A0A096M8D8_POEFO Loading...

Epithelial stromal interaction 1

AlphaFold DB , UniProt , Accession A0A096M8D8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 342 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M46.4Very low44.4Very low238 Ų238166.2 Ų166.2100%1.17287%0.874SS**  085.90-77.7-65.7-175.900106.2
2D43.8Very low43.9Very low161 Ų161159 Ų15986%0.86187%0.87SS**  trans-105.5139.2178.3-73.9-57.2000109.6
3P53.3Low43.2Very low118 Ų118165 Ų16577%0.76687%0.872SS**PPolyproline II helixtrans-85.4143-176.133.4-32000112.2
4Q49.6Very low42.7Very low191 Ų191165.1 Ų165.189%0.89387%0.873SS**PPolyproline II helixtrans-67.1147.2175.8-71-145.5-70.600113.2
5P50.4Low42.3Very low123 Ų123168.8 Ų168.880%0.79987%0.872SS**PPolyproline II helixtrans-90.5137.2163.232.2-28.7000113
6N41.7Very low42.5Very low157 Ų157165.2 Ų165.284%0.8486%0.863SS**PPolyproline II helixtrans-61.1138.1-176.5-132.4-17.5000113.8
7Q43.8Very low42.3Very low195 Ų195162.1 Ų162.191%0.91186%0.858SS**PPolyproline II helixtrans-81.4122.4170.4-71.9-172.650.300110.3
8V47.4Very low42Very low129 Ų129163.1 Ų163.178%0.78286%0.857SS**  trans-107.2118.7170.2178.70000109.4S10V8-S10 PolarHBondContact O-N 2.77Å
9N37.4Very low41.6Very low153 Ų153160.8 Ų160.882%0.81886%0.856SS**  trans-51.3125.9174.5-92.8-31.9000112.8
10S38.4Very low41.2Very low124 Ų124157.9 Ų157.987%0.86786%0.856SS**  trans-93.996.9167.6-60.40000109.5V8V8-S10 PolarHBondContact O-N 2.77Å
11R36.1Very low40.9Very low239 Ų239155.4 Ų155.490%0.90286%0.856SS**  trans-78.3146.2166.1-81-177.6172.8179.3-2.2109.8
12G38.4Very low40.2Very low80 Ų80147.9 Ų147.983%0.82584%0.84SS**  trans-60.4151.5-158.800000116.7
13R35.3Very low39.6Very low237 Ų237145.3 Ų145.389%0.89484%0.841SS**  trans-110.8115.1161.3-80.9-172-171.2-137.81.7109
14N35.6Very low38.8Very low166 Ų166145.8 Ų145.889%0.88885%0.847SS**PPolyproline II helixtrans-66.3137.2161.4-76.9-32.9000109.3
15Y37Very low37.9Very low221 Ų221140 Ų14087%0.86784%0.84SS**PPolyproline II helixtrans-95.2134.6163.3-74.1-86.3000109.1
16P46.1Very low37.1Very low111 Ų111143.3 Ų143.372%0.72184%0.844SS**PPolyproline II helixtrans-85.4127.8164.430.9-25.4000110.2
17S38.1Very low36.6Very low112 Ų112143.1 Ų143.178%0.78384%0.838SS**PPolyproline II helixtrans-68.1128.6163.9172.70000109.5
18Q37.7Very low36.3Very low181 Ų181139.6 Ų139.685%0.84683%0.832SS**  trans-132.9114.2160.2-74.1-168.851.500109.6
19S34.5Very low35.8Very low120 Ų120141.5 Ų141.584%0.83983%0.833SS**  trans-63133.3157-73.40000110
20A33.6Very low35.6Very low102 Ų102138.6 Ų138.684%0.84383%0.83SS**  trans-144.2128.1152.900000109.3
21A34.3Very low35.4Very low105 Ų105143.7 Ų143.787%0.86883%0.83SS**  trans-79.1148.2-17900000111.9
22G30.9Very low35.5Very low81 Ų81140.9 Ų140.984%0.83583%0.827SS**  trans65.1103.313700000119.5
23A32.3Very low35.4Very low106 Ų106144.5 Ų144.588%0.87682%0.824SS**  trans-157.3117.9136.900000109.8
24S35.6Very low35.4Very low128 Ų128139.8 Ų139.890%0.89582%0.817SS**  trans-68.1148.5176.342.50000113.2
25G30.4Very low35.7Very low71 Ų71135 Ų13573%0.73281%0.806SS**  trans174.684.4167.200000115
26E33.9Very low35.5Very low191 Ų191133.4 Ų133.489%0.89381%0.807SS**  trans69.899144.7-58.4-175.6161.100120.5
27E32.3Very low34.8Very low153 Ų153134.6 Ų134.672%0.71581%0.812SS**  trans-68.4143.9153.7-174.4-172.3165.900111.1Q29E27-Q29 HydrophobicContact CG-CG 4.47Å; E27-Q29 WeakPolarHBondContact OE1-CG 3.45Å
28P38Very low34.8Very low122 Ų122134.4 Ų134.479%0.79281%0.808SS**  trans-114.8117.3142.419.9-3.9000110.1A30P28-A30 PolarHBondContact O-N 3.38Å
29Q35.7Very low35Very low169 Ų169130.5 Ų130.579%0.7981%0.807SS**  trans-55.7127.1166.8-74.7-178-14.100110.7E27E27-Q29 HydrophobicContact CG-CG 4.47Å; E27-Q29 WeakPolarHBondContact OE1-CG 3.45Å
30A33.5Very low35.2Very low91 Ų91131.1 Ų131.175%0.75281%0.805SS**  trans-14396158.100000110.7P28P28-A30 PolarHBondContact O-N 3.38Å
31R33.4Very low35.4Very low232 Ų232128.9 Ų128.988%0.87579%0.792SS**  trans57.2107.5137.9-54.8-154.9176.4-157.5-0.1118.1M33R31-M33 PolarHBondContact O-N 3.44Å
32H38.7Very low36Very low179 Ų179135.3 Ų135.383%0.82979%0.794SS**  trans-46.6116.9148.4-136.8-83.6000110.2
33M37.4Very low37Very low157 Ų157139.7 Ų139.777%0.77379%0.793SS**  trans-137.2144.6161.7-88.9-71.3131.900107.6R31R31-M33 PolarHBondContact O-N 3.44Å
34D33.5Very low37.8Very low138 Ų138140.1 Ų140.174%0.73879%0.787SS**  trans-69.6153.8-155.7-62.9-67.8000115.8Q36D34-Q36 PolarHBondContact O-N 2.9Å
35G42.1Very low38.6Very low65 Ų65136.7 Ų136.767%0.6777%0.766SS**  trans15.5100.8147.900000118.3
36Q32.8Very low39.7Very low188 Ų188137.3 Ų137.388%0.87976%0.764SS**  trans-168.696131.5-106.2153.884.100108.9D34 P38D34-Q36 PolarHBondContact O-N 2.9Å; Q36-P38 VanDerWaalsContact O-CD 3.25Å; Q36-P38 WeakPolarHBondContact O-CD 3.3Å
37T33Very low41Very low135 Ų135135.5 Ų135.583%0.82876%0.761SS**  trans-56.3116.7150.818.90000107.1A39T37-A39 PolarHBondContact O-N 3.49Å
38P37.7Very low42.5Very low109 Ų109131.9 Ų131.971%0.70874%0.74SS**  trans-65.6112.3159.427.5-26.9000104.3Q36 V40Q36-P38 VanDerWaalsContact O-CD 3.25Å; Q36-P38 WeakPolarHBondContact O-CD 3.3Å; P38-V40 PolarHBondContact O-N 3.18Å
39A41.4Very low44.1Very low98 Ų98133.4 Ų133.481%0.8174%0.737SS**  trans-55.586.7163.700000107.2T37 G41T37-A39 PolarHBondContact O-N 3.49Å; A39-G41 PolarHBondContact O-N 2.85Å
40V38Very low46.1Very low134 Ų134127.6 Ų127.681%0.81271%0.714SS**  trans-68.895.1165.8177.30000104P38 R42P38-V40 PolarHBondContact O-N 3.18Å; V40-R42 PolarHBondContact O-N 2.9Å
41G38.4Very low48.2Very low55 Ų55129.8 Ų129.857%0.56771%0.708SS**  trans-43.7114.7-179.700000109.2A39 Q43A39-G41 PolarHBondContact O-N 2.85Å; G41-Q43 PolarHBondContact O-N 3.25Å
42R47.3Very low50.4Low239 Ų239127 Ų12790%0.90270%0.699SS**  trans-56.692156.3-178-175.4-130-139.53.6105.3V40 P44V40-R42 PolarHBondContact O-N 2.9Å; R42-P44 WeakPolarHBondContact O-CD 3.3Å; R42-P44 VanDerWaalsContact O-N 3.08Å
43Q51.6Low52.3Low173 Ų173120.8 Ų120.881%0.80868%0.676SS**  trans-60.4116.8169-73.7-158.9-34.600106G41 A45G41-Q43 PolarHBondContact O-N 3.25Å; Q43-A45 PolarHBondContact O-N 2.89Å; Q43-A45 VanDerWaalsContact O-N 3.09Å
44P48.8Very low54.4Low116 Ų116117.5 Ų117.575%0.75368%0.682SS**  trans-62.5118.2172.325.9-29.3000105.8R42 A46R42-P44 WeakPolarHBondContact O-CD 3.3Å; R42-P44 VanDerWaalsContact O-N 3.08Å; P44-A46 PolarHBondContact O-N 3.29Å
45A53.1Low56.9Low55 Ų55116 Ų11646%0.45569%0.689SS.*  trans-62.5107.9166.600000105.7Q43 D47Q43-A45 PolarHBondContact O-N 2.89Å; Q43-A45 VanDerWaalsContact O-N 3.09Å; A45-D47 PolarHBondContact O-N 3.39Å
46A53.8Low58.9Low85 Ų85119.1 Ų119.170%0.70268%0.684SS**THydrogen-bonded Turntrans-47.5128.3173.600000109.1P44P44-A46 PolarHBondContact O-N 3.29Å
47D59.6Low61.5Low152 Ų152113.4 Ų113.481%0.81366%0.663SS**THydrogen-bonded Turntrans60.352165.7-53-30.7000118A45A45-D47 PolarHBondContact O-N 3.39Å
48R65.1Low64Low77 Ų77110 Ų11029%0.29164%0.641SS.*  trans-102.767162.6-72-129.9179.784.120.6112.4P60 N62R48-P60 WeakPolarHBondContact CD-O 3.44Å; R48-P60 PolarHBondContact NE-O 3.29Å; R48-P60 VanDerWaalsContact NE-O 3.16Å; R48-N62 PolarHBondContact NH1-ND2 2.88Å; R48-N62 PolarHBondContact NH2-OD1 3.13Å
49Q71.1Confident66.2Low155 Ų155110.6 Ų110.672%0.72464%0.637SS**  trans-72.3126.8169-65.3-62-26.100109.1Q51Q49-Q51 PolarHBondContact O-N 3.35Å
50P77.3Confident68Low46 Ų46108.5 Ų108.530%0.29962%0.616SS.*  trans-60.5129.3172.4-15.527.5000109.7Y52 T57P50-Y52 HydrophobicContact CB-CE2 3.99Å; P50-Y52 WeakPolarHBondContact O-CD2 3.33Å; P50-T57 HydrophobicContact CB-CG2 3.44Å; P50-T57 VanDerWaalsContact CB-CG2 3.44Å
51Q77.8Confident69.9Low137 Ų137106.4 Ų106.464%0.6460%0.604SS**EExtended strand (participates in β ladder)trans-91.4115.2175.5-169173.94.200108.7Q49 V58Q49-Q51 PolarHBondContact O-N 3.35Å; Q51-V58 HydrophobicContact CB-CB 4.5Å; Q51-V58 PolarHBondContact N-O 2.97Å; Q51-V58 PolarHBondContact O-N 2.86Å
52Y79.1Confident72.1Confident174 Ų174105.6 Ų105.668%0.68259%0.587SS**EExtended strand (participates in β ladder)trans-89.3117.1-179-67-85.5000110.3P50 T57P50-Y52 HydrophobicContact CB-CE2 3.99Å; P50-Y52 WeakPolarHBondContact O-CD2 3.33Å; Y52-T57 HydrophobicContact CD1-CG2 3.95Å; Y52-T57 VanDerWaalsContact CD1-OG1 3.27Å; Y52-T57 WeakPolarHBondContact CD1-OG1 3.45Å; Y52-T57 HydrophobicContact CE1-CG2 3.73Å; Y52-T57 WeakPolarHBondContact CE1-OG1 3.45Å
53S79.8Confident73.9Confident49 Ų4999.8 Ų99.834%0.34357%0.57SS.*EExtended strand (participates in β ladder)trans-115.269.2175.2490000109.6A55 F56S53-A55 PolarHBondContact O-N 3.27Å; S53-F56 PolarHBondContact N-O 3.06Å; S53-F56 PolarHBondContact O-N 3.49Å; S53-F56 WeakPolarHBondContact OG-CD2 3.38Å; S53-F56 WeakPolarHBondContact OG-CE2 3.48Å; S53-F56 WeakPolarHBondContact OG-CZ 3.3Å; S53-F56 PolarHBondContact OG-O 3.13Å
54G81.6Confident75.7Confident88 Ų8895.6 Ų95.691%0.90756%0.557SS**THydrogen-bonded Turntrans63.3-82.7173.300000114.6
55A85.7Confident77.5Confident106 Ų10698.6 Ų98.688%0.87655%0.553SS**THydrogen-bonded Turntrans-90.4-11.4-175.800000114.2S53S53-A55 PolarHBondContact O-N 3.27Å
56F83.8Confident79.2Confident130 Ų130102.2 Ų102.257%0.5756%0.555SS**EExtended strand (participates in β ladder)trans-145.3156.9178.962-81.5000112.4S53 V58S53-F56 PolarHBondContact N-O 3.06Å; S53-F56 PolarHBondContact O-N 3.49Å; S53-F56 WeakPolarHBondContact OG-CD2 3.38Å; S53-F56 WeakPolarHBondContact OG-CE2 3.48Å; S53-F56 WeakPolarHBondContact OG-CZ 3.3Å; S53-F56 PolarHBondContact OG-O 3.13Å; F56-V58 HydrophobicContact CD2-CG2 3.56Å; F56-V58 HydrophobicContact CE2-CG2 3.31Å; F56-V58 HydrophobicContact CZ-CG2 4.49Å
57T87.4Confident81.1Confident69 Ų69101 Ų10142%0.42354%0.542SS..EExtended strand (participates in β ladder)trans-105.7122.1176-52.60000109.4P50 Y52 I59P50-T57 HydrophobicContact CB-CG2 3.44Å; P50-T57 VanDerWaalsContact CB-CG2 3.44Å; Y52-T57 HydrophobicContact CD1-CG2 3.95Å; Y52-T57 VanDerWaalsContact CD1-OG1 3.27Å; Y52-T57 WeakPolarHBondContact CD1-OG1 3.45Å; Y52-T57 HydrophobicContact CE1-CG2 3.73Å; Y52-T57 WeakPolarHBondContact CE1-OG1 3.45Å; T57-I59 HydrophobicContact CG2-CG1 4.47Å
58V85.6Confident82.7Confident62 Ų6299.9 Ų99.938%0.37653%0.529SS..EExtended strand (participates in β ladder)trans-95.3117.6176-177.10000108.9Q51 F56Q51-V58 HydrophobicContact CB-CB 4.5Å; Q51-V58 PolarHBondContact N-O 2.97Å; Q51-V58 PolarHBondContact O-N 2.86Å; F56-V58 HydrophobicContact CD2-CG2 3.56Å; F56-V58 HydrophobicContact CE2-CG2 3.31Å; F56-V58 HydrophobicContact CZ-CG2 4.49Å
59I83.1Confident84.1Confident122 Ų122101.3 Ų101.363%0.62654%0.543SS*.  trans-101.5115.1173.8-58.9174.4000108.2T57T57-I59 HydrophobicContact CG2-CG1 4.47Å
60P80.5Confident85.2Confident55 Ų5599.4 Ų99.436%0.35753%0.532SS..  trans-61.6139.9-179.1-25.534.9000112.6R48 N62R48-P60 WeakPolarHBondContact CD-O 3.44Å; R48-P60 PolarHBondContact NE-O 3.29Å; R48-P60 VanDerWaalsContact NE-O 3.16Å; P60-N62 PolarHBondContact O-N 2.84Å
61P77.1Confident86.1Confident89 Ų89101.5 Ų101.558%0.57854%0.538SS*.  trans-63.4120.8-178.123.3-31.8000111.6Q63P61-Q63 VanDerWaalsContact C-N 3.27Å; P61-Q63 PolarHBondContact O-N 3.45Å
62N85.3Confident87Confident38 Ų38100 Ų10020%0.20353%0.532CS..  36.423116.8-117.4-7.2000122.5R48 P60 T64 R65 R66R48-N62 PolarHBondContact NH1-ND2 2.88Å; R48-N62 PolarHBondContact NH2-OD1 3.13Å; P60-N62 PolarHBondContact O-N 2.84Å; N62-T64 VanDerWaalsContact C-N 3.33Å; N62-T64 PolarHBondContact O-N 2.98Å; N62-T64 VanDerWaalsContact O-N 3.17Å; N62-T64 PolarHBondContact OD1-N 3.49Å; N62-T64 VanDerWaalsContact OD1-N 3.11Å; N62-R65 HydrophobicContact CB-CB 3.69Å; N62-R65 CarbonylContact O-C 3.56Å; N62-R65 PolarHBondContact O-N 2.89Å; N62-R65 PolarHBondContact OD1-N 3.15Å; N62-R66 VanDerWaalsContact O-CB 3.22Å; N62-R66 WeakPolarHBondContact O-CB 3.45Å; N62-R66 PolarHBondContact O-N 2.92Å
63Q84.7Confident87.8Confident118 Ų11893.6 Ų93.655%0.55152%0.516SS*.Hα-helixtrans-54.3-42.7-167.8-64.8-67.327.300114.6P61 R66 S67P61-Q63 VanDerWaalsContact C-N 3.27Å; P61-Q63 PolarHBondContact O-N 3.45Å; Q63-R66 PolarHBondContact O-N 3.32Å; Q63-S67 WeakPolarHBondContact O-CB 3.42Å; Q63-S67 PolarHBondContact O-N 2.95Å; Q63-S67 PolarHBondContact O-OG 3.44Å
64T88.7Confident88.6Confident85 Ų8597 Ų9752%0.52153%0.526SS..Hα-helixtrans-67.4-40.9174.9-46.20000112.3N62 S67 K68N62-T64 VanDerWaalsContact C-N 3.33Å; N62-T64 PolarHBondContact O-N 2.98Å; N62-T64 VanDerWaalsContact O-N 3.17Å; N62-T64 PolarHBondContact OD1-N 3.49Å; N62-T64 VanDerWaalsContact OD1-N 3.11Å; T64-S67 WeakPolarHBondContact CA-OG 3.44Å; T64-S67 PolarHBondContact O-OG 3.49Å; T64-K68 HydrophobicContact CG2-CD 4.41Å; T64-K68 WeakPolarHBondContact O-CB 3.45Å; T64-K68 WeakPolarHBondContact O-CG 3.41Å; T64-K68 PolarHBondContact O-N 3.15Å; T64-K68 VanDerWaalsContact O-N 3.09Å
65R88.2Confident89.4Confident179 Ų17999.5 Ų99.568%0.67551%0.508SS*.Hα-helixtrans-70.3-34.2176.5-167.7176.671.3-174.13.5111.9N62 N69N62-R65 HydrophobicContact CB-CB 3.69Å; N62-R65 CarbonylContact O-C 3.56Å; N62-R65 PolarHBondContact O-N 2.89Å; N62-R65 PolarHBondContact OD1-N 3.15Å; R65-N69 VanDerWaalsContact O-CB 3.25Å; R65-N69 WeakPolarHBondContact O-CB 3.42Å; R65-N69 PolarHBondContact O-N 3.06Å
66R88.8Confident89.9Confident130 Ų13099.8 Ų99.849%0.49149%0.491SS..Hα-helixtrans-72.2-44.1-179.7-173.4-178.5-173.5-149.34.4110.7N62 Q63 N69 K70N62-R66 VanDerWaalsContact O-CB 3.22Å; N62-R66 WeakPolarHBondContact O-CB 3.45Å; N62-R66 PolarHBondContact O-N 2.92Å; Q63-R66 PolarHBondContact O-N 3.32Å; R66-N69 PolarHBondContact O-N 2.89Å; R66-K70 WeakPolarHBondContact O-CB 3.21Å; R66-K70 VanDerWaalsContact O-CG 3.31Å; R66-K70 WeakPolarHBondContact O-CG 3.49Å; R66-K70 PolarHBondContact O-N 3.27Å
67S92.1Very high90.5Very high61 Ų6197.2 Ų97.243%0.42749%0.486SS..Hα-helixtrans-61.4-49.117245.70000110.8Q63 T64 N69 K70 E71Q63-S67 WeakPolarHBondContact O-CB 3.42Å; Q63-S67 PolarHBondContact O-N 2.95Å; Q63-S67 PolarHBondContact O-OG 3.44Å; T64-S67 WeakPolarHBondContact CA-OG 3.44Å; T64-S67 PolarHBondContact O-OG 3.49Å; S67-N69 VanDerWaalsContact C-N 3.32Å; S67-N69 PolarHBondContact O-N 2.72Å; S67-K70 PolarHBondContact O-N 2.88Å; S67-E71 WeakPolarHBondContact O-CB 3.28Å; S67-E71 PolarHBondContact O-N 3.4Å
68K94.8Very high90.9Very high127 Ų12798.7 Ų98.755%0.55249%0.488SS*.Hα-helixtrans-55.1-43.5174.2-74.6175.4179.5-173.50113.3T64 E71 M72T64-K68 HydrophobicContact CG2-CD 4.41Å; T64-K68 WeakPolarHBondContact O-CB 3.45Å; T64-K68 WeakPolarHBondContact O-CG 3.41Å; T64-K68 PolarHBondContact O-N 3.15Å; T64-K68 VanDerWaalsContact O-N 3.09Å; K68-E71 PolarHBondContact O-N 3.5Å; K68-M72 VanDerWaalsContact O-CB 3.28Å; K68-M72 WeakPolarHBondContact O-CB 3.36Å; K68-M72 PolarHBondContact O-N 2.85Å
