A0A5K4F6Q1_SCHMA Loading...

EF-hand domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F6Q1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 282 aa.

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(Predicted Aligned Error values between residue pairs)
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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
1M46.9Very low50.9Low240 Ų240153.2 Ų153.2100%1.18280%0.8SS**  0114.10-72.6-173.5158.100105.9E3M1-E3 PolarHBondContact O-N 3.21Å
2S49.9Very low50.5Low115 Ų115158.2 Ų158.280%0.80480%0.8SS**  trans-84106.7-173-54.20000109.5N4S2-N4 PolarHBondContact O-N 3.19Å
3E47Very low51Low180 Ų180160.5 Ų160.584%0.84180%0.801SS**  trans-8890.6165.7-85.3176.9130.500108.4M1 T5M1-E3 PolarHBondContact O-N 3.21Å; E3-T5 PolarHBondContact O-N 3.42Å
4N49.9Very low51.5Low146 Ų146160.9 Ų160.978%0.78180%0.799SS**  trans-79.890.9164.9-76.8-3.4000108S2 E6S2-N4 PolarHBondContact O-N 3.19Å; N4-E6 PolarHBondContact O-N 3.06Å
5T54.3Low51.5Low112 Ų112157.9 Ų157.969%0.68779%0.793SS**  trans-87.286.4171-55.90000108.7E3 I7E3-T5 PolarHBondContact O-N 3.42Å; T5-I7 HydrophobicContact CG2-CD1 4.43Å; T5-I7 HydrophobicContact CG2-CG1 3.92Å; T5-I7 PolarHBondContact O-N 3.28Å
6E46.9Very low51.7Low166 Ų166157.7 Ų157.778%0.77679%0.788SS**  trans-76.495.6172.7-171.8113-163.800109.2N4 Q8N4-E6 PolarHBondContact O-N 3.06Å; E6-Q8 HydrophobicContact CG-CG 4.41Å; E6-Q8 PolarHBondContact O-N 3.34Å
7I53.7Low52Low146 Ų146157.3 Ų157.375%0.74979%0.789SS**  trans-82.898.7175.2-55.1178.2000107.7T5T5-I7 HydrophobicContact CG2-CD1 4.43Å; T5-I7 HydrophobicContact CG2-CG1 3.92Å; T5-I7 PolarHBondContact O-N 3.28Å
8Q48.5Very low52.1Low162 Ų162156.7 Ų156.776%0.75779%0.787SS**  trans-77.3127.1170-67.8-160.443.400110.6E6 E10E6-Q8 HydrophobicContact CG-CG 4.41Å; E6-Q8 PolarHBondContact O-N 3.34Å; Q8-E10 PolarHBondContact O-N 3.5Å
9P55.9Low52.1Low109 Ų109153.7 Ų153.771%0.70878%0.78SS**  trans-84.593.9176.432.4-30.8000110.2I11P9-I11 PolarHBondContact O-N 3.19Å
10E52.8Low52.2Low160 Ų160151.3 Ų151.375%0.74878%0.775SS**  trans-79.383.7172.6-162.8171.9157.200110.1Q8 R12Q8-E10 PolarHBondContact O-N 3.5Å; E10-R12 VanDerWaalsContact C-N 3.28Å; E10-R12 PolarHBondContact O-N 3.12Å
11I53.9Low52.1Low149 Ų149152.1 Ų152.176%0.76478%0.779SS**  trans-72.887.2172.9-55.1176.1000107.9P9 K13P9-I11 PolarHBondContact O-N 3.19Å; I11-K13 PolarHBondContact O-N 3.38Å
12R46.3Very low52.4Low213 Ų213148.2 Ų148.280%0.80476%0.758SS**  trans-60.5104.3168.7-83-175.1173-161.8-1.4109.4E10 H14E10-R12 VanDerWaalsContact C-N 3.28Å; E10-R12 PolarHBondContact O-N 3.12Å; R12-H14 PolarHBondContact O-N 3.24Å; R12-H14 VanDerWaalsContact O-N 3.11Å
13K57.1Low52.1Low188 Ų188147.1 Ų147.182%0.81776%0.756SS**  trans-63.9109.8165.2-63.6-175.6-178.6-177.20107.8I11 V15I11-K13 PolarHBondContact O-N 3.38Å; K13-V15 VanDerWaalsContact C-N 3.33Å; K13-V15 PolarHBondContact O-N 2.92Å
14H57.4Low51.9Low167 Ų167144.1 Ų144.177%0.77375%0.75SS**  trans-69.792.5173-164.266.6000107.9R12 Q16R12-H14 PolarHBondContact O-N 3.24Å; R12-H14 VanDerWaalsContact O-N 3.11Å; H14-Q16 PolarHBondContact O-N 3.36Å; H14-Q16 VanDerWaalsContact O-N 3.14Å
15V52.8Low51.5Low116 Ų116145.9 Ų145.970%0.70375%0.753SS**  trans-74.899.9171.3174.90000106.7K13 N17K13-V15 VanDerWaalsContact C-N 3.33Å; K13-V15 PolarHBondContact O-N 2.92Å; V15-N17 PolarHBondContact O-N 2.75Å
16Q54.3Low51Low154 Ų154144.6 Ų144.672%0.7275%0.745SS**  trans-70.9102.1174.2-159.4151.4-0.300107.6H14 I18H14-Q16 PolarHBondContact O-N 3.36Å; H14-Q16 VanDerWaalsContact O-N 3.14Å; Q16-I18 PolarHBondContact O-N 2.85Å
17N56.9Low50.6Low151 Ų151141.2 Ų141.281%0.80775%0.745SS**  trans-72.191.2-177.7-142.227.8000108.1V15 P19V15-N17 PolarHBondContact O-N 2.75Å; N17-P19 VanDerWaalsContact O-CD 3.31Å; N17-P19 WeakPolarHBondContact O-CD 3.38Å
18I53Low50Low147 Ų147143.1 Ų143.175%0.75475%0.749SS**  trans-76.5115.7177.7-60.4171000107.6Q16Q16-I18 PolarHBondContact O-N 2.85Å
19P52.6Low49.4Very low100 Ų100143.5 Ų143.565%0.64976%0.756SS**  trans-67.6147.6179.426.8-32.7000111.3N17 I21N17-P19 VanDerWaalsContact O-CD 3.31Å; N17-P19 WeakPolarHBondContact O-CD 3.38Å; P19-I21 PolarHBondContact O-N 3.13Å
20P54.5Low48.5Very low104 Ų104141.7 Ų141.768%0.67576%0.757SS**  trans-64.2131.7-179.526.1-32.4000110.5H22P20-H22 PolarHBondContact O-N 3.44Å
21I50.5Low47.7Very low169 Ų169144.2 Ų144.287%0.86777%0.766SS**  trans-65.9100.5174.1-57.8171.8000107P19 A23P19-I21 PolarHBondContact O-N 3.13Å; I21-A23 PolarHBondContact O-N 3.36Å
22H52Low47.1Very low159 Ų159142.4 Ų142.474%0.73677%0.766SS**  trans-60.6122.1170.3-86.6-91.7000108.6P20 V24P20-H22 PolarHBondContact O-N 3.44Å; H22-V24 PolarHBondContact O-N 2.98Å
23A43.1Very low46.7Very low92 Ų92141.5 Ų141.576%0.7677%0.768SS**  trans-58.4106.2171.500000108.9I21 Q25I21-A23 PolarHBondContact O-N 3.36Å; A23-Q25 VanDerWaalsContact C-N 3.3Å; A23-Q25 PolarHBondContact O-N 3.02Å
24V44.4Very low46Very low117 Ų117139.3 Ų139.371%0.70977%0.766SS**  trans-7489.2175.7177.20000107.5H22 T26H22-V24 PolarHBondContact O-N 2.98Å; V24-T26 HydrophobicContact CG1-CG2 3.37Å; V24-T26 PolarHBondContact O-N 3.49Å; V24-T26 VanDerWaalsContact O-N 3.08Å
25Q40.4Very low45.4Very low182 Ų182139.8 Ų139.885%0.8577%0.774SS**  trans-76.973.1167.9-166.879.822.900108.4A23 A27A23-Q25 VanDerWaalsContact C-N 3.3Å; A23-Q25 PolarHBondContact O-N 3.02Å; Q25-A27 PolarHBondContact O-N 2.94Å
26T43.7Very low44.9Very low86 Ų86139 Ų13953%0.52877%0.773SS.*  trans-86.495.6173.644.20000109.9V24 F28V24-T26 HydrophobicContact CG1-CG2 3.37Å; V24-T26 PolarHBondContact O-N 3.49Å; V24-T26 VanDerWaalsContact O-N 3.08Å; T26-F28 VanDerWaalsContact C-N 3.34Å; T26-F28 HydrophobicContact CG2-CE2 4.18Å; T26-F28 PolarHBondContact O-N 3.2Å; T26-F28 VanDerWaalsContact O-N 3.1Å
27A39.3Very low44.6Very low94 Ų94140.8 Ų140.878%0.77778%0.781SS**  trans-63.396.9153.900000107.9Q25 D29Q25-A27 PolarHBondContact O-N 2.94Å; A27-D29 VanDerWaalsContact C-N 3.32Å; A27-D29 PolarHBondContact O-N 3.03Å; A27-D29 VanDerWaalsContact O-N 3.13Å
28F41.4Very low44Very low186 Ų186141.9 Ų141.982%0.81679%0.785SS**  trans-80.284.5170.4-90-87.6000108.6T26T26-F28 VanDerWaalsContact C-N 3.34Å; T26-F28 HydrophobicContact CG2-CE2 4.18Å; T26-F28 PolarHBondContact O-N 3.2Å; T26-F28 VanDerWaalsContact O-N 3.1Å
29D35.1Very low43.4Very low170 Ų170142.2 Ų142.291%0.90979%0.789SS**  trans-114.593.4163.9-128.3-21000106.3A27A27-D29 VanDerWaalsContact C-N 3.32Å; A27-D29 PolarHBondContact O-N 3.03Å; A27-D29 VanDerWaalsContact O-N 3.13Å
30G37.4Very low42.9Very low71 Ų71142.5 Ų142.573%0.73279%0.793SS**  trans-155.685.3-168.300000111.7
31K35.7Very low42.1Very low213 Ų213145.8 Ų145.893%0.92680%0.804SS**  trans-83.5105.7173.4-165.3170.5-175.1170.80108.7
32S41.2Very low41.5Very low112 Ų112143 Ų14378%0.78380%0.799SS**  trans-153.3110.4165.4-72.40000104.8
33K38.6Very low41Very low194 Ų194144.1 Ų144.184%0.84381%0.807SS**  44.380.859.6-94.4-168.1177.4-176.20112
34D42.6Very low40.9Very low142 Ų142149 Ų14976%0.75981%0.811SS**  152.579.5128.7-77.2-13.9000110.2
35D43.8Very low40.6Very low177 Ų177149.3 Ų149.395%0.94782%0.816SS**  trans-108.981.1162.3-78.7-35.8000108.4
36S42.8Very low40.5Very low98 Ų98150 Ų15069%0.68582%0.819SS**  trans-104.378.2166.662.90000109.3
37H47Very low40.1Very low193 Ų193154.6 Ų154.689%0.89483%0.832SS**  trans-151.883.5163.5-86.5-42.1000109.5
38I44.7Very low40.2Very low173 Ų173156.1 Ų156.189%0.88783%0.833SS**  trans-106.5123155.256.9168.7000108.7
39D41.2Very low39.8Very low155 Ų155155.9 Ų155.983%0.82983%0.832SS**  trans-68.8147-169.9-145.1-14.1000111.7L41D39-L41 PolarHBondContact O-N 3.1Å; D39-L41 VanDerWaalsContact O-N 3.15Å
40S40.8Very low40.1Very low106 Ų106154 Ų15474%0.74183%0.827SS**  trans-75.697.2-170.9-65.10000111.4S42S40-S42 PolarHBondContact O-N 3.15Å; S40-S42 VanDerWaalsContact O-N 3.15Å
41L39.3Very low39.9Very low172 Ų172155.5 Ų155.590%0.90183%0.826SS**  trans-84.588.7166-73.3176.7000110.8D39 M43D39-L41 PolarHBondContact O-N 3.1Å; D39-L41 VanDerWaalsContact O-N 3.15Å; L41-M43 PolarHBondContact O-N 2.69Å
42S37Very low40.2Very low111 Ų111153.4 Ų153.478%0.77683%0.825SS**  trans-55.2100.8167162.90000112.2S40S40-S42 PolarHBondContact O-N 3.15Å; S40-S42 VanDerWaalsContact O-N 3.15Å
43M41.6Very low40Very low182 Ų182154.3 Ų154.390%0.89783%0.826SS**  trans-116.2128.3161.8-69.9-171.873.300110.9L41L41-M43 PolarHBondContact O-N 2.69Å
44K41Very low40.2Very low194 Ų194153.4 Ų153.484%0.84383%0.825SS**PPolyproline II helixtrans-66.5156.3-171.8-86.7174.9175.2173.70113.2
45P38.1Very low40.5Very low125 Ų125154.4 Ų154.481%0.81283%0.825SS**PPolyproline II helixtrans-84.1123.9-171.833.3-32.5000112.1
46E39.1Very low40.7Very low195 Ų195152.8 Ų152.891%0.91182%0.821SS**PPolyproline II helixtrans-90.4134.6161-96.8-167.5145.700110.3
47K34.5Very low41.4Very low184 Ų184153.8 Ų153.880%0.882%0.823SS**  trans-120.9111.4-171.3-174.7-175.7-167174.30108.8
48P42.3Very low42Very low125 Ų125152.6 Ų152.681%0.81282%0.818SS**  trans-108.6137.8155.216.71.6000110.8
49K33.2Very low42.8Very low182 Ų182150.2 Ų150.279%0.79181%0.806SS**  trans-92.1129.5178.6-68.2165.7166.9173.80109.4
50T40Very low44.4Very low130 Ų130145.9 Ų145.980%0.79879%0.788SS**  trans-170.297.2149.243.30000104.9
51S34.1Very low46.1Very low102 Ų102144.8 Ų144.871%0.71379%0.785SS**  34.778.994.376.50000113.6
52D42.3Very low48.2Very low169 Ų169138.6 Ų138.690%0.90476%0.763SS**  -144.8114.2129.4-86.6-35.1000107.6
53T35.7Very low50.5Low131 Ų131136.7 Ų136.780%0.80474%0.744SS**  trans-88104.7174.3-62.90000105.4
54E42.5Very low52.4Low175 Ų175132.6 Ų132.682%0.81873%0.725SS**  trans178.2136.5141.4-107.1166.7173.800111.2
55E50.7Low54.3Low163 Ų163126.1 Ų126.176%0.76271%0.708SS**  trans69.588.6163-46.8-135.4157.600115.1T57E55-T57 PolarHBondContact O-N 3.05Å
56V46.3Very low56.5Low143 Ų143126.7 Ų126.787%0.86770%0.7SS**  trans-4882.1146.8-171.10000107.4E58V56-E58 PolarHBondContact O-N 3.44Å
57T58.7Low58.4Low119 Ų119121.8 Ų121.873%0.7368%0.679SS**  trans-65.2101.9164.250.80000104.4E55 I59E55-T57 PolarHBondContact O-N 3.05Å; T57-I59 PolarHBondContact O-N 3.42Å
58E58.6Low60.6Low169 Ų169119.5 Ų119.579%0.7967%0.671SS**  trans-38.5115.3172.2-61.7176.9168.800107.8V56 S60V56-E58 PolarHBondContact O-N 3.44Å; E58-S60 VanDerWaalsContact C-N 3.32Å; E58-S60 PolarHBondContact O-N 3.1Å
59I62.6Low62.3Low123 Ų123116.6 Ų116.663%0.63165%0.653SS**  trans-57.5106.5170.9-53.1169000104.2T57 D63 L64T57-I59 PolarHBondContact O-N 3.42Å; I59-D63 HydrophobicContact CG2-CB 3.95Å; I59-L64 HydrophobicContact CG2-CD1 4.48Å; I59-L64 HydrophobicContact CG2-CG 4.35Å
60S74.1Confident64.5Low63 Ų63110.3 Ų110.344%0.44164%0.635SS.*  trans-66.9150.2-174.1177.50000107.9E58 G62 D63 L64E58-S60 VanDerWaalsContact C-N 3.32Å; E58-S60 PolarHBondContact O-N 3.1Å; S60-G62 PolarHBondContact O-N 3.42Å; S60-G62 PolarHBondContact OG-N 3.4Å; S60-D63 PolarHBondContact N-OD2 3.46Å; S60-D63 PolarHBondContact O-N 3.02Å; S60-L64 PolarHBondContact O-N 3.41Å; S60-L64 VanDerWaalsContact O-N 3.13Å
61A76Confident66.1Low84 Ų84108.8 Ų108.869%0.69462%0.621SS**Hα-helixtrans-54.6-23.3168.600000111.6A65A61-A65 WeakPolarHBondContact O-CB 3.42Å; A61-A65 PolarHBondContact O-N 2.82Å
62G83.7Confident67.8Low41 Ų41106.3 Ų106.342%0.42361%0.607SS.*Hα-helixtrans-65.1-47.4169.300000113.6S60 L64 A65 E66S60-G62 PolarHBondContact O-N 3.42Å; S60-G62 PolarHBondContact OG-N 3.4Å; G62-L64 VanDerWaalsContact C-N 3.33Å; G62-L64 PolarHBondContact O-N 3.48Å; G62-A65 CarbonylContact O-C 3.57Å; G62-A65 WeakPolarHBondContact O-CB 3.4Å; G62-A65 PolarHBondContact O-N 3.48Å; G62-A65 VanDerWaalsContact O-N 3.13Å; G62-E66 PolarHBondContact O-N 3.21Å
63D85.3Confident69.1Low72 Ų72105.9 Ų105.939%0.38560%0.599SS.*Hα-helixtrans-65.1-39.9179.7-50.7-29.2000110.8I59 S60 A65 E66 I67I59-D63 HydrophobicContact CG2-CB 3.95Å; S60-D63 PolarHBondContact N-OD2 3.46Å; S60-D63 PolarHBondContact O-N 3.02Å; D63-A65 VanDerWaalsContact C-N 3.33Å; D63-A65 PolarHBondContact O-N 2.97Å; D63-E66 PolarHBondContact O-N 2.91Å; D63-I67 VanDerWaalsContact O-CG1 3.29Å; D63-I67 WeakPolarHBondContact O-CG1 3.32Å; D63-I67 PolarHBondContact O-N 3.12Å
64L81.2Confident70.6Confident95 Ų95104.2 Ų104.250%0.49759%0.593SS.*Hα-helixtrans-63.4-38.9173.2-101.6157.4000112I59 S60 G62 H68I59-L64 HydrophobicContact CG2-CD1 4.48Å; I59-L64 HydrophobicContact CG2-CG 4.35Å; S60-L64 PolarHBondContact O-N 3.41Å; S60-L64 VanDerWaalsContact O-N 3.13Å; G62-L64 VanDerWaalsContact C-N 3.33Å; G62-L64 PolarHBondContact O-N 3.48Å; L64-H68 WeakPolarHBondContact O-CB 3.35Å; L64-H68 PolarHBondContact O-N 3.03Å
65A81.2Confident71.4Confident58 Ų5898.8 Ų98.848%0.47957%0.572SS.*Hα-helixtrans-67.2-37.9174.300000111.6A61 G62 D63 H68 S69A61-A65 WeakPolarHBondContact O-CB 3.42Å; A61-A65 PolarHBondContact O-N 2.82Å; G62-A65 CarbonylContact O-C 3.57Å; G62-A65 WeakPolarHBondContact O-CB 3.4Å; G62-A65 PolarHBondContact O-N 3.48Å; G62-A65 VanDerWaalsContact O-N 3.13Å; D63-A65 VanDerWaalsContact C-N 3.33Å; D63-A65 PolarHBondContact O-N 2.97Å; A65-H68 PolarHBondContact O-N 3.3Å; A65-S69 WeakPolarHBondContact O-CB 3.48Å; A65-S69 PolarHBondContact O-N 3.22Å
66E85.2Confident71.9Confident138 Ų13896.2 Ų96.265%0.64557%0.57SS**Hα-helixtrans-66.1-42.6175.7-168.7171.4-165.500111.4G62 D63 H68 S69 A70G62-E66 PolarHBondContact O-N 3.21Å; D63-E66 PolarHBondContact O-N 2.91Å; E66-H68 PolarHBondContact O-N 3.49Å; E66-S69 PolarHBondContact O-N 2.88Å; E66-A70 WeakPolarHBondContact O-CB 3.46Å; E66-A70 PolarHBondContact O-N 3.14Å
67I77.9Confident72.5Confident91 Ų9195.6 Ų95.647%0.46756%0.557SS.*Hα-helixtrans-63.5-42.2173.2-66.1165000110.7D63 S69 A70 I71D63-I67 VanDerWaalsContact O-CG1 3.29Å; D63-I67 WeakPolarHBondContact O-CG1 3.32Å; D63-I67 PolarHBondContact O-N 3.12Å; I67-S69 VanDerWaalsContact C-N 3.31Å; I67-S69 PolarHBondContact O-N 3.4Å; I67-A70 PolarHBondContact O-N 3.47Å; I67-I71 HydrophobicContact CG2-CD1 3.75Å; I67-I71 HydrophobicContact CG2-CG1 4.32Å; I67-I71 WeakPolarHBondContact O-CB 3.36Å; I67-I71 VanDerWaalsContact O-CG1 3.27Å; I67-I71 WeakPolarHBondContact O-CG1 3.48Å; I67-I71 PolarHBondContact O-N 3.35Å
68H81.6Confident72.6Confident137 Ų13795.8 Ų95.863%0.63455%0.553SS**Hα-helixtrans-61.9-40.8174.9-109.6-95.6000112L64 A65 E66 A72L64-H68 WeakPolarHBondContact O-CB 3.35Å; L64-H68 PolarHBondContact O-N 3.03Å; A65-H68 PolarHBondContact O-N 3.3Å; E66-H68 PolarHBondContact O-N 3.49Å; H68-A72 WeakPolarHBondContact O-CB 3.35Å; H68-A72 PolarHBondContact O-N 2.87Å
