A0A077Z1F2_TRITR Loading...

CCDC50 N domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z1F2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 306 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M43.8Very low52.6Low247 Ų247158 Ų158100%1.21787%0.868SS**  0140.90-78-172.1170.300108
2A44.6Very low52.6Low99 Ų99150.2 Ų150.282%0.81885%0.851SS**  trans75.983.9-176.900000116.6
3A49.6Very low52.6Low105 Ų105151.2 Ų151.287%0.86885%0.847SS**  trans-81.9118163.400000109.2G5A3-G5 PolarHBondContact O-N 3.06Å
4L59.5Low52.7Low177 Ų177149.3 Ų149.393%0.92785%0.845SS**  trans-83.794.4175.5-70.1169.4000109S6L4-S6 PolarHBondContact O-N 2.88Å
5G48.5Very low52.2Low75 Ų75149.9 Ų149.977%0.77384%0.844SS**  trans-68.1115.6174.600000111.3A3 H7A3-G5 PolarHBondContact O-N 3.06Å; G5-H7 PolarHBondContact O-N 3.04Å
6S55.8Low52.4Low112 Ų112151.6 Ų151.678%0.78384%0.843SS**  trans-68.9123.2173.1-178.30000110.4L4 F8L4-S6 PolarHBondContact O-N 2.88Å; S6-F8 PolarHBondContact O-N 2.99Å
7H55.1Low52.3Low166 Ų166157.1 Ų157.177%0.76985%0.848SS**  trans-80.492.5-168.1-143.8-26.1000109.8G5 R9G5-H7 PolarHBondContact O-N 3.04Å; H7-R9 PolarHBondContact O-N 3.08Å
8F53.8Low52.4Low200 Ų200156.9 Ų156.988%0.87784%0.84SS**  trans-67.698.5168.3-98.7-91000109.7S6 K10S6-F8 PolarHBondContact O-N 2.99Å; F8-K10 PolarHBondContact O-N 3.07Å; F8-K10 VanDerWaalsContact O-N 3.1Å
9R54.2Low52.4Low220 Ų220157.3 Ų157.383%0.8384%0.842SS**  trans-74.294.5165.7-80.6-170.4-175.2-161.82.3108.9H7 V11H7-R9 PolarHBondContact O-N 3.08Å; R9-V11 PolarHBondContact O-N 3.27Å; R9-V11 VanDerWaalsContact O-N 3.15Å
10K57.6Low52.4Low206 Ų206156.3 Ų156.390%0.89684%0.837SS**  trans-71.297.3168.7-150172-173-179.90107.7F8 G12F8-K10 PolarHBondContact O-N 3.07Å; F8-K10 VanDerWaalsContact O-N 3.1Å; K10-G12 PolarHBondContact O-N 3.15Å; K10-G12 VanDerWaalsContact O-N 3.11Å
11V55.8Low52.2Low131 Ų131152.3 Ų152.379%0.79483%0.833SS**  trans-73.899.1172.7-178.50000107.1R9R9-V11 PolarHBondContact O-N 3.27Å; R9-V11 VanDerWaalsContact O-N 3.15Å
12G53.2Low52.3Low64 Ų64150.2 Ų150.266%0.6682%0.817SS**  trans-70.9122172.800000110.1K10K10-G12 PolarHBondContact O-N 3.15Å; K10-G12 VanDerWaalsContact O-N 3.11Å
13M52Low52.6Low163 Ų163154 Ų15480%0.80382%0.818SS**  trans-75.1122.9166.7-78.9-77.9-54.600108.6L15M13-L15 PolarHBondContact O-N 3.47Å
14P54Low52.6Low125 Ų125158.3 Ų158.381%0.81282%0.82SS**  trans-72.3107.2174.2-9.825.4000109.7
15L46.2Very low52.1Low159 Ų159158.6 Ų158.683%0.83282%0.816SS**  trans-89.7116.2156.1-101.5112.8000106.2M13M13-L15 PolarHBondContact O-N 3.47Å
16E55.2Low52.1Low176 Ų176163.9 Ų163.982%0.82282%0.821SS**  trans173.899.2149.4-96.3159.2-151.700106.7
17R50.2Low51.7Low246 Ų246167.5 Ų167.593%0.92883%0.826SS**  trans-103.499.4154.1-92.8-172.8-175141.92.1105.7N19R17-N19 PolarHBondContact O-N 3.23Å
18E54.2Low51.3Low154 Ų154168.6 Ų168.672%0.7283%0.831SS**  trans-55.4114.5161.5-68.5168143.500107.3D20E18-D20 PolarHBondContact O-N 3.13Å
19N51.4Low51Low163 Ų163167.3 Ų167.387%0.87283%0.828SS**  trans-8395.9165.5-95.9-17.5000106.1R17 G21R17-N19 PolarHBondContact O-N 3.23Å; N19-G21 PolarHBondContact O-N 2.93Å
20D52.8Low51Low137 Ų137165 Ų16573%0.73383%0.826SS**  trans-60.1128172.1-65.9-42.6000110.2E18 K22E18-D20 PolarHBondContact O-N 3.13Å; D20-K22 PolarHBondContact O-N 3.29Å
21G49.5Very low50.4Low73 Ų73165.8 Ų165.875%0.75382%0.824SS**  trans-56.9128.7175.400000111.3N19N19-G21 PolarHBondContact O-N 2.93Å
22K46.1Very low50.3Low204 Ų204164.4 Ų164.489%0.88782%0.815SS**  trans-108.594.2161.1-77.3-170.8174.9-1760108D20D20-K22 PolarHBondContact O-N 3.29Å
23E49.6Very low50.3Low179 Ų179166.7 Ų166.784%0.83681%0.812SS**  trans28.1108.9134.8-62.9177.8169.700115.9E25E23-E25 PolarHBondContact O-N 3.31Å; E23-E25 VanDerWaalsContact O-N 3.13Å
24E50.3Low50.5Low195 Ų195164.9 Ų164.991%0.91181%0.805SS**  trans-59.599.5162.8-63174.4156.900108.7E26E24-E26 PolarHBondContact O-N 3.38Å
25E49.6Very low50.5Low182 Ų182163.1 Ų163.185%0.8580%0.796SS**  trans-76.1109.7164.7-79.2-175.4161.700108.3E23 E27E23-E25 PolarHBondContact O-N 3.31Å; E23-E25 VanDerWaalsContact O-N 3.13Å; E25-E27 PolarHBondContact O-N 2.75Å
26E47.8Very low50.8Low186 Ų186164.1 Ų164.187%0.86979%0.793SS**  trans-60.997.3169.8-66.5178.8153.100109.3E24 E28E24-E26 PolarHBondContact O-N 3.38Å; E26-E28 PolarHBondContact O-N 3.4Å
27E48Very low50.4Low189 Ų189157.9 Ų157.988%0.88378%0.776SS**  trans-68.9100.4169.8-74.3-174.8163.500109.2E25 E29E25-E27 PolarHBondContact O-N 2.75Å; E27-E29 PolarHBondContact O-N 3.03Å
28E46.9Very low50.3Low188 Ų188154.7 Ų154.788%0.87976%0.764SS**  trans-56.7108166.1-77.2-172.9147.400109.3E26 E30E26-E28 PolarHBondContact O-N 3.4Å; E28-E30 PolarHBondContact O-N 2.86Å
29E47.1Very low50.5Low174 Ų174152.2 Ų152.281%0.81376%0.764SS**  trans-68.578.1178.8-151.4-177-151.400109.7E27 R31E27-E29 PolarHBondContact O-N 3.03Å; E29-R31 PolarHBondContact O-N 3.28Å
30E53.6Low50.4Low171 Ų171151 Ų15180%0.79975%0.753SS**  trans-64.498.9172.5-165.9178.5-168.300108.3E28 V32E28-E30 PolarHBondContact O-N 2.86Å; E30-V32 PolarHBondContact O-N 2.74Å
31R45.4Very low50.4Low223 Ų223151.8 Ų151.884%0.84275%0.75SS**  trans-63.483.4172.6-78.5-176.5174.8179.1-0.4109.9E29 D33E29-R31 PolarHBondContact O-N 3.28Å; R31-D33 PolarHBondContact O-N 2.99Å
32V53.8Low50.5Low101 Ų101154.3 Ų154.361%0.61274%0.742SS**  trans-65.6113.1171.4-179.90000108.3E30 L34E30-V32 PolarHBondContact O-N 2.74Å; V32-L34 VanDerWaalsContact C-N 3.34Å; V32-L34 PolarHBondContact O-N 3.05Å
33D51.7Low50.8Low112 Ų112150.6 Ų150.660%0.59973%0.731SS**  trans-65.890176.7-164.5-11.5000109.6R31 S35R31-D33 PolarHBondContact O-N 2.99Å; D33-S35 PolarHBondContact O-N 3.49Å; D33-S35 PolarHBondContact OD1-OG 3.11Å
34L56.5Low51Low126 Ų126146 Ų14666%0.6672%0.716SS**THydrogen-bonded Turntrans-61.4-1.7-175.7-68.6173.1000113.8V32 W38V32-L34 VanDerWaalsContact C-N 3.34Å; V32-L34 PolarHBondContact O-N 3.05Å; L34-W38 PolarHBondContact O-NE1 3.19Å
35S55.5Low51.3Low87 Ų87138.6 Ų138.661%0.60869%0.688SS**THydrogen-bonded Turntrans-80.7-16.1-17765.80000114.5D33D33-S35 PolarHBondContact O-N 3.49Å; D33-S35 PolarHBondContact OD1-OG 3.11Å
36K51.7Low51.4Low180 Ų180134.9 Ų134.978%0.78367%0.673SS**SBendtrans-117.10.1-170.5-73.5176.8-178.1167.20117
37G46.4Very low51.8Low45 Ų45128.8 Ų128.846%0.46465%0.651SS.*  trans-108.8-5.2-17000000118.2S39 H40G37-S39 VanDerWaalsContact C-N 3.33Å; G37-S39 PolarHBondContact O-N 3.31Å; G37-H40 PolarHBondContact O-N 3.35Å
38W47.6Very low52.2Low179 Ų179121.4 Ų121.468%0.67863%0.625SS**Hα-helixtrans-68.5-27.2-164.7-71.265.5000114.4L34L34-W38 PolarHBondContact O-NE1 3.19Å
39S59.4Low52.3Low102 Ų102117.8 Ų117.871%0.71361%0.61SS**Hα-helixtrans-75.8-25.2-176.263.80000114.2G37G37-S39 VanDerWaalsContact C-N 3.33Å; G37-S39 PolarHBondContact O-N 3.31Å
40H50.1Low52.6Low138 Ų138116.3 Ų116.364%0.63960%0.603SS**Hα-helixtrans-92.9-30.7-179.4-157.4-32.5000112.4G37 E42 L43 T44G37-H40 PolarHBondContact O-N 3.35Å; H40-E42 PolarHBondContact O-N 2.94Å; H40-L43 PolarHBondContact O-N 3.4Å; H40-T44 PolarHBondContact ND1-OG1 2.79Å; H40-T44 PolarHBondContact O-N 3.36Å; H40-T44 PolarHBondContact O-OG1 3.38Å
41F51.4Low52.7Low154 Ų154118.4 Ų118.468%0.67560%0.604SS**Hα-helixtrans-66.9-36.1-178.3-170.2-99.8000112.7L43 T44 A45F41-L43 VanDerWaalsContact C-N 3.33Å; F41-L43 PolarHBondContact O-N 3.22Å; F41-T44 PolarHBondContact O-N 2.92Å; F41-A45 HydrophobicContact CE1-CB 4.32Å; F41-A45 VanDerWaalsContact O-CB 3.31Å; F41-A45 WeakPolarHBondContact O-CB 3.49Å; F41-A45 PolarHBondContact O-N 2.85Å
42E51.8Low53.1Low125 Ų125114.1 Ų114.158%0.58460%0.595SS**Hα-helixtrans-62.6-37179.7-72.6-173164.100112.8H40 I46H40-E42 PolarHBondContact O-N 2.94Å; E42-I46 VanDerWaalsContact O-CD1 3.31Å; E42-I46 WeakPolarHBondContact O-CD1 3.48Å; E42-I46 WeakPolarHBondContact O-CG1 3.43Å; E42-I46 PolarHBondContact O-N 3.5Å
43L52.4Low53Low126 Ų126112 Ų11266%0.6658%0.582SS**Hα-helixtrans-77.1-36-180-69.9173.5000112.7H40 F41 I46 S47H40-L43 PolarHBondContact O-N 3.4Å; F41-L43 VanDerWaalsContact C-N 3.33Å; F41-L43 PolarHBondContact O-N 3.22Å; L43-I46 PolarHBondContact O-N 2.89Å; L43-S47 PolarHBondContact O-N 3.33Å; L43-S47 VanDerWaalsContact O-N 3.09Å
44T54.9Low53.3Low83 Ų83111.3 Ų111.351%0.50959%0.591SS.*Hα-helixtrans-72.6-36.7177.4-47.40000111.4H40 F41 I46 S47 G48H40-T44 PolarHBondContact ND1-OG1 2.79Å; H40-T44 PolarHBondContact O-N 3.36Å; H40-T44 PolarHBondContact O-OG1 3.38Å; F41-T44 PolarHBondContact O-N 2.92Å; T44-I46 VanDerWaalsContact C-N 3.34Å; T44-I46 PolarHBondContact O-N 3.42Å; T44-S47 PolarHBondContact O-N 3.43Å; T44-G48 PolarHBondContact O-N 2.85Å
45A55.3Low53.4Low39 Ų39114 Ų11432%0.32260%0.6SS.*Hα-helixtrans-63.4-39.7174.800000111.8F41 G48 M49F41-A45 HydrophobicContact CE1-CB 4.32Å; F41-A45 VanDerWaalsContact O-CB 3.31Å; F41-A45 WeakPolarHBondContact O-CB 3.49Å; F41-A45 PolarHBondContact O-N 2.85Å; A45-G48 PolarHBondContact O-N 3.01Å; A45-M49 WeakPolarHBondContact O-CB 3.38Å; A45-M49 WeakPolarHBondContact O-CG 3.49Å; A45-M49 PolarHBondContact O-N 3.36Å
46I53.2Low53.4Low104 Ų104112.7 Ų112.753%0.53359%0.589SS.*Hα-helixtrans-66.8-43.8176.6-66.6166.3000111E42 L43 T44 G48 M49 E50E42-I46 VanDerWaalsContact O-CD1 3.31Å; E42-I46 WeakPolarHBondContact O-CD1 3.48Å; E42-I46 WeakPolarHBondContact O-CG1 3.43Å; E42-I46 PolarHBondContact O-N 3.5Å; L43-I46 PolarHBondContact O-N 2.89Å; T44-I46 VanDerWaalsContact C-N 3.34Å; T44-I46 PolarHBondContact O-N 3.42Å; I46-G48 PolarHBondContact O-N 2.84Å; I46-M49 PolarHBondContact O-N 2.91Å; I46-E50 PolarHBondContact O-N 3.48Å
47S55.6Low53.9Low59 Ų59110.1 Ų110.141%0.41358%0.584SS.*Hα-helixtrans-67.6-35.2177.5-1780000113L43 T44 E50L43-S47 PolarHBondContact O-N 3.33Å; L43-S47 VanDerWaalsContact O-N 3.09Å; T44-S47 PolarHBondContact O-N 3.43Å; S47-E50 PolarHBondContact O-N 3.25Å
48G55.5Low54.9Low34 Ų34112 Ų11235%0.35159%0.594SS.*Hα-helixtrans-67.6-39.3174.400000112.5T44 A45 I46 E50 R51 M52T44-G48 PolarHBondContact O-N 2.85Å; A45-G48 PolarHBondContact O-N 3.01Å; I46-G48 PolarHBondContact O-N 2.84Å; G48-E50 VanDerWaalsContact C-N 3.34Å; G48-E50 PolarHBondContact O-N 3.38Å; G48-R51 PolarHBondContact O-N 2.9Å; G48-M52 PolarHBondContact O-N 3.05Å
49M49.9Very low55.7Low112 Ų112107.4 Ų107.455%0.55259%0.589SS**Hα-helixtrans-61.8-41.4174.9-78.5-176.874.500111.5A45 I46 R51 M52 V53A45-M49 WeakPolarHBondContact O-CB 3.38Å; A45-M49 WeakPolarHBondContact O-CG 3.49Å; A45-M49 PolarHBondContact O-N 3.36Å; I46-M49 PolarHBondContact O-N 2.91Å; M49-R51 PolarHBondContact O-N 3.35Å; M49-M52 PolarHBondContact O-N 3Å; M49-V53 WeakPolarHBondContact O-CG2 3.33Å; M49-V53 PolarHBondContact O-N 3.43Å; M49-V53 VanDerWaalsContact O-N 3.13Å
50E53.2Low55.9Low143 Ų143107.2 Ų107.267%0.66858%0.576SS**Hα-helixtrans-55.8-34.6176.9-84-172.815900113.3I46 S47 G48 V53I46-E50 PolarHBondContact O-N 3.48Å; S47-E50 PolarHBondContact O-N 3.25Å; G48-E50 VanDerWaalsContact C-N 3.34Å; G48-E50 PolarHBondContact O-N 3.38Å; E50-V53 PolarHBondContact O-N 3.32Å
51R56.3Low56.6Low215 Ų215104.7 Ų104.781%0.81156%0.563SS**Hα-helixtrans-78.4-27.7176.4-69-169.9-161.4178.96.8113.8G48 M49 V53G48-R51 PolarHBondContact O-N 2.9Å; M49-R51 PolarHBondContact O-N 3.35Å; R51-V53 VanDerWaalsContact C-N 3.28Å
52M53.7Low57.3Low132 Ų13299.7 Ų99.765%0.6555%0.551SS**Hα-helixtrans-75-18.1173-75.9-168.8-83.300112.7G48 M49 A54 H55 V56G48-M52 PolarHBondContact O-N 3.05Å; M49-M52 PolarHBondContact O-N 3Å; M52-A54 PolarHBondContact O-N 3.31Å; M52-H55 PolarHBondContact O-N 3.02Å; M52-V56 WeakPolarHBondContact O-CG2 3Å
53V51.4Low58Low57 Ų5797.5 Ų97.535%0.34554%0.541SS..G310 helixtrans-62-24.9179.2-179.60000113.5M49 E50 R51 H55 F61M49-V53 WeakPolarHBondContact O-CG2 3.33Å; M49-V53 PolarHBondContact O-N 3.43Å; M49-V53 VanDerWaalsContact O-N 3.13Å; E50-V53 PolarHBondContact O-N 3.32Å; R51-V53 VanDerWaalsContact C-N 3.28Å; V53-H55 PolarHBondContact O-N 3.46Å; V53-F61 HydrophobicContact CB-CE2 3.92Å; V53-F61 HydrophobicContact CB-CZ 4.3Å; V53-F61 HydrophobicContact CG1-CD2 4.05Å; V53-F61 HydrophobicContact CG1-CE2 3.31Å; V53-F61 HydrophobicContact CG1-CZ 3.7Å; V53-F61 HydrophobicContact CG2-CE2 3.47Å; V53-F61 VanDerWaalsContact CG2-CE2 3.47Å; V53-F61 HydrophobicContact CG2-CZ 3.58Å
54A58.4Low58.7Low97 Ų9794.1 Ų94.180%0.80252%0.523SS*.G310 helixtrans-63.8-18.5-176.500000113.8M52M52-A54 PolarHBondContact O-N 3.31Å
55H58.1Low59.3Low183 Ų18395.7 Ų95.785%0.84753%0.526SS*.G310 helixtrans-127.12.9-175.9-137.7-55.6000115M52 V53M52-H55 PolarHBondContact O-N 3.02Å; V53-H55 PolarHBondContact O-N 3.46Å
56V54.2Low60Low60 Ų6097.9 Ų97.936%0.36454%0.536SS..SBendtrans-90.6118.6179.3174.90000108.2M52 A58 F60M52-V56 WeakPolarHBondContact O-CG2 3Å; V56-A58 PolarHBondContact O-N 3.18Å; V56-F60 HydrophobicContact CG1-CB 3.55Å; V56-F60 HydrophobicContact CG1-CD1 3.37Å; V56-F60 HydrophobicContact CG1-CE1 4.21Å; V56-F60 HydrophobicContact CG1-CG 3.66Å
57D63.4Low60.6Low126 Ų12694.2 Ų94.267%0.67452%0.517SS*.  trans-39.8133.3179.6-91.3-39.9000111.8S59 F60D57-S59 WeakPolarHBondContact CB-OG 3.49Å; D57-S59 PolarHBondContact O-N 2.91Å; D57-F60 WeakPolarHBondContact O-CB 3.45Å; D57-F60 PolarHBondContact O-N 2.9Å
58A66.9Low61.1Low83 Ų83100.1 Ų100.169%0.68653%0.53SS*.Hα-helixtrans-52.7-22.917800000113V56 F61 A62V56-A58 PolarHBondContact O-N 3.18Å; A58-F61 PolarHBondContact O-N 2.93Å; A58-A62 PolarHBondContact O-N 3.44Å
59S63.8Low61.7Low83 Ų83105.5 Ų105.558%0.5854%0.544SS*.Hα-helixtrans-62.1-38.6173.463.30000113.1D57 A62 M63D57-S59 WeakPolarHBondContact CB-OG 3.49Å; D57-S59 PolarHBondContact O-N 2.91Å; S59-A62 PolarHBondContact O-N 2.92Å; S59-M63 WeakPolarHBondContact O-CB 3.36Å; S59-M63 PolarHBondContact O-N 2.64Å
60F64.3Low62.6Low98 Ų98104.3 Ų104.343%0.4354%0.54SS..Hα-helixtrans-69.4-40.1178.4-175.7-99.4000111.2V56 D57 M63 I64V56-F60 HydrophobicContact CG1-CB 3.55Å; V56-F60 HydrophobicContact CG1-CD1 3.37Å; V56-F60 HydrophobicContact CG1-CE1 4.21Å; V56-F60 HydrophobicContact CG1-CG 3.66Å; D57-F60 WeakPolarHBondContact O-CB 3.45Å; D57-F60 PolarHBondContact O-N 2.9Å; F60-M63 HydrophobicContact CD2-CE 4.24Å; F60-M63 HydrophobicContact CE2-CE 4.38Å; F60-M63 PolarHBondContact O-N 3.39Å; F60-I64 HydrophobicContact CD1-CD1 3.68Å; F60-I64 HydrophobicContact CD1-CG1 4.38Å; F60-I64 HydrophobicContact CE1-CD1 3.19Å; F60-I64 HydrophobicContact CE1-CG1 4.15Å; F60-I64 HydrophobicContact CZ-CD1 3.69Å; F60-I64 HydrophobicContact CZ-CG1 4.39Å; F60-I64 WeakPolarHBondContact O-CG1 3.36Å; F60-I64 PolarHBondContact O-N 3.4Å