69N94.3Very high91.5Very high108 Ų108101.8 Ų101.858%0.57850%0.499SS*.Hα-helixtrans-69.4-40.5179-171.1-59.2000111.7R65 R66 S67 E71 M72 A73R65-N69 VanDerWaalsContact O-CB 3.25Å; R65-N69 WeakPolarHBondContact O-CB 3.42Å; R65-N69 PolarHBondContact O-N 3.06Å; R66-N69 PolarHBondContact O-N 2.89Å; S67-N69 VanDerWaalsContact C-N 3.32Å; S67-N69 PolarHBondContact O-N 2.72Å; N69-E71 PolarHBondContact O-N 3.24Å; N69-M72 PolarHBondContact O-N 2.91Å; N69-A73 WeakPolarHBondContact O-CB 3.4Å; N69-A73 PolarHBondContact O-N 3.26Å
70K94.3Very high92.1Very high114 Ų114100.5 Ų100.550%0.49649%0.493SS..Hα-helixtrans-61.7-43.8173.6-76.7179.9174-166.90112.2R66 S67 A73 Q74R66-K70 WeakPolarHBondContact O-CB 3.21Å; R66-K70 VanDerWaalsContact O-CG 3.31Å; R66-K70 WeakPolarHBondContact O-CG 3.49Å; R66-K70 PolarHBondContact O-N 3.27Å; S67-K70 PolarHBondContact O-N 2.88Å; K70-A73 PolarHBondContact O-N 2.88Å; K70-Q74 WeakPolarHBondContact O-CB 3.41Å; K70-Q74 VanDerWaalsContact O-CG 3.31Å; K70-Q74 WeakPolarHBondContact O-CG 3.24Å; K70-Q74 PolarHBondContact O-N 2.92Å
71E96.5Very high92.8Very high91 Ų91103.3 Ų103.343%0.42550%0.501SS..Hα-helixtrans-64.6-44.1178-172.1-177.2-179.800110.8S67 K68 N69 Q74 R75S67-E71 WeakPolarHBondContact O-CB 3.28Å; S67-E71 PolarHBondContact O-N 3.4Å; K68-E71 PolarHBondContact O-N 3.5Å; N69-E71 PolarHBondContact O-N 3.24Å; E71-Q74 PolarHBondContact O-N 2.95Å; E71-R75 WeakPolarHBondContact O-CG 3.47Å; E71-R75 PolarHBondContact O-N 3.42Å; E71-R75 IonicContact OE1-CZ 3.86Å; E71-R75 IonicContact OE1-NE 2.69Å; E71-R75 IonicContact OE1-NH2 3.09Å; E71-R75 PolarHBondContact OE1-NH2 3.39Å; E71-R75 IonicContact OE2-NH2 3.45Å
72M95.7Very high93.7Very high104 Ų104106.4 Ų106.451%0.51250%0.501SS..Hα-helixtrans-60.3-46.9173.9-174.7176.8-70.600111.6K68 N69 Q74 R75 E76K68-M72 VanDerWaalsContact O-CB 3.28Å; K68-M72 WeakPolarHBondContact O-CB 3.36Å; K68-M72 PolarHBondContact O-N 2.85Å; N69-M72 PolarHBondContact O-N 2.91Å; M72-Q74 VanDerWaalsContact C-N 3.3Å; M72-Q74 PolarHBondContact O-N 3.39Å; M72-R75 PolarHBondContact O-N 2.98Å; M72-E76 HydrophobicContact CG-CG 4.48Å; M72-E76 WeakPolarHBondContact CG-OE1 3.27Å; M72-E76 WeakPolarHBondContact O-CB 3.27Å; M72-E76 WeakPolarHBondContact O-CG 3.37Å; M72-E76 PolarHBondContact O-N 2.85Å
73A96.3Very high94.2Very high41 Ų41111.4 Ų111.434%0.33952%0.518SS..Hα-helixtrans-59.7-40.6176.500000112N69 K70 T77N69-A73 WeakPolarHBondContact O-CB 3.4Å; N69-A73 PolarHBondContact O-N 3.26Å; K70-A73 PolarHBondContact O-N 2.88Å; A73-T77 VanDerWaalsContact O-CG2 3.24Å; A73-T77 WeakPolarHBondContact O-CG2 3.47Å; A73-T77 PolarHBondContact O-N 2.81Å; A73-T77 PolarHBondContact O-OG1 3.29Å
74Q96.9Very high94.7Very high119 Ų119112.1 Ų112.156%0.55652%0.519SS*.Hα-helixtrans-63.2-50.1174.7-76173.9-1800111.4K70 E71 M72 E76 T77 E78K70-Q74 WeakPolarHBondContact O-CB 3.41Å; K70-Q74 VanDerWaalsContact O-CG 3.31Å; K70-Q74 WeakPolarHBondContact O-CG 3.24Å; K70-Q74 PolarHBondContact O-N 2.92Å; E71-Q74 PolarHBondContact O-N 2.95Å; M72-Q74 VanDerWaalsContact C-N 3.3Å; M72-Q74 PolarHBondContact O-N 3.39Å; Q74-E76 VanDerWaalsContact C-N 3.31Å; Q74-E76 PolarHBondContact O-N 3.39Å; Q74-T77 WeakPolarHBondContact CA-OG1 3.46Å; Q74-T77 PolarHBondContact O-N 3.19Å; Q74-T77 VanDerWaalsContact O-N 3.11Å; Q74-T77 PolarHBondContact O-OG1 2.88Å; Q74-E78 WeakPolarHBondContact O-CG 3.2Å; Q74-E78 PolarHBondContact O-N 3.05Å
75R97.3Very high94.8Very high141 Ų141114.1 Ų114.153%0.53252%0.523SS..Hα-helixtrans-57.4-44.3177-69.6-178.6-156.2167.11112E71 M72 E78 E79E71-R75 WeakPolarHBondContact O-CG 3.47Å; E71-R75 PolarHBondContact O-N 3.42Å; E71-R75 IonicContact OE1-CZ 3.86Å; E71-R75 IonicContact OE1-NE 2.69Å; E71-R75 IonicContact OE1-NH2 3.09Å; E71-R75 PolarHBondContact OE1-NH2 3.39Å; E71-R75 IonicContact OE2-NH2 3.45Å; M72-R75 PolarHBondContact O-N 2.98Å; R75-E78 PolarHBondContact O-N 3.31Å; R75-E79 VanDerWaalsContact O-CB 3.31Å; R75-E79 WeakPolarHBondContact O-CB 3.42Å; R75-E79 PolarHBondContact O-N 3.37Å
76E96.7Very high95.1Very high113 Ų113109.5 Ų109.553%0.52852%0.523SS..Hα-helixtrans-63.8-39.9176.6-73.9173.7-17400111.8M72 Q74 E79 L80M72-E76 HydrophobicContact CG-CG 4.48Å; M72-E76 WeakPolarHBondContact CG-OE1 3.27Å; M72-E76 WeakPolarHBondContact O-CB 3.27Å; M72-E76 WeakPolarHBondContact O-CG 3.37Å; M72-E76 PolarHBondContact O-N 2.85Å; Q74-E76 VanDerWaalsContact C-N 3.31Å; Q74-E76 PolarHBondContact O-N 3.39Å; E76-E79 PolarHBondContact O-N 3.49Å; E76-L80 VanDerWaalsContact O-CB 3.32Å; E76-L80 WeakPolarHBondContact O-CB 3.44Å; E76-L80 PolarHBondContact O-N 2.94Å
77T95.9Very high95.2Very high76 Ų76108.8 Ų108.847%0.46653%0.525SS..Hα-helixtrans-65.5-40.3175.755.80000112.3A73 Q74 L80 Q81A73-T77 VanDerWaalsContact O-CG2 3.24Å; A73-T77 WeakPolarHBondContact O-CG2 3.47Å; A73-T77 PolarHBondContact O-N 2.81Å; A73-T77 PolarHBondContact O-OG1 3.29Å; Q74-T77 WeakPolarHBondContact CA-OG1 3.46Å; Q74-T77 PolarHBondContact O-N 3.19Å; Q74-T77 VanDerWaalsContact O-N 3.11Å; Q74-T77 PolarHBondContact O-OG1 2.88Å; T77-L80 PolarHBondContact O-N 3.5Å; T77-Q81 WeakPolarHBondContact O-CB 3.37Å; T77-Q81 VanDerWaalsContact O-CG 3.3Å; T77-Q81 WeakPolarHBondContact O-CG 3.32Å; T77-Q81 PolarHBondContact O-N 3.19Å
78E97.3Very high95.1Very high99 Ų99114.9 Ų114.946%0.46354%0.539SS..Hα-helixtrans-68.9-38.9176.1-71.1173.5-171.300111.5Q74 R75 Q81 R82Q74-E78 WeakPolarHBondContact O-CG 3.2Å; Q74-E78 PolarHBondContact O-N 3.05Å; R75-E78 PolarHBondContact O-N 3.31Å; E78-Q81 PolarHBondContact O-N 2.98Å; E78-R82 WeakPolarHBondContact O-CB 3.38Å; E78-R82 WeakPolarHBondContact O-CG 3.49Å; E78-R82 PolarHBondContact O-N 3.4Å
79E97.3Very high94.5Very high127 Ų127113.7 Ų113.759%0.59354%0.544SS*.Hα-helixtrans-65.4-41.7174.7-173.5170.8-162.200111.4R75 E76 Q81 R82 Y83R75-E79 VanDerWaalsContact O-CB 3.31Å; R75-E79 WeakPolarHBondContact O-CB 3.42Å; R75-E79 PolarHBondContact O-N 3.37Å; E76-E79 PolarHBondContact O-N 3.49Å; E79-Q81 VanDerWaalsContact C-N 3.35Å; E79-Q81 PolarHBondContact O-N 3.12Å; E79-R82 PolarHBondContact O-N 2.94Å; E79-Y83 VanDerWaalsContact O-CB 3.28Å; E79-Y83 WeakPolarHBondContact O-CB 3.29Å; E79-Y83 PolarHBondContact O-N 2.85Å
80L95.4Very high93.9Very high96 Ų96111 Ų11150%0.50354%0.541SS..Hα-helixtrans-62.4-41.7173.1-171.986.8000111.5E76 T77 Y83 K84E76-L80 VanDerWaalsContact O-CB 3.32Å; E76-L80 WeakPolarHBondContact O-CB 3.44Å; E76-L80 PolarHBondContact O-N 2.94Å; T77-L80 PolarHBondContact O-N 3.5Å; L80-Y83 PolarHBondContact O-N 2.98Å; L80-K84 HydrophobicContact CG-CD 4.47Å; L80-K84 WeakPolarHBondContact O-CB 3.28Å; L80-K84 VanDerWaalsContact O-CG 3.26Å; L80-K84 WeakPolarHBondContact O-CG 3.46Å; L80-K84 PolarHBondContact O-N 3.18Å
81Q95.3Very high93Very high114 Ų114111.7 Ų111.753%0.53356%0.558SS.*Hα-helixtrans-63.6-49.3175.6-77.2176.60.100110.9T77 E78 E79 Y83 K84 E85T77-Q81 WeakPolarHBondContact O-CB 3.37Å; T77-Q81 VanDerWaalsContact O-CG 3.3Å; T77-Q81 WeakPolarHBondContact O-CG 3.32Å; T77-Q81 PolarHBondContact O-N 3.19Å; E78-Q81 PolarHBondContact O-N 2.98Å; E79-Q81 VanDerWaalsContact C-N 3.35Å; E79-Q81 PolarHBondContact O-N 3.12Å; Q81-Y83 VanDerWaalsContact C-N 3.29Å; Q81-Y83 PolarHBondContact O-N 3.38Å; Q81-K84 CarbonylContact O-C 3.52Å; Q81-K84 WeakPolarHBondContact O-CB 3.47Å; Q81-K84 PolarHBondContact O-N 3.42Å; Q81-K84 VanDerWaalsContact O-N 3.11Å; Q81-E85 WeakPolarHBondContact O-CB 3.36Å; Q81-E85 WeakPolarHBondContact O-CG 3.42Å; Q81-E85 PolarHBondContact O-N 3.03Å
82R96.5Very high91.7Very high154 Ų154113.6 Ų113.658%0.58157%0.57SS**Hα-helixtrans-59-40.1175.1-76.9-173-77.2-176.9-5.6112.2E78 E79 E85 A86E78-R82 WeakPolarHBondContact O-CB 3.38Å; E78-R82 WeakPolarHBondContact O-CG 3.49Å; E78-R82 PolarHBondContact O-N 3.4Å; E79-R82 PolarHBondContact O-N 2.94Å; R82-E85 PolarHBondContact O-N 3.46Å; R82-A86 WeakPolarHBondContact O-CB 3.49Å; R82-A86 PolarHBondContact O-N 2.9Å
83Y95.5Very high90.1Very high142 Ų142117.9 Ų117.956%0.55759%0.588SS**Hα-helixtrans-62.9-47.5174.2-177.7-87.2000110.9E79 L80 Q81 E85 A86 H87E79-Y83 VanDerWaalsContact O-CB 3.28Å; E79-Y83 WeakPolarHBondContact O-CB 3.29Å; E79-Y83 PolarHBondContact O-N 2.85Å; L80-Y83 PolarHBondContact O-N 2.98Å; Q81-Y83 VanDerWaalsContact C-N 3.29Å; Q81-Y83 PolarHBondContact O-N 3.38Å; Y83-E85 VanDerWaalsContact C-N 3.27Å; Y83-E85 PolarHBondContact O-N 3.24Å; Y83-A86 PolarHBondContact O-N 3.2Å; Y83-H87 AromaticContact CD1-ND1 3.88Å; Y83-H87 AromaticContact CD2-CE1 3.3Å; Y83-H87 WeakPolarHBondContact CD2-CE1 3.29Å; Y83-H87 AromaticContact CD2-ND1 3.47Å; Y83-H87 WeakPolarHBondContact CD2-ND1 3.34Å; Y83-H87 HydrophobicContact CE1-CB 4.41Å; Y83-H87 AromaticContact CE1-ND1 3.89Å; Y83-H87 AromaticContact CE2-CE1 3.13Å; Y83-H87 WeakPolarHBondContact CE2-CE1 3.48Å; Y83-H87 AromaticContact CE2-ND1 3.5Å; Y83-H87 WeakPolarHBondContact CE2-ND1 3.41Å; Y83-H87 AromaticContact CE2-NE2 3.56Å; Y83-H87 AromaticContact CG-CE1 3.99Å; Y83-H87 AromaticContact CG-ND1 3.66Å; Y83-H87 AromaticContact CZ-CD2 3.98Å; Y83-H87 AromaticContact CZ-CE1 3.7Å; Y83-H87 AromaticContact CZ-CG 3.89Å; Y83-H87 AromaticContact CZ-ND1 3.7Å; Y83-H87 AromaticContact CZ-NE2 3.86Å; Y83-H87 VanDerWaalsContact O-CB 3.31Å; Y83-H87 WeakPolarHBondContact O-CB 3.35Å; Y83-H87 PolarHBondContact O-N 3.03Å; Y83-H87 PolarHBondContact O-ND1 3.22Å
84K94.5Very high88.8Confident133 Ų133122.2 Ų122.258%0.57861%0.605SS**Hα-helixtrans-61.3-34.8176.7-77.1174.9177.2-178.10112.9L80 Q81 H87 R88L80-K84 HydrophobicContact CG-CD 4.47Å; L80-K84 WeakPolarHBondContact O-CB 3.28Å; L80-K84 VanDerWaalsContact O-CG 3.26Å; L80-K84 WeakPolarHBondContact O-CG 3.46Å; L80-K84 PolarHBondContact O-N 3.18Å; Q81-K84 CarbonylContact O-C 3.52Å; Q81-K84 WeakPolarHBondContact O-CB 3.47Å; Q81-K84 PolarHBondContact O-N 3.42Å; Q81-K84 VanDerWaalsContact O-N 3.11Å; K84-H87 CarbonylContact O-C 3.43Å; K84-R88 WeakPolarHBondContact O-CA 3.49Å; K84-R88 VanDerWaalsContact O-CB 3.29Å; K84-R88 WeakPolarHBondContact O-CB 3.47Å; K84-R88 PolarHBondContact O-N 3.29Å
85E91.8Very high87.4Confident127 Ų127120.8 Ų120.859%0.59361%0.614SS**Hα-helixtrans-75.5-45.8177.5-73.2173.8-17600111.9Q81 R82 Y83 H87 R88Q81-E85 WeakPolarHBondContact O-CB 3.36Å; Q81-E85 WeakPolarHBondContact O-CG 3.42Å; Q81-E85 PolarHBondContact O-N 3.03Å; R82-E85 PolarHBondContact O-N 3.46Å; Y83-E85 VanDerWaalsContact C-N 3.27Å; Y83-E85 PolarHBondContact O-N 3.24Å; E85-H87 VanDerWaalsContact C-N 3.29Å; E85-H87 PolarHBondContact O-N 2.92Å; E85-R88 WeakPolarHBondContact O-CB 3.47Å; E85-R88 PolarHBondContact O-N 3.43Å; E85-R88 VanDerWaalsContact O-N 3.1Å
86A93.1Very high86.1Confident82 Ų82117.8 Ų117.868%0.67861%0.612SS**Hα-helixtrans-64.1-35.2177.100000112.3R82 Y83 R88R82-A86 WeakPolarHBondContact O-CB 3.49Å; R82-A86 PolarHBondContact O-N 2.9Å; Y83-A86 PolarHBondContact O-N 3.2Å; A86-R88 VanDerWaalsContact C-N 3.35Å
87H91.1Very high85Confident115 Ų115119.3 Ų119.353%0.53262%0.62SS.*THydrogen-bonded Turntrans-98.913.5176.4-56.376.3000111.7Y83 K84 E85 P89Y83-H87 AromaticContact CD1-ND1 3.88Å; Y83-H87 AromaticContact CD2-CE1 3.3Å; Y83-H87 WeakPolarHBondContact CD2-CE1 3.29Å; Y83-H87 AromaticContact CD2-ND1 3.47Å; Y83-H87 WeakPolarHBondContact CD2-ND1 3.34Å; Y83-H87 HydrophobicContact CE1-CB 4.41Å; Y83-H87 AromaticContact CE1-ND1 3.89Å; Y83-H87 AromaticContact CE2-CE1 3.13Å; Y83-H87 WeakPolarHBondContact CE2-CE1 3.48Å; Y83-H87 AromaticContact CE2-ND1 3.5Å; Y83-H87 WeakPolarHBondContact CE2-ND1 3.41Å; Y83-H87 AromaticContact CE2-NE2 3.56Å; Y83-H87 AromaticContact CG-CE1 3.99Å; Y83-H87 AromaticContact CG-ND1 3.66Å; Y83-H87 AromaticContact CZ-CD2 3.98Å; Y83-H87 AromaticContact CZ-CE1 3.7Å; Y83-H87 AromaticContact CZ-CG 3.89Å; Y83-H87 AromaticContact CZ-ND1 3.7Å; Y83-H87 AromaticContact CZ-NE2 3.86Å; Y83-H87 VanDerWaalsContact O-CB 3.31Å; Y83-H87 WeakPolarHBondContact O-CB 3.35Å; Y83-H87 PolarHBondContact O-N 3.03Å; Y83-H87 PolarHBondContact O-ND1 3.22Å; K84-H87 CarbonylContact O-C 3.43Å; E85-H87 VanDerWaalsContact C-N 3.29Å; E85-H87 PolarHBondContact O-N 2.92Å; H87-P89 VanDerWaalsContact O-CD 3.31Å; H87-P89 WeakPolarHBondContact O-CD 3.42Å
88R90.4Very high84.1Confident190 Ų190122 Ų12272%0.71762%0.621SS**SBendtrans-66.6122.5172.4-165.7177.5-176116.20.1106.5K84 E85 A86 G90K84-R88 WeakPolarHBondContact O-CA 3.49Å; K84-R88 VanDerWaalsContact O-CB 3.29Å; K84-R88 WeakPolarHBondContact O-CB 3.47Å; K84-R88 PolarHBondContact O-N 3.29Å; E85-R88 WeakPolarHBondContact O-CB 3.47Å; E85-R88 PolarHBondContact O-N 3.43Å; E85-R88 VanDerWaalsContact O-N 3.1Å; A86-R88 VanDerWaalsContact C-N 3.35Å; R88-G90 PolarHBondContact O-N 3.43Å
89P83.3Confident83Confident102 Ų102122.2 Ų122.266%0.66263%0.625SS**PPolyproline II helixtrans-53.9134.4169.9-19.930.7000108.4H87H87-P89 VanDerWaalsContact O-CD 3.31Å; H87-P89 WeakPolarHBondContact O-CD 3.42Å
90G80.4Confident81.6Confident51 Ų51120 Ų12053%0.52664%0.636SS.*PPolyproline II helixtrans-55.1158.7178.200000111.5R88 L92R88-G90 PolarHBondContact O-N 3.43Å; G90-L92 PolarHBondContact O-N 3.36Å
91P76.4Confident80.3Confident129 Ų129119.1 Ų119.184%0.83865%0.651SS**  trans-54.4104.4176.8-23.133.2000110H93P91-H93 PolarHBondContact O-N 3.03Å; P91-H93 VanDerWaalsContact O-N 3.14Å
92L67.6Low79.3Confident131 Ų131115.2 Ų115.269%0.68664%0.64SS**  trans-73.6107.4176.3-66.6177.3000107G90 L94G90-L92 PolarHBondContact O-N 3.36Å; L92-L94 HydrophobicContact CB-CD1 4.32Å; L92-L94 HydrophobicContact CB-CG 4.22Å; L92-L94 HydrophobicContact CD1-CD1 4.32Å; L92-L94 PolarHBondContact O-N 3.16Å
93H63.3Low78.3Confident193 Ų193114 Ų11489%0.89465%0.646SS**  trans-73.362.6164.7-80.8130.6000109.5P91P91-H93 PolarHBondContact O-N 3.03Å; P91-H93 VanDerWaalsContact O-N 3.14Å
94L68.6Low77.6Confident132 Ų132109.4 Ų109.469%0.69163%0.632SS**PPolyproline II helixtrans-86.4137.6161.8-65.6172.7000106.8L92L92-L94 HydrophobicContact CB-CD1 4.32Å; L92-L94 HydrophobicContact CB-CG 4.22Å; L92-L94 HydrophobicContact CD1-CD1 4.32Å; L92-L94 PolarHBondContact O-N 3.16Å
95A67.4Low77.3Confident89 Ų89105.3 Ų105.374%0.73662%0.618SS**PPolyproline II helixtrans-51.9129.3165.600000107E97A95-E97 PolarHBondContact O-N 2.86Å
96P69.8Low76.9Confident78 Ų78100.2 Ų100.251%0.50660%0.595SS.*PPolyproline II helixtrans-49.1131.8-178-25.531.3000109.2R98 T105P96-R98 VanDerWaalsContact C-N 3.35Å; P96-R98 WeakPolarHBondContact O-CG 3.43Å; P96-R98 PolarHBondContact O-N 3.42Å; P96-T105 HydrophobicContact CB-CG2 3.62Å
97E74.5Confident76.5Confident146 Ų14699.5 Ų99.568%0.68259%0.589SS**  trans-59.3102.2-179.7-156.9-167.6154.500107.1A95 I106A95-E97 PolarHBondContact O-N 2.86Å; E97-I106 HydrophobicContact CB-CD1 3.73Å; E97-I106 HydrophobicContact CG-CD1 3.36Å; E97-I106 WeakPolarHBondContact O-CB 3.45Å; E97-I106 WeakPolarHBondContact O-CD1 3.48Å; E97-I106 WeakPolarHBondContact O-CG1 3.36Å; E97-I106 PolarHBondContact O-N 3.49Å; E97-I106 VanDerWaalsContact OE1-CD1 3.31Å; E97-I106 WeakPolarHBondContact OE1-CD1 3.46Å
