.50950%0.5SS..Hα-helixtrans-63.4-46.2177.8-173.762.236.400111.4R365 S366 Q367 S371 H372 D373R365-Q369 WeakPolarHBondContact O-CB 3.23Å; R365-Q369 PolarHBondContact O-N 2.99Å; S366-Q369 PolarHBondContact O-N 2.92Å; Q367-Q369 VanDerWaalsContact C-N 3.34Å; Q369-S371 PolarHBondContact O-N 3.25Å; Q369-H372 PolarHBondContact O-N 3.01Å; Q369-D373 PolarHBondContact NE2-OD1 3.48Å; Q369-D373 PolarHBondContact NE2-OD2 3.45Å; Q369-D373 WeakPolarHBondContact O-CB 3.32Å; Q369-D373 PolarHBondContact O-N 2.93Å
370S91.4Very high92.7Very high57 Ų5798.2 Ų98.240%0.39950%0.499SS..Hα-helixtrans-63.2-43.6177.766.60000111.9S366 Q367 H372 D373 D374S366-S370 PolarHBondContact O-N 3.37Å; S366-S370 PolarHBondContact O-OG 2.95Å; Q367-S370 PolarHBondContact O-N 3.41Å; Q367-S370 PolarHBondContact O-OG 3.18Å; S370-H372 VanDerWaalsContact C-N 3.3Å; S370-H372 PolarHBondContact O-N 2.75Å; S370-D373 PolarHBondContact O-N 2.91Å; S370-D374 WeakPolarHBondContact O-CB 3.32Å; S370-D374 VanDerWaalsContact O-CG 3.25Å; S370-D374 PolarHBondContact O-N 3.15Å
371S89.3Confident92.7Very high65 Ų6598.2 Ų98.246%0.45550%0.499SS..Hα-helixtrans-62.3-37.7176.1178.40000112.4Q367 Q368 Q369 S375Q367-S371 WeakPolarHBondContact O-CB 3.37Å; Q367-S371 PolarHBondContact O-N 3.47Å; Q368-S371 PolarHBondContact O-N 3.39Å; Q369-S371 PolarHBondContact O-N 3.25Å; S371-S375 VanDerWaalsContact O-CB 3.31Å; S371-S375 WeakPolarHBondContact O-CB 3.31Å; S371-S375 PolarHBondContact O-N 3Å; S371-S375 PolarHBondContact O-OG 3.28Å
372H90.6Very high92.6Very high110 Ų11099.9 Ų99.951%0.50951%0.508SS..Hα-helixtrans-69.1-40.4176.2-172.3-79.9000111.7Q368 Q369 S370 S375 R376Q368-H372 VanDerWaalsContact O-CB 3.31Å; Q368-H372 WeakPolarHBondContact O-CB 3.3Å; Q368-H372 PolarHBondContact O-N 3.38Å; Q369-H372 PolarHBondContact O-N 3.01Å; S370-H372 VanDerWaalsContact C-N 3.3Å; S370-H372 PolarHBondContact O-N 2.75Å; H372-S375 PolarHBondContact O-N 2.74Å; H372-R376 VanDerWaalsContact O-CB 3.25Å; H372-R376 WeakPolarHBondContact O-CB 3.4Å; H372-R376 PolarHBondContact O-N 2.89Å
373D91.9Very high92.6Very high75 Ų75100.9 Ų100.940%0.40151%0.51SS..Hα-helixtrans-67.7-40.3176.8-71.5-26.5000111.6Q369 S370 R376 S377Q369-D373 PolarHBondContact NE2-OD1 3.48Å; Q369-D373 PolarHBondContact NE2-OD2 3.45Å; Q369-D373 WeakPolarHBondContact O-CB 3.32Å; Q369-D373 PolarHBondContact O-N 2.93Å; S370-D373 PolarHBondContact O-N 2.91Å; D373-R376 PolarHBondContact O-N 2.99Å; D373-S377 WeakPolarHBondContact O-CB 3.27Å; D373-S377 PolarHBondContact O-N 3.46Å
374D91.8Very high92.5Very high106 Ų10698.9 Ų98.957%0.56750%0.5SS*.Hα-helixtrans-60.7-49172.2-71.4-21.7000110.8S370 R376 S377 A378S370-D374 WeakPolarHBondContact O-CB 3.32Å; S370-D374 VanDerWaalsContact O-CG 3.25Å; S370-D374 PolarHBondContact O-N 3.15Å; D374-R376 VanDerWaalsContact C-N 3.32Å; D374-R376 PolarHBondContact O-N 2.96Å; D374-S377 PolarHBondContact O-N 3.44Å; D374-S377 PolarHBondContact O-OG 2.63Å; D374-A378 PolarHBondContact O-N 2.94Å
375S90.1Very high92.6Very high63 Ų63100.5 Ų100.544%0.44150%0.503SS..Hα-helixtrans-60.3-41.7177.2-60.40000111.7S371 H372 A378 L379S371-S375 VanDerWaalsContact O-CB 3.31Å; S371-S375 WeakPolarHBondContact O-CB 3.31Å; S371-S375 PolarHBondContact O-N 3Å; S371-S375 PolarHBondContact O-OG 3.28Å; H372-S375 PolarHBondContact O-N 2.74Å; S375-A378 PolarHBondContact O-N 3.45Å; S375-L379 WeakPolarHBondContact O-CB 3.48Å; S375-L379 WeakPolarHBondContact O-CG 3.4Å; S375-L379 PolarHBondContact O-N 2.77Å
376R93.3Very high92.5Very high131 Ų13197.4 Ų97.449%0.49450%0.499SS..Hα-helixtrans-66.3-38.7177-173.9175.4-174.5148.45.9111.9H372 D373 D374 R380H372-R376 VanDerWaalsContact O-CB 3.25Å; H372-R376 WeakPolarHBondContact O-CB 3.4Å; H372-R376 PolarHBondContact O-N 2.89Å; D373-R376 PolarHBondContact O-N 2.99Å; D374-R376 VanDerWaalsContact C-N 3.32Å; D374-R376 PolarHBondContact O-N 2.96Å; R376-R380 WeakPolarHBondContact O-CG 3.45Å; R376-R380 PolarHBondContact O-N 3.38Å
377S92.4Very high92.7Very high54 Ų54100.2 Ų100.238%0.37850%0.5SS..Hα-helixtrans-65.9-41.3175.880.80000111.4D373 D374 R380 Q381D373-S377 WeakPolarHBondContact O-CB 3.27Å; D373-S377 PolarHBondContact O-N 3.46Å; D374-S377 PolarHBondContact O-N 3.44Å; D374-S377 PolarHBondContact O-OG 2.63Å; S377-R380 PolarHBondContact O-N 3.04Å; S377-Q381 WeakPolarHBondContact O-CG 3.39Å; S377-Q381 PolarHBondContact O-N 3.35Å
378A92.8Very high92.8Very high45 Ų45100.3 Ų100.337%0.37250%0.498SS..Hα-helixtrans-65-43.417600000111.7D374 S375 Q381 L382D374-A378 PolarHBondContact O-N 2.94Å; S375-A378 PolarHBondContact O-N 3.45Å; A378-Q381 PolarHBondContact O-N 3.03Å; A378-L382 WeakPolarHBondContact O-CG 3.3Å; A378-L382 PolarHBondContact O-N 2.92Å
379L92.1Very high92.8Very high104 Ų10497.3 Ų97.355%0.54549%0.49SS..Hα-helixtrans-59.6-46.3174.5-75.9172.6000111.7S375 Q381 L382 E383S375-L379 WeakPolarHBondContact O-CB 3.48Å; S375-L379 WeakPolarHBondContact O-CG 3.4Å; S375-L379 PolarHBondContact O-N 2.77Å; L379-Q381 VanDerWaalsContact C-N 3.33Å; L379-Q381 PolarHBondContact O-N 3.44Å; L379-L382 PolarHBondContact O-N 3.37Å; L379-L382 VanDerWaalsContact O-N 3.15Å; L379-E383 WeakPolarHBondContact O-CG 3.49Å; L379-E383 PolarHBondContact O-N 3.22Å
380R95.4Very high92.9Very high142 Ų14295 Ų9554%0.53648%0.483SS..Hα-helixtrans-59.1-42.2175.2-78.8179.3173.7172.9-1.4112.6R376 S377 L382 E383 D384R376-R380 WeakPolarHBondContact O-CG 3.45Å; R376-R380 PolarHBondContact O-N 3.38Å; S377-R380 PolarHBondContact O-N 3.04Å; R380-L382 VanDerWaalsContact C-N 3.32Å; R380-L382 PolarHBondContact O-N 3.28Å; R380-E383 PolarHBondContact O-N 2.88Å; R380-D384 WeakPolarHBondContact O-CB 3.3Å; R380-D384 PolarHBondContact O-N 3.42Å
381Q94.5Very high93.1Very high116 Ų11697 Ų9754%0.54249%0.487SS..Hα-helixtrans-64.3-37.7176.6-71.8177.817.200112.3S377 A378 L379 K385S377-Q381 WeakPolarHBondContact O-CG 3.39Å; S377-Q381 PolarHBondContact O-N 3.35Å; A378-Q381 PolarHBondContact O-N 3.03Å; L379-Q381 VanDerWaalsContact C-N 3.33Å; L379-Q381 PolarHBondContact O-N 3.44Å; Q381-K385 WeakPolarHBondContact O-CB 3.4Å; Q381-K385 VanDerWaalsContact O-CG 3.27Å; Q381-K385 WeakPolarHBondContact O-CG 3.49Å; Q381-K385 PolarHBondContact O-N 2.89Å
382L91.7Very high93.3Very high108 Ų10899.1 Ų99.157%0.56549%0.489SS*.Hα-helixtrans-69.6-41.1175.6-71.8174.7000111.7A378 L379 R380 K385 L386A378-L382 WeakPolarHBondContact O-CG 3.3Å; A378-L382 PolarHBondContact O-N 2.92Å; L379-L382 PolarHBondContact O-N 3.37Å; L379-L382 VanDerWaalsContact O-N 3.15Å; R380-L382 VanDerWaalsContact C-N 3.32Å; R380-L382 PolarHBondContact O-N 3.28Å; L382-K385 PolarHBondContact O-N 2.95Å; L382-L386 VanDerWaalsContact O-CB 3.32Å; L382-L386 WeakPolarHBondContact O-CB 3.48Å; L382-L386 PolarHBondContact O-N 2.89Å
383E94.1Very high93.4Very high127 Ų12796.3 Ų96.359%0.59349%0.485SS*.Hα-helixtrans-60.8-45.1173.5-74.9173177.200111.6L379 R380 K385 L386 R387L379-E383 WeakPolarHBondContact O-CG 3.49Å; L379-E383 PolarHBondContact O-N 3.22Å; R380-E383 PolarHBondContact O-N 2.88Å; E383-K385 PolarHBondContact O-N 3.41Å; E383-L386 PolarHBondContact O-N 3.44Å; E383-R387 WeakPolarHBondContact O-CB 3.44Å; E383-R387 PolarHBondContact O-N 3.2Å
384D94.2Very high93.6Very high68 Ų6897.6 Ų97.636%0.36449%0.492SS..Hα-helixtrans-65.1-39177-82.7-30.7000112.1R380 R387 K388R380-D384 WeakPolarHBondContact O-CB 3.3Å; R380-D384 PolarHBondContact O-N 3.42Å; D384-R387 IonicContact OD1-CZ 2.9Å; D384-R387 VanDerWaalsContact OD1-CZ 3.32Å; D384-R387 IonicContact OD1-NH1 2.77Å; D384-R387 PolarHBondContact OD1-NH1 2.88Å; D384-R387 IonicContact OD1-NH2 2.66Å; D384-R387 PolarHBondContact OD1-NH2 3.26Å; D384-K388 WeakPolarHBondContact O-CG 3.17Å; D384-K388 PolarHBondContact O-N 3.33Å
385K95.3Very high93.8Very high129 Ų12997.8 Ų97.856%0.56149%0.491SS*.Hα-helixtrans-63.8-45.6173.5-78174.4-177.2177.20110.9Q381 L382 E383 R387 K388 T389Q381-K385 WeakPolarHBondContact O-CB 3.4Å; Q381-K385 VanDerWaalsContact O-CG 3.27Å; Q381-K385 WeakPolarHBondContact O-CG 3.49Å; Q381-K385 PolarHBondContact O-N 2.89Å; L382-K385 PolarHBondContact O-N 2.95Å; E383-K385 PolarHBondContact O-N 3.41Å; K385-R387 VanDerWaalsContact C-N 3.35Å; K385-R387 PolarHBondContact O-N 2.84Å; K385-K388 PolarHBondContact O-N 3.39Å; K385-T389 WeakPolarHBondContact O-CG2 3.47Å; K385-T389 PolarHBondContact O-N 3.43Å; K385-T389 PolarHBondContact O-OG1 3.19Å
386L92.2Very high93.9Very high111 Ų111102.3 Ų102.358%0.58150%0.499SS*.Hα-helixtrans-59.6-48178-171.4151.2000110.2L382 E383 K388 T389 T390L382-L386 VanDerWaalsContact O-CB 3.32Å; L382-L386 WeakPolarHBondContact O-CB 3.48Å; L382-L386 PolarHBondContact O-N 2.89Å; E383-L386 PolarHBondContact O-N 3.44Å; L386-K388 PolarHBondContact O-N 2.9Å; L386-T389 WeakPolarHBondContact CA-OG1 3.45Å; L386-T389 PolarHBondContact O-N 2.91Å; L386-T389 PolarHBondContact O-OG1 3.39Å; L386-T390 HydrophobicContact CD2-CG2 3.92Å; L386-T390 WeakPolarHBondContact O-CG2 3.48Å; L386-T390 PolarHBondContact O-N 2.92Å; L386-T390 PolarHBondContact O-OG1 3.49Å; L386-T390 VanDerWaalsContact O-OG1 3.12Å
387R96.4Very high94Very high124 Ų124100.4 Ų100.447%0.46850%0.496SS..Hα-helixtrans-56.8-46.5177.2-168.4-177.370.3-120.7-7.4112.1E383 D384 K385 T390 E391E383-R387 WeakPolarHBondContact O-CB 3.44Å; E383-R387 PolarHBondContact O-N 3.2Å; D384-R387 IonicContact OD1-CZ 2.9Å; D384-R387 VanDerWaalsContact OD1-CZ 3.32Å; D384-R387 IonicContact OD1-NH1 2.77Å; D384-R387 PolarHBondContact OD1-NH1 2.88Å; D384-R387 IonicContact OD1-NH2 2.66Å; D384-R387 PolarHBondContact OD1-NH2 3.26Å; K385-R387 VanDerWaalsContact C-N 3.35Å; K385-R387 PolarHBondContact O-N 2.84Å; R387-T390 WeakPolarHBondContact CA-OG1 3.5Å; R387-T390 PolarHBondContact O-N 3.25Å; R387-T390 PolarHBondContact O-OG1 2.98Å; R387-E391 WeakPolarHBondContact CG-OE1 3.29Å; R387-E391 IonicContact NE-OE1 3.92Å; R387-E391 WeakPolarHBondContact O-CB 3.47Å; R387-E391 VanDerWaalsContact O-CG 3.28Å; R387-E391 WeakPolarHBondContact O-CG 3.42Å; R387-E391 PolarHBondContact O-N 2.86Å