61F64.6Low63.1Low85 Ų8599.8 Ų99.837%0.37352%0.518SS..Hα-helixtrans-62.7-44.2173.7-111.6-90.3000112.2V53 A58 M63 I64 M65V53-F61 HydrophobicContact CB-CE2 3.92Å; V53-F61 HydrophobicContact CB-CZ 4.3Å; V53-F61 HydrophobicContact CG1-CD2 4.05Å; V53-F61 HydrophobicContact CG1-CE2 3.31Å; V53-F61 HydrophobicContact CG1-CZ 3.7Å; V53-F61 HydrophobicContact CG2-CE2 3.47Å; V53-F61 VanDerWaalsContact CG2-CE2 3.47Å; V53-F61 HydrophobicContact CG2-CZ 3.58Å; A58-F61 PolarHBondContact O-N 2.93Å; F61-M63 VanDerWaalsContact C-N 3.31Å; F61-M63 PolarHBondContact O-N 3.38Å; F61-I64 PolarHBondContact O-N 3.47Å; F61-M65 WeakPolarHBondContact O-CB 3.42Å; F61-M65 WeakPolarHBondContact O-CG 3.31Å; F61-M65 PolarHBondContact O-N 2.88Å
62A67.4Low63.5Low50 Ų5092.9 Ų92.941%0.41351%0.507SS..Hα-helixtrans-60.3-42.4175.200000111.4A58 S59 M65 V66A58-A62 PolarHBondContact O-N 3.44Å; S59-A62 PolarHBondContact O-N 2.92Å; A62-M65 PolarHBondContact O-N 3.12Å; A62-V66 WeakPolarHBondContact O-CG2 3.17Å; A62-V66 PolarHBondContact O-N 2.97Å
63M65.1Low64.1Low78 Ų7896.5 Ų96.538%0.38451%0.513SS..Hα-helixtrans-63.7-46.3177.7-168.7177.575.200112.2S59 F60 F61 M65 V66 D67S59-M63 WeakPolarHBondContact O-CB 3.36Å; S59-M63 PolarHBondContact O-N 2.64Å; F60-M63 HydrophobicContact CD2-CE 4.24Å; F60-M63 HydrophobicContact CE2-CE 4.38Å; F60-M63 PolarHBondContact O-N 3.39Å; F61-M63 VanDerWaalsContact C-N 3.31Å; F61-M63 PolarHBondContact O-N 3.38Å; M63-M65 VanDerWaalsContact C-N 3.28Å; M63-M65 PolarHBondContact O-N 2.98Å; M63-V66 PolarHBondContact O-N 3.47Å; M63-D67 PolarHBondContact O-N 3.14Å
64I66.8Low64.8Low55 Ų5599.9 Ų99.928%0.28253%0.528SS..Hα-helixtrans-60.2-40.4175.6-71.4179.1000110.9F60 F61 D67 R68F60-I64 HydrophobicContact CD1-CD1 3.68Å; F60-I64 HydrophobicContact CD1-CG1 4.38Å; F60-I64 HydrophobicContact CE1-CD1 3.19Å; F60-I64 HydrophobicContact CE1-CG1 4.15Å; F60-I64 HydrophobicContact CZ-CD1 3.69Å; F60-I64 HydrophobicContact CZ-CG1 4.39Å; F60-I64 WeakPolarHBondContact O-CG1 3.36Å; F60-I64 PolarHBondContact O-N 3.4Å; F61-I64 PolarHBondContact O-N 3.47Å; I64-D67 PolarHBondContact O-N 3.4Å; I64-R68 HydrophobicContact CG2-CG 4.48Å; I64-R68 WeakPolarHBondContact O-CB 3.45Å; I64-R68 WeakPolarHBondContact O-CG 3.38Å; I64-R68 PolarHBondContact O-N 2.9Å
65M69.2Low65Low116 Ų11697.1 Ų97.157%0.57150%0.501SS*.Hα-helixtrans-66.7-41.4178.3-77.8-159.8-85.200112.3F61 A62 M63 D67 R68 F69F61-M65 WeakPolarHBondContact O-CB 3.42Å; F61-M65 WeakPolarHBondContact O-CG 3.31Å; F61-M65 PolarHBondContact O-N 2.88Å; A62-M65 PolarHBondContact O-N 3.12Å; M63-M65 VanDerWaalsContact C-N 3.28Å; M63-M65 PolarHBondContact O-N 2.98Å; M65-D67 VanDerWaalsContact C-N 3.34Å; M65-R68 PolarHBondContact O-N 2.97Å; M65-F69 WeakPolarHBondContact O-CB 3.37Å; M65-F69 PolarHBondContact O-N 3.24Å
66V68.4Low65.3Low86 Ų8693.8 Ų93.852%0.52150%0.496SS..Hα-helixtrans-62.4-43.4175.6172.40000110.7A62 M63 F69 L70A62-V66 WeakPolarHBondContact O-CG2 3.17Å; A62-V66 PolarHBondContact O-N 2.97Å; M63-V66 PolarHBondContact O-N 3.47Å; V66-F69 PolarHBondContact O-N 3.3Å; V66-L70 HydrophobicContact CG1-CD1 3.93Å; V66-L70 WeakPolarHBondContact O-CB 3.27Å; V66-L70 WeakPolarHBondContact O-CG 3.31Å; V66-L70 PolarHBondContact O-N 3.44Å
67D67.6Low65.8Low27 Ų2795.5 Ų95.514%0.14451%0.507CS..Hα-helixtrans-66.3-40177.7-84.7-18.4000112.3M63 I64 M65 F69 F71 F86 R93M63-D67 PolarHBondContact O-N 3.14Å; I64-D67 PolarHBondContact O-N 3.4Å; M65-D67 VanDerWaalsContact C-N 3.34Å; D67-F69 VanDerWaalsContact C-N 3.33Å; D67-F69 PolarHBondContact O-N 2.93Å; D67-F71 VanDerWaalsContact O-CB 3.28Å; D67-F71 WeakPolarHBondContact O-CB 3.24Å; D67-F71 PolarHBondContact O-N 2.86Å; D67-F86 HydrophobicContact CB-CE2 4.45Å; D67-F86 HydrophobicContact CB-CZ 4.48Å; D67-R93 IonicContact OD1-CZ 2.81Å; D67-R93 IonicContact OD1-NH1 2.86Å; D67-R93 PolarHBondContact OD1-NH1 2.97Å; D67-R93 IonicContact OD1-NH2 3.67Å; D67-R93 IonicContact OD2-NH1 2.72Å; D67-R93 PolarHBondContact OD2-NH1 3.34Å
68R64.5Low65.9Low182 Ų18294.8 Ų94.869%0.68751%0.509SS*.Hα-helixtrans-62.4-40.6172.3-79.2-177109.8149.14.3111.9I64 M65 F71 A72I64-R68 HydrophobicContact CG2-CG 4.48Å; I64-R68 WeakPolarHBondContact O-CB 3.45Å; I64-R68 WeakPolarHBondContact O-CG 3.38Å; I64-R68 PolarHBondContact O-N 2.9Å; M65-R68 PolarHBondContact O-N 2.97Å; R68-F71 PolarHBondContact O-N 3.46Å; R68-A72 WeakPolarHBondContact O-CB 3.41Å; R68-A72 PolarHBondContact O-N 3.13Å
69F68.5Low66.5Low147 Ų14793.3 Ų93.365%0.64549%0.493SS*.Hα-helixtrans-69.7-40.7-178.7-151.3-85.7000111.8M65 V66 D67 R73M65-F69 WeakPolarHBondContact O-CB 3.37Å; M65-F69 PolarHBondContact O-N 3.24Å; V66-F69 PolarHBondContact O-N 3.3Å; D67-F69 VanDerWaalsContact C-N 3.33Å; D67-F69 PolarHBondContact O-N 2.93Å; F69-R73 PolarHBondContact O-N 3.4Å
70L68.1Low67.2Low87 Ų8793 Ų9346%0.45550%0.496SS..Hα-helixtrans-64.8-41.6173-75.6168.3000111.3V66 R73 I74V66-L70 HydrophobicContact CG1-CD1 3.93Å; V66-L70 WeakPolarHBondContact O-CB 3.27Å; V66-L70 WeakPolarHBondContact O-CG 3.31Å; V66-L70 PolarHBondContact O-N 3.44Å; L70-R73 PolarHBondContact O-N 2.89Å; L70-I74 VanDerWaalsContact O-CG1 3.32Å; L70-I74 WeakPolarHBondContact O-CG1 3.27Å; L70-I74 PolarHBondContact O-N 3.46Å
71F64Low67.9Low48 Ų4895.5 Ų95.521%0.21151%0.509CS..Hα-helixtrans-63.9-45.3177.5-171.7-98.6000112.2D67 R68 R73 I74 V75 F86D67-F71 VanDerWaalsContact O-CB 3.28Å; D67-F71 WeakPolarHBondContact O-CB 3.24Å; D67-F71 PolarHBondContact O-N 2.86Å; R68-F71 PolarHBondContact O-N 3.46Å; F71-R73 PolarHBondContact O-N 3.43Å; F71-I74 PolarHBondContact O-N 3.39Å; F71-I74 VanDerWaalsContact O-N 3.12Å; F71-V75 HydrophobicContact CD2-CB 4.47Å; F71-V75 HydrophobicContact CD2-CG2 4.07Å; F71-V75 HydrophobicContact CE1-CB 4.08Å; F71-V75 HydrophobicContact CE1-CG1 4.4Å; F71-V75 HydrophobicContact CE2-CB 3.98Å; F71-V75 HydrophobicContact CE2-CG1 4.5Å; F71-V75 HydrophobicContact CE2-CG2 3.57Å; F71-V75 HydrophobicContact CZ-CB 3.78Å; F71-V75 HydrophobicContact CZ-CG1 3.97Å; F71-V75 HydrophobicContact CZ-CG2 3.88Å; F71-V75 PolarHBondContact O-N 2.89Å; F71-F86 HydrophobicContact CB-CD2 4.2Å; F71-F86 HydrophobicContact CB-CE2 4.07Å; F71-F86 HydrophobicContact CD2-CB 4Å; F71-F86 AromaticContact CD2-CD2 3.4Å; F71-F86 HydrophobicContact CD2-CD2 3.4Å; F71-F86 VanDerWaalsContact CD2-CD2 3.4Å; F71-F86 HydrophobicContact CD2-CE2 4.14Å; F71-F86 AromaticContact CD2-CG 3.93Å; F71-F86 HydrophobicContact CD2-CG 3.93Å; F71-F86 HydrophobicContact CE2-CB 3.6Å; F71-F86 AromaticContact CE2-CD2 3.95Å; F71-F86 HydrophobicContact CE2-CD2 3.95Å; F71-F86 HydrophobicContact CE2-CG 4.03Å; F71-F86 AromaticContact CG-CD2 3.9Å; F71-F86 HydrophobicContact CG-CD2 3.9Å; F71-F86 HydrophobicContact CG-CE2 4.23Å; F71-F86 HydrophobicContact CG-CG 4.45Å; F71-F86 HydrophobicContact CZ-CB 4.14Å
72A65.8Low68.7Low70 Ų7091.6 Ų91.658%0.57949%0.493SS*.Hα-helixtrans-59.2-29.1176.500000112.5R68R68-A72 WeakPolarHBondContact O-CB 3.41Å; R68-A72 PolarHBondContact O-N 3.13Å
73R65.7Low69.3Low208 Ų20892 Ų9279%0.78549%0.492SS*.Hα-helixtrans-80.9-33.1175.8-109.1-171.4165.7166.9-1.7114.3F69 L70 F71F69-R73 PolarHBondContact O-N 3.4Å; L70-R73 PolarHBondContact O-N 2.89Å; F71-R73 PolarHBondContact O-N 3.43Å
74I67.1Low70Confident129 Ų12997.1 Ų97.166%0.66251%0.507SS*.Hα-helixtrans-89.4-34.3-174.3-65.3166.7000111.5L70 F71 P76L70-I74 VanDerWaalsContact O-CG1 3.32Å; L70-I74 WeakPolarHBondContact O-CG1 3.27Å; L70-I74 PolarHBondContact O-N 3.46Å; F71-I74 PolarHBondContact O-N 3.39Å; F71-I74 VanDerWaalsContact O-N 3.12Å; I74-P76 VanDerWaalsContact O-CD 3.26Å; I74-P76 WeakPolarHBondContact O-CD 3.43Å
75V62.5Low70.8Confident38 Ų38100.2 Ų100.223%0.2352%0.524CS..  trans-119.284.1-175.7-173.30000109.1F71 T77F71-V75 HydrophobicContact CD2-CB 4.47Å; F71-V75 HydrophobicContact CD2-CG2 4.07Å; F71-V75 HydrophobicContact CE1-CB 4.08Å; F71-V75 HydrophobicContact CE1-CG1 4.4Å; F71-V75 HydrophobicContact CE2-CB 3.98Å; F71-V75 HydrophobicContact CE2-CG1 4.5Å; F71-V75 HydrophobicContact CE2-CG2 3.57Å; F71-V75 HydrophobicContact CZ-CB 3.78Å; F71-V75 HydrophobicContact CZ-CG1 3.97Å; F71-V75 HydrophobicContact CZ-CG2 3.88Å; F71-V75 PolarHBondContact O-N 2.89Å; V75-T77 VanDerWaalsContact CG1-O 3.25Å; V75-T77 WeakPolarHBondContact CG1-O 3.46Å; V75-T77 PolarHBondContact O-N 3.25Å
76P64.1Low71.4Confident114 Ų11497.5 Ų97.574%0.7451%0.509SS*.SBendtrans-67.7-5.1-174.723.5-32000114.3I74I74-P76 VanDerWaalsContact O-CD 3.26Å; I74-P76 WeakPolarHBondContact O-CD 3.43Å
77T65.1Low72.3Confident96 Ų9698 Ų9859%0.58951%0.508SS*.SBendtrans-136.812517453.30000110.2V75 S79V75-T77 VanDerWaalsContact CG1-O 3.25Å; V75-T77 WeakPolarHBondContact CG1-O 3.46Å; V75-T77 PolarHBondContact O-N 3.25Å; T77-S79 PolarHBondContact O-N 3.46Å
78P65.5Low73.3Confident111 Ų111101.6 Ų101.672%0.72153%0.526SS*.  trans-70.676.2175.830.5-34.4000109.2
79S78.5Confident74.3Confident51 Ų5195 Ų9536%0.35751%0.511SS..  trans-72.6145.9164.376.20000107.8T77 Q81 G82 C83T77-S79 PolarHBondContact O-N 3.46Å; S79-Q81 PolarHBondContact O-N 3.38Å; S79-G82 WeakPolarHBondContact O-CA 3.34Å; S79-G82 PolarHBondContact O-N 2.95Å; S79-G82 PolarHBondContact OG-N 3.01Å; S79-G82 VanDerWaalsContact OG-N 3.12Å; S79-C83 PolarHBondContact O-N 3.04Å
80A78.3Confident75.2Confident77 Ų7791.7 Ų91.764%0.63650%0.499SS*.Hα-helixtrans-54-28175.300000112.2R84A80-R84 WeakPolarHBondContact O-CG 3.17Å; A80-R84 PolarHBondContact O-N 3.33Å
81Q80.4Confident76.3Confident150 Ų15091.4 Ų91.470%0.70150%0.497SS*.Hα-helixtrans-68.3-40.8172.6-68.8-179.1-6.100112.5S79 C83 R84 L85S79-Q81 PolarHBondContact O-N 3.38Å; Q81-C83 PolarHBondContact O-N 3.28Å; Q81-R84 PolarHBondContact O-N 3.38Å; Q81-L85 WeakPolarHBondContact O-CG 3.36Å; Q81-L85 PolarHBondContact O-N 3.34Å
82G79.6Confident77.5Confident4 Ų492.2 Ų92.24%0.04151%0.506CS..Hα-helixtrans-59.9-44.6175.500000112.6S79 R84 L85 F86S79-G82 WeakPolarHBondContact O-CA 3.34Å; S79-G82 PolarHBondContact O-N 2.95Å; S79-G82 PolarHBondContact OG-N 3.01Å; S79-G82 VanDerWaalsContact OG-N 3.12Å; G82-R84 PolarHBondContact O-N 3.32Å; G82-L85 PolarHBondContact O-N 3.26Å; G82-F86 PolarHBondContact O-N 3Å
83C80Confident78.6Confident59 Ų5995.5 Ų95.540%0.39950%0.503SS..Hα-helixtrans-62.9-40.6176-63.10000112.2S79 Q81 F86 I87S79-C83 PolarHBondContact O-N 3.04Å; Q81-C83 PolarHBondContact O-N 3.28Å; C83-F86 PolarHBondContact O-N 3.45Å; C83-I87 WeakPolarHBondContact O-CG1 3.45Å; C83-I87 PolarHBondContact O-N 2.9Å
84R81.6Confident79.7Confident185 Ų18593.6 Ų93.670%0.69850%0.496SS*.Hα-helixtrans-61.8-45.2175.7-74.7178.2179.1-170.7-0.5112.1A80 Q81 G82 F86 I87 L88A80-R84 WeakPolarHBondContact O-CG 3.17Å; A80-R84 PolarHBondContact O-N 3.33Å; Q81-R84 PolarHBondContact O-N 3.38Å; G82-R84 PolarHBondContact O-N 3.32Å; R84-F86 VanDerWaalsContact C-N 3.31Å; R84-F86 PolarHBondContact O-N 3.43Å; R84-I87 PolarHBondContact O-N 2.84Å; R84-L88 WeakPolarHBondContact O-CB 3.42Å; R84-L88 WeakPolarHBondContact O-CG 3.3Å; R84-L88 PolarHBondContact O-N 3.34Å
85L83.5Confident80.9Confident120 Ų12092.7 Ų92.763%0.62849%0.489SS*.Hα-helixtrans-63.5-37.3177-70.7174.4000112Q81 G82 L88 A89Q81-L85 WeakPolarHBondContact O-CG 3.36Å; Q81-L85 PolarHBondContact O-N 3.34Å; G82-L85 PolarHBondContact O-N 3.26Å; L85-L88 PolarHBondContact O-N 3.49Å; L85-A89 WeakPolarHBondContact O-CB 3.37Å; L85-A89 PolarHBondContact O-N 3.02Å
86F81.7Confident82.2Confident58 Ų5898.7 Ų98.725%0.25451%0.508SS..Hα-helixtrans-65-47.1175.8-175.2-109.5000112.5D67 F71 G82 C83 R84 L88 A89 I90D67-F86 HydrophobicContact CB-CE2 4.45Å; D67-F86 HydrophobicContact CB-CZ 4.48Å; F71-F86 HydrophobicContact CB-CD2 4.2Å; F71-F86 HydrophobicContact CB-CE2 4.07Å; F71-F86 HydrophobicContact CD2-CB 4Å; F71-F86 AromaticContact CD2-CD2 3.4Å; F71-F86 HydrophobicContact CD2-CD2 3.4Å; F71-F86 VanDerWaalsContact CD2-CD2 3.4Å; F71-F86 HydrophobicContact CD2-CE2 4.14Å; F71-F86 AromaticContact CD2-CG 3.93Å; F71-F86 HydrophobicContact CD2-CG 3.93Å; F71-F86 HydrophobicContact CE2-CB 3.6Å; F71-F86 AromaticContact CE2-CD2 3.95Å; F71-F86 HydrophobicContact CE2-CD2 3.95Å; F71-F86 HydrophobicContact CE2-CG 4.03Å; F71-F86 AromaticContact CG-CD2 3.9Å; F71-F86 HydrophobicContact CG-CD2 3.9Å; F71-F86 HydrophobicContact CG-CE2 4.23Å; F71-F86 HydrophobicContact CG-CG 4.45Å; F71-F86 HydrophobicContact CZ-CB 4.14Å; G82-F86 PolarHBondContact O-N 3Å; C83-F86 PolarHBondContact O-N 3.45Å; R84-F86 VanDerWaalsContact C-N 3.31Å; R84-F86 PolarHBondContact O-N 3.43Å; F86-L88 VanDerWaalsContact C-N 3.33Å; F86-L88 PolarHBondContact O-N 3.25Å; F86-A89 WeakPolarHBondContact O-CB 3.4Å; F86-A89 PolarHBondContact O-N 3.26Å; F86-I90 HydrophobicContact CD1-CD1 3.8Å; F86-I90 HydrophobicContact CE1-CD1 3.3Å; F86-I90 HydrophobicContact CE1-CG1 4.33Å; F86-I90 HydrophobicContact CE2-CD1 4.36Å; F86-I90 HydrophobicContact CZ-CD1 3.63Å; F86-I90 HydrophobicContact CZ-CG1 4.33Å; F86-I90 PolarHBondContact O-N 3.38Å
87I86.8Confident83.5Confident98 Ų9899.8 Ų99.850%0.50350%0.497SS..Hα-helixtrans-60.6-44.6176.8-67.7167.6000110.2C83 R84 A89 I90 I91C83-I87 WeakPolarHBondContact O-CG1 3.45Å; C83-I87 PolarHBondContact O-N 2.9Å; R84-I87 PolarHBondContact O-N 2.84Å; I87-A89 VanDerWaalsContact C-N 3.34Å; I87-A89 PolarHBondContact O-N 3.36Å; I87-I90 PolarHBondContact O-N 2.93Å; I87-I91 HydrophobicContact CG2-CD1 3.78Å; I87-I91 HydrophobicContact CG2-CG1 4.42Å; I87-I91 WeakPolarHBondContact O-CG1 3.43Å; I87-I91 PolarHBondContact O-N 3.47Å
88L87.4Confident84.7Confident102 Ų10299.8 Ų99.853%0.53449%0.49SS..Hα-helixtrans-60.3-42175.1-73.4172.7000112R84 L85 F86 I90 I91 V92R84-L88 WeakPolarHBondContact O-CB 3.42Å; R84-L88 WeakPolarHBondContact O-CG 3.3Å; R84-L88 PolarHBondContact O-N 3.34Å; L85-L88 PolarHBondContact O-N 3.49Å; F86-L88 VanDerWaalsContact C-N 3.33Å; F86-L88 PolarHBondContact O-N 3.25Å; L88-I90 VanDerWaalsContact C-N 3.35Å; L88-I90 PolarHBondContact O-N 2.9Å; L88-I91 PolarHBondContact O-N 2.82Å; L88-V92 WeakPolarHBondContact O-CB 3.42Å; L88-V92 WeakPolarHBondContact O-CG2 3.38Å; L88-V92 PolarHBondContact O-N 3.34Å