98R76.9Confident76.4Confident131 Ų13197.2 Ų97.249%0.49458%0.579SS.*BIsolated β-bridgetrans-86.1130.4-175.8-82.6175.3161.6-136.1-9108P96 G100 G102 D103P96-R98 VanDerWaalsContact C-N 3.35Å; P96-R98 WeakPolarHBondContact O-CG 3.43Å; P96-R98 PolarHBondContact O-N 3.42Å; R98-G100 PolarHBondContact O-N 3.25Å; R98-G102 WeakPolarHBondContact CD-O 3.46Å; R98-D103 IonicContact CZ-OD1 2.67Å; R98-D103 IonicContact NH1-OD1 3.62Å; R98-D103 PolarHBondContact NH1-OD1 3.25Å; R98-D103 IonicContact NH2-OD1 3Å; R98-D103 PolarHBondContact NH2-OD1 2.99Å; R98-D103 VanDerWaalsContact NH2-OD1 3.09Å
99L74.4Confident76.4Confident105 Ų10589.3 Ų89.355%0.5555%0.554SS.*G310 helixtrans-77.8115.9179.7-169.763.1000108.9G101 G102 V104 I106 A109L99-G101 PolarHBondContact O-N 2.87Å; L99-G102 PolarHBondContact O-N 3.46Å; L99-V104 PolarHBondContact N-O 2.69Å; L99-I106 HydrophobicContact CB-CG1 3.66Å; L99-I106 HydrophobicContact CD1-CD1 4.41Å; L99-I106 HydrophobicContact CD1-CG1 4.03Å; L99-I106 HydrophobicContact CG-CG1 4.38Å; L99-A109 HydrophobicContact CD2-CB 3.88Å
100G68.1Low76.7Confident80 Ų8092.5 Ų92.583%0.82555%0.553SS**G310 helixtrans5942.5167.200000115.5R98 G102R98-G100 PolarHBondContact O-N 3.25Å; G100-G102 PolarHBondContact O-N 3.19Å; G100-G102 VanDerWaalsContact O-N 3.09Å
101G67.2Low77.3Confident78 Ų7896.2 Ų96.280%0.80456%0.556SS**G310 helixtrans70.32.8175.800000115.7L99L99-G101 PolarHBondContact O-N 2.87Å
102G73.6Confident78Confident31 Ų3196.3 Ų96.332%0.3254%0.54SS..SBendtrans-84.2172.1177.200000114.1R98 L99 G100 V104R98-G102 WeakPolarHBondContact CD-O 3.46Å; L99-G102 PolarHBondContact O-N 3.46Å; G100-G102 PolarHBondContact O-N 3.19Å; G100-G102 VanDerWaalsContact O-N 3.09Å; G102-V104 PolarHBondContact O-N 2.86Å
103D77.3Confident79.1Confident130 Ų13095.5 Ų95.570%0.69553%0.533SS*.SBendtrans-77.3-7.2178.7-69.5-44.6000114.7R98R98-D103 IonicContact CZ-OD1 2.67Å; R98-D103 IonicContact NH1-OD1 3.62Å; R98-D103 PolarHBondContact NH1-OD1 3.25Å; R98-D103 IonicContact NH2-OD1 3Å; R98-D103 PolarHBondContact NH2-OD1 2.99Å; R98-D103 VanDerWaalsContact NH2-OD1 3.09Å
104V80.6Confident80.5Confident45 Ų4592.3 Ų92.327%0.27352%0.516SS..SBendtrans-90.7127.9-176.8-176.10000109.9L99 G102 E108 A109L99-V104 PolarHBondContact N-O 2.69Å; G102-V104 PolarHBondContact O-N 2.86Å; V104-E108 HydrophobicContact CG1-CB 3.83Å; V104-E108 HydrophobicContact CG1-CG 3.99Å; V104-A109 HydrophobicContact CG1-CB 4.03Å
105T86.9Confident81.6Confident46 Ų4689.4 Ų89.428%0.28251%0.505SS..BIsolated β-bridgetrans-69143.7173.5-57.30000109.5P96 A107 E108 A109P96-T105 HydrophobicContact CB-CG2 3.62Å; T105-A107 HydrophobicContact CG2-CB 4.24Å; T105-A107 PolarHBondContact O-N 3.18Å; T105-A107 VanDerWaalsContact O-N 3.11Å; T105-E108 WeakPolarHBondContact O-CA 3.34Å; T105-E108 WeakPolarHBondContact O-CB 3.49Å; T105-E108 PolarHBondContact O-N 2.68Å; T105-A109 PolarHBondContact O-N 3.5Å
106I83.3Confident82.8Confident20 Ų2090.4 Ų90.410%0.10350%0.498CS..Hα-helixtrans-52.5-38.1179.1-75.4169.3000112.4E97 L99 E108 A109 R110E97-I106 HydrophobicContact CB-CD1 3.73Å; E97-I106 HydrophobicContact CG-CD1 3.36Å; E97-I106 WeakPolarHBondContact O-CB 3.45Å; E97-I106 WeakPolarHBondContact O-CD1 3.48Å; E97-I106 WeakPolarHBondContact O-CG1 3.36Å; E97-I106 PolarHBondContact O-N 3.49Å; E97-I106 VanDerWaalsContact OE1-CD1 3.31Å; E97-I106 WeakPolarHBondContact OE1-CD1 3.46Å; L99-I106 HydrophobicContact CB-CG1 3.66Å; L99-I106 HydrophobicContact CD1-CD1 4.41Å; L99-I106 HydrophobicContact CD1-CG1 4.03Å; L99-I106 HydrophobicContact CG-CG1 4.38Å; I106-E108 VanDerWaalsContact C-N 3.35Å; I106-E108 PolarHBondContact O-N 3.46Å; I106-A109 PolarHBondContact O-N 3.01Å; I106-R110 HydrophobicContact CG2-CG 4.45Å; I106-R110 WeakPolarHBondContact O-CB 3.38Å; I106-R110 WeakPolarHBondContact O-CG 3.33Å; I106-R110 PolarHBondContact O-N 2.93Å
107A85.6Confident83.7Confident68 Ų6892.8 Ų92.856%0.56250%0.502SS*.Hα-helixtrans-60.5-43.4176.100000112.3T105 R110 Q111T105-A107 HydrophobicContact CG2-CB 4.24Å; T105-A107 PolarHBondContact O-N 3.18Å; T105-A107 VanDerWaalsContact O-N 3.11Å; A107-R110 PolarHBondContact O-N 3Å; A107-Q111 WeakPolarHBondContact O-CB 3.35Å; A107-Q111 PolarHBondContact O-N 2.87Å
108E89.7Confident84.5Confident67 Ų6795 Ų9531%0.31350%0.504SS..Hα-helixtrans-69.2-41.1177.4-172.5-170.5167.300111.2V104 T105 I106 R110 Q111 R112V104-E108 HydrophobicContact CG1-CB 3.83Å; V104-E108 HydrophobicContact CG1-CG 3.99Å; T105-E108 WeakPolarHBondContact O-CA 3.34Å; T105-E108 WeakPolarHBondContact O-CB 3.49Å; T105-E108 PolarHBondContact O-N 2.68Å; I106-E108 VanDerWaalsContact C-N 3.35Å; I106-E108 PolarHBondContact O-N 3.46Å; E108-R110 VanDerWaalsContact C-N 3.32Å; E108-R110 PolarHBondContact O-N 3.38Å; E108-Q111 PolarHBondContact O-N 3.48Å; E108-R112 HydrophobicContact CG-CG 4.49Å; E108-R112 WeakPolarHBondContact O-CB 3.3Å; E108-R112 WeakPolarHBondContact O-CG 3.41Å; E108-R112 PolarHBondContact O-N 3.02Å; E108-R112 IonicContact OE1-CZ 3.51Å; E108-R112 IonicContact OE1-NE 2.64Å; E108-R112 PolarHBondContact OE1-NE 3.38Å; E108-R112 IonicContact OE1-NH2 3.68Å; E108-R112 PolarHBondContact OE1-NH2 3.05Å
109A89.2Confident85.2Confident23 Ų2390.1 Ų90.119%0.1949%0.494CS..Hα-helixtrans-59.3-44.1175.300000111.5L99 V104 T105 I106 R112 Q113L99-A109 HydrophobicContact CD2-CB 3.88Å; V104-A109 HydrophobicContact CG1-CB 4.03Å; T105-A109 PolarHBondContact O-N 3.5Å; I106-A109 PolarHBondContact O-N 3.01Å; A109-R112 PolarHBondContact O-N 2.87Å; A109-Q113 WeakPolarHBondContact O-CB 3.26Å; A109-Q113 PolarHBondContact O-N 3.41Å
110R90Very high86.1Confident170 Ų17087.2 Ų87.264%0.64248%0.483SS*.Hα-helixtrans-64.8-41174.9-72.6176.3-177176.45112I106 A107 E108 Q113 F114I106-R110 HydrophobicContact CG2-CG 4.45Å; I106-R110 WeakPolarHBondContact O-CB 3.38Å; I106-R110 WeakPolarHBondContact O-CG 3.33Å; I106-R110 PolarHBondContact O-N 2.93Å; A107-R110 PolarHBondContact O-N 3Å; E108-R110 VanDerWaalsContact C-N 3.32Å; E108-R110 PolarHBondContact O-N 3.38Å; R110-Q113 PolarHBondContact O-N 2.89Å; R110-F114 WeakPolarHBondContact O-CB 3.47Å; R110-F114 PolarHBondContact O-N 3.23Å
111Q92.4Very high87.3Confident128 Ų12886.7 Ų86.760%0.59847%0.466SS*.Hα-helixtrans-61.7-48.1175.7-175.5179.78.800111A107 E108 Q113 F114 T115A107-Q111 WeakPolarHBondContact O-CB 3.35Å; A107-Q111 PolarHBondContact O-N 2.87Å; E108-Q111 PolarHBondContact O-N 3.48Å; Q111-Q113 VanDerWaalsContact C-N 3.33Å; Q111-Q113 PolarHBondContact O-N 3.27Å; Q111-F114 WeakPolarHBondContact O-CB 3.34Å; Q111-F114 PolarHBondContact O-N 3.22Å; Q111-F114 VanDerWaalsContact O-N 3.16Å; Q111-T115 HydrophobicContact CG-CG2 4.5Å; Q111-T115 WeakPolarHBondContact O-CG2 3.47Å; Q111-T115 PolarHBondContact O-N 2.88Å; Q111-T115 PolarHBondContact O-OG1 2.86Å
112R91.1Very high88.6Confident132 Ų13288.6 Ų88.650%0.49846%0.457SS..Hα-helixtrans-59.7-43.3176.2-72.4176.3-179.8-1453.1111.5E108 A109 F114 T115 N116E108-R112 HydrophobicContact CG-CG 4.49Å; E108-R112 WeakPolarHBondContact O-CB 3.3Å; E108-R112 WeakPolarHBondContact O-CG 3.41Å; E108-R112 PolarHBondContact O-N 3.02Å; E108-R112 IonicContact OE1-CZ 3.51Å; E108-R112 IonicContact OE1-NE 2.64Å; E108-R112 PolarHBondContact OE1-NE 3.38Å; E108-R112 IonicContact OE1-NH2 3.68Å; E108-R112 PolarHBondContact OE1-NH2 3.05Å; A109-R112 PolarHBondContact O-N 2.87Å; R112-F114 VanDerWaalsContact C-N 3.33Å; R112-F114 PolarHBondContact O-N 2.95Å; R112-T115 WeakPolarHBondContact CA-OG1 3.38Å; R112-T115 PolarHBondContact O-N 3.42Å; R112-T115 PolarHBondContact O-OG1 2.99Å; R112-N116 WeakPolarHBondContact O-CB 3.26Å; R112-N116 PolarHBondContact O-N 3.29Å; R112-N116 PolarHBondContact O-ND2 3.45Å; R112-N116 PolarHBondContact O-OD1 2.88Å
113Q91.1Very high89.6Confident114 Ų11492.6 Ų92.653%0.53347%0.468SS..Hα-helixtrans-60.6-44.8175.4-177.6179.6-1.300111.1A109 R110 Q111 N116 Q117A109-Q113 WeakPolarHBondContact O-CB 3.26Å; A109-Q113 PolarHBondContact O-N 3.41Å; R110-Q113 PolarHBondContact O-N 2.89Å; Q111-Q113 VanDerWaalsContact C-N 3.33Å; Q111-Q113 PolarHBondContact O-N 3.27Å; Q113-N116 PolarHBondContact O-N 3.44Å; Q113-Q117 VanDerWaalsContact CG-NE2 3.28Å; Q113-Q117 WeakPolarHBondContact O-CB 3.35Å; Q113-Q117 VanDerWaalsContact O-CG 3.24Å; Q113-Q117 WeakPolarHBondContact O-CG 3.42Å; Q113-Q117 PolarHBondContact O-N 3.34Å
114F91.9Very high90.5Very high125 Ų12593.2 Ų93.255%0.54846%0.464SS..Hα-helixtrans-64.1-45.3177.1-175.8-96.3000112.3R110 Q111 R112 Q117 R118R110-F114 WeakPolarHBondContact O-CB 3.47Å; R110-F114 PolarHBondContact O-N 3.23Å; Q111-F114 WeakPolarHBondContact O-CB 3.34Å; Q111-F114 PolarHBondContact O-N 3.22Å; Q111-F114 VanDerWaalsContact O-N 3.16Å; R112-F114 VanDerWaalsContact C-N 3.33Å; R112-F114 PolarHBondContact O-N 2.95Å; F114-Q117 PolarHBondContact O-N 3.18Å; F114-R118 VanDerWaalsContact O-CB 3.26Å; F114-R118 WeakPolarHBondContact O-CB 3.41Å; F114-R118 PolarHBondContact O-N 3.45Å
115T92.3Very high91.3Very high72 Ų7297.4 Ų97.444%0.44248%0.479SS..Hα-helixtrans-65-40.6177.354.30000111.5Q111 R112 R118 G119Q111-T115 HydrophobicContact CG-CG2 4.5Å; Q111-T115 WeakPolarHBondContact O-CG2 3.47Å; Q111-T115 PolarHBondContact O-N 2.88Å; Q111-T115 PolarHBondContact O-OG1 2.86Å; R112-T115 WeakPolarHBondContact CA-OG1 3.38Å; R112-T115 PolarHBondContact O-N 3.42Å; R112-T115 PolarHBondContact O-OG1 2.99Å; T115-R118 PolarHBondContact O-N 2.93Å; T115-G119 PolarHBondContact O-N 3.15Å
116N92Very high91.7Very high110 Ų110100.4 Ų100.459%0.58849%0.493SS*.Hα-helixtrans-66.1-44.5178-70.5-8.6000111.2R112 Q113 R118 G119 S120R112-N116 WeakPolarHBondContact O-CB 3.26Å; R112-N116 PolarHBondContact O-N 3.29Å; R112-N116 PolarHBondContact O-ND2 3.45Å; R112-N116 PolarHBondContact O-OD1 2.88Å; Q113-N116 PolarHBondContact O-N 3.44Å; N116-R118 PolarHBondContact O-N 3.38Å; N116-G119 PolarHBondContact O-N 2.98Å; N116-S120 WeakPolarHBondContact O-CA 3.36Å; N116-S120 WeakPolarHBondContact O-CB 3.34Å; N116-S120 PolarHBondContact O-N 3.43Å
117Q89.9Confident92.4Very high127 Ų127105.6 Ų105.659%0.59352%0.515SS*.Hα-helixtrans-61.5-44.9175.2-74.6177.726.800111.3Q113 F114 G119Q113-Q117 VanDerWaalsContact CG-NE2 3.28Å; Q113-Q117 WeakPolarHBondContact O-CB 3.35Å; Q113-Q117 VanDerWaalsContact O-CG 3.24Å; Q113-Q117 WeakPolarHBondContact O-CG 3.42Å; Q113-Q117 PolarHBondContact O-N 3.34Å; F114-Q117 PolarHBondContact O-N 3.18Å; Q117-G119 PolarHBondContact O-N 3Å
118R91.5Very high93Very high193 Ų193109 Ų10973%0.72852%0.517SS*.Hα-helixtrans-67.2-34179.3-171.2170.4174.9155.1-2.1112.8F114 T115 N116F114-R118 VanDerWaalsContact O-CB 3.26Å; F114-R118 WeakPolarHBondContact O-CB 3.41Å; F114-R118 PolarHBondContact O-N 3.45Å; T115-R118 PolarHBondContact O-N 2.93Å; N116-R118 PolarHBondContact O-N 3.38Å
119G91.8Very high93.4Very high28 Ų28110 Ų11029%0.28952%0.521SS..Hα-helixtrans-90.8-18.9-177.800000115.5T115 N116 Q117 S121 L122 Q123T115-G119 PolarHBondContact O-N 3.15Å; N116-G119 PolarHBondContact O-N 2.98Å; Q117-G119 PolarHBondContact O-N 3Å; G119-S121 VanDerWaalsContact C-N 3.33Å; G119-S121 PolarHBondContact O-N 3.42Å; G119-L122 PolarHBondContact O-N 3.48Å; G119-L122 VanDerWaalsContact O-N 3.1Å; G119-Q123 PolarHBondContact O-N 2.9Å
120S93.6Very high93.8Very high44 Ų44113.1 Ų113.131%0.30854%0.535SS..Hα-helixtrans-58.1-41.4-172.8-178.80000113N116 L122 Q123 K124N116-S120 WeakPolarHBondContact O-CA 3.36Å; N116-S120 WeakPolarHBondContact O-CB 3.34Å; N116-S120 PolarHBondContact O-N 3.43Å; S120-L122 PolarHBondContact O-N 2.93Å; S120-Q123 PolarHBondContact O-N 3.47Å; S120-K124 WeakPolarHBondContact O-CB 3.36Å; S120-K124 VanDerWaalsContact O-CG 3.31Å; S120-K124 WeakPolarHBondContact O-CG 3.38Å; S120-K124 PolarHBondContact O-N 3.46Å
121S92.9Very high94.1Very high69 Ų69109.8 Ų109.848%0.48353%0.528SS..Hα-helixtrans-63.2-42.6177.8-174.70000112.1G119 K124 K125G119-S121 VanDerWaalsContact C-N 3.33Å; G119-S121 PolarHBondContact O-N 3.42Å; S121-K124 PolarHBondContact O-N 3.13Å; S121-K125 WeakPolarHBondContact O-CG 3.43Å; S121-K125 PolarHBondContact O-N 3.36Å; S121-K125 VanDerWaalsContact O-N 3.08Å
122L94.4Very high94.4Very high118 Ų118106.5 Ų106.562%0.61851%0.514SS*.Hα-helixtrans-66.5-44.4178.5-66.8174000111.2G119 S120 K124 K125 L126G119-L122 PolarHBondContact O-N 3.48Å; G119-L122 VanDerWaalsContact O-N 3.1Å; S120-L122 PolarHBondContact O-N 2.93Å; L122-K124 VanDerWaalsContact C-N 3.33Å; L122-K124 PolarHBondContact O-N 2.87Å; L122-K125 WeakPolarHBondContact O-CB 3.39Å; L122-K125 PolarHBondContact O-N 2.89Å; L122-L126 PolarHBondContact O-N 3.18Å
123Q94.1Very high94.7Very high115 Ų115104.5 Ų104.554%0.53751%0.509SS..Hα-helixtrans-61.5-41.4177.7-169.5-175.626.400111.9G119 S120 K125 L126 K127G119-Q123 PolarHBondContact O-N 2.9Å; S120-Q123 PolarHBondContact O-N 3.47Å; Q123-K125 VanDerWaalsContact C-N 3.34Å; Q123-L126 PolarHBondContact O-N 2.84Å; Q123-K127 WeakPolarHBondContact O-CG 3.49Å; Q123-K127 PolarHBondContact O-N 3.43Å
124K95.9Very high95Very high143 Ų143105.4 Ų105.462%0.62251%0.508SS*.Hα-helixtrans-62.1-41.4175.2-74.9178.5-177.4-1740112S120 S121 L122 K128S120-K124 WeakPolarHBondContact O-CB 3.36Å; S120-K124 VanDerWaalsContact O-CG 3.31Å; S120-K124 WeakPolarHBondContact O-CG 3.38Å; S120-K124 PolarHBondContact O-N 3.46Å; S121-K124 PolarHBondContact O-N 3.13Å; L122-K124 VanDerWaalsContact C-N 3.33Å; L122-K124 PolarHBondContact O-N 2.87Å; K124-K128 WeakPolarHBondContact O-CB 3.31Å; K124-K128 PolarHBondContact O-N 3.34Å
125K96.9Very high95.3Very high133 Ų133105.2 Ų105.258%0.57851%0.507SS*.Hα-helixtrans-62.9-44.9176.2-72.3176.7-176.9-174.50111.8S121 L122 Q123 K128 E129S121-K125 WeakPolarHBondContact O-CG 3.43Å; S121-K125 PolarHBondContact O-N 3.36Å; S121-K125 VanDerWaalsContact O-N 3.08Å; L122-K125 WeakPolarHBondContact O-CB 3.39Å; L122-K125 PolarHBondContact O-N 2.89Å; Q123-K125 VanDerWaalsContact C-N 3.34Å; K125-K128 PolarHBondContact O-N 3.24Å; K125-E129 WeakPolarHBondContact O-CB 3.23Å; K125-E129 PolarHBondContact O-N 2.94Å
126L97.1Very high95.6Very high109 Ų109108 Ų10857%0.57151%0.509SS*.Hα-helixtrans-59.2-50.7177.8-135.277.8000111.2L122 Q123 K128 E129 D130L122-L126 PolarHBondContact O-N 3.18Å; Q123-L126 PolarHBondContact O-N 2.84Å; L126-K128 VanDerWaalsContact C-N 3.28Å; L126-K128 PolarHBondContact O-N 2.91Å; L126-E129 PolarHBondContact O-N 3.25Å; L126-E129 VanDerWaalsContact O-N 3.16Å; L126-D130 VanDerWaalsContact O-CG 3.3Å; L126-D130 PolarHBondContact O-N 2.83Å
127K97.5Very high95.8Very high130 Ų130108.3 Ų108.357%0.56551%0.507SS*.Hα-helixtrans-58.1-40.4177.2-72.6-176.8176.8-1720112.4Q123 M131Q123-K127 WeakPolarHBondContact O-CG 3.49Å; Q123-K127 PolarHBondContact O-N 3.43Å; K127-M131 VanDerWaalsContact O-CG 3.29Å; K127-M131 WeakPolarHBondContact O-CG 3.45Å; K127-M131 PolarHBondContact O-N 3.4Å; K127-M131 VanDerWaalsContact O-N 3.13Å
128K98Very high96.1Very high139 Ų139106.6 Ų106.660%0.60450%0.499SS*.Hα-helixtrans-65.9-46.2177.1-176.3177.4178.1-179.50111.4K124 K125 L126 D130 M131 D132K124-K128 WeakPolarHBondContact O-CB 3.31Å; K124-K128 PolarHBondContact O-N 3.34Å; K125-K128 PolarHBondContact O-N 3.24Å; L126-K128 VanDerWaalsContact C-N 3.28Å; L126-K128 PolarHBondContact O-N 2.91Å; K128-D130 VanDerWaalsContact C-N 3.3Å; K128-D130 PolarHBondContact O-N 3.28Å; K128-M131 PolarHBondContact O-N 2.85Å; K128-D132 WeakPolarHBondContact O-CB 3.47Å; K128-D132 VanDerWaalsContact O-CG 3.28Å; K128-D132 PolarHBondContact O-N 2.9Å