69S77.2Confident72.9Confident63 Ų6392.1 Ų92.144%0.44154%0.539SS..Hα-helixtrans-65.5-44.9176.1-154.50000110.8A65 E66 I67 I71 A72 E73A65-S69 WeakPolarHBondContact O-CB 3.48Å; A65-S69 PolarHBondContact O-N 3.22Å; E66-S69 PolarHBondContact O-N 2.88Å; I67-S69 VanDerWaalsContact C-N 3.31Å; I67-S69 PolarHBondContact O-N 3.4Å; S69-I71 PolarHBondContact O-N 2.97Å; S69-A72 WeakPolarHBondContact O-CB 3.35Å; S69-A72 PolarHBondContact O-N 3.38Å; S69-E73 WeakPolarHBondContact O-CB 3.44Å; S69-E73 WeakPolarHBondContact O-CG 3.4Å; S69-E73 PolarHBondContact O-N 2.81Å
70A78.9Confident73.4Confident51 Ų5190.7 Ų90.742%0.42154%0.539SS..Hα-helixtrans-65.5-37.1178.100000112.6E66 I67 E73 S74E66-A70 WeakPolarHBondContact O-CB 3.46Å; E66-A70 PolarHBondContact O-N 3.14Å; I67-A70 PolarHBondContact O-N 3.47Å; A70-E73 PolarHBondContact O-N 3.17Å; A70-S74 WeakPolarHBondContact O-CB 3.4Å; A70-S74 PolarHBondContact O-N 2.98Å
71I75Confident73.5Confident97 Ų9795.3 Ų95.350%0.49755%0.554SS.*Hα-helixtrans-69.3-41.3173.4-68.2168.4000110.2I67 S69 E73 S74 T75I67-I71 HydrophobicContact CG2-CD1 3.75Å; I67-I71 HydrophobicContact CG2-CG1 4.32Å; I67-I71 WeakPolarHBondContact O-CB 3.36Å; I67-I71 VanDerWaalsContact O-CG1 3.27Å; I67-I71 WeakPolarHBondContact O-CG1 3.48Å; I67-I71 PolarHBondContact O-N 3.35Å; S69-I71 PolarHBondContact O-N 2.97Å; I71-E73 VanDerWaalsContact C-N 3.28Å; I71-E73 PolarHBondContact O-N 3.35Å; I71-S74 PolarHBondContact O-N 3.36Å; I71-T75 HydrophobicContact CG2-CG2 4.1Å; I71-T75 WeakPolarHBondContact O-CB 3.43Å; I71-T75 WeakPolarHBondContact O-CG2 3.36Å; I71-T75 PolarHBondContact O-N 3.39Å; I71-T75 PolarHBondContact O-OG1 2.92Å
72A70.4Confident73.6Confident50 Ų5094.6 Ų94.641%0.41354%0.541SS..Hα-helixtrans-60.7-39.7175.400000111.6H68 S69 T75H68-A72 WeakPolarHBondContact O-CB 3.35Å; H68-A72 PolarHBondContact O-N 2.87Å; S69-A72 WeakPolarHBondContact O-CB 3.35Å; S69-A72 PolarHBondContact O-N 3.38Å; A72-T75 PolarHBondContact O-OG1 3.33Å
73E69.3Low73.4Confident160 Ų16095.7 Ų95.775%0.74854%0.537SS*.Hα-helixtrans-72.3-36.6174.9-73.2177.6-167.400113.2S69 A70 I71S69-E73 WeakPolarHBondContact O-CB 3.44Å; S69-E73 WeakPolarHBondContact O-CG 3.4Å; S69-E73 PolarHBondContact O-N 2.81Å; A70-E73 PolarHBondContact O-N 3.17Å; I71-E73 VanDerWaalsContact C-N 3.28Å; I71-E73 PolarHBondContact O-N 3.35Å
74S65.4Low73.3Confident96 Ų9696.7 Ų96.767%0.67154%0.542SS*.Hα-helixtrans-85.1-21.9-178.2-179.30000113.4A70 I71 P76A70-S74 WeakPolarHBondContact O-CB 3.4Å; A70-S74 PolarHBondContact O-N 2.98Å; I71-S74 PolarHBondContact O-N 3.36Å; S74-P76 WeakPolarHBondContact O-CD 3.49Å; S74-P76 VanDerWaalsContact O-N 3.16Å
75T61.1Low73.5Confident62 Ų6293.9 Ų93.938%0.3854%0.536SS..SBendtrans-64.1118169.5440000106.3I71 A72 H77I71-T75 HydrophobicContact CG2-CG2 4.1Å; I71-T75 WeakPolarHBondContact O-CB 3.43Å; I71-T75 WeakPolarHBondContact O-CG2 3.36Å; I71-T75 PolarHBondContact O-N 3.39Å; I71-T75 PolarHBondContact O-OG1 2.92Å; A72-T75 PolarHBondContact O-OG1 3.33Å; T75-H77 PolarHBondContact O-N 2.93Å; T75-H77 PolarHBondContact O-ND1 3.26Å; T75-H77 PolarHBondContact OG1-ND1 3.27Å
76P60.7Low73.5Confident109 Ų10996.1 Ų96.171%0.70854%0.54SS*.  trans-60.695.7167.326.4-30.5000104.7S74 L78S74-P76 WeakPolarHBondContact O-CD 3.49Å; S74-P76 VanDerWaalsContact O-N 3.16Å; P76-L78 PolarHBondContact O-N 2.82Å
77H59.1Low73.6Confident129 Ų12995.8 Ų95.860%0.59754%0.536SS*.  trans-56.794.3157.9-84.455.1000101.9T75 D79T75-H77 PolarHBondContact O-N 2.93Å; T75-H77 PolarHBondContact O-ND1 3.26Å; T75-H77 PolarHBondContact OG1-ND1 3.27Å; H77-D79 PolarHBondContact O-N 3.18Å
78L61.1Low74.2Confident124 Ų12496.6 Ų96.665%0.64954%0.538SS*.  trans-57.891.6159.2-67.5174.1000102.1P76 S80 I83P76-L78 PolarHBondContact O-N 2.82Å; L78-S80 PolarHBondContact O-N 3.09Å; L78-S80 VanDerWaalsContact O-N 3.17Å; L78-I83 HydrophobicContact CB-CD1 3.88Å; L78-I83 HydrophobicContact CB-CG1 4.16Å
79D63.9Low74.5Confident92 Ų9295.8 Ų95.849%0.49253%0.534SS..  trans-51.6131-168.4-71.3-42.7000106.1H77 E81 T82 I83H77-D79 PolarHBondContact O-N 3.18Å; D79-E81 HydrophobicContact CB-CB 4.45Å; D79-E81 CarbonylContact O-C 3.54Å; D79-E81 PolarHBondContact O-N 3.08Å; D79-T82 HydrophobicContact CB-CG2 4.1Å; D79-T82 PolarHBondContact N-OG1 3.49Å; D79-T82 WeakPolarHBondContact O-CA 3.2Å; D79-T82 WeakPolarHBondContact O-CB 3.47Å; D79-T82 PolarHBondContact O-N 3.31Å; D79-T82 PolarHBondContact O-OG1 2.88Å; D79-I83 PolarHBondContact O-N 3.32Å
80S73.1Confident75Confident92 Ų9297.3 Ų97.364%0.64354%0.541SS*.Hα-helixtrans-46.6-33178.156.20000111.5L78 I83 D84L78-S80 PolarHBondContact O-N 3.09Å; L78-S80 VanDerWaalsContact O-N 3.17Å; S80-I83 PolarHBondContact O-N 3.46Å; S80-D84 VanDerWaalsContact O-CB 3.31Å; S80-D84 WeakPolarHBondContact O-CB 3.35Å; S80-D84 VanDerWaalsContact O-CG 3.3Å; S80-D84 PolarHBondContact O-N 3.24Å
81E76Confident75.7Confident161 Ų16197.2 Ų97.275%0.75254%0.54SS*.Hα-helixtrans-59.3-44.6171.4-170.4175.1-179.700114.3D79 G85D79-E81 HydrophobicContact CB-CB 4.45Å; D79-E81 CarbonylContact O-C 3.54Å; D79-E81 PolarHBondContact O-N 3.08Å; E81-G85 PolarHBondContact O-N 3.08Å
82T78.7Confident76.3Confident68 Ų6898.2 Ų98.242%0.41754%0.541SS..Hα-helixtrans-66-42176.564.10000111.7D79 L86D79-T82 HydrophobicContact CB-CG2 4.1Å; D79-T82 PolarHBondContact N-OG1 3.49Å; D79-T82 WeakPolarHBondContact O-CA 3.2Å; D79-T82 WeakPolarHBondContact O-CB 3.47Å; D79-T82 PolarHBondContact O-N 3.31Å; D79-T82 PolarHBondContact O-OG1 2.88Å; T82-L86 WeakPolarHBondContact O-CG 3.5Å; T82-L86 PolarHBondContact O-N 3.09Å
83I78.3Confident77.1Confident65 Ų6599.2 Ų99.233%0.33354%0.541SS..Hα-helixtrans-65.9-45178.2-65.6-179.7000110.2L78 D79 S80 L86 K87L78-I83 HydrophobicContact CB-CD1 3.88Å; L78-I83 HydrophobicContact CB-CG1 4.16Å; D79-I83 PolarHBondContact O-N 3.32Å; S80-I83 PolarHBondContact O-N 3.46Å; I83-L86 PolarHBondContact O-N 2.94Å; I83-K87 HydrophobicContact CG2-CD 4.21Å; I83-K87 WeakPolarHBondContact O-CG 3.43Å; I83-K87 PolarHBondContact O-N 2.83Å
84D83.7Confident78.1Confident92 Ų9294 Ų9449%0.49253%0.526SS..Hα-helixtrans-69.8-36.7-179.6-73.6-16.6000111.8S80 K87 E88S80-D84 VanDerWaalsContact O-CB 3.31Å; S80-D84 WeakPolarHBondContact O-CB 3.35Å; S80-D84 VanDerWaalsContact O-CG 3.3Å; S80-D84 PolarHBondContact O-N 3.24Å; D84-K87 PolarHBondContact O-N 2.97Å; D84-K87 IonicContact OD1-NZ 3.96Å; D84-E88 WeakPolarHBondContact O-CB 3.42Å; D84-E88 PolarHBondContact O-N 3.38Å
85G85.4Confident79.3Confident37 Ų3796.5 Ų96.538%0.38153%0.525SS..Hα-helixtrans-61-43.3171.500000113E81 E88 Q89E81-G85 PolarHBondContact O-N 3.08Å; G85-E88 PolarHBondContact O-N 3.08Å; G85-Q89 PolarHBondContact O-N 3.46Å
86L82Confident80.6Confident105 Ų10597.4 Ų97.455%0.5553%0.526SS..Hα-helixtrans-66.9-42.2176-74173.5000112.2T82 I83 E88 Q89 V90T82-L86 WeakPolarHBondContact O-CG 3.5Å; T82-L86 PolarHBondContact O-N 3.09Å; I83-L86 PolarHBondContact O-N 2.94Å; L86-E88 VanDerWaalsContact C-N 3.31Å; L86-E88 PolarHBondContact O-N 3.22Å; L86-Q89 PolarHBondContact O-N 3.48Å; L86-V90 WeakPolarHBondContact O-CG2 3.48Å; L86-V90 PolarHBondContact O-N 3.48Å
87K87.6Confident82Confident130 Ų13098.1 Ų98.157%0.56552%0.521SS*.Hα-helixtrans-59.8-42.5174.8-74.8172.3-177.3166.10111.7I83 D84 V90 A91I83-K87 HydrophobicContact CG2-CD 4.21Å; I83-K87 WeakPolarHBondContact O-CG 3.43Å; I83-K87 PolarHBondContact O-N 2.83Å; D84-K87 PolarHBondContact O-N 2.97Å; D84-K87 IonicContact OD1-NZ 3.96Å; K87-V90 PolarHBondContact O-N 3.23Å; K87-A91 WeakPolarHBondContact O-CB 3.44Å; K87-A91 PolarHBondContact O-N 3.01Å
88E89.7Confident83.4Confident109 Ų10998.5 Ų98.551%0.50952%0.522SS..Hα-helixtrans-64.1-41.9176.5-162.4-163.3-175.800111.3D84 G85 L86 A91 K92D84-E88 WeakPolarHBondContact O-CB 3.42Å; D84-E88 PolarHBondContact O-N 3.38Å; G85-E88 PolarHBondContact O-N 3.08Å; L86-E88 VanDerWaalsContact C-N 3.31Å; L86-E88 PolarHBondContact O-N 3.22Å; E88-A91 PolarHBondContact O-N 3.39Å; E88-K92 VanDerWaalsContact CD-CE 3.44Å; E88-K92 HydrophobicContact CG-CD 4.28Å; E88-K92 WeakPolarHBondContact O-CB 3.45Å; E88-K92 VanDerWaalsContact O-CG 3.27Å; E88-K92 WeakPolarHBondContact O-CG 3.35Å; E88-K92 PolarHBondContact O-N 2.94Å; E88-K92 WeakPolarHBondContact OE1-CE 3.48Å; E88-K92 IonicContact OE1-NZ 2.95Å; E88-K92 PolarHBondContact OE1-NZ 3.31Å; E88-K92 IonicContact OE2-NZ 2.96Å; E88-K92 PolarHBondContact OE2-NZ 2.87Å
89Q88.4Confident84.7Confident119 Ų11999.3 Ų99.356%0.55652%0.521SS*.Hα-helixtrans-63.3-44177-169.4-172.570.300112.1G85 L86 K92 T93G85-Q89 PolarHBondContact O-N 3.46Å; L86-Q89 PolarHBondContact O-N 3.48Å; Q89-K92 PolarHBondContact O-N 3.39Å; Q89-T93 WeakPolarHBondContact O-CB 3.36Å; Q89-T93 PolarHBondContact O-N 3.3Å; Q89-T93 PolarHBondContact O-OG1 2.87Å
90V88.3Confident85.6Confident96 Ų96102.3 Ų102.358%0.58253%0.525SS*.Hα-helixtrans-64.1-43.5176.4172.40000110.6L86 K87 K92 T93 A94L86-V90 WeakPolarHBondContact O-CG2 3.48Å; L86-V90 PolarHBondContact O-N 3.48Å; K87-V90 PolarHBondContact O-N 3.23Å; V90-K92 PolarHBondContact O-N 2.74Å; V90-T93 PolarHBondContact O-N 3.15Å; V90-A94 WeakPolarHBondContact O-CB 3.34Å; V90-A94 PolarHBondContact O-N 2.86Å
91A92.2Very high86.1Confident48 Ų48104.1 Ų104.140%0.39752%0.523SS..Hα-helixtrans-63-40.9176.600000112.4K87 E88 T93 K95K87-A91 WeakPolarHBondContact O-CB 3.44Å; K87-A91 PolarHBondContact O-N 3.01Å; E88-A91 PolarHBondContact O-N 3.39Å; A91-T93 VanDerWaalsContact C-N 3.35Å; A91-K95 WeakPolarHBondContact O-CB 3.5Å; A91-K95 WeakPolarHBondContact O-CG 3.46Å; A91-K95 PolarHBondContact O-N 2.96Å
92K88.7Confident86.3Confident119 Ų11999.2 Ų99.252%0.51751%0.51SS..Hα-helixtrans-61.9-43173.7-76.2170.3-179.6164.80111.2E88 Q89 V90 L96E88-K92 VanDerWaalsContact CD-CE 3.44Å; E88-K92 HydrophobicContact CG-CD 4.28Å; E88-K92 WeakPolarHBondContact O-CB 3.45Å; E88-K92 VanDerWaalsContact O-CG 3.27Å; E88-K92 WeakPolarHBondContact O-CG 3.35Å; E88-K92 PolarHBondContact O-N 2.94Å; E88-K92 WeakPolarHBondContact OE1-CE 3.48Å; E88-K92 IonicContact OE1-NZ 2.95Å; E88-K92 PolarHBondContact OE1-NZ 3.31Å; E88-K92 IonicContact OE2-NZ 2.96Å; E88-K92 PolarHBondContact OE2-NZ 2.87Å; Q89-K92 PolarHBondContact O-N 3.39Å; V90-K92 PolarHBondContact O-N 2.74Å; K92-L96 WeakPolarHBondContact O-CB 3.28Å; K92-L96 PolarHBondContact O-N 3.26Å
93T86.1Confident86.4Confident70 Ų70101.5 Ų101.543%0.42952%0.517SS..Hα-helixtrans-67.4-45.3179.9-56.50000111.8Q89 V90 A91 K95 L96 Q97Q89-T93 WeakPolarHBondContact O-CB 3.36Å; Q89-T93 PolarHBondContact O-N 3.3Å; Q89-T93 PolarHBondContact O-OG1 2.87Å; V90-T93 PolarHBondContact O-N 3.15Å; A91-T93 VanDerWaalsContact C-N 3.35Å; T93-K95 VanDerWaalsContact C-N 3.34Å; T93-K95 PolarHBondContact O-N 3.38Å; T93-L96 WeakPolarHBondContact O-CB 3.41Å; T93-L96 PolarHBondContact O-N 3.02Å; T93-L96 VanDerWaalsContact O-N 3.15Å; T93-Q97 PolarHBondContact O-N 2.85Å
94A91.5Very high86.2Confident50 Ų50104 Ų10441%0.41353%0.53SS..Hα-helixtrans-60.7-43.1177.200000111.6V90 L96 Q97 Q98V90-A94 WeakPolarHBondContact O-CB 3.34Å; V90-A94 PolarHBondContact O-N 2.86Å; A94-L96 PolarHBondContact O-N 3.47Å; A94-Q97 PolarHBondContact O-N 3.2Å; A94-Q98 WeakPolarHBondContact O-CB 3.44Å; A94-Q98 PolarHBondContact O-N 3.09Å
95K89.8Confident85.6Confident150 Ų150104.7 Ų104.765%0.65253%0.533SS*.Hα-helixtrans-62.8-39.8174.2-75.4178.6-180179.90112.4A91 T93 Q98 K99A91-K95 WeakPolarHBondContact O-CB 3.5Å; A91-K95 WeakPolarHBondContact O-CG 3.46Å; A91-K95 PolarHBondContact O-N 2.96Å; T93-K95 VanDerWaalsContact C-N 3.34Å; T93-K95 PolarHBondContact O-N 3.38Å; K95-Q98 PolarHBondContact O-N 3.24Å; K95-K99 WeakPolarHBondContact O-CB 3.41Å; K95-K99 PolarHBondContact O-N 3.43Å
96L89.2Confident84.8Confident80 Ų80105.4 Ų105.442%0.41954%0.535SS..Hα-helixtrans-65.4-42.4177-178.465000111.7K92 T93 A94 K99 R100K92-L96 WeakPolarHBondContact O-CB 3.28Å; K92-L96 PolarHBondContact O-N 3.26Å; T93-L96 WeakPolarHBondContact O-CB 3.41Å; T93-L96 PolarHBondContact O-N 3.02Å; T93-L96 VanDerWaalsContact O-N 3.15Å; A94-L96 PolarHBondContact O-N 3.47Å; L96-K99 PolarHBondContact O-N 2.98Å; L96-R100 WeakPolarHBondContact O-CG 3.27Å; L96-R100 PolarHBondContact O-N 3.18Å
97Q89.7Confident83.7Confident125 Ų125103.3 Ų103.358%0.58453%0.529SS*.Hα-helixtrans-63.2-44.5175.4-75.5-178.4-26.600111.6T93 A94 K99 R100 Q101T93-Q97 PolarHBondContact O-N 2.85Å; A94-Q97 PolarHBondContact O-N 3.2Å; Q97-K99 VanDerWaalsContact C-N 3.34Å; Q97-K99 PolarHBondContact O-N 3.08Å; Q97-R100 PolarHBondContact O-N 2.95Å; Q97-Q101 PolarHBondContact O-N 2.9Å
98Q87.9Confident82.2Confident136 Ų136102.8 Ų102.864%0.63653%0.529SS*.Hα-helixtrans-61.1-42.6175.5-172.9179.53500111.7A94 K95 Q101 A102A94-Q98 WeakPolarHBondContact O-CB 3.44Å; A94-Q98 PolarHBondContact O-N 3.09Å; K95-Q98 PolarHBondContact O-N 3.24Å; Q98-Q101 PolarHBondContact O-N 3.17Å; Q98-A102 WeakPolarHBondContact O-CB 3.47Å; Q98-A102 PolarHBondContact O-N 3.43Å
99K88.2Confident80.6Confident141 Ų141103.9 Ų103.961%0.61353%0.534SS*.Hα-helixtrans-60.5-46.4175.4-176.8-177.9175-174.50111.4K95 L96 Q97 Q101 A102 E103K95-K99 WeakPolarHBondContact O-CB 3.41Å; K95-K99 PolarHBondContact O-N 3.43Å; L96-K99 PolarHBondContact O-N 2.98Å; Q97-K99 VanDerWaalsContact C-N 3.34Å; Q97-K99 PolarHBondContact O-N 3.08Å; K99-Q101 VanDerWaalsContact C-N 3.34Å; K99-Q101 PolarHBondContact O-N 2.84Å; K99-A102 PolarHBondContact O-N 3.24Å; K99-E103 WeakPolarHBondContact O-CB 3.42Å; K99-E103 PolarHBondContact O-N 3.03Å
100R83.6Confident78.9Confident155 Ų155101.9 Ų101.959%0.58553%0.53SS*.Hα-helixtrans-61.6-41.5177.2-75.4176.7177.1168.8-1111.8L96 Q97 E103 L104L96-R100 WeakPolarHBondContact O-CG 3.27Å; L96-R100 PolarHBondContact O-N 3.18Å; Q97-R100 PolarHBondContact O-N 2.95Å; R100-E103 PolarHBondContact O-N 2.89Å; R100-L104 WeakPolarHBondContact O-CB 3.34Å; R100-L104 PolarHBondContact O-N 3.29Å
101Q83.5Confident77.3Confident130 Ų130101.5 Ų101.561%0.60753%0.528SS*.Hα-helixtrans-64.1-42.6176-170.7177.520.200111.6Q97 Q98 K99 L104 L105Q97-Q101 PolarHBondContact O-N 2.9Å; Q98-Q101 PolarHBondContact O-N 3.17Å; K99-Q101 VanDerWaalsContact C-N 3.34Å; K99-Q101 PolarHBondContact O-N 2.84Å; Q101-L104 PolarHBondContact O-N 2.94Å; Q101-L105 HydrophobicContact CG-CD1 4.41Å; Q101-L105 WeakPolarHBondContact O-CG 3.38Å; Q101-L105 PolarHBondContact O-N 2.92Å
102A80.3Confident75.5Confident58 Ų58105.3 Ų105.348%0.47954%0.541SS..Hα-helixtrans-64.9-38.2176.100000112.4Q98 K99 A106Q98-A102 WeakPolarHBondContact O-CB 3.47Å; Q98-A102 PolarHBondContact O-N 3.43Å; K99-A102 PolarHBondContact O-N 3.24Å; A102-A106 VanDerWaalsContact O-CB 3.26Å; A102-A106 WeakPolarHBondContact O-CB 3.42Å; A102-A106 PolarHBondContact O-N 3.47Å