89A86.6Confident86Confident44 Ų4498.8 Ų98.836%0.36448%0.482SS..Hα-helixtrans-62.8-39.5177.100000112.5L85 F86 I87 R93L85-A89 WeakPolarHBondContact O-CB 3.37Å; L85-A89 PolarHBondContact O-N 3.02Å; F86-A89 WeakPolarHBondContact O-CB 3.4Å; F86-A89 PolarHBondContact O-N 3.26Å; I87-A89 VanDerWaalsContact C-N 3.34Å; I87-A89 PolarHBondContact O-N 3.36Å; A89-R93 WeakPolarHBondContact O-CB 3.43Å; A89-R93 VanDerWaalsContact O-CG 3.31Å; A89-R93 WeakPolarHBondContact O-CG 3.32Å; A89-R93 PolarHBondContact O-N 3.04Å
90I87.3Confident86.6Confident77 Ų77101.9 Ų101.940%0.39549%0.491SS..Hα-helixtrans-64.4-48.5174.7-69.2172.1000110.8F86 I87 L88 V92 R93 R94F86-I90 HydrophobicContact CD1-CD1 3.8Å; F86-I90 HydrophobicContact CE1-CD1 3.3Å; F86-I90 HydrophobicContact CE1-CG1 4.33Å; F86-I90 HydrophobicContact CE2-CD1 4.36Å; F86-I90 HydrophobicContact CZ-CD1 3.63Å; F86-I90 HydrophobicContact CZ-CG1 4.33Å; F86-I90 PolarHBondContact O-N 3.38Å; I87-I90 PolarHBondContact O-N 2.93Å; L88-I90 VanDerWaalsContact C-N 3.35Å; L88-I90 PolarHBondContact O-N 2.9Å; I90-V92 VanDerWaalsContact C-N 3.34Å; I90-V92 PolarHBondContact O-N 3.15Å; I90-R93 PolarHBondContact O-N 3.35Å; I90-R94 WeakPolarHBondContact O-CB 3.32Å; I90-R94 PolarHBondContact O-N 3.44Å
91I91.5Very high87.3Confident81 Ų81102.7 Ų102.742%0.41548%0.484SS..Hα-helixtrans-59.6-47.8180-68.1168000110.1I87 L88 R94 Q95I87-I91 HydrophobicContact CG2-CD1 3.78Å; I87-I91 HydrophobicContact CG2-CG1 4.42Å; I87-I91 WeakPolarHBondContact O-CG1 3.43Å; I87-I91 PolarHBondContact O-N 3.47Å; L88-I91 PolarHBondContact O-N 2.82Å; I91-R94 PolarHBondContact O-N 2.84Å; I91-Q95 WeakPolarHBondContact O-CG 3.26Å; I91-Q95 PolarHBondContact O-N 2.81Å
92V89.3Confident88Confident64 Ų64102 Ų10239%0.38848%0.479SS..Hα-helixtrans-60.8-49.3178.4169.80000110.3L88 I90 R94 Q95 W96L88-V92 WeakPolarHBondContact O-CB 3.42Å; L88-V92 WeakPolarHBondContact O-CG2 3.38Å; L88-V92 PolarHBondContact O-N 3.34Å; I90-V92 VanDerWaalsContact C-N 3.34Å; I90-V92 PolarHBondContact O-N 3.15Å; V92-R94 VanDerWaalsContact C-N 3.28Å; V92-R94 PolarHBondContact O-N 2.95Å; V92-Q95 WeakPolarHBondContact O-CB 3.3Å; V92-Q95 PolarHBondContact O-N 3.31Å; V92-Q95 VanDerWaalsContact O-N 3.16Å; V92-W96 PolarHBondContact O-N 2.9Å
93R88.4Confident88.7Confident139 Ų139104 Ų10453%0.52549%0.492SS..Hα-helixtrans-58.9-38.4177-79-180-177.8175.30.1113.2D67 A89 I90 W96 R97D67-R93 IonicContact OD1-CZ 2.81Å; D67-R93 IonicContact OD1-NH1 2.86Å; D67-R93 PolarHBondContact OD1-NH1 2.97Å; D67-R93 IonicContact OD1-NH2 3.67Å; D67-R93 IonicContact OD2-NH1 2.72Å; D67-R93 PolarHBondContact OD2-NH1 3.34Å; A89-R93 WeakPolarHBondContact O-CB 3.43Å; A89-R93 VanDerWaalsContact O-CG 3.31Å; A89-R93 WeakPolarHBondContact O-CG 3.32Å; A89-R93 PolarHBondContact O-N 3.04Å; I90-R93 PolarHBondContact O-N 3.35Å; R93-W96 PolarHBondContact O-N 3.03Å; R93-R97 PolarHBondContact O-N 2.71Å
94R89.6Confident89.4Confident168 Ų168105.8 Ų105.863%0.63450%0.497SS*.Hα-helixtrans-63.6-48.1175.5179178.9171.1177.90.7110.7I90 I91 V92 W96 R97 E98I90-R94 WeakPolarHBondContact O-CB 3.32Å; I90-R94 PolarHBondContact O-N 3.44Å; I91-R94 PolarHBondContact O-N 2.84Å; V92-R94 VanDerWaalsContact C-N 3.28Å; V92-R94 PolarHBondContact O-N 2.95Å; R94-W96 VanDerWaalsContact C-N 3.33Å; R94-W96 PolarHBondContact O-N 3.4Å; R94-R97 PolarHBondContact O-N 3.12Å; R94-E98 WeakPolarHBondContact CG-OE1 3.48Å; R94-E98 IonicContact CZ-OE1 3.63Å; R94-E98 IonicContact NE-OE1 3.98Å; R94-E98 PolarHBondContact NE-OE1 3.13Å; R94-E98 IonicContact NH2-OE1 3.62Å; R94-E98 PolarHBondContact NH2-OE1 2.98Å; R94-E98 WeakPolarHBondContact O-CG 3.32Å; R94-E98 PolarHBondContact O-N 2.71Å
95Q90.4Very high90.1Very high111 Ų11199.6 Ų99.652%0.51949%0.486SS..Hα-helixtrans-59.3-42.9175.7-72.8179.5-25.200111.9I91 V92 R97 E98 V99I91-Q95 WeakPolarHBondContact O-CG 3.26Å; I91-Q95 PolarHBondContact O-N 2.81Å; V92-Q95 WeakPolarHBondContact O-CB 3.3Å; V92-Q95 PolarHBondContact O-N 3.31Å; V92-Q95 VanDerWaalsContact O-N 3.16Å; Q95-R97 VanDerWaalsContact C-N 3.35Å; Q95-R97 PolarHBondContact O-N 2.88Å; Q95-E98 PolarHBondContact O-N 3.46Å; Q95-V99 VanDerWaalsContact O-CG2 3.31Å; Q95-V99 WeakPolarHBondContact O-CG2 3.4Å; Q95-V99 PolarHBondContact O-N 3.45Å
96W90Very high90.7Very high163 Ų16399.1 Ų99.162%0.61748%0.481SS*.Hα-helixtrans-60.2-43.8175.2-81103.1000112.1V92 R93 R94 V99 E100V92-W96 PolarHBondContact O-N 2.9Å; R93-W96 PolarHBondContact O-N 3.03Å; R94-W96 VanDerWaalsContact C-N 3.33Å; R94-W96 PolarHBondContact O-N 3.4Å; W96-V99 PolarHBondContact O-N 3.19Å; W96-E100 WeakPolarHBondContact O-CB 3.44Å; W96-E100 WeakPolarHBondContact O-CG 3.36Å; W96-E100 PolarHBondContact O-N 3.42Å
97R91.5Very high91.5Very high138 Ų138103.1 Ų103.152%0.52150%0.498SS..Hα-helixtrans-63.4-43.9176.4-170.5-176.4-59.4-117.20.7111.9R93 R94 Q95 V99 E100 D101R93-R97 PolarHBondContact O-N 2.71Å; R94-R97 PolarHBondContact O-N 3.12Å; Q95-R97 VanDerWaalsContact C-N 3.35Å; Q95-R97 PolarHBondContact O-N 2.88Å; R97-V99 VanDerWaalsContact C-N 3.28Å; R97-V99 PolarHBondContact O-N 3.49Å; R97-E100 PolarHBondContact O-N 3.17Å; R97-D101 WeakPolarHBondContact O-CB 3.47Å; R97-D101 VanDerWaalsContact O-CG 3.26Å; R97-D101 PolarHBondContact O-N 3.34Å
98E91.5Very high92Very high96 Ų96103.6 Ų103.645%0.44950%0.501SS..Hα-helixtrans-60.3-39.4176.6-72.4170.4-17500111.4R94 Q95 F102R94-E98 WeakPolarHBondContact CG-OE1 3.48Å; R94-E98 IonicContact CZ-OE1 3.63Å; R94-E98 IonicContact NE-OE1 3.98Å; R94-E98 PolarHBondContact NE-OE1 3.13Å; R94-E98 IonicContact NH2-OE1 3.62Å; R94-E98 PolarHBondContact NH2-OE1 2.98Å; R94-E98 WeakPolarHBondContact O-CG 3.32Å; R94-E98 PolarHBondContact O-N 2.71Å; Q95-E98 PolarHBondContact O-N 3.46Å; E98-F102 VanDerWaalsContact O-CB 3.23Å; E98-F102 WeakPolarHBondContact O-CB 3.49Å; E98-F102 PolarHBondContact O-N 3.22Å
99V91.5Very high92.5Very high89 Ų89105.3 Ų105.354%0.53951%0.506SS..Hα-helixtrans-68.7-43.2175171.90000112Q95 W96 R97 F102 S103Q95-V99 VanDerWaalsContact O-CG2 3.31Å; Q95-V99 WeakPolarHBondContact O-CG2 3.4Å; Q95-V99 PolarHBondContact O-N 3.45Å; W96-V99 PolarHBondContact O-N 3.19Å; R97-V99 VanDerWaalsContact C-N 3.28Å; R97-V99 PolarHBondContact O-N 3.49Å; V99-F102 PolarHBondContact O-N 3.04Å; V99-S103 WeakPolarHBondContact O-CB 3.5Å; V99-S103 PolarHBondContact O-N 3.47Å
100E91.5Very high93Very high117 Ų117108.6 Ų108.655%0.54751%0.514SS..Hα-helixtrans-61.7-48.2176.6-76.1174.6178.500111.1W96 R97 F102 S103 L104W96-E100 WeakPolarHBondContact O-CB 3.44Å; W96-E100 WeakPolarHBondContact O-CG 3.36Å; W96-E100 PolarHBondContact O-N 3.42Å; R97-E100 PolarHBondContact O-N 3.17Å; E100-F102 PolarHBondContact O-N 3.5Å; E100-S103 PolarHBondContact O-N 3.07Å; E100-S103 PolarHBondContact O-OG 2.91Å; E100-L104 PolarHBondContact O-N 3.07Å
101D94Very high93.5Very high93 Ų93109.7 Ų109.750%0.49752%0.524SS..Hα-helixtrans-62.3-42.7177.8-72.4-19.4000111.1R97 L104 A105R97-D101 WeakPolarHBondContact O-CB 3.47Å; R97-D101 VanDerWaalsContact O-CG 3.26Å; R97-D101 PolarHBondContact O-N 3.34Å; D101-L104 PolarHBondContact O-N 3.3Å; D101-A105 WeakPolarHBondContact O-CB 3.4Å; D101-A105 PolarHBondContact O-N 3.02Å
102F94.4Very high93.8Very high137 Ų137111.4 Ų111.460%0.60153%0.53SS*.Hα-helixtrans-60.2-46173.8178.1-96.7000111.7E98 V99 E100 L104 A105 Q106E98-F102 VanDerWaalsContact O-CB 3.23Å; E98-F102 WeakPolarHBondContact O-CB 3.49Å; E98-F102 PolarHBondContact O-N 3.22Å; V99-F102 PolarHBondContact O-N 3.04Å; E100-F102 PolarHBondContact O-N 3.5Å; F102-L104 VanDerWaalsContact C-N 3.28Å; F102-L104 PolarHBondContact O-N 3.39Å; F102-A105 PolarHBondContact O-N 3.07Å; F102-Q106 WeakPolarHBondContact O-CB 3.5Å; F102-Q106 PolarHBondContact O-N 3.47Å
103S94.3Very high94.2Very high45 Ų45114.2 Ų114.232%0.31554%0.538SS..Hα-helixtrans-63.7-35.2179.380.40000112.4V99 E100 K107V99-S103 WeakPolarHBondContact O-CB 3.5Å; V99-S103 PolarHBondContact O-N 3.47Å; E100-S103 PolarHBondContact O-N 3.07Å; E100-S103 PolarHBondContact O-OG 2.91Å; S103-K107 WeakPolarHBondContact O-CG 3.28Å; S103-K107 PolarHBondContact O-N 2.95Å; S103-K107 VanDerWaalsContact O-N 3.13Å
104L95.5Very high94.7Very high96 Ų96111.4 Ų111.450%0.50353%0.53SS..Hα-helixtrans-71.3-46.6176.1178.760.6000110.9E100 D101 F102 Q106 K107 L108E100-L104 PolarHBondContact O-N 3.07Å; D101-L104 PolarHBondContact O-N 3.3Å; F102-L104 VanDerWaalsContact C-N 3.28Å; F102-L104 PolarHBondContact O-N 3.39Å; L104-Q106 VanDerWaalsContact C-N 3.3Å; L104-Q106 PolarHBondContact O-N 3.35Å; L104-K107 PolarHBondContact O-N 2.92Å; L104-L108 HydrophobicContact CD1-CD1 4.41Å; L104-L108 HydrophobicContact CD1-CG 4.36Å; L104-L108 HydrophobicContact CG-CD1 4.22Å; L104-L108 WeakPolarHBondContact O-CG 3.49Å; L104-L108 PolarHBondContact O-N 3.1Å
105A95.6Very high95.1Very high56 Ų56110.4 Ų110.446%0.46353%0.531SS..Hα-helixtrans-58.2-44176.500000111.2D101 F102 K107 L108 Q109D101-A105 WeakPolarHBondContact O-CB 3.4Å; D101-A105 PolarHBondContact O-N 3.02Å; F102-A105 PolarHBondContact O-N 3.07Å; A105-K107 PolarHBondContact O-N 3.35Å; A105-L108 PolarHBondContact O-N 2.89Å; A105-Q109 WeakPolarHBondContact O-CB 3.45Å; A105-Q109 PolarHBondContact O-N 2.91Å
106Q96.8Very high95.5Very high110 Ų110109.5 Ų109.551%0.51453%0.526SS..Hα-helixtrans-61.1-44.2176.1-171.8-177.412.400111.9F102 L104 Q109 E110F102-Q106 WeakPolarHBondContact O-CB 3.5Å; F102-Q106 PolarHBondContact O-N 3.47Å; L104-Q106 VanDerWaalsContact C-N 3.3Å; L104-Q106 PolarHBondContact O-N 3.35Å; Q106-Q109 PolarHBondContact O-N 3.5Å; Q106-E110 WeakPolarHBondContact O-CB 3.48Å; Q106-E110 PolarHBondContact O-N 2.99Å
107K97.1Very high95.9Very high142 Ų142107.5 Ų107.562%0.61752%0.519SS*.Hα-helixtrans-63.3-42.3176.3-76171.5-177.51710112.3S103 L104 A105 Q109 E110 V111S103-K107 WeakPolarHBondContact O-CG 3.28Å; S103-K107 PolarHBondContact O-N 2.95Å; S103-K107 VanDerWaalsContact O-N 3.13Å; L104-K107 PolarHBondContact O-N 2.92Å; A105-K107 PolarHBondContact O-N 3.35Å; K107-Q109 VanDerWaalsContact C-N 3.35Å; K107-E110 PolarHBondContact O-N 3.21Å; K107-V111 VanDerWaalsContact O-CG2 3.28Å; K107-V111 WeakPolarHBondContact O-CG2 3.45Å; K107-V111 PolarHBondContact O-N 3.38Å
108L97.8Very high96.2Very high108 Ų108103.6 Ų103.657%0.56551%0.509SS*.Hα-helixtrans-64-43.1177.1-71.6174.1000111.1L104 A105 V111 E112L104-L108 HydrophobicContact CD1-CD1 4.41Å; L104-L108 HydrophobicContact CD1-CG 4.36Å; L104-L108 HydrophobicContact CG-CD1 4.22Å; L104-L108 WeakPolarHBondContact O-CG 3.49Å; L104-L108 PolarHBondContact O-N 3.1Å; A105-L108 PolarHBondContact O-N 2.89Å; L108-V111 PolarHBondContact O-N 3.04Å; L108-E112 WeakPolarHBondContact O-CB 3.31Å; L108-E112 PolarHBondContact O-N 3.4Å
109Q97.5Very high96.5Very high137 Ų137104.9 Ų104.964%0.6451%0.511SS*.Hα-helixtrans-61.6-43.5176-173.3177.721.200111.8A105 Q106 K107 E112 F113A105-Q109 WeakPolarHBondContact O-CB 3.45Å; A105-Q109 PolarHBondContact O-N 2.91Å; Q106-Q109 PolarHBondContact O-N 3.5Å; K107-Q109 VanDerWaalsContact C-N 3.35Å; Q109-E112 PolarHBondContact O-N 2.91Å; Q109-F113 VanDerWaalsContact O-CB 3.25Å; Q109-F113 WeakPolarHBondContact O-CB 3.37Å; Q109-F113 PolarHBondContact O-N 3.23Å
110E98Very high96.8Very high113 Ų113104.5 Ų104.553%0.52851%0.505SS..Hα-helixtrans-63-43.8177-175.659.6-147.600111.6Q106 K107 F113 Q114Q106-E110 WeakPolarHBondContact O-CB 3.48Å; Q106-E110 PolarHBondContact O-N 2.99Å; K107-E110 PolarHBondContact O-N 3.21Å; E110-F113 PolarHBondContact O-N 2.99Å; E110-Q114 VanDerWaalsContact O-CB 3.25Å; E110-Q114 WeakPolarHBondContact O-CB 3.45Å; E110-Q114 PolarHBondContact O-N 3.41Å
111V97.8Very high97.1Very high100 Ų100105.5 Ų105.561%0.60650%0.504SS*.Hα-helixtrans-62.7-44.2177.1169.70000111.4K107 L108 K115K107-V111 VanDerWaalsContact O-CG2 3.28Å; K107-V111 WeakPolarHBondContact O-CG2 3.45Å; K107-V111 PolarHBondContact O-N 3.38Å; L108-V111 PolarHBondContact O-N 3.04Å; V111-K115 WeakPolarHBondContact O-CB 3.39Å; V111-K115 PolarHBondContact O-N 3.43Å
112E97.6Very high97.3Very high118 Ų118106.6 Ų106.655%0.55151%0.506SS*.Hα-helixtrans-64.9-47.1177.2-179.1172.6-163.200111.5L108 Q109 Q114 K115 H116L108-E112 WeakPolarHBondContact O-CB 3.31Å; L108-E112 PolarHBondContact O-N 3.4Å; Q109-E112 PolarHBondContact O-N 2.91Å; E112-Q114 PolarHBondContact O-N 3.41Å; E112-K115 WeakPolarHBondContact O-CB 3.36Å; E112-K115 PolarHBondContact O-N 2.86Å; E112-H116 PolarHBondContact O-CD2 3.14Å; E112-H116 VanDerWaalsContact O-CD2 3.22Å; E112-H116 PolarHBondContact O-N 2.85Å
113F98.1Very high97.4Very high123 Ų123103.3 Ų103.354%0.53949%0.493SS..Hα-helixtrans-57.2-49.7176.7179.1-97000111Q109 E110 K115 H116 Y117Q109-F113 VanDerWaalsContact O-CB 3.25Å; Q109-F113 WeakPolarHBondContact O-CB 3.37Å; Q109-F113 PolarHBondContact O-N 3.23Å; E110-F113 PolarHBondContact O-N 2.99Å; F113-K115 VanDerWaalsContact C-N 3.31Å; F113-K115 PolarHBondContact O-N 2.9Å; F113-H116 PolarHBondContact O-N 3.35Å; F113-Y117 HydrophobicContact CZ-CD2 4.48Å; F113-Y117 VanDerWaalsContact O-CB 3.23Å; F113-Y117 WeakPolarHBondContact O-CB 3.3Å; F113-Y117 PolarHBondContact O-N 2.99Å
114Q98.2Very high97.5Very high80 Ų80109.9 Ų109.937%0.37451%0.511SS..Hα-helixtrans-63.7-38-178.9-173.1608.100112E110 E112 N118E110-Q114 VanDerWaalsContact O-CB 3.25Å; E110-Q114 WeakPolarHBondContact O-CB 3.45Å; E110-Q114 PolarHBondContact O-N 3.41Å; E112-Q114 PolarHBondContact O-N 3.41Å; Q114-N118 PolarHBondContact NE2-ND2 2.92Å; Q114-N118 PolarHBondContact NE2-OD1 3.39Å; Q114-N118 WeakPolarHBondContact O-CB 3.3Å; Q114-N118 PolarHBondContact O-N 3.46Å; Q114-N118 PolarHBondContact O-ND2 3.26Å; Q114-N118 VanDerWaalsContact O-ND2 3.16Å
115K98.1Very high97.6Very high147 Ų147110.6 Ų110.664%0.63951%0.511SS*.Hα-helixtrans-60.1-51.8173.8-179.4-173.7176.4-171.50111.3V111 E112 F113 N118 Y119V111-K115 WeakPolarHBondContact O-CB 3.39Å; V111-K115 PolarHBondContact O-N 3.43Å; E112-K115 WeakPolarHBondContact O-CB 3.36Å; E112-K115 PolarHBondContact O-N 2.86Å; F113-K115 VanDerWaalsContact C-N 3.31Å; F113-K115 PolarHBondContact O-N 2.9Å; K115-N118 PolarHBondContact O-N 3.4Å; K115-Y119 WeakPolarHBondContact O-CB 3.39Å; K115-Y119 PolarHBondContact O-N 2.96Å