388K95.8Very high94.1Very high121 Ų121100.6 Ų100.653%0.52650%0.497SS..Hα-helixtrans-61.7-45.3176.5-72.7175.6-178.6-177.30112.1D384 K385 L386 T390 E391 E392D384-K388 WeakPolarHBondContact O-CG 3.17Å; D384-K388 PolarHBondContact O-N 3.33Å; K385-K388 PolarHBondContact O-N 3.39Å; L386-K388 PolarHBondContact O-N 2.9Å; K388-T390 VanDerWaalsContact C-N 3.32Å; K388-T390 PolarHBondContact O-N 2.93Å; K388-E391 PolarHBondContact O-N 3.25Å; K388-E392 WeakPolarHBondContact O-CG 3.32Å; K388-E392 PolarHBondContact O-N 2.89Å
389T91.9Very high94.2Very high79 Ų79103.7 Ų103.749%0.48550%0.503SS..Hα-helixtrans-66.1-34.2179.153.30000112.8K385 L386 A393K385-T389 WeakPolarHBondContact O-CG2 3.47Å; K385-T389 PolarHBondContact O-N 3.43Å; K385-T389 PolarHBondContact O-OG1 3.19Å; L386-T389 WeakPolarHBondContact CA-OG1 3.45Å; L386-T389 PolarHBondContact O-N 2.91Å; L386-T389 PolarHBondContact O-OG1 3.39Å; T389-A393 WeakPolarHBondContact O-CB 3.42Å; T389-A393 PolarHBondContact O-N 2.85Å
390T93.3Very high94.2Very high60 Ų60106.7 Ų106.737%0.36851%0.508SS..Hα-helixtrans-70.3-42.7174.951.30000111.2L386 R387 K388 E392 A393 D394L386-T390 HydrophobicContact CD2-CG2 3.92Å; L386-T390 WeakPolarHBondContact O-CG2 3.48Å; L386-T390 PolarHBondContact O-N 2.92Å; L386-T390 PolarHBondContact O-OG1 3.49Å; L386-T390 VanDerWaalsContact O-OG1 3.12Å; R387-T390 WeakPolarHBondContact CA-OG1 3.5Å; R387-T390 PolarHBondContact O-N 3.25Å; R387-T390 PolarHBondContact O-OG1 2.98Å; K388-T390 VanDerWaalsContact C-N 3.32Å; K388-T390 PolarHBondContact O-N 2.93Å; T390-E392 VanDerWaalsContact C-N 3.33Å; T390-E392 PolarHBondContact O-N 3.46Å; T390-A393 PolarHBondContact O-N 3.5Å; T390-D394 WeakPolarHBondContact O-CB 3.32Å; T390-D394 VanDerWaalsContact O-CG 3.23Å; T390-D394 PolarHBondContact O-N 2.97Å
391E95.4Very high94.1Very high100 Ų100106.9 Ų106.947%0.46751%0.508SS..Hα-helixtrans-60.1-42.7175-73.2167.5-172.300111.5R387 K388 M395R387-E391 WeakPolarHBondContact CG-OE1 3.29Å; R387-E391 IonicContact NE-OE1 3.92Å; R387-E391 WeakPolarHBondContact O-CB 3.47Å; R387-E391 VanDerWaalsContact O-CG 3.28Å; R387-E391 WeakPolarHBondContact O-CG 3.42Å; R387-E391 PolarHBondContact O-N 2.86Å; K388-E391 PolarHBondContact O-N 3.25Å; E391-M395 WeakPolarHBondContact O-CB 3.41Å; E391-M395 WeakPolarHBondContact O-CG 3.26Å; E391-M395 PolarHBondContact O-N 3.06Å
392E94.4Very high94.1Very high108 Ų108107 Ų10751%0.50551%0.509SS..Hα-helixtrans-63.8-44.4174.9-73.9174.4-172.500112K388 T390 M395 Y396K388-E392 WeakPolarHBondContact O-CG 3.32Å; K388-E392 PolarHBondContact O-N 2.89Å; T390-E392 VanDerWaalsContact C-N 3.33Å; T390-E392 PolarHBondContact O-N 3.46Å; E392-M395 WeakPolarHBondContact O-CB 3.42Å; E392-M395 PolarHBondContact O-N 3.1Å; E392-Y396 HydrophobicContact CB-CE2 4.46Å; E392-Y396 WeakPolarHBondContact O-CD2 3.5Å; E392-Y396 PolarHBondContact O-N 3.25Å
393A93.1Very high94.1Very high52 Ų52106 Ų10643%0.4351%0.507SS..Hα-helixtrans-61.3-46.3177.100000111.8T389 T390 M395 Y396 E397T389-A393 WeakPolarHBondContact O-CB 3.42Å; T389-A393 PolarHBondContact O-N 2.85Å; T390-A393 PolarHBondContact O-N 3.5Å; A393-M395 VanDerWaalsContact C-N 3.31Å; A393-M395 PolarHBondContact O-N 3.45Å; A393-Y396 PolarHBondContact O-N 3.35Å; A393-E397 WeakPolarHBondContact O-CB 3.32Å; A393-E397 PolarHBondContact O-N 3.46Å
394D95.1Very high94Very high102 Ų102101.7 Ų101.755%0.54549%0.491SS..Hα-helixtrans-61.2-40.4177.1-70.9-18.3000111.2T390 E397 S398T390-D394 WeakPolarHBondContact O-CB 3.32Å; T390-D394 VanDerWaalsContact O-CG 3.23Å; T390-D394 PolarHBondContact O-N 2.97Å; D394-E397 PolarHBondContact O-N 3.34Å; D394-S398 WeakPolarHBondContact O-CB 3.41Å; D394-S398 PolarHBondContact O-N 3.48Å
395M95.6Very high93.9Very high109 Ų109105.1 Ų105.154%0.53750%0.503SS..Hα-helixtrans-61.8-45.2174-81.9-177.135.400112.4E391 E392 A393 E397 S398 K399E391-M395 WeakPolarHBondContact O-CB 3.41Å; E391-M395 WeakPolarHBondContact O-CG 3.26Å; E391-M395 PolarHBondContact O-N 3.06Å; E392-M395 WeakPolarHBondContact O-CB 3.42Å; E392-M395 PolarHBondContact O-N 3.1Å; A393-M395 VanDerWaalsContact C-N 3.31Å; A393-M395 PolarHBondContact O-N 3.45Å; M395-E397 VanDerWaalsContact C-N 3.34Å; M395-S398 PolarHBondContact O-N 3.48Å; M395-K399 WeakPolarHBondContact O-CG 3.48Å; M395-K399 PolarHBondContact O-N 2.88Å
396Y93Very high93.7Very high159 Ų159103.1 Ų103.162%0.62450%0.502SS*.Hα-helixtrans-65.8-38.3177-73.8-60.1000111.8E392 A393 K399 Y400E392-Y396 HydrophobicContact CB-CE2 4.46Å; E392-Y396 WeakPolarHBondContact O-CD2 3.5Å; E392-Y396 PolarHBondContact O-N 3.25Å; A393-Y396 PolarHBondContact O-N 3.35Å; Y396-K399 PolarHBondContact O-N 3.2Å; Y396-Y400 WeakPolarHBondContact O-CB 3.45Å; Y396-Y400 PolarHBondContact O-N 3.41Å
397E95Very high93.5Very high90 Ų90100.4 Ų100.442%0.42149%0.487SS..Hα-helixtrans-65.2-42.5176-163.2-174.8157.700111.4A393 D394 M395 K399 Y400 R401A393-E397 WeakPolarHBondContact O-CB 3.32Å; A393-E397 PolarHBondContact O-N 3.46Å; D394-E397 PolarHBondContact O-N 3.34Å; M395-E397 VanDerWaalsContact C-N 3.34Å; E397-K399 PolarHBondContact O-N 2.94Å; E397-Y400 PolarHBondContact O-N 2.94Å; E397-R401 WeakPolarHBondContact O-CG 3.43Å; E397-R401 PolarHBondContact O-N 3.35Å; E397-R401 IonicContact OE1-CZ 2.91Å; E397-R401 IonicContact OE1-NE 3.62Å; E397-R401 PolarHBondContact OE1-NE 3.23Å; E397-R401 IonicContact OE1-NH2 2.64Å; E397-R401 PolarHBondContact OE1-NH2 2.94Å
398S94.9Very high93.1Very high59 Ų5997.6 Ų97.641%0.41348%0.482SS..Hα-helixtrans-60.4-47.2174.9-169.20000111.5D394 M395 Y400 R401 E402D394-S398 WeakPolarHBondContact O-CB 3.41Å; D394-S398 PolarHBondContact O-N 3.48Å; M395-S398 PolarHBondContact O-N 3.48Å; S398-Y400 VanDerWaalsContact C-N 3.33Å; S398-Y400 PolarHBondContact O-N 3.44Å; S398-R401 PolarHBondContact O-N 2.92Å; S398-E402 WeakPolarHBondContact O-CG 3.44Å; S398-E402 PolarHBondContact O-N 2.9Å
399K94.8Very high92.8Very high110 Ų11097.7 Ų97.748%0.47849%0.487SS..Hα-helixtrans-60.5-42.1175.8-73.1176.1-178.6177.50111.8M395 Y396 E397 E402 V403M395-K399 WeakPolarHBondContact O-CG 3.48Å; M395-K399 PolarHBondContact O-N 2.88Å; Y396-K399 PolarHBondContact O-N 3.2Å; E397-K399 PolarHBondContact O-N 2.94Å; K399-E402 PolarHBondContact O-N 3.35Å; K399-V403 WeakPolarHBondContact O-CG2 3.41Å; K399-V403 PolarHBondContact O-N 3.31Å
400Y91.8Very high92.6Very high167 Ų16797.2 Ų97.266%0.65548%0.481SS*.Hα-helixtrans-62.6-43.8176.1178.1-97.8000111.6Y396 E397 S398 E402 V403 S404Y396-Y400 WeakPolarHBondContact O-CB 3.45Å; Y396-Y400 PolarHBondContact O-N 3.41Å; E397-Y400 PolarHBondContact O-N 2.94Å; S398-Y400 VanDerWaalsContact C-N 3.33Å; S398-Y400 PolarHBondContact O-N 3.44Å; Y400-E402 VanDerWaalsContact C-N 3.32Å; Y400-E402 PolarHBondContact O-N 2.93Å; Y400-V403 PolarHBondContact O-N 3.37Å; Y400-S404 WeakPolarHBondContact O-CB 3.2Å; Y400-S404 PolarHBondContact O-N 2.97Å
401R94.4Very high92.3Very high145 Ų14595.7 Ų95.755%0.54747%0.47SS..Hα-helixtrans-60.7-40.8175.2-72.6179.1-168.3-154.19.3111.8E397 S398 K405E397-R401 WeakPolarHBondContact O-CG 3.43Å; E397-R401 PolarHBondContact O-N 3.35Å; E397-R401 IonicContact OE1-CZ 2.91Å; E397-R401 IonicContact OE1-NE 3.62Å; E397-R401 PolarHBondContact OE1-NE 3.23Å; E397-R401 IonicContact OE1-NH2 2.64Å; E397-R401 PolarHBondContact OE1-NH2 2.94Å; S398-R401 PolarHBondContact O-N 2.92Å; R401-K405 VanDerWaalsContact O-CG 3.28Å; R401-K405 WeakPolarHBondContact O-CG 3.4Å; R401-K405 PolarHBondContact O-N 3.48Å
402E94.3Very high91.9Very high118 Ų11894.9 Ų94.955%0.55147%0.468SS*.Hα-helixtrans-63.3-48.6175.5-73.5172.3-166.500112S398 K399 Y400 S404 K405 T406S398-E402 WeakPolarHBondContact O-CG 3.44Å; S398-E402 PolarHBondContact O-N 2.9Å; K399-E402 PolarHBondContact O-N 3.35Å; Y400-E402 VanDerWaalsContact C-N 3.32Å; Y400-E402 PolarHBondContact O-N 2.93Å; E402-S404 PolarHBondContact O-N 3.36Å; E402-K405 WeakPolarHBondContact O-CB 3.24Å; E402-K405 PolarHBondContact O-N 2.85Å; E402-T406 PolarHBondContact O-N 3.43Å; E402-T406 VanDerWaalsContact O-N 3.07Å
403V91.9Very high91.5Very high88 Ų8892.1 Ų92.153%0.53346%0.461SS..Hα-helixtrans-64.9-38.6178173.80000111.6K399 Y400 K405 T406 L407K399-V403 WeakPolarHBondContact O-CG2 3.41Å; K399-V403 PolarHBondContact O-N 3.31Å; Y400-V403 PolarHBondContact O-N 3.37Å; V403-K405 VanDerWaalsContact C-N 3.34Å; V403-K405 PolarHBondContact O-N 3.42Å; V403-T406 WeakPolarHBondContact CA-OG1 3.23Å; V403-T406 PolarHBondContact O-N 3.17Å; V403-T406 PolarHBondContact O-OG1 3.35Å; V403-L407 VanDerWaalsContact O-CB 3.25Å; V403-L407 WeakPolarHBondContact O-CB 3.46Å; V403-L407 PolarHBondContact O-N 2.88Å
404S90.4Very high91.1Very high36 Ų3689.8 Ų89.825%0.25244%0.441SS..Hα-helixtrans-62.5-42.4175.1-170.10000111.2Y400 E402 T406 L407 D408Y400-S404 WeakPolarHBondContact O-CB 3.2Å; Y400-S404 PolarHBondContact O-N 2.97Å; E402-S404 PolarHBondContact O-N 3.36Å; S404-T406 PolarHBondContact O-N 3.43Å; S404-L407 PolarHBondContact O-N 2.94Å; S404-D408 WeakPolarHBondContact O-CB 3.47Å; S404-D408 PolarHBondContact O-N 3.29Å
405K92.8Very high90.6Very high141 Ų14187.9 Ų87.961%0.61343%0.429SS*.Hα-helixtrans-61.4-43.9176.1-74.8171.3-177.31780111.9R401 E402 V403 L407 D408 L409R401-K405 VanDerWaalsContact O-CG 3.28Å; R401-K405 WeakPolarHBondContact O-CG 3.4Å; R401-K405 PolarHBondContact O-N 3.48Å; E402-K405 WeakPolarHBondContact O-CB 3.24Å; E402-K405 PolarHBondContact O-N 2.85Å; V403-K405 VanDerWaalsContact C-N 3.34Å; V403-K405 PolarHBondContact O-N 3.42Å; K405-L407 VanDerWaalsContact C-N 3.34Å; K405-D408 PolarHBondContact O-N 2.94Å; K405-L409 WeakPolarHBondContact O-CG 3.32Å; K405-L409 PolarHBondContact O-N 3.29Å
406T90.3Very high90.1Very high87 Ų8790 Ų9053%0.53444%0.435SS..Hα-helixtrans-67.3-37.7178.257.90000111.7E402 V403 S404 L409 L410E402-T406 PolarHBondContact O-N 3.43Å; E402-T406 VanDerWaalsContact O-N 3.07Å; V403-T406 WeakPolarHBondContact CA-OG1 3.23Å; V403-T406 PolarHBondContact O-N 3.17Å; V403-T406 PolarHBondContact O-OG1 3.35Å; S404-T406 PolarHBondContact O-N 3.43Å; T406-L409 PolarHBondContact O-N 3.22Å; T406-L410 PolarHBondContact O-N 3.33Å
407L88.6Confident89.7Confident53 Ų5386.3 Ų86.328%0.27743%0.426SS..Hα-helixtrans-65.3-41.1175.7-168.165000112.1V403 S404 K405 L410 K411 D440 L443V403-L407 VanDerWaalsContact O-CB 3.25Å; V403-L407 WeakPolarHBondContact O-CB 3.46Å; V403-L407 PolarHBondContact O-N 2.88Å; S404-L407 PolarHBondContact O-N 2.94Å; K405-L407 VanDerWaalsContact C-N 3.34Å; L407-L410 WeakPolarHBondContact O-CB 3.26Å; L407-L410 PolarHBondContact O-N 2.9Å; L407-K411 WeakPolarHBondContact O-CG 3.18Å; L407-K411 PolarHBondContact O-N 3.45Å; L407-D440 WeakPolarHBondContact CD2-OD1 3.3Å; L407-D440 WeakPolarHBondContact CG-OD1 3.33Å; L407-L443 HydrophobicContact CD1-CD2 4.28Å