103E80.6Confident74.1Confident117 Ų117107.4 Ų107.455%0.54755%0.55SS.*Hα-helixtrans-67.6-37176.2-175.2169.8-168.600112.2K99 R100 S107K99-E103 WeakPolarHBondContact O-CB 3.42Å; K99-E103 PolarHBondContact O-N 3.03Å; R100-E103 PolarHBondContact O-N 2.89Å; E103-S107 VanDerWaalsContact O-CB 3.26Å; E103-S107 WeakPolarHBondContact O-CB 3.36Å; E103-S107 PolarHBondContact O-N 3.04Å; E103-S107 PolarHBondContact O-OG 3.37Å
104L73.7Confident72.8Confident118 Ų118113.8 Ų113.862%0.61857%0.567SS**Hα-helixtrans-69.3-44.7176.8-152152.1000111.1R100 Q101 A106 S107 E108R100-L104 WeakPolarHBondContact O-CB 3.34Å; R100-L104 PolarHBondContact O-N 3.29Å; Q101-L104 PolarHBondContact O-N 2.94Å; L104-A106 PolarHBondContact O-N 3.03Å; L104-S107 PolarHBondContact O-N 3.47Å; L104-E108 WeakPolarHBondContact O-CB 3.29Å; L104-E108 PolarHBondContact O-N 3.09Å
105L71.8Confident71.5Confident106 Ų106116 Ų11656%0.55557%0.567SS**Hα-helixtrans-63.3-40.6174.1-70.3173.2000112.4Q101 S107 E109Q101-L105 HydrophobicContact CG-CD1 4.41Å; Q101-L105 WeakPolarHBondContact O-CG 3.38Å; Q101-L105 PolarHBondContact O-N 2.92Å; L105-S107 VanDerWaalsContact C-N 3.34Å; L105-E109 PolarHBondContact O-N 3.42Å
106A67.6Low70.8Confident52 Ų52112.5 Ų112.543%0.4356%0.562SS.*Hα-helixtrans-66.9-36.617500000111.8A102 L104 V110A102-A106 VanDerWaalsContact O-CB 3.26Å; A102-A106 WeakPolarHBondContact O-CB 3.42Å; A102-A106 PolarHBondContact O-N 3.47Å; L104-A106 PolarHBondContact O-N 3.03Å; A106-V110 WeakPolarHBondContact O-CB 3.45Å; A106-V110 WeakPolarHBondContact O-CG2 3.27Å; A106-V110 PolarHBondContact O-N 3.15Å; A106-V110 VanDerWaalsContact O-N 3.14Å
107S58.6Low70.4Confident60 Ų60116.2 Ų116.242%0.4257%0.574SS.*Hα-helixtrans-69-40.8177.3-61.60000111.7E103 L104 L105 E109 V110 T111E103-S107 VanDerWaalsContact O-CB 3.26Å; E103-S107 WeakPolarHBondContact O-CB 3.36Å; E103-S107 PolarHBondContact O-N 3.04Å; E103-S107 PolarHBondContact O-OG 3.37Å; L104-S107 PolarHBondContact O-N 3.47Å; L105-S107 VanDerWaalsContact C-N 3.34Å; S107-E109 PolarHBondContact O-N 3.29Å; S107-V110 CarbonylContact O-C 3.56Å; S107-V110 PolarHBondContact O-N 2.92Å; S107-V110 VanDerWaalsContact O-N 3.1Å; S107-T111 WeakPolarHBondContact O-CG2 3.28Å; S107-T111 PolarHBondContact O-N 2.85Å; S107-T111 PolarHBondContact O-OG1 3.36Å
108E57.4Low69.8Low119 Ų119113.2 Ų113.256%0.55657%0.571SS**Hα-helixtrans-61.5-42.9176.9-171.3165.6-175.500111.6L104 V110 T111L104-E108 WeakPolarHBondContact O-CB 3.29Å; L104-E108 PolarHBondContact O-N 3.09Å; E108-V110 VanDerWaalsContact C-N 3.26Å; E108-V110 PolarHBondContact O-N 3.34Å; E108-T111 WeakPolarHBondContact CA-OG1 3.46Å; E108-T111 PolarHBondContact O-N 2.95Å; E108-T111 PolarHBondContact O-OG1 3.5Å
109E55.4Low69.4Low132 Ų132108.9 Ų108.962%0.61756%0.558SS**Hα-helixtrans-67-27.6175.1-155.3-171.4159.700112.8L105 S107 K113L105-E109 PolarHBondContact O-N 3.42Å; S107-E109 PolarHBondContact O-N 3.29Å; E109-K113 IonicContact OE1-NZ 2.69Å
110V52.3Low69.1Low77 Ų77106.2 Ų106.247%0.46755%0.55SS.*Hα-helixtrans-82.2-35.7177.8172.80000111.9A106 S107 E108 D112 K113 R114A106-V110 WeakPolarHBondContact O-CB 3.45Å; A106-V110 WeakPolarHBondContact O-CG2 3.27Å; A106-V110 PolarHBondContact O-N 3.15Å; A106-V110 VanDerWaalsContact O-N 3.14Å; S107-V110 CarbonylContact O-C 3.56Å; S107-V110 PolarHBondContact O-N 2.92Å; S107-V110 VanDerWaalsContact O-N 3.1Å; E108-V110 VanDerWaalsContact C-N 3.26Å; E108-V110 PolarHBondContact O-N 3.34Å; V110-D112 VanDerWaalsContact C-N 3.34Å; V110-D112 PolarHBondContact O-N 2.88Å; V110-K113 PolarHBondContact O-N 3.43Å; V110-R114 HydrophobicContact CG1-CB 4.29Å; V110-R114 VanDerWaalsContact O-CB 3.26Å; V110-R114 WeakPolarHBondContact O-CB 3.36Å; V110-R114 PolarHBondContact O-N 2.92Å
111T55.4Low69.1Low89 Ų89103.5 Ų103.555%0.54654%0.544SS..Hα-helixtrans-63.1-37.9-176.942.30000112.6S107 E108 K113 R114S107-T111 WeakPolarHBondContact O-CG2 3.28Å; S107-T111 PolarHBondContact O-N 2.85Å; S107-T111 PolarHBondContact O-OG1 3.36Å; E108-T111 WeakPolarHBondContact CA-OG1 3.46Å; E108-T111 PolarHBondContact O-N 2.95Å; E108-T111 PolarHBondContact O-OG1 3.5Å; T111-K113 VanDerWaalsContact C-N 3.28Å; T111-K113 PolarHBondContact O-N 3.27Å; T111-R114 PolarHBondContact O-N 2.97Å
112D54.4Low69.2Low127 Ų127100.2 Ų100.268%0.67953%0.53SS*.Hα-helixtrans-63.2-35.9179.3-86.7-25.2000112.6V110V110-D112 VanDerWaalsContact C-N 3.34Å; V110-D112 PolarHBondContact O-N 2.88Å
113K59.5Low69.3Low163 Ų163101.7 Ų101.771%0.70953%0.527SS*.Hα-helixtrans-88.3-23-179.3-64.1173.2-171.51600112.5E109 V110 T111 K115E109-K113 IonicContact OE1-NZ 2.69Å; V110-K113 PolarHBondContact O-N 3.43Å; T111-K113 VanDerWaalsContact C-N 3.28Å; T111-K113 PolarHBondContact O-N 3.27Å; K113-K115 PolarHBondContact O-N 2.81Å
114R58.1Low69.6Low204 Ų20498.9 Ų98.977%0.7752%0.52SS*.  trans-9734.9-175.3-153.5-178-177.2-178-0.4113V110 T111 S116V110-R114 HydrophobicContact CG1-CB 4.29Å; V110-R114 VanDerWaalsContact O-CB 3.26Å; V110-R114 WeakPolarHBondContact O-CB 3.36Å; V110-R114 PolarHBondContact O-N 2.92Å; T111-R114 PolarHBondContact O-N 2.97Å; R114-S116 PolarHBondContact O-N 3.11Å
115K64.5Low70.3Confident98 Ų98101.9 Ų101.943%0.42652%0.523SS..  trans-56.4126.8162.4-65.2-174.8-177.3-178.60108.4K113 A119 L120 E123K113-K115 PolarHBondContact O-N 2.81Å; K115-A119 HydrophobicContact CB-CB 4.43Å; K115-L120 HydrophobicContact CB-CD2 4.13Å; K115-L120 HydrophobicContact CB-CG 4.3Å; K115-L120 HydrophobicContact CD-CD2 4.17Å; K115-E123 IonicContact NZ-OE1 3.62Å; K115-E123 PolarHBondContact NZ-OE1 2.97Å; K115-E123 IonicContact NZ-OE2 2.74Å; K115-E123 PolarHBondContact NZ-OE2 3.04Å
116S74.8Confident71Confident76 Ų7698.8 Ų98.853%0.53151%0.509SS..  trans-54.7146.2176.1174.10000110.2R114 A118 A119 L120R114-S116 PolarHBondContact O-N 3.11Å; S116-A118 PolarHBondContact O-N 3.28Å; S116-A118 VanDerWaalsContact O-N 3.09Å; S116-A118 PolarHBondContact OG-N 2.84Å; S116-A119 WeakPolarHBondContact O-CA 3.41Å; S116-A119 VanDerWaalsContact O-CB 3.31Å; S116-A119 WeakPolarHBondContact O-CB 3.39Å; S116-A119 PolarHBondContact O-N 3.14Å; S116-L120 PolarHBondContact O-N 2.98Å
117K80.9Confident71.9Confident158 Ų158100.7 Ų100.769%0.68751%0.509SS*.Hα-helixtrans-53-34.4175.6-172.3176.8-179.6-178.60111.6L120 H121K117-L120 PolarHBondContact O-N 3.43Å; K117-H121 PolarHBondContact O-CD2 2.94Å; K117-H121 PolarHBondContact O-N 3.12Å; K117-H121 VanDerWaalsContact O-N 3.12Å
118A78.4Confident73.5Confident61 Ų61101.8 Ų101.850%0.50451%0.51SS..Hα-helixtrans-63.2-43173.600000112.6S116 H121 L122S116-A118 PolarHBondContact O-N 3.28Å; S116-A118 VanDerWaalsContact O-N 3.09Å; S116-A118 PolarHBondContact OG-N 2.84Å; A118-H121 PolarHBondContact O-N 2.74Å; A118-L122 PolarHBondContact O-N 2.82Å
119A78.3Confident74.9Confident45 Ų45100.8 Ų100.837%0.37251%0.508SS..Hα-helixtrans-63.1-42.7176.500000111.3K115 S116 H121 L122 E123K115-A119 HydrophobicContact CB-CB 4.43Å; S116-A119 WeakPolarHBondContact O-CA 3.41Å; S116-A119 VanDerWaalsContact O-CB 3.31Å; S116-A119 WeakPolarHBondContact O-CB 3.39Å; S116-A119 PolarHBondContact O-N 3.14Å; A119-H121 VanDerWaalsContact C-N 3.32Å; A119-H121 PolarHBondContact O-N 2.83Å; A119-L122 PolarHBondContact O-N 3.25Å; A119-L122 VanDerWaalsContact O-N 3.12Å; A119-E123 WeakPolarHBondContact O-CB 3.46Å; A119-E123 PolarHBondContact O-N 3.42Å
120L82.4Confident76.4Confident86 Ų8697.2 Ų97.245%0.4549%0.492SS..Hα-helixtrans-61.1-39.6175.6-67.1175.9000112.6K115 S116 K117 L122 S124K115-L120 HydrophobicContact CB-CD2 4.13Å; K115-L120 HydrophobicContact CB-CG 4.3Å; K115-L120 HydrophobicContact CD-CD2 4.17Å; S116-L120 PolarHBondContact O-N 2.98Å; K117-L120 PolarHBondContact O-N 3.43Å; L120-L122 VanDerWaalsContact C-N 3.32Å; L120-S124 WeakPolarHBondContact O-CB 3.46Å; L120-S124 PolarHBondContact O-N 3.27Å; L120-S124 PolarHBondContact O-OG 2.95Å
121H84.5Confident78.2Confident98 Ų9898.4 Ų98.445%0.45449%0.491SS..Hα-helixtrans-66.1-35.6175.5-75.6-54.6000112.7K117 A118 A119 R125K117-H121 PolarHBondContact O-CD2 2.94Å; K117-H121 PolarHBondContact O-N 3.12Å; K117-H121 VanDerWaalsContact O-N 3.12Å; A118-H121 PolarHBondContact O-N 2.74Å; A119-H121 VanDerWaalsContact C-N 3.32Å; A119-H121 PolarHBondContact O-N 2.83Å; H121-R125 PolarHBondContact O-N 2.95Å; H121-R125 VanDerWaalsContact O-N 3.15Å
122L84.7Confident79.9Confident61 Ų61100.3 Ų100.332%0.31949%0.494SS..Hα-helixtrans-72.4-44.6176.9-173.850.5000111.3A118 A119 L120 S124 R125 V126 W203A118-L122 PolarHBondContact O-N 2.82Å; A119-L122 PolarHBondContact O-N 3.25Å; A119-L122 VanDerWaalsContact O-N 3.12Å; L120-L122 VanDerWaalsContact C-N 3.32Å; L122-S124 VanDerWaalsContact C-N 3.32Å; L122-S124 PolarHBondContact O-N 3.12Å; L122-R125 WeakPolarHBondContact O-CA 3.49Å; L122-R125 WeakPolarHBondContact O-CB 3.43Å; L122-R125 PolarHBondContact O-N 2.89Å; L122-V126 HydrophobicContact CD1-CG2 4.26Å; L122-V126 WeakPolarHBondContact O-CG2 3.45Å; L122-V126 PolarHBondContact O-N 3.35Å; L122-W203 HydrophobicContact CD2-CH2 3.49Å; L122-W203 VanDerWaalsContact CD2-CH2 3.49Å; L122-W203 HydrophobicContact CD2-CZ2 4.22Å; L122-W203 HydrophobicContact CD2-CZ3 4.4Å; L122-W203 HydrophobicContact CG-CH2 4.24Å
123E82.3Confident81.6Confident89 Ų8995.2 Ų95.242%0.41647%0.467SS..Hα-helixtrans-53.3-49.5172.2-178.7171.8-17800110.7K115 A119 R125 V126 E127K115-E123 IonicContact NZ-OE1 3.62Å; K115-E123 PolarHBondContact NZ-OE1 2.97Å; K115-E123 IonicContact NZ-OE2 2.74Å; K115-E123 PolarHBondContact NZ-OE2 3.04Å; A119-E123 WeakPolarHBondContact O-CB 3.46Å; A119-E123 PolarHBondContact O-N 3.42Å; E123-R125 VanDerWaalsContact C-N 3.27Å; E123-R125 PolarHBondContact O-N 3.34Å; E123-V126 PolarHBondContact O-N 2.99Å; E123-E127 WeakPolarHBondContact O-CB 3.47Å; E123-E127 PolarHBondContact O-N 3.42Å
124S86.3Confident82.9Confident57 Ų5789.5 Ų89.540%0.39944%0.444SS..Hα-helixtrans-59.8-36.2176-580000112.7L120 L122 N128L120-S124 WeakPolarHBondContact O-CB 3.46Å; L120-S124 PolarHBondContact O-N 3.27Å; L120-S124 PolarHBondContact O-OG 2.95Å; L122-S124 VanDerWaalsContact C-N 3.32Å; L122-S124 PolarHBondContact O-N 3.12Å; S124-N128 WeakPolarHBondContact O-CB 3.47Å; S124-N128 VanDerWaalsContact O-CG 3.23Å; S124-N128 PolarHBondContact O-N 3.18Å; S124-N128 VanDerWaalsContact O-N 3.14Å; S124-N128 PolarHBondContact O-ND2 3Å; S124-N128 VanDerWaalsContact O-ND2 3.11Å
125R89.1Confident84.7Confident181 Ų18182.6 Ų82.668%0.68342%0.424SS*.Hα-helixtrans-72.4-40.8178.7-177.259.2172.8179.72.3111.6H121 L122 E123 N128 L129H121-R125 PolarHBondContact O-N 2.95Å; H121-R125 VanDerWaalsContact O-N 3.15Å; L122-R125 WeakPolarHBondContact O-CA 3.49Å; L122-R125 WeakPolarHBondContact O-CB 3.43Å; L122-R125 PolarHBondContact O-N 2.89Å; E123-R125 VanDerWaalsContact C-N 3.27Å; E123-R125 PolarHBondContact O-N 3.34Å; R125-N128 PolarHBondContact O-N 2.86Å; R125-L129 PolarHBondContact O-N 3.35Å
126V85.3Confident86Confident42 Ų4282.3 Ų82.326%0.25543%0.425SS..Hα-helixtrans-67.4-44176.9171.80000110.3L122 E123 N128 L129 I130L122-V126 HydrophobicContact CD1-CG2 4.26Å; L122-V126 WeakPolarHBondContact O-CG2 3.45Å; L122-V126 PolarHBondContact O-N 3.35Å; E123-V126 PolarHBondContact O-N 2.99Å; V126-N128 VanDerWaalsContact C-N 3.29Å; V126-N128 PolarHBondContact O-N 2.91Å; V126-L129 WeakPolarHBondContact O-CB 3.43Å; V126-L129 PolarHBondContact O-N 3.35Å; V126-I130 HydrophobicContact CG1-CD1 3.86Å; V126-I130 HydrophobicContact CG1-CG1 4.4Å; V126-I130 WeakPolarHBondContact O-CG1 3.49Å; V126-I130 PolarHBondContact O-N 3.34Å
127E88.3Confident86.8Confident92 Ų9279.5 Ų79.543%0.4341%0.405SS..Hα-helixtrans-58.3-43.4175.5-168-167.9157.700111.3E123 I130 K131E123-E127 WeakPolarHBondContact O-CB 3.47Å; E123-E127 PolarHBondContact O-N 3.42Å; E127-I130 PolarHBondContact O-N 3.47Å; E127-K131 HydrophobicContact CG-CD 4.5Å; E127-K131 WeakPolarHBondContact O-CG 3.11Å; E127-K131 PolarHBondContact O-N 3.04Å; E127-K131 WeakPolarHBondContact OE1-CE 3.27Å; E127-K131 IonicContact OE1-NZ 3.62Å; E127-K131 PolarHBondContact OE1-NZ 2.67Å
128N92Very high87.4Confident82 Ų8276.6 Ų76.644%0.43940%0.397SS..Hα-helixtrans-63.9-40.1174-74-26.3000112.3S124 R125 V126 I130 K131 E132S124-N128 WeakPolarHBondContact O-CB 3.47Å; S124-N128 VanDerWaalsContact O-CG 3.23Å; S124-N128 PolarHBondContact O-N 3.18Å; S124-N128 VanDerWaalsContact O-N 3.14Å; S124-N128 PolarHBondContact O-ND2 3Å; S124-N128 VanDerWaalsContact O-ND2 3.11Å; R125-N128 PolarHBondContact O-N 2.86Å; V126-N128 VanDerWaalsContact C-N 3.29Å; V126-N128 PolarHBondContact O-N 2.91Å; N128-I130 VanDerWaalsContact C-N 3.34Å; N128-K131 PolarHBondContact O-N 2.99Å; N128-E132 WeakPolarHBondContact O-CG 3.29Å; N128-E132 PolarHBondContact O-N 3.33Å
129L87.2Confident88.2Confident98 Ų9880.4 Ų80.451%0.51340%0.402SS..Hα-helixtrans-62.9-41.6175.5179.963.6000111.5R125 V126 E132 M133R125-L129 PolarHBondContact O-N 3.35Å; V126-L129 WeakPolarHBondContact O-CB 3.43Å; V126-L129 PolarHBondContact O-N 3.35Å; L129-E132 PolarHBondContact O-N 3.14Å; L129-M133 HydrophobicContact CD1-CG 4.5Å; L129-M133 HydrophobicContact CG-SD 4.17Å; L129-M133 WeakPolarHBondContact O-CB 3.21Å; L129-M133 VanDerWaalsContact O-CG 3.28Å; L129-M133 WeakPolarHBondContact O-CG 3.36Å; L129-M133 PolarHBondContact O-N 3.37Å
130I85.9Confident88.9Confident57 Ų5779.2 Ų79.229%0.29239%0.39SS..Hα-helixtrans-62.2-45.7176.4-67166.4000110.1V126 E127 N128 E132 M133 D134V126-I130 HydrophobicContact CG1-CD1 3.86Å; V126-I130 HydrophobicContact CG1-CG1 4.4Å; V126-I130 WeakPolarHBondContact O-CG1 3.49Å; V126-I130 PolarHBondContact O-N 3.34Å; E127-I130 PolarHBondContact O-N 3.47Å; N128-I130 VanDerWaalsContact C-N 3.34Å; I130-E132 PolarHBondContact O-N 3.47Å; I130-M133 WeakPolarHBondContact O-CB 3.43Å; I130-M133 PolarHBondContact O-N 2.79Å; I130-D134 PolarHBondContact O-N 2.81Å
131K90.1Very high89.5Confident102 Ų10278 Ų7844%0.44338%0.383SS..Hα-helixtrans-58.8-43.2176.1-75.6167.8170.8164.40112.7E127 N128 D134 T135E127-K131 HydrophobicContact CG-CD 4.5Å; E127-K131 WeakPolarHBondContact O-CG 3.11Å; E127-K131 PolarHBondContact O-N 3.04Å; E127-K131 WeakPolarHBondContact OE1-CE 3.27Å; E127-K131 IonicContact OE1-NZ 3.62Å; E127-K131 PolarHBondContact OE1-NZ 2.67Å; N128-K131 PolarHBondContact O-N 2.99Å; K131-D134 PolarHBondContact O-N 3.14Å; K131-T135 WeakPolarHBondContact O-CB 3.28Å; K131-T135 PolarHBondContact O-N 3Å; K131-T135 PolarHBondContact O-OG1 2.74Å
132E91.8Very high90Very high130 Ų13078.2 Ų78.261%0.60739%0.388SS*.Hα-helixtrans-65.5-40.9175.9-71.7-63.8135.200111.7N128 L129 I130 T135 M136N128-E132 WeakPolarHBondContact O-CG 3.29Å; N128-E132 PolarHBondContact O-N 3.33Å; L129-E132 PolarHBondContact O-N 3.14Å; I130-E132 PolarHBondContact O-N 3.47Å; E132-T135 PolarHBondContact O-N 3.1Å; E132-M136 WeakPolarHBondContact O-CB 3.46Å; E132-M136 PolarHBondContact O-N 3.4Å