116H98.3Very high97.6Very high91 Ų91112.1 Ų112.142%0.42151%0.512SS..Hα-helixtrans-68.3-36.3-179.6-76.5-67.4000112.7E112 F113 N120E112-H116 PolarHBondContact O-CD2 3.14Å; E112-H116 VanDerWaalsContact O-CD2 3.22Å; E112-H116 PolarHBondContact O-N 2.85Å; F113-H116 PolarHBondContact O-N 3.35Å; H116-N120 VanDerWaalsContact O-CB 3.31Å; H116-N120 WeakPolarHBondContact O-CB 3.38Å; H116-N120 PolarHBondContact O-N 3.38Å; H116-N120 PolarHBondContact O-ND2 3.41Å
117Y98.2Very high97.6Very high121 Ų121112 Ų11248%0.47551%0.512SS..Hα-helixtrans-61.9-48.5175.7-179.6-98.2000111.3F113 N120 R121F113-Y117 HydrophobicContact CZ-CD2 4.48Å; F113-Y117 VanDerWaalsContact O-CB 3.23Å; F113-Y117 WeakPolarHBondContact O-CB 3.3Å; F113-Y117 PolarHBondContact O-N 2.99Å; Y117-N120 PolarHBondContact O-N 2.92Å; Y117-R121 VanDerWaalsContact O-CB 3.3Å; Y117-R121 WeakPolarHBondContact O-CB 3.46Å; Y117-R121 PolarHBondContact O-N 2.86Å
118N98Very high97.5Very high56 Ų56106.3 Ų106.330%0.29950%0.495SS..Hα-helixtrans-63.4-45.9177.7-71-26000111.6Q114 K115 N120 R121 E122Q114-N118 PolarHBondContact NE2-ND2 2.92Å; Q114-N118 PolarHBondContact NE2-OD1 3.39Å; Q114-N118 WeakPolarHBondContact O-CB 3.3Å; Q114-N118 PolarHBondContact O-N 3.46Å; Q114-N118 PolarHBondContact O-ND2 3.26Å; Q114-N118 VanDerWaalsContact O-ND2 3.16Å; K115-N118 PolarHBondContact O-N 3.4Å; N118-N120 PolarHBondContact O-N 3.23Å; N118-R121 WeakPolarHBondContact O-CB 3.34Å; N118-R121 PolarHBondContact O-N 2.9Å; N118-E122 WeakPolarHBondContact O-CG 3.37Å; N118-E122 PolarHBondContact O-N 3.45Å
119Y98.1Very high97.5Very high124 Ų124103 Ų10349%0.48648%0.483SS..Hα-helixtrans-57.3-50.6176.3179.9-105000111.9K115 R121 E122 E123K115-Y119 WeakPolarHBondContact O-CB 3.39Å; K115-Y119 PolarHBondContact O-N 2.96Å; Y119-R121 VanDerWaalsContact C-N 3.26Å; Y119-R121 PolarHBondContact O-N 3.2Å; Y119-E122 PolarHBondContact O-N 3.39Å; Y119-E123 HydrophobicContact CD1-CG 4.25Å; Y119-E123 HydrophobicContact CD2-CG 4.46Å; Y119-E123 HydrophobicContact CE1-CG 3.78Å; Y119-E123 HydrophobicContact CE2-CG 3.97Å; Y119-E123 WeakPolarHBondContact CE2-OE1 3.44Å; Y119-E123 WeakPolarHBondContact O-CG 3.36Å; Y119-E123 PolarHBondContact O-N 2.98Å; Y119-E123 PolarHBondContact OH-OE1 2.88Å
120N97.8Very high97.5Very high81 Ų81101.5 Ų101.543%0.43348%0.479SS..Hα-helixtrans-63.1-33.3178.3-73.7-23.2000112.7H116 Y117 N118 R124H116-N120 VanDerWaalsContact O-CB 3.31Å; H116-N120 WeakPolarHBondContact O-CB 3.38Å; H116-N120 PolarHBondContact O-N 3.38Å; H116-N120 PolarHBondContact O-ND2 3.41Å; Y117-N120 PolarHBondContact O-N 2.92Å; N118-N120 PolarHBondContact O-N 3.23Å; N120-R124 WeakPolarHBondContact O-CB 3.5Å; N120-R124 VanDerWaalsContact O-CG 3.23Å; N120-R124 WeakPolarHBondContact O-CG 3.38Å; N120-R124 PolarHBondContact O-N 3.44Å
121R97.5Very high97.5Very high137 Ų137100.9 Ų100.952%0.51748%0.483SS..Hα-helixtrans-67.3-45175.8-176.5-177.3177.9-163.9-0.8111.1Y117 N118 Y119 R124 Q125Y117-R121 VanDerWaalsContact O-CB 3.3Å; Y117-R121 WeakPolarHBondContact O-CB 3.46Å; Y117-R121 PolarHBondContact O-N 2.86Å; N118-R121 WeakPolarHBondContact O-CB 3.34Å; N118-R121 PolarHBondContact O-N 2.9Å; Y119-R121 VanDerWaalsContact C-N 3.26Å; Y119-R121 PolarHBondContact O-N 3.2Å; R121-R124 PolarHBondContact O-N 3.07Å; R121-Q125 WeakPolarHBondContact O-CG 3.45Å; R121-Q125 PolarHBondContact O-N 3.01Å
122E97.9Very high97.4Very high116 Ų116103 Ų10354%0.54248%0.48SS..Hα-helixtrans-63.1-46.9176.1-72.4175.6-176.900111.3N118 Y119 R124 Q125 N126N118-E122 WeakPolarHBondContact O-CG 3.37Å; N118-E122 PolarHBondContact O-N 3.45Å; Y119-E122 PolarHBondContact O-N 3.39Å; E122-R124 VanDerWaalsContact C-N 3.32Å; E122-R124 PolarHBondContact O-N 3.2Å; E122-Q125 WeakPolarHBondContact O-CB 3.38Å; E122-Q125 PolarHBondContact O-N 3.01Å; E122-N126 PolarHBondContact O-N 3.01Å
123E97.1Very high97.4Very high69 Ų69102.5 Ų102.532%0.32248%0.481SS..Hα-helixtrans-56.9-43.7175.2-73.6-63.6150.100111.9Y119 Q125 N126 M127Y119-E123 HydrophobicContact CD1-CG 4.25Å; Y119-E123 HydrophobicContact CD2-CG 4.46Å; Y119-E123 HydrophobicContact CE1-CG 3.78Å; Y119-E123 HydrophobicContact CE2-CG 3.97Å; Y119-E123 WeakPolarHBondContact CE2-OE1 3.44Å; Y119-E123 WeakPolarHBondContact O-CG 3.36Å; Y119-E123 PolarHBondContact O-N 2.98Å; Y119-E123 PolarHBondContact OH-OE1 2.88Å; E123-Q125 VanDerWaalsContact C-N 3.32Å; E123-Q125 PolarHBondContact O-N 3.15Å; E123-N126 PolarHBondContact O-N 3.46Å; E123-M127 WeakPolarHBondContact O-CB 3.42Å; E123-M127 WeakPolarHBondContact O-CG 3.3Å; E123-M127 PolarHBondContact O-N 3.47Å
124R96.7Very high97.4Very high183 Ų18399.9 Ų99.969%0.69148%0.478SS*.Hα-helixtrans-64.2-36175.2-75174.7-174.5-170.53.4113N120 R121 E122 M127 G128N120-R124 WeakPolarHBondContact O-CB 3.5Å; N120-R124 VanDerWaalsContact O-CG 3.23Å; N120-R124 WeakPolarHBondContact O-CG 3.38Å; N120-R124 PolarHBondContact O-N 3.44Å; R121-R124 PolarHBondContact O-N 3.07Å; E122-R124 VanDerWaalsContact C-N 3.32Å; E122-R124 PolarHBondContact O-N 3.2Å; R124-M127 HydrophobicContact CG-CE 4.03Å; R124-G128 PolarHBondContact O-N 3.37Å
125Q96.5Very high97.4Very high110 Ų110102.6 Ų102.651%0.51449%0.488SS..Hα-helixtrans-67.1-43175.9-74.2178.51.400111.3R121 E122 E123 G128 A129R121-Q125 WeakPolarHBondContact O-CG 3.45Å; R121-Q125 PolarHBondContact O-N 3.01Å; E122-Q125 WeakPolarHBondContact O-CB 3.38Å; E122-Q125 PolarHBondContact O-N 3.01Å; E123-Q125 VanDerWaalsContact C-N 3.32Å; E123-Q125 PolarHBondContact O-N 3.15Å; Q125-G128 PolarHBondContact O-N 2.8Å; Q125-A129 PolarHBondContact O-N 3.46Å
126N96.9Very high97.4Very high89 Ų89104 Ų10448%0.47649%0.49SS..Hα-helixtrans-63-51.8176.7-68.6-13000111E122 E123 G128 A129 D130E122-N126 PolarHBondContact O-N 3.01Å; E123-N126 PolarHBondContact O-N 3.46Å; N126-G128 VanDerWaalsContact C-N 3.26Å; N126-G128 PolarHBondContact O-N 3.31Å; N126-A129 WeakPolarHBondContact O-CA 3.48Å; N126-A129 WeakPolarHBondContact O-CB 3.49Å; N126-A129 PolarHBondContact O-N 2.97Å; N126-D130 PolarHBondContact O-N 3.41Å
127M96.4Very high97.3Very high106 Ų106106 Ų10652%0.52250%0.499SS..Hα-helixtrans-55.8-42.2174.4-72.9-172.1-7100111.9E123 R124 A129 D130 V131E123-M127 WeakPolarHBondContact O-CB 3.42Å; E123-M127 WeakPolarHBondContact O-CG 3.3Å; E123-M127 PolarHBondContact O-N 3.47Å; R124-M127 HydrophobicContact CG-CE 4.03Å; M127-A129 VanDerWaalsContact C-N 3.3Å; M127-A129 PolarHBondContact O-N 3.35Å; M127-D130 PolarHBondContact O-N 2.93Å; M127-V131 VanDerWaalsContact O-CG2 3.26Å; M127-V131 WeakPolarHBondContact O-CG2 3.28Å; M127-V131 PolarHBondContact O-N 2.95Å
128G96Very high97.3Very high24 Ų24105.4 Ų105.425%0.24750%0.501CS..Hα-helixtrans-63.1-34.6176.100000113.2R124 Q125 N126 R132R124-G128 PolarHBondContact O-N 3.37Å; Q125-G128 PolarHBondContact O-N 2.8Å; N126-G128 VanDerWaalsContact C-N 3.26Å; N126-G128 PolarHBondContact O-N 3.31Å; G128-R132 WeakPolarHBondContact O-CG 3.39Å; G128-R132 VanDerWaalsContact O-CZ 3.25Å; G128-R132 PolarHBondContact O-N 3.34Å; G128-R132 PolarHBondContact O-NH1 3.15Å
129A96.5Very high97.3Very high39 Ų39107 Ų10732%0.32251%0.509SS..Hα-helixtrans-69.5-45.1174.700000111.7Q125 N126 M127 V131 R132 L133Q125-A129 PolarHBondContact O-N 3.46Å; N126-A129 WeakPolarHBondContact O-CA 3.48Å; N126-A129 WeakPolarHBondContact O-CB 3.49Å; N126-A129 PolarHBondContact O-N 2.97Å; M127-A129 VanDerWaalsContact C-N 3.3Å; M127-A129 PolarHBondContact O-N 3.35Å; A129-V131 PolarHBondContact O-N 3.02Å; A129-R132 PolarHBondContact O-N 2.98Å; A129-L133 PolarHBondContact O-N 2.93Å
130D98Very high97.3Very high104 Ų104103.7 Ų103.756%0.55651%0.507SS*.Hα-helixtrans-63.2-41.9179.4-67.1-15000111.8N126 M127 R132 L133 S134N126-D130 PolarHBondContact O-N 3.41Å; M127-D130 PolarHBondContact O-N 2.93Å; D130-R132 VanDerWaalsContact C-N 3.31Å; D130-R132 PolarHBondContact O-N 3.1Å; D130-L133 WeakPolarHBondContact O-CB 3.5Å; D130-L133 PolarHBondContact O-N 3.19Å; D130-S134 VanDerWaalsContact O-CB 3.3Å; D130-S134 WeakPolarHBondContact O-CB 3.44Å; D130-S134 PolarHBondContact O-N 3.11Å
131V97.1Very high97.2Very high101 Ų101104.5 Ų104.561%0.61251%0.508SS*.Hα-helixtrans-60.6-41.3175.2170.50000111.3M127 A129 K135M127-V131 VanDerWaalsContact O-CG2 3.26Å; M127-V131 WeakPolarHBondContact O-CG2 3.28Å; M127-V131 PolarHBondContact O-N 2.95Å; A129-V131 PolarHBondContact O-N 3.02Å; V131-K135 WeakPolarHBondContact O-CB 3.48Å; V131-K135 PolarHBondContact O-N 3.14Å
132R97.4Very high97.2Very high143 Ų143102.7 Ų102.754%0.5451%0.505SS..Hα-helixtrans-67.6-39.3176.8-72.2-173.8-58.2-90.92.7111.9G128 A129 D130 R136G128-R132 WeakPolarHBondContact O-CG 3.39Å; G128-R132 VanDerWaalsContact O-CZ 3.25Å; G128-R132 PolarHBondContact O-N 3.34Å; G128-R132 PolarHBondContact O-NH1 3.15Å; A129-R132 PolarHBondContact O-N 2.98Å; D130-R132 VanDerWaalsContact C-N 3.31Å; D130-R132 PolarHBondContact O-N 3.1Å; R132-R136 WeakPolarHBondContact O-CG 3.44Å; R132-R136 PolarHBondContact O-N 3.24Å
133L97.6Very high97.1Very high109 Ų109101 Ų10157%0.57151%0.505SS*.Hα-helixtrans-63.2-52.2175.9-173.297.9000110.4A129 D130 K135 R136 E137A129-L133 PolarHBondContact O-N 2.93Å; D130-L133 WeakPolarHBondContact O-CB 3.5Å; D130-L133 PolarHBondContact O-N 3.19Å; L133-K135 VanDerWaalsContact C-N 3.31Å; L133-K135 PolarHBondContact O-N 3.48Å; L133-R136 WeakPolarHBondContact O-CB 3.4Å; L133-R136 PolarHBondContact O-N 2.9Å; L133-E137 PolarHBondContact O-N 3.45Å
134S97.7Very high97.1Very high68 Ų68105.6 Ų105.648%0.47652%0.52SS..Hα-helixtrans-57.1-43179.1178.10000111.7D130 R136 E137 Q138D130-S134 VanDerWaalsContact O-CB 3.3Å; D130-S134 WeakPolarHBondContact O-CB 3.44Å; D130-S134 PolarHBondContact O-N 3.11Å; S134-R136 VanDerWaalsContact C-N 3.35Å; S134-R136 PolarHBondContact O-N 3.22Å; S134-E137 PolarHBondContact O-N 3.48Å; S134-Q138 WeakPolarHBondContact O-CB 3.26Å; S134-Q138 PolarHBondContact O-N 3.29Å
135K97.3Very high97.1Very high137 Ų137104.1 Ų104.160%0.59652%0.515SS*.Hα-helixtrans-61.4-40.6175.1-174174.9-178.61790112.6V131 L133 L139V131-K135 WeakPolarHBondContact O-CB 3.48Å; V131-K135 PolarHBondContact O-N 3.14Å; L133-K135 VanDerWaalsContact C-N 3.31Å; L133-K135 PolarHBondContact O-N 3.48Å; K135-L139 HydrophobicContact CG-CD1 4.35Å; K135-L139 VanDerWaalsContact O-CG 3.28Å; K135-L139 WeakPolarHBondContact O-CG 3.41Å; K135-L139 PolarHBondContact O-N 2.96Å; K135-L139 VanDerWaalsContact O-N 3.07Å
136R97.8Very high97.1Very high177 Ų177107.5 Ų107.567%0.66852%0.524SS*.Hα-helixtrans-67.1-42.3177.5-72.7174.6-173.5163.40.6111.7R132 L133 S134 L139 A140R132-R136 WeakPolarHBondContact O-CG 3.44Å; R132-R136 PolarHBondContact O-N 3.24Å; L133-R136 WeakPolarHBondContact O-CB 3.4Å; L133-R136 PolarHBondContact O-N 2.9Å; S134-R136 VanDerWaalsContact C-N 3.35Å; S134-R136 PolarHBondContact O-N 3.22Å; R136-L139 PolarHBondContact O-N 3.34Å; R136-A140 WeakPolarHBondContact O-CB 3.41Å; R136-A140 PolarHBondContact O-N 3.17Å
137E97.5Very high97.1Very high132 Ų132108.6 Ų108.662%0.61753%0.527SS*.Hα-helixtrans-63.7-44.6177.1-174.8173.5-166.300111.3L133 S134 L139 A140 E141L133-E137 PolarHBondContact O-N 3.45Å; S134-E137 PolarHBondContact O-N 3.48Å; E137-L139 PolarHBondContact O-N 3.08Å; E137-A140 WeakPolarHBondContact O-CB 3.36Å; E137-A140 PolarHBondContact O-N 2.99Å; E137-E141 PolarHBondContact O-N 2.88Å
138Q98.1Very high97.2Very high109 Ų109109.1 Ų109.151%0.50953%0.528SS..Hα-helixtrans-57.7-48.5175.2-176.2-177.4-9.700111.6S134 A140 E141 E142S134-Q138 WeakPolarHBondContact O-CB 3.26Å; S134-Q138 PolarHBondContact O-N 3.29Å; Q138-A140 VanDerWaalsContact C-N 3.31Å; Q138-A140 PolarHBondContact O-N 3.4Å; Q138-E141 PolarHBondContact O-N 3.34Å; Q138-E142 WeakPolarHBondContact CG-OE1 3.38Å; Q138-E142 PolarHBondContact NE2-OE1 2.94Å; Q138-E142 WeakPolarHBondContact O-CG 3.46Å; Q138-E142 PolarHBondContact O-N 2.94Å
139L97.5Very high97.2Very high90 Ų90113.1 Ų113.147%0.47154%0.536SS..Hα-helixtrans-62.3-38.8177.8-72171.9000112.3K135 R136 E137 C143K135-L139 HydrophobicContact CG-CD1 4.35Å; K135-L139 VanDerWaalsContact O-CG 3.28Å; K135-L139 WeakPolarHBondContact O-CG 3.41Å; K135-L139 PolarHBondContact O-N 2.96Å; K135-L139 VanDerWaalsContact O-N 3.07Å; R136-L139 PolarHBondContact O-N 3.34Å; E137-L139 PolarHBondContact O-N 3.08Å; L139-C143 WeakPolarHBondContact O-CB 3.38Å; L139-C143 PolarHBondContact O-N 3.37Å; L139-C143 PolarHBondContact O-SG 3.39Å
140A97.3Very high97.3Very high54 Ų54114.6 Ų114.645%0.44654%0.538SS..Hα-helixtrans-64.3-42.3175.900000111.6R136 E137 Q138 C143 R144R136-A140 WeakPolarHBondContact O-CB 3.41Å; R136-A140 PolarHBondContact O-N 3.17Å; E137-A140 WeakPolarHBondContact O-CB 3.36Å; E137-A140 PolarHBondContact O-N 2.99Å; Q138-A140 VanDerWaalsContact C-N 3.31Å; Q138-A140 PolarHBondContact O-N 3.4Å; A140-C143 PolarHBondContact O-N 2.88Å; A140-R144 WeakPolarHBondContact O-CG 3.43Å; A140-R144 PolarHBondContact O-N 3.36Å
141E97Very high97.2Very high97 Ų97113.4 Ų113.445%0.45353%0.531SS..Hα-helixtrans-67.7-41.7177.8-168.158.7-15600111.9E137 Q138 C143 R144 Y145E137-E141 PolarHBondContact O-N 2.88Å; Q138-E141 PolarHBondContact O-N 3.34Å; E141-C143 VanDerWaalsContact C-N 3.31Å; E141-C143 PolarHBondContact O-N 3.47Å; E141-R144 PolarHBondContact O-N 3.31Å; E141-R144 IonicContact OE2-CZ 2.98Å; E141-R144 IonicContact OE2-NH1 3.79Å; E141-R144 PolarHBondContact OE2-NH1 3.21Å; E141-Y145 WeakPolarHBondContact O-CB 3.39Å; E141-Y145 PolarHBondContact O-N 2.99Å
142E97Very high97.3Very high99 Ų99112.6 Ų112.646%0.46352%0.521SS..Hα-helixtrans-59.9-41.5173.8-74.7174.3-168.700111.7Q138 Y145 R146Q138-E142 WeakPolarHBondContact CG-OE1 3.38Å; Q138-E142 PolarHBondContact NE2-OE1 2.94Å; Q138-E142 WeakPolarHBondContact O-CG 3.46Å; Q138-E142 PolarHBondContact O-N 2.94Å; E142-Y145 PolarHBondContact O-N 2.93Å; E142-R146 VanDerWaalsContact O-CB 3.3Å; E142-R146 WeakPolarHBondContact O-CB 3.49Å; E142-R146 PolarHBondContact O-N 3.35Å
143C96.9Very high97.3Very high80 Ų80110.5 Ų110.554%0.54152%0.517SS..Hα-helixtrans-64-44.8175.6-71.50000111.8L139 A140 E141 R146 M147L139-C143 WeakPolarHBondContact O-CB 3.38Å; L139-C143 PolarHBondContact O-N 3.37Å; L139-C143 PolarHBondContact O-SG 3.39Å; A140-C143 PolarHBondContact O-N 2.88Å; E141-C143 VanDerWaalsContact C-N 3.31Å; E141-C143 PolarHBondContact O-N 3.47Å; C143-R146 PolarHBondContact O-N 2.95Å; C143-M147 WeakPolarHBondContact O-CG 3.45Å; C143-M147 PolarHBondContact O-N 3.32Å