129E97.4Very high96.4Very high88 Ų88102.2 Ų102.241%0.41149%0.487SS..Hα-helixtrans-61.5-40.1179.1-170.2-175.7162.100111.8K125 L126 D132 K133K125-E129 WeakPolarHBondContact O-CB 3.23Å; K125-E129 PolarHBondContact O-N 2.94Å; L126-E129 PolarHBondContact O-N 3.25Å; L126-E129 VanDerWaalsContact O-N 3.16Å; E129-D132 PolarHBondContact O-N 3.12Å; E129-K133 HydrophobicContact CG-CD 4.22Å; E129-K133 WeakPolarHBondContact O-CB 3.39Å; E129-K133 VanDerWaalsContact O-CG 3.27Å; E129-K133 WeakPolarHBondContact O-CG 3.44Å; E129-K133 PolarHBondContact O-N 2.97Å; E129-K133 WeakPolarHBondContact OE1-CE 3.39Å; E129-K133 IonicContact OE1-NZ 2.89Å; E129-K133 PolarHBondContact OE1-NZ 2.91Å
130D97.6Very high96.7Very high88 Ų88107 Ų10747%0.47150%0.502SS..Hα-helixtrans-64-43.2176.5-68-22.1000111.7L126 K128 K133 R134L126-D130 VanDerWaalsContact O-CG 3.3Å; L126-D130 PolarHBondContact O-N 2.83Å; K128-D130 VanDerWaalsContact C-N 3.3Å; K128-D130 PolarHBondContact O-N 3.28Å; D130-K133 PolarHBondContact O-N 3.04Å; D130-R134 PolarHBondContact O-N 2.88Å
131M97.3Very high96.9Very high101 Ų101110.5 Ų110.550%0.49851%0.513SS..Hα-helixtrans-63.8-44.4174.6-70.4-61.9-61.200111.9K127 K128 K133 R134 K135K127-M131 VanDerWaalsContact O-CG 3.29Å; K127-M131 WeakPolarHBondContact O-CG 3.45Å; K127-M131 PolarHBondContact O-N 3.4Å; K127-M131 VanDerWaalsContact O-N 3.13Å; K128-M131 PolarHBondContact O-N 2.85Å; M131-K133 VanDerWaalsContact C-N 3.33Å; M131-K133 PolarHBondContact O-N 3.27Å; M131-R134 PolarHBondContact O-N 3.48Å; M131-K135 WeakPolarHBondContact O-CB 3.47Å; M131-K135 PolarHBondContact O-N 3.29Å
132D97.8Very high97.1Very high59 Ų59113.3 Ų113.332%0.31652%0.518SS..Hα-helixtrans-64.5-38.8178.4-71.3-14.2000111.2K128 E129 R136K128-D132 WeakPolarHBondContact O-CB 3.47Å; K128-D132 VanDerWaalsContact O-CG 3.28Å; K128-D132 PolarHBondContact O-N 2.9Å; E129-D132 PolarHBondContact O-N 3.12Å; D132-R136 WeakPolarHBondContact O-CG 3.44Å; D132-R136 PolarHBondContact O-N 2.91Å
133K98.1Very high97.2Very high90 Ų90116.4 Ų116.439%0.39152%0.522SS..Hα-helixtrans-63.1-46.7174.4-80.2169.7176.7167.10111.4E129 D130 M131 K135 R136 Q137E129-K133 HydrophobicContact CG-CD 4.22Å; E129-K133 WeakPolarHBondContact O-CB 3.39Å; E129-K133 VanDerWaalsContact O-CG 3.27Å; E129-K133 WeakPolarHBondContact O-CG 3.44Å; E129-K133 PolarHBondContact O-N 2.97Å; E129-K133 WeakPolarHBondContact OE1-CE 3.39Å; E129-K133 IonicContact OE1-NZ 2.89Å; E129-K133 PolarHBondContact OE1-NZ 2.91Å; D130-K133 PolarHBondContact O-N 3.04Å; M131-K133 VanDerWaalsContact C-N 3.33Å; M131-K133 PolarHBondContact O-N 3.27Å; K133-K135 VanDerWaalsContact C-N 3.33Å; K133-K135 PolarHBondContact O-N 3.32Å; K133-R136 PolarHBondContact O-N 2.91Å; K133-Q137 WeakPolarHBondContact O-CG 3.12Å; K133-Q137 PolarHBondContact O-N 3.35Å
134R97.3Very high97.3Very high132 Ų132116 Ų11650%0.49852%0.52SS..Hα-helixtrans-61.1-44.4178.4-162-177.775.5-160.8-0.7111.3D130 M131 R136 Q137 E138D130-R134 PolarHBondContact O-N 2.88Å; M131-R134 PolarHBondContact O-N 3.48Å; R134-R136 PolarHBondContact O-N 3.36Å; R134-Q137 WeakPolarHBondContact O-CB 3.37Å; R134-Q137 PolarHBondContact O-N 3.35Å; R134-E138 WeakPolarHBondContact CG-OE1 3.35Å; R134-E138 IonicContact NE-OE1 3.2Å; R134-E138 PolarHBondContact NE-OE1 2.9Å; R134-E138 WeakPolarHBondContact O-CG 3.27Å; R134-E138 PolarHBondContact O-N 3.5Å
135K97.9Very high97.5Very high122 Ų122115.7 Ų115.753%0.5352%0.519SS..Hα-helixtrans-59.5-45176.6-169.4-177.5-178.3-166.30112.5M131 K133 Q137 E138 E139M131-K135 WeakPolarHBondContact O-CB 3.47Å; M131-K135 PolarHBondContact O-N 3.29Å; K133-K135 VanDerWaalsContact C-N 3.33Å; K133-K135 PolarHBondContact O-N 3.32Å; K135-Q137 VanDerWaalsContact C-N 3.32Å; K135-Q137 PolarHBondContact O-N 2.92Å; K135-E138 PolarHBondContact O-N 3.33Å; K135-E139 WeakPolarHBondContact CE-OE1 3.36Å; K135-E139 IonicContact NZ-OE1 3.2Å; K135-E139 WeakPolarHBondContact O-CG 3.47Å; K135-E139 PolarHBondContact O-N 3.37Å
136R97.7Very high97.5Very high131 Ų131115.3 Ų115.349%0.49452%0.521SS..Hα-helixtrans-62.3-39.5176.1-71.5-178.8-153.3112.34.1112.3D132 K133 R134 E139 E140D132-R136 WeakPolarHBondContact O-CG 3.44Å; D132-R136 PolarHBondContact O-N 2.91Å; K133-R136 PolarHBondContact O-N 2.91Å; R134-R136 PolarHBondContact O-N 3.36Å; R136-E139 PolarHBondContact O-N 3.38Å; R136-E140 WeakPolarHBondContact O-CB 3.2Å; R136-E140 VanDerWaalsContact O-CG 3.31Å; R136-E140 WeakPolarHBondContact O-CG 3.3Å; R136-E140 PolarHBondContact O-N 2.9Å
137Q96.9Very high97.5Very high115 Ų115114.4 Ų114.454%0.53751%0.512SS..Hα-helixtrans-63.9-44.9177.2-72.6173.2-15.700111.6K133 R134 K135 E139 E140 E141K133-Q137 WeakPolarHBondContact O-CG 3.12Å; K133-Q137 PolarHBondContact O-N 3.35Å; R134-Q137 WeakPolarHBondContact O-CB 3.37Å; R134-Q137 PolarHBondContact O-N 3.35Å; K135-Q137 VanDerWaalsContact C-N 3.32Å; K135-Q137 PolarHBondContact O-N 2.92Å; Q137-E139 PolarHBondContact O-N 3.34Å; Q137-E140 PolarHBondContact O-N 3.47Å; Q137-E141 WeakPolarHBondContact O-CG 3.39Å; Q137-E141 PolarHBondContact O-N 3Å
138E97.4Very high97.6Very high91 Ų91110.7 Ų110.743%0.42551%0.506SS..Hα-helixtrans-59-47.5175.5-69.1164.4-166.100111R134 K135 E140 E141 E142R134-E138 WeakPolarHBondContact CG-OE1 3.35Å; R134-E138 IonicContact NE-OE1 3.2Å; R134-E138 PolarHBondContact NE-OE1 2.9Å; R134-E138 WeakPolarHBondContact O-CG 3.27Å; R134-E138 PolarHBondContact O-N 3.5Å; K135-E138 PolarHBondContact O-N 3.33Å; E138-E140 PolarHBondContact O-N 3.32Å; E138-E141 PolarHBondContact O-N 2.86Å; E138-E142 WeakPolarHBondContact O-CG 3.48Å; E138-E142 PolarHBondContact O-N 3.04Å
139E97Very high97.6Very high101 Ų101106.8 Ų106.847%0.47249%0.493SS..Hα-helixtrans-61.4-41.6176.3-71.3172.6-172.900112.5K135 R136 Q137 E142 W143K135-E139 WeakPolarHBondContact CE-OE1 3.36Å; K135-E139 IonicContact NZ-OE1 3.2Å; K135-E139 WeakPolarHBondContact O-CG 3.47Å; K135-E139 PolarHBondContact O-N 3.37Å; R136-E139 PolarHBondContact O-N 3.38Å; Q137-E139 PolarHBondContact O-N 3.34Å; E139-E142 PolarHBondContact O-N 3.33Å; E139-W143 WeakPolarHBondContact O-CB 3.35Å; E139-W143 PolarHBondContact O-N 3.36Å
140E97.5Very high97.6Very high129 Ų129109.7 Ų109.760%0.60351%0.507SS*.Hα-helixtrans-65.5-41.6176.7-78.4176.8-165.400112R136 Q137 E138 W143 Q144R136-E140 WeakPolarHBondContact O-CB 3.2Å; R136-E140 VanDerWaalsContact O-CG 3.31Å; R136-E140 WeakPolarHBondContact O-CG 3.3Å; R136-E140 PolarHBondContact O-N 2.9Å; Q137-E140 PolarHBondContact O-N 3.47Å; E138-E140 PolarHBondContact O-N 3.32Å; E140-W143 PolarHBondContact O-N 3.14Å; E140-Q144 VanDerWaalsContact O-CG 3.26Å; E140-Q144 WeakPolarHBondContact O-CG 3.19Å; E140-Q144 PolarHBondContact O-N 3.3Å
141E97.8Very high97.6Very high118 Ų118112.6 Ų112.655%0.55151%0.511SS*.Hα-helixtrans-63.8-42.9176.3-75.4-178.4-167.900111.8Q137 E138 Q144 K145Q137-E141 WeakPolarHBondContact O-CG 3.39Å; Q137-E141 PolarHBondContact O-N 3Å; E138-E141 PolarHBondContact O-N 2.86Å; E141-Q144 PolarHBondContact O-N 3.35Å; E141-K145 WeakPolarHBondContact O-CG 3.29Å; E141-K145 PolarHBondContact O-N 3.2Å
142E97.8Very high97.6Very high127 Ų127113.7 Ų113.759%0.59352%0.515SS*.Hα-helixtrans-62-44.6173.8-73.1-171.7167.300111.8E138 E139 Q144 K145 M146E138-E142 WeakPolarHBondContact O-CG 3.48Å; E138-E142 PolarHBondContact O-N 3.04Å; E139-E142 PolarHBondContact O-N 3.33Å; E142-Q144 VanDerWaalsContact C-N 3.3Å; E142-Q144 PolarHBondContact O-N 3.02Å; E142-K145 WeakPolarHBondContact O-CB 3.47Å; E142-K145 PolarHBondContact O-N 2.98Å; E142-M146 WeakPolarHBondContact O-CG 3.46Å; E142-M146 PolarHBondContact O-N 3.32Å
143W96.7Very high97.6Very high184 Ų184118 Ų11870%0.69753%0.531SS*.Hα-helixtrans-59.9-41.3176-176.3-108.2000112.1E139 E140 M146 K147E139-W143 WeakPolarHBondContact O-CB 3.35Å; E139-W143 PolarHBondContact O-N 3.36Å; E140-W143 PolarHBondContact O-N 3.14Å; W143-M146 PolarHBondContact O-N 2.97Å; W143-K147 WeakPolarHBondContact O-CB 3.49Å; W143-K147 PolarHBondContact O-N 3.47Å
144Q96.8Very high97.6Very high107 Ų107116.5 Ų116.550%0.554%0.536SS..Hα-helixtrans-66.4-39.6175.7-68.8-66.6-4.200112.3E140 E141 E142 K147 A148E140-Q144 VanDerWaalsContact O-CG 3.26Å; E140-Q144 WeakPolarHBondContact O-CG 3.19Å; E140-Q144 PolarHBondContact O-N 3.3Å; E141-Q144 PolarHBondContact O-N 3.35Å; E142-Q144 VanDerWaalsContact C-N 3.3Å; E142-Q144 PolarHBondContact O-N 3.02Å; Q144-K147 PolarHBondContact O-N 2.9Å; Q144-A148 WeakPolarHBondContact O-CB 3Å; Q144-A148 PolarHBondContact O-N 3.02Å
145K98.1Very high97.6Very high135 Ų135116.8 Ų116.859%0.58754%0.542SS*.Hα-helixtrans-60.3-45.9173-72.6170.6-174.81680111E141 E142 K147 A148 T149E141-K145 WeakPolarHBondContact O-CG 3.29Å; E141-K145 PolarHBondContact O-N 3.2Å; E142-K145 WeakPolarHBondContact O-CB 3.47Å; E142-K145 PolarHBondContact O-N 2.98Å; K145-K147 VanDerWaalsContact C-N 3.33Å; K145-K147 PolarHBondContact O-N 3.18Å; K145-A148 PolarHBondContact O-N 3.3Å; K145-T149 WeakPolarHBondContact O-CG2 3.42Å; K145-T149 PolarHBondContact O-N 3.35Å; K145-T149 PolarHBondContact O-OG1 3.44Å
146M97.3Very high97.6Very high126 Ų126118.7 Ų118.762%0.62155%0.547SS*.Hα-helixtrans-61.3-41.8176.2-70-63.4-78.600111.7E142 W143 T149 Q150E142-M146 WeakPolarHBondContact O-CG 3.46Å; E142-M146 PolarHBondContact O-N 3.32Å; W143-M146 PolarHBondContact O-N 2.97Å; M146-T149 PolarHBondContact O-OG1 3.45Å; M146-Q150 WeakPolarHBondContact O-CB 3.45Å; M146-Q150 PolarHBondContact O-N 3.05Å
147K98.3Very high97.6Very high89 Ų89118.3 Ų118.339%0.38755%0.553SS.*Hα-helixtrans-64.8-41.8175.6-167177-169.2177.70112.4W143 Q144 K145 Q150 R151W143-K147 WeakPolarHBondContact O-CB 3.49Å; W143-K147 PolarHBondContact O-N 3.47Å; Q144-K147 PolarHBondContact O-N 2.9Å; K145-K147 VanDerWaalsContact C-N 3.33Å; K145-K147 PolarHBondContact O-N 3.18Å; K147-Q150 PolarHBondContact O-N 3.46Å; K147-R151 VanDerWaalsContact CE-NH2 3.31Å; K147-R151 WeakPolarHBondContact O-CG 3.48Å; K147-R151 PolarHBondContact O-N 2.89Å
148A98.1Very high97.7Very high52 Ų52116.4 Ų116.443%0.4355%0.545SS..Hα-helixtrans-64.6-46.717800000111.5Q144 K145 Q150 R151 E152Q144-A148 WeakPolarHBondContact O-CB 3Å; Q144-A148 PolarHBondContact O-N 3.02Å; K145-A148 PolarHBondContact O-N 3.3Å; A148-Q150 VanDerWaalsContact C-N 3.27Å; A148-Q150 PolarHBondContact O-N 3Å; A148-R151 WeakPolarHBondContact O-CB 3.48Å; A148-R151 PolarHBondContact O-N 3.43Å; A148-E152 PolarHBondContact O-N 3.35Å
149T97.9Very high97.7Very high57 Ų57116.9 Ų116.935%0.3555%0.549SS..Hα-helixtrans-62.3-36176.558.20000112.1K145 M146 K153K145-T149 WeakPolarHBondContact O-CG2 3.42Å; K145-T149 PolarHBondContact O-N 3.35Å; K145-T149 PolarHBondContact O-OG1 3.44Å; M146-T149 PolarHBondContact O-OG1 3.45Å; T149-K153 WeakPolarHBondContact O-CB 3.49Å; T149-K153 VanDerWaalsContact O-CG 3.26Å; T149-K153 WeakPolarHBondContact O-CG 3.32Å; T149-K153 PolarHBondContact O-N 3.43Å
150Q97.6Very high97.7Very high149 Ų149117.9 Ų117.970%0.69655%0.552SS**Hα-helixtrans-69.4-39176.6-153.5-178.586.900111.8M146 K147 A148 K153 A154M146-Q150 WeakPolarHBondContact O-CB 3.45Å; M146-Q150 PolarHBondContact O-N 3.05Å; K147-Q150 PolarHBondContact O-N 3.46Å; A148-Q150 VanDerWaalsContact C-N 3.27Å; A148-Q150 PolarHBondContact O-N 3Å; Q150-K153 PolarHBondContact O-N 3.04Å; Q150-A154 WeakPolarHBondContact O-CB 3.33Å; Q150-A154 PolarHBondContact O-N 2.69Å
151R97.9Very high97.7Very high149 Ų149118.5 Ų118.556%0.56255%0.549SS*.Hα-helixtrans-63.2-45.6172.5-74.6171.8176.1161.4-8.8112.1K147 A148 K153 A154 E155K147-R151 VanDerWaalsContact CE-NH2 3.31Å; K147-R151 WeakPolarHBondContact O-CG 3.48Å; K147-R151 PolarHBondContact O-N 2.89Å; A148-R151 WeakPolarHBondContact O-CB 3.48Å; A148-R151 PolarHBondContact O-N 3.43Å; R151-K153 VanDerWaalsContact C-N 3.33Å; R151-K153 PolarHBondContact O-N 3.32Å; R151-A154 WeakPolarHBondContact O-CB 3.31Å; R151-A154 PolarHBondContact O-N 2.81Å; R151-A154 VanDerWaalsContact O-N 3.15Å; R151-E155 PolarHBondContact O-N 3.29Å
152E97.6Very high97.8Very high124 Ų124119.2 Ų119.258%0.57955%0.547SS*.Hα-helixtrans-60.6-43.1177-172.9-16716500111.1A148 A154 E155 R156A148-E152 PolarHBondContact O-N 3.35Å; E152-A154 VanDerWaalsContact C-N 3.33Å; E152-A154 PolarHBondContact O-N 3.35Å; E152-E155 PolarHBondContact O-N 2.97Å; E152-R156 VanDerWaalsContact O-CB 3.29Å; E152-R156 WeakPolarHBondContact O-CB 3.44Å; E152-R156 PolarHBondContact O-N 3.16Å
153K98.3Very high97.7Very high150 Ų150118.3 Ų118.365%0.65254%0.543SS*.Hα-helixtrans-60.3-42.5174.2-75.4172-177.2175.60111.9T149 Q150 R151 L157T149-K153 WeakPolarHBondContact O-CB 3.49Å; T149-K153 VanDerWaalsContact O-CG 3.26Å; T149-K153 WeakPolarHBondContact O-CG 3.32Å; T149-K153 PolarHBondContact O-N 3.43Å; Q150-K153 PolarHBondContact O-N 3.04Å; R151-K153 VanDerWaalsContact C-N 3.33Å; R151-K153 PolarHBondContact O-N 3.32Å; K153-L157 WeakPolarHBondContact O-CB 3.35Å; K153-L157 PolarHBondContact O-N 3.26Å
154A97.6Very high97.8Very high58 Ų58114.2 Ų114.248%0.47953%0.531SS..Hα-helixtrans-65-45.6177.600000111.8Q150 R151 E152 R156 L157 E158Q150-A154 WeakPolarHBondContact O-CB 3.33Å; Q150-A154 PolarHBondContact O-N 2.69Å; R151-A154 WeakPolarHBondContact O-CB 3.31Å; R151-A154 PolarHBondContact O-N 2.81Å; R151-A154 VanDerWaalsContact O-N 3.15Å; E152-A154 VanDerWaalsContact C-N 3.33Å; E152-A154 PolarHBondContact O-N 3.35Å; A154-R156 PolarHBondContact O-N 2.93Å; A154-L157 PolarHBondContact O-N 3.13Å; A154-E158 WeakPolarHBondContact O-CB 3.47Å; A154-E158 PolarHBondContact O-N 3.42Å
155E97.9Very high97.8Very high138 Ų138111.5 Ų111.565%0.64552%0.52SS*.Hα-helixtrans-60.9-45.1176.2-176.5-178.3175.100111.3R151 E152 L157 E158 L159R151-E155 PolarHBondContact O-N 3.29Å; E152-E155 PolarHBondContact O-N 2.97Å; E155-L157 VanDerWaalsContact C-N 3.3Å; E155-L157 PolarHBondContact O-N 3.42Å; E155-E158 PolarHBondContact O-N 2.95Å; E155-L159 WeakPolarHBondContact O-CB 3.26Å; E155-L159 PolarHBondContact O-N 2.84Å
156R98.1Very high97.8Very high163 Ų163110.4 Ų110.462%0.61552%0.517SS*.Hα-helixtrans-60.4-40.5176.5-176.3175.8-177.7175.1-0.2112.1E152 A154 K160E152-R156 VanDerWaalsContact O-CB 3.29Å; E152-R156 WeakPolarHBondContact O-CB 3.44Å; E152-R156 PolarHBondContact O-N 3.16Å; A154-R156 PolarHBondContact O-N 2.93Å; R156-K160 WeakPolarHBondContact O-CG 3.15Å; R156-K160 PolarHBondContact O-N 3Å
157L97.7Very high97.7Very high122 Ų122113 Ų11364%0.63952%0.52SS*.Hα-helixtrans-68.1-42.5176.8-174.767.5000111.2K153 A154 E155 L159 K160 R161K153-L157 WeakPolarHBondContact O-CB 3.35Å; K153-L157 PolarHBondContact O-N 3.26Å; A154-L157 PolarHBondContact O-N 3.13Å; E155-L157 VanDerWaalsContact C-N 3.3Å; E155-L157 PolarHBondContact O-N 3.42Å; L157-L159 VanDerWaalsContact C-N 3.35Å; L157-L159 PolarHBondContact O-N 2.87Å; L157-K160 PolarHBondContact O-N 2.83Å; L157-R161 PolarHBondContact O-N 2.98Å