408D88.4Confident89.1Confident66 Ų6683 Ų8335%0.35341%0.41SS..Hα-helixtrans-67.7-37.5176.3-68.9-27.1000112.1S404 K405 L410 K411 N412S404-D408 WeakPolarHBondContact O-CB 3.47Å; S404-D408 PolarHBondContact O-N 3.29Å; K405-D408 PolarHBondContact O-N 2.94Å; D408-L410 VanDerWaalsContact C-N 3.3Å; D408-L410 PolarHBondContact O-N 2.94Å; D408-K411 PolarHBondContact O-N 2.89Å; D408-K411 IonicContact OD1-NZ 2.65Å; D408-K411 PolarHBondContact OD1-NZ 3.09Å; D408-N412 WeakPolarHBondContact O-CB 3.4Å; D408-N412 VanDerWaalsContact O-CG 3.24Å; D408-N412 PolarHBondContact O-N 3.46Å; D408-N412 PolarHBondContact O-ND2 3.33Å
409L89.8Confident88.5Confident123 Ų12386.4 Ų86.464%0.64442%0.418SS*.Hα-helixtrans-61.4-40.3170.3-72.3172000111.6K405 T406 N412 S413K405-L409 WeakPolarHBondContact O-CG 3.32Å; K405-L409 PolarHBondContact O-N 3.29Å; T406-L409 PolarHBondContact O-N 3.22Å; L409-N412 PolarHBondContact O-N 3.02Å; L409-S413 PolarHBondContact O-N 2.9Å
410L87.9Confident87.9Confident69 Ų6989.9 Ų89.936%0.36143%0.433SS..Hα-helixtrans-67-44.4176.8-174.865000112T406 L407 D408 N412 S413 V414 L443 F447T406-L410 PolarHBondContact O-N 3.33Å; L407-L410 WeakPolarHBondContact O-CB 3.26Å; L407-L410 PolarHBondContact O-N 2.9Å; D408-L410 VanDerWaalsContact C-N 3.3Å; D408-L410 PolarHBondContact O-N 2.94Å; L410-N412 VanDerWaalsContact C-N 3.28Å; L410-N412 PolarHBondContact O-N 2.9Å; L410-S413 WeakPolarHBondContact CA-OG 3.35Å; L410-S413 PolarHBondContact O-N 3.32Å; L410-S413 PolarHBondContact O-OG 3.18Å; L410-V414 HydrophobicContact CD1-CG2 4.27Å; L410-V414 HydrophobicContact CG-CG2 4.35Å; L410-V414 WeakPolarHBondContact O-CB 3.46Å; L410-V414 VanDerWaalsContact O-CG2 3.25Å; L410-V414 WeakPolarHBondContact O-CG2 3.5Å; L410-V414 PolarHBondContact O-N 3.1Å; L410-L443 HydrophobicContact CD2-CD2 4.07Å; L410-F447 HydrophobicContact CD1-CZ 4.26Å; L410-F447 HydrophobicContact CD2-CZ 4.35Å; L410-F447 HydrophobicContact CG-CZ 4.38Å
411K85.5Confident87.3Confident28 Ų2883.7 Ų83.712%0.12241%0.41CS..Hα-helixtrans-55.1-47.1173.8-72.6170.9-173.5159.30111.1L407 D408 S413 V414 E415 V438 D440 L443L407-K411 WeakPolarHBondContact O-CG 3.18Å; L407-K411 PolarHBondContact O-N 3.45Å; D408-K411 PolarHBondContact O-N 2.89Å; D408-K411 IonicContact OD1-NZ 2.65Å; D408-K411 PolarHBondContact OD1-NZ 3.09Å; K411-S413 PolarHBondContact O-N 2.91Å; K411-V414 PolarHBondContact O-N 2.63Å; K411-E415 WeakPolarHBondContact O-CB 3.35Å; K411-E415 PolarHBondContact O-N 2.88Å; K411-V438 HydrophobicContact CB-CG1 4.39Å; K411-V438 HydrophobicContact CG-CG1 4.26Å; K411-D440 VanDerWaalsContact CE-CG 3.4Å; K411-D440 WeakPolarHBondContact CE-OD1 3.41Å; K411-D440 IonicContact NZ-OD1 3.74Å; K411-D440 PolarHBondContact NZ-OD1 3.47Å; K411-D440 IonicContact NZ-OD2 2.69Å; K411-D440 PolarHBondContact NZ-OD2 3.13Å; K411-L443 HydrophobicContact CG-CD1 4.21Å
412N87.1Confident86.3Confident83 Ų8383 Ų8344%0.44442%0.418SS..Hα-helixtrans-64.8-38.3179.1-72.1-33.4000112.3D408 L409 L410 K416D408-N412 WeakPolarHBondContact O-CB 3.4Å; D408-N412 VanDerWaalsContact O-CG 3.24Å; D408-N412 PolarHBondContact O-N 3.46Å; D408-N412 PolarHBondContact O-ND2 3.33Å; L409-N412 PolarHBondContact O-N 3.02Å; L410-N412 VanDerWaalsContact C-N 3.28Å; L410-N412 PolarHBondContact O-N 2.9Å; N412-K416 VanDerWaalsContact O-CG 3.26Å; N412-K416 WeakPolarHBondContact O-CG 3.48Å; N412-K416 PolarHBondContact O-N 3.37Å; N412-K416 VanDerWaalsContact O-N 3.08Å
413S86.3Confident85.2Confident50 Ų5077.9 Ų77.935%0.3540%0.395SS..Hα-helixtrans-71.1-40.217871.90000111.9L409 L410 K411 K416 L417L409-S413 PolarHBondContact O-N 2.9Å; L410-S413 WeakPolarHBondContact CA-OG 3.35Å; L410-S413 PolarHBondContact O-N 3.32Å; L410-S413 PolarHBondContact O-OG 3.18Å; K411-S413 PolarHBondContact O-N 2.91Å; S413-K416 PolarHBondContact O-N 2.9Å; S413-L417 WeakPolarHBondContact O-CB 3.44Å; S413-L417 PolarHBondContact O-N 3.4Å
414V85.9Confident84.1Confident2 Ų278.3 Ų78.31%0.01239%0.394CS..Hα-helixtrans-63.4-44.2174.2172.30000110.8L410 K411 K416 L417 F418 L443 F447 I450L410-V414 HydrophobicContact CD1-CG2 4.27Å; L410-V414 HydrophobicContact CG-CG2 4.35Å; L410-V414 WeakPolarHBondContact O-CB 3.46Å; L410-V414 VanDerWaalsContact O-CG2 3.25Å; L410-V414 WeakPolarHBondContact O-CG2 3.5Å; L410-V414 PolarHBondContact O-N 3.1Å; K411-V414 PolarHBondContact O-N 2.63Å; V414-K416 VanDerWaalsContact C-N 3.33Å; V414-K416 PolarHBondContact O-N 3.27Å; V414-L417 PolarHBondContact O-N 2.92Å; V414-F418 VanDerWaalsContact O-CB 3.29Å; V414-F418 WeakPolarHBondContact O-CB 3.49Å; V414-F418 PolarHBondContact O-N 2.96Å; V414-L443 HydrophobicContact CB-CD1 4.27Å; V414-L443 HydrophobicContact CG1-CD1 4.27Å; V414-L443 HydrophobicContact CG2-CD1 4.17Å; V414-F447 HydrophobicContact CG2-CD1 4.37Å; V414-F447 HydrophobicContact CG2-CE1 3.46Å; V414-F447 VanDerWaalsContact CG2-CE1 3.46Å; V414-F447 HydrophobicContact CG2-CE2 4.32Å; V414-F447 HydrophobicContact CG2-CZ 3.43Å; V414-F447 VanDerWaalsContact CG2-CZ 3.43Å; V414-I450 HydrophobicContact CG1-CD1 3.88Å
415E83.6Confident82.8Confident62 Ų6278.3 Ų78.329%0.2940%0.397SS..Hα-helixtrans-61.2-42.4176.2-167.9-173.9161.300111.5K411 F418 K419 V438K411-E415 WeakPolarHBondContact O-CB 3.35Å; K411-E415 PolarHBondContact O-N 2.88Å; E415-F418 PolarHBondContact O-N 3.24Å; E415-K419 WeakPolarHBondContact O-CG 3.21Å; E415-K419 PolarHBondContact O-N 3.45Å; E415-K419 WeakPolarHBondContact OE1-CE 3.41Å; E415-K419 IonicContact OE1-NZ 3.31Å; E415-K419 PolarHBondContact OE1-NZ 3.4Å; E415-V438 HydrophobicContact CB-CG2 4.04Å; E415-V438 HydrophobicContact CG-CG2 4.35Å
416K85.1Confident81.6Confident154 Ų15475.8 Ų75.867%0.6739%0.393SS*.Hα-helixtrans-62.5-44.1174.3-74.6173.2-176.4179.90112N412 S413 V414 K419 K420N412-K416 VanDerWaalsContact O-CG 3.26Å; N412-K416 WeakPolarHBondContact O-CG 3.48Å; N412-K416 PolarHBondContact O-N 3.37Å; N412-K416 VanDerWaalsContact O-N 3.08Å; S413-K416 PolarHBondContact O-N 2.9Å; V414-K416 VanDerWaalsContact C-N 3.33Å; V414-K416 PolarHBondContact O-N 3.27Å; K416-K419 PolarHBondContact O-N 3.5Å; K416-K420 WeakPolarHBondContact O-CB 3.47Å; K416-K420 PolarHBondContact O-N 2.83Å
417L84.3Confident80.4Confident82 Ų8277.5 Ų77.543%0.42939%0.393SS..Hα-helixtrans-63.1-45.3177.3-106.2159.9000111.6S413 V414 K419 K420 I421 I450S413-L417 WeakPolarHBondContact O-CB 3.44Å; S413-L417 PolarHBondContact O-N 3.4Å; V414-L417 PolarHBondContact O-N 2.92Å; L417-K419 VanDerWaalsContact C-N 3.31Å; L417-K419 PolarHBondContact O-N 2.97Å; L417-K420 PolarHBondContact O-N 3.07Å; L417-K420 VanDerWaalsContact O-N 3.11Å; L417-I421 HydrophobicContact CD2-CD1 3.47Å; L417-I421 VanDerWaalsContact CD2-CD1 3.47Å; L417-I421 HydrophobicContact CD2-CG1 4.19Å; L417-I421 WeakPolarHBondContact O-CG1 3.41Å; L417-I421 PolarHBondContact O-N 2.9Å; L417-I450 HydrophobicContact CB-CD1 4.5Å
418F82.4Confident79.1Confident19 Ų1975.2 Ų75.28%0.08338%0.381CS..Hα-helixtrans-59.2-42.9178.6-167.4-88.6000111.7V414 E415 N422 C423 A425 I428 Y446 I449 I450V414-F418 VanDerWaalsContact O-CB 3.29Å; V414-F418 WeakPolarHBondContact O-CB 3.49Å; V414-F418 PolarHBondContact O-N 2.96Å; E415-F418 PolarHBondContact O-N 3.24Å; F418-N422 PolarHBondContact O-N 3.32Å; F418-C423 HydrophobicContact CD1-CB 4.18Å; F418-C423 HydrophobicContact CD2-CB 3.59Å; F418-C423 HydrophobicContact CE1-CB 3.91Å; F418-C423 VanDerWaalsContact CE1-O 3.31Å; F418-C423 WeakPolarHBondContact CE1-O 3.26Å; F418-C423 HydrophobicContact CE2-CB 3.31Å; F418-C423 HydrophobicContact CG-CB 4.02Å; F418-C423 HydrophobicContact CZ-CB 3.48Å; F418-C423 VanDerWaalsContact CZ-CB 3.48Å; F418-C423 PolarHBondContact O-N 3.34Å; F418-A425 HydrophobicContact CE1-CB 3.95Å; F418-A425 HydrophobicContact CZ-CB 4.28Å; F418-I428 HydrophobicContact CE2-CD1 3.73Å; F418-I428 HydrophobicContact CZ-CD1 3.81Å; F418-Y446 HydrophobicContact CD1-CE1 4.34Å; F418-Y446 AromaticContact CD2-CD1 3.57Å; F418-Y446 HydrophobicContact CD2-CD1 3.57Å; F418-Y446 HydrophobicContact CD2-CE1 4.09Å; F418-Y446 HydrophobicContact CE1-CE1 4.33Å; F418-Y446 AromaticContact CE2-CD1 3.72Å; F418-Y446 HydrophobicContact CE2-CD1 3.72Å; F418-Y446 HydrophobicContact CE2-CE1 4.05Å; F418-Y446 HydrophobicContact CG-CD1 4.03Å; F418-Y446 HydrophobicContact CG-CE1 4.23Å; F418-Y446 HydrophobicContact CZ-CD1 4.32Å; F418-Y446 HydrophobicContact CZ-CE1 4.18Å; F418-I449 HydrophobicContact CE2-CB 4.47Å; F418-I449 HydrophobicContact CE2-CG2 3.91Å; F418-I450 HydrophobicContact CB-CD1 4.27Å; F418-I450 HydrophobicContact CD2-CD1 4.19Å; F418-I450 HydrophobicContact CD2-CG1 3.89Å
419K82.6Confident77.9Confident132 Ų13276 Ų7657%0.57439%0.385SS*.Hα-helixtrans-66.7-40.6173.6-71.1176.2-173.3169.50112.2E415 K416 L417 N422E415-K419 WeakPolarHBondContact O-CG 3.21Å; E415-K419 PolarHBondContact O-N 3.45Å; E415-K419 WeakPolarHBondContact OE1-CE 3.41Å; E415-K419 IonicContact OE1-NZ 3.31Å; E415-K419 PolarHBondContact OE1-NZ 3.4Å; K416-K419 PolarHBondContact O-N 3.5Å; L417-K419 VanDerWaalsContact C-N 3.31Å; L417-K419 PolarHBondContact O-N 2.97Å; K419-N422 PolarHBondContact O-N 3.3Å; K419-N422 PolarHBondContact O-OD1 2.93Å
420K83.1Confident76.6Confident182 Ų18276.2 Ų76.279%0.79139%0.391SS*.Hα-helixtrans-70-34.9-177.1-169.7175.9-179.4-177.40113.4K416 L417 N422K416-K420 WeakPolarHBondContact O-CB 3.47Å; K416-K420 PolarHBondContact O-N 2.83Å; L417-K420 PolarHBondContact O-N 3.07Å; L417-K420 VanDerWaalsContact O-N 3.11Å; K420-N422 VanDerWaalsContact C-N 3.28Å
421I77.9Confident75.2Confident37 Ų3780 Ų8019%0.1941%0.407CS..THydrogen-bonded Turntrans-84-5.3-179.2-61.3170.1000111.5L417 C423 I450 K453 L457L417-I421 HydrophobicContact CD2-CD1 3.47Å; L417-I421 VanDerWaalsContact CD2-CD1 3.47Å; L417-I421 HydrophobicContact CD2-CG1 4.19Å; L417-I421 WeakPolarHBondContact O-CG1 3.41Å; L417-I421 PolarHBondContact O-N 2.9Å; I421-C423 VanDerWaalsContact C-N 3.33Å; I421-C423 PolarHBondContact O-N 3.01Å; I421-I450 HydrophobicContact CD1-CG2 4.06Å; I421-K453 HydrophobicContact CG2-CB 4.28Å; I421-K453 HydrophobicContact CG2-CG 3.69Å; I421-L457 HydrophobicContact CG2-CD1 3.89Å