133M88.3Confident90.5Very high20 Ų2081 Ų8110%0.09940%0.398CS..Hα-helixtrans-64.5-43.3175.5-73.7175.362.500112.1L129 I130 T135 M136 V137 L191 I194 R195L129-M133 HydrophobicContact CD1-CG 4.5Å; L129-M133 HydrophobicContact CG-SD 4.17Å; L129-M133 WeakPolarHBondContact O-CB 3.21Å; L129-M133 VanDerWaalsContact O-CG 3.28Å; L129-M133 WeakPolarHBondContact O-CG 3.36Å; L129-M133 PolarHBondContact O-N 3.37Å; I130-M133 WeakPolarHBondContact O-CB 3.43Å; I130-M133 PolarHBondContact O-N 2.79Å; M133-T135 VanDerWaalsContact C-N 3.34Å; M133-M136 WeakPolarHBondContact O-CB 3.44Å; M133-M136 PolarHBondContact O-N 3.25Å; M133-M136 VanDerWaalsContact O-N 3.14Å; M133-V137 WeakPolarHBondContact O-CG2 3.35Å; M133-V137 PolarHBondContact O-N 3.35Å; M133-L191 HydrophobicContact CE-CD2 4.12Å; M133-L191 VanDerWaalsContact CE-O 3.29Å; M133-L191 WeakPolarHBondContact CE-O 3.45Å; M133-L191 HydrophobicContact CG-CD2 4.27Å; M133-I194 HydrophobicContact CE-CB 3.63Å; M133-I194 HydrophobicContact CE-CG2 3.55Å; M133-I194 HydrophobicContact SD-CG2 3.94Å; M133-R195 HydrophobicContact CE-CB 4.22Å
134D88.6Confident91.1Very high43 Ų4381.1 Ų81.123%0.2339%0.394CS..Hα-helixtrans-61.9-44.7176.4-76-27.4000110.5I130 K131 M136 V137 D138 R195I130-D134 PolarHBondContact O-N 2.81Å; K131-D134 PolarHBondContact O-N 3.14Å; D134-M136 VanDerWaalsContact C-N 3.25Å; D134-M136 PolarHBondContact O-N 3.42Å; D134-V137 WeakPolarHBondContact O-CB 3.33Å; D134-V137 PolarHBondContact O-N 3.06Å; D134-V137 VanDerWaalsContact O-N 3.12Å; D134-D138 PolarHBondContact O-N 2.8Å; D134-R195 IonicContact OD1-CZ 3.96Å; D134-R195 VanDerWaalsContact OD1-CZ 3.23Å; D134-R195 IonicContact OD1-NE 2.74Å; D134-R195 IonicContact OD1-NH1 3.23Å; D134-R195 PolarHBondContact OD1-NH1 2.85Å; D134-R195 IonicContact OD1-NH2 3.83Å
135T94.5Very high91.5Very high58 Ų5881.4 Ų81.436%0.35639%0.394SS..Hα-helixtrans-58.4-38.3173.6-57.50000112K131 E132 M133 K139K131-T135 WeakPolarHBondContact O-CB 3.28Å; K131-T135 PolarHBondContact O-N 3Å; K131-T135 PolarHBondContact O-OG1 2.74Å; E132-T135 PolarHBondContact O-N 3.1Å; M133-T135 VanDerWaalsContact C-N 3.34Å; T135-K139 HydrophobicContact CG2-CD 4.29Å; T135-K139 VanDerWaalsContact O-CG 3.29Å; T135-K139 WeakPolarHBondContact O-CG 3.37Å; T135-K139 PolarHBondContact O-N 3.18Å; T135-K139 VanDerWaalsContact O-N 3.09Å
136M91.5Very high91.8Very high92 Ų9277.2 Ų77.245%0.45338%0.382SS..Hα-helixtrans-70.1-39.6176.8-166.3-177.6-56.200112E132 M133 D134 D138 K139 L140 L191E132-M136 WeakPolarHBondContact O-CB 3.46Å; E132-M136 PolarHBondContact O-N 3.4Å; M133-M136 WeakPolarHBondContact O-CB 3.44Å; M133-M136 PolarHBondContact O-N 3.25Å; M133-M136 VanDerWaalsContact O-N 3.14Å; D134-M136 VanDerWaalsContact C-N 3.25Å; D134-M136 PolarHBondContact O-N 3.42Å; M136-D138 VanDerWaalsContact C-N 3.34Å; M136-K139 PolarHBondContact O-N 3.31Å; M136-L140 HydrophobicContact CG-CD1 4.17Å; M136-L140 WeakPolarHBondContact O-CB 3.46Å; M136-L140 VanDerWaalsContact O-CG 3.27Å; M136-L140 WeakPolarHBondContact O-CG 3.42Å; M136-L140 PolarHBondContact O-N 3.05Å; M136-L191 HydrophobicContact CB-CD1 4.46Å; M136-L191 HydrophobicContact CG-CD1 4.14Å; M136-L191 HydrophobicContact SD-CD1 4Å; M136-L191 HydrophobicContact SD-CD2 4.15Å
137V91.5Very high92.2Very high18 Ų1875.7 Ų75.711%0.10937%0.372CS..Hα-helixtrans-60.8-44.5174.6166.80000110.5M133 D134 L140 N141 L188 L191M133-V137 WeakPolarHBondContact O-CG2 3.35Å; M133-V137 PolarHBondContact O-N 3.35Å; D134-V137 WeakPolarHBondContact O-CB 3.33Å; D134-V137 PolarHBondContact O-N 3.06Å; D134-V137 VanDerWaalsContact O-N 3.12Å; V137-L140 PolarHBondContact O-N 3.26Å; V137-N141 WeakPolarHBondContact O-CB 3Å; V137-N141 PolarHBondContact O-N 3.12Å; V137-N141 PolarHBondContact O-ND2 3.21Å; V137-N141 VanDerWaalsContact O-ND2 3.17Å; V137-L188 HydrophobicContact CB-CD2 4.29Å; V137-L188 HydrophobicContact CG1-CD2 3.95Å; V137-L188 HydrophobicContact CG2-CD2 4.26Å; V137-L191 HydrophobicContact CG2-CB 3.97Å; V137-L191 HydrophobicContact CG2-CD1 3.96Å
138D94Very high92.5Very high97 Ų9775 Ų7552%0.51937%0.371SS..Hα-helixtrans-62.3-49.5177.4-68.3-20.7000111.1D134 M136 L140 N141 D142D134-D138 PolarHBondContact O-N 2.8Å; M136-D138 VanDerWaalsContact C-N 3.34Å; D138-L140 VanDerWaalsContact C-N 3.3Å; D138-L140 PolarHBondContact O-N 2.71Å; D138-N141 PolarHBondContact O-N 3Å; D138-N141 VanDerWaalsContact O-N 3.15Å; D138-D142 PolarHBondContact O-N 3.42Å
139K94.9Very high92.6Very high140 Ų14076.5 Ų76.561%0.60937%0.374SS*.Hα-helixtrans-58.5-38.8176.1-73.4171.6-178.5172.40113.2T135 M136 K143T135-K139 HydrophobicContact CG2-CD 4.29Å; T135-K139 VanDerWaalsContact O-CG 3.29Å; T135-K139 WeakPolarHBondContact O-CG 3.37Å; T135-K139 PolarHBondContact O-N 3.18Å; T135-K139 VanDerWaalsContact O-N 3.09Å; M136-K139 PolarHBondContact O-N 3.31Å; K139-K143 WeakPolarHBondContact O-CB 3.34Å; K139-K143 PolarHBondContact O-N 3.18Å
140L94.4Very high92.9Very high21 Ų2174.7 Ų74.711%0.1137%0.365CS..Hα-helixtrans-70.3-39.5177.5-76.3169.3000111.7M136 V137 D138 K143 R144 I184 L187 L188 L191M136-L140 HydrophobicContact CG-CD1 4.17Å; M136-L140 WeakPolarHBondContact O-CB 3.46Å; M136-L140 VanDerWaalsContact O-CG 3.27Å; M136-L140 WeakPolarHBondContact O-CG 3.42Å; M136-L140 PolarHBondContact O-N 3.05Å; V137-L140 PolarHBondContact O-N 3.26Å; D138-L140 VanDerWaalsContact C-N 3.3Å; D138-L140 PolarHBondContact O-N 2.71Å; L140-K143 PolarHBondContact O-N 2.83Å; L140-R144 WeakPolarHBondContact O-CB 3.24Å; L140-R144 PolarHBondContact O-N 3.22Å; L140-I184 HydrophobicContact CB-CG2 4.14Å; L140-I184 HydrophobicContact CD2-CG1 4.27Å; L140-I184 HydrophobicContact CD2-CG2 4.16Å; L140-L187 HydrophobicContact CD1-CB 4.4Å; L140-L187 HydrophobicContact CD1-CD2 3.56Å; L140-L187 HydrophobicContact CD1-CG 3.71Å; L140-L187 HydrophobicContact CD2-CD2 3.85Å; L140-L187 HydrophobicContact CG-CD2 4.35Å; L140-L188 HydrophobicContact CB-CD2 3.8Å; L140-L188 HydrophobicContact CB-CG 4.15Å; L140-L188 HydrophobicContact CD1-CD2 4.16Å; L140-L188 HydrophobicContact CD1-CG 4.46Å; L140-L191 HydrophobicContact CD1-CD1 3.5Å
141N93.5Very high93.2Very high59 Ų5972.4 Ų72.432%0.31635%0.353SS..Hα-helixtrans-63-45172.5-78.1-41000111.2V137 D138 K143 R144 T145 L188V137-N141 WeakPolarHBondContact O-CB 3Å; V137-N141 PolarHBondContact O-N 3.12Å; V137-N141 PolarHBondContact O-ND2 3.21Å; V137-N141 VanDerWaalsContact O-ND2 3.17Å; D138-N141 PolarHBondContact O-N 3Å; D138-N141 VanDerWaalsContact O-N 3.15Å; N141-K143 VanDerWaalsContact C-N 3.35Å; N141-K143 PolarHBondContact O-N 3.11Å; N141-R144 WeakPolarHBondContact O-CB 3.4Å; N141-R144 PolarHBondContact O-N 3.47Å; N141-T145 WeakPolarHBondContact O-CG2 3.35Å; N141-T145 PolarHBondContact O-N 3.4Å; N141-L188 WeakPolarHBondContact OD1-CD1 3.12Å
142D96.4Very high93.4Very high104 Ų10474 Ų7456%0.55636%0.362SS*.Hα-helixtrans-57.2-49.5175.4-71.4-18.5000110.7D138 R144 T145 Q146D138-D142 PolarHBondContact O-N 3.42Å; D142-R144 VanDerWaalsContact C-N 3.33Å; D142-R144 PolarHBondContact O-N 3.33Å; D142-T145 PolarHBondContact O-N 2.94Å; D142-T145 VanDerWaalsContact O-N 3.15Å; D142-T145 PolarHBondContact O-OG1 3.27Å; D142-Q146 PolarHBondContact O-N 2.82Å
143K94.7Very high93.4Very high120 Ų12071.4 Ų71.452%0.52235%0.354SS..Hα-helixtrans-60.2-41.4176.9-172.1175.2-179.4-1790112.4K139 L140 N141 Q146 L147 I184K139-K143 WeakPolarHBondContact O-CB 3.34Å; K139-K143 PolarHBondContact O-N 3.18Å; L140-K143 PolarHBondContact O-N 2.83Å; N141-K143 VanDerWaalsContact C-N 3.35Å; N141-K143 PolarHBondContact O-N 3.11Å; K143-Q146 PolarHBondContact O-N 3.01Å; K143-L147 WeakPolarHBondContact O-CG 3.04Å; K143-L147 PolarHBondContact O-N 2.73Å; K143-I184 HydrophobicContact CB-CD1 4.39Å; K143-I184 HydrophobicContact CD-CD1 3.94Å; K143-I184 HydrophobicContact CG-CD1 3.92Å
144R94.2Very high93.5Very high91 Ų9171.8 Ų71.834%0.34336%0.359SS..Hα-helixtrans-60.4-45.7174.3177.6-174135.1127.32.9111.2L140 N141 D142 Q146 L147 L148 M181 I184 N185L140-R144 WeakPolarHBondContact O-CB 3.24Å; L140-R144 PolarHBondContact O-N 3.22Å; N141-R144 WeakPolarHBondContact O-CB 3.4Å; N141-R144 PolarHBondContact O-N 3.47Å; D142-R144 VanDerWaalsContact C-N 3.33Å; D142-R144 PolarHBondContact O-N 3.33Å; R144-Q146 VanDerWaalsContact C-N 3.3Å; R144-Q146 PolarHBondContact O-N 3.15Å; R144-L147 PolarHBondContact O-N 3.25Å; R144-L148 WeakPolarHBondContact O-CG 3.48Å; R144-L148 PolarHBondContact O-N 3Å; R144-L148 VanDerWaalsContact O-N 3.08Å; R144-M181 HydrophobicContact CG-CG 4.29Å; R144-I184 HydrophobicContact CB-CG2 4.1Å; R144-N185 PolarHBondContact NH1-OD1 2.85Å
145T95.2Very high93.6Very high63 Ų6374.1 Ų74.139%0.38737%0.368SS..Hα-helixtrans-66-34.4177.566.50000112.3N141 D142 L148 K149N141-T145 WeakPolarHBondContact O-CG2 3.35Å; N141-T145 PolarHBondContact O-N 3.4Å; D142-T145 PolarHBondContact O-N 2.94Å; D142-T145 VanDerWaalsContact O-N 3.15Å; D142-T145 PolarHBondContact O-OG1 3.27Å; T145-L148 PolarHBondContact O-N 3.34Å; T145-K149 WeakPolarHBondContact O-CG 3.31Å; T145-K149 PolarHBondContact O-N 3.5Å
146Q95.6Very high93.3Very high92 Ų9273.3 Ų73.343%0.4337%0.365SS..Hα-helixtrans-65.2-48.2174.9-174.259.542.200111D142 K143 R144 L148 K149 D150D142-Q146 PolarHBondContact O-N 2.82Å; K143-Q146 PolarHBondContact O-N 3.01Å; R144-Q146 VanDerWaalsContact C-N 3.3Å; R144-Q146 PolarHBondContact O-N 3.15Å; Q146-L148 VanDerWaalsContact C-N 3.27Å; Q146-L148 PolarHBondContact O-N 2.66Å; Q146-K149 WeakPolarHBondContact O-CB 3.48Å; Q146-K149 PolarHBondContact O-N 2.88Å; Q146-K149 VanDerWaalsContact O-N 3.09Å; Q146-D150 PolarHBondContact NE2-OD1 3.36Å; Q146-D150 VanDerWaalsContact O-CG 3.26Å; Q146-D150 PolarHBondContact O-N 3.27Å
147L94.3Very high93Very high11 Ų1173.8 Ų73.86%0.05837%0.366CS..Hα-helixtrans-58-39.5176.5-72.1173000112.1K143 R144 K149 D150 I151 D177 R180 I184K143-L147 WeakPolarHBondContact O-CG 3.04Å; K143-L147 PolarHBondContact O-N 2.73Å; R144-L147 PolarHBondContact O-N 3.25Å; L147-K149 PolarHBondContact O-N 3.49Å; L147-D150 PolarHBondContact O-N 3.49Å; L147-I151 WeakPolarHBondContact O-CB 3.38Å; L147-I151 WeakPolarHBondContact O-CD1 3.45Å; L147-I151 WeakPolarHBondContact O-CG1 3.37Å; L147-I151 PolarHBondContact O-N 3.32Å; L147-D177 HydrophobicContact CD2-CB 4.03Å; L147-R180 HydrophobicContact CD1-CB 4.1Å; L147-I184 HydrophobicContact CD1-CD1 3.58Å
148L93.8Very high93Very high76 Ų7674.2 Ų74.240%0.39837%0.367SS..Hα-helixtrans-61.5-43175.5-74.3171.6000112.4R144 T145 Q146 I151 E152 M181R144-L148 WeakPolarHBondContact O-CG 3.48Å; R144-L148 PolarHBondContact O-N 3Å; R144-L148 VanDerWaalsContact O-N 3.08Å; T145-L148 PolarHBondContact O-N 3.34Å; Q146-L148 VanDerWaalsContact C-N 3.27Å; Q146-L148 PolarHBondContact O-N 2.66Å; L148-I151 PolarHBondContact O-N 2.74Å; L148-E152 PolarHBondContact O-N 3.39Å; L148-M181 HydrophobicContact CD2-SD 3.77Å; L148-M181 HydrophobicContact CG-SD 4.26Å
149K94.6Very high92.6Very high114 Ų11476 Ų7650%0.49638%0.377SS..Hα-helixtrans-65.9-41.6175.6-67.1171.3-169.6167.70111.7T145 Q146 L147 I151 E152 V153T145-K149 WeakPolarHBondContact O-CG 3.31Å; T145-K149 PolarHBondContact O-N 3.5Å; Q146-K149 WeakPolarHBondContact O-CB 3.48Å; Q146-K149 PolarHBondContact O-N 2.88Å; Q146-K149 VanDerWaalsContact O-N 3.09Å; L147-K149 PolarHBondContact O-N 3.49Å; K149-I151 VanDerWaalsContact C-N 3.34Å; K149-E152 PolarHBondContact O-N 2.85Å; K149-V153 WeakPolarHBondContact O-CG2 3.48Å; K149-V153 PolarHBondContact O-N 3.22Å
150D92.7Very high92.2Very high61 Ų6177 Ų7733%0.32638%0.381SS..Hα-helixtrans-64.4-41.2179.1-65.5-19.2000110.8Q146 L147 V153 C154Q146-D150 PolarHBondContact NE2-OD1 3.36Å; Q146-D150 VanDerWaalsContact O-CG 3.26Å; Q146-D150 PolarHBondContact O-N 3.27Å; L147-D150 PolarHBondContact O-N 3.49Å; D150-V153 PolarHBondContact O-N 2.7Å; D150-C154 WeakPolarHBondContact O-CB 3.42Å; D150-C154 PolarHBondContact O-N 2.9Å; D150-C154 PolarHBondContact O-SG 2.82Å; D150-C154 VanDerWaalsContact O-SG 3.38Å
151I93.5Very high91.7Very high8 Ų876.9 Ų76.94%0.04138%0.382CS..Hα-helixtrans-59.8-49.2173-71.9163.3000110.5L147 L148 K149 V153 C154 E155 I174 D177L147-I151 WeakPolarHBondContact O-CB 3.38Å; L147-I151 WeakPolarHBondContact O-CD1 3.45Å; L147-I151 WeakPolarHBondContact O-CG1 3.37Å; L147-I151 PolarHBondContact O-N 3.32Å; L148-I151 PolarHBondContact O-N 2.74Å; K149-I151 VanDerWaalsContact C-N 3.34Å; I151-V153 VanDerWaalsContact C-N 3.3Å; I151-V153 PolarHBondContact O-N 3.43Å; I151-C154 WeakPolarHBondContact O-CB 3.14Å; I151-C154 PolarHBondContact O-N 2.96Å; I151-C154 VanDerWaalsContact O-N 3.14Å; I151-E155 HydrophobicContact CG2-CG 4.28Å; I151-E155 WeakPolarHBondContact O-CG 3.47Å; I151-E155 PolarHBondContact O-N 3.42Å; I151-I174 HydrophobicContact CG2-CG2 4.19Å; I151-D177 HydrophobicContact CD1-CB 4.08Å; I151-D177 HydrophobicContact CG1-CB 3.96Å
152E92.7Very high91.1Very high137 Ų13780.7 Ų80.764%0.6441%0.408SS*.Hα-helixtrans-57.6-43.3178.1-178-179.8-169.100111.8L148 K149 E155 S156L148-E152 PolarHBondContact O-N 3.39Å; K149-E152 PolarHBondContact O-N 2.85Å; E152-E155 PolarHBondContact O-N 3.42Å; E152-S156 PolarHBondContact O-N 3.12Å
153V91.9Very high90.7Very high74 Ų7481.3 Ų81.345%0.44841%0.408SS..Hα-helixtrans-61.7-50.2175.1170.30000110.2K149 D150 I151 E155 S156 H157K149-V153 WeakPolarHBondContact O-CG2 3.48Å; K149-V153 PolarHBondContact O-N 3.22Å; D150-V153 PolarHBondContact O-N 2.7Å; I151-V153 VanDerWaalsContact C-N 3.3Å; I151-V153 PolarHBondContact O-N 3.43Å; V153-E155 PolarHBondContact O-N 2.97Å; V153-S156 WeakPolarHBondContact O-CB 3.27Å; V153-S156 PolarHBondContact O-N 3.05Å; V153-S156 VanDerWaalsContact O-N 3.15Å; V153-S156 PolarHBondContact O-OG 3.29Å; V153-H157 PolarHBondContact O-CD2 3.44Å; V153-H157 PolarHBondContact O-N 3.12Å
154C90.3Very high90.3Very high28 Ų2880.2 Ų80.219%0.18942%0.415CS..Hα-helixtrans-58.4-42.8178.1-77.80000112.8D150 I151 S156 H157 I158 I170 I174D150-C154 WeakPolarHBondContact O-CB 3.42Å; D150-C154 PolarHBondContact O-N 2.9Å; D150-C154 PolarHBondContact O-SG 2.82Å; D150-C154 VanDerWaalsContact O-SG 3.38Å; I151-C154 WeakPolarHBondContact O-CB 3.14Å; I151-C154 PolarHBondContact O-N 2.96Å; I151-C154 VanDerWaalsContact O-N 3.14Å; C154-S156 VanDerWaalsContact C-N 3.32Å; C154-S156 PolarHBondContact O-N 3.39Å; C154-H157 WeakPolarHBondContact O-CB 3.3Å; C154-H157 PolarHBondContact O-N 3.44Å; C154-H157 VanDerWaalsContact O-N 3.1Å; C154-I158 PolarHBondContact O-N 3.05Å; C154-I170 HydrophobicContact CB-CG2 3.61Å; C154-I170 WeakPolarHBondContact O-CG2 3.17Å; C154-I174 HydrophobicContact CB-CD1 3.87Å; C154-I174 HydrophobicContact CB-CG1 3.59Å