144R97.1Very high97.3Very high166 Ų166110.4 Ų110.463%0.62651%0.513SS*.Hα-helixtrans-60.9-48.7176.3-75.3177.162.6-155.20.5111.5A140 E141 R146 M147 E148A140-R144 WeakPolarHBondContact O-CG 3.43Å; A140-R144 PolarHBondContact O-N 3.36Å; E141-R144 PolarHBondContact O-N 3.31Å; E141-R144 IonicContact OE2-CZ 2.98Å; E141-R144 IonicContact OE2-NH1 3.79Å; E141-R144 PolarHBondContact OE2-NH1 3.21Å; R144-R146 VanDerWaalsContact C-N 3.31Å; R144-R146 PolarHBondContact O-N 3.25Å; R144-M147 PolarHBondContact O-N 3.04Å; R144-E148 PolarHBondContact O-N 3.04Å
145Y96.8Very high97.3Very high152 Ų152111.2 Ų111.260%0.59651%0.509SS*.Hα-helixtrans-59.1-43.5178-179.5-99.9000111.6E141 E142 M147 E148 R149E141-Y145 WeakPolarHBondContact O-CB 3.39Å; E141-Y145 PolarHBondContact O-N 2.99Å; E142-Y145 PolarHBondContact O-N 2.93Å; Y145-M147 PolarHBondContact O-N 3.38Å; Y145-E148 PolarHBondContact O-N 3.31Å; Y145-R149 HydrophobicContact CD1-CG 4.06Å; Y145-R149 HydrophobicContact CE1-CG 3.62Å; Y145-R149 HydrophobicContact CE2-CG 4.18Å; Y145-R149 WeakPolarHBondContact O-CB 3.46Å; Y145-R149 VanDerWaalsContact O-CG 3.31Å; Y145-R149 WeakPolarHBondContact O-CG 3.23Å; Y145-R149 PolarHBondContact O-N 2.87Å
146R96.3Very high97.4Very high182 Ų182108.4 Ų108.469%0.68750%0.5SS*.Hα-helixtrans-63-40.8177.1-173.3175.5-177.4160.62.2112.5E142 C143 R144 L150E142-R146 VanDerWaalsContact O-CB 3.3Å; E142-R146 WeakPolarHBondContact O-CB 3.49Å; E142-R146 PolarHBondContact O-N 3.35Å; C143-R146 PolarHBondContact O-N 2.95Å; R144-R146 VanDerWaalsContact C-N 3.31Å; R144-R146 PolarHBondContact O-N 3.25Å; R146-L150 WeakPolarHBondContact O-CB 3.37Å; R146-L150 PolarHBondContact O-N 2.95Å
147M96.7Very high97.4Very high111 Ų111106.7 Ų106.755%0.54750%0.5SS..Hα-helixtrans-66.6-42.4176.4-71-61.29900112C143 R144 Y145 L150 N151C143-M147 WeakPolarHBondContact O-CG 3.45Å; C143-M147 PolarHBondContact O-N 3.32Å; R144-M147 PolarHBondContact O-N 3.04Å; Y145-M147 PolarHBondContact O-N 3.38Å; M147-L150 PolarHBondContact O-N 3.43Å; M147-N151 WeakPolarHBondContact O-CB 3.31Å; M147-N151 PolarHBondContact O-N 3.04Å
148E97.5Very high97.5Very high117 Ų117105.8 Ų105.855%0.54749%0.494SS..Hα-helixtrans-62.2-45.9176.4-171.459.6-150.700111.4R144 Y145 L150 N151 Q152R144-E148 PolarHBondContact O-N 3.04Å; Y145-E148 PolarHBondContact O-N 3.31Å; E148-L150 VanDerWaalsContact C-N 3.35Å; E148-L150 PolarHBondContact O-N 3.41Å; E148-N151 WeakPolarHBondContact O-CB 3.42Å; E148-N151 PolarHBondContact O-N 3.34Å; E148-N151 VanDerWaalsContact O-N 3.17Å; E148-Q152 PolarHBondContact O-N 2.94Å
149R96.6Very high97.5Very high108 Ų108104.9 Ų104.941%0.40849%0.492SS..Hα-helixtrans-56.8-46.7174.9-80.4-65-51.7172.27.3112.5Y145 N151 Q152 E153Y145-R149 HydrophobicContact CD1-CG 4.06Å; Y145-R149 HydrophobicContact CE1-CG 3.62Å; Y145-R149 HydrophobicContact CE2-CG 4.18Å; Y145-R149 WeakPolarHBondContact O-CB 3.46Å; Y145-R149 VanDerWaalsContact O-CG 3.31Å; Y145-R149 WeakPolarHBondContact O-CG 3.23Å; Y145-R149 PolarHBondContact O-N 2.87Å; R149-N151 VanDerWaalsContact C-N 3.3Å; R149-N151 PolarHBondContact O-N 2.95Å; R149-Q152 PolarHBondContact O-N 3.17Å; R149-E153 IonicContact CZ-OE1 2.71Å; R149-E153 IonicContact NE-OE1 3.56Å; R149-E153 IonicContact NH2-OE1 2.71Å; R149-E153 PolarHBondContact NH2-OE1 2.91Å; R149-E153 WeakPolarHBondContact O-CB 3.44Å; R149-E153 WeakPolarHBondContact O-CG 3.37Å; R149-E153 PolarHBondContact O-N 3.31Å
150L97.6Very high97.5Very high70 Ų70103.3 Ų103.337%0.36649%0.492SS..Hα-helixtrans-65.4-36178.6-175.3150.6000111.8R146 M147 E148 K154R146-L150 WeakPolarHBondContact O-CB 3.37Å; R146-L150 PolarHBondContact O-N 2.95Å; M147-L150 PolarHBondContact O-N 3.43Å; E148-L150 VanDerWaalsContact C-N 3.35Å; E148-L150 PolarHBondContact O-N 3.41Å; L150-K154 HydrophobicContact CD2-CD 3.93Å; L150-K154 VanDerWaalsContact CD2-CE 3.43Å; L150-K154 WeakPolarHBondContact O-CG 3.43Å; L150-K154 PolarHBondContact O-N 3.37Å; L150-K154 VanDerWaalsContact O-N 3.13Å
151N97.5Very high97.6Very high79 Ų79103.6 Ų103.642%0.42249%0.494SS..Hα-helixtrans-66.3-45.5174.7-169.248.3000111.2M147 E148 R149 E153 K154 E155M147-N151 WeakPolarHBondContact O-CB 3.31Å; M147-N151 PolarHBondContact O-N 3.04Å; E148-N151 WeakPolarHBondContact O-CB 3.42Å; E148-N151 PolarHBondContact O-N 3.34Å; E148-N151 VanDerWaalsContact O-N 3.17Å; R149-N151 VanDerWaalsContact C-N 3.3Å; R149-N151 PolarHBondContact O-N 2.95Å; N151-E153 VanDerWaalsContact C-N 3.34Å; N151-E153 PolarHBondContact O-N 3.08Å; N151-K154 WeakPolarHBondContact O-CB 3.4Å; N151-K154 PolarHBondContact O-N 3.17Å; N151-E155 WeakPolarHBondContact O-CG 3.44Å; N151-E155 PolarHBondContact O-N 2.99Å
152Q97.8Very high97.7Very high85 Ų85104.3 Ų104.340%0.39750%0.498SS..Hα-helixtrans-59.7-44.8175.6-17362.244.400111.6E148 R149 K154 E155 D156E148-Q152 PolarHBondContact O-N 2.94Å; R149-Q152 PolarHBondContact O-N 3.17Å; Q152-K154 VanDerWaalsContact C-N 3.28Å; Q152-K154 PolarHBondContact O-N 3.49Å; Q152-E155 PolarHBondContact O-N 3.13Å; Q152-E155 VanDerWaalsContact O-N 3.15Å; Q152-D156 PolarHBondContact NE2-OD1 2.91Å; Q152-D156 WeakPolarHBondContact O-CB 3.47Å; Q152-D156 VanDerWaalsContact O-CG 3.23Å; Q152-D156 PolarHBondContact O-N 3.28Å
153E97.8Very high97.7Very high98 Ų98103.8 Ų103.846%0.45850%0.497SS..Hα-helixtrans-59.8-38.5177.8-76.7165.3-163.900112.1R149 N151 E157R149-E153 IonicContact CZ-OE1 2.71Å; R149-E153 IonicContact NE-OE1 3.56Å; R149-E153 IonicContact NH2-OE1 2.71Å; R149-E153 PolarHBondContact NH2-OE1 2.91Å; R149-E153 WeakPolarHBondContact O-CB 3.44Å; R149-E153 WeakPolarHBondContact O-CG 3.37Å; R149-E153 PolarHBondContact O-N 3.31Å; N151-E153 VanDerWaalsContact C-N 3.34Å; N151-E153 PolarHBondContact O-N 3.08Å; E153-E157 WeakPolarHBondContact O-CB 3.35Å; E153-E157 PolarHBondContact O-N 3.45Å
154K97.8Very high97.8Very high108 Ų108104.9 Ų104.947%0.4750%0.495SS..Hα-helixtrans-67.3-39.9174.7-75.6175.5176.2174.10113L150 N151 Q152 K158L150-K154 HydrophobicContact CD2-CD 3.93Å; L150-K154 VanDerWaalsContact CD2-CE 3.43Å; L150-K154 WeakPolarHBondContact O-CG 3.43Å; L150-K154 PolarHBondContact O-N 3.37Å; L150-K154 VanDerWaalsContact O-N 3.13Å; N151-K154 WeakPolarHBondContact O-CB 3.4Å; N151-K154 PolarHBondContact O-N 3.17Å; Q152-K154 VanDerWaalsContact C-N 3.28Å; Q152-K154 PolarHBondContact O-N 3.49Å; K154-K158 VanDerWaalsContact O-CG 3.3Å; K154-K158 WeakPolarHBondContact O-CG 3.34Å; K154-K158 PolarHBondContact O-N 2.9Å
155E98.2Very high97.9Very high84 Ų84102.9 Ų102.939%0.39349%0.493SS..Hα-helixtrans-69-40.2177.3-66.7-54.9128.600111.1N151 Q152 K158 L159N151-E155 WeakPolarHBondContact O-CG 3.44Å; N151-E155 PolarHBondContact O-N 2.99Å; Q152-E155 PolarHBondContact O-N 3.13Å; Q152-E155 VanDerWaalsContact O-N 3.15Å; E155-K158 PolarHBondContact O-N 3.44Å; E155-K158 IonicContact OE1-NZ 3.94Å; E155-K158 PolarHBondContact OE1-NZ 3.2Å; E155-K158 IonicContact OE2-NZ 3.14Å; E155-L159 WeakPolarHBondContact O-CB 3.37Å; E155-L159 PolarHBondContact O-N 2.93Å
156D98.5Very high98Very high79 Ų79101 Ų10142%0.42249%0.489SS..Hα-helixtrans-63-41.5174.3-68.6-12.7000111.3Q152 L159 A160Q152-D156 PolarHBondContact NE2-OD1 2.91Å; Q152-D156 WeakPolarHBondContact O-CB 3.47Å; Q152-D156 VanDerWaalsContact O-CG 3.23Å; Q152-D156 PolarHBondContact O-N 3.28Å; D156-L159 PolarHBondContact O-N 3.14Å; D156-A160 VanDerWaalsContact O-CB 3.32Å; D156-A160 WeakPolarHBondContact O-CB 3.35Å; D156-A160 PolarHBondContact O-N 3.29Å
157E98.3Very high98.1Very high141 Ų14196.6 Ų96.666%0.65948%0.479SS*.Hα-helixtrans-62.9-44.7175.4-175.7-179.3-168.200111.8E153 L159 A160 A161E153-E157 WeakPolarHBondContact O-CB 3.35Å; E153-E157 PolarHBondContact O-N 3.45Å; E157-L159 VanDerWaalsContact C-N 3.34Å; E157-L159 PolarHBondContact O-N 3.47Å; E157-A160 PolarHBondContact O-N 3.17Å; E157-A161 WeakPolarHBondContact O-CB 3.46Å; E157-A161 PolarHBondContact O-N 2.94Å
158K98.5Very high98.1Very high113 Ų11395.3 Ų95.349%0.49147%0.474SS..Hα-helixtrans-60.6-44.4175.1-73.7171.5-170.3168.10111.5K154 E155 A161 Q162K154-K158 VanDerWaalsContact O-CG 3.3Å; K154-K158 WeakPolarHBondContact O-CG 3.34Å; K154-K158 PolarHBondContact O-N 2.9Å; E155-K158 PolarHBondContact O-N 3.44Å; E155-K158 IonicContact OE1-NZ 3.94Å; E155-K158 PolarHBondContact OE1-NZ 3.2Å; E155-K158 IonicContact OE2-NZ 3.14Å; K158-A161 PolarHBondContact O-N 3.04Å; K158-Q162 WeakPolarHBondContact O-CG 3.23Å; K158-Q162 PolarHBondContact O-N 3.32Å
159L98.5Very high98.2Very high90 Ų9093.9 Ų93.947%0.47147%0.469SS..Hα-helixtrans-63.7-44.2178.3-179.961.2000110.9E155 D156 E157 A161 Q162 L163E155-L159 WeakPolarHBondContact O-CB 3.37Å; E155-L159 PolarHBondContact O-N 2.93Å; D156-L159 PolarHBondContact O-N 3.14Å; E157-L159 VanDerWaalsContact C-N 3.34Å; E157-L159 PolarHBondContact O-N 3.47Å; L159-A161 VanDerWaalsContact C-N 3.33Å; L159-A161 PolarHBondContact O-N 3.01Å; L159-Q162 PolarHBondContact O-N 3.26Å; L159-L163 HydrophobicContact CD1-CD1 4.44Å; L159-L163 HydrophobicContact CD1-CG 4.44Å; L159-L163 HydrophobicContact CG-CD1 4.21Å; L159-L163 WeakPolarHBondContact O-CG 3.3Å; L159-L163 PolarHBondContact O-N 3.49Å
160A98.5Very high98.3Very high56 Ų5693.7 Ų93.746%0.46347%0.473SS..Hα-helixtrans-60.6-42.3176.100000111.7D156 E157 L163 Q164D156-A160 VanDerWaalsContact O-CB 3.32Å; D156-A160 WeakPolarHBondContact O-CB 3.35Å; D156-A160 PolarHBondContact O-N 3.29Å; E157-A160 PolarHBondContact O-N 3.17Å; A160-L163 PolarHBondContact O-N 2.91Å; A160-Q164 WeakPolarHBondContact O-CB 3.35Å; A160-Q164 PolarHBondContact O-N 2.99Å
161A98.5Very high98.3Very high61 Ų6192.8 Ų92.850%0.50447%0.468SS..Hα-helixtrans-63.4-41.1176.200000112.4E157 K158 L159 Q164 Q165E157-A161 WeakPolarHBondContact O-CB 3.46Å; E157-A161 PolarHBondContact O-N 2.94Å; K158-A161 PolarHBondContact O-N 3.04Å; L159-A161 VanDerWaalsContact C-N 3.33Å; L159-A161 PolarHBondContact O-N 3.01Å; A161-Q164 PolarHBondContact O-N 3.34Å; A161-Q165 PolarHBondContact O-N 3.07Å
162Q98.5Very high98.3Very high112 Ų11294.1 Ų94.152%0.52347%0.474SS..Hα-helixtrans-64.1-44.4175.6-73.8177.6-4.500112.2K158 L159 Q164 Q165 Q166K158-Q162 WeakPolarHBondContact O-CG 3.23Å; K158-Q162 PolarHBondContact O-N 3.32Å; L159-Q162 PolarHBondContact O-N 3.26Å; Q162-Q164 VanDerWaalsContact C-N 3.35Å; Q162-Q165 PolarHBondContact O-N 2.92Å; Q162-Q166 WeakPolarHBondContact O-CG 3.42Å; Q162-Q166 PolarHBondContact O-N 3.21Å
163L98.6Very high98.4Very high87 Ų8794.7 Ų94.746%0.45548%0.476SS..Hα-helixtrans-63.7-41.6176.8-71.5172.9000111.4L159 A160 Q165 Q166 L167L159-L163 HydrophobicContact CD1-CD1 4.44Å; L159-L163 HydrophobicContact CD1-CG 4.44Å; L159-L163 HydrophobicContact CG-CD1 4.21Å; L159-L163 WeakPolarHBondContact O-CG 3.3Å; L159-L163 PolarHBondContact O-N 3.49Å; A160-L163 PolarHBondContact O-N 2.91Å; L163-Q165 VanDerWaalsContact C-N 3.33Å; L163-Q165 PolarHBondContact O-N 3.37Å; L163-Q166 PolarHBondContact O-N 3.3Å; L163-L167 WeakPolarHBondContact O-CG 3.36Å; L163-L167 PolarHBondContact O-N 3.22Å
164Q98.5Very high98.4Very high103 Ų10396.3 Ų96.348%0.48148%0.478SS..Hα-helixtrans-59.9-45.3175.5-174.560.652.300111.3A160 A161 Q162 Q166 L167 D168A160-Q164 WeakPolarHBondContact O-CB 3.35Å; A160-Q164 PolarHBondContact O-N 2.99Å; A161-Q164 PolarHBondContact O-N 3.34Å; Q162-Q164 VanDerWaalsContact C-N 3.35Å; Q164-Q166 VanDerWaalsContact C-N 3.32Å; Q164-Q166 PolarHBondContact O-N 3.42Å; Q164-L167 PolarHBondContact O-N 3.44Å; Q164-D168 PolarHBondContact NE2-OD1 2.98Å; Q164-D168 VanDerWaalsContact O-CG 3.25Å; Q164-D168 PolarHBondContact O-N 3.27Å
165Q98.5Very high98.4Very high125 Ų12598.5 Ų98.558%0.58448%0.484SS*.Hα-helixtrans-61-40.7177.4-173.4-177.7500112.2A161 Q162 L163 D168 I169A161-Q165 PolarHBondContact O-N 3.07Å; Q162-Q165 PolarHBondContact O-N 2.92Å; L163-Q165 VanDerWaalsContact C-N 3.33Å; L163-Q165 PolarHBondContact O-N 3.37Å; Q165-D168 PolarHBondContact O-N 3Å; Q165-I169 HydrophobicContact CG-CD1 4.23Å; Q165-I169 VanDerWaalsContact O-CG1 3.3Å; Q165-I169 WeakPolarHBondContact O-CG1 3.25Å; Q165-I169 PolarHBondContact O-N 2.97Å; Q165-I169 VanDerWaalsContact O-N 3.13Å
166Q98.5Very high98.4Very high112 Ų11297.6 Ų97.652%0.52349%0.486SS..Hα-helixtrans-63.7-44.4176.4-72.4176.5300111.5Q162 L163 Q164 D168 I169 E170Q162-Q166 WeakPolarHBondContact O-CG 3.42Å; Q162-Q166 PolarHBondContact O-N 3.21Å; L163-Q166 PolarHBondContact O-N 3.3Å; Q164-Q166 VanDerWaalsContact C-N 3.32Å; Q164-Q166 PolarHBondContact O-N 3.42Å; Q166-D168 VanDerWaalsContact C-N 3.34Å; Q166-D168 PolarHBondContact O-N 3.48Å; Q166-I169 PolarHBondContact O-N 2.79Å; Q166-E170 WeakPolarHBondContact O-CG 3.4Å; Q166-E170 PolarHBondContact O-N 3.43Å
167L98.5Very high98.3Very high90 Ų90101.3 Ų101.347%0.47149%0.494SS..Hα-helixtrans-62.1-41.3177-70.9173.4000112.1L163 Q164 I169 E170 D171L163-L167 WeakPolarHBondContact O-CG 3.36Å; L163-L167 PolarHBondContact O-N 3.22Å; Q164-L167 PolarHBondContact O-N 3.44Å; L167-I169 VanDerWaalsContact C-N 3.33Å; L167-I169 PolarHBondContact O-N 3.25Å; L167-E170 PolarHBondContact O-N 3.36Å; L167-D171 WeakPolarHBondContact O-CB 3.28Å; L167-D171 PolarHBondContact O-N 3.41Å
168D98.6Very high98.3Very high84 Ų8499 Ų9945%0.44949%0.486SS..Hα-helixtrans-63.7-39.6178.3-68.3-18.1000111.6Q164 Q165 Q166 M172Q164-D168 PolarHBondContact NE2-OD1 2.98Å; Q164-D168 VanDerWaalsContact O-CG 3.25Å; Q164-D168 PolarHBondContact O-N 3.27Å; Q165-D168 PolarHBondContact O-N 3Å; Q166-D168 VanDerWaalsContact C-N 3.34Å; Q166-D168 PolarHBondContact O-N 3.48Å; D168-M172 WeakPolarHBondContact O-CB 3.48Å; D168-M172 WeakPolarHBondContact O-CG 3.36Å; D168-M172 PolarHBondContact O-N 2.89Å
169I98.5Very high98.3Very high87 Ų87100.4 Ų100.445%0.44649%0.494SS..Hα-helixtrans-65.4-48.4175.4-67165000110.4Q165 Q166 L167 D171 M172 E173Q165-I169 HydrophobicContact CG-CD1 4.23Å; Q165-I169 VanDerWaalsContact O-CG1 3.3Å; Q165-I169 WeakPolarHBondContact O-CG1 3.25Å; Q165-I169 PolarHBondContact O-N 2.97Å; Q165-I169 VanDerWaalsContact O-N 3.13Å; Q166-I169 PolarHBondContact O-N 2.79Å; L167-I169 VanDerWaalsContact C-N 3.33Å; L167-I169 PolarHBondContact O-N 3.25Å; I169-D171 VanDerWaalsContact C-N 3.3Å; I169-D171 PolarHBondContact O-N 3.38Å; I169-M172 PolarHBondContact O-N 3.01Å; I169-M172 VanDerWaalsContact O-N 3.14Å; I169-E173 PolarHBondContact O-N 3.16Å