158E97.4Very high97.6Very high76 Ų76116.2 Ų116.236%0.35553%0.53SS..Hα-helixtrans-62.6-42.4177.3-169.1-176.317500111.6A154 E155 K160 R161 R162A154-E158 WeakPolarHBondContact O-CB 3.47Å; A154-E158 PolarHBondContact O-N 3.42Å; E155-E158 PolarHBondContact O-N 2.95Å; E158-K160 VanDerWaalsContact C-N 3.33Å; E158-K160 PolarHBondContact O-N 3.43Å; E158-R161 WeakPolarHBondContact O-CB 3.47Å; E158-R161 PolarHBondContact O-N 3.47Å; E158-R162 WeakPolarHBondContact O-CG 3.42Å; E158-R162 PolarHBondContact O-N 3.02Å; E158-R162 IonicContact OE1-CZ 3.28Å; E158-R162 VanDerWaalsContact OE1-CZ 3.28Å; E158-R162 IonicContact OE1-NE 3.16Å; E158-R162 PolarHBondContact OE1-NE 2.96Å; E158-R162 VanDerWaalsContact OE1-NE 3.16Å; E158-R162 IonicContact OE1-NH2 3.3Å; E158-R162 PolarHBondContact OE1-NH2 2.89Å
159L97.9Very high97.6Very high100 Ų100122.4 Ų122.452%0.52454%0.542SS..Hα-helixtrans-60.3-43.3176.4-172.668.1000111.5E155 L157 R162 Q163E155-L159 WeakPolarHBondContact O-CB 3.26Å; E155-L159 PolarHBondContact O-N 2.84Å; L157-L159 VanDerWaalsContact C-N 3.35Å; L157-L159 PolarHBondContact O-N 2.87Å; L159-R162 PolarHBondContact O-N 3.38Å; L159-Q163 WeakPolarHBondContact O-CG 3.46Å; L159-Q163 PolarHBondContact O-N 3.21Å
160K97.9Very high97.5Very high122 Ų122125.8 Ų125.853%0.5355%0.554SS.*Hα-helixtrans-61.6-44.6174.2-74.9-176.6177.2-173.70111.9R156 L157 E158 R162 Q163 E164R156-K160 WeakPolarHBondContact O-CG 3.15Å; R156-K160 PolarHBondContact O-N 3Å; L157-K160 PolarHBondContact O-N 2.83Å; E158-K160 VanDerWaalsContact C-N 3.33Å; E158-K160 PolarHBondContact O-N 3.43Å; K160-R162 VanDerWaalsContact C-N 3.33Å; K160-R162 PolarHBondContact O-N 3.01Å; K160-Q163 PolarHBondContact O-N 3.18Å; K160-E164 PolarHBondContact O-N 3.02Å
161R98Very high97.4Very high142 Ų142124.1 Ų124.154%0.53655%0.549SS..Hα-helixtrans-59.2-45.7176.8-163.1-168.788.2-144.15.2111.1L157 E158 Q163 E164 D165L157-R161 PolarHBondContact O-N 2.98Å; E158-R161 WeakPolarHBondContact O-CB 3.47Å; E158-R161 PolarHBondContact O-N 3.47Å; R161-Q163 VanDerWaalsContact C-N 3.34Å; R161-Q163 PolarHBondContact O-N 3.08Å; R161-E164 PolarHBondContact O-N 3.41Å; R161-D165 IonicContact NE-OD2 2.68Å; R161-D165 WeakPolarHBondContact O-CB 3.41Å; R161-D165 VanDerWaalsContact O-CG 3.26Å; R161-D165 PolarHBondContact O-N 2.67Å
162R98.1Very high97.3Very high133 Ų133123.8 Ų123.850%0.50255%0.552SS.*Hα-helixtrans-60.6-41177.3-72177.9-176.4-169.22.5112.1E158 L159 K160 D165 Q166E158-R162 WeakPolarHBondContact O-CG 3.42Å; E158-R162 PolarHBondContact O-N 3.02Å; E158-R162 IonicContact OE1-CZ 3.28Å; E158-R162 VanDerWaalsContact OE1-CZ 3.28Å; E158-R162 IonicContact OE1-NE 3.16Å; E158-R162 PolarHBondContact OE1-NE 2.96Å; E158-R162 VanDerWaalsContact OE1-NE 3.16Å; E158-R162 IonicContact OE1-NH2 3.3Å; E158-R162 PolarHBondContact OE1-NH2 2.89Å; L159-R162 PolarHBondContact O-N 3.38Å; K160-R162 VanDerWaalsContact C-N 3.33Å; K160-R162 PolarHBondContact O-N 3.01Å; R162-D165 PolarHBondContact O-N 3.38Å; R162-Q166 WeakPolarHBondContact O-CB 3.47Å; R162-Q166 VanDerWaalsContact O-CG 3.27Å; R162-Q166 WeakPolarHBondContact O-CG 3.39Å; R162-Q166 PolarHBondContact O-N 3.24Å
163Q97.6Very high97.2Very high109 Ų109123.4 Ų123.451%0.50955%0.55SS..Hα-helixtrans-65.5-42.1175.7-73.4-179.511.300112.4L159 K160 R161 Q166 R167L159-Q163 WeakPolarHBondContact O-CG 3.46Å; L159-Q163 PolarHBondContact O-N 3.21Å; K160-Q163 PolarHBondContact O-N 3.18Å; R161-Q163 VanDerWaalsContact C-N 3.34Å; R161-Q163 PolarHBondContact O-N 3.08Å; Q163-Q166 PolarHBondContact O-N 3.09Å; Q163-R167 WeakPolarHBondContact O-CG 3.38Å; Q163-R167 PolarHBondContact O-N 2.98Å
164E97.3Very high97.1Very high98 Ų98119.6 Ų119.646%0.45854%0.542SS..Hα-helixtrans-65.1-43.6176-170.6-177.2169.900111.5K160 R161 Q166 R167 R168K160-E164 PolarHBondContact O-N 3.02Å; R161-E164 PolarHBondContact O-N 3.41Å; E164-Q166 VanDerWaalsContact C-N 3.29Å; E164-Q166 PolarHBondContact O-N 3.2Å; E164-R167 PolarHBondContact O-N 2.85Å; E164-R168 WeakPolarHBondContact O-CG 3.36Å; E164-R168 PolarHBondContact O-N 2.84Å; E164-R168 IonicContact OE1-CZ 2.98Å; E164-R168 VanDerWaalsContact OE1-CZ 3.3Å; E164-R168 IonicContact OE1-NE 3.18Å; E164-R168 PolarHBondContact OE1-NE 3.39Å; E164-R168 IonicContact OE1-NH2 2.69Å; E164-R168 PolarHBondContact OE1-NH2 2.82Å
165D97.1Very high97Very high50 Ų50120.7 Ų120.727%0.26754%0.54SS..Hα-helixtrans-60.4-39.6175.8-72.5-24.2000111.3R161 R162 R168 R169R161-D165 IonicContact NE-OD2 2.68Å; R161-D165 WeakPolarHBondContact O-CB 3.41Å; R161-D165 VanDerWaalsContact O-CG 3.26Å; R161-D165 PolarHBondContact O-N 2.67Å; R162-D165 PolarHBondContact O-N 3.38Å; D165-R168 PolarHBondContact O-N 3Å; D165-R169 WeakPolarHBondContact O-CB 3.18Å; D165-R169 WeakPolarHBondContact O-CG 3.47Å; D165-R169 PolarHBondContact O-N 2.92Å
166Q97.4Very high96.8Very high112 Ų112118.5 Ų118.552%0.52353%0.53SS..Hα-helixtrans-62.5-48.3173.2-76.8172.67.200111.6R162 Q163 E164 R168 R169 E170R162-Q166 WeakPolarHBondContact O-CB 3.47Å; R162-Q166 VanDerWaalsContact O-CG 3.27Å; R162-Q166 WeakPolarHBondContact O-CG 3.39Å; R162-Q166 PolarHBondContact O-N 3.24Å; Q163-Q166 PolarHBondContact O-N 3.09Å; E164-Q166 VanDerWaalsContact C-N 3.29Å; E164-Q166 PolarHBondContact O-N 3.2Å; Q166-R168 VanDerWaalsContact C-N 3.33Å; Q166-R168 PolarHBondContact O-N 3.36Å; Q166-R169 WeakPolarHBondContact O-CB 3.41Å; Q166-R169 PolarHBondContact O-N 3.33Å; Q166-R169 VanDerWaalsContact O-N 3.12Å; Q166-E170 WeakPolarHBondContact O-CG 3.26Å; Q166-E170 PolarHBondContact O-N 3.37Å
167R96.5Very high96.7Very high181 Ų181113.5 Ų113.568%0.68352%0.517SS*.Hα-helixtrans-58.8-42.5175.9-75.9179.2154.7-154.8-6.4112.6Q163 E164 R169 E170 L171Q163-R167 WeakPolarHBondContact O-CG 3.38Å; Q163-R167 PolarHBondContact O-N 2.98Å; E164-R167 PolarHBondContact O-N 2.85Å; R167-R169 VanDerWaalsContact C-N 3.34Å; R167-E170 PolarHBondContact O-N 3.47Å; R167-L171 WeakPolarHBondContact O-CG 3.24Å; R167-L171 PolarHBondContact O-N 3.39Å
168R96.9Very high96.6Very high155 Ų155116.7 Ų116.759%0.58552%0.521SS*.Hα-helixtrans-62.5-41.8175.7-73177.7-176.9-156.93.2111.3E164 D165 Q166 F172E164-R168 WeakPolarHBondContact O-CG 3.36Å; E164-R168 PolarHBondContact O-N 2.84Å; E164-R168 IonicContact OE1-CZ 2.98Å; E164-R168 VanDerWaalsContact OE1-CZ 3.3Å; E164-R168 IonicContact OE1-NE 3.18Å; E164-R168 PolarHBondContact OE1-NE 3.39Å; E164-R168 IonicContact OE1-NH2 2.69Å; E164-R168 PolarHBondContact OE1-NH2 2.82Å; D165-R168 PolarHBondContact O-N 3Å; Q166-R168 VanDerWaalsContact C-N 3.33Å; Q166-R168 PolarHBondContact O-N 3.36Å; R168-F172 VanDerWaalsContact O-CB 3.32Å; R168-F172 WeakPolarHBondContact O-CB 3.2Å; R168-F172 PolarHBondContact O-N 3.48Å
169R96.4Very high96.5Very high183 Ų183120 Ų12069%0.69153%0.534SS*.Hα-helixtrans-65.6-42.4176.1-73170.3-172-165.92.6112.1D165 Q166 R167 F172 H173D165-R169 WeakPolarHBondContact O-CB 3.18Å; D165-R169 WeakPolarHBondContact O-CG 3.47Å; D165-R169 PolarHBondContact O-N 2.92Å; Q166-R169 WeakPolarHBondContact O-CB 3.41Å; Q166-R169 PolarHBondContact O-N 3.33Å; Q166-R169 VanDerWaalsContact O-N 3.12Å; R167-R169 VanDerWaalsContact C-N 3.34Å; R169-F172 PolarHBondContact O-N 2.97Å; R169-H173 WeakPolarHBondContact O-CB 3.42Å; R169-H173 PolarHBondContact O-N 2.84Å
170E96.3Very high96.4Very high127 Ų127119.6 Ų119.659%0.59353%0.532SS*.Hα-helixtrans-62.2-46.1176.8-74.1170.3-173.600111.7Q166 R167 H173 S174Q166-E170 WeakPolarHBondContact O-CG 3.26Å; Q166-E170 PolarHBondContact O-N 3.37Å; R167-E170 PolarHBondContact O-N 3.47Å; E170-H173 PolarHBondContact O-N 3.45Å; E170-S174 WeakPolarHBondContact O-CB 3.31Å; E170-S174 PolarHBondContact O-N 3.1Å
171L95.6Very high96.2Very high115 Ų115117.9 Ų117.960%0.60253%0.529SS*.Hα-helixtrans-61-48.5175.2-74.8168.3000111.5R167 H173 S174 D175R167-L171 WeakPolarHBondContact O-CG 3.24Å; R167-L171 PolarHBondContact O-N 3.39Å; L171-H173 VanDerWaalsContact C-N 3.29Å; L171-H173 PolarHBondContact O-N 3.27Å; L171-S174 PolarHBondContact O-N 3.45Å; L171-D175 PolarHBondContact O-N 3.42Å
172F96.6Very high96Very high142 Ų142113.7 Ų113.762%0.62352%0.522SS*.Hα-helixtrans-60-41.8177.1180-97.2000111.7R168 R169 D175 Q176R168-F172 VanDerWaalsContact O-CB 3.32Å; R168-F172 WeakPolarHBondContact O-CB 3.2Å; R168-F172 PolarHBondContact O-N 3.48Å; R169-F172 PolarHBondContact O-N 2.97Å; F172-D175 PolarHBondContact O-N 3.39Å; F172-Q176 VanDerWaalsContact O-CB 3.28Å; F172-Q176 WeakPolarHBondContact O-CB 3.38Å; F172-Q176 PolarHBondContact O-N 2.96Å
173H95.5Very high95.9Very high116 Ų116113.2 Ų113.254%0.53752%0.523SS..Hα-helixtrans-64.8-43.5177.4-169.556.9000111.5R169 E170 L171 D175 Q176 T177R169-H173 WeakPolarHBondContact O-CB 3.42Å; R169-H173 PolarHBondContact O-N 2.84Å; E170-H173 PolarHBondContact O-N 3.45Å; L171-H173 VanDerWaalsContact C-N 3.29Å; L171-H173 PolarHBondContact O-N 3.27Å; H173-D175 PolarHBondContact O-N 3.1Å; H173-Q176 WeakPolarHBondContact O-CB 3.44Å; H173-Q176 PolarHBondContact O-N 3.36Å; H173-T177 WeakPolarHBondContact O-CG2 3.31Å; H173-T177 PolarHBondContact O-N 3.35Å; H173-T177 PolarHBondContact O-OG1 2.91Å
174S94.8Very high95.8Very high69 Ų69112.4 Ų112.448%0.48352%0.522SS..Hα-helixtrans-63.5-38.8175.4-1750000112.8E170 L171 T177 R178E170-S174 WeakPolarHBondContact O-CB 3.31Å; E170-S174 PolarHBondContact O-N 3.1Å; L171-S174 PolarHBondContact O-N 3.45Å; S174-T177 WeakPolarHBondContact CA-OG1 3.37Å; S174-T177 PolarHBondContact O-OG1 3.2Å; S174-R178 WeakPolarHBondContact O-CB 3.5Å; S174-R178 PolarHBondContact O-N 2.93Å
175D95.2Very high95.5Very high81 Ų81113.3 Ų113.343%0.43353%0.526SS..Hα-helixtrans-69.3-38.1175.4-81.2-16.9000111.2L171 F172 H173 K179L171-D175 PolarHBondContact O-N 3.42Å; F172-D175 PolarHBondContact O-N 3.39Å; H173-D175 PolarHBondContact O-N 3.1Å; D175-K179 WeakPolarHBondContact O-CB 3.3Å; D175-K179 VanDerWaalsContact O-CG 3.27Å; D175-K179 WeakPolarHBondContact O-CG 3.46Å; D175-K179 PolarHBondContact O-N 3.46Å
176Q95.6Very high95.3Very high93 Ų93116 Ų11644%0.43554%0.54SS..Hα-helixtrans-63.9-45.5176.5-175.6175.516.100111.5F172 H173 K179 N180F172-Q176 VanDerWaalsContact O-CB 3.28Å; F172-Q176 WeakPolarHBondContact O-CB 3.38Å; F172-Q176 PolarHBondContact O-N 2.96Å; H173-Q176 WeakPolarHBondContact O-CB 3.44Å; H173-Q176 PolarHBondContact O-N 3.36Å; Q176-K179 PolarHBondContact O-N 2.91Å; Q176-N180 WeakPolarHBondContact O-CB 3.14Å; Q176-N180 PolarHBondContact O-N 3.48Å
177T94.9Very high95.1Very high58 Ų58114.9 Ų114.936%0.35654%0.538SS..Hα-helixtrans-62.7-48.417652.60000110.7H173 S174 K179 N180 D181H173-T177 WeakPolarHBondContact O-CG2 3.31Å; H173-T177 PolarHBondContact O-N 3.35Å; H173-T177 PolarHBondContact O-OG1 2.91Å; S174-T177 WeakPolarHBondContact CA-OG1 3.37Å; S174-T177 PolarHBondContact O-OG1 3.2Å; T177-K179 VanDerWaalsContact C-N 3.3Å; T177-K179 PolarHBondContact O-N 2.95Å; T177-N180 PolarHBondContact O-N 3.36Å; T177-N180 VanDerWaalsContact O-N 3.13Å; T177-D181 VanDerWaalsContact O-CG 3.28Å; T177-D181 PolarHBondContact O-N 3.11Å
178R95.8Very high94.7Very high188 Ų188112.8 Ų112.871%0.70954%0.536SS*.Hα-helixtrans-56.4-43176.6-176-177.4175.3-173.30.3112.5S174 S182S174-R178 WeakPolarHBondContact O-CB 3.5Å; S174-R178 PolarHBondContact O-N 2.93Å; R178-S182 WeakPolarHBondContact O-CB 3.21Å; R178-S182 PolarHBondContact O-N 3.41Å; R178-S182 PolarHBondContact O-OG 3.42Å
179K95.4Very high94Very high146 Ų146114.7 Ų114.764%0.63554%0.543SS*.Hα-helixtrans-65.7-45.6176.9-76.7174.1-177.7173.90111.5D175 Q176 T177 D181 S182 F183D175-K179 WeakPolarHBondContact O-CB 3.3Å; D175-K179 VanDerWaalsContact O-CG 3.27Å; D175-K179 WeakPolarHBondContact O-CG 3.46Å; D175-K179 PolarHBondContact O-N 3.46Å; Q176-K179 PolarHBondContact O-N 2.91Å; T177-K179 VanDerWaalsContact C-N 3.3Å; T177-K179 PolarHBondContact O-N 2.95Å; K179-D181 PolarHBondContact O-N 2.89Å; K179-S182 PolarHBondContact O-N 2.83Å; K179-S182 PolarHBondContact O-OG 2.95Å; K179-F183 WeakPolarHBondContact O-CB 3.26Å; K179-F183 PolarHBondContact O-N 2.82Å
180N95.2Very high93.2Very high92 Ų92110 Ų11049%0.49254%0.543SS..Hα-helixtrans-58.9-46.6175.6-93.8-0.9000111.6Q176 T177 S182 F183 L184Q176-N180 WeakPolarHBondContact O-CB 3.14Å; Q176-N180 PolarHBondContact O-N 3.48Å; T177-N180 PolarHBondContact O-N 3.36Å; T177-N180 VanDerWaalsContact O-N 3.13Å; N180-S182 VanDerWaalsContact C-N 3.35Å; N180-S182 PolarHBondContact O-N 3.16Å; N180-F183 WeakPolarHBondContact O-CB 3.35Å; N180-F183 PolarHBondContact O-N 3.44Å; N180-F183 VanDerWaalsContact O-N 3.15Å; N180-L184 WeakPolarHBondContact O-CG 3.13Å; N180-L184 PolarHBondContact O-N 3.38Å
181D94.8Very high92Very high85 Ų85107.9 Ų107.946%0.45555%0.547SS..Hα-helixtrans-63.1-42.4178.9-66.7-16.2000111.2T177 K179 F183 L184 Q185T177-D181 VanDerWaalsContact O-CG 3.28Å; T177-D181 PolarHBondContact O-N 3.11Å; K179-D181 PolarHBondContact O-N 2.89Å; D181-F183 VanDerWaalsContact C-N 3.28Å; D181-F183 PolarHBondContact O-N 3.4Å; D181-L184 PolarHBondContact O-N 3.47Å; D181-Q185 WeakPolarHBondContact O-CB 3.31Å; D181-Q185 WeakPolarHBondContact O-CG 3.48Å; D181-Q185 PolarHBondContact O-N 2.83Å
182S94Very high90.3Very high55 Ų55104.9 Ų104.939%0.38554%0.539SS..Hα-helixtrans-62.8-35.8175.473.90000112.7R178 K179 N180 N186R178-S182 WeakPolarHBondContact O-CB 3.21Å; R178-S182 PolarHBondContact O-N 3.41Å; R178-S182 PolarHBondContact O-OG 3.42Å; K179-S182 PolarHBondContact O-N 2.83Å; K179-S182 PolarHBondContact O-OG 2.95Å; N180-S182 VanDerWaalsContact C-N 3.35Å; N180-S182 PolarHBondContact O-N 3.16Å; S182-N186 WeakPolarHBondContact O-CB 3.32Å; S182-N186 VanDerWaalsContact O-CG 3.3Å; S182-N186 PolarHBondContact O-N 2.89Å; S182-N186 PolarHBondContact O-ND2 2.88Å
183F95.8Very high88.3Confident122 Ų122104.8 Ų104.854%0.53555%0.553SS.*Hα-helixtrans-68.5-44.5175.9174.3-100.2000111.3K179 N180 D181 N186 L187K179-F183 WeakPolarHBondContact O-CB 3.26Å; K179-F183 PolarHBondContact O-N 2.82Å; N180-F183 WeakPolarHBondContact O-CB 3.35Å; N180-F183 PolarHBondContact O-N 3.44Å; N180-F183 VanDerWaalsContact O-N 3.15Å; D181-F183 VanDerWaalsContact C-N 3.28Å; D181-F183 PolarHBondContact O-N 3.4Å; F183-N186 PolarHBondContact O-N 2.94Å; F183-L187 HydrophobicContact CD1-CD1 4Å; F183-L187 HydrophobicContact CE1-CD1 3.38Å; F183-L187 HydrophobicContact CE1-CG 4.16Å; F183-L187 HydrophobicContact CZ-CD1 3.68Å; F183-L187 HydrophobicContact CZ-CD2 4.43Å; F183-L187 HydrophobicContact CZ-CG 4.12Å; F183-L187 PolarHBondContact O-N 3.05Å
184L94.5Very high86.2Confident92 Ų92104.5 Ų104.548%0.48256%0.564SS.*Hα-helixtrans-61.9-45.7175.6-69.4173.5000111.6N180 D181 N186 L187 E188N180-L184 WeakPolarHBondContact O-CG 3.13Å; N180-L184 PolarHBondContact O-N 3.38Å; D181-L184 PolarHBondContact O-N 3.47Å; L184-N186 VanDerWaalsContact C-N 3.29Å; L184-N186 PolarHBondContact O-N 2.78Å; L184-L187 WeakPolarHBondContact O-CB 3.48Å; L184-L187 PolarHBondContact O-N 3.49Å; L184-L187 VanDerWaalsContact O-N 3.13Å; L184-E188 WeakPolarHBondContact O-CG 3.2Å; L184-E188 PolarHBondContact O-N 2.92Å