155E90.7Very high89.9Confident92 Ų9284.5 Ų84.543%0.4344%0.436SS..Hα-helixtrans-60.9-42.3175.5-73.4-179.3167.700111.5I151 E152 V153 H157 I158 N159 I174I151-E155 HydrophobicContact CG2-CG 4.28Å; I151-E155 WeakPolarHBondContact O-CG 3.47Å; I151-E155 PolarHBondContact O-N 3.42Å; E152-E155 PolarHBondContact O-N 3.42Å; V153-E155 PolarHBondContact O-N 2.97Å; E155-H157 VanDerWaalsContact C-N 3.27Å; E155-H157 PolarHBondContact O-N 2.86Å; E155-I158 PolarHBondContact O-N 3.16Å; E155-N159 PolarHBondContact O-N 3.29Å; E155-N159 VanDerWaalsContact O-N 3.12Å; E155-N159 PolarHBondContact O-ND2 2.94Å; E155-I174 HydrophobicContact CG-CD1 3.73Å
156S88.4Confident89.6Confident42 Ų4286.1 Ų86.129%0.29444%0.439SS..Hα-helixtrans-62.2-34.9174.787.80000112.4E152 V153 C154 K160E152-S156 PolarHBondContact O-N 3.12Å; V153-S156 WeakPolarHBondContact O-CB 3.27Å; V153-S156 PolarHBondContact O-N 3.05Å; V153-S156 VanDerWaalsContact O-N 3.15Å; V153-S156 PolarHBondContact O-OG 3.29Å; C154-S156 VanDerWaalsContact C-N 3.32Å; C154-S156 PolarHBondContact O-N 3.39Å; S156-K160 VanDerWaalsContact O-CG 3.32Å; S156-K160 WeakPolarHBondContact O-CG 3.49Å; S156-K160 PolarHBondContact O-N 3.11Å
157H86.8Confident89.2Confident101 Ų10187.5 Ų87.547%0.46844%0.441SS..Hα-helixtrans-71.7-37.8175.5-78.1-76.6000112.3V153 C154 E155 N159 K160 S161 I170V153-H157 PolarHBondContact O-CD2 3.44Å; V153-H157 PolarHBondContact O-N 3.12Å; C154-H157 WeakPolarHBondContact O-CB 3.3Å; C154-H157 PolarHBondContact O-N 3.44Å; C154-H157 VanDerWaalsContact O-N 3.1Å; E155-H157 VanDerWaalsContact C-N 3.27Å; E155-H157 PolarHBondContact O-N 2.86Å; H157-N159 VanDerWaalsContact C-N 3.26Å; H157-N159 PolarHBondContact O-N 3.03Å; H157-K160 PolarHBondContact O-N 3Å; H157-S161 WeakPolarHBondContact O-CB 3.28Å; H157-S161 PolarHBondContact O-N 3.33Å; H157-I170 HydrophobicContact CB-CD1 4Å
158I89.5Confident89Confident27 Ų2790 Ų9014%0.13846%0.459CS..Hα-helixtrans-60-39.5173.9-72.4178.8000111.2C154 E155 K160 I170 M171 I174C154-I158 PolarHBondContact O-N 3.05Å; E155-I158 PolarHBondContact O-N 3.16Å; I158-K160 VanDerWaalsContact C-N 3.3Å; I158-K160 PolarHBondContact O-N 2.98Å; I158-I170 HydrophobicContact CD1-CB 3.98Å; I158-I170 HydrophobicContact CD1-CG2 3.73Å; I158-I170 HydrophobicContact CG1-CB 3.61Å; I158-I170 HydrophobicContact CG1-CD1 4.24Å; I158-I170 HydrophobicContact CG1-CG2 3.46Å; I158-I170 VanDerWaalsContact CG1-CG2 3.46Å; I158-M171 HydrophobicContact CD1-CB 4.27Å; I158-I174 HydrophobicContact CD1-CD1 3.36Å; I158-I174 HydrophobicContact CG1-CD1 4.41Å
159N86.2Confident88.9Confident136 Ų13694 Ų9473%0.72747%0.473SS*.Hα-helixtrans-71.4-25.6179.9-70.2-27.7000112.8E155 H157E155-N159 PolarHBondContact O-N 3.29Å; E155-N159 VanDerWaalsContact O-N 3.12Å; E155-N159 PolarHBondContact O-ND2 2.94Å; H157-N159 VanDerWaalsContact C-N 3.26Å; H157-N159 PolarHBondContact O-N 3.03Å
160K86.9Confident88.7Confident159 Ų15990.3 Ų90.369%0.69146%0.459SS*.Hα-helixtrans-92.7-28.4179.2-68.3170.4-173.91710113.4S156 H157 I158S156-K160 VanDerWaalsContact O-CG 3.32Å; S156-K160 WeakPolarHBondContact O-CG 3.49Å; S156-K160 PolarHBondContact O-N 3.11Å; H157-K160 PolarHBondContact O-N 3Å; I158-K160 VanDerWaalsContact C-N 3.3Å; I158-K160 PolarHBondContact O-N 2.98Å
161S84.3Confident88.6Confident19 Ų1993.7 Ų93.713%0.13347%0.474CS..  trans-76130-179.1179.70000111H157 E163 E166 R167H157-S161 WeakPolarHBondContact O-CB 3.28Å; H157-S161 PolarHBondContact O-N 3.33Å; S161-E163 PolarHBondContact OG-N 3.11Å; S161-E166 WeakPolarHBondContact OG-CB 3.2Å; S161-E166 PolarHBondContact OG-OE2 3.24Å; S161-R167 WeakPolarHBondContact O-CD 3.09Å
162T81.4Confident88.5Confident139 Ų13998.1 Ų98.185%0.85350%0.498SS*.  trans-92.1-17.2175.651.80000112.4
163E87.1Confident88.5Confident117 Ų11795.6 Ų95.655%0.54749%0.486SS..  trans-83.8120.2-175.3-65.3-163177.200111.5S161 K165 E166 R167S161-E163 PolarHBondContact OG-N 3.11Å; E163-K165 VanDerWaalsContact C-N 3.26Å; E163-K165 PolarHBondContact O-N 2.85Å; E163-E166 HydrophobicContact CB-CB 4.22Å; E163-E166 HydrophobicContact CB-CG 3.99Å; E163-E166 PolarHBondContact O-N 3.26Å; E163-R167 WeakPolarHBondContact O-CG 3.39Å; E163-R167 PolarHBondContact O-N 3.28Å
164S85.3Confident88.5Confident98 Ų9893 Ų9369%0.68547%0.469SS*.Hα-helixtrans-55.7-39.2-177.9-175.90000113.2R167 S168S164-R167 PolarHBondContact O-N 3.03Å; S164-S168 PolarHBondContact O-N 3.31Å
165K87.7Confident88.6Confident180 Ų18098.3 Ų98.378%0.78349%0.489SS*.Hα-helixtrans-68.9-38.9-178.9-167.3178.4-178.1-179.60112.5E163 K169E163-K165 VanDerWaalsContact C-N 3.26Å; E163-K165 PolarHBondContact O-N 2.85Å; K165-K169 PolarHBondContact O-N 2.93Å
166E87.1Confident88.7Confident97 Ų9795.6 Ų95.645%0.45348%0.483SS..Hα-helixtrans-66.8-45.3174.8-66.9-171.315500111.1S161 E163 S168 K169 I170S161-E166 WeakPolarHBondContact OG-CB 3.2Å; S161-E166 PolarHBondContact OG-OE2 3.24Å; E163-E166 HydrophobicContact CB-CB 4.22Å; E163-E166 HydrophobicContact CB-CG 3.99Å; E163-E166 PolarHBondContact O-N 3.26Å; E166-S168 VanDerWaalsContact C-N 3.31Å; E166-S168 PolarHBondContact O-N 3.29Å; E166-K169 PolarHBondContact O-N 3.15Å; E166-K169 VanDerWaalsContact O-N 3.13Å; E166-I170 WeakPolarHBondContact O-CG1 3.33Å; E166-I170 PolarHBondContact O-N 3.46Å
167R89.1Confident89Confident122 Ų12293.9 Ų93.946%0.4647%0.47SS..Hα-helixtrans-56.7-44.5176.7-67-179.879.1-159.3-1.4111.9S161 E163 S164 K169 I170 M171S161-R167 WeakPolarHBondContact O-CD 3.09Å; E163-R167 WeakPolarHBondContact O-CG 3.39Å; E163-R167 PolarHBondContact O-N 3.28Å; S164-R167 PolarHBondContact O-N 3.03Å; R167-K169 PolarHBondContact O-N 3.35Å; R167-I170 PolarHBondContact O-N 3.04Å; R167-M171 WeakPolarHBondContact O-CB 3.47Å; R167-M171 PolarHBondContact O-N 3.4Å
168S89.7Confident89.2Confident64 Ų6492.6 Ų92.645%0.44846%0.464SS..Hα-helixtrans-58.7-47.5175.6-171.40000111.7S164 E166 I170 M171 D172S164-S168 PolarHBondContact O-N 3.31Å; E166-S168 VanDerWaalsContact C-N 3.31Å; E166-S168 PolarHBondContact O-N 3.29Å; S168-I170 PolarHBondContact O-N 2.92Å; S168-M171 WeakPolarHBondContact O-CB 3.4Å; S168-M171 PolarHBondContact O-N 2.98Å; S168-D172 PolarHBondContact O-N 3.44Å
169K90.6Very high89.4Confident159 Ų15995.7 Ų95.769%0.69148%0.481SS*.Hα-helixtrans-62.8-40.9-179.1-174.6-179.1177.2-1730112.4K165 E166 R167 Q173K165-K169 PolarHBondContact O-N 2.93Å; E166-K169 PolarHBondContact O-N 3.15Å; E166-K169 VanDerWaalsContact O-N 3.13Å; R167-K169 PolarHBondContact O-N 3.35Å; K169-Q173 PolarHBondContact O-N 2.98Å; K169-Q173 VanDerWaalsContact O-N 3.12Å
170I90.7Very high89.6Confident36 Ų3695.2 Ų95.219%0.18547%0.469CS..Hα-helixtrans-70.3-36.9178.2-56.5162.7000110.3C154 H157 I158 E166 R167 S168 D172 Q173 I174C154-I170 HydrophobicContact CB-CG2 3.61Å; C154-I170 WeakPolarHBondContact O-CG2 3.17Å; H157-I170 HydrophobicContact CB-CD1 4Å; I158-I170 HydrophobicContact CD1-CB 3.98Å; I158-I170 HydrophobicContact CD1-CG2 3.73Å; I158-I170 HydrophobicContact CG1-CB 3.61Å; I158-I170 HydrophobicContact CG1-CD1 4.24Å; I158-I170 HydrophobicContact CG1-CG2 3.46Å; I158-I170 VanDerWaalsContact CG1-CG2 3.46Å; E166-I170 WeakPolarHBondContact O-CG1 3.33Å; E166-I170 PolarHBondContact O-N 3.46Å; R167-I170 PolarHBondContact O-N 3.04Å; S168-I170 PolarHBondContact O-N 2.92Å; I170-D172 VanDerWaalsContact C-N 3.35Å; I170-D172 PolarHBondContact O-N 3.33Å; I170-Q173 WeakPolarHBondContact O-CB 3.19Å; I170-Q173 PolarHBondContact O-N 3.08Å; I170-I174 HydrophobicContact CG2-CD1 4.2Å; I170-I174 HydrophobicContact CG2-CG1 4.44Å; I170-I174 WeakPolarHBondContact O-CG1 3.4Å; I170-I174 PolarHBondContact O-N 3.23Å
171M90.4Very high89.8Confident133 Ų13389.1 Ų89.166%0.65544%0.443SS*.Hα-helixtrans-62.4-41.7175.6-168.5174.2-15700112I158 R167 S168 Q173 I174 K175I158-M171 HydrophobicContact CD1-CB 4.27Å; R167-M171 WeakPolarHBondContact O-CB 3.47Å; R167-M171 PolarHBondContact O-N 3.4Å; S168-M171 WeakPolarHBondContact O-CB 3.4Å; S168-M171 PolarHBondContact O-N 2.98Å; M171-Q173 VanDerWaalsContact C-N 3.32Å; M171-Q173 PolarHBondContact O-N 3.35Å; M171-I174 PolarHBondContact O-N 3.1Å; M171-K175 PolarHBondContact O-N 3.14Å
172D92.4Very high90Very high100 Ų10091.7 Ų91.754%0.53546%0.458SS..Hα-helixtrans-63.2-39174.5-66.4-29.5000111.6S168 I170 K175 A176S168-D172 PolarHBondContact O-N 3.44Å; I170-D172 VanDerWaalsContact C-N 3.35Å; I170-D172 PolarHBondContact O-N 3.33Å; D172-K175 PolarHBondContact O-N 2.89Å; D172-A176 PolarHBondContact O-N 3.49Å
173Q91.7Very high90.4Very high84 Ų8490.1 Ų90.139%0.39345%0.445SS..Hα-helixtrans-64.8-46.7176-176.859.543.600111.9K169 I170 M171 K175 A176 D177K169-Q173 PolarHBondContact O-N 2.98Å; K169-Q173 VanDerWaalsContact O-N 3.12Å; I170-Q173 WeakPolarHBondContact O-CB 3.19Å; I170-Q173 PolarHBondContact O-N 3.08Å; M171-Q173 VanDerWaalsContact C-N 3.32Å; M171-Q173 PolarHBondContact O-N 3.35Å; Q173-K175 VanDerWaalsContact C-N 3.26Å; Q173-K175 PolarHBondContact O-N 3.22Å; Q173-A176 PolarHBondContact O-N 3.39Å; Q173-A176 VanDerWaalsContact O-N 3.17Å; Q173-D177 VanDerWaalsContact NE2-CG 3.32Å; Q173-D177 PolarHBondContact NE2-OD1 2.8Å; Q173-D177 PolarHBondContact NE2-OD2 2.95Å; Q173-D177 PolarHBondContact O-N 3.26Å
174I92.1Very high90.7Very high19 Ų1985 Ų8510%0.09742%0.421CS..Hα-helixtrans-57.8-43.2176.1-70.8170000110.3I151 C154 E155 I158 I170 M171 D177 H178I151-I174 HydrophobicContact CG2-CG2 4.19Å; C154-I174 HydrophobicContact CB-CD1 3.87Å; C154-I174 HydrophobicContact CB-CG1 3.59Å; E155-I174 HydrophobicContact CG-CD1 3.73Å; I158-I174 HydrophobicContact CD1-CD1 3.36Å; I158-I174 HydrophobicContact CG1-CD1 4.41Å; I170-I174 HydrophobicContact CG2-CD1 4.2Å; I170-I174 HydrophobicContact CG2-CG1 4.44Å; I170-I174 WeakPolarHBondContact O-CG1 3.4Å; I170-I174 PolarHBondContact O-N 3.23Å; M171-I174 PolarHBondContact O-N 3.1Å; I174-D177 PolarHBondContact O-N 3.19Å; I174-H178 VanDerWaalsContact CG2-CE1 3.43Å; I174-H178 WeakPolarHBondContact CG2-CE1 3.48Å; I174-H178 VanDerWaalsContact CG2-ND1 3.35Å; I174-H178 WeakPolarHBondContact CG2-ND1 3.25Å; I174-H178 PolarHBondContact O-N 3.48Å; I174-H178 PolarHBondContact O-ND1 3.43Å
175K93.1Very high90.9Very high140 Ų14082.5 Ų82.561%0.60940%0.4SS*.Hα-helixtrans-62-45.9177.5-171.1-177.1177.3-1720111.4M171 D172 Q173 D177 H178 D179M171-K175 PolarHBondContact O-N 3.14Å; D172-K175 PolarHBondContact O-N 2.89Å; Q173-K175 VanDerWaalsContact C-N 3.26Å; Q173-K175 PolarHBondContact O-N 3.22Å; K175-D177 VanDerWaalsContact C-N 3.3Å; K175-D177 PolarHBondContact O-N 3.19Å; K175-H178 WeakPolarHBondContact O-CB 3.34Å; K175-H178 PolarHBondContact O-N 3.23Å; K175-D179 PolarHBondContact O-N 3.04Å
176A92.9Very high91Very high35 Ų3578.5 Ų78.529%0.28939%0.387SS..Hα-helixtrans-61.7-37.1177.400000112.7D172 Q173 D179 R180D172-A176 PolarHBondContact O-N 3.49Å; Q173-A176 PolarHBondContact O-N 3.39Å; Q173-A176 VanDerWaalsContact O-N 3.17Å; A176-D179 PolarHBondContact O-N 3.2Å; A176-R180 VanDerWaalsContact O-CG 3.28Å; A176-R180 WeakPolarHBondContact O-CG 3.36Å; A176-R180 PolarHBondContact O-N 2.92Å; A176-R180 VanDerWaalsContact O-N 3.08Å
177D93.2Very high91Very high7 Ų777.6 Ų77.64%0.03739%0.385CS..Hα-helixtrans-74.5-31.7177.2-69.6-29.3000112.5L147 I151 Q173 I174 K175 R180 M181L147-D177 HydrophobicContact CD2-CB 4.03Å; I151-D177 HydrophobicContact CD1-CB 4.08Å; I151-D177 HydrophobicContact CG1-CB 3.96Å; Q173-D177 VanDerWaalsContact NE2-CG 3.32Å; Q173-D177 PolarHBondContact NE2-OD1 2.8Å; Q173-D177 PolarHBondContact NE2-OD2 2.95Å; Q173-D177 PolarHBondContact O-N 3.26Å; I174-D177 PolarHBondContact O-N 3.19Å; K175-D177 VanDerWaalsContact C-N 3.3Å; K175-D177 PolarHBondContact O-N 3.19Å; D177-R180 IonicContact OD1-CZ 2.86Å; D177-R180 IonicContact OD1-NH1 2.94Å; D177-R180 PolarHBondContact OD1-NH1 3.37Å; D177-M181 WeakPolarHBondContact O-CB 3.46Å; D177-M181 PolarHBondContact O-N 3.42Å
178H92.3Very high91Very high74 Ų7472.2 Ų72.234%0.34337%0.365SS..Hα-helixtrans-63.4-45168.2-81.686.7000112I174 K175 R180 M181 V182I174-H178 VanDerWaalsContact CG2-CE1 3.43Å; I174-H178 WeakPolarHBondContact CG2-CE1 3.48Å; I174-H178 VanDerWaalsContact CG2-ND1 3.35Å; I174-H178 WeakPolarHBondContact CG2-ND1 3.25Å; I174-H178 PolarHBondContact O-N 3.48Å; I174-H178 PolarHBondContact O-ND1 3.43Å; K175-H178 WeakPolarHBondContact O-CB 3.34Å; K175-H178 PolarHBondContact O-N 3.23Å; H178-R180 PolarHBondContact O-N 3.32Å; H178-M181 WeakPolarHBondContact O-CB 3.34Å; H178-M181 PolarHBondContact O-N 2.85Å; H178-M181 VanDerWaalsContact O-N 3.09Å; H178-V182 PolarHBondContact O-N 3.09Å; H178-V182 VanDerWaalsContact O-N 3.08Å
179D93Very high90.9Very high91 Ų9173.7 Ų73.749%0.48737%0.371SS..Hα-helixtrans-60.8-45.7177.8-68.8-20.5000110.6K175 A176 M181 V182 D183K175-D179 PolarHBondContact O-N 3.04Å; A176-D179 PolarHBondContact O-N 3.2Å; D179-M181 PolarHBondContact O-N 3.44Å; D179-V182 WeakPolarHBondContact O-CB 3.47Å; D179-V182 PolarHBondContact O-N 3.44Å; D179-V182 VanDerWaalsContact O-N 3.09Å; D179-D183 PolarHBondContact O-N 2.91Å; D179-D183 VanDerWaalsContact O-N 3.08Å
180R91Very high90.5Very high126 Ų12669.1 Ų69.148%0.47536%0.36SS..Hα-helixtrans-59.6-33.7173.7-71.5166.5177178.1-2.6113.1L147 A176 D177 H178 D183 I184L147-R180 HydrophobicContact CD1-CB 4.1Å; A176-R180 VanDerWaalsContact O-CG 3.28Å; A176-R180 WeakPolarHBondContact O-CG 3.36Å; A176-R180 PolarHBondContact O-N 2.92Å; A176-R180 VanDerWaalsContact O-N 3.08Å; D177-R180 IonicContact OD1-CZ 2.86Å; D177-R180 IonicContact OD1-NH1 2.94Å; D177-R180 PolarHBondContact OD1-NH1 3.37Å; H178-R180 PolarHBondContact O-N 3.32Å; R180-D183 PolarHBondContact O-N 2.98Å; R180-I184 WeakPolarHBondContact O-CD1 3.49Å; R180-I184 VanDerWaalsContact O-CG1 3.27Å; R180-I184 WeakPolarHBondContact O-CG1 3.45Å; R180-I184 PolarHBondContact O-N 3.32Å
181M91Very high90.1Very high31 Ų3168.1 Ų68.115%0.15335%0.354CS..Hα-helixtrans-68.6-37.9176.9-175.7-177.961.600111.4R144 L148 D177 H178 D179 I184 N185R144-M181 HydrophobicContact CG-CG 4.29Å; L148-M181 HydrophobicContact CD2-SD 3.77Å; L148-M181 HydrophobicContact CG-SD 4.26Å; D177-M181 WeakPolarHBondContact O-CB 3.46Å; D177-M181 PolarHBondContact O-N 3.42Å; H178-M181 WeakPolarHBondContact O-CB 3.34Å; H178-M181 PolarHBondContact O-N 2.85Å; H178-M181 VanDerWaalsContact O-N 3.09Å; D179-M181 PolarHBondContact O-N 3.44Å; M181-I184 PolarHBondContact O-N 2.94Å; M181-N185 VanDerWaalsContact O-CG 3.25Å; M181-N185 PolarHBondContact O-N 3.15Å; M181-N185 PolarHBondContact O-ND2 3.26Å