422N74.6Confident73.9Confident130 Ų13082 Ų8270%0.69542%0.418SS*.THydrogen-bonded Turntrans51.650.7-172.8-69.9-21.5000111.6F418 K419 K420F418-N422 PolarHBondContact O-N 3.32Å; K419-N422 PolarHBondContact O-N 3.3Å; K419-N422 PolarHBondContact O-OD1 2.93Å; K420-N422 VanDerWaalsContact C-N 3.28Å
423C71.1Confident72.2Confident11 Ų1180.2 Ų80.27%0.07442%0.42CS..  trans-71.8138.9174.9-68.80000110.8F418 I421 A425 I449F418-C423 HydrophobicContact CD1-CB 4.18Å; F418-C423 HydrophobicContact CD2-CB 3.59Å; F418-C423 HydrophobicContact CE1-CB 3.91Å; F418-C423 VanDerWaalsContact CE1-O 3.31Å; F418-C423 WeakPolarHBondContact CE1-O 3.26Å; F418-C423 HydrophobicContact CE2-CB 3.31Å; F418-C423 HydrophobicContact CG-CB 4.02Å; F418-C423 HydrophobicContact CZ-CB 3.48Å; F418-C423 VanDerWaalsContact CZ-CB 3.48Å; F418-C423 PolarHBondContact O-N 3.34Å; I421-C423 VanDerWaalsContact C-N 3.33Å; I421-C423 PolarHBondContact O-N 3.01Å; C423-A425 PolarHBondContact O-N 3.18Å; C423-I449 HydrophobicContact CB-CG2 4.17Å
424D68.2Low70.4Confident97 Ų9786.9 Ų86.952%0.51945%0.446SS..  trans-68.9105179.6-73.6-38.1000111.3T426D424-T426 PolarHBondContact O-N 3.31Å
425A64Low68.9Low37 Ų3791.2 Ų91.231%0.30647%0.472SS..THydrogen-bonded Turntrans-67.7-15176.200000113.4F418 C423 K427 I428 L429F418-A425 HydrophobicContact CE1-CB 3.95Å; F418-A425 HydrophobicContact CZ-CB 4.28Å; C423-A425 PolarHBondContact O-N 3.18Å; A425-K427 VanDerWaalsContact C-N 3.34Å; A425-K427 PolarHBondContact O-N 3.33Å; A425-I428 PolarHBondContact O-N 2.92Å; A425-I428 VanDerWaalsContact O-N 3.15Å; A425-L429 HydrophobicContact CB-CD1 4.04Å; A425-L429 WeakPolarHBondContact O-CB 3.24Å; A425-L429 PolarHBondContact O-N 3.49Å
426T67.2Low67.8Low88 Ų8890.6 Ų90.654%0.5448%0.482SS..Hα-helixtrans-61.3-38.7-173.551.60000112.6D424 I428 V430D424-T426 PolarHBondContact O-N 3.31Å; T426-I428 VanDerWaalsContact C-N 3.33Å; T426-I428 PolarHBondContact O-N 2.92Å; T426-V430 VanDerWaalsContact O-CG2 3.23Å; T426-V430 WeakPolarHBondContact O-CG2 3.49Å; T426-V430 PolarHBondContact O-N 3.49Å; T426-V430 VanDerWaalsContact O-N 3.13Å
427K64.5Low67Low122 Ų12290.7 Ų90.753%0.5348%0.483SS..Hα-helixtrans-66.9-33.6177.4-69.6180-178171.70112.8A425 Q431A425-K427 VanDerWaalsContact C-N 3.34Å; A425-K427 PolarHBondContact O-N 3.33Å; K427-Q431 WeakPolarHBondContact O-CG 3.2Å; K427-Q431 PolarHBondContact O-N 3.41Å
428I62.3Low66.3Low5 Ų587.6 Ų87.63%0.02647%0.467CS..Hα-helixtrans-77.2-44.5179-54-179000110F418 A425 T426 V430 Q431 L432 Y446 I449F418-I428 HydrophobicContact CE2-CD1 3.73Å; F418-I428 HydrophobicContact CZ-CD1 3.81Å; A425-I428 PolarHBondContact O-N 2.92Å; A425-I428 VanDerWaalsContact O-N 3.15Å; T426-I428 VanDerWaalsContact C-N 3.33Å; T426-I428 PolarHBondContact O-N 2.92Å; I428-V430 VanDerWaalsContact C-N 3.31Å; I428-V430 PolarHBondContact O-N 3.18Å; I428-Q431 PolarHBondContact O-N 2.94Å; I428-L432 HydrophobicContact CG2-CD1 3.53Å; I428-L432 WeakPolarHBondContact O-CB 3.19Å; I428-L432 PolarHBondContact O-N 2.91Å; I428-Y446 HydrophobicContact CD1-CD1 3.45Å; I428-Y446 VanDerWaalsContact CD1-CD1 3.45Å; I428-Y446 HydrophobicContact CD1-CD2 4.31Å; I428-Y446 HydrophobicContact CD1-CE1 3.4Å; I428-Y446 HydrophobicContact CD1-CE2 4.25Å; I428-Y446 HydrophobicContact CD1-CG 3.92Å; I428-Y446 HydrophobicContact CG2-CE2 3.94Å; I428-I449 HydrophobicContact CD1-CD1 3.41Å; I428-I449 VanDerWaalsContact CD1-CD1 3.41Å; I428-I449 HydrophobicContact CG1-CD1 3.12Å
429L62.1Low65.9Low83 Ų8389.4 Ų89.444%0.43548%0.48SS..Hα-helixtrans-60.3-37.4178.8-84156.9000112.8A425 G433A425-L429 HydrophobicContact CB-CD1 4.04Å; A425-L429 WeakPolarHBondContact O-CB 3.24Å; A425-L429 PolarHBondContact O-N 3.49Å; L429-G433 PolarHBondContact O-N 3.23Å
430V63.3Low65.4Low127 Ų12787.1 Ų87.177%0.7747%0.474SS*.Hα-helixtrans-72-32.8177.1172.40000112.3T426 I428T426-V430 VanDerWaalsContact O-CG2 3.23Å; T426-V430 WeakPolarHBondContact O-CG2 3.49Å; T426-V430 PolarHBondContact O-N 3.49Å; T426-V430 VanDerWaalsContact O-N 3.13Å; I428-V430 VanDerWaalsContact C-N 3.31Å; I428-V430 PolarHBondContact O-N 3.18Å
431Q58.9Low65.1Low149 Ų14985.1 Ų85.170%0.69647%0.471SS*.Hα-helixtrans-88.8-25.8-176.9-73.6-175.5-21.200114.3K427 I428K427-Q431 WeakPolarHBondContact O-CG 3.2Å; K427-Q431 PolarHBondContact O-N 3.41Å; I428-Q431 PolarHBondContact O-N 2.94Å
432L58.3Low65Low69 Ų6983.5 Ų83.536%0.36146%0.463SS..Hα-helixtrans-118.6-4.1-168.4-78.2146.8000115.6I428 N442I428-L432 HydrophobicContact CG2-CD1 3.53Å; I428-L432 WeakPolarHBondContact O-CB 3.19Å; I428-L432 PolarHBondContact O-N 2.91Å; L432-N442 HydrophobicContact CD1-CB 3.86Å; L432-N442 HydrophobicContact CD2-CB 4.1Å
433G51.3Low65.3Low47 Ų4778 Ų7849%0.48543%0.433SS..  trans70.3109.1172.400000114.5L429 T435L429-G433 PolarHBondContact O-N 3.23Å; G433-T435 VanDerWaalsContact C-N 3.28Å; G433-T435 PolarHBondContact O-N 2.87Å
434E48.8Very low65.8Low189 Ų18981.4 Ų81.488%0.88346%0.455SS*.SBendtrans51.2-26.1161.8-68.8-173.8162.500122G436E434-G436 PolarHBondContact O-N 2.85Å
435T54.3Low66.4Low93 Ų9380.3 Ų80.357%0.57145%0.447SS*.  trans-97.791.4178.663.80000110.2G433 K437G433-T435 VanDerWaalsContact C-N 3.28Å; G433-T435 PolarHBondContact O-N 2.87Å; T435-K437 PolarHBondContact O-N 3.14Å
436G59.7Low67.2Low49 Ų4979.1 Ų79.151%0.50543%0.434SS..  trans-64.327.4172.900000115.3E434E434-G436 PolarHBondContact O-N 2.85Å
437K67.3Low68Low157 Ų15779.2 Ų79.268%0.68343%0.427SS*.SBendtrans-101.6143.6176.5-66.7-174.7178.7-179.40109.8T435 T439 N442T435-K437 PolarHBondContact O-N 3.14Å; K437-T439 PolarHBondContact O-N 3.47Å; K437-N442 PolarHBondContact O-ND2 2.85Å
438V70.3Confident68.9Low16 Ų1676 Ų7610%0.09742%0.423CS..  trans-75.5115.6175.1-172.40000109.2K411 E415 N442 L443 Y446K411-V438 HydrophobicContact CB-CG1 4.39Å; K411-V438 HydrophobicContact CG-CG1 4.26Å; E415-V438 HydrophobicContact CB-CG2 4.04Å; E415-V438 HydrophobicContact CG-CG2 4.35Å; V438-N442 VanDerWaalsContact CA-OD1 3.31Å; V438-N442 WeakPolarHBondContact CA-OD1 3.47Å; V438-L443 HydrophobicContact CG1-CB 4.46Å; V438-L443 HydrophobicContact CG1-CD1 3.32Å; V438-L443 HydrophobicContact CG1-CG 4.49Å; V438-Y446 HydrophobicContact CB-CD2 4.46Å; V438-Y446 HydrophobicContact CB-CE2 4.38Å; V438-Y446 HydrophobicContact CG1-CD2 4.09Å; V438-Y446 HydrophobicContact CG1-CE2 4.47Å; V438-Y446 HydrophobicContact CG2-CD1 4.24Å; V438-Y446 HydrophobicContact CG2-CD2 4.07Å; V438-Y446 HydrophobicContact CG2-CE1 4.09Å; V438-Y446 HydrophobicContact CG2-CE2 3.93Å; V438-Y446 HydrophobicContact CG2-CG 4.24Å
439T74.4Confident69.8Low58 Ų5877.5 Ų77.536%0.35643%0.431SS..  trans-112.3164.3175.366.50000110.2K437 I441 N442 L443K437-T439 PolarHBondContact O-N 3.47Å; T439-I441 PolarHBondContact O-N 2.88Å; T439-N442 PolarHBondContact N-ND2 2.88Å; T439-N442 PolarHBondContact N-OD1 3.19Å; T439-N442 PolarHBondContact O-N 3.33Å; T439-N442 VanDerWaalsContact O-N 3.08Å; T439-N442 PolarHBondContact O-OD1 3.44Å; T439-N442 PolarHBondContact OG1-ND2 3.47Å; T439-L443 PolarHBondContact O-N 2.86Å
440D71.8Confident70.8Confident83 Ų8374.4 Ų74.444%0.44442%0.415SS..THydrogen-bonded Turntrans-60-31.7-177.2-65.8-46.8000113.7L407 K411L407-D440 WeakPolarHBondContact CD2-OD1 3.3Å; L407-D440 WeakPolarHBondContact CG-OD1 3.33Å; K411-D440 VanDerWaalsContact CE-CG 3.4Å; K411-D440 WeakPolarHBondContact CE-OD1 3.41Å; K411-D440 IonicContact NZ-OD1 3.74Å; K411-D440 PolarHBondContact NZ-OD1 3.47Å; K411-D440 IonicContact NZ-OD2 2.69Å; K411-D440 PolarHBondContact NZ-OD2 3.13Å
441I76.8Confident71.9Confident140 Ų14074.2 Ų74.272%0.71841%0.406SS*.THydrogen-bonded Turntrans-75.9-32.4-179.8-57.3171.2000110.8T439 Q445T439-I441 PolarHBondContact O-N 2.88Å; I441-Q445 PolarHBondContact O-OE1 2.93Å; I441-Q445 VanDerWaalsContact O-OE1 3.07Å
442N76.6Confident73.1Confident4 Ų472.9 Ų72.92%0.02140%0.398CS..THydrogen-bonded Turntrans-95.3-13.4-17575.224.2000114L432 K437 V438 T439 P444 Q445 Y446L432-N442 HydrophobicContact CD1-CB 3.86Å; L432-N442 HydrophobicContact CD2-CB 4.1Å; K437-N442 PolarHBondContact O-ND2 2.85Å; V438-N442 VanDerWaalsContact CA-OD1 3.31Å; V438-N442 WeakPolarHBondContact CA-OD1 3.47Å; T439-N442 PolarHBondContact N-ND2 2.88Å; T439-N442 PolarHBondContact N-OD1 3.19Å; T439-N442 PolarHBondContact O-N 3.33Å; T439-N442 VanDerWaalsContact O-N 3.08Å; T439-N442 PolarHBondContact O-OD1 3.44Å; T439-N442 PolarHBondContact OG1-ND2 3.47Å; N442-P444 VanDerWaalsContact C-CD 3.42Å; N442-P444 VanDerWaalsContact C-N 3.32Å; N442-Q445 PolarHBondContact O-N 3.36Å; N442-Q445 PolarHBondContact O-OE1 3.28Å; N442-Y446 HydrophobicContact CB-CD2 4.27Å; N442-Y446 HydrophobicContact CB-CE2 4.2Å; N442-Y446 VanDerWaalsContact O-CD2 3.31Å; N442-Y446 WeakPolarHBondContact O-CD2 3.47Å; N442-Y446 PolarHBondContact O-N 2.75Å; N442-Y446 VanDerWaalsContact O-N 3.08Å; N442-Y446 WeakPolarHBondContact OD1-CD2 3.43Å; N442-Y446 WeakPolarHBondContact OD1-CE2 3.43Å
443L80.3Confident74.3Confident15 Ų1572.8 Ų72.88%0.07939%0.394CS..Hα-helixtrans-51.4-42.2-179.8-164.674.2000113L407 L410 K411 V414 V438 T439 Y446 F447L407-L443 HydrophobicContact CD1-CD2 4.28Å; L410-L443 HydrophobicContact CD2-CD2 4.07Å; K411-L443 HydrophobicContact CG-CD1 4.21Å; V414-L443 HydrophobicContact CB-CD1 4.27Å; V414-L443 HydrophobicContact CG1-CD1 4.27Å; V414-L443 HydrophobicContact CG2-CD1 4.17Å; V438-L443 HydrophobicContact CG1-CB 4.46Å; V438-L443 HydrophobicContact CG1-CD1 3.32Å; V438-L443 HydrophobicContact CG1-CG 4.49Å; T439-L443 PolarHBondContact O-N 2.86Å; L443-Y446 PolarHBondContact O-N 2.94Å; L443-F447 HydrophobicContact CD1-CE2 4.37Å; L443-F447 HydrophobicContact CD2-CE2 4Å; L443-F447 HydrophobicContact CG-CD2 4.2Å; L443-F447 HydrophobicContact CG-CE2 3.74Å; L443-F447 VanDerWaalsContact O-CD2 3.25Å; L443-F447 WeakPolarHBondContact O-CD2 3.34Å; L443-F447 PolarHBondContact O-N 3.47Å
444P82.4Confident75.8Confident82 Ų8273 Ų7353%0.53239%0.386SS..Hα-helixtrans-64.7-38.4176.1-21.535.1000113.6N442 F447 A448N442-P444 VanDerWaalsContact C-CD 3.42Å; N442-P444 VanDerWaalsContact C-N 3.32Å; P444-F447 PolarHBondContact O-N 3.26Å; P444-A448 PolarHBondContact O-N 3.44Å