170E98.1Very high98.3Very high104 Ų10499.6 Ų99.649%0.48650%0.495SS..Hα-helixtrans-60.4-40.4178-74.7-174.6-174.800112.3Q166 L167 M172 E173 R174Q166-E170 WeakPolarHBondContact O-CG 3.4Å; Q166-E170 PolarHBondContact O-N 3.43Å; L167-E170 PolarHBondContact O-N 3.36Å; E170-M172 VanDerWaalsContact C-N 3.34Å; E170-E173 PolarHBondContact O-N 3.45Å; E170-R174 VanDerWaalsContact O-CB 3.24Å; E170-R174 WeakPolarHBondContact O-CB 3.33Å; E170-R174 PolarHBondContact O-N 3.42Å
171D98.1Very high98.3Very high50 Ų50103.4 Ų103.427%0.26750%0.502SS..Hα-helixtrans-64.6-39.8175.4-94.45.4000111.6L167 I169 R174 R175L167-D171 WeakPolarHBondContact O-CB 3.28Å; L167-D171 PolarHBondContact O-N 3.41Å; I169-D171 VanDerWaalsContact C-N 3.3Å; I169-D171 PolarHBondContact O-N 3.38Å; D171-R174 PolarHBondContact O-N 3.01Å; D171-R174 IonicContact OD1-CZ 3.31Å; D171-R174 VanDerWaalsContact OD1-CZ 3.31Å; D171-R174 IonicContact OD1-NH1 2.64Å; D171-R174 PolarHBondContact OD1-NH1 3.08Å; D171-R174 IonicContact OD1-NH2 3.63Å; D171-R175 WeakPolarHBondContact O-CB 3.25Å; D171-R175 VanDerWaalsContact O-CG 3.27Å; D171-R175 WeakPolarHBondContact O-CG 3.45Å; D171-R175 PolarHBondContact O-N 3.27Å
172M98.2Very high98.2Very high108 Ų108105.5 Ų105.553%0.53250%0.504SS..Hα-helixtrans-66.1-44.4176.3-71.5-84.661.100112.3D168 I169 E170 R174 R175 S176D168-M172 WeakPolarHBondContact O-CB 3.48Å; D168-M172 WeakPolarHBondContact O-CG 3.36Å; D168-M172 PolarHBondContact O-N 2.89Å; I169-M172 PolarHBondContact O-N 3.01Å; I169-M172 VanDerWaalsContact O-N 3.14Å; E170-M172 VanDerWaalsContact C-N 3.34Å; M172-R174 VanDerWaalsContact C-N 3.33Å; M172-R174 PolarHBondContact O-N 3Å; M172-R175 HydrophobicContact CE-CB 4.24Å; M172-R175 PolarHBondContact O-N 3.38Å; M172-S176 WeakPolarHBondContact O-CB 3.04Å; M172-S176 PolarHBondContact O-N 2.88Å
173E98.4Very high98.2Very high96 Ų96108 Ų10845%0.44951%0.51SS..Hα-helixtrans-60.8-43.6173.6-72.5-170.1-167.200111.9I169 E170 S176 R177I169-E173 PolarHBondContact O-N 3.16Å; E170-E173 PolarHBondContact O-N 3.45Å; E173-S176 PolarHBondContact O-N 2.83Å; E173-R177 VanDerWaalsContact O-CG 3.27Å; E173-R177 WeakPolarHBondContact O-CG 3.32Å; E173-R177 PolarHBondContact O-N 3.43Å; E173-R177 IonicContact OE2-CZ 3.93Å; E173-R177 IonicContact OE2-NH2 2.92Å; E173-R177 PolarHBondContact OE2-NH2 2.91Å
174R98.1Very high98.1Very high132 Ų132110.2 Ų110.250%0.49852%0.518SS..Hα-helixtrans-60.9-47.8178.3-172.5-173.3-55.4145.22.8111E170 D171 M172 R177 L178E170-R174 VanDerWaalsContact O-CB 3.24Å; E170-R174 WeakPolarHBondContact O-CB 3.33Å; E170-R174 PolarHBondContact O-N 3.42Å; D171-R174 PolarHBondContact O-N 3.01Å; D171-R174 IonicContact OD1-CZ 3.31Å; D171-R174 VanDerWaalsContact OD1-CZ 3.31Å; D171-R174 IonicContact OD1-NH1 2.64Å; D171-R174 PolarHBondContact OD1-NH1 3.08Å; D171-R174 IonicContact OD1-NH2 3.63Å; M172-R174 VanDerWaalsContact C-N 3.33Å; M172-R174 PolarHBondContact O-N 3Å; R174-R177 PolarHBondContact O-N 3.45Å; R174-L178 HydrophobicContact CG-CD1 4.12Å; R174-L178 WeakPolarHBondContact O-CD1 3.44Å; R174-L178 PolarHBondContact O-N 3.26Å
175R97.9Very high98.1Very high155 Ų155112.9 Ų112.959%0.58553%0.525SS*.Hα-helixtrans-61.6-44.5177.4-72.8179.2-162.7171.77.6111.5D171 M172 R177 L178 E179D171-R175 WeakPolarHBondContact O-CB 3.25Å; D171-R175 VanDerWaalsContact O-CG 3.27Å; D171-R175 WeakPolarHBondContact O-CG 3.45Å; D171-R175 PolarHBondContact O-N 3.27Å; M172-R175 HydrophobicContact CE-CB 4.24Å; M172-R175 PolarHBondContact O-N 3.38Å; R175-R177 PolarHBondContact O-N 3.41Å; R175-L178 PolarHBondContact O-N 3.4Å; R175-E179 PolarHBondContact O-N 2.93Å
176S98.1Very high98Very high64 Ų64109.3 Ų109.345%0.44852%0.517SS..Hα-helixtrans-61.2-41.9176.4179.70000112.3M172 E173 L178 E179 C180M172-S176 WeakPolarHBondContact O-CB 3.04Å; M172-S176 PolarHBondContact O-N 2.88Å; E173-S176 PolarHBondContact O-N 2.83Å; S176-L178 VanDerWaalsContact C-N 3.34Å; S176-L178 PolarHBondContact O-N 2.87Å; S176-E179 PolarHBondContact O-N 3.34Å; S176-C180 PolarHBondContact O-N 3.13Å; S176-C180 PolarHBondContact O-SG 3.32Å; S176-C180 VanDerWaalsContact O-SG 3.38Å
177R97.9Very high97.9Very high157 Ų157109 Ų10959%0.59251%0.514SS*.Hα-helixtrans-64-37.3174.9-70.3174.6-161.2-175.410.1112.5E173 R174 R175 K181E173-R177 VanDerWaalsContact O-CG 3.27Å; E173-R177 WeakPolarHBondContact O-CG 3.32Å; E173-R177 PolarHBondContact O-N 3.43Å; E173-R177 IonicContact OE2-CZ 3.93Å; E173-R177 IonicContact OE2-NH2 2.92Å; E173-R177 PolarHBondContact OE2-NH2 2.91Å; R174-R177 PolarHBondContact O-N 3.45Å; R175-R177 PolarHBondContact O-N 3.41Å; R177-K181 WeakPolarHBondContact O-CG 3.34Å; R177-K181 PolarHBondContact O-N 3.31Å
178L98Very high97.7Very high94 Ų94106.9 Ų106.949%0.49251%0.506SS..Hα-helixtrans-65.9-46.4174.2-95.780.7000111R174 R175 S176 C180 K181 D182R174-L178 HydrophobicContact CG-CD1 4.12Å; R174-L178 WeakPolarHBondContact O-CD1 3.44Å; R174-L178 PolarHBondContact O-N 3.26Å; R175-L178 PolarHBondContact O-N 3.4Å; S176-L178 VanDerWaalsContact C-N 3.34Å; S176-L178 PolarHBondContact O-N 2.87Å; L178-C180 VanDerWaalsContact C-N 3.31Å; L178-C180 PolarHBondContact O-N 3.06Å; L178-K181 WeakPolarHBondContact O-CB 3.39Å; L178-K181 PolarHBondContact O-N 3.4Å; L178-D182 PolarHBondContact O-N 3.49Å
179E98Very high97.5Very high141 Ų141107.8 Ų107.866%0.65951%0.511SS*.Hα-helixtrans-58.6-41.9179-174175.9-164.900112R175 S176 K181 D182 Y183R175-E179 PolarHBondContact O-N 2.93Å; S176-E179 PolarHBondContact O-N 3.34Å; E179-K181 PolarHBondContact O-N 3Å; E179-D182 PolarHBondContact O-N 3.47Å; E179-Y183 WeakPolarHBondContact O-CB 3.16Å; E179-Y183 PolarHBondContact O-N 3.26Å
180C98.2Very high97.3Very high73 Ų73107.5 Ų107.549%0.49351%0.513SS..Hα-helixtrans-60.4-43.8173.4-70.50000112.5S176 L178 Y183 E184S176-C180 PolarHBondContact O-N 3.13Å; S176-C180 PolarHBondContact O-SG 3.32Å; S176-C180 VanDerWaalsContact O-SG 3.38Å; L178-C180 VanDerWaalsContact C-N 3.31Å; L178-C180 PolarHBondContact O-N 3.06Å; C180-Y183 PolarHBondContact O-N 3.21Å; C180-E184 WeakPolarHBondContact O-CG 3.47Å; C180-E184 PolarHBondContact O-N 3.03Å
181K98.1Very high97Very high137 Ų137107.6 Ų107.660%0.59651%0.514SS*.Hα-helixtrans-66-40.8177.6-72.3175.2-180-177.10112R177 L178 E179 Y183 E184 Y185R177-K181 WeakPolarHBondContact O-CG 3.34Å; R177-K181 PolarHBondContact O-N 3.31Å; L178-K181 WeakPolarHBondContact O-CB 3.39Å; L178-K181 PolarHBondContact O-N 3.4Å; E179-K181 PolarHBondContact O-N 3Å; K181-Y183 VanDerWaalsContact C-N 3.33Å; K181-E184 PolarHBondContact O-N 3.32Å; K181-Y185 WeakPolarHBondContact O-CB 3.4Å; K181-Y185 PolarHBondContact O-N 3.41Å
182D98Very high96.5Very high105 Ų105110.2 Ų110.256%0.56153%0.527SS*.Hα-helixtrans-65.6-39.7178.2-72.6-12.5000110.9L178 E179 Y185 A186L178-D182 PolarHBondContact O-N 3.49Å; E179-D182 PolarHBondContact O-N 3.47Å; D182-Y185 PolarHBondContact O-N 2.88Å; D182-A186 VanDerWaalsContact O-CB 3.31Å; D182-A186 WeakPolarHBondContact O-CB 3.23Å; D182-A186 PolarHBondContact O-N 3.19Å
183Y97.7Very high95.7Very high164 Ų164109 Ų10964%0.64353%0.53SS*.Hα-helixtrans-61.7-46.5172.9177.7-97.6000112.1E179 C180 K181 Y185 A186 K187E179-Y183 WeakPolarHBondContact O-CB 3.16Å; E179-Y183 PolarHBondContact O-N 3.26Å; C180-Y183 PolarHBondContact O-N 3.21Å; K181-Y183 VanDerWaalsContact C-N 3.33Å; Y183-Y185 PolarHBondContact O-N 3.3Å; Y183-A186 PolarHBondContact O-N 2.85Å; Y183-K187 WeakPolarHBondContact O-CB 3.38Å; Y183-K187 PolarHBondContact O-N 3.2Å
184E97.3Very high94.8Very high133 Ų133108.9 Ų108.962%0.62154%0.539SS*.Hα-helixtrans-61.9-42.1175.3-74.2179.717400112C180 K181 K187 S188C180-E184 WeakPolarHBondContact O-CG 3.47Å; C180-E184 PolarHBondContact O-N 3.03Å; K181-E184 PolarHBondContact O-N 3.32Å; E184-K187 PolarHBondContact O-N 3.13Å; E184-S188 PolarHBondContact O-N 2.9Å
185Y97.1Very high93.5Very high159 Ų159106.9 Ų106.962%0.62455%0.546SS*.Hα-helixtrans-63.6-47.6177.2-173-99000111.3K181 D182 Y183 K187 S188 L189K181-Y185 WeakPolarHBondContact O-CB 3.4Å; K181-Y185 PolarHBondContact O-N 3.41Å; D182-Y185 PolarHBondContact O-N 2.88Å; Y183-Y185 PolarHBondContact O-N 3.3Å; Y185-K187 VanDerWaalsContact C-N 3.31Å; Y185-K187 PolarHBondContact O-N 3.48Å; Y185-S188 PolarHBondContact O-N 3.5Å; Y185-S188 PolarHBondContact O-OG 3.4Å; Y185-L189 WeakPolarHBondContact O-CB 3.32Å; Y185-L189 PolarHBondContact O-N 3.02Å
186A96.4Very high91.6Very high50 Ų50103.4 Ų103.441%0.41355%0.545SS..Hα-helixtrans-59.8-41.817600000111.8D182 Y183 L189 T190D182-A186 VanDerWaalsContact O-CB 3.31Å; D182-A186 WeakPolarHBondContact O-CB 3.23Å; D182-A186 PolarHBondContact O-N 3.19Å; Y183-A186 PolarHBondContact O-N 2.85Å; A186-L189 PolarHBondContact O-N 3.35Å; A186-T190 WeakPolarHBondContact O-CG2 3.41Å; A186-T190 PolarHBondContact O-N 3.48Å; A186-T190 VanDerWaalsContact O-N 3.11Å; A186-T190 PolarHBondContact O-OG1 2.92Å
187K96.6Very high89.5Confident106 Ų106105 Ų10546%0.46156%0.556SS.*Hα-helixtrans-60.9-49.1174.3-174.2177.9173.9-175.90111.5Y183 E184 Y185 L189 T190 E191Y183-K187 WeakPolarHBondContact O-CB 3.38Å; Y183-K187 PolarHBondContact O-N 3.2Å; E184-K187 PolarHBondContact O-N 3.13Å; Y185-K187 VanDerWaalsContact C-N 3.31Å; Y185-K187 PolarHBondContact O-N 3.48Å; K187-L189 VanDerWaalsContact C-N 3.28Å; K187-L189 PolarHBondContact O-N 3.02Å; K187-T190 PolarHBondContact O-N 2.86Å; K187-T190 PolarHBondContact O-OG1 2.85Å; K187-E191 WeakPolarHBondContact CE-OE1 3.45Å; K187-E191 WeakPolarHBondContact O-CG 3.32Å; K187-E191 PolarHBondContact O-N 3.37Å
188S95.4Very high87.3Confident45 Ų45103 Ų10332%0.31556%0.561SS.*Hα-helixtrans-60.5-36.4177.776.20000113E184 Y185 E191 N192E184-S188 PolarHBondContact O-N 2.9Å; Y185-S188 PolarHBondContact O-N 3.5Å; Y185-S188 PolarHBondContact O-OG 3.4Å; S188-E191 PolarHBondContact O-N 3.43Å; S188-N192 WeakPolarHBondContact O-CB 3.5Å; S188-N192 PolarHBondContact O-N 3.47Å; S188-N192 PolarHBondContact O-ND2 3.35Å
189L93.8Very high85.3Confident104 Ų104104 Ų10455%0.54557%0.574SS.*Hα-helixtrans-65.1-43177.8-167.471.1000111.2Y185 A186 K187 S193Y185-L189 WeakPolarHBondContact O-CB 3.32Å; Y185-L189 PolarHBondContact O-N 3.02Å; A186-L189 PolarHBondContact O-N 3.35Å; K187-L189 VanDerWaalsContact C-N 3.28Å; K187-L189 PolarHBondContact O-N 3.02Å; L189-S193 WeakPolarHBondContact O-CB 3.47Å; L189-S193 PolarHBondContact O-N 2.96Å; L189-S193 PolarHBondContact O-OG 3.48Å
190T93.3Very high83.2Confident81 Ų81104.4 Ų104.450%0.49758%0.579SS.*Hα-helixtrans-68.3-40.5177.958.50000112.6A186 K187 S193 S194A186-T190 WeakPolarHBondContact O-CG2 3.41Å; A186-T190 PolarHBondContact O-N 3.48Å; A186-T190 VanDerWaalsContact O-N 3.11Å; A186-T190 PolarHBondContact O-OG1 2.92Å; K187-T190 PolarHBondContact O-N 2.86Å; K187-T190 PolarHBondContact O-OG1 2.85Å; T190-S193 PolarHBondContact O-N 3.5Å; T190-S193 PolarHBondContact O-OG 3.09Å; T190-S194 PolarHBondContact O-N 3.13Å; T190-S194 VanDerWaalsContact O-N 3.13Å; T190-S194 PolarHBondContact O-OG 3.37Å
191E92.8Very high81.1Confident106 Ų106109.5 Ų109.550%0.49559%0.593SS.*Hα-helixtrans-66.2-42.2177-70.7175.1-177.800112.4K187 S188 S194 S195K187-E191 WeakPolarHBondContact CE-OE1 3.45Å; K187-E191 WeakPolarHBondContact O-CG 3.32Å; K187-E191 PolarHBondContact O-N 3.37Å; S188-E191 PolarHBondContact O-N 3.43Å; E191-S194 PolarHBondContact O-N 2.94Å; E191-S195 PolarHBondContact O-N 3.31Å; E191-S195 PolarHBondContact O-OG 3.45Å
192N87.7Confident78.7Confident104 Ų104107.4 Ų107.456%0.55660%0.595SS**Hα-helixtrans-67.5-35.6176.5-70.9-18000112.2S188 S194 S195 S196S188-N192 WeakPolarHBondContact O-CB 3.5Å; S188-N192 PolarHBondContact O-N 3.47Å; S188-N192 PolarHBondContact O-ND2 3.35Å; N192-S194 VanDerWaalsContact C-N 3.3Å; N192-S194 PolarHBondContact O-N 3.47Å; N192-S195 PolarHBondContact O-OG 3.17Å; N192-S196 WeakPolarHBondContact O-CB 3.48Å; N192-S196 PolarHBondContact O-N 3.49Å; N192-S196 VanDerWaalsContact O-N 3.15Å
193S80.2Confident76.7Confident83 Ų83106.6 Ų106.658%0.5860%0.596SS**Hα-helixtrans-68.2-30175.6730000113.1L189 T190L189-S193 WeakPolarHBondContact O-CB 3.47Å; L189-S193 PolarHBondContact O-N 2.96Å; L189-S193 PolarHBondContact O-OG 3.48Å; T190-S193 PolarHBondContact O-N 3.5Å; T190-S193 PolarHBondContact O-OG 3.09Å
194S79.5Confident74.9Confident93 Ų93104.9 Ų104.965%0.6561%0.605SS**Hα-helixtrans-78.3-31.1-179.5-56.70000112.6T190 E191 N192T190-S194 PolarHBondContact O-N 3.13Å; T190-S194 VanDerWaalsContact O-N 3.13Å; T190-S194 PolarHBondContact O-OG 3.37Å; E191-S194 PolarHBondContact O-N 2.94Å; N192-S194 VanDerWaalsContact C-N 3.3Å; N192-S194 PolarHBondContact O-N 3.47Å
195S72.1Confident72.6Confident91 Ų91107.2 Ų107.264%0.63662%0.616SS**Hα-helixtrans-87.3-26.1-179.246.10000113.2E191 N192 S197E191-S195 PolarHBondContact O-N 3.31Å; E191-S195 PolarHBondContact O-OG 3.45Å; N192-S195 PolarHBondContact O-OG 3.17Å; S195-S197 PolarHBondContact O-N 3.11Å; S195-S197 VanDerWaalsContact O-N 3.08Å
196S57.2Low70.2Confident82 Ų82105.7 Ų105.757%0.57363%0.628SS**  trans-85.155.5173.5178.20000112.3N192 T198N192-S196 WeakPolarHBondContact O-CB 3.48Å; N192-S196 PolarHBondContact O-N 3.49Å; N192-S196 VanDerWaalsContact O-N 3.15Å; S196-T198 PolarHBondContact O-N 3.25Å
197S54.8Low67.9Low97 Ų97107.7 Ų107.768%0.67865%0.645SS**  trans-8162167.856.30000111.4S195S195-S197 PolarHBondContact O-N 3.11Å; S195-S197 VanDerWaalsContact O-N 3.08Å
198T51.7Low65.5Low114 Ų114108.4 Ų108.470%0.69966%0.658SS**  trans-132.487.8152.743.10000109.4S196 I200S196-T198 PolarHBondContact O-N 3.25Å; T198-I200 PolarHBondContact O-N 2.83Å
199P54.5Low63Low116 Ų116112.8 Ų112.875%0.75368%0.683SS**  trans-7887.5171.432-30.7000108.5F201P199-F201 PolarHBondContact O-N 3.31Å; P199-F201 VanDerWaalsContact O-N 3.07Å
200I53.9Low60.4Low149 Ų149111.2 Ų111.276%0.76469%0.693SS**  trans-82.575.9155.7-61.1179.6000106.3T198 S202T198-I200 PolarHBondContact O-N 2.83Å; I200-S202 PolarHBondContact O-N 2.94Å
201F55Low58.1Low181 Ų181118.5 Ų118.579%0.79471%0.713SS**  trans-71.783168.5-163.5-93.1000107.3P199 P203P199-F201 PolarHBondContact O-N 3.31Å; P199-F201 VanDerWaalsContact O-N 3.07Å; F201-P203 WeakPolarHBondContact O-CD 3.31Å