182V88.3Confident89.6Confident74 Ų7467.3 Ų67.345%0.44835%0.347SS..Hα-helixtrans-61.4-47.7172.8177.50000109.9H178 D179 I184 N185 D186H178-V182 PolarHBondContact O-N 3.09Å; H178-V182 VanDerWaalsContact O-N 3.08Å; D179-V182 WeakPolarHBondContact O-CB 3.47Å; D179-V182 PolarHBondContact O-N 3.44Å; D179-V182 VanDerWaalsContact O-N 3.09Å; V182-I184 VanDerWaalsContact C-N 3.29Å; V182-I184 PolarHBondContact O-N 3.02Å; V182-N185 WeakPolarHBondContact O-CB 3.42Å; V182-N185 PolarHBondContact O-N 2.97Å; V182-D186 PolarHBondContact O-N 3.37Å
183D90.7Very high89Confident106 Ų10672.3 Ų72.357%0.56736%0.359SS*.Hα-helixtrans-57.2-41.8176.9-64.4-26.7000112.3D179 R180 D186 L187D179-D183 PolarHBondContact O-N 2.91Å; D179-D183 VanDerWaalsContact O-N 3.08Å; R180-D183 PolarHBondContact O-N 2.98Å; D183-D186 PolarHBondContact O-N 3.21Å; D183-L187 WeakPolarHBondContact O-CB 3.37Å; D183-L187 PolarHBondContact O-N 3.45Å
184I91.7Very high88.2Confident10 Ų1072.2 Ų72.25%0.05136%0.36CS..Hα-helixtrans-65.4-41176.3-70164.1000111.1L140 K143 R144 L147 R180 M181 V182 L187 L188L140-I184 HydrophobicContact CB-CG2 4.14Å; L140-I184 HydrophobicContact CD2-CG1 4.27Å; L140-I184 HydrophobicContact CD2-CG2 4.16Å; K143-I184 HydrophobicContact CB-CD1 4.39Å; K143-I184 HydrophobicContact CD-CD1 3.94Å; K143-I184 HydrophobicContact CG-CD1 3.92Å; R144-I184 HydrophobicContact CB-CG2 4.1Å; L147-I184 HydrophobicContact CD1-CD1 3.58Å; R180-I184 WeakPolarHBondContact O-CD1 3.49Å; R180-I184 VanDerWaalsContact O-CG1 3.27Å; R180-I184 WeakPolarHBondContact O-CG1 3.45Å; R180-I184 PolarHBondContact O-N 3.32Å; M181-I184 PolarHBondContact O-N 2.94Å; V182-I184 VanDerWaalsContact C-N 3.29Å; V182-I184 PolarHBondContact O-N 3.02Å; I184-L187 PolarHBondContact O-N 3.24Å; I184-L188 HydrophobicContact CG2-CD1 4.07Å; I184-L188 HydrophobicContact CG2-CG 4.36Å; I184-L188 WeakPolarHBondContact O-CB 3.43Å; I184-L188 WeakPolarHBondContact O-CG 3.42Å; I184-L188 PolarHBondContact O-N 3.07Å
185N90.3Very high87.4Confident45 Ų4577.8 Ų77.824%0.24138%0.38CS..Hα-helixtrans-64-42.5178.1-71.5-33.5000111.3R144 M181 V182 L187 L188 V189R144-N185 PolarHBondContact NH1-OD1 2.85Å; M181-N185 VanDerWaalsContact O-CG 3.25Å; M181-N185 PolarHBondContact O-N 3.15Å; M181-N185 PolarHBondContact O-ND2 3.26Å; V182-N185 WeakPolarHBondContact O-CB 3.42Å; V182-N185 PolarHBondContact O-N 2.97Å; N185-L187 VanDerWaalsContact C-N 3.33Å; N185-L187 PolarHBondContact O-N 3.19Å; N185-L188 PolarHBondContact O-N 2.89Å; N185-V189 WeakPolarHBondContact O-CG2 3.38Å; N185-V189 PolarHBondContact O-N 3.14Å
186D89.9Confident86.1Confident96 Ų9676.9 Ų76.951%0.51338%0.381SS..Hα-helixtrans-63.9-39.8177.2-72-11000111.6V182 D183 V189 S190V182-D186 PolarHBondContact O-N 3.37Å; D183-D186 PolarHBondContact O-N 3.21Å; D186-V189 PolarHBondContact O-N 2.86Å; D186-S190 WeakPolarHBondContact O-CB 3.3Å; D186-S190 PolarHBondContact O-N 2.75Å; D186-S190 PolarHBondContact O-OG 3.18Å
187L88Confident84.5Confident77 Ų7778 Ų7840%0.40338%0.382SS..Hα-helixtrans-65.9-40.7174.3-175.257.5000112L140 D183 I184 N185 S190 L191L140-L187 HydrophobicContact CD1-CB 4.4Å; L140-L187 HydrophobicContact CD1-CD2 3.56Å; L140-L187 HydrophobicContact CD1-CG 3.71Å; L140-L187 HydrophobicContact CD2-CD2 3.85Å; L140-L187 HydrophobicContact CG-CD2 4.35Å; D183-L187 WeakPolarHBondContact O-CB 3.37Å; D183-L187 PolarHBondContact O-N 3.45Å; I184-L187 PolarHBondContact O-N 3.24Å; N185-L187 VanDerWaalsContact C-N 3.33Å; N185-L187 PolarHBondContact O-N 3.19Å; L187-S190 WeakPolarHBondContact O-CB 3.26Å; L187-S190 PolarHBondContact O-N 3.3Å; L187-L191 HydrophobicContact CG-CD1 4.23Å; L187-L191 WeakPolarHBondContact O-CG 3.31Å; L187-L191 PolarHBondContact O-N 3.27Å
188L89.2Confident82.6Confident9 Ų981.1 Ų81.15%0.04740%0.403CS..Hα-helixtrans-63.4-41.3175.6-78.4173.5000112.1V137 L140 N141 I184 N185 S190 L191 K192V137-L188 HydrophobicContact CB-CD2 4.29Å; V137-L188 HydrophobicContact CG1-CD2 3.95Å; V137-L188 HydrophobicContact CG2-CD2 4.26Å; L140-L188 HydrophobicContact CB-CD2 3.8Å; L140-L188 HydrophobicContact CB-CG 4.15Å; L140-L188 HydrophobicContact CD1-CD2 4.16Å; L140-L188 HydrophobicContact CD1-CG 4.46Å; N141-L188 WeakPolarHBondContact OD1-CD1 3.12Å; I184-L188 HydrophobicContact CG2-CD1 4.07Å; I184-L188 HydrophobicContact CG2-CG 4.36Å; I184-L188 WeakPolarHBondContact O-CB 3.43Å; I184-L188 WeakPolarHBondContact O-CG 3.42Å; I184-L188 PolarHBondContact O-N 3.07Å; N185-L188 PolarHBondContact O-N 2.89Å; L188-S190 VanDerWaalsContact C-N 3.33Å; L188-L191 PolarHBondContact O-N 2.95Å; L188-K192 WeakPolarHBondContact O-CB 3.45Å; L188-K192 VanDerWaalsContact O-CG 3.28Å; L188-K192 WeakPolarHBondContact O-CG 3.15Å; L188-K192 PolarHBondContact O-N 3.33Å
189V85.8Confident80.6Confident96 Ų9681.1 Ų81.158%0.58241%0.405SS*.Hα-helixtrans-63.2-42.7174.7172.30000110.5N185 D186 K192 R193N185-V189 WeakPolarHBondContact O-CG2 3.38Å; N185-V189 PolarHBondContact O-N 3.14Å; D186-V189 PolarHBondContact O-N 2.86Å; V189-K192 PolarHBondContact O-N 2.92Å; V189-R193 WeakPolarHBondContact O-CB 3.31Å; V189-R193 PolarHBondContact O-N 2.88Å
190S83Confident78.8Confident63 Ų6382.3 Ų82.344%0.44141%0.411SS..Hα-helixtrans-62.6-46.1178-58.90000112D186 L187 L188 R193 I194D186-S190 WeakPolarHBondContact O-CB 3.3Å; D186-S190 PolarHBondContact O-N 2.75Å; D186-S190 PolarHBondContact O-OG 3.18Å; L187-S190 WeakPolarHBondContact O-CB 3.26Å; L187-S190 PolarHBondContact O-N 3.3Å; L188-S190 VanDerWaalsContact C-N 3.33Å; S190-R193 PolarHBondContact O-N 3.36Å; S190-I194 WeakPolarHBondContact O-CG1 3.26Å; S190-I194 PolarHBondContact O-N 3.27Å; S190-I194 VanDerWaalsContact O-N 3.12Å
191L82Confident77.3Confident15 Ų1578.9 Ų78.98%0.07941%0.405CS..Hα-helixtrans-62.3-43.7175.7-75.5167.2000111.9M133 M136 V137 L140 L187 L188 R193 I194 R195M133-L191 HydrophobicContact CE-CD2 4.12Å; M133-L191 VanDerWaalsContact CE-O 3.29Å; M133-L191 WeakPolarHBondContact CE-O 3.45Å; M133-L191 HydrophobicContact CG-CD2 4.27Å; M136-L191 HydrophobicContact CB-CD1 4.46Å; M136-L191 HydrophobicContact CG-CD1 4.14Å; M136-L191 HydrophobicContact SD-CD1 4Å; M136-L191 HydrophobicContact SD-CD2 4.15Å; V137-L191 HydrophobicContact CG2-CB 3.97Å; V137-L191 HydrophobicContact CG2-CD1 3.96Å; L140-L191 HydrophobicContact CD1-CD1 3.5Å; L187-L191 HydrophobicContact CG-CD1 4.23Å; L187-L191 WeakPolarHBondContact O-CG 3.31Å; L187-L191 PolarHBondContact O-N 3.27Å; L188-L191 PolarHBondContact O-N 2.95Å; L191-R193 VanDerWaalsContact C-N 3.31Å; L191-R193 PolarHBondContact O-N 2.92Å; L191-I194 PolarHBondContact O-N 3.08Å; L191-R195 PolarHBondContact O-N 3.37Å
192K80.8Confident75.5Confident116 Ų11681.3 Ų81.350%0.50441%0.412SS..Hα-helixtrans-62-38.4175.6-77177.2-179.2-179.90112.1L188 V189 R195 N196L188-K192 WeakPolarHBondContact O-CB 3.45Å; L188-K192 VanDerWaalsContact O-CG 3.28Å; L188-K192 WeakPolarHBondContact O-CG 3.15Å; L188-K192 PolarHBondContact O-N 3.33Å; V189-K192 PolarHBondContact O-N 2.92Å; K192-R195 PolarHBondContact O-N 3.01Å; K192-N196 VanDerWaalsContact O-CB 3.27Å; K192-N196 WeakPolarHBondContact O-CB 3.47Å; K192-N196 PolarHBondContact O-N 2.72Å
193R79.4Confident74Confident204 Ų20483 Ų8377%0.7741%0.411SS*.Hα-helixtrans-63.9-40.7176.9-175.4177.5177.5-179.9-1.2111.9V189 S190 L191 I197V189-R193 WeakPolarHBondContact O-CB 3.31Å; V189-R193 PolarHBondContact O-N 2.88Å; S190-R193 PolarHBondContact O-N 3.36Å; L191-R193 VanDerWaalsContact C-N 3.31Å; L191-R193 PolarHBondContact O-N 2.92Å; R193-I197 WeakPolarHBondContact O-CG1 3.44Å; R193-I197 PolarHBondContact O-N 2.89Å
194I75.2Confident72.6Confident83 Ų8383 Ų8343%0.42641%0.407SS..Hα-helixtrans-69.2-37177-63165.3000110.9M133 S190 L191 I197M133-I194 HydrophobicContact CE-CB 3.63Å; M133-I194 HydrophobicContact CE-CG2 3.55Å; M133-I194 HydrophobicContact SD-CG2 3.94Å; S190-I194 WeakPolarHBondContact O-CG1 3.26Å; S190-I194 PolarHBondContact O-N 3.27Å; S190-I194 VanDerWaalsContact O-N 3.12Å; L191-I194 PolarHBondContact O-N 3.08Å; I194-I197 WeakPolarHBondContact O-CG1 3.26Å
195R74.6Confident71.2Confident136 Ų13689.9 Ų89.951%0.51344%0.437SS..Hα-helixtrans-68.5-44175.9-176.8-179.7175.6179.4-3.9112.4M133 D134 L191 K192 I197M133-R195 HydrophobicContact CE-CB 4.22Å; D134-R195 IonicContact OD1-CZ 3.96Å; D134-R195 VanDerWaalsContact OD1-CZ 3.23Å; D134-R195 IonicContact OD1-NE 2.74Å; D134-R195 IonicContact OD1-NH1 3.23Å; D134-R195 PolarHBondContact OD1-NH1 2.85Å; D134-R195 IonicContact OD1-NH2 3.83Å; L191-R195 PolarHBondContact O-N 3.37Å; K192-R195 PolarHBondContact O-N 3.01Å; R195-I197 PolarHBondContact O-N 3.25Å
196N66.2Low69.8Low120 Ų12091.4 Ų91.464%0.64244%0.444SS*.THydrogen-bonded Turntrans-86.416.4-176.5-77.57.5000113.3K192 P198K192-N196 VanDerWaalsContact O-CB 3.27Å; K192-N196 WeakPolarHBondContact O-CB 3.47Å; K192-N196 PolarHBondContact O-N 2.72Å; N196-P198 WeakPolarHBondContact O-CD 3.4Å; N196-P198 VanDerWaalsContact O-N 3.11Å
197I58.1Low68.4Low59 Ų5991.3 Ų91.330%0.30344%0.443SS..SBendtrans-67.9112.9164.9-47.9173.7000104.8R193 I194 R195 D199 R202R193-I197 WeakPolarHBondContact O-CG1 3.44Å; R193-I197 PolarHBondContact O-N 2.89Å; I194-I197 WeakPolarHBondContact O-CG1 3.26Å; R195-I197 PolarHBondContact O-N 3.25Å; I197-D199 PolarHBondContact O-N 3.45Å; I197-R202 HydrophobicContact CB-CG 4.28Å; I197-R202 HydrophobicContact CG2-CG 3.41Å; I197-R202 VanDerWaalsContact CG2-CG 3.41Å
198P53.5Low67.2Low72 Ų7293.6 Ų93.647%0.46845%0.45SS..  trans-54.8121.2178.7-16.327.8000106.4N196 D200 T201 R202N196-P198 WeakPolarHBondContact O-CD 3.4Å; N196-P198 VanDerWaalsContact O-N 3.11Å; P198-D200 PolarHBondContact O-N 3.17Å; P198-D200 VanDerWaalsContact O-N 3.1Å; P198-T201 HydrophobicContact CB-CG2 4.04Å; P198-T201 WeakPolarHBondContact CD-OG1 3.48Å; P198-T201 HydrophobicContact CG-CG2 4.03Å; P198-T201 PolarHBondContact O-N 3Å; P198-T201 PolarHBondContact O-OG1 3.18Å; P198-R202 PolarHBondContact O-N 3.46Å
199D52Low66Low75 Ų7595.5 Ų95.540%0.40146%0.462SS..Hα-helixtrans-52.7-35.7-177.5-76.3-33.8000110.4I197 T201 R202 W203I197-D199 PolarHBondContact O-N 3.45Å; D199-T201 VanDerWaalsContact C-N 3.34Å; D199-T201 PolarHBondContact O-N 3.44Å; D199-R202 PolarHBondContact O-N 3.49Å; D199-R202 IonicContact OD1-CZ 2.67Å; D199-R202 IonicContact OD1-NE 3.81Å; D199-R202 IonicContact OD1-NH2 3.74Å; D199-R202 PolarHBondContact OD1-NH2 2.89Å; D199-W203 PolarHBondContact O-N 2.95Å
200D55Low64.8Low115 Ų11591.9 Ų91.962%0.61544%0.439SS*.Hα-helixtrans-52.6-47.3171.7-58.1-16000111.7P198 R202 E204P198-D200 PolarHBondContact O-N 3.17Å; P198-D200 VanDerWaalsContact O-N 3.1Å; D200-R202 PolarHBondContact O-N 3.45Å; D200-E204 WeakPolarHBondContact O-CA 3.45Å; D200-E204 WeakPolarHBondContact O-CB 3.23Å; D200-E204 WeakPolarHBondContact O-CG 3.34Å; D200-E204 PolarHBondContact O-N 3.2Å
201T58Low64Low55 Ų5590.3 Ų90.334%0.33743%0.426SS..Hα-helixtrans-71.7-29.6-176.862.10000114.2P198 D199 K205P198-T201 HydrophobicContact CB-CG2 4.04Å; P198-T201 WeakPolarHBondContact CD-OG1 3.48Å; P198-T201 HydrophobicContact CG-CG2 4.03Å; P198-T201 PolarHBondContact O-N 3Å; P198-T201 PolarHBondContact O-OG1 3.18Å; D199-T201 VanDerWaalsContact C-N 3.34Å; D199-T201 PolarHBondContact O-N 3.44Å; T201-K205 WeakPolarHBondContact O-CB 3.38Å; T201-K205 VanDerWaalsContact O-CG 3.24Å; T201-K205 WeakPolarHBondContact O-CG 3.45Å; T201-K205 PolarHBondContact O-N 3.37Å
202R54.8Low63.1Low82 Ų8296.2 Ų96.231%0.30945%0.453SS..Hα-helixtrans-73.4-50.3175.5-73.5-173.8-69.9-174.4-1.4110I197 P198 D199 D200 K205 I206I197-R202 HydrophobicContact CB-CG 4.28Å; I197-R202 HydrophobicContact CG2-CG 3.41Å; I197-R202 VanDerWaalsContact CG2-CG 3.41Å; P198-R202 PolarHBondContact O-N 3.46Å; D199-R202 PolarHBondContact O-N 3.49Å; D199-R202 IonicContact OD1-CZ 2.67Å; D199-R202 IonicContact OD1-NE 3.81Å; D199-R202 IonicContact OD1-NH2 3.74Å; D199-R202 PolarHBondContact OD1-NH2 2.89Å; D200-R202 PolarHBondContact O-N 3.45Å; R202-K205 PolarHBondContact O-N 2.71Å; R202-I206 WeakPolarHBondContact O-CD1 3.5Å; R202-I206 VanDerWaalsContact O-CG1 3.27Å; R202-I206 WeakPolarHBondContact O-CG1 3.07Å; R202-I206 PolarHBondContact O-N 2.94Å
203W55.7Low62.5Low109 Ų10995.3 Ų95.341%0.41345%0.454SS..Hα-helixtrans-65.5-42.7179-69.3121000111.3L122 D199 K205 I206 L207L122-W203 HydrophobicContact CD2-CH2 3.49Å; L122-W203 VanDerWaalsContact CD2-CH2 3.49Å; L122-W203 HydrophobicContact CD2-CZ2 4.22Å; L122-W203 HydrophobicContact CD2-CZ3 4.4Å; L122-W203 HydrophobicContact CG-CH2 4.24Å; D199-W203 PolarHBondContact O-N 2.95Å; W203-K205 VanDerWaalsContact C-N 3.32Å; W203-K205 PolarHBondContact O-N 2.98Å; W203-I206 HydrophobicContact CE3-CD1 4.29Å; W203-I206 HydrophobicContact CZ3-CD1 4.25Å; W203-I206 PolarHBondContact O-N 3.2Å; W203-L207 HydrophobicContact CB-CD1 4.44Å; W203-L207 WeakPolarHBondContact O-CB 2.99Å; W203-L207 WeakPolarHBondContact O-CG 3.46Å; W203-L207 PolarHBondContact O-N 3.16Å
204E62Low61.4Low106 Ų10694.9 Ų94.950%0.49545%0.452SS..Hα-helixtrans-61.1-37.7175.5-78.5177.8-177.100112.7D200 K208D200-E204 WeakPolarHBondContact O-CA 3.45Å; D200-E204 WeakPolarHBondContact O-CB 3.23Å; D200-E204 WeakPolarHBondContact O-CG 3.34Å; D200-E204 PolarHBondContact O-N 3.2Å; E204-K208 WeakPolarHBondContact O-CB 3.48Å; E204-K208 VanDerWaalsContact O-CG 3.28Å; E204-K208 WeakPolarHBondContact O-CG 3.4Å; E204-K208 PolarHBondContact O-N 3.32Å
205K62.3Low61.3Low155 Ų15594.7 Ų94.767%0.67445%0.452SS*.Hα-helixtrans-69.1-44.8175.9-80.8-179.9179.4-172.80111.7T201 R202 W203 K208 V209T201-K205 WeakPolarHBondContact O-CB 3.38Å; T201-K205 VanDerWaalsContact O-CG 3.24Å; T201-K205 WeakPolarHBondContact O-CG 3.45Å; T201-K205 PolarHBondContact O-N 3.37Å; R202-K205 PolarHBondContact O-N 2.71Å; W203-K205 VanDerWaalsContact C-N 3.32Å; W203-K205 PolarHBondContact O-N 2.98Å; K205-K208 PolarHBondContact O-N 2.67Å; K205-V209 WeakPolarHBondContact O-CG2 3.35Å; K205-V209 PolarHBondContact O-N 3.13Å
206I59.6Low60.6Low76 Ų7691.1 Ų91.139%0.3946%0.458SS..Hα-helixtrans-65.4-45.8178.9-67164.7000109.9R202 W203 V209 L210R202-I206 WeakPolarHBondContact O-CD1 3.5Å; R202-I206 VanDerWaalsContact O-CG1 3.27Å; R202-I206 WeakPolarHBondContact O-CG1 3.07Å; R202-I206 PolarHBondContact O-N 2.94Å; W203-I206 HydrophobicContact CE3-CD1 4.29Å; W203-I206 HydrophobicContact CZ3-CD1 4.25Å; W203-I206 PolarHBondContact O-N 3.2Å; I206-V209 PolarHBondContact O-N 3.1Å; I206-L210 HydrophobicContact CG2-CD1 3.55Å; I206-L210 HydrophobicContact CG2-CG 4.3Å; I206-L210 WeakPolarHBondContact O-CB 3.36Å; I206-L210 WeakPolarHBondContact O-CG 3.4Å; I206-L210 PolarHBondContact O-N 2.84Å