445Q79.4Confident77.5Confident74 Ų7467.1 Ų67.135%0.34636%0.361SS..Hα-helixtrans-67.4-37.8176.2-67.691.3-16.200111.6I441 N442 F447 A448 I449I441-Q445 PolarHBondContact O-OE1 2.93Å; I441-Q445 VanDerWaalsContact O-OE1 3.07Å; N442-Q445 PolarHBondContact O-N 3.36Å; N442-Q445 PolarHBondContact O-OE1 3.28Å; Q445-F447 VanDerWaalsContact C-N 3.34Å; Q445-A448 PolarHBondContact O-N 2.86Å; Q445-I449 WeakPolarHBondContact O-CG1 3.22Å; Q445-I449 PolarHBondContact O-N 3.36Å
446Y81.1Confident78.9Confident12 Ų1266.2 Ų66.25%0.04735%0.352CS..Hα-helixtrans-60.6-43.2172.9-83.9-82000111.4F418 I428 V438 N442 L443 I449 I450F418-Y446 HydrophobicContact CD1-CE1 4.34Å; F418-Y446 AromaticContact CD2-CD1 3.57Å; F418-Y446 HydrophobicContact CD2-CD1 3.57Å; F418-Y446 HydrophobicContact CD2-CE1 4.09Å; F418-Y446 HydrophobicContact CE1-CE1 4.33Å; F418-Y446 AromaticContact CE2-CD1 3.72Å; F418-Y446 HydrophobicContact CE2-CD1 3.72Å; F418-Y446 HydrophobicContact CE2-CE1 4.05Å; F418-Y446 HydrophobicContact CG-CD1 4.03Å; F418-Y446 HydrophobicContact CG-CE1 4.23Å; F418-Y446 HydrophobicContact CZ-CD1 4.32Å; F418-Y446 HydrophobicContact CZ-CE1 4.18Å; I428-Y446 HydrophobicContact CD1-CD1 3.45Å; I428-Y446 VanDerWaalsContact CD1-CD1 3.45Å; I428-Y446 HydrophobicContact CD1-CD2 4.31Å; I428-Y446 HydrophobicContact CD1-CE1 3.4Å; I428-Y446 HydrophobicContact CD1-CE2 4.25Å; I428-Y446 HydrophobicContact CD1-CG 3.92Å; I428-Y446 HydrophobicContact CG2-CE2 3.94Å; V438-Y446 HydrophobicContact CB-CD2 4.46Å; V438-Y446 HydrophobicContact CB-CE2 4.38Å; V438-Y446 HydrophobicContact CG1-CD2 4.09Å; V438-Y446 HydrophobicContact CG1-CE2 4.47Å; V438-Y446 HydrophobicContact CG2-CD1 4.24Å; V438-Y446 HydrophobicContact CG2-CD2 4.07Å; V438-Y446 HydrophobicContact CG2-CE1 4.09Å; V438-Y446 HydrophobicContact CG2-CE2 3.93Å; V438-Y446 HydrophobicContact CG2-CG 4.24Å; N442-Y446 HydrophobicContact CB-CD2 4.27Å; N442-Y446 HydrophobicContact CB-CE2 4.2Å; N442-Y446 VanDerWaalsContact O-CD2 3.31Å; N442-Y446 WeakPolarHBondContact O-CD2 3.47Å; N442-Y446 PolarHBondContact O-N 2.75Å; N442-Y446 VanDerWaalsContact O-N 3.08Å; N442-Y446 WeakPolarHBondContact OD1-CD2 3.43Å; N442-Y446 WeakPolarHBondContact OD1-CE2 3.43Å; L443-Y446 PolarHBondContact O-N 2.94Å; Y446-I449 PolarHBondContact O-N 3.39Å; Y446-I450 VanDerWaalsContact O-CG1 3.3Å; Y446-I450 WeakPolarHBondContact O-CG1 3.18Å; Y446-I450 PolarHBondContact O-N 3.19Å
447F84.4Confident80Confident89 Ų8967.8 Ų67.839%0.3935%0.349SS..Hα-helixtrans-61.6-45.7174.8-78.2-55.2000112.8L410 V414 L443 P444 Q445 I449 I450 E451L410-F447 HydrophobicContact CD1-CZ 4.26Å; L410-F447 HydrophobicContact CD2-CZ 4.35Å; L410-F447 HydrophobicContact CG-CZ 4.38Å; V414-F447 HydrophobicContact CG2-CD1 4.37Å; V414-F447 HydrophobicContact CG2-CE1 3.46Å; V414-F447 VanDerWaalsContact CG2-CE1 3.46Å; V414-F447 HydrophobicContact CG2-CE2 4.32Å; V414-F447 HydrophobicContact CG2-CZ 3.43Å; V414-F447 VanDerWaalsContact CG2-CZ 3.43Å; L443-F447 HydrophobicContact CD1-CE2 4.37Å; L443-F447 HydrophobicContact CD2-CE2 4Å; L443-F447 HydrophobicContact CG-CD2 4.2Å; L443-F447 HydrophobicContact CG-CE2 3.74Å; L443-F447 VanDerWaalsContact O-CD2 3.25Å; L443-F447 WeakPolarHBondContact O-CD2 3.34Å; L443-F447 PolarHBondContact O-N 3.47Å; P444-F447 PolarHBondContact O-N 3.26Å; Q445-F447 VanDerWaalsContact C-N 3.34Å; F447-I449 PolarHBondContact O-N 2.97Å; F447-I450 PolarHBondContact O-N 2.9Å; F447-E451 WeakPolarHBondContact O-CB 3.45Å; F447-E451 PolarHBondContact O-N 2.92Å
448A83.4Confident80.7Confident54 Ų5463.6 Ų63.645%0.44633%0.334SS..Hα-helixtrans-59.8-34.8179.800000112.7P444 Q445 K452P444-A448 PolarHBondContact O-N 3.44Å; Q445-A448 PolarHBondContact O-N 2.86Å; A448-K452 WeakPolarHBondContact O-CB 3.42Å; A448-K452 PolarHBondContact O-N 2.66Å
449I82.1Confident81.2Confident38 Ų3868.4 Ų68.420%0.19536%0.358CS..Hα-helixtrans-76.8-40.8178.5-69.5164.2000111.3F418 C423 I428 Q445 Y446 F447 E451 K452 K453F418-I449 HydrophobicContact CE2-CB 4.47Å; F418-I449 HydrophobicContact CE2-CG2 3.91Å; C423-I449 HydrophobicContact CB-CG2 4.17Å; I428-I449 HydrophobicContact CD1-CD1 3.41Å; I428-I449 VanDerWaalsContact CD1-CD1 3.41Å; I428-I449 HydrophobicContact CG1-CD1 3.12Å; Q445-I449 WeakPolarHBondContact O-CG1 3.22Å; Q445-I449 PolarHBondContact O-N 3.36Å; Y446-I449 PolarHBondContact O-N 3.39Å; F447-I449 PolarHBondContact O-N 2.97Å; I449-E451 VanDerWaalsContact C-N 3.31Å; I449-K452 PolarHBondContact O-N 3.22Å; I449-K453 WeakPolarHBondContact O-CB 3.35Å; I449-K453 PolarHBondContact O-N 3.5Å
450I82.8Confident81.6Confident18 Ų1871 Ų719%0.09237%0.37CS..Hα-helixtrans-60.4-44.8172.7-68.8168.1000110V414 L417 F418 I421 Y446 F447 K453 T454V414-I450 HydrophobicContact CG1-CD1 3.88Å; L417-I450 HydrophobicContact CB-CD1 4.5Å; F418-I450 HydrophobicContact CB-CD1 4.27Å; F418-I450 HydrophobicContact CD2-CD1 4.19Å; F418-I450 HydrophobicContact CD2-CG1 3.89Å; I421-I450 HydrophobicContact CD1-CG2 4.06Å; Y446-I450 VanDerWaalsContact O-CG1 3.3Å; Y446-I450 WeakPolarHBondContact O-CG1 3.18Å; Y446-I450 PolarHBondContact O-N 3.19Å; F447-I450 PolarHBondContact O-N 2.9Å; I450-K453 PolarHBondContact O-N 3.26Å; I450-T454 VanDerWaalsContact O-CB 3.3Å; I450-T454 WeakPolarHBondContact O-CB 3.47Å; I450-T454 PolarHBondContact O-N 3.49Å; I450-T454 PolarHBondContact O-OG1 3.19Å
451E84.9Confident81.8Confident123 Ų12370.5 Ų70.558%0.57536%0.364SS*.Hα-helixtrans-59.4-50.2177.4-175.6-177.9178.600111F447 I449 K453 T454 N455F447-E451 WeakPolarHBondContact O-CB 3.45Å; F447-E451 PolarHBondContact O-N 2.92Å; I449-E451 VanDerWaalsContact C-N 3.31Å; E451-K453 PolarHBondContact O-N 3.42Å; E451-T454 PolarHBondContact O-N 3.34Å; E451-N455 WeakPolarHBondContact O-CB 3.37Å; E451-N455 VanDerWaalsContact O-CG 3.26Å; E451-N455 PolarHBondContact O-N 3.31Å; E451-N455 PolarHBondContact O-ND2 2.88Å
452K85.1Confident81.7Confident121 Ų12165.2 Ų65.253%0.52634%0.339SS..Hα-helixtrans-57.4-47.9176.9-176.1173.1-179.8165.40112A448 I449 T454 N455 D456A448-K452 WeakPolarHBondContact O-CB 3.42Å; A448-K452 PolarHBondContact O-N 2.66Å; I449-K452 PolarHBondContact O-N 3.22Å; K452-T454 VanDerWaalsContact C-N 3.32Å; K452-T454 PolarHBondContact O-N 3.16Å; K452-N455 PolarHBondContact O-N 3.02Å; K452-D456 VanDerWaalsContact O-CG 3.24Å; K452-D456 PolarHBondContact O-N 3.19Å
453K82.5Confident81.6Confident66 Ų6672 Ų7229%0.28737%0.365SS..Hα-helixtrans-66.6-35.9-179.2-166.565.5171.8-1730112I421 I449 I450 E451 D456 L457I421-K453 HydrophobicContact CG2-CB 4.28Å; I421-K453 HydrophobicContact CG2-CG 3.69Å; I449-K453 WeakPolarHBondContact O-CB 3.35Å; I449-K453 PolarHBondContact O-N 3.5Å; I450-K453 PolarHBondContact O-N 3.26Å; E451-K453 PolarHBondContact O-N 3.42Å; K453-D456 PolarHBondContact O-N 3.5Å; K453-L457 WeakPolarHBondContact O-CB 3.49Å; K453-L457 WeakPolarHBondContact O-CG 3.25Å; K453-L457 PolarHBondContact O-N 3.38Å
454T84Confident81.3Confident52 Ų5279.6 Ų79.632%0.31939%0.393SS..Hα-helixtrans-65.6-43.3175.4-54.50000110.4I450 E451 K452 D456 L457 L458I450-T454 VanDerWaalsContact O-CB 3.3Å; I450-T454 WeakPolarHBondContact O-CB 3.47Å; I450-T454 PolarHBondContact O-N 3.49Å; I450-T454 PolarHBondContact O-OG1 3.19Å; E451-T454 PolarHBondContact O-N 3.34Å; K452-T454 VanDerWaalsContact C-N 3.32Å; K452-T454 PolarHBondContact O-N 3.16Å; T454-D456 PolarHBondContact O-N 3.2Å; T454-L457 PolarHBondContact O-N 3.32Å; T454-L458 HydrophobicContact CG2-CD1 4.22Å; T454-L458 WeakPolarHBondContact O-CB 3.49Å; T454-L458 VanDerWaalsContact O-CG 3.3Å; T454-L458 WeakPolarHBondContact O-CG 3.36Å; T454-L458 PolarHBondContact O-N 2.79Å
455N84.8Confident80.9Confident65 Ų6582.1 Ų82.135%0.34839%0.391SS..Hα-helixtrans-62.6-41.3174.9-69.5-19.4000112E451 K452 L458 L459E451-N455 WeakPolarHBondContact O-CB 3.37Å; E451-N455 VanDerWaalsContact O-CG 3.26Å; E451-N455 PolarHBondContact O-N 3.31Å; E451-N455 PolarHBondContact O-ND2 2.88Å; K452-N455 PolarHBondContact O-N 3.02Å; N455-L458 PolarHBondContact O-N 2.86Å; N455-L459 WeakPolarHBondContact O-CB 3.49Å; N455-L459 PolarHBondContact O-N 2.96Å
456D83.9Confident80.5Confident74 Ų7482.5 Ų82.540%0.39640%0.395SS..Hα-helixtrans-63.7-43.5175.6-66-19.5000111.6K452 K453 T454 L459 L460K452-D456 VanDerWaalsContact O-CG 3.24Å; K452-D456 PolarHBondContact O-N 3.19Å; K453-D456 PolarHBondContact O-N 3.5Å; T454-D456 PolarHBondContact O-N 3.2Å; D456-L459 PolarHBondContact O-N 3.33Å; D456-L460 WeakPolarHBondContact O-CG 3.23Å; D456-L460 PolarHBondContact O-N 3.44Å
457L83.1Confident80Confident83 Ų8385.6 Ų85.644%0.43541%0.412SS..Hα-helixtrans-65.1-40.7176.4-75.4173.4000112.2I421 K453 T454 L459 L460 E461I421-L457 HydrophobicContact CG2-CD1 3.89Å; K453-L457 WeakPolarHBondContact O-CB 3.49Å; K453-L457 WeakPolarHBondContact O-CG 3.25Å; K453-L457 PolarHBondContact O-N 3.38Å; T454-L457 PolarHBondContact O-N 3.32Å; L457-L459 VanDerWaalsContact C-N 3.35Å; L457-L460 PolarHBondContact O-N 3.09Å; L457-E461 WeakPolarHBondContact O-CB 3.33Å; L457-E461 PolarHBondContact O-N 3.21Å
458L80.3Confident79.1Confident68 Ų6886.3 Ų86.336%0.35642%0.42SS..Hα-helixtrans-60-47.5173.5-76.2168.5000110.1T454 N455 L460 E461 T462T454-L458 HydrophobicContact CG2-CD1 4.22Å; T454-L458 WeakPolarHBondContact O-CB 3.49Å; T454-L458 VanDerWaalsContact O-CG 3.3Å; T454-L458 WeakPolarHBondContact O-CG 3.36Å; T454-L458 PolarHBondContact O-N 2.79Å; N455-L458 PolarHBondContact O-N 2.86Å; L458-L460 VanDerWaalsContact C-N 3.34Å; L458-L460 PolarHBondContact O-N 2.86Å; L458-E461 WeakPolarHBondContact O-CA 3.34Å; L458-E461 WeakPolarHBondContact O-CB 3.47Å; L458-E461 PolarHBondContact O-N 3.5Å; L458-E461 VanDerWaalsContact O-N 3.07Å; L458-T462 WeakPolarHBondContact O-CG2 3.3Å; L458-T462 PolarHBondContact O-N 2.96Å
459L81.7Confident78Confident118 Ų11889.2 Ų89.262%0.61843%0.426SS*.Hα-helixtrans-57.8-44.7177.6-167.874.3000112N455 D456 L457 E461 T462 Y463N455-L459 WeakPolarHBondContact O-CB 3.49Å; N455-L459 PolarHBondContact O-N 2.96Å; D456-L459 PolarHBondContact O-N 3.33Å; L457-L459 VanDerWaalsContact C-N 3.35Å; L459-E461 VanDerWaalsContact C-N 3.3Å; L459-E461 PolarHBondContact O-N 2.85Å; L459-T462 PolarHBondContact O-N 2.93Å; L459-T462 PolarHBondContact O-OG1 3.26Å; L459-Y463 PolarHBondContact O-N 2.97Å