185Q92.1Very high84Confident118 Ų118105.3 Ų105.355%0.55158%0.583SS**Hα-helixtrans-60.8-36.7175.6-73.5177.61300112.7D181 E188 R189D181-Q185 WeakPolarHBondContact O-CB 3.31Å; D181-Q185 WeakPolarHBondContact O-CG 3.48Å; D181-Q185 PolarHBondContact O-N 2.83Å; Q185-E188 PolarHBondContact O-N 3.45Å; Q185-R189 VanDerWaalsContact O-CB 3.3Å; Q185-R189 WeakPolarHBondContact O-CB 3.29Å; Q185-R189 PolarHBondContact O-N 2.87Å
186N92.8Very high81.7Confident105 Ų105104.9 Ų104.956%0.56160%0.598SS**Hα-helixtrans-68-39.6174.9-79.6-15.3000111.9S182 F183 L184 R189 A190S182-N186 WeakPolarHBondContact O-CB 3.32Å; S182-N186 VanDerWaalsContact O-CG 3.3Å; S182-N186 PolarHBondContact O-N 2.89Å; S182-N186 PolarHBondContact O-ND2 2.88Å; F183-N186 PolarHBondContact O-N 2.94Å; L184-N186 VanDerWaalsContact C-N 3.29Å; L184-N186 PolarHBondContact O-N 2.78Å; N186-R189 PolarHBondContact O-N 3.21Å; N186-A190 VanDerWaalsContact O-CB 3.3Å; N186-A190 WeakPolarHBondContact O-CB 3.35Å; N186-A190 PolarHBondContact O-N 2.79Å
187L91.9Very high79.2Confident89 Ų89104.7 Ų104.747%0.46661%0.612SS.*Hα-helixtrans-63.5-43.7173-75177.2000111.6F183 L184 A190 A191F183-L187 HydrophobicContact CD1-CD1 4Å; F183-L187 HydrophobicContact CE1-CD1 3.38Å; F183-L187 HydrophobicContact CE1-CG 4.16Å; F183-L187 HydrophobicContact CZ-CD1 3.68Å; F183-L187 HydrophobicContact CZ-CD2 4.43Å; F183-L187 HydrophobicContact CZ-CG 4.12Å; F183-L187 PolarHBondContact O-N 3.05Å; L184-L187 WeakPolarHBondContact O-CB 3.48Å; L184-L187 PolarHBondContact O-N 3.49Å; L184-L187 VanDerWaalsContact O-N 3.13Å; L187-A190 CarbonylContact O-C 3.58Å; L187-A190 PolarHBondContact O-N 3.42Å; L187-A191 VanDerWaalsContact O-CB 3.3Å; L187-A191 WeakPolarHBondContact O-CB 3.4Å; L187-A191 PolarHBondContact O-N 3.33Å
188E88.6Confident77.3Confident138 Ų138106.6 Ų106.665%0.64563%0.634SS**Hα-helixtrans-62.6-42.2176.1-73.8176.7-178.300111.7L184 Q185 A190 A191 A192L184-E188 WeakPolarHBondContact O-CG 3.2Å; L184-E188 PolarHBondContact O-N 2.92Å; Q185-E188 PolarHBondContact O-N 3.45Å; E188-A190 VanDerWaalsContact C-N 3.33Å; E188-A190 PolarHBondContact O-N 3.09Å; E188-A191 CarbonylContact O-C 3.52Å; E188-A191 PolarHBondContact O-N 3.35Å; E188-A192 PolarHBondContact O-N 3.3Å
189R83.4Confident74.9Confident194 Ų194105.5 Ų105.573%0.73264%0.636SS**Hα-helixtrans-64.9-37.1175-172.5-175.7-62.7-117-0.8112.2Q185 N186 A191Q185-R189 VanDerWaalsContact O-CB 3.3Å; Q185-R189 WeakPolarHBondContact O-CB 3.29Å; Q185-R189 PolarHBondContact O-N 2.87Å; N186-R189 PolarHBondContact O-N 3.21Å; R189-A191 VanDerWaalsContact C-N 3.31Å
190A79.1Confident72.5Confident85 Ų85104.8 Ų104.870%0.70265%0.645SS**Hα-helixtrans-72-25.9174.400000112.6N186 L187 E188N186-A190 VanDerWaalsContact O-CB 3.3Å; N186-A190 WeakPolarHBondContact O-CB 3.35Å; N186-A190 PolarHBondContact O-N 2.79Å; L187-A190 CarbonylContact O-C 3.58Å; L187-A190 PolarHBondContact O-N 3.42Å; E188-A190 VanDerWaalsContact C-N 3.33Å; E188-A190 PolarHBondContact O-N 3.09Å
191A71.6Confident70.2Confident82 Ų82105.4 Ų105.468%0.67866%0.656SS**Hα-helixtrans-87.2-14.6175.700000113.6L187 E188 R189L187-A191 VanDerWaalsContact O-CB 3.3Å; L187-A191 WeakPolarHBondContact O-CB 3.4Å; L187-A191 PolarHBondContact O-N 3.33Å; E188-A191 CarbonylContact O-C 3.52Å; E188-A191 PolarHBondContact O-N 3.35Å; R189-A191 VanDerWaalsContact C-N 3.31Å
192A59.7Low67.6Low52 Ų52107.6 Ų107.643%0.4367%0.673SS.*SBendtrans-62.6136.1171.200000109.7E188 S194E188-A192 PolarHBondContact O-N 3.3Å; A192-S194 VanDerWaalsContact C-N 3.32Å; A192-S194 PolarHBondContact O-N 3.32Å
193P54.7Low65.2Low140 Ų140110.4 Ų110.491%0.90969%0.688SS**SBendtrans-74.784.4-168.430.7-35000111
194S50.1Low62.8Low111 Ų111112 Ų11278%0.77670%0.702SS**  trans-116.5108.2156.4-178.90000106.5A192 G196A192-S194 VanDerWaalsContact C-N 3.32Å; A192-S194 PolarHBondContact O-N 3.32Å; S194-G196 PolarHBondContact O-N 2.98Å
195G49.5Very low60.6Low86 Ų86115.7 Ų115.789%0.88771%0.714SS**  trans-53.6130-170.400000113.4
196G46.6Very low58.5Low71 Ų71115.4 Ų115.473%0.73272%0.72SS**  trans156.2101.6167.200000115.4S194S194-G196 PolarHBondContact O-N 2.98Å
197A43.4Very low56.5Low89 Ų89114.9 Ų114.974%0.73673%0.725SS**  trans66.5124.2146.200000121
198A54Low54.5Low99 Ų99117.3 Ų117.382%0.81874%0.738SS**  trans-76.6140.9173.300000113.7
199H45.2Very low52.7Low164 Ų164116.8 Ų116.876%0.75974%0.736SS**  trans-147.2113.5153.5-6.4-69.4000112.6
200T46Very low51.2Low132 Ų132113 Ų11381%0.8173%0.726SS**  trans14127.1146.461.40000122.7
201S46.6Very low49.8Very low104 Ų104111.9 Ų111.973%0.72772%0.717SS**  35122.2122.8-166.50000119.8
202T40.9Very low49Very low132 Ų132109.8 Ų109.881%0.8170%0.703SS**  trans-157.7120.4136.1-72.40000110.8
203T42.8Very low49.1Very low113 Ų113112.8 Ų112.869%0.69371%0.707SS**  trans-49.9126.7175.4-2.20000114.4K205T203-K205 PolarHBondContact O-N 3.46Å; T203-K205 VanDerWaalsContact O-N 3.15Å
204N45.1Very low49.2Very low156 Ų156112.4 Ų112.483%0.83470%0.696SS**  trans-67103164.4-78-14.2000110.2
205K49.3Very low49.8Very low169 Ų169110.5 Ų110.574%0.73568%0.681SS**  trans-126.232.2173.8-97.2-164.7176.2-173.60112.4T203T203-K205 PolarHBondContact O-N 3.46Å; T203-K205 VanDerWaalsContact O-N 3.15Å
206V48Very low50.7Low112 Ų112115.4 Ų115.468%0.67967%0.672SS**SBendtrans-107.2-21.1-174.9-1760000112.8
207S51.1Low52.1Low95 Ų95115.5 Ų115.566%0.66466%0.662SS**Hα-helixtrans-72.8-34.6-174.1-36.20000114.1
208D48.9Very low53.8Low140 Ų140116.2 Ų116.275%0.74965%0.651SS**Hα-helixtrans-81.3-23.4-174.8-64.3-32.1000113.6G212D208-G212 PolarHBondContact O-N 3.48Å
209Q50.7Low55.2Low126 Ų126117.1 Ų117.159%0.58964%0.638SS**Hα-helixtrans-73.9-35.3179.7-81.2-171.83800112.8G212 K213Q209-G212 PolarHBondContact O-N 3.45Å; Q209-K213 VanDerWaalsContact O-CG 3.24Å; Q209-K213 WeakPolarHBondContact O-CG 3.45Å; Q209-K213 PolarHBondContact O-N 3.44Å
210E51Low57.1Low114 Ų114115.7 Ų115.753%0.53363%0.632SS.*Hα-helixtrans-72.7-38.5-179.6-69.9-67.512000111.3K213 L214E210-K213 PolarHBondContact O-N 3.3Å; E210-K213 IonicContact OE1-NZ 2.9Å; E210-K213 PolarHBondContact OE1-NZ 2.98Å; E210-L214 PolarHBondContact O-N 3.14Å
211A51.4Low59.1Low62 Ų62114.1 Ų114.151%0.51262%0.618SS.*Hα-helixtrans-66.2-36.9173.500000112.6T215A211-T215 WeakPolarHBondContact O-CG2 3.35Å; A211-T215 PolarHBondContact O-N 3.5Å; A211-T215 PolarHBondContact O-OG1 2.9Å
212G54Low61.1Low38 Ų38114.9 Ų114.939%0.39261%0.61SS.*Hα-helixtrans-70.3-32.9175.600000114.4D208 Q209 T215 R216D208-G212 PolarHBondContact O-N 3.48Å; Q209-G212 PolarHBondContact O-N 3.45Å; G212-T215 WeakPolarHBondContact CA-OG1 3.38Å; G212-T215 PolarHBondContact O-OG1 2.81Å; G212-R216 VanDerWaalsContact O-CB 3.28Å; G212-R216 WeakPolarHBondContact O-CB 3.4Å; G212-R216 PolarHBondContact O-N 3.4Å
213K61.1Low63.5Low115 Ų115114 Ų11450%0.560%0.6SS.*Hα-helixtrans-70.8-40175.8-73.2168.7-166.8171.30112.2Q209 E210 S217Q209-K213 VanDerWaalsContact O-CG 3.24Å; Q209-K213 WeakPolarHBondContact O-CG 3.45Å; Q209-K213 PolarHBondContact O-N 3.44Å; E210-K213 PolarHBondContact O-N 3.3Å; E210-K213 IonicContact OE1-NZ 2.9Å; E210-K213 PolarHBondContact OE1-NZ 2.98Å; K213-S217 VanDerWaalsContact O-CB 3.29Å; K213-S217 WeakPolarHBondContact O-CB 3.3Å; K213-S217 PolarHBondContact O-N 3.23Å
214L58.1Low65.8Low132 Ų132112.8 Ų112.869%0.69159%0.586SS**Hα-helixtrans-71.5-37.9-176.4-141.6149.8000111.8E210 M218E210-L214 PolarHBondContact O-N 3.14Å; L214-M218 WeakPolarHBondContact O-CB 3.48Å; L214-M218 PolarHBondContact O-N 2.82Å
215T62.9Low68Low72 Ų72111.3 Ų111.344%0.44257%0.574SS.*Hα-helixtrans-66.6-45.8173.145.80000112A211 G212 S217 M218 E219A211-T215 WeakPolarHBondContact O-CG2 3.35Å; A211-T215 PolarHBondContact O-N 3.5Å; A211-T215 PolarHBondContact O-OG1 2.9Å; G212-T215 WeakPolarHBondContact CA-OG1 3.38Å; G212-T215 PolarHBondContact O-OG1 2.81Å; T215-S217 VanDerWaalsContact C-N 3.33Å; T215-S217 PolarHBondContact O-N 2.86Å; T215-M218 PolarHBondContact O-N 3.42Å; T215-E219 WeakPolarHBondContact O-CG 3.31Å; T215-E219 PolarHBondContact O-N 3.1Å
216R67.1Low70.1Confident189 Ų189112.2 Ų112.271%0.71357%0.573SS**Hα-helixtrans-61.2-39.6174.9-168.6174.7-173.6148.61.9112.7G212 E219 E220G212-R216 VanDerWaalsContact O-CB 3.28Å; G212-R216 WeakPolarHBondContact O-CB 3.4Å; G212-R216 PolarHBondContact O-N 3.4Å; R216-E219 PolarHBondContact O-N 3.38Å; R216-E220 WeakPolarHBondContact O-CB 3.33Å; R216-E220 PolarHBondContact O-N 3.36Å
217S76.3Confident72.4Confident73 Ų73114.2 Ų114.251%0.5157%0.568SS.*Hα-helixtrans-66.5-35.9175.5177.20000112.5K213 T215 E220 L221K213-S217 VanDerWaalsContact O-CB 3.29Å; K213-S217 WeakPolarHBondContact O-CB 3.3Å; K213-S217 PolarHBondContact O-N 3.23Å; T215-S217 VanDerWaalsContact C-N 3.33Å; T215-S217 PolarHBondContact O-N 2.86Å; S217-E220 PolarHBondContact O-N 3.36Å; S217-L221 PolarHBondContact O-N 3.36Å
218M78.7Confident74.5Confident104 Ų104113.4 Ų113.451%0.51256%0.559SS.*Hα-helixtrans-69.3-41.4175.3-175.1177.367.700112.2L214 T215 E220 L221 Q222L214-M218 WeakPolarHBondContact O-CB 3.48Å; L214-M218 PolarHBondContact O-N 2.82Å; T215-M218 PolarHBondContact O-N 3.42Å; M218-E220 VanDerWaalsContact C-N 3.33Å; M218-L221 PolarHBondContact O-N 2.85Å; M218-Q222 WeakPolarHBondContact O-CG 3.37Å; M218-Q222 PolarHBondContact O-N 2.84Å
219E84.7Confident76.6Confident118 Ų118111.3 Ų111.355%0.55155%0.548SS*.Hα-helixtrans-63-39.7174.4-72.717717400111.7T215 R216 Q222 L223T215-E219 WeakPolarHBondContact O-CG 3.31Å; T215-E219 PolarHBondContact O-N 3.1Å; R216-E219 PolarHBondContact O-N 3.38Å; E219-Q222 PolarHBondContact O-N 2.83Å; E219-L223 WeakPolarHBondContact O-CG 3.33Å; E219-L223 PolarHBondContact O-N 3.36Å
220E85Confident78.5Confident133 Ų133110.1 Ų110.162%0.62154%0.542SS*.Hα-helixtrans-63.9-43.1175.7-171.4170-166.800112.1R216 S217 M218 Q222 L223 E224R216-E220 WeakPolarHBondContact O-CB 3.33Å; R216-E220 PolarHBondContact O-N 3.36Å; S217-E220 PolarHBondContact O-N 3.36Å; M218-E220 VanDerWaalsContact C-N 3.33Å; E220-Q222 VanDerWaalsContact C-N 3.31Å; E220-Q222 PolarHBondContact O-N 3.42Å; E220-L223 PolarHBondContact O-N 2.92Å; E220-E224 WeakPolarHBondContact O-CB 3.43Å; E220-E224 PolarHBondContact O-N 2.68Å
221L88.4Confident80.5Confident100 Ų100106.7 Ų106.752%0.52453%0.534SS..Hα-helixtrans-62.9-37.7174.7-171.371.1000112S217 M218 E224 H225S217-L221 PolarHBondContact O-N 3.36Å; M218-L221 PolarHBondContact O-N 2.85Å; L221-E224 PolarHBondContact O-N 2.94Å; L221-H225 WeakPolarHBondContact O-CB 3.24Å; L221-H225 PolarHBondContact O-N 3.49Å
222Q88.6Confident82.6Confident120 Ų120109.7 Ų109.756%0.56154%0.535SS*.Hα-helixtrans-67.4-41.3175.7-73.81783.600112.1M218 E219 E220 E224 H225 R226M218-Q222 WeakPolarHBondContact O-CG 3.37Å; M218-Q222 PolarHBondContact O-N 2.84Å; E219-Q222 PolarHBondContact O-N 2.83Å; E220-Q222 VanDerWaalsContact C-N 3.31Å; E220-Q222 PolarHBondContact O-N 3.42Å; Q222-E224 VanDerWaalsContact C-N 3.32Å; Q222-H225 PolarHBondContact O-N 3.23Å; Q222-R226 WeakPolarHBondContact O-CB 3.28Å; Q222-R226 PolarHBondContact O-N 3.33Å
223L90.1Very high84.4Confident114 Ų114111.9 Ų111.960%0.59754%0.538SS*.Hα-helixtrans-64.1-39.2174.3-73170.6000111.3E219 E220 R226 R227E219-L223 WeakPolarHBondContact O-CG 3.33Å; E219-L223 PolarHBondContact O-N 3.36Å; E220-L223 PolarHBondContact O-N 2.92Å; L223-R226 PolarHBondContact O-N 2.92Å; L223-R227 WeakPolarHBondContact O-CB 3.45Å; L223-R227 PolarHBondContact O-N 2.91Å
224E90.6Very high85.8Confident86 Ų86110 Ų11040%0.40253%0.533SS..Hα-helixtrans-64-48.1174.2176.5162.9-125.600111.9E220 L221 Q222 R226 R227 V228E220-E224 WeakPolarHBondContact O-CB 3.43Å; E220-E224 PolarHBondContact O-N 2.68Å; L221-E224 PolarHBondContact O-N 2.94Å; Q222-E224 VanDerWaalsContact C-N 3.32Å; E224-R226 VanDerWaalsContact C-N 3.27Å; E224-R226 PolarHBondContact O-N 2.84Å; E224-R227 WeakPolarHBondContact O-CB 3.19Å; E224-R227 PolarHBondContact O-N 3.36Å; E224-R227 VanDerWaalsContact O-N 3.13Å; E224-R227 IonicContact OE1-NH2 3.62Å; E224-R227 PolarHBondContact OE1-NH2 2.92Å; E224-V228 HydrophobicContact CG-CG2 4.28Å; E224-V228 WeakPolarHBondContact O-CG2 3.37Å; E224-V228 PolarHBondContact O-N 3.29Å
225H92.9Very high87.4Confident125 Ų125110.3 Ų110.358%0.57953%0.529SS*.Hα-helixtrans-55.2-44.3173.6-106.6-146.5000111.6L221 Q222 V228 N229L221-H225 WeakPolarHBondContact O-CB 3.24Å; L221-H225 PolarHBondContact O-N 3.49Å; Q222-H225 PolarHBondContact O-N 3.23Å; H225-V228 PolarHBondContact O-N 3.47Å; H225-N229 VanDerWaalsContact O-CB 3.3Å; H225-N229 WeakPolarHBondContact O-CB 3.25Å; H225-N229 PolarHBondContact O-N 3.11Å; H225-N229 PolarHBondContact O-ND2 2.64Å; H225-N229 PolarHBondContact O-OD1 2.9Å
226R93.4Very high88.3Confident188 Ų188111 Ų11171%0.70953%0.53SS*.Hα-helixtrans-62.6-44176.9-165.9-179.2-158.4169.96.5111.8Q222 L223 E224 N229 Q230Q222-R226 WeakPolarHBondContact O-CB 3.28Å; Q222-R226 PolarHBondContact O-N 3.33Å; L223-R226 PolarHBondContact O-N 2.92Å; E224-R226 VanDerWaalsContact C-N 3.27Å; E224-R226 PolarHBondContact O-N 2.84Å; R226-N229 PolarHBondContact O-N 3.36Å; R226-Q230 WeakPolarHBondContact O-CB 3.33Å; R226-Q230 PolarHBondContact O-N 3.22Å
227R95.6Very high89Confident154 Ų154107 Ų10758%0.58152%0.519SS*.Hα-helixtrans-63.3-45.1177.9178-17560.9172.2-3.2111.9L223 E224 Q230 A231L223-R227 WeakPolarHBondContact O-CB 3.45Å; L223-R227 PolarHBondContact O-N 2.91Å; E224-R227 WeakPolarHBondContact O-CB 3.19Å; E224-R227 PolarHBondContact O-N 3.36Å; E224-R227 VanDerWaalsContact O-N 3.13Å; E224-R227 IonicContact OE1-NH2 3.62Å; E224-R227 PolarHBondContact OE1-NH2 2.92Å; R227-Q230 PolarHBondContact O-N 3.38Å; R227-A231 WeakPolarHBondContact O-CB 3.22Å; R227-A231 PolarHBondContact O-N 3.5Å
228V94.3Very high88.7Confident79 Ų79107.9 Ų107.948%0.47952%0.524SS..Hα-helixtrans-66-42.5178.8173.60000110.6E224 H225 Q230 A231 F232E224-V228 HydrophobicContact CG-CG2 4.28Å; E224-V228 WeakPolarHBondContact O-CG2 3.37Å; E224-V228 PolarHBondContact O-N 3.29Å; H225-V228 PolarHBondContact O-N 3.47Å; V228-Q230 VanDerWaalsContact C-N 3.34Å; V228-Q230 PolarHBondContact O-N 3.5Å; V228-A231 PolarHBondContact O-N 3.39Å; V228-F232 WeakPolarHBondContact O-CB 3.07Å; V228-F232 PolarHBondContact O-N 2.84Å
229N92.9Very high88.2Confident96 Ų96108.9 Ų108.951%0.51353%0.532SS..Hα-helixtrans-62.5-42175.2-71.8-8.8000111.7H225 R226 F232 L233H225-N229 VanDerWaalsContact O-CB 3.3Å; H225-N229 WeakPolarHBondContact O-CB 3.25Å; H225-N229 PolarHBondContact O-N 3.11Å; H225-N229 PolarHBondContact O-ND2 2.64Å; H225-N229 PolarHBondContact O-OD1 2.9Å; R226-N229 PolarHBondContact O-N 3.36Å; N229-F232 PolarHBondContact O-N 2.91Å; N229-L233 WeakPolarHBondContact O-CG 3.49Å; N229-L233 PolarHBondContact O-N 3.09Å