207L60.9Low60.5Low94 Ų9492.4 Ų92.449%0.49246%0.457SS..Hα-helixtrans-63.1-42.8176.9-71.2170.4000111.6W203 V209 L210 D211W203-L207 HydrophobicContact CB-CD1 4.44Å; W203-L207 WeakPolarHBondContact O-CB 2.99Å; W203-L207 WeakPolarHBondContact O-CG 3.46Å; W203-L207 PolarHBondContact O-N 3.16Å; L207-V209 PolarHBondContact O-N 3.48Å; L207-L210 PolarHBondContact O-N 3.46Å; L207-D211 WeakPolarHBondContact O-CA 3.38Å; L207-D211 WeakPolarHBondContact O-CB 3.37Å; L207-D211 PolarHBondContact O-N 3.15Å
208K64.2Low60.8Low125 Ų12592.7 Ų92.754%0.54346%0.459SS..Hα-helixtrans-60.9-31.4176.9-88.4177.7178.1170.60114.2E204 K205 E212E204-K208 WeakPolarHBondContact O-CB 3.48Å; E204-K208 VanDerWaalsContact O-CG 3.28Å; E204-K208 WeakPolarHBondContact O-CG 3.4Å; E204-K208 PolarHBondContact O-N 3.32Å; K205-K208 PolarHBondContact O-N 2.67Å; K208-E212 VanDerWaalsContact O-CG 3.25Å; K208-E212 WeakPolarHBondContact O-CG 3.42Å
209V63.3Low61.3Low49 Ų4993.5 Ų93.530%0.29746%0.457SS..Hα-helixtrans-85.3-34.4179.3174.10000111K205 I206 L207 H222 V226 L229K205-V209 WeakPolarHBondContact O-CG2 3.35Å; K205-V209 PolarHBondContact O-N 3.13Å; I206-V209 PolarHBondContact O-N 3.1Å; L207-V209 PolarHBondContact O-N 3.48Å; V209-H222 PolarHBondContact O-ND1 3.22Å; V209-V226 HydrophobicContact CG1-CG2 4.26Å; V209-L229 HydrophobicContact CG1-CD1 4.35Å
210L60.8Low62Low21 Ų2192.4 Ų92.411%0.1145%0.45CS..Hα-helixtrans-82.5-25.7-177.7-72.7178.2000114.2I206 L207 I218 H222 V226I206-L210 HydrophobicContact CG2-CD1 3.55Å; I206-L210 HydrophobicContact CG2-CG 4.3Å; I206-L210 WeakPolarHBondContact O-CB 3.36Å; I206-L210 WeakPolarHBondContact O-CG 3.4Å; I206-L210 PolarHBondContact O-N 2.84Å; L207-L210 PolarHBondContact O-N 3.46Å; L210-I218 HydrophobicContact CB-CD1 4.14Å; L210-I218 HydrophobicContact CB-CG1 4.09Å; L210-I218 HydrophobicContact CB-CG2 4.02Å; L210-I218 HydrophobicContact CD1-CD1 4.14Å; L210-I218 HydrophobicContact CD2-CG2 3.82Å; L210-I218 HydrophobicContact CG-CG2 4.38Å; L210-H222 HydrophobicContact CD2-CB 4.01Å; L210-H222 PolarHBondContact O-CD2 3.47Å; L210-H222 VanDerWaalsContact O-CD2 3.24Å; L210-V226 HydrophobicContact CD2-CB 4.38Å; L210-V226 HydrophobicContact CD2-CG2 3.43Å; L210-V226 VanDerWaalsContact CD2-CG2 3.43Å; L210-V226 HydrophobicContact CG-CG2 4.03Å
211D66.5Low62.6Low29 Ų2991.7 Ų91.716%0.15545%0.447CS..  trans-134.959.2-173.8-173.826.2000107.2L207 D213 R214 D215 G216L207-D211 WeakPolarHBondContact O-CA 3.38Å; L207-D211 WeakPolarHBondContact O-CB 3.37Å; L207-D211 PolarHBondContact O-N 3.15Å; D211-D213 PolarHBondContact O-N 3.02Å; D211-R214 VanDerWaalsContact CG-CA 3.43Å; D211-R214 PolarHBondContact O-N 3.44Å; D211-R214 VanDerWaalsContact O-N 3.11Å; D211-R214 VanDerWaalsContact OD1-C 3.28Å; D211-R214 WeakPolarHBondContact OD1-CA 3.34Å; D211-R214 PolarHBondContact OD1-N 3.06Å; D211-R214 WeakPolarHBondContact OD2-CA 3.45Å; D211-D215 PolarHBondContact OD1-N 2.94Å; D211-G216 PolarHBondContact OD1-N 2.92Å; D211-G216 PolarHBondContact OD2-N 3.37Å
212E61.9Low62.8Low139 Ų13990.3 Ų90.365%0.6544%0.436SS*.SBendtrans-59.2-34.7-176.3-83-175.3176.700111.9K208K208-E212 VanDerWaalsContact O-CG 3.25Å; K208-E212 WeakPolarHBondContact O-CG 3.42Å
213D68.2Low63.3Low98 Ų9886.6 Ų86.652%0.52442%0.423SS..SBendtrans-90-7.3177.671-15.6000113.9D211 D215D211-D213 PolarHBondContact O-N 3.02Å; D213-D215 VanDerWaalsContact C-N 3.28Å; D213-D215 PolarHBondContact O-N 3.35Å; D213-D215 PolarHBondContact OD1-N 2.91Å
214R55.9Low63.8Low194 Ų19485.6 Ų85.673%0.73243%0.425SS*.  trans60.732.9178.1-54.5-177.9-174.6174.42.9113.4D211 G216D211-R214 VanDerWaalsContact CG-CA 3.43Å; D211-R214 PolarHBondContact O-N 3.44Å; D211-R214 VanDerWaalsContact O-N 3.11Å; D211-R214 VanDerWaalsContact OD1-C 3.28Å; D211-R214 WeakPolarHBondContact OD1-CA 3.34Å; D211-R214 PolarHBondContact OD1-N 3.06Å; D211-R214 WeakPolarHBondContact OD2-CA 3.45Å; R214-G216 VanDerWaalsContact C-N 3.29Å
215D72.9Confident64Low79 Ų7983 Ų8342%0.42242%0.418SS..SBendtrans-83.8-10.4177.591.6-22.4000112.4D211 D213 K217D211-D215 PolarHBondContact OD1-N 2.94Å; D213-D215 VanDerWaalsContact C-N 3.28Å; D213-D215 PolarHBondContact O-N 3.35Å; D213-D215 PolarHBondContact OD1-N 2.91Å; D215-K217 VanDerWaalsContact C-N 3.33Å; D215-K217 WeakPolarHBondContact OD1-CA 3.33Å; D215-K217 VanDerWaalsContact OD1-CB 3.23Å; D215-K217 WeakPolarHBondContact OD1-CB 3.35Å; D215-K217 PolarHBondContact OD1-N 2.92Å; D215-K217 WeakPolarHBondContact OD2-CD 3.42Å
216G61.6Low64.1Low62 Ų6277.9 Ų77.964%0.63940%0.4SS*.SBendtrans82.28.6-179.800000114D211 R214D211-G216 PolarHBondContact OD1-N 2.92Å; D211-G216 PolarHBondContact OD2-N 3.37Å; R214-G216 VanDerWaalsContact C-N 3.29Å
217K64.2Low64.4Low146 Ų14677.4 Ų77.464%0.63540%0.397SS*.  trans-113126.8173.5-55.4179.5-172.5168.50108.5D215 E219D215-K217 VanDerWaalsContact C-N 3.33Å; D215-K217 WeakPolarHBondContact OD1-CA 3.33Å; D215-K217 VanDerWaalsContact OD1-CB 3.23Å; D215-K217 WeakPolarHBondContact OD1-CB 3.35Å; D215-K217 PolarHBondContact OD1-N 2.92Å; D215-K217 WeakPolarHBondContact OD2-CD 3.42Å; K217-E219 PolarHBondContact O-N 3.45Å
218I62.9Low64.8Low65 Ų6580.2 Ų80.233%0.33341%0.408SS..  trans-92.6105.1175.5-57.8171.1000106.4L210 H222 V223L210-I218 HydrophobicContact CB-CD1 4.14Å; L210-I218 HydrophobicContact CB-CG1 4.09Å; L210-I218 HydrophobicContact CB-CG2 4.02Å; L210-I218 HydrophobicContact CD1-CD1 4.14Å; L210-I218 HydrophobicContact CD2-CG2 3.82Å; L210-I218 HydrophobicContact CG-CG2 4.38Å; I218-H222 HydrophobicContact CG2-CB 4.13Å; I218-V223 HydrophobicContact CG2-CG2 3.72Å
219E65.6Low64.8Low90 Ų9079 Ų7942%0.42141%0.407SS..  trans-64.9153.9171-57.9-170.4171.600112K217 N221 H222 V223 E252K217-E219 PolarHBondContact O-N 3.45Å; E219-N221 PolarHBondContact O-N 2.81Å; E219-N221 PolarHBondContact OE2-ND2 3.34Å; E219-H222 WeakPolarHBondContact O-CA 3.34Å; E219-H222 VanDerWaalsContact O-CB 3.3Å; E219-H222 WeakPolarHBondContact O-CB 3.27Å; E219-H222 PolarHBondContact O-N 3.13Å; E219-V223 PolarHBondContact O-N 3.47Å; E219-E252 WeakPolarHBondContact CA-OE1 3.46Å
220L65.8Low64.7Low52 Ų5279 Ų7927%0.27241%0.405SS..Hα-helixtrans-54.7-39.6178.3-174.851.8000110.9H222 V223 L224 I249 E252L220-H222 PolarHBondContact O-N 3.3Å; L220-V223 PolarHBondContact O-N 3.2Å; L220-V223 VanDerWaalsContact O-N 3.14Å; L220-L224 HydrophobicContact CD1-CG 4.49Å; L220-L224 HydrophobicContact CG-CD1 4.16Å; L220-L224 HydrophobicContact CG-CG 4.49Å; L220-L224 WeakPolarHBondContact O-CG 3.5Å; L220-L224 PolarHBondContact O-N 3.45Å; L220-I249 HydrophobicContact CD1-CB 4.03Å; L220-I249 HydrophobicContact CD1-CD1 4.08Å; L220-I249 HydrophobicContact CD1-CG1 3.52Å; L220-I249 HydrophobicContact CD1-CG2 3.63Å; L220-E252 WeakPolarHBondContact CA-OE2 3.4Å; L220-E252 WeakPolarHBondContact CB-OE1 3.4Å; L220-E252 WeakPolarHBondContact CB-OE2 3.29Å; L220-E252 PolarHBondContact N-OE1 2.88Å; L220-E252 PolarHBondContact N-OE2 3.26Å
221N66.7Low64.9Low100 Ų10080.5 Ų80.554%0.53543%0.426SS..Hα-helixtrans-57.3-37.5178-60.8-44000110.8E219 S225E219-N221 PolarHBondContact O-N 2.81Å; E219-N221 PolarHBondContact OE2-ND2 3.34Å; N221-S225 WeakPolarHBondContact O-CB 3.4Å; N221-S225 PolarHBondContact O-N 2.94Å; N221-S225 PolarHBondContact O-OG 2.85Å
222H62.4Low64.8Low26 Ų2683.4 Ų83.412%0.1245%0.448CS..Hα-helixtrans-74.2-38177.8-59.8-58000112.2V209 L210 I218 E219 L220 S225 V226V209-H222 PolarHBondContact O-ND1 3.22Å; L210-H222 HydrophobicContact CD2-CB 4.01Å; L210-H222 PolarHBondContact O-CD2 3.47Å; L210-H222 VanDerWaalsContact O-CD2 3.24Å; I218-H222 HydrophobicContact CG2-CB 4.13Å; E219-H222 WeakPolarHBondContact O-CA 3.34Å; E219-H222 VanDerWaalsContact O-CB 3.3Å; E219-H222 WeakPolarHBondContact O-CB 3.27Å; E219-H222 PolarHBondContact O-N 3.13Å; L220-H222 PolarHBondContact O-N 3.3Å; H222-S225 WeakPolarHBondContact O-CB 3.35Å; H222-S225 PolarHBondContact O-N 3.37Å; H222-V226 PolarHBondContact O-N 3.38Å
223V65.2Low64.9Low4 Ų484 Ų842%0.02445%0.451CS..Hα-helixtrans-63.2-44.6174.6-176.40000111.1I218 E219 L220 V226 I227 V245 M248 I249I218-V223 HydrophobicContact CG2-CG2 3.72Å; E219-V223 PolarHBondContact O-N 3.47Å; L220-V223 PolarHBondContact O-N 3.2Å; L220-V223 VanDerWaalsContact O-N 3.14Å; V223-V226 PolarHBondContact O-N 2.97Å; V223-I227 PolarHBondContact O-N 3.3Å; V223-V245 HydrophobicContact CG1-CG1 3.58Å; V223-M248 HydrophobicContact CB-CE 4.2Å; V223-M248 HydrophobicContact CG1-CE 3.54Å; V223-M248 HydrophobicContact CG2-CE 3.58Å; V223-I249 HydrophobicContact CG1-CG1 4.32Å
224L67.8Low64.4Low88 Ų8886.3 Ų86.346%0.46146%0.463SS..Hα-helixtrans-62.2-41.8174.6-72.9171.4000111.8L220 V226 I227 E228L220-L224 HydrophobicContact CD1-CG 4.49Å; L220-L224 HydrophobicContact CG-CD1 4.16Å; L220-L224 HydrophobicContact CG-CG 4.49Å; L220-L224 WeakPolarHBondContact O-CG 3.5Å; L220-L224 PolarHBondContact O-N 3.45Å; L224-V226 VanDerWaalsContact C-N 3.27Å; L224-V226 PolarHBondContact O-N 3.38Å; L224-I227 HydrophobicContact CD2-CD1 4.26Å; L224-I227 WeakPolarHBondContact O-CB 3.36Å; L224-I227 PolarHBondContact O-N 3.42Å; L224-I227 VanDerWaalsContact O-N 3.08Å; L224-E228 PolarHBondContact O-N 2.94Å
225S65.5Low64.6Low51 Ų5180 Ų8036%0.35745%0.446SS..Hα-helixtrans-58.8-39.2175.1-59.30000111.9N221 H222 E228 L229N221-S225 WeakPolarHBondContact O-CB 3.4Å; N221-S225 PolarHBondContact O-N 2.94Å; N221-S225 PolarHBondContact O-OG 2.85Å; H222-S225 WeakPolarHBondContact O-CB 3.35Å; H222-S225 PolarHBondContact O-N 3.37Å; S225-E228 PolarHBondContact O-N 2.88Å; S225-L229 WeakPolarHBondContact O-CB 3.2Å; S225-L229 WeakPolarHBondContact O-CG 3.05Å; S225-L229 PolarHBondContact O-N 3.38Å
226V63.6Low64.1Low47 Ų4785.9 Ų85.929%0.28547%0.468SS..Hα-helixtrans-67.1-40.4174.1171.60000111.6V209 L210 H222 V223 L224 E228 L229 L230V209-V226 HydrophobicContact CG1-CG2 4.26Å; L210-V226 HydrophobicContact CD2-CB 4.38Å; L210-V226 HydrophobicContact CD2-CG2 3.43Å; L210-V226 VanDerWaalsContact CD2-CG2 3.43Å; L210-V226 HydrophobicContact CG-CG2 4.03Å; H222-V226 PolarHBondContact O-N 3.38Å; V223-V226 PolarHBondContact O-N 2.97Å; L224-V226 VanDerWaalsContact C-N 3.27Å; L224-V226 PolarHBondContact O-N 3.38Å; V226-E228 VanDerWaalsContact C-N 3.31Å; V226-E228 PolarHBondContact O-N 3.43Å; V226-L229 PolarHBondContact O-N 2.92Å; V226-L230 WeakPolarHBondContact O-CB 3.31Å; V226-L230 PolarHBondContact O-N 2.91Å
227I65.9Low64.1Low66 Ų6685.9 Ų85.934%0.33845%0.453SS..Hα-helixtrans-60.7-42.3175.1-67162000110.9V223 L224 L230 G231 V245V223-I227 PolarHBondContact O-N 3.3Å; L224-I227 HydrophobicContact CD2-CD1 4.26Å; L224-I227 WeakPolarHBondContact O-CB 3.36Å; L224-I227 PolarHBondContact O-N 3.42Å; L224-I227 VanDerWaalsContact O-N 3.08Å; I227-L230 PolarHBondContact O-N 2.99Å; I227-G231 PolarHBondContact O-N 2.69Å; I227-V245 HydrophobicContact CD1-CG1 3.59Å; I227-V245 HydrophobicContact CG1-CG1 4Å
228E69.9Low64.2Low153 Ų15381.6 Ų81.672%0.71544%0.442SS*.Hα-helixtrans-65.5-46.8178.9-172.1172.6-170.500111.6L224 S225 V226 L230 G231 S232L224-E228 PolarHBondContact O-N 2.94Å; S225-E228 PolarHBondContact O-N 2.88Å; V226-E228 VanDerWaalsContact C-N 3.31Å; V226-E228 PolarHBondContact O-N 3.43Å; E228-L230 VanDerWaalsContact C-N 3.31Å; E228-L230 PolarHBondContact O-N 3.14Å; E228-G231 PolarHBondContact O-N 2.86Å; E228-S232 WeakPolarHBondContact O-CB 3.48Å; E228-S232 PolarHBondContact O-N 2.86Å
229L63.9Low64.6Low99 Ų9983.4 Ų83.452%0.51846%0.46SS..Hα-helixtrans-58.9-44.5174.4-73.7170.7000111.3V209 S225 V226 G231 S232 E233V209-L229 HydrophobicContact CG1-CD1 4.35Å; S225-L229 WeakPolarHBondContact O-CB 3.2Å; S225-L229 WeakPolarHBondContact O-CG 3.05Å; S225-L229 PolarHBondContact O-N 3.38Å; V226-L229 PolarHBondContact O-N 2.92Å; L229-G231 PolarHBondContact O-N 3.4Å; L229-S232 PolarHBondContact O-N 3.22Å; L229-S232 PolarHBondContact O-OG 3.02Å; L229-E233 PolarHBondContact O-N 2.95Å; L229-E233 VanDerWaalsContact O-N 3.12Å
230L62.1Low64.8Low51 Ų5186.5 Ų86.527%0.26747%0.472SS..Hα-helixtrans-70.7-33-177.7-155.758.2000112.2V226 I227 E228 V235 L237V226-L230 WeakPolarHBondContact O-CB 3.31Å; V226-L230 PolarHBondContact O-N 2.91Å; I227-L230 PolarHBondContact O-N 2.99Å; E228-L230 VanDerWaalsContact C-N 3.31Å; E228-L230 PolarHBondContact O-N 3.14Å; L230-V235 HydrophobicContact CD1-CB 3.63Å; L230-V235 HydrophobicContact CD1-CG1 3.78Å; L230-V235 HydrophobicContact CD1-CG2 3.53Å; L230-V235 HydrophobicContact CG-CB 3.8Å; L230-V235 HydrophobicContact CG-CG1 4.04Å; L230-V235 HydrophobicContact CG-CG2 4.22Å; L230-V235 WeakPolarHBondContact O-CB 3.49Å; L230-V235 PolarHBondContact O-N 3.34Å; L230-L237 HydrophobicContact CD2-CD1 3.87Å; L230-L237 HydrophobicContact CD2-CD2 3.38Å; L230-L237 HydrophobicContact CD2-CG 4.1Å; L230-L237 HydrophobicContact CG-CD1 4.3Å; L230-L237 HydrophobicContact CG-CD2 3.97Å; L230-L237 HydrophobicContact CG-CG 4.4Å
231G64.3Low64.6Low52 Ų5288.6 Ų88.654%0.53648%0.481SS..Hα-helixtrans-67.7-39.3170.100000112.8I227 E228 L229 E233 N234I227-G231 PolarHBondContact O-N 2.69Å; E228-G231 PolarHBondContact O-N 2.86Å; L229-G231 PolarHBondContact O-N 3.4Å; G231-E233 VanDerWaalsContact C-N 3.33Å; G231-E233 PolarHBondContact O-N 3.43Å; G231-N234 PolarHBondContact O-N 3.17Å
232S65.1Low64.5Low89 Ų8988.4 Ų88.462%0.62248%0.478SS*.Hα-helixtrans-67-32.7178.478.20000113E228 L229 N234E228-S232 WeakPolarHBondContact O-CB 3.48Å; E228-S232 PolarHBondContact O-N 2.86Å; L229-S232 PolarHBondContact O-N 3.22Å; L229-S232 PolarHBondContact O-OG 3.02Å; S232-N234 VanDerWaalsContact C-N 3.25Å; S232-N234 PolarHBondContact O-N 2.72Å
233E64Low64.7Low151 Ų15189.8 Ų89.871%0.70650%0.495SS*.THydrogen-bonded Turntrans-86.312.3-178.1-158.8171.9-164.200113.2L229 G231 V235L229-E233 PolarHBondContact O-N 2.95Å; L229-E233 VanDerWaalsContact O-N 3.12Å; G231-E233 VanDerWaalsContact C-N 3.33Å; G231-E233 PolarHBondContact O-N 3.43Å; E233-V235 HydrophobicContact CB-CG2 4.17Å; E233-V235 PolarHBondContact O-N 3.4Å
234N56.8Low64.5Low147 Ų14794.5 Ų94.579%0.78651%0.512SS*.THydrogen-bonded Turntrans54.235.5-177.4-73.9-55.6000113.4G231 S232 K236G231-N234 PolarHBondContact O-N 3.17Å; S232-N234 VanDerWaalsContact C-N 3.25Å; S232-N234 PolarHBondContact O-N 2.72Å; N234-K236 PolarHBondContact O-N 3.19Å
235V60.2Low64.3Low62 Ų6292.1 Ų92.138%0.37650%0.501SS..  trans-77.3119.3176.7-178.70000109.3L230 E233 L237L230-V235 HydrophobicContact CD1-CB 3.63Å; L230-V235 HydrophobicContact CD1-CG1 3.78Å; L230-V235 HydrophobicContact CD1-CG2 3.53Å; L230-V235 HydrophobicContact CG-CB 3.8Å; L230-V235 HydrophobicContact CG-CG1 4.04Å; L230-V235 HydrophobicContact CG-CG2 4.22Å; L230-V235 WeakPolarHBondContact O-CB 3.49Å; L230-V235 PolarHBondContact O-N 3.34Å; E233-V235 HydrophobicContact CB-CG2 4.17Å; E233-V235 PolarHBondContact O-N 3.4Å; V235-L237 HydrophobicContact CG1-CD2 4.09Å; V235-L237 PolarHBondContact O-N 2.73Å