460L82.1Confident76.8Confident113 Ų11394.6 Ų94.659%0.59245%0.45SS*.Hα-helixtrans-62-37.8175.6-72.1173.2000112.5D456 L457 L458 Y463 R464D456-L460 WeakPolarHBondContact O-CG 3.23Å; D456-L460 PolarHBondContact O-N 3.44Å; L457-L460 PolarHBondContact O-N 3.09Å; L458-L460 VanDerWaalsContact C-N 3.34Å; L458-L460 PolarHBondContact O-N 2.86Å; L460-Y463 PolarHBondContact O-N 3.41Å; L460-R464 WeakPolarHBondContact O-CB 3.33Å; L460-R464 PolarHBondContact O-N 3.47Å
461E77.4Confident75.4Confident71 Ų7197.1 Ų97.133%0.33248%0.481SS..Hα-helixtrans-66.9-41.5175.8-161.9-88.8177.200111.6L457 L458 L459 Y463 R464 R465L457-E461 WeakPolarHBondContact O-CB 3.33Å; L457-E461 PolarHBondContact O-N 3.21Å; L458-E461 WeakPolarHBondContact O-CA 3.34Å; L458-E461 WeakPolarHBondContact O-CB 3.47Å; L458-E461 PolarHBondContact O-N 3.5Å; L458-E461 VanDerWaalsContact O-N 3.07Å; L459-E461 VanDerWaalsContact C-N 3.3Å; L459-E461 PolarHBondContact O-N 2.85Å; E461-Y463 VanDerWaalsContact C-N 3.32Å; E461-Y463 PolarHBondContact O-N 3.49Å; E461-R464 PolarHBondContact O-N 2.82Å; E461-R465 VanDerWaalsContact CD-NE 3.29Å; E461-R465 PolarHBondContact O-N 2.85Å; E461-R465 IonicContact OE1-CZ 3.58Å; E461-R465 IonicContact OE1-NE 3.7Å; E461-R465 PolarHBondContact OE1-NE 3.42Å; E461-R465 IonicContact OE1-NH2 3.44Å; E461-R465 PolarHBondContact OE1-NH2 3.27Å; E461-R465 IonicContact OE2-CZ 3.48Å; E461-R465 IonicContact OE2-NE 3.96Å; E461-R465 PolarHBondContact OE2-NE 3.35Å; E461-R465 IonicContact OE2-NH2 3.51Å
462T73.8Confident73.7Confident30 Ų3094.2 Ų94.218%0.18448%0.477CS..Hα-helixtrans-58.7-45.2173.275.10000111.4L458 L459 R464 R465 I466 P483L458-T462 WeakPolarHBondContact O-CG2 3.3Å; L458-T462 PolarHBondContact O-N 2.96Å; L459-T462 PolarHBondContact O-N 2.93Å; L459-T462 PolarHBondContact O-OG1 3.26Å; T462-R464 VanDerWaalsContact C-N 3.35Å; T462-R464 PolarHBondContact O-N 3.45Å; T462-R465 PolarHBondContact O-N 3.34Å; T462-I466 VanDerWaalsContact O-CG1 3.28Å; T462-I466 WeakPolarHBondContact O-CG1 3.32Å; T462-I466 PolarHBondContact O-N 3Å; T462-P483 HydrophobicContact CG2-CB 3.32Å; T462-P483 HydrophobicContact CG2-CG 3.3Å
463Y74.1Confident71.9Confident145 Ų14598.5 Ų98.557%0.56950%0.499SS*.Hα-helixtrans-65.9-40.1-179.8-171.9-106000111.3L459 L460 E461 I466 L467L459-Y463 PolarHBondContact O-N 2.97Å; L460-Y463 PolarHBondContact O-N 3.41Å; E461-Y463 VanDerWaalsContact C-N 3.32Å; E461-Y463 PolarHBondContact O-N 3.49Å; Y463-I466 PolarHBondContact O-N 3.06Å; Y463-L467 HydrophobicContact CD1-CD1 3.74Å; Y463-L467 HydrophobicContact CD1-CG 4.41Å; Y463-L467 HydrophobicContact CE1-CD1 3.44Å; Y463-L467 VanDerWaalsContact CE1-CD1 3.44Å; Y463-L467 HydrophobicContact CE1-CG 4.13Å; Y463-L467 WeakPolarHBondContact O-CG 3.44Å; Y463-L467 PolarHBondContact O-N 3.44Å
464R75.1Confident70Confident176 Ų17699 Ų9966%0.66452%0.515SS*.Hα-helixtrans-64.3-42.5175.3-172.1166.3179.4170.3-0.4112.4L460 E461 T462 I466 L467 D468L460-R464 WeakPolarHBondContact O-CB 3.33Å; L460-R464 PolarHBondContact O-N 3.47Å; E461-R464 PolarHBondContact O-N 2.82Å; T462-R464 VanDerWaalsContact C-N 3.35Å; T462-R464 PolarHBondContact O-N 3.45Å; R464-I466 VanDerWaalsContact C-N 3.31Å; R464-I466 PolarHBondContact O-N 2.79Å; R464-L467 PolarHBondContact O-N 3.15Å; R464-D468 WeakPolarHBondContact O-CB 3.26Å; R464-D468 VanDerWaalsContact O-CG 3.26Å; R464-D468 PolarHBondContact O-N 3.08Å
465R72.3Confident68.2Low134 Ų134106.2 Ų106.251%0.50655%0.546SS..Hα-helixtrans-62.1-37.9174.2-72.7-168.8-172.9-175.310.4112.5E461 T462 D468 M469E461-R465 VanDerWaalsContact CD-NE 3.29Å; E461-R465 PolarHBondContact O-N 2.85Å; E461-R465 IonicContact OE1-CZ 3.58Å; E461-R465 IonicContact OE1-NE 3.7Å; E461-R465 PolarHBondContact OE1-NE 3.42Å; E461-R465 IonicContact OE1-NH2 3.44Å; E461-R465 PolarHBondContact OE1-NH2 3.27Å; E461-R465 IonicContact OE2-CZ 3.48Å; E461-R465 IonicContact OE2-NE 3.96Å; E461-R465 PolarHBondContact OE2-NE 3.35Å; E461-R465 IonicContact OE2-NH2 3.51Å; T462-R465 PolarHBondContact O-N 3.34Å; R465-D468 PolarHBondContact O-N 3.31Å; R465-M469 VanDerWaalsContact O-CG 3.3Å; R465-M469 WeakPolarHBondContact O-CG 3.23Å; R465-M469 PolarHBondContact O-N 2.88Å
466I71.8Confident66.4Low83 Ų83110.2 Ų110.243%0.42657%0.566SS.*Hα-helixtrans-64.4-44.7175.8-67.7163.8000110.3T462 Y463 R464 M469 E470T462-I466 VanDerWaalsContact O-CG1 3.28Å; T462-I466 WeakPolarHBondContact O-CG1 3.32Å; T462-I466 PolarHBondContact O-N 3Å; Y463-I466 PolarHBondContact O-N 3.06Å; R464-I466 VanDerWaalsContact C-N 3.31Å; R464-I466 PolarHBondContact O-N 2.79Å; I466-M469 WeakPolarHBondContact O-CB 3.19Å; I466-M469 PolarHBondContact O-N 3.34Å; I466-E470 PolarHBondContact O-N 2.73Å
467L71Confident64.4Low76 Ų76112.8 Ų112.840%0.39858%0.584SS.*Hα-helixtrans-64.3-39.7175.6-73170.9000112.9Y463 R464 M469 E470 G471Y463-L467 HydrophobicContact CD1-CD1 3.74Å; Y463-L467 HydrophobicContact CD1-CG 4.41Å; Y463-L467 HydrophobicContact CE1-CD1 3.44Å; Y463-L467 VanDerWaalsContact CE1-CD1 3.44Å; Y463-L467 HydrophobicContact CE1-CG 4.13Å; Y463-L467 WeakPolarHBondContact O-CG 3.44Å; Y463-L467 PolarHBondContact O-N 3.44Å; R464-L467 PolarHBondContact O-N 3.15Å; L467-M469 PolarHBondContact O-N 3.47Å; L467-E470 PolarHBondContact O-N 3.25Å; L467-E470 VanDerWaalsContact O-N 3.15Å; L467-G471 PolarHBondContact O-N 2.83Å
468D65.2Low62.9Low104 Ų104112.7 Ų112.756%0.55659%0.589SS**Hα-helixtrans-66.4-27.5176.3-69.3-24.3000111.5R464 R465R464-D468 WeakPolarHBondContact O-CB 3.26Å; R464-D468 VanDerWaalsContact O-CG 3.26Å; R464-D468 PolarHBondContact O-N 3.08Å; R465-D468 PolarHBondContact O-N 3.31Å
469M59.7Low61.3Low115 Ų115114.7 Ų114.757%0.56761%0.605SS**Hα-helixtrans-73.6-29.6171.5-73.6-178.568.100113.2R465 I466 L467 G471 P478R465-M469 VanDerWaalsContact O-CG 3.3Å; R465-M469 WeakPolarHBondContact O-CG 3.23Å; R465-M469 PolarHBondContact O-N 2.88Å; I466-M469 WeakPolarHBondContact O-CB 3.19Å; I466-M469 PolarHBondContact O-N 3.34Å; L467-M469 PolarHBondContact O-N 3.47Å; M469-G471 VanDerWaalsContact C-N 3.31Å; M469-P478 HydrophobicContact CE-CG 4.43Å
470E56.6Low59.8Low152 Ų152117.6 Ų117.671%0.7161%0.613SS**Hα-helixtrans-74.3-21.9175.4-72.2179166.500112.6I466 L467I466-E470 PolarHBondContact O-N 2.73Å; L467-E470 PolarHBondContact O-N 3.25Å; L467-E470 VanDerWaalsContact O-N 3.15Å
471G53.6Low58.4Low71 Ų71117.6 Ų117.673%0.73261%0.613SS**SBendtrans-88.1-11.7178.900000115.9L467 M469L467-G471 PolarHBondContact O-N 2.83Å; M469-G471 VanDerWaalsContact C-N 3.31Å
472A49.3Very low57Low61 Ų61117.6 Ų117.650%0.50462%0.616SS.*  trans-113.3100.5-178.800000110.6A474A472-A474 PolarHBondContact O-N 3.39Å
473E46.7Very low56Low211 Ų211117.4 Ų117.499%0.98662%0.615SS**  trans-65.766.6164.7-69.5-173.8157.400110.9
474A44.4Very low54.8Low76 Ų76118.5 Ų118.563%0.62862%0.623SS**  trans-116116175.700000110.1A472 I476A472-A474 PolarHBondContact O-N 3.39Å; A474-I476 PolarHBondContact O-N 2.85Å
475E45.9Very low53.6Low205 Ų205118.7 Ų118.796%0.95862%0.624SS**SBendtrans-61.828.6-173.9-79.6-177.8140.100117.1
476I46.9Very low52.1Low149 Ų149114.7 Ų114.776%0.76462%0.624SS**  trans-138.1103.1173.9-50.6175.2000108.9A474 P478A474-I476 PolarHBondContact O-N 2.85Å; I476-P478 WeakPolarHBondContact O-CD 3.38Å
477T42.4Very low50.7Low128 Ų128113.5 Ų113.579%0.78563%0.633SS**  trans-61.1113.4167.941.20000109.4
478P50Low49.3Very low81 Ų81113 Ų11353%0.52664%0.636SS.*  trans-72.1150.7170.731.6-30.7000108.9M469 I476 F480M469-P478 HydrophobicContact CE-CG 4.43Å; I476-P478 WeakPolarHBondContact O-CD 3.38Å; P478-F480 PolarHBondContact O-N 2.78Å
479P48.2Very low48.2Very low109 Ų109112.5 Ų112.571%0.70865%0.646SS**  trans-60.5132.4178.223.7-30.3000109.8L481P479-L481 PolarHBondContact O-N 2.91Å
480F49.6Very low47.5Very low180 Ų180115.2 Ų115.279%0.78966%0.662SS**  trans-59.9101.6176-175.6-95.1000109.8P478P478-F480 PolarHBondContact O-N 2.78Å
481L51.8Low46.7Very low113 Ų113114.3 Ų114.359%0.59266%0.661SS**  trans-84.5112.9168.8-91.7113.4000108.5P479 P483P479-L481 PolarHBondContact O-N 2.91Å; L481-P483 VanDerWaalsContact O-CD 3.27Å; L481-P483 WeakPolarHBondContact O-CD 3.5Å
482N49.7Very low45.9Very low70 Ų70120 Ų12037%0.37467%0.666SS.*  trans-53.1119.8175.6-170.9-10000110F484 W485 G486N482-F484 PolarHBondContact O-N 3.22Å; N482-F484 VanDerWaalsContact O-N 3.13Å; N482-F484 PolarHBondContact OD1-N 3.38Å; N482-W485 WeakPolarHBondContact O-CA 3.32Å; N482-W485 PolarHBondContact O-N 3.05Å; N482-G486 PolarHBondContact O-N 3.07Å
483P51.7Low45.4Very low27 Ų27122.7 Ų122.718%0.17568%0.678CS.*G310 helixtrans-61.6-22.5-177.8-29.641.4000113.9T462 L481 W485 G486T462-P483 HydrophobicContact CG2-CB 3.32Å; T462-P483 HydrophobicContact CG2-CG 3.3Å; L481-P483 VanDerWaalsContact O-CD 3.27Å; L481-P483 WeakPolarHBondContact O-CD 3.5Å; P483-W485 PolarHBondContact O-N 2.95Å; P483-G486 PolarHBondContact O-N 3.41Å
484F50Low45Very low167 Ų167117.8 Ų117.873%0.73266%0.664SS**G310 helixtrans-63.3-18.4170.2-82-84.8000113.9N482N482-F484 PolarHBondContact O-N 3.22Å; N482-F484 VanDerWaalsContact O-N 3.13Å; N482-F484 PolarHBondContact OD1-N 3.38Å
485W48.8Very low44.9Very low180 Ų180122.3 Ų122.368%0.68267%0.673SS**G310 helixtrans-114.512.3-179.9-64.970.7000111.9N482 P483 G487 S488N482-W485 WeakPolarHBondContact O-CA 3.32Å; N482-W485 PolarHBondContact O-N 3.05Å; P483-W485 PolarHBondContact O-N 2.95Å; W485-G487 PolarHBondContact O-N 3.29Å; W485-S488 PolarHBondContact O-N 2.86Å; W485-S488 VanDerWaalsContact O-N 3.12Å; W485-S488 PolarHBondContact O-OG 3.4Å
486G41.8Very low44.6Very low50 Ų50118.7 Ų118.752%0.51567%0.667SS.*THydrogen-bonded Turntrans-67.53.8-17600000116N482 P483N482-G486 PolarHBondContact O-N 3.07Å; P483-G486 PolarHBondContact O-N 3.41Å
487G41.1Very low44.3Very low59 Ų59118 Ų11861%0.60866%0.663SS**THydrogen-bonded Turntrans-80.5-12.9167.200000114W485 A489W485-G487 PolarHBondContact O-N 3.29Å; G487-A489 VanDerWaalsContact C-N 3.34Å; G487-A489 PolarHBondContact O-N 2.78Å