230Q91.6Very high87.3Confident100 Ų100106.8 Ų106.847%0.46753%0.534SS..Hα-helixtrans-62.9-47.8175.9-166.566.542.700111.2R226 R227 V228 F232 L233 D234R226-Q230 WeakPolarHBondContact O-CB 3.33Å; R226-Q230 PolarHBondContact O-N 3.22Å; R227-Q230 PolarHBondContact O-N 3.38Å; V228-Q230 VanDerWaalsContact C-N 3.34Å; V228-Q230 PolarHBondContact O-N 3.5Å; Q230-F232 PolarHBondContact O-N 3.18Å; Q230-L233 PolarHBondContact O-N 3.32Å; Q230-L233 VanDerWaalsContact O-N 3.12Å; Q230-D234 PolarHBondContact NE2-OD1 2.97Å; Q230-D234 VanDerWaalsContact O-CG 3.23Å; Q230-D234 PolarHBondContact O-N 2.85Å
231A93.1Very high86Confident43 Ų43109.8 Ų109.836%0.35554%0.54SS..Hα-helixtrans-62.2-32.2177.600000112.8R227 V228 K235R227-A231 WeakPolarHBondContact O-CB 3.22Å; R227-A231 PolarHBondContact O-N 3.5Å; V228-A231 PolarHBondContact O-N 3.39Å; A231-K235 WeakPolarHBondContact O-CB 3.2Å; A231-K235 WeakPolarHBondContact O-CD 3.41Å; A231-K235 VanDerWaalsContact O-CG 3.23Å; A231-K235 WeakPolarHBondContact O-CG 3.46Å; A231-K235 PolarHBondContact O-N 3.11Å; A231-K235 VanDerWaalsContact O-N 3.14Å
232F94.5Very high84.2Confident124 Ų124108.2 Ų108.254%0.54455%0.548SS..Hα-helixtrans-68.9-43.9173.5177.1-98.7000111.9V228 N229 Q230 K235 L236V228-F232 WeakPolarHBondContact O-CB 3.07Å; V228-F232 PolarHBondContact O-N 2.84Å; N229-F232 PolarHBondContact O-N 2.91Å; Q230-F232 PolarHBondContact O-N 3.18Å; F232-K235 PolarHBondContact O-N 3.17Å; F232-L236 HydrophobicContact CD1-CD1 3.97Å; F232-L236 HydrophobicContact CE1-CD1 3.38Å; F232-L236 HydrophobicContact CE1-CG 4.16Å; F232-L236 HydrophobicContact CZ-CD1 3.78Å; F232-L236 HydrophobicContact CZ-CG 4.23Å; F232-L236 PolarHBondContact O-N 3.45Å
233L92.8Very high82.4Confident84 Ų84108.6 Ų108.644%0.4456%0.558SS.*Hα-helixtrans-63.1-45.2175.1-70.2172.4000111.7N229 Q230 K235 L236 E237N229-L233 WeakPolarHBondContact O-CG 3.49Å; N229-L233 PolarHBondContact O-N 3.09Å; Q230-L233 PolarHBondContact O-N 3.32Å; Q230-L233 VanDerWaalsContact O-N 3.12Å; L233-K235 VanDerWaalsContact C-N 3.28Å; L233-K235 PolarHBondContact O-N 3.42Å; L233-L236 WeakPolarHBondContact O-CA 3.34Å; L233-L236 WeakPolarHBondContact O-CB 3.32Å; L233-L236 PolarHBondContact O-N 2.91Å; L233-E237 WeakPolarHBondContact O-CG 3.36Å; L233-E237 PolarHBondContact O-N 2.79Å
234D90.2Very high80.2Confident75 Ų75111.2 Ų111.240%0.40157%0.568SS.*Hα-helixtrans-60.1-39.6177.3-63.1-12.7000111.2Q230 E237 C238Q230-D234 PolarHBondContact NE2-OD1 2.97Å; Q230-D234 VanDerWaalsContact O-CG 3.23Å; Q230-D234 PolarHBondContact O-N 2.85Å; D234-E237 PolarHBondContact O-N 2.69Å; D234-C238 WeakPolarHBondContact O-CB 3.16Å; D234-C238 PolarHBondContact O-N 2.91Å; D234-C238 PolarHBondContact O-SG 2.96Å
235K90.9Very high77.8Confident140 Ų140114 Ų11461%0.60959%0.59SS**Hα-helixtrans-64.5-39.1173.9-77169.1-175.9-74.30112.2A231 F232 L233 N239A231-K235 WeakPolarHBondContact O-CB 3.2Å; A231-K235 WeakPolarHBondContact O-CD 3.41Å; A231-K235 VanDerWaalsContact O-CG 3.23Å; A231-K235 WeakPolarHBondContact O-CG 3.46Å; A231-K235 PolarHBondContact O-N 3.11Å; A231-K235 VanDerWaalsContact O-N 3.14Å; F232-K235 PolarHBondContact O-N 3.17Å; L233-K235 VanDerWaalsContact C-N 3.28Å; L233-K235 PolarHBondContact O-N 3.42Å; K235-N239 VanDerWaalsContact O-CB 3.3Å; K235-N239 WeakPolarHBondContact O-CB 3.43Å; K235-N239 PolarHBondContact O-N 3.18Å; K235-N239 PolarHBondContact O-ND2 2.92Å
236L82.4Confident75.4Confident86 Ų86116.6 Ų116.645%0.4560%0.602SS.*Hα-helixtrans-66.6-40.5174.9-74.9177.3000111.7F232 L233 N239 A240F232-L236 HydrophobicContact CD1-CD1 3.97Å; F232-L236 HydrophobicContact CE1-CD1 3.38Å; F232-L236 HydrophobicContact CE1-CG 4.16Å; F232-L236 HydrophobicContact CZ-CD1 3.78Å; F232-L236 HydrophobicContact CZ-CG 4.23Å; F232-L236 PolarHBondContact O-N 3.45Å; L233-L236 WeakPolarHBondContact O-CA 3.34Å; L233-L236 WeakPolarHBondContact O-CB 3.32Å; L233-L236 PolarHBondContact O-N 2.91Å; L236-N239 PolarHBondContact O-N 3.16Å; L236-A240 WeakPolarHBondContact O-CB 3.31Å; L236-A240 PolarHBondContact O-N 2.95Å
237E82.3Confident72.9Confident105 Ų105112.1 Ų112.149%0.49161%0.606SS.*Hα-helixtrans-67.6-40.4177.7-70.7-174.8-165.800112.2L233 D234 A240 R241L233-E237 WeakPolarHBondContact O-CG 3.36Å; L233-E237 PolarHBondContact O-N 2.79Å; D234-E237 PolarHBondContact O-N 2.69Å; E237-A240 PolarHBondContact O-N 3.26Å; E237-R241 WeakPolarHBondContact O-CG 3.38Å; E237-R241 PolarHBondContact O-N 2.92Å
238C70.8Confident70.3Confident91 Ų91110.2 Ų110.262%0.61562%0.616SS**Hα-helixtrans-63.6-40.8172.4-73.50000112D234 G242D234-C238 WeakPolarHBondContact O-CB 3.16Å; D234-C238 PolarHBondContact O-N 2.91Å; D234-C238 PolarHBondContact O-SG 2.96Å; C238-G242 PolarHBondContact O-N 2.73Å
239N68.3Low67.6Low126 Ų126111.4 Ų111.467%0.67463%0.628SS**Hα-helixtrans-72.4-29.7176.8-71.2-8.1000112.6K235 L236K235-N239 VanDerWaalsContact O-CB 3.3Å; K235-N239 WeakPolarHBondContact O-CB 3.43Å; K235-N239 PolarHBondContact O-N 3.18Å; K235-N239 PolarHBondContact O-ND2 2.92Å; L236-N239 PolarHBondContact O-N 3.16Å
240A64.6Low64.4Low73 Ų73113.4 Ų113.460%0.60365%0.648SS**Hα-helixtrans-75.1-29.2176.700000112.8L236 E237L236-A240 WeakPolarHBondContact O-CB 3.31Å; L236-A240 PolarHBondContact O-N 2.95Å; E237-A240 PolarHBondContact O-N 3.26Å
241R58.4Low61.5Low196 Ų196114 Ų11474%0.7466%0.663SS**Hα-helixtrans-85.3-9.8175.6-67.6179-167.8-86.61.1113.8E237 T243E237-R241 WeakPolarHBondContact O-CG 3.38Å; E237-R241 PolarHBondContact O-N 2.92Å; R241-T243 VanDerWaalsContact C-N 3.27Å; R241-T243 PolarHBondContact O-N 2.82Å
242G50.1Low58.7Low67 Ų67117.7 Ų117.769%0.69169%0.686SS**THydrogen-bonded Turntrans-77.710.9-176.400000116.8C238C238-G242 PolarHBondContact O-N 2.73Å
243T51.5Low55.6Low128 Ų128122.4 Ų122.479%0.78570%0.7SS**THydrogen-bonded Turntrans-108-0.4176.322.90000114.8R241R241-T243 VanDerWaalsContact C-N 3.27Å; R241-T243 PolarHBondContact O-N 2.82Å
244E43.3Very low52.7Low170 Ų170126.2 Ų126.279%0.79472%0.716SS**SBendtrans-129.7103176.9-69.4-171.2168.500112.3
245V40.2Very low49.9Very low143 Ų143131.6 Ų131.687%0.86774%0.739SS**  trans81128.9146.6-170.10000118.1
246E42Very low46.9Very low180 Ų180133.4 Ų133.484%0.84175%0.749SS**  trans-53.5148.4174.7-66.8-140.2137.800115.3
247A42.2Very low44.4Very low95 Ų95139.1 Ų139.179%0.78577%0.765SS**  trans5693.7147.700000118.6
248S40.1Very low42.4Very low113 Ų113139.8 Ų139.879%0.7978%0.778SS**  -169.2129.6128.3-170.60000112.3
249S36.7Very low40.6Very low105 Ų105145.4 Ų145.473%0.73479%0.787SS**SBendtrans57.296.2157.769.80000119.3
250C25.8Very low38.9Very low137 Ų137147.7 Ų147.793%0.92680%0.798SS**  172.887.2106.5-105.40000110.3
251S32.1Very low37.4Very low113 Ų113150.4 Ų150.479%0.7981%0.807SS**  trans-130.6118.7157.969.70000108.6
252S32.9Very low36.7Very low121 Ų121146.6 Ų146.685%0.84681%0.808SS**  trans-162.597159.1-77.90000110.1
253R31.2Very low35.7Very low222 Ų222151 Ų15184%0.83882%0.815SS**  171.2103.2127.2-100-173.7143.7-175.1-3.4108.3
254E30.2Very low34.9Very low164 Ų164151.4 Ų151.477%0.76681%0.813SS**  86.2106.782.4-85.6-166.9144.900112.1
255E31.7Very low34.4Very low188 Ų188152.1 Ų152.188%0.87982%0.816SS**  trans179.193.1133.9-103.9178163.500106.3
256E28.7Very low34.1Very low178 Ų178155.7 Ų155.783%0.83281%0.814SS**  75.693.292.5-159.9176.1177.100114.5
257R28.6Very low33.7Very low207 Ų207159 Ų15978%0.78182%0.819SS**  trans37.1161.2136.5-98.8-163.8158.5147.1-6121.8
258P41.7Very low33.1Very low118 Ų118162.5 Ų162.577%0.76682%0.818SS**  cis-135.2166.51726.8-1.3000118.1
259R32.1Very low32.6Very low209 Ų209161.8 Ų161.879%0.78982%0.819SS**  trans-81.6152.1-177.9-54.5-176.3174.9-138-1.1112.3
260L32.5Very low32.2Very low175 Ų175161.7 Ų161.792%0.91683%0.825SS**  trans-136.3156.9144.9-72.9178000110
261T33.7Very low32.7Very low129 Ų129160.4 Ų160.479%0.79182%0.824SS**  trans-80.7165.1-14747.40000116.9
262P43.2Very low32.7Very low117 Ų117158.8 Ų158.876%0.7683%0.825SS**  trans-92.1142.8169.535.1-26.8000111.1
263D30.4Very low32.7Very low158 Ų158164.6 Ų164.685%0.84583%0.828SS**  trans-149.8135.9151.3-123.3-39.5000111.7
264D33.8Very low32.9Very low138 Ų138160.2 Ų160.274%0.73883%0.826SS**  trans-62.4161.9176.8-91.1-55.1000111.3
265H32.3Very low33.1Very low185 Ų185156.3 Ų156.386%0.85682%0.822SS**  -174.1108.7127.9-87.29.8000111.4
266R34.3Very low33.1Very low218 Ų218154.9 Ų154.982%0.82382%0.819SS**  trans-52128.6163.1171.8-168.5-77.4173.8-6.6112.6
267R33.6Very low33.2Very low250 Ų250152.4 Ų152.494%0.94382%0.817SS**  trans-149.3142.1146.8-74.4-159.9171.3161.5-1.4113
268H30.5Very low33.3Very low168 Ų168151 Ų15178%0.77882%0.818SS**  trans-85.1160.1-174.1-79.1-102.5000114.2
269A28.5Very low33.4Very low98 Ų98150.4 Ų150.481%0.8182%0.815SS**  trans71.7124142.900000120.2
270A28.4Very low33.7Very low103 Ų103148 Ų14885%0.85181%0.813SS**  163.7149104.500000111.7
271A36Very low33.9Very low110 Ų110145.6 Ų145.691%0.90981%0.807SS**  trans-65153.6179.900000114.4
272G31.8Very low33.7Very low78 Ų78141.6 Ų141.680%0.80479%0.791SS**  trans-165.5114166.400000111.6
273R34.1Very low33.9Very low243 Ų243141.8 Ų141.892%0.91779%0.793SS**  trans-74.5164.9166.9-72.2173.493.3-157.210110.1
274V35.7Very low34Very low130 Ų130144 Ų14479%0.78880%0.798SS**  trans117.894.3145.1-169.60000116
275A33Very low34.4Very low82 Ų82148 Ų14868%0.67880%0.803SS**  59.7156.4119.100000124.6
276L32.2Very low34.6Very low159 Ų159150.2 Ų150.283%0.83280%0.804SS**  trans98.4130167.1-55.7161.9000113.6
277T30.4Very low34.2Very low126 Ų126146.5 Ų146.577%0.77381%0.81SS**  cis-1721536.717.80000108.8
278H30.8Very low34.4Very low177 Ų177139 Ų13982%0.81980%0.795SS**  trans-11.9166158.5-112.8-100.4000120.6
279P43.7Very low34.7Very low106 Ų106137.6 Ų137.669%0.68879%0.794SS**  cis-142.5167.98.641.4-21.3000118.3
280E38.1Very low34.7Very low159 Ų159144.3 Ų144.374%0.74380%0.798SS**  trans28.6139.3148.9-92-86.3130.600122.8G282E280-G282 PolarHBondContact OE1-N 3.39Å; E280-G282 PolarHBondContact OE2-N 2.98Å
281P37.7Very low35.3Very low123 Ų123145.7 Ų145.780%0.79980%0.796SS**  -142.5142.979.437.5-20.6000116.4
282G29.4Very low35.7Very low45 Ų45147.8 Ų147.846%0.46479%0.787SS.*  trans-85.5-174.9148.500000112.1E280E280-G282 PolarHBondContact OE1-N 3.39Å; E280-G282 PolarHBondContact OE2-N 2.98Å
283P46.3Very low36.5Very low122 Ų122153 Ų15379%0.79279%0.791SS**  cis-129.6125.7-14.734.6-16000112.3
284E34.3Very low37.1Very low204 Ų204144.7 Ų144.795%0.95377%0.767SS**  trans-99.896.3158.7-71.5-165.3164.600109.2
285R41.4Very low38.3Very low223 Ų223143 Ų14384%0.84275%0.754SS**  trans-128.6107.8158.3-86-170.7176-111.20.9108.8
286R36Very low40Very low231 Ų231143.1 Ų143.187%0.87275%0.747SS**  trans-170.387.2131.3-113.1-179.5174.6-159-2111.6
287C27.3Very low41.9Very low140 Ų140140.1 Ų140.195%0.94673%0.729SS**  trans-130.890.4135.9-830000105.1
288S37.7Very low44.2Very low92 Ų92136.6 Ų136.664%0.64371%0.713SS**  trans-114.894.9173.2-47.60000105.1
289D36.3Very low46.7Very low139 Ų139131.4 Ų131.474%0.74369%0.691SS**  trans-165.166.3144.6-143.98000110.2
290W28.6Very low48.8Very low238 Ų238131.2 Ų131.290%0.90268%0.676SS**  trans-110.9108.5146.4-7098000104.2E292W290-E292 PolarHBondContact O-N 3.24Å
291T40.4Very low51.2Low133 Ų133127.9 Ų127.982%0.81666%0.664SS**  trans-65.681.9156.28.70000105.4E293T291-E293 VanDerWaalsContact C-N 3.26Å; T291-E293 PolarHBondContact O-N 3.39Å
292E45.3Very low53.8Low153 Ų153129.2 Ų129.272%0.71565%0.653SS**  trans-68.692.8169.8-158.6163.4-165.300104.8W290 T294W290-E292 PolarHBondContact O-N 3.24Å; E292-T294 HydrophobicContact CG-CG2 4.24Å; E292-T294 PolarHBondContact O-N 2.8Å; E292-T294 PolarHBondContact O-OG1 3.17Å
293E46.9Very low56.8Low188 Ų188128.3 Ų128.388%0.87964%0.637SS**  trans-60.780.9149.6-79.2-98.4153.500105.2T291 D295T291-E293 VanDerWaalsContact C-N 3.26Å; T291-E293 PolarHBondContact O-N 3.39Å; E293-D295 PolarHBondContact O-N 3.43Å
294T48.3Very low59Low68 Ų68122.9 Ų122.942%0.41760%0.602SS.*  trans-58.3109.4169.6-0.50000105.4E292 P296 D299E292-T294 HydrophobicContact CG-CG2 4.24Å; E292-T294 PolarHBondContact O-N 2.8Å; E292-T294 PolarHBondContact O-OG1 3.17Å; T294-P296 WeakPolarHBondContact O-CD 3.31Å; T294-D299 WeakPolarHBondContact CB-OD2 3.02Å; T294-D299 WeakPolarHBondContact CG2-OD2 3.28Å
295D60.3Low61.7Low96 Ų96119.2 Ų119.251%0.51359%0.586SS.*  trans-56.1108.1168.3177.52.9000106.8E293 Q297 A298 D299E293-D295 PolarHBondContact O-N 3.43Å; D295-Q297 PolarHBondContact O-N 2.92Å; D295-Q297 VanDerWaalsContact OD1-CB 3.26Å; D295-Q297 WeakPolarHBondContact OD1-CB 3.32Å; D295-Q297 PolarHBondContact OD1-N 3.07Å; D295-Q297 VanDerWaalsContact OD1-N 3.1Å; D295-A298 HydrophobicContact CB-CB 4.07Å; D295-A298 WeakPolarHBondContact O-CB 3.5Å; D295-A298 PolarHBondContact O-N 3.17Å; D295-D299 PolarHBondContact O-N 3.36Å
296P69.6Low64.1Low84 Ų84112.4 Ų112.455%0.54556%0.563SS.*Hα-helixtrans-61.8-17.5-174.2-21.234.3000111.8T294 R300T294-P296 WeakPolarHBondContact O-CD 3.31Å; P296-R300 WeakPolarHBondContact O-CD 3.32Å; P296-R300 WeakPolarHBondContact O-CG 3.26Å; P296-R300 PolarHBondContact O-N 3.41Å
297Q72Confident66.7Low95 Ų95101.4 Ų101.444%0.44452%0.521SS..Hα-helixtrans-75.9-39175.1-168.258.835.300112.3D295 D299 R300 D301D295-Q297 PolarHBondContact O-N 2.92Å; D295-Q297 VanDerWaalsContact OD1-CB 3.26Å; D295-Q297 WeakPolarHBondContact OD1-CB 3.32Å; D295-Q297 PolarHBondContact OD1-N 3.07Å; D295-Q297 VanDerWaalsContact OD1-N 3.1Å; Q297-D299 VanDerWaalsContact C-N 3.33Å; Q297-D299 PolarHBondContact O-N 2.83Å; Q297-R300 PolarHBondContact O-N 2.86Å; Q297-D301 PolarHBondContact NE2-OD1 3.37Å; Q297-D301 PolarHBondContact O-N 3Å
298A78.1Confident69.8Low52 Ų5296.7 Ų96.743%0.4349%0.488SS..Hα-helixtrans-65.7-38.6177.300000111.4D295 D301 W302D295-A298 HydrophobicContact CB-CB 4.07Å; D295-A298 WeakPolarHBondContact O-CB 3.5Å; D295-A298 PolarHBondContact O-N 3.17Å; A298-D301 PolarHBondContact O-N 3.3Å; A298-W302 VanDerWaalsContact O-CB 3.26Å; A298-W302 WeakPolarHBondContact O-CB 3.47Å; A298-W302 PolarHBondContact O-N 3.03Å
299D83.8Confident72.2Confident68 Ų6898.5 Ų98.536%0.36449%0.491SS..Hα-helixtrans-65.8-39.2175.5-72.2-21.4000111.9T294 D295 Q297 W302 N303T294-D299 WeakPolarHBondContact CB-OD2 3.02Å; T294-D299 WeakPolarHBondContact CG2-OD2 3.28Å; D295-D299 PolarHBondContact O-N 3.36Å; Q297-D299 VanDerWaalsContact C-N 3.33Å; Q297-D299 PolarHBondContact O-N 2.83Å; D299-W302 PolarHBondContact O-N 3.48Å; D299-N303 VanDerWaalsContact O-CB 3.3Å; D299-N303 WeakPolarHBondContact O-CB 3.31Å; D299-N303 PolarHBondContact O-N 3Å; D299-N303 PolarHBondContact O-ND2 2.9Å; D299-N303 PolarHBondContact O-OD1 3.36Å