236K63.3Low64.3Low202 Ų20294.4 Ų94.488%0.87851%0.508SS*.  trans-73.396.2174.2-68.8-179.3-179.4177.90109.2N234N234-K236 PolarHBondContact O-N 3.19Å
237L61Low64.3Low62 Ų6297.5 Ų97.533%0.32552%0.52SS..  trans-77.7128.9171.5-58.6171.3000110.2L230 V235 E241 I242L230-L237 HydrophobicContact CD2-CD1 3.87Å; L230-L237 HydrophobicContact CD2-CD2 3.38Å; L230-L237 HydrophobicContact CD2-CG 4.1Å; L230-L237 HydrophobicContact CG-CD1 4.3Å; L230-L237 HydrophobicContact CG-CD2 3.97Å; L230-L237 HydrophobicContact CG-CG 4.4Å; V235-L237 HydrophobicContact CG1-CD2 4.09Å; V235-L237 PolarHBondContact O-N 2.73Å; L237-E241 HydrophobicContact CD2-CB 4.45Å; L237-I242 HydrophobicContact CB-CD1 4.35Å; L237-I242 HydrophobicContact CB-CG1 3.99Å
238S66.2Low64.1Low57 Ų5798.2 Ų98.240%0.39952%0.523SS..  trans-70.9152.4168.968.80000110.3K240 E241 I242S238-K240 PolarHBondContact O-N 2.71Å; S238-E241 VanDerWaalsContact CB-OE2 3.3Å; S238-E241 WeakPolarHBondContact CB-OE2 3.46Å; S238-E241 PolarHBondContact N-OE2 3.5Å; S238-E241 PolarHBondContact O-N 3.27Å; S238-E241 VanDerWaalsContact OG-CD 3.26Å; S238-E241 WeakPolarHBondContact OG-CG 3.27Å; S238-E241 PolarHBondContact OG-N 2.73Å; S238-E241 PolarHBondContact OG-OE2 3.34Å; S238-I242 PolarHBondContact O-N 2.94Å; S238-I242 VanDerWaalsContact O-N 3.16Å
239S71.7Confident63.6Low103 Ų10392.4 Ų92.472%0.7250%0.496SS*.Hα-helixtrans-53.5-28177.4173.70000113.1A243S239-A243 WeakPolarHBondContact O-CB 3.45Å; S239-A243 PolarHBondContact O-N 3.16Å
240K68.8Low63.4Low155 Ų15592 Ų9267%0.67450%0.495SS*.Hα-helixtrans-73.7-35.7177-170.5176.3-177.5176.30113.2S238 R244S238-K240 PolarHBondContact O-N 2.71Å; K240-R244 PolarHBondContact O-N 2.86Å; K240-R244 VanDerWaalsContact O-N 3.11Å
241E61.2Low63.2Low96 Ų9694 Ų9445%0.44951%0.506SS..Hα-helixtrans-69.3-40.7175.5-72.2154.615100110.1L237 S238 R244 V245L237-E241 HydrophobicContact CD2-CB 4.45Å; S238-E241 VanDerWaalsContact CB-OE2 3.3Å; S238-E241 WeakPolarHBondContact CB-OE2 3.46Å; S238-E241 PolarHBondContact N-OE2 3.5Å; S238-E241 PolarHBondContact O-N 3.27Å; S238-E241 VanDerWaalsContact OG-CD 3.26Å; S238-E241 WeakPolarHBondContact OG-CG 3.27Å; S238-E241 PolarHBondContact OG-N 2.73Å; S238-E241 PolarHBondContact OG-OE2 3.34Å; E241-R244 PolarHBondContact O-N 2.84Å; E241-V245 WeakPolarHBondContact O-CG2 3.05Å; E241-V245 PolarHBondContact O-N 3.47Å
242I66Low62.9Low95 Ų9593.4 Ų93.449%0.48749%0.489SS..Hα-helixtrans-61.1-45.8173.4-60.1172.4000110.8L237 S238 R244 V245 L246L237-I242 HydrophobicContact CB-CD1 4.35Å; L237-I242 HydrophobicContact CB-CG1 3.99Å; S238-I242 PolarHBondContact O-N 2.94Å; S238-I242 VanDerWaalsContact O-N 3.16Å; I242-R244 VanDerWaalsContact C-N 3.3Å; I242-R244 PolarHBondContact O-N 2.97Å; I242-V245 PolarHBondContact O-N 3.28Å; I242-L246 PolarHBondContact O-N 3.22Å
243A65.9Low62.2Low56 Ų5694.9 Ų94.946%0.46349%0.486SS..Hα-helixtrans-61.3-36.9178.100000112.9S239 L246 E247S239-A243 WeakPolarHBondContact O-CB 3.45Å; S239-A243 PolarHBondContact O-N 3.16Å; A243-L246 PolarHBondContact O-N 3.34Å; A243-E247 PolarHBondContact O-N 3.47Å
244R62.2Low61.5Low102 Ų10293.1 Ų93.139%0.38548%0.48SS..Hα-helixtrans-68.7-38.7174.6-92.4-168.8-177.3169.3-1.1113.1K240 E241 I242 L246 E247 M248K240-R244 PolarHBondContact O-N 2.86Å; K240-R244 VanDerWaalsContact O-N 3.11Å; E241-R244 PolarHBondContact O-N 2.84Å; I242-R244 VanDerWaalsContact C-N 3.3Å; I242-R244 PolarHBondContact O-N 2.97Å; R244-L246 VanDerWaalsContact C-N 3.27Å; R244-E247 PolarHBondContact O-N 3.01Å; R244-M248 PolarHBondContact O-N 2.74Å
245V62.1Low61.2Low38 Ų3889.2 Ų89.223%0.2347%0.469CS..Hα-helixtrans-63.4-42.6176.2179.30000108.9V223 I227 E241 I242 E247 M248 I249V223-V245 HydrophobicContact CG1-CG1 3.58Å; I227-V245 HydrophobicContact CD1-CG1 3.59Å; I227-V245 HydrophobicContact CG1-CG1 4Å; E241-V245 WeakPolarHBondContact O-CG2 3.05Å; E241-V245 PolarHBondContact O-N 3.47Å; I242-V245 PolarHBondContact O-N 3.28Å; V245-E247 PolarHBondContact O-N 2.92Å; V245-M248 WeakPolarHBondContact O-CB 3.34Å; V245-M248 PolarHBondContact O-N 2.66Å; V245-I249 HydrophobicContact CG1-CD1 4.36Å; V245-I249 VanDerWaalsContact O-CG1 3.31Å; V245-I249 WeakPolarHBondContact O-CG1 3.43Å; V245-I249 PolarHBondContact O-N 2.78Å; V245-I249 VanDerWaalsContact O-N 3.07Å
246L65.6Low60.8Low99 Ų9993.2 Ų93.252%0.51848%0.483SS..Hα-helixtrans-62-41.7174.2-164.567.8000112.7I242 A243 R244 M248 I249 D250I242-L246 PolarHBondContact O-N 3.22Å; A243-L246 PolarHBondContact O-N 3.34Å; R244-L246 VanDerWaalsContact C-N 3.27Å; L246-M248 VanDerWaalsContact C-N 3.28Å; L246-M248 PolarHBondContact O-N 2.89Å; L246-I249 WeakPolarHBondContact O-CB 3.13Å; L246-I249 PolarHBondContact O-N 2.73Å; L246-I249 VanDerWaalsContact O-N 3.16Å; L246-D250 PolarHBondContact O-N 3.17Å
247E64.5Low59.9Low112 Ų11290.9 Ų90.952%0.52348%0.475SS..Hα-helixtrans-61.8-35.3174.4-175.9-176.8-172.700112.4A243 R244 V245 D250 N251A243-E247 PolarHBondContact O-N 3.47Å; R244-E247 PolarHBondContact O-N 3.01Å; V245-E247 PolarHBondContact O-N 2.92Å; E247-D250 PolarHBondContact O-N 3.41Å; E247-N251 WeakPolarHBondContact O-CB 3.42Å; E247-N251 VanDerWaalsContact O-CG 3.26Å; E247-N251 PolarHBondContact O-N 2.91Å; E247-N251 PolarHBondContact O-ND2 3.27Å
248M60.7Low59.1Low82 Ų8294.1 Ų94.140%0.40449%0.492SS..Hα-helixtrans-67.7-37.7175.5-167166.560.700111.6V223 R244 V245 L246 E252V223-M248 HydrophobicContact CB-CE 4.2Å; V223-M248 HydrophobicContact CG1-CE 3.54Å; V223-M248 HydrophobicContact CG2-CE 3.58Å; R244-M248 PolarHBondContact O-N 2.74Å; V245-M248 WeakPolarHBondContact O-CB 3.34Å; V245-M248 PolarHBondContact O-N 2.66Å; L246-M248 VanDerWaalsContact C-N 3.28Å; L246-M248 PolarHBondContact O-N 2.89Å; M248-E252 PolarHBondContact O-N 3.04Å; M248-E252 VanDerWaalsContact O-N 3.17Å
249I60.3Low58Low31 Ų3195.3 Ų95.316%0.15950%0.498CS..Hα-helixtrans-64.7-45.5173.1-63170.9000110.8L220 V223 V245 L246 N251 E252 H253L220-I249 HydrophobicContact CD1-CB 4.03Å; L220-I249 HydrophobicContact CD1-CD1 4.08Å; L220-I249 HydrophobicContact CD1-CG1 3.52Å; L220-I249 HydrophobicContact CD1-CG2 3.63Å; V223-I249 HydrophobicContact CG1-CG1 4.32Å; V245-I249 HydrophobicContact CG1-CD1 4.36Å; V245-I249 VanDerWaalsContact O-CG1 3.31Å; V245-I249 WeakPolarHBondContact O-CG1 3.43Å; V245-I249 PolarHBondContact O-N 2.78Å; V245-I249 VanDerWaalsContact O-N 3.07Å; L246-I249 WeakPolarHBondContact O-CB 3.13Å; L246-I249 PolarHBondContact O-N 2.73Å; L246-I249 VanDerWaalsContact O-N 3.16Å; I249-N251 VanDerWaalsContact C-N 3.33Å; I249-N251 PolarHBondContact O-N 3.02Å; I249-E252 WeakPolarHBondContact O-CB 3.32Å; I249-E252 PolarHBondContact O-N 2.93Å; I249-H253 PolarHBondContact O-N 3.48Å
250D58.9Low57Low90 Ų9095.4 Ų95.448%0.48149%0.494SS..Hα-helixtrans-64.1-38.7179.3-72.1-19.3000111.7L246 E247 E252 H253 L254L246-D250 PolarHBondContact O-N 3.17Å; E247-D250 PolarHBondContact O-N 3.41Å; D250-E252 VanDerWaalsContact C-N 3.31Å; D250-E252 PolarHBondContact O-N 3.27Å; D250-H253 PolarHBondContact O-N 3.13Å; D250-L254 WeakPolarHBondContact O-CG 3.33Å; D250-L254 PolarHBondContact O-N 3.46Å; D250-L254 VanDerWaalsContact O-N 3.13Å
251N59.5Low56.2Low94 Ų9493.9 Ų93.950%0.50349%0.49SS..Hα-helixtrans-66.1-32.9175.7-75.7-29.2000112.7E247 I249 A255E247-N251 WeakPolarHBondContact O-CB 3.42Å; E247-N251 VanDerWaalsContact O-CG 3.26Å; E247-N251 PolarHBondContact O-N 2.91Å; E247-N251 PolarHBondContact O-ND2 3.27Å; I249-N251 VanDerWaalsContact C-N 3.33Å; I249-N251 PolarHBondContact O-N 3.02Å; N251-A255 PolarHBondContact O-N 2.84Å
252E56.6Low55.6Low39 Ų3995.1 Ų95.118%0.18250%0.5CS..Hα-helixtrans-69.9-42.1173-177.6-179.6-171.700111.6E219 L220 M248 I249 D250 L254 A255 E256E219-E252 WeakPolarHBondContact CA-OE1 3.46Å; L220-E252 WeakPolarHBondContact CA-OE2 3.4Å; L220-E252 WeakPolarHBondContact CB-OE1 3.4Å; L220-E252 WeakPolarHBondContact CB-OE2 3.29Å; L220-E252 PolarHBondContact N-OE1 2.88Å; L220-E252 PolarHBondContact N-OE2 3.26Å; M248-E252 PolarHBondContact O-N 3.04Å; M248-E252 VanDerWaalsContact O-N 3.17Å; I249-E252 WeakPolarHBondContact O-CB 3.32Å; I249-E252 PolarHBondContact O-N 2.93Å; D250-E252 VanDerWaalsContact C-N 3.31Å; D250-E252 PolarHBondContact O-N 3.27Å; E252-L254 PolarHBondContact O-N 2.83Å; E252-A255 WeakPolarHBondContact O-CA 3.39Å; E252-A255 WeakPolarHBondContact O-CB 3.5Å; E252-A255 PolarHBondContact O-N 3.49Å; E252-E256 PolarHBondContact O-N 3.04Å
253H50.4Low54.8Low119 Ų11997.5 Ų97.555%0.55151%0.513SS*.Hα-helixtrans-60.1-32.2177.1-133-51.8000112.2I249 D250 A255I249-H253 PolarHBondContact O-N 3.48Å; D250-H253 PolarHBondContact O-N 3.13Å; H253-A255 VanDerWaalsContact C-N 3.35Å
254L50.5Low54.1Low114 Ų114101.6 Ų101.660%0.59752%0.52SS*.Hα-helixtrans-71.9-24.9172.4-70.1168.3000113.4D250 E252D250-L254 WeakPolarHBondContact O-CG 3.33Å; D250-L254 PolarHBondContact O-N 3.46Å; D250-L254 VanDerWaalsContact O-N 3.13Å; E252-L254 PolarHBondContact O-N 2.83Å
255A50.1Low53.5Low65 Ų6599.7 Ų99.754%0.53753%0.526SS..Hα-helixtrans-76.5-27.8178.400000112.4N251 E252 H253 E257N251-A255 PolarHBondContact O-N 2.84Å; E252-A255 WeakPolarHBondContact O-CA 3.39Å; E252-A255 WeakPolarHBondContact O-CB 3.5Å; E252-A255 PolarHBondContact O-N 3.49Å; H253-A255 VanDerWaalsContact C-N 3.35Å; A255-E257 VanDerWaalsContact C-N 3.33Å
256E51.9Low52.7Low146 Ų146102.6 Ų102.668%0.68254%0.54SS*.Hα-helixtrans-73.7-20.5175.9-68.8-165.8162.200113.6E252 I258E252-E256 PolarHBondContact O-N 3.04Å; E256-I258 PolarHBondContact O-N 3.13Å; E256-I258 VanDerWaalsContact O-N 3.14Å
257E44.8Very low52Low153 Ų153105.7 Ų105.772%0.71555%0.549SS*.THydrogen-bonded Turntrans-77.210.2-178.5-92.6-166.8177.800114.9A255 P259A255-E257 VanDerWaalsContact C-N 3.33Å; E257-P259 WeakPolarHBondContact O-CD 3.49Å
258I43Very low51.4Low131 Ų131106.4 Ų106.467%0.67256%0.557SS**SBendtrans-76.6104.5169.4-53.4178.5000108E256 T260E256-I258 PolarHBondContact O-N 3.13Å; E256-I258 VanDerWaalsContact O-N 3.14Å; I258-T260 PolarHBondContact O-N 2.88Å; I258-T260 VanDerWaalsContact O-N 3.16Å
259P42.9Very low50.8Low81 Ų81111.4 Ų111.453%0.52657%0.571SS.*  trans-69121-175.6-9.428000108E257 E261 D262E257-P259 WeakPolarHBondContact O-CD 3.49Å; P259-E261 PolarHBondContact O-N 2.8Å; P259-D262 PolarHBondContact O-N 3.24Å
260T52.2Low50.4Low105 Ų105116.4 Ų116.464%0.64460%0.597SS**THydrogen-bonded Turntrans-61.41.2178.750.60000114.6I258I258-T260 PolarHBondContact O-N 2.88Å; I258-T260 VanDerWaalsContact O-N 3.16Å
261E52Low50Low123 Ų123119.8 Ų119.858%0.57561%0.608SS**THydrogen-bonded Turntrans-74.8-29.1174.7-73.2-73.7106.200112.6P259 L263 K264P259-E261 PolarHBondContact O-N 2.8Å; E261-L263 PolarHBondContact O-N 2.96Å; E261-K264 PolarHBondContact O-N 2.85Å; E261-K264 VanDerWaalsContact O-N 3.17Å; E261-K264 IonicContact OE1-NZ 3.18Å; E261-K264 PolarHBondContact OE1-NZ 2.87Å
262D47.3Very low49.6Very low123 Ų123119.4 Ų119.466%0.65861%0.613SS**Hα-helixtrans-70.9-19.3178.2-75.2-25.3000112.9P259 K264P259-D262 PolarHBondContact O-N 3.24Å; D262-K264 VanDerWaalsContact C-N 3.33Å; D262-K264 PolarHBondContact O-N 3.47Å
263L50Low49.1Very low145 Ų145122 Ų12276%0.75964%0.635SS**Hα-helixtrans-78.4-13.5174.9-72.1171000113.7E261E261-L263 PolarHBondContact O-N 2.96Å
264K51.3Low49.2Very low142 Ų142122.1 Ų122.162%0.61764%0.644SS**Hα-helixtrans-89.9-24175.7-69179-165.3150.70113.1E261 D262 D266E261-K264 PolarHBondContact O-N 2.85Å; E261-K264 VanDerWaalsContact O-N 3.17Å; E261-K264 IonicContact OE1-NZ 3.18Å; E261-K264 PolarHBondContact OE1-NZ 2.87Å; D262-K264 VanDerWaalsContact C-N 3.33Å; D262-K264 PolarHBondContact O-N 3.47Å; K264-D266 PolarHBondContact O-N 3.42Å
265A49.8Very low49.2Very low61 Ų61123.6 Ų123.650%0.50465%0.652SS.*Hα-helixtrans-67.3-36.8-178.900000112.6K267 N268A265-K267 VanDerWaalsContact C-N 3.34Å; A265-K267 PolarHBondContact O-N 3.41Å; A265-N268 PolarHBondContact O-N 3.42Å
266D45.4Very low49.2Very low100 Ų100129 Ų12954%0.53567%0.666SS.*Hα-helixtrans-76.4-19.1-177.2-96.3-17.8000114.3K264 N268K264-D266 PolarHBondContact O-N 3.42Å; D266-N268 VanDerWaalsContact C-N 3.29Å; D266-N268 PolarHBondContact O-N 3.5Å
267K49.8Very low48.7Very low163 Ų163127.1 Ų127.171%0.70967%0.669SS**Hα-helixtrans-74.1-21.6176.3-151.2169.8-172.4168.80112.8A265A265-K267 VanDerWaalsContact C-N 3.34Å; A265-K267 PolarHBondContact O-N 3.41Å
268N51.5Low48.6Very low127 Ų127128.9 Ų128.968%0.67968%0.677SS**Hα-helixtrans-92.2-25-179.8-124.133.6000113.9A265 D266 L270A265-N268 PolarHBondContact O-N 3.42Å; D266-N268 VanDerWaalsContact C-N 3.29Å; D266-N268 PolarHBondContact O-N 3.5Å; N268-L270 VanDerWaalsContact C-N 3.33Å
269R48.3Very low48.6Very low188 Ų188129.3 Ų129.371%0.70969%0.685SS**Hα-helixtrans-71.4-26.9174.3-79.8179.773.2-150.76.1113.3
270L51.6Low48.7Very low135 Ų135132.1 Ų132.171%0.70770%0.702SS**Hα-helixtrans-83-18179.4-72.4165000113.8N268N268-L270 VanDerWaalsContact C-N 3.33Å
271K51.4Low48Very low162 Ų162133 Ų13370%0.70471%0.712SS**Hα-helixtrans-82.3-29.3175-80.7-170.4176.7-175.50113.9
272S51.2Low47.6Very low86 Ų86140.8 Ų140.860%0.60174%0.744SS**Hα-helixtrans-80-16.7-179.961.10000114.1V274S272-V274 PolarHBondContact O-N 3.49Å
273S46.7Very low47.6Very low92 Ų92141.7 Ų141.764%0.64375%0.748SS**THydrogen-bonded Turntrans-82-8.1-179-164.30000114.6
274V51.5Low47.5Very low122 Ų122141.5 Ų141.574%0.73975%0.748SS**SBendtrans-90.8-17.6179.41780000112.5S272S272-V274 PolarHBondContact O-N 3.49Å
275D51Low47.2Very low146 Ų146141.4 Ų141.478%0.78176%0.755SS**THydrogen-bonded Turntrans-98.216.4-170.4-130.3-3.3000114.8
276H49Very low47.1Very low177 Ų177146.2 Ų146.282%0.81977%0.77SS**THydrogen-bonded Turntrans-124.414.7-177.7-111.152.5000116.1
277S42.5Very low47.2Very low107 Ų107149.1 Ų149.175%0.74878%0.784SS**SBendtrans-119.618.2-178.4-57.20000115.7
278Q42.3Very low47Very low190 Ų190148.1 Ų148.189%0.88879%0.789SS**SBendtrans-127.742.9176.2-69.6-141.656.900114.9
279V42.9Very low46.7Very low140 Ų140149.6 Ų149.685%0.84880%0.797SS**SBendtrans-150.268.3163.8-167.50000111.7
280T45.2Very low46.6Very low141 Ų141146.7 Ų146.787%0.86580%0.804SS**  trans-158.367.9155.647.60000110.5
281S37.5Very low46.2Very low124 Ų124147.7 Ų147.787%0.86781%0.812SS**  trans-147.478159.9-85.30000108.9
282K42.8Very low45.7Very low285 Ų285146.4 Ų146.4100%1.23982%0.822SS**  trans-164.80152.5-116.2176.2-178.8179.50109.5

Retrieved 282 of 282 residues in 172.7 ms (Link to these results)