488S42.4Very low44.4Very low66 Ų66121.1 Ų121.146%0.46267%0.666SS.*THydrogen-bonded Turntrans-80.3-7-171.8-56.90000114.9W485 L490 L491W485-S488 PolarHBondContact O-N 2.86Å; W485-S488 VanDerWaalsContact O-N 3.12Å; W485-S488 PolarHBondContact O-OG 3.4Å; S488-L490 VanDerWaalsContact C-N 3.29Å; S488-L490 PolarHBondContact O-N 2.75Å; S488-L491 VanDerWaalsContact O-O 3.09Å
489A42.5Very low43.6Very low93 Ų93122.9 Ų122.977%0.76968%0.675SS**THydrogen-bonded Turntrans-75.8-15.7176.900000113.5G487G487-A489 VanDerWaalsContact C-N 3.34Å; G487-A489 PolarHBondContact O-N 2.78Å
490L43.8Very low43.4Very low172 Ų172124.2 Ų124.290%0.90168%0.675SS**SBendtrans-102.8-6.5176.7-67.9176.3000113.6S488S488-L490 VanDerWaalsContact C-N 3.29Å; S488-L490 PolarHBondContact O-N 2.75Å
491L39.5Very low42.8Very low132 Ų132120 Ų12069%0.69167%0.665SS**SBendtrans-102.8107.7170.6-67.1172.6000106.9S488S488-L491 VanDerWaalsContact O-O 3.09Å
492K37.7Very low42.1Very low192 Ų192119.8 Ų119.884%0.83567%0.671SS**  trans-45.9130.2163.4-74.7-178.2176.1-178.30107.2P494K492-P494 WeakPolarHBondContact O-CD 3.35Å
493P38Very low41.8Very low117 Ų117122.6 Ų122.676%0.7669%0.69SS**  trans-54.1123.6170.121.8-28.4000105.9E495P493-E495 PolarHBondContact O-N 2.94Å
494P39Very low41.3Very low107 Ų107128.8 Ų128.870%0.69572%0.721SS**  trans-56.8133.217324.3-30.2000106K492K492-P494 WeakPolarHBondContact O-CD 3.35Å
495E41.6Very low41.1Very low172 Ų172123.6 Ų123.680%0.80472%0.715SS**  trans-42.5138.4168.4-74177.815900108.1P493 I497P493-E495 PolarHBondContact O-N 2.94Å; E495-I497 VanDerWaalsContact C-N 3.29Å; E495-I497 PolarHBondContact O-N 2.96Å
496P39.3Very low41.3Very low129 Ų129119.5 Ų119.584%0.83872%0.719SS**  trans-56.799.4-177.523.6-32.6000108.1K498P496-K498 PolarHBondContact O-N 3.49Å
497I41.8Very low41.7Very low135 Ų135122.1 Ų122.169%0.69272%0.721SS**  trans-61114.3170.6-63.5170.3000102.9E495 V499E495-I497 VanDerWaalsContact C-N 3.29Å; E495-I497 PolarHBondContact O-N 2.96Å; I497-V499 PolarHBondContact O-N 3.5Å
498K43.1Very low42.5Very low193 Ų193123.2 Ų123.284%0.83972%0.718SS**  trans-55.293161-105-179.8173.5178.50105.6P496 I500P496-K498 PolarHBondContact O-N 3.49Å; K498-I500 PolarHBondContact O-N 2.84Å
499V34.9Very low43.1Very low117 Ų117123.2 Ų123.271%0.70971%0.71SS**  trans-67.293.6166.6-179.80000104.1I497 P501I497-V499 PolarHBondContact O-N 3.5Å; V499-P501 VanDerWaalsContact O-CD 3.23Å; V499-P501 WeakPolarHBondContact O-CD 3.28Å
500I43.6Very low43.8Very low138 Ų138120.1 Ų120.171%0.70869%0.687SS**  trans-63.7112.7157.4-57.8169000102.8K498K498-I500 PolarHBondContact O-N 2.84Å
501P36.8Very low44.4Very low90 Ų90119.2 Ų119.258%0.58468%0.683SS**  trans-53.8141.3174.522.2-30.3000107.4V499 V503V499-P501 VanDerWaalsContact O-CD 3.23Å; V499-P501 WeakPolarHBondContact O-CD 3.28Å; P501-V503 PolarHBondContact O-N 2.74Å
502P38Very low45.3Very low109 Ų109119.6 Ų119.671%0.70868%0.675SS**  trans-51.5124.1171.822.8-30.9000106.4L504P502-L504 PolarHBondContact O-N 3.12Å
503V42.7Very low46.2Very low129 Ų129114.7 Ų114.778%0.78266%0.657SS**  trans-58.898.6170.4175.10000104.7P501 G505P501-V503 PolarHBondContact O-N 2.74Å; V503-G505 VanDerWaalsContact C-N 3.25Å; V503-G505 PolarHBondContact O-N 3.35Å
504L40Very low47.2Very low158 Ų158116.2 Ų116.283%0.82766%0.659SS**  trans-57.2105.7156.9-70.8169.3000102.9P502 A506P502-L504 PolarHBondContact O-N 3.12Å; L504-A506 PolarHBondContact O-N 2.86Å
505G47.5Very low48.1Very low58 Ų58117.9 Ų117.960%0.59866%0.662SS**  trans-47.9139.6176.200000108.5V503 D507V503-G505 VanDerWaalsContact C-N 3.25Å; V503-G505 PolarHBondContact O-N 3.35Å; G505-D507 PolarHBondContact O-N 3.13Å; G505-D507 VanDerWaalsContact O-N 3.15Å
506A52Low48.9Very low94 Ų94112.7 Ų112.778%0.77764%0.642SS**  trans-37.2122.9-177.900000110.3L504 P508L504-A506 PolarHBondContact O-N 2.86Å; A506-P508 WeakPolarHBondContact O-CD 3.34Å
507D50.2Low49.8Very low104 Ų104116.3 Ų116.356%0.55665%0.648SS**  trans-50.6112.4176.9-175-0.2000107.7G505 F509 G510G505-D507 PolarHBondContact O-N 3.13Å; G505-D507 VanDerWaalsContact O-N 3.15Å; D507-F509 PolarHBondContact O-N 3.06Å; D507-F509 WeakPolarHBondContact OD1-CD2 3.1Å; D507-F509 PolarHBondContact OD1-N 2.81Å; D507-G510 PolarHBondContact O-N 2.81Å
508P57.6Low50.8Low83 Ų83117.3 Ų117.354%0.53965%0.65SS.*THydrogen-bonded Turntrans-62.4-7.1-174-22.934000113.5A506 N532A506-P508 WeakPolarHBondContact O-CD 3.34Å; P508-N532 WeakPolarHBondContact CB-ND2 3.2Å
509F54.8Low51.7Low66 Ų66114.3 Ų114.329%0.28965%0.65SS.*THydrogen-bonded Turntrans-106.4-12.5-178.8-55.2-72.4000113.7D507 D511 R512 L513 L528 N532D507-F509 PolarHBondContact O-N 3.06Å; D507-F509 WeakPolarHBondContact OD1-CD2 3.1Å; D507-F509 PolarHBondContact OD1-N 2.81Å; F509-D511 PolarHBondContact O-N 3.49Å; F509-R512 PolarHBondContact O-N 3.43Å; F509-L513 HydrophobicContact CB-CD1 3.61Å; F509-L513 HydrophobicContact CB-CG 4.16Å; F509-L513 WeakPolarHBondContact O-CB 3.29Å; F509-L513 VanDerWaalsContact O-CG 3.26Å; F509-L513 WeakPolarHBondContact O-CG 3.27Å; F509-L513 PolarHBondContact O-N 3.12Å; F509-L528 HydrophobicContact CD1-CD2 3.54Å; F509-L528 HydrophobicContact CE1-CD2 3.76Å; F509-N532 HydrophobicContact CE1-CB 4.48Å
510G56.9Low53.5Low28 Ų28111.5 Ų111.529%0.28963%0.63SS.*Hα-helixtrans-56.7-52.3-173.500000113.1D507 R512 L513 D514D507-G510 PolarHBondContact O-N 2.81Å; G510-R512 VanDerWaalsContact C-N 3.26Å; G510-R512 PolarHBondContact O-N 2.77Å; G510-L513 PolarHBondContact O-N 3.36Å; G510-D514 PolarHBondContact O-N 3.45Å
511D58Low55Low153 Ų153110 Ų11082%0.81862%0.624SS**Hα-helixtrans-67.8-18.4-177-81.8-6.6000114.5F509F509-D511 PolarHBondContact O-N 3.49Å
512R58.4Low56.7Low140 Ų140112.8 Ų112.853%0.52863%0.629SS.*Hα-helixtrans-105.2-13.1-179-70.4-166.6-179.6-165.50.9114F509 G510F509-R512 PolarHBondContact O-N 3.43Å; G510-R512 VanDerWaalsContact C-N 3.26Å; G510-R512 PolarHBondContact O-N 2.77Å
513L56.8Low58.6Low88 Ų88110.9 Ų110.946%0.46162%0.618SS.*Hα-helixtrans-90-24.4177.1-71.8173.8000112.2F509 G510 D515 V516 L520F509-L513 HydrophobicContact CB-CD1 3.61Å; F509-L513 HydrophobicContact CB-CG 4.16Å; F509-L513 WeakPolarHBondContact O-CB 3.29Å; F509-L513 VanDerWaalsContact O-CG 3.26Å; F509-L513 WeakPolarHBondContact O-CG 3.27Å; F509-L513 PolarHBondContact O-N 3.12Å; G510-L513 PolarHBondContact O-N 3.36Å; L513-D515 PolarHBondContact O-N 2.88Å; L513-V516 PolarHBondContact O-N 2.92Å; L513-L520 HydrophobicContact CD2-CD1 4.01Å
514D58.2Low60.3Low149 Ų149107 Ų10780%0.79760%0.596SS**THydrogen-bonded Turntrans-67.5-22.2175.8-98.5-0.8000113.3G510G510-D514 PolarHBondContact O-N 3.45Å
515D58.8Low62Low143 Ų143103.6 Ų103.677%0.76558%0.579SS**THydrogen-bonded Turntrans-86.60.2-178.5-79-20.8000114.3L513L513-D515 PolarHBondContact O-N 2.88Å
516V58.4Low63.4Low62 Ų62108.9 Ų108.938%0.37658%0.581SS.*  trans-120.195.3-173-160.50000111.8L513 Q518 L520L513-V516 PolarHBondContact O-N 2.92Å; V516-Q518 WeakPolarHBondContact CG1-O 3.13Å; V516-Q518 PolarHBondContact O-N 3.17Å; V516-L520 HydrophobicContact CG1-CD2 4.02Å; V516-L520 HydrophobicContact CG1-CG 4.17Å
517E56.8Low64.7Low205 Ų205110.5 Ų110.596%0.95857%0.572SS**SBendtrans-68.23.4176.8-78.5-174.115000114.9
518Q63.8Low66.1Low157 Ų157107.2 Ų107.273%0.73455%0.554SS**SBendtrans-133147.8177.6-98.4177.6-15.800113.1V516 L520V516-Q518 WeakPolarHBondContact CG1-O 3.13Å; V516-Q518 PolarHBondContact O-N 3.17Å; Q518-L520 PolarHBondContact O-N 3.27Å
519P61.6Low67.1Low129 Ų129107.5 Ų107.584%0.83855%0.55SS**PPolyproline II helixtrans-63.3122.3178.225-31.5000110.7
520L72.1Confident68.2Low59 Ų59108.6 Ų108.631%0.30956%0.559SS.*PPolyproline II helixtrans-63.7136.8-177.6-73.5158.8000112L513 V516 Q518 L525L513-L520 HydrophobicContact CD2-CD1 4.01Å; V516-L520 HydrophobicContact CG1-CD2 4.02Å; V516-L520 HydrophobicContact CG1-CG 4.17Å; Q518-L520 PolarHBondContact O-N 3.27Å; L520-L525 HydrophobicContact CB-CD1 4.47Å
521D76.5Confident69.2Low106 Ų106111 Ų11157%0.56757%0.565SS**PPolyproline II helixtrans-66.1151.6170.5-179.938.9000111.2S523 S524 L525D521-S523 PolarHBondContact O-N 3.33Å; D521-S523 VanDerWaalsContact O-N 3.13Å; D521-S523 PolarHBondContact OD2-OG 2.81Å; D521-S524 PolarHBondContact O-N 3.49Å; D521-S524 VanDerWaalsContact O-N 3.07Å; D521-L525 PolarHBondContact O-N 2.91Å
522H72.4Confident70Confident149 Ų149105.6 Ų105.669%0.6954%0.536SS*.Hα-helixtrans-58.5-31-175.1-174.8-75.2000112.4R526H522-R526 WeakPolarHBondContact O-CB 3.47Å; H522-R526 PolarHBondContact O-N 2.86Å; H522-R526 VanDerWaalsContact O-N 3.12Å
523S76.2Confident70.7Confident68 Ų68106.8 Ų106.848%0.47654%0.542SS..Hα-helixtrans-65.4-47176.363.30000112.1D521 R526 Q527D521-S523 PolarHBondContact O-N 3.33Å; D521-S523 VanDerWaalsContact O-N 3.13Å; D521-S523 PolarHBondContact OD2-OG 2.81Å; S523-R526 PolarHBondContact O-N 3.46Å; S523-Q527 PolarHBondContact O-N 3.11Å; S523-Q527 VanDerWaalsContact O-N 3.16Å
524S78.3Confident71.6Confident47 Ų47106.8 Ų106.833%0.32954%0.541SS..Hα-helixtrans-66.9-38.6177.8-51.60000112.2D521 R526 Q527 L528D521-S524 PolarHBondContact O-N 3.49Å; D521-S524 VanDerWaalsContact O-N 3.07Å; S524-R526 PolarHBondContact O-N 3.16Å; S524-Q527 PolarHBondContact O-N 3.46Å; S524-L528 PolarHBondContact O-N 3.42Å
525L77.3Confident72.2Confident88 Ų88104 Ų10446%0.46153%0.526SS..Hα-helixtrans-64.4-40.9177.4-134.2157000111.5L520 D521 Q527 L528 I529L520-L525 HydrophobicContact CB-CD1 4.47Å; D521-L525 PolarHBondContact O-N 2.91Å; L525-Q527 PolarHBondContact O-N 2.75Å; L525-L528 PolarHBondContact O-N 3.29Å; L525-I529 HydrophobicContact CD2-CD1 3.95Å; L525-I529 VanDerWaalsContact O-CG1 3.32Å; L525-I529 WeakPolarHBondContact O-CG1 3.1Å; L525-I529 PolarHBondContact O-N 3.22Å
526R77.1Confident72.8Confident169 Ų169103.8 Ų103.864%0.63852%0.518SS*.Hα-helixtrans-63.8-40174.7-174-178.6178.1-156.8-0.8112H522 S523 S524 I529 L530H522-R526 WeakPolarHBondContact O-CB 3.47Å; H522-R526 PolarHBondContact O-N 2.86Å; H522-R526 VanDerWaalsContact O-N 3.12Å; S523-R526 PolarHBondContact O-N 3.46Å; S524-R526 PolarHBondContact O-N 3.16Å; R526-I529 PolarHBondContact O-N 3.35Å; R526-L530 HydrophobicContact CG-CD1 4.3Å; R526-L530 WeakPolarHBondContact O-CG 3.1Å; R526-L530 PolarHBondContact O-N 3.41Å; R526-L530 VanDerWaalsContact O-N 3.12Å