202S48.3Very low56Low92 Ų92119.1 Ų119.164%0.64373%0.728SS**  trans-85113.9161.9-64.70000107.1I200 P204I200-S202 PolarHBondContact O-N 2.94Å; S202-P204 WeakPolarHBondContact O-CD 3.31Å
203P55.8Low53.9Low88 Ų88119.3 Ų119.357%0.57174%0.738SS**  trans-66.1127.5179.1-6.620.1000108.6F201 Q205F201-P203 WeakPolarHBondContact O-CD 3.31Å; P203-Q205 VanDerWaalsContact C-N 3.34Å; P203-Q205 PolarHBondContact O-N 2.72Å
204P59Low52.3Low128 Ų128119.5 Ų119.583%0.83175%0.745SS**  trans-67100.4169.725.3-29.1000107.7S202S202-P204 WeakPolarHBondContact O-CD 3.31Å
205Q49Very low50.7Low183 Ų183120.5 Ų120.586%0.85575%0.752SS**  trans-56.5141.3166.7-72.2-172-7.600109.2P203 A207P203-Q205 VanDerWaalsContact C-N 3.34Å; P203-Q205 PolarHBondContact O-N 2.72Å; Q205-A207 PolarHBondContact O-N 3.2Å
206S45.9Very low49.5Very low126 Ų126124.7 Ų124.788%0.88176%0.761SS**  trans-40.5120.1174.6-47.80000112.7
207A50Low49.1Very low92 Ų92129.2 Ų129.276%0.7678%0.778SS**  trans-147.689.215200000108.4Q205Q205-A207 PolarHBondContact O-N 3.2Å
208T46.1Very low48.5Very low121 Ų121129 Ų12974%0.74278%0.777SS**  trans-33.8151.2141.7-175.80000112.3
209T43.1Very low48.4Very low137 Ų137130.4 Ų130.484%0.8478%0.778SS**  trans101.2128.5162710000119.6
210G39Very low48Very low72 Ų72132.5 Ų132.574%0.74278%0.782SS**  trans9992165.500000112.7
211Y44.6Very low47.5Very low234 Ų234130.6 Ų130.692%0.91878%0.782SS**  42.896.358.4-127.5-82000112.3
212S47.6Very low47.5Very low118 Ų118127.4 Ų127.483%0.82578%0.779SS**  trans147.2141.5156.8-72.40000107.8
213S44.7Very low47.4Very low108 Ų108131.1 Ų131.176%0.75579%0.792SS**  cis-179.8144-13-171.20000102.7
214A45.6Very low46.9Very low88 Ų88129.9 Ų129.973%0.72780%0.795SS**  trans42108.315400000119.4
215S46.1Very low46.3Very low114 Ų114131.7 Ų131.780%0.79780%0.797SS**  trans-159.690.2132.7-1440000106.4
216E47.8Very low46.6Very low178 Ų178127.1 Ų127.183%0.83279%0.786SS**  4386.196.1-70.6-168.5171.500111.8
217L48.7Very low47Very low178 Ų178126 Ų12693%0.93278%0.778SS**  trans-139.7110.1134.8-96171.1000107.7
218S42.8Very low47.2Very low93 Ų93127.1 Ų127.165%0.6578%0.78SS**  trans-78.9143.9-168.8690000112
219I49.3Very low47.6Very low142 Ų142127.3 Ų127.373%0.72878%0.776SS**  trans56.7103.8132.5-51.6161.1000115.4
220I46.6Very low48.3Very low161 Ų161125.6 Ų125.683%0.82676%0.762SS**  -143.298.2102.5-73123.2000106.3P222I220-P222 VanDerWaalsContact O-CD 3.31Å; I220-P222 WeakPolarHBondContact O-CD 3.18Å
221S43.5Very low49.2Very low109 Ų109130 Ų13076%0.76277%0.767SS**  trans-86.4112.6160.7-72.60000107.9
222P54.9Low49.6Very low114 Ų114124.7 Ų124.774%0.7475%0.754SS**  trans-82.9112.9151.930.2-22.8000107.5I220 G224I220-P222 VanDerWaalsContact O-CD 3.31Å; I220-P222 WeakPolarHBondContact O-CD 3.18Å; P222-G224 PolarHBondContact O-N 2.91Å; P222-G224 VanDerWaalsContact O-N 3.12Å
223N44.9Very low50.2Low170 Ų170125.3 Ų125.391%0.90974%0.744SS**  trans-17.2104.7169.4-75.4-22.2000114.5
224G45Very low51.3Low62 Ų62122.1 Ų122.164%0.63973%0.728SS**  trans-124.684.9167.900000108.5P222P222-G224 PolarHBondContact O-N 2.91Å; P222-G224 VanDerWaalsContact O-N 3.12Å
225D46.7Very low52.7Low165 Ų165120.2 Ų120.288%0.88271%0.71SS**  trans-149.561.4164.3-84.4-32000108.5
226S55.3Low54.1Low88 Ų88119.4 Ų119.462%0.61570%0.7SS**  trans-130.81.9165.2-58.70000113.1S228S226-S228 PolarHBondContact O-N 2.81Å
227S55.6Low55.4Low101 Ų101119.8 Ų119.871%0.70669%0.693SS**THydrogen-bonded Turntrans-80.2-13.7-167.8-58.60000115
228S54Low56.6Low117 Ų117116.1 Ų116.182%0.81867%0.671SS**THydrogen-bonded Turntrans-90.7-9.4178.744.80000114.5S226S226-S228 PolarHBondContact O-N 2.81Å
229L54.4Low58.4Low124 Ų124118.1 Ų118.165%0.64967%0.668SS**THydrogen-bonded Turntrans-86.4-23.2174.4-94.7167.9000113.8L231 L232 E233L229-L231 VanDerWaalsContact C-N 3.31Å; L229-L231 PolarHBondContact O-N 3.44Å; L229-L232 PolarHBondContact O-N 2.95Å; L229-E233 PolarHBondContact O-N 3.39Å
230N58.4Low60.1Low101 Ų101114.9 Ų114.954%0.5466%0.659SS.*Hα-helixtrans-69.6-23.4-173-68.3-24.4000114.2G234N230-G234 PolarHBondContact O-N 3.45Å
231L57Low61.7Low164 Ų164111.1 Ų111.186%0.85964%0.639SS**Hα-helixtrans-76-27.7179.8-129.1109.6000112.7L229L229-L231 VanDerWaalsContact C-N 3.31Å; L229-L231 PolarHBondContact O-N 3.44Å
232L52.9Low63.3Low124 Ų124112.9 Ų112.965%0.64963%0.629SS**Hα-helixtrans-83.4-32.2177.6-161.669000111.6L229 G234 S235 V236L229-L232 PolarHBondContact O-N 2.95Å; L232-G234 PolarHBondContact O-N 2.95Å; L232-S235 PolarHBondContact O-N 3.28Å; L232-V236 PolarHBondContact O-N 2.95Å
233E61Low64.5Low131 Ų131113.1 Ų113.161%0.61262%0.624SS**Hα-helixtrans-67.3-34.8179.2-160.5166.1-160.100112.4L229 S235 V236 R237L229-E233 PolarHBondContact O-N 3.39Å; E233-S235 VanDerWaalsContact C-N 3.31Å; E233-S235 PolarHBondContact O-N 3.42Å; E233-V236 PolarHBondContact O-N 2.8Å; E233-R237 PolarHBondContact O-N 3.06Å
234G67.1Low66.4Low40 Ų40107.5 Ų107.541%0.41260%0.601SS.*Hα-helixtrans-58-40.8171.900000113.1N230 L232 R237 E238N230-G234 PolarHBondContact O-N 3.45Å; L232-G234 PolarHBondContact O-N 2.95Å; G234-R237 PolarHBondContact O-N 3.38Å; G234-E238 WeakPolarHBondContact O-CB 3.47Å; G234-E238 PolarHBondContact O-N 2.94Å
235S74.5Confident68.3Low49 Ų49110.1 Ų110.134%0.34360%0.596SS.*Hα-helixtrans-69.2-34.9179.3-172.10000112.8L232 E233 K239L232-S235 PolarHBondContact O-N 3.28Å; E233-S235 VanDerWaalsContact C-N 3.31Å; E233-S235 PolarHBondContact O-N 3.42Å; S235-K239 WeakPolarHBondContact O-CB 3.42Å; S235-K239 VanDerWaalsContact O-CG 3.26Å; S235-K239 WeakPolarHBondContact O-CG 3.44Å; S235-K239 PolarHBondContact O-N 3.03Å; S235-K239 VanDerWaalsContact O-N 3.12Å
236V74.8Confident70Confident97 Ų97107.3 Ų107.359%0.58858%0.581SS**Hα-helixtrans-71.2-42.4177179.60000110.4L232 E233 K239 S240L232-V236 PolarHBondContact O-N 2.95Å; E233-V236 PolarHBondContact O-N 2.8Å; V236-K239 PolarHBondContact O-N 3.44Å; V236-S240 PolarHBondContact O-N 3.28Å
237R75.1Confident71.7Confident185 Ų185106.4 Ų106.470%0.69857%0.574SS**Hα-helixtrans-64.9-42.6177.9-166.9176.4178.4-158.7-1.8111.9E233 G234 K239 S240 I241E233-R237 PolarHBondContact O-N 3.06Å; G234-R237 PolarHBondContact O-N 3.38Å; R237-K239 PolarHBondContact O-N 3.5Å; R237-S240 WeakPolarHBondContact O-CB 3.31Å; R237-S240 PolarHBondContact O-N 2.81Å; R237-I241 HydrophobicContact CG-CD1 4.23Å; R237-I241 WeakPolarHBondContact O-CG1 3.33Å; R237-I241 PolarHBondContact O-N 3.39Å
238E75Confident73.6Confident101 Ų101106.6 Ų106.647%0.47257%0.567SS.*Hα-helixtrans-65.4-39.5177.7-163.2-178.4171.100112G234 S240 I241 R242G234-E238 WeakPolarHBondContact O-CB 3.47Å; G234-E238 PolarHBondContact O-N 2.94Å; E238-S240 VanDerWaalsContact C-N 3.34Å; E238-S240 PolarHBondContact O-N 2.93Å; E238-I241 PolarHBondContact O-N 3.19Å; E238-R242 WeakPolarHBondContact O-CG 3.33Å; E238-R242 PolarHBondContact O-N 3.39Å; E238-R242 IonicContact OE1-CZ 3.43Å; E238-R242 IonicContact OE1-NE 2.81Å; E238-R242 IonicContact OE1-NH2 3.55Å; E238-R242 PolarHBondContact OE1-NH2 3.36Å
239K80.6Confident75.4Confident135 Ų135108.5 Ų108.559%0.58756%0.558SS**Hα-helixtrans-63.5-38.8172.2-75173.1-177.4174.30112.3S235 V236 R237 L243S235-K239 WeakPolarHBondContact O-CB 3.42Å; S235-K239 VanDerWaalsContact O-CG 3.26Å; S235-K239 WeakPolarHBondContact O-CG 3.44Å; S235-K239 PolarHBondContact O-N 3.03Å; S235-K239 VanDerWaalsContact O-N 3.12Å; V236-K239 PolarHBondContact O-N 3.44Å; R237-K239 PolarHBondContact O-N 3.5Å; K239-L243 WeakPolarHBondContact O-CB 3.33Å; K239-L243 VanDerWaalsContact O-CG 3.28Å; K239-L243 WeakPolarHBondContact O-CG 3.43Å; K239-L243 PolarHBondContact O-N 3.25Å
240S83.7Confident77.2Confident75 Ų75108.8 Ų108.852%0.52456%0.556SS.*Hα-helixtrans-66.1-39177.5-166.90000112.3V236 R237 E238 L243 A244V236-S240 PolarHBondContact O-N 3.28Å; R237-S240 WeakPolarHBondContact O-CB 3.31Å; R237-S240 PolarHBondContact O-N 2.81Å; E238-S240 VanDerWaalsContact C-N 3.34Å; E238-S240 PolarHBondContact O-N 2.93Å; S240-L243 PolarHBondContact O-N 3.16Å; S240-A244 PolarHBondContact O-N 2.92Å; S240-A244 VanDerWaalsContact O-N 3.07Å
241I81.7Confident78.8Confident82 Ų82108.6 Ų108.642%0.42155%0.554SS.*Hα-helixtrans-66.1-47.6177.3-67.8165.7000110.1R237 E238 L243 A244 E245R237-I241 HydrophobicContact CG-CD1 4.23Å; R237-I241 WeakPolarHBondContact O-CG1 3.33Å; R237-I241 PolarHBondContact O-N 3.39Å; E238-I241 PolarHBondContact O-N 3.19Å; I241-L243 VanDerWaalsContact C-N 3.29Å; I241-L243 PolarHBondContact O-N 3.43Å; I241-A244 WeakPolarHBondContact O-CB 3.46Å; I241-A244 PolarHBondContact O-N 2.96Å; I241-E245 HydrophobicContact CG2-CG 4.46Å; I241-E245 WeakPolarHBondContact O-CG 3.33Å; I241-E245 PolarHBondContact O-N 3.3Å
242R76.8Confident80.7Confident146 Ų146103.4 Ų103.455%0.55154%0.535SS*.Hα-helixtrans-62.5-34177.6-67.8-175-167.5-171.95113.1E238 L246E238-R242 WeakPolarHBondContact O-CG 3.33Å; E238-R242 PolarHBondContact O-N 3.39Å; E238-R242 IonicContact OE1-CZ 3.43Å; E238-R242 IonicContact OE1-NE 2.81Å; E238-R242 IonicContact OE1-NH2 3.55Å; E238-R242 PolarHBondContact OE1-NH2 3.36Å; R242-L246 VanDerWaalsContact O-CG 3.3Å; R242-L246 WeakPolarHBondContact O-CG 3.38Å; R242-L246 PolarHBondContact O-N 3.31Å
243L79.5Confident82.7Confident119 Ų119101.1 Ų101.162%0.62352%0.523SS*.Hα-helixtrans-69.1-35.8174.2-74172.8000112.3K239 S240 I241 S247K239-L243 WeakPolarHBondContact O-CB 3.33Å; K239-L243 VanDerWaalsContact O-CG 3.28Å; K239-L243 WeakPolarHBondContact O-CG 3.43Å; K239-L243 PolarHBondContact O-N 3.25Å; S240-L243 PolarHBondContact O-N 3.16Å; I241-L243 VanDerWaalsContact C-N 3.29Å; I241-L243 PolarHBondContact O-N 3.43Å; L243-S247 PolarHBondContact O-N 3.31Å; L243-S247 VanDerWaalsContact O-N 3.1Å
244A86.1Confident84.2Confident51 Ų51103.7 Ų103.742%0.42153%0.527SS..Hα-helixtrans-67.2-43.6173.400000111.4S240 I241 L246 S247 D248S240-A244 PolarHBondContact O-N 2.92Å; S240-A244 VanDerWaalsContact O-N 3.07Å; I241-A244 WeakPolarHBondContact O-CB 3.46Å; I241-A244 PolarHBondContact O-N 2.96Å; A244-L246 VanDerWaalsContact C-N 3.34Å; A244-L246 PolarHBondContact O-N 2.9Å; A244-S247 WeakPolarHBondContact O-CB 3.42Å; A244-S247 PolarHBondContact O-N 2.87Å; A244-S247 VanDerWaalsContact O-N 3.14Å; A244-D248 PolarHBondContact O-N 3.46Å
245E84.8Confident85.6Confident118 Ų118106.6 Ų106.655%0.55153%0.532SS*.Hα-helixtrans-61.3-39.2175.9-70.1172.1171.300112.5I241 D248 Y249I241-E245 HydrophobicContact CG2-CG 4.46Å; I241-E245 WeakPolarHBondContact O-CG 3.33Å; I241-E245 PolarHBondContact O-N 3.3Å; E245-D248 PolarHBondContact O-N 3.38Å; E245-Y249 WeakPolarHBondContact O-CB 3.31Å; E245-Y249 PolarHBondContact O-N 3.44Å
246L82.5Confident86.6Confident106 Ų106110.1 Ų110.156%0.55554%0.544SS*.Hα-helixtrans-66.2-38.5174.3-73.8171.5000112.1R242 A244 Y249 E250R242-L246 VanDerWaalsContact O-CG 3.3Å; R242-L246 WeakPolarHBondContact O-CG 3.38Å; R242-L246 PolarHBondContact O-N 3.31Å; A244-L246 VanDerWaalsContact C-N 3.34Å; A244-L246 PolarHBondContact O-N 2.9Å; L246-Y249 PolarHBondContact O-N 2.99Å; L246-E250 PolarHBondContact O-N 3.47Å
247S90.9Very high87.6Confident69 Ų69110 Ų11048%0.48354%0.54SS..Hα-helixtrans-63.7-42.6174.3178.80000111.6L243 A244 E250 L251L243-S247 PolarHBondContact O-N 3.31Å; L243-S247 VanDerWaalsContact O-N 3.1Å; A244-S247 WeakPolarHBondContact O-CB 3.42Å; A244-S247 PolarHBondContact O-N 2.87Å; A244-S247 VanDerWaalsContact O-N 3.14Å; S247-E250 PolarHBondContact O-N 2.86Å; S247-L251 WeakPolarHBondContact O-CB 3.49Å; S247-L251 PolarHBondContact O-N 3.01Å
248D94.2Very high88.5Confident104 Ų104107.6 Ų107.656%0.55654%0.536SS*.Hα-helixtrans-68.3-37.2178.9-72.5-11.6000111.6A244 E245 L251 A252A244-D248 PolarHBondContact O-N 3.46Å; E245-D248 PolarHBondContact O-N 3.38Å; D248-L251 PolarHBondContact O-N 3.29Å; D248-A252 WeakPolarHBondContact O-CB 3.37Å; D248-A252 PolarHBondContact O-N 2.89Å
249Y91.7Very high89.4Confident158 Ų158109.8 Ų109.862%0.6255%0.547SS*.Hα-helixtrans-63.8-45172.7-178.5-99000112.1E245 L246 L251 A252 L253E245-Y249 WeakPolarHBondContact O-CB 3.31Å; E245-Y249 PolarHBondContact O-N 3.44Å; L246-Y249 PolarHBondContact O-N 2.99Å; Y249-L251 VanDerWaalsContact C-N 3.32Å; Y249-L251 PolarHBondContact O-N 2.84Å; Y249-A252 PolarHBondContact O-N 2.97Å; Y249-L253 WeakPolarHBondContact O-CB 3.48Å; Y249-L253 PolarHBondContact O-N 2.76Å
250E93.2Very high90Very high130 Ų130106 Ų10661%0.60754%0.541SS*.Hα-helixtrans-62.6-38.3174.6-78-173.8175.600112.3L246 S247 L253 R254L246-E250 PolarHBondContact O-N 3.47Å; S247-E250 PolarHBondContact O-N 2.86Å; E250-L253 PolarHBondContact O-N 3.26Å; E250-R254 PolarHBondContact O-N 2.98Å
251L92.6Very high90.4Very high97 Ų97106.3 Ų106.351%0.50854%0.542SS..Hα-helixtrans-65.8-44.4175.9-177.664000111.6S247 D248 Y249 L253 R254 L255S247-L251 WeakPolarHBondContact O-CB 3.49Å; S247-L251 PolarHBondContact O-N 3.01Å; D248-L251 PolarHBondContact O-N 3.29Å; Y249-L251 VanDerWaalsContact C-N 3.32Å; Y249-L251 PolarHBondContact O-N 2.84Å; L251-L253 VanDerWaalsContact C-N 3.33Å; L251-L253 PolarHBondContact O-N 3.25Å; L251-R254 PolarHBondContact O-N 3.45Å; L251-L255 HydrophobicContact CG-CD1 4.33Å; L251-L255 WeakPolarHBondContact O-CG 3.36Å; L251-L255 PolarHBondContact O-N 2.94Å
252A95.8Very high90.9Very high54 Ų54105 Ų10545%0.44654%0.543SS..Hα-helixtrans-61.4-41.7176.100000111.6D248 Y249 R254 L255 Q256D248-A252 WeakPolarHBondContact O-CB 3.37Å; D248-A252 PolarHBondContact O-N 2.89Å; Y249-A252 PolarHBondContact O-N 2.97Å; A252-R254 VanDerWaalsContact C-N 3.34Å; A252-R254 PolarHBondContact O-N 3.45Å; A252-L255 PolarHBondContact O-N 2.89Å; A252-Q256 WeakPolarHBondContact O-CB 3.38Å; A252-Q256 PolarHBondContact O-N 2.93Å
253L95.4Very high91.5Very high77 Ų77100.7 Ų100.740%0.40354%0.538SS..Hα-helixtrans-64.4-38.7176.4-153.383.3000111.8Y249 E250 L251 N257Y249-L253 WeakPolarHBondContact O-CB 3.48Å; Y249-L253 PolarHBondContact O-N 2.76Å; E250-L253 PolarHBondContact O-N 3.26Å; L251-L253 VanDerWaalsContact C-N 3.33Å; L251-L253 PolarHBondContact O-N 3.25Å; L253-N257 VanDerWaalsContact O-CG 3.29Å; L253-N257 PolarHBondContact O-N 2.88Å; L253-N257 VanDerWaalsContact O-N 3.08Å; L253-N257 PolarHBondContact O-ND2 3.45Å; L253-N257 VanDerWaalsContact O-ND2 3.14Å