527Q79.3Confident73.4Confident127 Ų127105 Ų10559%0.59352%0.519SS*.Hα-helixtrans-63.9-44177.2-116.3171.5-14.400111.8S523 S524 L525 I529 L530 D531S523-Q527 PolarHBondContact O-N 3.11Å; S523-Q527 VanDerWaalsContact O-N 3.16Å; S524-Q527 PolarHBondContact O-N 3.46Å; L525-Q527 PolarHBondContact O-N 2.75Å; Q527-I529 VanDerWaalsContact C-N 3.3Å; Q527-I529 PolarHBondContact O-N 2.92Å; Q527-L530 PolarHBondContact O-N 3.07Å; Q527-L530 VanDerWaalsContact O-N 3.13Å; Q527-D531 PolarHBondContact O-N 3.06Å
528L79.8Confident73.8Confident35 Ų3599 Ų9918%0.18349%0.494CS..Hα-helixtrans-63.1-37.1179.9-153.6157000111.9F509 S524 L525 N532F509-L528 HydrophobicContact CD1-CD2 3.54Å; F509-L528 HydrophobicContact CE1-CD2 3.76Å; S524-L528 PolarHBondContact O-N 3.42Å; L525-L528 PolarHBondContact O-N 3.29Å; L528-N532 WeakPolarHBondContact O-CB 3.44Å; L528-N532 PolarHBondContact O-N 3.39Å
529I77.2Confident73.8Confident90 Ų90100.5 Ų100.546%0.46249%0.493SS..Hα-helixtrans-67.1-41.9174.2-66.9166.1000111.5L525 R526 Q527 N532 Y533L525-I529 HydrophobicContact CD2-CD1 3.95Å; L525-I529 VanDerWaalsContact O-CG1 3.32Å; L525-I529 WeakPolarHBondContact O-CG1 3.1Å; L525-I529 PolarHBondContact O-N 3.22Å; R526-I529 PolarHBondContact O-N 3.35Å; Q527-I529 VanDerWaalsContact C-N 3.3Å; Q527-I529 PolarHBondContact O-N 2.92Å; I529-N532 PolarHBondContact O-N 3.33Å; I529-Y533 PolarHBondContact O-N 3.15Å
530L78.6Confident73.5Confident89 Ų8996.8 Ų96.847%0.46647%0.47SS..Hα-helixtrans-65.6-43.9179.6-72.7169.7000111.8R526 Q527 N532 Y533 I534R526-L530 HydrophobicContact CG-CD1 4.3Å; R526-L530 WeakPolarHBondContact O-CG 3.1Å; R526-L530 PolarHBondContact O-N 3.41Å; R526-L530 VanDerWaalsContact O-N 3.12Å; Q527-L530 PolarHBondContact O-N 3.07Å; Q527-L530 VanDerWaalsContact O-N 3.13Å; L530-N532 VanDerWaalsContact C-N 3.3Å; L530-N532 PolarHBondContact O-N 3.02Å; L530-Y533 WeakPolarHBondContact O-CB 3.11Å; L530-Y533 PolarHBondContact O-N 2.9Å; L530-I534 WeakPolarHBondContact O-CG1 3.15Å; L530-I534 PolarHBondContact O-N 2.81Å
531D77.9Confident72.9Confident77 Ų7799.9 Ų99.941%0.41248%0.481SS..Hα-helixtrans-61.8-38.9177-73.1-9.6000111.8Q527 I534 L535Q527-D531 PolarHBondContact O-N 3.06Å; D531-I534 PolarHBondContact O-N 3.36Å; D531-L535 WeakPolarHBondContact O-CG 3.45Å; D531-L535 PolarHBondContact O-N 3.24Å
532N74.8Confident71.7Confident41 Ų41102 Ų10222%0.21949%0.488CS..Hα-helixtrans-67.2-38.6176.1-159.5-65.4000111.8P508 F509 L528 I529 L530 I534 L535 K536P508-N532 WeakPolarHBondContact CB-ND2 3.2Å; F509-N532 HydrophobicContact CE1-CB 4.48Å; L528-N532 WeakPolarHBondContact O-CB 3.44Å; L528-N532 PolarHBondContact O-N 3.39Å; I529-N532 PolarHBondContact O-N 3.33Å; L530-N532 VanDerWaalsContact C-N 3.3Å; L530-N532 PolarHBondContact O-N 3.02Å; N532-I534 VanDerWaalsContact C-N 3.32Å; N532-I534 PolarHBondContact O-N 3.41Å; N532-L535 PolarHBondContact O-N 2.86Å; N532-K536 WeakPolarHBondContact O-CB 3.25Å; N532-K536 PolarHBondContact O-N 3.02Å
533Y73.8Confident70.6Confident165 Ų165100.5 Ų100.565%0.64749%0.489SS*.Hα-helixtrans-61.8-41.8175.6-157.9-90000111.5I529 L530 K536 E537I529-Y533 PolarHBondContact O-N 3.15Å; L530-Y533 WeakPolarHBondContact O-CB 3.11Å; L530-Y533 PolarHBondContact O-N 2.9Å; Y533-K536 PolarHBondContact O-N 3.18Å; Y533-E537 WeakPolarHBondContact O-CB 3.06Å; Y533-E537 PolarHBondContact O-N 2.76Å
534I74.9Confident69.2Low88 Ų88106.9 Ų106.945%0.45150%0.503SS..Hα-helixtrans-64.9-44.6176.3-65165.3000110.9L530 D531 N532 K536 E537 N538L530-I534 WeakPolarHBondContact O-CG1 3.15Å; L530-I534 PolarHBondContact O-N 2.81Å; D531-I534 PolarHBondContact O-N 3.36Å; N532-I534 VanDerWaalsContact C-N 3.32Å; N532-I534 PolarHBondContact O-N 3.41Å; I534-K536 VanDerWaalsContact C-N 3.33Å; I534-K536 PolarHBondContact O-N 2.84Å; I534-E537 PolarHBondContact O-N 2.94Å; I534-N538 VanDerWaalsContact O-CG 3.26Å; I534-N538 PolarHBondContact O-N 2.84Å; I534-N538 PolarHBondContact O-ND2 3.5Å
535L71.7Confident67.4Low90 Ų90107.7 Ų107.747%0.47152%0.518SS..Hα-helixtrans-61.5-39.9175.6-80.9160.9000112.4D531 N532 N538 R539D531-L535 WeakPolarHBondContact O-CG 3.45Å; D531-L535 PolarHBondContact O-N 3.24Å; N532-L535 PolarHBondContact O-N 2.86Å; L535-N538 PolarHBondContact O-N 2.8Å; L535-R539 PolarHBondContact O-N 3.5Å
536K69.8Low65.7Low139 Ų139111.2 Ų111.260%0.60454%0.537SS*.Hα-helixtrans-68.3-39.6176.7-167.5174-176.6175.30111.5N532 Y533 I534 N538 R539 S540N532-K536 WeakPolarHBondContact O-CB 3.25Å; N532-K536 PolarHBondContact O-N 3.02Å; Y533-K536 PolarHBondContact O-N 3.18Å; I534-K536 VanDerWaalsContact C-N 3.33Å; I534-K536 PolarHBondContact O-N 2.84Å; K536-N538 VanDerWaalsContact C-N 3.34Å; K536-R539 PolarHBondContact O-N 2.78Å; K536-S540 WeakPolarHBondContact O-CB 2.83Å; K536-S540 PolarHBondContact O-N 3.3Å; K536-S540 PolarHBondContact O-OG 2.66Å
537E71.3Confident63.9Low86 Ų86107.5 Ų107.540%0.40254%0.537SS..Hα-helixtrans-64.8-39.1175.9-157.3-171.3149.300111.5Y533 I534 S540 K541Y533-E537 WeakPolarHBondContact O-CB 3.06Å; Y533-E537 PolarHBondContact O-N 2.76Å; I534-E537 PolarHBondContact O-N 2.94Å; E537-S540 WeakPolarHBondContact O-CB 3.19Å; E537-S540 PolarHBondContact O-N 2.73Å; E537-K541 WeakPolarHBondContact O-CG 3.2Å; E537-K541 PolarHBondContact O-N 3.44Å; E537-K541 WeakPolarHBondContact OE1-CE 2.88Å; E537-K541 IonicContact OE1-NZ 3Å; E537-K541 PolarHBondContact OE1-NZ 3.45Å
538N65.9Low61.7Low80 Ų80109.4 Ų109.443%0.42855%0.551SS.*Hα-helixtrans-66.5-44176.1-69.3-15.6000112.1I534 L535 K536 S540 K541 E542I534-N538 VanDerWaalsContact O-CG 3.26Å; I534-N538 PolarHBondContact O-N 2.84Å; I534-N538 PolarHBondContact O-ND2 3.5Å; L535-N538 PolarHBondContact O-N 2.8Å; K536-N538 VanDerWaalsContact C-N 3.34Å; N538-S540 VanDerWaalsContact C-N 3.26Å; N538-S540 PolarHBondContact O-N 2.71Å; N538-K541 PolarHBondContact O-N 3.38Å; N538-K541 VanDerWaalsContact O-N 3.1Å; N538-E542 PolarHBondContact O-N 3.26Å; N538-E542 VanDerWaalsContact O-N 3.1Å
539R62.8Low59.7Low188 Ų188113.7 Ų113.771%0.70958%0.581SS**Hα-helixtrans-61.5-34.5171.9-75.8-175.6175.1-176.40.4112.6L535 K536 K541 E542 V543L535-R539 PolarHBondContact O-N 3.5Å; K536-R539 PolarHBondContact O-N 2.78Å; R539-K541 VanDerWaalsContact C-N 3.27Å; R539-K541 PolarHBondContact O-N 2.83Å; R539-E542 PolarHBondContact O-N 3Å; R539-V543 WeakPolarHBondContact O-CG2 3.18Å; R539-V543 PolarHBondContact O-N 3.42Å
540S56.9Low57.7Low51 Ų51118 Ų11836%0.35760%0.599SS.*Hα-helixtrans-70.5-23.4176.8-52.90000113.2K536 E537 N538K536-S540 WeakPolarHBondContact O-CB 2.83Å; K536-S540 PolarHBondContact O-N 3.3Å; K536-S540 PolarHBondContact O-OG 2.66Å; E537-S540 WeakPolarHBondContact O-CB 3.19Å; E537-S540 PolarHBondContact O-N 2.73Å; N538-S540 VanDerWaalsContact C-N 3.26Å; N538-S540 PolarHBondContact O-N 2.71Å
541K58.6Low55.6Low124 Ų124123.7 Ų123.754%0.53962%0.62SS.*Hα-helixtrans-83-36.8175.3-74.6171.5-175.6162.80111.3E537 N538 R539 R544E537-K541 WeakPolarHBondContact O-CG 3.2Å; E537-K541 PolarHBondContact O-N 3.44Å; E537-K541 WeakPolarHBondContact OE1-CE 2.88Å; E537-K541 IonicContact OE1-NZ 3Å; E537-K541 PolarHBondContact OE1-NZ 3.45Å; N538-K541 PolarHBondContact O-N 3.38Å; N538-K541 VanDerWaalsContact O-N 3.1Å; R539-K541 VanDerWaalsContact C-N 3.27Å; R539-K541 PolarHBondContact O-N 2.83Å; K541-R544 PolarHBondContact O-N 2.99Å
542E51.3Low53.5Low151 Ų151125.7 Ų125.771%0.70664%0.635SS**Hα-helixtrans-65.2-41.9174.2-75.2178.1160.600112.6N538 R539 R544 G545N538-E542 PolarHBondContact O-N 3.26Å; N538-E542 VanDerWaalsContact O-N 3.1Å; R539-E542 PolarHBondContact O-N 3Å; E542-R544 PolarHBondContact O-N 2.77Å; E542-G545 PolarHBondContact O-N 3.4Å
543V49.5Very low51.4Low118 Ų118131.7 Ų131.772%0.71567%0.667SS**THydrogen-bonded Turntrans-66.5-19.1178.4174.60000112.9R539R539-V543 WeakPolarHBondContact O-CG2 3.18Å; R539-V543 PolarHBondContact O-N 3.42Å
544R45.7Very low49.6Very low202 Ų202130.4 Ų130.476%0.76267%0.671SS**THydrogen-bonded Turntrans-90.2-4.5-180-127.3-179.7-72.4-125.72.9113.9K541 E542K541-R544 PolarHBondContact O-N 2.99Å; E542-R544 PolarHBondContact O-N 2.77Å
545G42.2Very low47.6Very low63 Ų63131.7 Ų131.765%0.64969%0.688SS**SBendtrans-82.7-20.6179.100000115.2E542E542-G545 PolarHBondContact O-N 3.4Å
546D41.1Very low45.8Very low163 Ų163138.5 Ų138.587%0.87271%0.707SS**SBendtrans-106.919.8-164.4-106.7-2.2000115.4
547S39.4Very low44.1Very low90 Ų90137.6 Ų137.663%0.62972%0.718SS**  trans-141.563.1-178.4440000114.9
548L32.5Very low42.4Very low168 Ų168145.2 Ų145.288%0.8874%0.743SS**  trans-149.6123.9151.9-77.1178.9000111.1
549P38.7Very low41Very low125 Ų125151.5 Ų151.581%0.81277%0.767SS**  trans-86.2146165.833.4-28.5000111.3K551P549-K551 PolarHBondContact O-N 2.94Å
550E33.9Very low39.8Very low180 Ų180153.7 Ų153.784%0.84178%0.775SS**  trans-45.9128.8171-73.3173.5121.400113
551K34.2Very low38.7Very low208 Ų208157.3 Ų157.390%0.90480%0.795SS**  trans-134.4111.4138.9-79.1-160.9175.5-176.30110.2P549P549-K551 PolarHBondContact O-N 2.94Å
552V34.7Very low37.7Very low120 Ų120157.3 Ų157.373%0.72781%0.805SS**  trans-50.6125.3159.7174.30000109.2
553D31Very low36.9Very low167 Ų167162.4 Ų162.489%0.89383%0.832SS**  trans-149.3133.6137.6-127.2-16.4000111.2
554D35.2Very low36.3Very low137 Ų137164.7 Ų164.773%0.73384%0.838SS**  trans-104.1115.6-159.8-163.66.3000108.5
555S33.8Very low35.8Very low115 Ų115162.7 Ų162.780%0.80484%0.842SS**  trans-157.795.2157.448.90000113.2
556R33.1Very low35.5Very low234 Ų234168.2 Ų168.288%0.88385%0.853SS**  trans-11.1130.2151.2-68.4171.1173.2172.1-2116.6
557S33.6Very low35.1Very low119 Ų119168.5 Ų168.583%0.83285%0.852SS**  -155.3102.6117.248.30000111.9
558R36.4Very low34.9Very low247 Ų247173.4 Ų173.493%0.93287%0.866SS**  trans-68.7127161.1-78.8176.5172.5172.1-2.1108.6
559K35.7Very low35Very low212 Ų212173.8 Ų173.892%0.92287%0.865SS**  trans-136.1108.8143.2-91.2-173.3178.2176.70109.9
560R37.3Very low34.8Very low233 Ų233177.3 Ų177.388%0.87987%0.868SS**  trans-64.5138.4156.5-76.5176.2173.9174.5-3.8109.1
561V35.2Very low34.8Very low128 Ų128177.1 Ų177.178%0.77687%0.87SS**  trans-155.199.6141.2178.90000104.9
562T37.7Very low34.9Very low123 Ų123174.5 Ų174.576%0.75587%0.868SS**  34.785.490.943.10000115.2
563M34.8Very low34.9Very low259 Ų259179.5 Ų179.5100%1.27688%0.88SS**  -167.9093.1-83.8-141.892.400109

Retrieved 563 of 563 residues in 139.6 ms (Link to these results)