254R92.8Very high92.1Very high185 Ų18599 Ų9970%0.69853%0.533SS*.Hα-helixtrans-64.2-47.1173.8-91.5-175.3169.6148.70.1112.4E250 L251 A252 Q256 N257 E258E250-R254 PolarHBondContact O-N 2.98Å; L251-R254 PolarHBondContact O-N 3.45Å; A252-R254 VanDerWaalsContact C-N 3.34Å; A252-R254 PolarHBondContact O-N 3.45Å; R254-Q256 VanDerWaalsContact C-N 3.31Å; R254-Q256 PolarHBondContact O-N 3.46Å; R254-N257 PolarHBondContact O-N 3.42Å; R254-E258 WeakPolarHBondContact O-CB 3.49Å; R254-E258 PolarHBondContact O-N 2.96Å
255L95.2Very high92.2Very high100 Ų100101.1 Ų101.152%0.52454%0.537SS..Hα-helixtrans-61.5-41.4178.3-76.4170.1000111.6L251 A252 N257 E258 E259L251-L255 HydrophobicContact CG-CD1 4.33Å; L251-L255 WeakPolarHBondContact O-CG 3.36Å; L251-L255 PolarHBondContact O-N 2.94Å; A252-L255 PolarHBondContact O-N 2.89Å; L255-N257 VanDerWaalsContact C-N 3.35Å; L255-N257 PolarHBondContact O-N 3.46Å; L255-E258 PolarHBondContact O-N 3.33Å; L255-E259 WeakPolarHBondContact O-CB 3.45Å; L255-E259 PolarHBondContact O-N 3.44Å
256Q96.3Very high92.3Very high124 Ų124100.8 Ų100.858%0.57954%0.536SS*.Hα-helixtrans-63.2-40.3176-172.3175.923.800112.2A252 R254 A260A252-Q256 WeakPolarHBondContact O-CB 3.38Å; A252-Q256 PolarHBondContact O-N 2.93Å; R254-Q256 VanDerWaalsContact C-N 3.31Å; R254-Q256 PolarHBondContact O-N 3.46Å; Q256-A260 WeakPolarHBondContact O-CB 3.35Å; Q256-A260 PolarHBondContact O-N 3.25Å
257N94.9Very high92.5Very high95 Ų95101.9 Ų101.951%0.50854%0.538SS..Hα-helixtrans-67.4-39.5175.4-73.6-31.7000112L253 R254 L255 A260 C261L253-N257 VanDerWaalsContact O-CG 3.29Å; L253-N257 PolarHBondContact O-N 2.88Å; L253-N257 VanDerWaalsContact O-N 3.08Å; L253-N257 PolarHBondContact O-ND2 3.45Å; L253-N257 VanDerWaalsContact O-ND2 3.14Å; R254-N257 PolarHBondContact O-N 3.42Å; L255-N257 VanDerWaalsContact C-N 3.35Å; L255-N257 PolarHBondContact O-N 3.46Å; N257-A260 PolarHBondContact O-N 3.25Å; N257-C261 PolarHBondContact O-N 3.32Å; N257-C261 PolarHBondContact O-SG 2.99Å; N257-C261 VanDerWaalsContact O-SG 3.35Å
258E94Very high92.4Very high134 Ų134104.4 Ų104.463%0.62654%0.542SS*.Hα-helixtrans-66.5-40.7177.2-168.8172.2-178.400111.7R254 L255 C261 A262R254-E258 WeakPolarHBondContact O-CB 3.49Å; R254-E258 PolarHBondContact O-N 2.96Å; L255-E258 PolarHBondContact O-N 3.33Å; E258-C261 PolarHBondContact O-N 2.94Å; E258-A262 WeakPolarHBondContact O-CB 3.4Å; E258-A262 PolarHBondContact O-N 2.72Å
259E95.2Very high92.1Very high147 Ų147105.8 Ų105.869%0.68755%0.545SS*.Hα-helixtrans-63.5-41.4173.4-172.3175.5-166.800111.7L255 A262 A263L255-E259 WeakPolarHBondContact O-CB 3.45Å; L255-E259 PolarHBondContact O-N 3.44Å; E259-A262 PolarHBondContact O-N 2.95Å; E259-A263 WeakPolarHBondContact O-CB 3.21Å; E259-A263 PolarHBondContact O-N 2.86Å
260A93.7Very high91.8Very high56 Ų56105.8 Ų105.846%0.46354%0.544SS..Hα-helixtrans-63.7-40.4174.800000112.2Q256 N257 V264Q256-A260 WeakPolarHBondContact O-CB 3.35Å; Q256-A260 PolarHBondContact O-N 3.25Å; N257-A260 PolarHBondContact O-N 3.25Å; A260-V264 WeakPolarHBondContact O-CG2 3.5Å; A260-V264 PolarHBondContact O-N 3.36Å
261C91.4Very high91.4Very high81 Ų81104 Ų10455%0.54754%0.539SS..Hα-helixtrans-65.7-43.9174.4-73.10000112N257 E258 A263 V264 D265N257-C261 PolarHBondContact O-N 3.32Å; N257-C261 PolarHBondContact O-SG 2.99Å; N257-C261 VanDerWaalsContact O-SG 3.35Å; E258-C261 PolarHBondContact O-N 2.94Å; C261-A263 VanDerWaalsContact C-N 3.3Å; C261-A263 PolarHBondContact O-N 2.91Å; C261-V264 PolarHBondContact O-N 3.4Å; C261-V264 VanDerWaalsContact O-N 3.17Å; C261-D265 PolarHBondContact O-N 3.18Å; C261-D265 VanDerWaalsContact O-N 3.08Å
262A91.4Very high91Very high53 Ų53103.3 Ų103.344%0.43854%0.539SS..Hα-helixtrans-62.4-36.7178.300000112.4E258 E259 V264 D265 E266E258-A262 WeakPolarHBondContact O-CB 3.4Å; E258-A262 PolarHBondContact O-N 2.72Å; E259-A262 PolarHBondContact O-N 2.95Å; A262-V264 VanDerWaalsContact C-N 3.34Å; A262-V264 PolarHBondContact O-N 2.9Å; A262-D265 PolarHBondContact O-N 3.17Å; A262-E266 PolarHBondContact O-N 2.86Å
263A91Very high90.4Very high56 Ų56108.5 Ų108.546%0.46355%0.551SS.*Hα-helixtrans-64.4-37.4175.500000112.6E259 C261 Q267E259-A263 WeakPolarHBondContact O-CB 3.21Å; E259-A263 PolarHBondContact O-N 2.86Å; C261-A263 VanDerWaalsContact C-N 3.3Å; C261-A263 PolarHBondContact O-N 2.91Å; A263-Q267 PolarHBondContact O-N 2.97Å; A263-Q267 VanDerWaalsContact O-N 3.13Å
264V90.6Very high89.6Confident85 Ų85111.9 Ų111.952%0.51557%0.565SS.*Hα-helixtrans-66.6-44.3175.5174.30000110.7A260 C261 A262 E266 Q267 Q268A260-V264 WeakPolarHBondContact O-CG2 3.5Å; A260-V264 PolarHBondContact O-N 3.36Å; C261-V264 PolarHBondContact O-N 3.4Å; C261-V264 VanDerWaalsContact O-N 3.17Å; A262-V264 VanDerWaalsContact C-N 3.34Å; A262-V264 PolarHBondContact O-N 2.9Å; V264-E266 PolarHBondContact O-N 3.48Å; V264-Q267 PolarHBondContact O-N 3.24Å; V264-Q268 WeakPolarHBondContact O-CB 3.28Å; V264-Q268 PolarHBondContact O-N 2.89Å
265D88.4Confident88.6Confident95 Ų95111.5 Ų111.551%0.50857%0.571SS.*Hα-helixtrans-63.2-42.2178.5-75.2-14.8000111.9C261 A262 Q267 Q268 Q269C261-D265 PolarHBondContact O-N 3.18Å; C261-D265 VanDerWaalsContact O-N 3.08Å; A262-D265 PolarHBondContact O-N 3.17Å; D265-Q267 VanDerWaalsContact C-N 3.32Å; D265-Q267 PolarHBondContact O-N 3.45Å; D265-Q268 PolarHBondContact O-N 2.9Å; D265-Q269 WeakPolarHBondContact O-CG 3.43Å; D265-Q269 PolarHBondContact O-N 2.99Å
266E88Confident87.2Confident110 Ų110110.6 Ų110.651%0.51457%0.573SS.*Hα-helixtrans-60.3-42.1174-85.5-157.5-172.500112.1A262 V264 Q268 Q269 R270A262-E266 PolarHBondContact O-N 2.86Å; V264-E266 PolarHBondContact O-N 3.48Å; E266-Q268 VanDerWaalsContact C-N 3.34Å; E266-Q269 PolarHBondContact O-N 3.31Å; E266-R270 WeakPolarHBondContact O-CG 3.34Å; E266-R270 PolarHBondContact O-N 2.75Å; E266-R270 IonicContact OE2-NH2 3.72Å; E266-R270 PolarHBondContact OE2-NH2 3.18Å; E266-R270 VanDerWaalsContact OE2-NH2 3.14Å
267Q85.8Confident85.7Confident130 Ų130109.9 Ų109.961%0.60758%0.577SS**Hα-helixtrans-68.8-35.7179.8-166.4160.5-10.900111.6A263 V264 D265 R270 N271A263-Q267 PolarHBondContact O-N 2.97Å; A263-Q267 VanDerWaalsContact O-N 3.13Å; V264-Q267 PolarHBondContact O-N 3.24Å; D265-Q267 VanDerWaalsContact C-N 3.32Å; D265-Q267 PolarHBondContact O-N 3.45Å; Q267-R270 PolarHBondContact O-N 3.49Å; Q267-N271 VanDerWaalsContact O-CG 3.24Å; Q267-N271 PolarHBondContact O-N 3.39Å; Q267-N271 PolarHBondContact O-ND2 3.45Å
268Q88.3Confident84.2Confident121 Ų121110.3 Ų110.357%0.56559%0.585SS**Hα-helixtrans-70-35.2175.2-162156.3-6.900112.2V264 D265 E266 N271 T272V264-Q268 WeakPolarHBondContact O-CB 3.28Å; V264-Q268 PolarHBondContact O-N 2.89Å; D265-Q268 PolarHBondContact O-N 2.9Å; E266-Q268 VanDerWaalsContact C-N 3.34Å; Q268-N271 PolarHBondContact O-N 3.44Å; Q268-T272 WeakPolarHBondContact O-CG2 3.46Å; Q268-T272 PolarHBondContact O-N 3.35Å; Q268-T272 PolarHBondContact O-OG1 3.21Å
269Q87.7Confident82.9Confident133 Ų133110.5 Ų110.562%0.62160%0.595SS**Hα-helixtrans-66.1-38.1170.9-73.6-178.520.200112.6D265 E266 T272 K273D265-Q269 WeakPolarHBondContact O-CG 3.43Å; D265-Q269 PolarHBondContact O-N 2.99Å; E266-Q269 PolarHBondContact O-N 3.31Å; Q269-T272 WeakPolarHBondContact CA-OG1 3.32Å; Q269-T272 PolarHBondContact O-OG1 3.23Å; Q269-K273 WeakPolarHBondContact O-CB 3.39Å; Q269-K273 PolarHBondContact O-N 3Å
270R85.8Confident81.1Confident159 Ų159108.2 Ų108.260%0.660%0.595SS**Hα-helixtrans-64.6-45.5174-70.6178-164.2-172.19.4111.3E266 Q267 T272 K273 E274E266-R270 WeakPolarHBondContact O-CG 3.34Å; E266-R270 PolarHBondContact O-N 2.75Å; E266-R270 IonicContact OE2-NH2 3.72Å; E266-R270 PolarHBondContact OE2-NH2 3.18Å; E266-R270 VanDerWaalsContact OE2-NH2 3.14Å; Q267-R270 PolarHBondContact O-N 3.49Å; R270-T272 PolarHBondContact O-N 3.32Å; R270-K273 PolarHBondContact O-N 2.89Å; R270-E274 PolarHBondContact O-N 3.12Å; R270-E274 VanDerWaalsContact O-N 3.08Å
271N85.6Confident79.6Confident91 Ų91110.9 Ų110.949%0.48761%0.608SS.*Hα-helixtrans-62.5-39.8178.4-69.9-16.6000112.9Q267 Q268 Q275Q267-N271 VanDerWaalsContact O-CG 3.24Å; Q267-N271 PolarHBondContact O-N 3.39Å; Q267-N271 PolarHBondContact O-ND2 3.45Å; Q268-N271 PolarHBondContact O-N 3.44Å; N271-Q275 PolarHBondContact O-N 2.91Å
272T83.6Confident78Confident84 Ų84116 Ų11652%0.51562%0.621SS.*Hα-helixtrans-70.5-34.8177.544.40000112.6Q268 Q269 R270 Q275 S276Q268-T272 WeakPolarHBondContact O-CG2 3.46Å; Q268-T272 PolarHBondContact O-N 3.35Å; Q268-T272 PolarHBondContact O-OG1 3.21Å; Q269-T272 WeakPolarHBondContact CA-OG1 3.32Å; Q269-T272 PolarHBondContact O-OG1 3.23Å; R270-T272 PolarHBondContact O-N 3.32Å; T272-Q275 PolarHBondContact O-N 3.18Å; T272-S276 PolarHBondContact O-N 3.03Å
273K82.9Confident76.4Confident162 Ų162119.9 Ų119.970%0.70464%0.639SS**Hα-helixtrans-70.4-32.1176.9-163.7172.6-175.1178.40113Q269 R270 S276Q269-K273 WeakPolarHBondContact O-CB 3.39Å; Q269-K273 PolarHBondContact O-N 3Å; R270-K273 PolarHBondContact O-N 2.89Å; K273-S276 PolarHBondContact O-OG 3.22Å
274E78.2Confident74.6Confident148 Ų148125.6 Ų125.669%0.69265%0.654SS**Hα-helixtrans-74.3-32.3175.7-72.6-175.8178.600112.8R270 S276R270-E274 PolarHBondContact O-N 3.12Å; R270-E274 VanDerWaalsContact O-N 3.08Å; E274-S276 VanDerWaalsContact C-N 3.32Å; E274-S276 PolarHBondContact O-N 2.83Å
275Q72.4Confident72.6Confident177 Ų177125.8 Ų125.883%0.82766%0.664SS**Hα-helixtrans-74.5-19.9174.8-83.1-178-5.800113.9N271 T272N271-Q275 PolarHBondContact O-N 2.91Å; T272-Q275 PolarHBondContact O-N 3.18Å
276S66.4Low70.6Confident81 Ų81126.8 Ų126.857%0.56668%0.677SS**THydrogen-bonded Turntrans-92.816.7-177.476.80000114.3T272 K273 E274 P278T272-S276 PolarHBondContact O-N 3.03Å; K273-S276 PolarHBondContact O-OG 3.22Å; E274-S276 VanDerWaalsContact C-N 3.32Å; E274-S276 PolarHBondContact O-N 2.83Å; S276-P278 WeakPolarHBondContact O-CD 3.25Å
277V64.5Low68.8Low110 Ų110129.2 Ų129.267%0.66769%0.694SS**  trans-66.8107.3171.5-179.70000107.5V279V277-V279 PolarHBondContact O-N 3.04Å; V277-V279 VanDerWaalsContact O-N 3.11Å
278P62.6Low67Low103 Ų103125.8 Ų125.867%0.66969%0.693SS**  trans-64.5121.7178.928.3-31.3000107S276 S280S276-P278 WeakPolarHBondContact O-CD 3.25Å; P278-S280 VanDerWaalsContact C-N 3.28Å; P278-S280 PolarHBondContact O-N 3.23Å
279V67.7Low65.1Low138 Ų138129.8 Ų129.884%0.83671%0.709SS**  trans-57100.8166.2176.40000105.8V277 P281V277-V279 PolarHBondContact O-N 3.04Å; V277-V279 VanDerWaalsContact O-N 3.11Å; V279-P281 WeakPolarHBondContact O-CD 3.26Å
280S57.4Low63.2Low99 Ų99134 Ų13469%0.69272%0.721SS**  trans-49.2117.2177.9-65.30000108.1P278 K282P278-S280 VanDerWaalsContact C-N 3.28Å; P278-S280 PolarHBondContact O-N 3.23Å; S280-K282 PolarHBondContact O-N 2.84Å
281P61.2Low61.3Low113 Ų113135.8 Ų135.873%0.73473%0.733SS**  trans-61.1118.2174.718-21.6000106.4V279 V283V279-P281 WeakPolarHBondContact O-CD 3.26Å; P281-V283 PolarHBondContact O-N 2.74Å
282K58.9Low59.4Low187 Ų187140.4 Ų140.481%0.81375%0.752SS**  trans-49.9105.7169.8-81176.6176.4174.40106.8S280 F284S280-K282 PolarHBondContact O-N 2.84Å; K282-F284 PolarHBondContact O-N 3.35Å
283V56.4Low57.4Low136 Ų136139.5 Ų139.582%0.82476%0.76SS**  trans-65.893.1171.6-179.70000105.7P281 A285P281-V283 PolarHBondContact O-N 2.74Å; V283-A285 PolarHBondContact O-N 3.48Å
284F53.4Low55.6Low176 Ų176136.2 Ų136.277%0.77276%0.763SS**  trans-66.7107.5158.7-92.4-88.6000105.9K282 C286K282-F284 PolarHBondContact O-N 3.35Å; F284-C286 VanDerWaalsContact C-N 3.3Å; F284-C286 PolarHBondContact O-N 3Å
285A49.9Very low54.1Low88 Ų88136.7 Ų136.773%0.72777%0.77SS**  trans-6296164.900000107.8V283V283-A285 PolarHBondContact O-N 3.48Å
286C46.8Very low52.9Low116 Ų116132.9 Ų132.978%0.78476%0.763SS**  trans-107.5106.8157.7-750000106.4F284F284-C286 VanDerWaalsContact C-N 3.3Å; F284-C286 PolarHBondContact O-N 3Å
287D48.9Very low51.9Low161 Ų161134.4 Ų134.486%0.86177%0.773SS**  trans-53133.7172.8-72.7-47.4000111.3
288G48.4Very low51.1Low58 Ų58137.1 Ų137.160%0.59878%0.779SS**  trans74.3101.9151.200000116
289F48.7Very low50.4Low205 Ų205140.4 Ų140.490%0.89979%0.785SS**  -164.2110.7122.6-99.8-73.4000107.8F291F289-F291 PolarHBondContact O-N 3.27Å
290Y48.4Very low49.4Very low223 Ų223146 Ų14688%0.87579%0.791SS**  trans-62.9118166.9-80.7-100.6000108.1
291F45.9Very low49Very low196 Ų196152.7 Ų152.786%0.8680%0.801SS**  trans-117.192.4159.9-118.9-88.4000107.4F289 G293F289-F291 PolarHBondContact O-N 3.27Å; F291-G293 PolarHBondContact O-N 3.5Å
292E44.8Very low48.3Very low187 Ų187151.8 Ų151.887%0.87480%0.803SS**  trans-65.2114.4157.1-79.8179.8145.300107.4
293G41Very low47.8Very low66 Ų66152 Ų15268%0.6881%0.807SS**  trans-152.269.917900000109.2F291 N295F291-G293 PolarHBondContact O-N 3.5Å; G293-N295 PolarHBondContact O-N 3.12Å
294A46.6Very low47.9Very low93 Ų93152.2 Ų152.277%0.76981%0.808SS**  trans-55.2127.6161.100000109.2
295N46.5Very low47.6Very low158 Ų158152.3 Ų152.385%0.84582%0.816SS**  trans-175.797.3148.3-84-27.1000106G293G293-N295 PolarHBondContact O-N 3.12Å
296S46.5Very low47.8Very low97 Ų97156.3 Ų156.368%0.67885%0.849SS**  84.498.597.8-167.40000111E298S296-E298 PolarHBondContact O-N 3.04Å
297S44.6Very low47.9Very low112 Ų112158.4 Ų158.478%0.78385%0.853SS**  trans-31.7120.5146.748.50000113.1
298E48.6Very low47.8Very low168 Ų168158.2 Ų158.279%0.78585%0.852SS**  trans-166.998.9150.5-108.6170.4-166.600105.7S296S296-E298 PolarHBondContact O-N 3.04Å
299E48.5Very low47.8Very low171 Ų171163.8 Ų163.880%0.79987%0.866SS**  81.496.395.4-167.4168.9-141.800111.6
300R46.6Very low47.8Very low256 Ų256161.4 Ų161.497%0.96686%0.864SS**  trans-156.980.6147.8-106.1174.5-131.5-156.83.6108.9
301R47.5Very low47.7Very low240 Ų240157.5 Ų157.591%0.90686%0.864SS**  trans-70155.6152.5-86.5178.3166.8174.5-3.4109
302A47.5Very low47.8Very low93 Ų93154.9 Ų154.977%0.76986%0.864SS**  trans78.3105.915900000116.9
303E49.4Very low48Very low192 Ų192152.6 Ų152.690%0.89786%0.863SS**  -169.487119.7-101.4170.6-168.900108.4
304V57.1Low48.6Very low140 Ų140159.3 Ų159.385%0.84888%0.877SS**  trans-118.481.8159176.70000105.3
305L46.5Very low48.7Very low178 Ų178164.8 Ų164.893%0.93289%0.887SS**  trans-152.286.3164.8-81.7-176.3000109.4
306A55.8Low49Very low173 Ų173165.5 Ų165.5100%1.4389%0.89SS**  trans-169.40143.300000107.4

Retrieved 306 of 306 residues in 836.8 ms (Link to these results)