300R87Confident74.7Confident102 Ų10296 Ų9639%0.38548%0.476SS..Hα-helixtrans-64.2-47.1175.1-77.7170.2176.4-179.7-1.4112.2P296 Q297 W302 N303 L304 L323 N327P296-R300 WeakPolarHBondContact O-CD 3.32Å; P296-R300 WeakPolarHBondContact O-CG 3.26Å; P296-R300 PolarHBondContact O-N 3.41Å; Q297-R300 PolarHBondContact O-N 2.86Å; R300-W302 VanDerWaalsContact C-N 3.29Å; R300-W302 PolarHBondContact O-N 3.48Å; R300-N303 PolarHBondContact O-N 3.43Å; R300-L304 WeakPolarHBondContact O-CB 3.18Å; R300-L304 PolarHBondContact O-N 3.47Å; R300-L323 VanDerWaalsContact O-CD2 3.32Å; R300-L323 WeakPolarHBondContact O-CD2 3.48Å; R300-N327 PolarHBondContact NE-O 3.06Å; R300-N327 PolarHBondContact NH2-O 2.87Å
301D89.4Confident77.4Confident89 Ų8985.9 Ų85.948%0.47644%0.439SS..Hα-helixtrans-65.1-37.2179.6-70.5-18.8000111.3Q297 A298 M305Q297-D301 PolarHBondContact NE2-OD1 3.37Å; Q297-D301 PolarHBondContact O-N 3Å; A298-D301 PolarHBondContact O-N 3.3Å; D301-M305 PolarHBondContact O-N 3.04Å
302W92Very high79.5Confident152 Ų15284.3 Ų84.358%0.57643%0.43SS*.Hα-helixtrans-65.4-44.1174.1179.8-118.3000112.7A298 D299 R300 M305 K306A298-W302 VanDerWaalsContact O-CB 3.26Å; A298-W302 WeakPolarHBondContact O-CB 3.47Å; A298-W302 PolarHBondContact O-N 3.03Å; D299-W302 PolarHBondContact O-N 3.48Å; R300-W302 VanDerWaalsContact C-N 3.29Å; R300-W302 PolarHBondContact O-N 3.48Å; W302-M305 PolarHBondContact O-N 3.28Å; W302-K306 VanDerWaalsContact CE2-CE 3.44Å; W302-K306 PolarHBondContact O-N 2.96Å
303N92.1Very high81.3Confident25 Ų2584.6 Ų84.613%0.13444%0.437CS..Hα-helixtrans-65.2-40.1176.9-69.3-16.4000111.4D299 R300 M305 K306 L307 L323 G328 Y330D299-N303 VanDerWaalsContact O-CB 3.3Å; D299-N303 WeakPolarHBondContact O-CB 3.31Å; D299-N303 PolarHBondContact O-N 3Å; D299-N303 PolarHBondContact O-ND2 2.9Å; D299-N303 PolarHBondContact O-OD1 3.36Å; R300-N303 PolarHBondContact O-N 3.43Å; N303-M305 PolarHBondContact O-N 2.9Å; N303-K306 PolarHBondContact O-N 3.14Å; N303-L307 VanDerWaalsContact O-CG 3.31Å; N303-L307 WeakPolarHBondContact O-CG 3.44Å; N303-L307 PolarHBondContact O-N 3.02Å; N303-L323 HydrophobicContact CB-CD1 4.14Å; N303-L323 HydrophobicContact CB-CD2 4.1Å; N303-G328 PolarHBondContact ND2-O 3Å; N303-Y330 HydrophobicContact CB-CD2 4.2Å
304L92.1Very high83.1Confident8 Ų876.4 Ų76.44%0.04240%0.4CS..Hα-helixtrans-59.1-46.4173.3179.157.8000111.3R300 K306 L307 V308 V319 Q320 L323R300-L304 WeakPolarHBondContact O-CB 3.18Å; R300-L304 PolarHBondContact O-N 3.47Å; L304-K306 PolarHBondContact O-N 2.78Å; L304-L307 PolarHBondContact O-N 3.3Å; L304-V308 HydrophobicContact CD1-CG2 4.1Å; L304-V308 VanDerWaalsContact O-CG2 3.3Å; L304-V308 WeakPolarHBondContact O-CG2 3.48Å; L304-V308 PolarHBondContact O-N 2.88Å; L304-V319 HydrophobicContact CD1-CB 4.14Å; L304-V319 HydrophobicContact CD1-CG1 3.76Å; L304-Q320 HydrophobicContact CD1-CB 3.86Å; L304-Q320 HydrophobicContact CD2-CB 4.13Å; L304-Q320 HydrophobicContact CD2-CG 4.11Å; L304-L323 HydrophobicContact CB-CD2 3.72Å
305M91.3Very high85Confident127 Ų12776.6 Ų76.663%0.62641%0.405SS*.Hα-helixtrans-62.5-42.5179.5-169.268-165.200112.1D301 W302 N303 N309D301-M305 PolarHBondContact O-N 3.04Å; W302-M305 PolarHBondContact O-N 3.28Å; N303-M305 PolarHBondContact O-N 2.9Å; M305-N309 WeakPolarHBondContact O-CB 3.27Å; M305-N309 PolarHBondContact O-N 3.11Å
306K91.8Very high86.5Confident80 Ų8078.4 Ų78.435%0.34840%0.404SS..Hα-helixtrans-61.6-46.7175.3-77.8177.1171.6171.50112W302 N303 L304 N309 I310 Y330W302-K306 VanDerWaalsContact CE2-CE 3.44Å; W302-K306 PolarHBondContact O-N 2.96Å; N303-K306 PolarHBondContact O-N 3.14Å; L304-K306 PolarHBondContact O-N 2.78Å; K306-N309 WeakPolarHBondContact O-CB 3.19Å; K306-N309 PolarHBondContact O-N 2.77Å; K306-I310 WeakPolarHBondContact O-CD1 3.36Å; K306-I310 VanDerWaalsContact O-CG1 3.29Å; K306-I310 WeakPolarHBondContact O-CG1 3.47Å; K306-I310 PolarHBondContact O-N 2.86Å; K306-Y330 HydrophobicContact CB-CD2 4.46Å; K306-Y330 HydrophobicContact CB-CE2 3.77Å; K306-Y330 HydrophobicContact CD-CE2 4.18Å
307L90.8Very high87.5Confident0 Ų079.5 Ų79.50%041%0.406CS..Hα-helixtrans-64.4-43.4-178.4-72.5170.6000112.2N303 L304 N309 I310 F311 V319 L323 Y330 A333 C334 L337N303-L307 VanDerWaalsContact O-CG 3.31Å; N303-L307 WeakPolarHBondContact O-CG 3.44Å; N303-L307 PolarHBondContact O-N 3.02Å; L304-L307 PolarHBondContact O-N 3.3Å; L307-N309 PolarHBondContact O-N 3.45Å; L307-I310 PolarHBondContact O-N 3.49Å; L307-I310 VanDerWaalsContact O-N 3.12Å; L307-F311 HydrophobicContact CD2-CD2 4.42Å; L307-F311 HydrophobicContact CD2-CE2 4.1Å; L307-F311 WeakPolarHBondContact O-CD2 3.47Å; L307-F311 PolarHBondContact O-N 2.87Å; L307-V319 HydrophobicContact CB-CG1 3.4Å; L307-V319 VanDerWaalsContact CB-CG1 3.4Å; L307-V319 HydrophobicContact CD1-CG1 4Å; L307-V319 HydrophobicContact CG-CG1 4.34Å; L307-L323 HydrophobicContact CD1-CD1 3.94Å; L307-Y330 HydrophobicContact CD1-CD2 4.42Å; L307-Y330 HydrophobicContact CD2-CD2 4.06Å; L307-Y330 HydrophobicContact CD2-CE2 3.78Å; L307-Y330 HydrophobicContact CG-CD2 3.93Å; L307-Y330 HydrophobicContact CG-CE2 3.88Å; L307-A333 HydrophobicContact CD1-CB 3.7Å; L307-C334 HydrophobicContact CD2-CB 4.43Å; L307-C334 WeakPolarHBondContact CD2-SG 3.33Å; L307-L337 HydrophobicContact CB-CD1 4.42Å; L307-L337 HydrophobicContact CD1-CD1 4.31Å; L307-L337 HydrophobicContact CD2-CD1 3.9Å; L307-L337 HydrophobicContact CG-CD1 4.45Å
308V91.6Very high88.4Confident41 Ų4179 Ų7925%0.24840%0.402CS..Hα-helixtrans-62.1-32.3176172.20000111.8L304 F311 R316 V319L304-V308 HydrophobicContact CD1-CG2 4.1Å; L304-V308 VanDerWaalsContact O-CG2 3.3Å; L304-V308 WeakPolarHBondContact O-CG2 3.48Å; L304-V308 PolarHBondContact O-N 2.88Å; V308-F311 CarbonylContact O-C 3.6Å; V308-R316 HydrophobicContact CG2-CB 4.36Å; V308-R316 HydrophobicContact CG2-CG 4.13Å; V308-V319 HydrophobicContact CG2-CB 4.22Å; V308-V319 HydrophobicContact CG2-CG1 4.15Å; V308-V319 HydrophobicContact CG2-CG2 4.43Å
309N89.4Confident89Confident131 Ų13176.6 Ų76.670%0.70138%0.382SS*.Hα-helixtrans-75.4-28.8176.4-169.452.4000113.2M305 K306 L307M305-N309 WeakPolarHBondContact O-CB 3.27Å; M305-N309 PolarHBondContact O-N 3.11Å; K306-N309 WeakPolarHBondContact O-CB 3.19Å; K306-N309 PolarHBondContact O-N 2.77Å; L307-N309 PolarHBondContact O-N 3.45Å
310I87.5Confident89.4Confident85 Ų8576.9 Ų76.944%0.43638%0.381SS..Hα-helixtrans-81.7-34.3177.4-65.6163.6000111K306 L307 P312 Y330K306-I310 WeakPolarHBondContact O-CD1 3.36Å; K306-I310 VanDerWaalsContact O-CG1 3.29Å; K306-I310 WeakPolarHBondContact O-CG1 3.47Å; K306-I310 PolarHBondContact O-N 2.86Å; L307-I310 PolarHBondContact O-N 3.49Å; L307-I310 VanDerWaalsContact O-N 3.12Å; I310-P312 VanDerWaalsContact C-CD 3.41Å; I310-P312 VanDerWaalsContact O-CD 3.25Å; I310-P312 WeakPolarHBondContact O-CD 3.33Å; I310-Y330 HydrophobicContact CD1-CE2 4.42Å; I310-Y330 WeakPolarHBondContact CD1-OH 3.47Å
311F85.9Confident89.6Confident27 Ų2776.7 Ų76.712%0.11839%0.387CS..  trans-118.670.5179.8-55.5-76.4000110.8L307 V308 D313 C314 L337 V338 L341L307-F311 HydrophobicContact CD2-CD2 4.42Å; L307-F311 HydrophobicContact CD2-CE2 4.1Å; L307-F311 WeakPolarHBondContact O-CD2 3.47Å; L307-F311 PolarHBondContact O-N 2.87Å; V308-F311 CarbonylContact O-C 3.6Å; F311-D313 PolarHBondContact O-N 3.09Å; F311-D313 VanDerWaalsContact O-N 3.16Å; F311-C314 HydrophobicContact CB-CB 4Å; F311-C314 PolarHBondContact O-N 2.77Å; F311-C314 VanDerWaalsContact O-N 3.07Å; F311-L337 HydrophobicContact CD2-CB 4.13Å; F311-L337 HydrophobicContact CD2-CD1 3.84Å; F311-L337 HydrophobicContact CD2-CG 4.47Å; F311-L337 HydrophobicContact CE1-CB 4.32Å; F311-L337 HydrophobicContact CE2-CB 3.76Å; F311-L337 HydrophobicContact CE2-CD1 3.93Å; F311-L337 HydrophobicContact CE2-CG 4.45Å; F311-L337 HydrophobicContact CZ-CB 3.86Å; F311-V338 HydrophobicContact CE1-CG2 4.2Å; F311-V338 HydrophobicContact CZ-CG2 3.82Å; F311-L341 HydrophobicContact CD1-CD1 3.34Å; F311-L341 HydrophobicContact CE1-CD1 3.8Å; F311-L341 HydrophobicContact CG-CD1 4.18Å
312P84.1Confident89.7Confident99 Ų9972.9 Ų72.964%0.64337%0.367SS*.THydrogen-bonded Turntrans-64.3-20.1-178.527.9-35.8000113.1I310 C314I310-P312 VanDerWaalsContact C-CD 3.41Å; I310-P312 VanDerWaalsContact O-CD 3.25Å; I310-P312 WeakPolarHBondContact O-CD 3.33Å; P312-C314 VanDerWaalsContact C-N 3.34Å
313D83.5Confident89.6Confident160 Ų16066.1 Ų66.186%0.85634%0.342SS*.THydrogen-bonded Turntrans-83.3-11.2178.6-58.6-38.9000112.9F311F311-D313 PolarHBondContact O-N 3.09Å; F311-D313 VanDerWaalsContact O-N 3.16Å
314C84Confident89.6Confident16 Ų1669.4 Ų69.411%0.10836%0.363CS..SBendtrans-89.7138.6174.9-68.20000110.9F311 P312 R316 F318 V319F311-C314 HydrophobicContact CB-CB 4Å; F311-C314 PolarHBondContact O-N 2.77Å; F311-C314 VanDerWaalsContact O-N 3.07Å; P312-C314 VanDerWaalsContact C-N 3.34Å; C314-R316 PolarHBondContact O-N 3.41Å; C314-F318 HydrophobicContact CB-CD1 4.35Å; C314-V319 HydrophobicContact CB-CG2 3.67Å
315S89.1Confident89.4Confident72 Ų7275.9 Ų75.950%0.50339%0.393SS..  trans-66.1138.4174.464.90000110.4D317 F318 V319S315-D317 PolarHBondContact O-N 2.92Å; S315-F318 WeakPolarHBondContact O-CB 3.35Å; S315-F318 PolarHBondContact O-N 2.71Å; S315-F318 WeakPolarHBondContact OG-CB 3.38Å; S315-F318 PolarHBondContact OG-N 2.92Å; S315-V319 PolarHBondContact O-N 2.91Å
316R90.9Very high89.4Confident133 Ų13370.1 Ų70.150%0.50237%0.365SS..Hα-helixtrans-53.2-39.6179.8-179.3-179.2-180-71.8-5.6112.4V308 C314 V319 Q320V308-R316 HydrophobicContact CG2-CB 4.36Å; V308-R316 HydrophobicContact CG2-CG 4.13Å; C314-R316 PolarHBondContact O-N 3.41Å; R316-V319 PolarHBondContact O-N 3.14Å; R316-Q320 VanDerWaalsContact NH1-OE1 3.16Å; R316-Q320 WeakPolarHBondContact O-CB 3.36Å; R316-Q320 PolarHBondContact O-N 2.89Å
317D90.5Very high89.1Confident108 Ų10872.4 Ų72.458%0.57838%0.381SS*.Hα-helixtrans-68.1-38.2-179.5-56.9-32000111.4S315 Q320 D321S315-D317 PolarHBondContact O-N 2.92Å; D317-Q320 PolarHBondContact O-N 3.39Å; D317-D321 PolarHBondContact O-N 3.28Å
318F90.7Very high88.8Confident85 Ų8572.9 Ų72.937%0.37339%0.387SS..Hα-helixtrans-65.7-42.4174.8175.6-106.6000112.4C314 S315 Q320 D321 I322 L337C314-F318 HydrophobicContact CB-CD1 4.35Å; S315-F318 WeakPolarHBondContact O-CB 3.35Å; S315-F318 PolarHBondContact O-N 2.71Å; S315-F318 WeakPolarHBondContact OG-CB 3.38Å; S315-F318 PolarHBondContact OG-N 2.92Å; F318-Q320 VanDerWaalsContact C-N 3.3Å; F318-Q320 PolarHBondContact O-N 3.32Å; F318-D321 PolarHBondContact O-N 2.95Å; F318-I322 HydrophobicContact CD1-CD1 3.94Å; F318-I322 HydrophobicContact CD2-CD1 4.46Å; F318-I322 HydrophobicContact CE1-CD1 3.42Å; F318-I322 VanDerWaalsContact CE1-CD1 3.42Å; F318-I322 HydrophobicContact CE2-CD1 4Å; F318-I322 HydrophobicContact CG-CD1 4.44Å; F318-I322 HydrophobicContact CZ-CD1 3.47Å; F318-I322 VanDerWaalsContact CZ-CD1 3.47Å; F318-I322 HydrophobicContact CZ-CG1 4.47Å; F318-I322 WeakPolarHBondContact O-CG1 3.32Å; F318-I322 PolarHBondContact O-N 3.06Å; F318-L337 HydrophobicContact CD1-CD2 4.22Å; F318-L337 HydrophobicContact CE1-CD2 3.8Å
319V90.7Very high88.6Confident0 Ų073.9 Ų73.90%039%0.391CS..Hα-helixtrans-64.4-37.8175.11790000111L304 L307 V308 C314 S315 R316 I322 L323 L337L304-V319 HydrophobicContact CD1-CB 4.14Å; L304-V319 HydrophobicContact CD1-CG1 3.76Å; L307-V319 HydrophobicContact CB-CG1 3.4Å; L307-V319 VanDerWaalsContact CB-CG1 3.4Å; L307-V319 HydrophobicContact CD1-CG1 4Å; L307-V319 HydrophobicContact CG-CG1 4.34Å; V308-V319 HydrophobicContact CG2-CB 4.22Å; V308-V319 HydrophobicContact CG2-CG1 4.15Å; V308-V319 HydrophobicContact CG2-CG2 4.43Å; C314-V319 HydrophobicContact CB-CG2 3.67Å; S315-V319 PolarHBondContact O-N 2.91Å; R316-V319 PolarHBondContact O-N 3.14Å; V319-I322 PolarHBondContact O-N 3.47Å; V319-L323 WeakPolarHBondContact O-CB 3.3Å; V319-L323 PolarHBondContact O-N 2.96Å; V319-L337 HydrophobicContact CG1-CD1 4.19Å; V319-L337 HydrophobicContact CG2-CD1 4.48Å; V319-L337 HydrophobicContact CG2-CD2 4.36Å
320Q92.4Very high88.7Confident75 Ų7570.2 Ų70.235%0.3537%0.367SS..Hα-helixtrans-66.4-39.3176.1-175.3169.6-15.100112.2L304 R316 D317 F318 L323 T324L304-Q320 HydrophobicContact CD1-CB 3.86Å; L304-Q320 HydrophobicContact CD2-CB 4.13Å; L304-Q320 HydrophobicContact CD2-CG 4.11Å; R316-Q320 VanDerWaalsContact NH1-OE1 3.16Å; R316-Q320 WeakPolarHBondContact O-CB 3.36Å; R316-Q320 PolarHBondContact O-N 2.89Å; D317-Q320 PolarHBondContact O-N 3.39Å; F318-Q320 VanDerWaalsContact C-N 3.3Å; F318-Q320 PolarHBondContact O-N 3.32Å; Q320-L323 PolarHBondContact O-N 3.43Å; Q320-T324 WeakPolarHBondContact O-CB 3.29Å; Q320-T324 PolarHBondContact O-N 3.32Å; Q320-T324 PolarHBondContact O-OG1 3.01Å
321D91.7Very high88.8Confident97 Ų9772.4 Ų72.452%0.51938%0.376SS..Hα-helixtrans-65.3-42.4175.6-76.3-13.9000111.9D317 F318 T324 Q325D317-D321 PolarHBondContact O-N 3.28Å; F318-D321 PolarHBondContact O-N 2.95Å; D321-T324 WeakPolarHBondContact O-CB 3.38Å; D321-T324 PolarHBondContact O-N 3.49Å; D321-Q325 WeakPolarHBondContact O-CG 3.49Å; D321-Q325 PolarHBondContact O-N 3.04Å
322I90.9Very high88.9Confident10 Ų1076 Ų765%0.05139%0.393CS..Hα-helixtrans-64.2-45.3175.4-69.8170.2000110.7F318 V319 T324 Q325 C326 A333 L336 L337F318-I322 HydrophobicContact CD1-CD1 3.94Å; F318-I322 HydrophobicContact CD2-CD1 4.46Å; F318-I322 HydrophobicContact CE1-CD1 3.42Å; F318-I322 VanDerWaalsContact CE1-CD1 3.42Å; F318-I322 HydrophobicContact CE2-CD1 4Å; F318-I322 HydrophobicContact CG-CD1 4.44Å; F318-I322 HydrophobicContact CZ-CD1 3.47Å; F318-I322 VanDerWaalsContact CZ-CD1 3.47Å; F318-I322 HydrophobicContact CZ-CG1 4.47Å; F318-I322 WeakPolarHBondContact O-CG1 3.32Å; F318-I322 PolarHBondContact O-N 3.06Å; V319-I322 PolarHBondContact O-N 3.47Å; I322-T324 PolarHBondContact O-N 3.47Å; I322-Q325 WeakPolarHBondContact O-CB 3.49Å; I322-Q325 PolarHBondContact O-N 3.48Å; I322-Q325 VanDerWaalsContact O-N 3.14Å; I322-C326 PolarHBondContact O-N 3.44Å; I322-C326 PolarHBondContact O-SG 3.21Å; I322-C326 VanDerWaalsContact O-SG 3.39Å; I322-A333 HydrophobicContact CG2-CB 3.99Å; I322-L336 HydrophobicContact CG2-CB 4.2Å; I322-L336 HydrophobicContact CG2-CD1 4.28Å; I322-L337 HydrophobicContact CD1-CD2 3.46Å; I322-L337 VanDerWaalsContact CD1-CD2 3.46Å; I322-L337 HydrophobicContact CD1-CG 3.87Å; I322-L337 HydrophobicContact CG2-CG 4.39Å
323L91.7Very high89.2Confident9 Ų971.3 Ų71.35%0.04736%0.362CS..Hα-helixtrans-63.4-33.3177.9-169.465.9000111.8R300 N303 L304 L307 V319 Q320 C326 N327 G328 A333R300-L323 VanDerWaalsContact O-CD2 3.32Å; R300-L323 WeakPolarHBondContact O-CD2 3.48Å; N303-L323 HydrophobicContact CB-CD1 4.14Å; N303-L323 HydrophobicContact CB-CD2 4.1Å; L304-L323 HydrophobicContact CB-CD2 3.72Å; L307-L323 HydrophobicContact CD1-CD1 3.94Å; V319-L323 WeakPolarHBondContact O-CB 3.3Å; V319-L323 PolarHBondContact O-N 2.96Å; Q320-L323 PolarHBondContact O-N 3.43Å; L323-C326 CarbonylContact O-C 3.6Å; L323-C326 PolarHBondContact O-N 2.96Å; L323-N327 PolarHBondContact O-N 3Å; L323-G328 PolarHBondContact O-N 2.85Å; L323-A333 HydrophobicContact CD1-CB 3.89Å
324T90.2Very high89.4Confident94 Ų9464.7 Ų64.758%0.57733%0.328SS*.Hα-helixtrans-67.6-42.5173.4-570000111.4Q320 D321 I322 C326 N327Q320-T324 WeakPolarHBondContact O-CB 3.29Å; Q320-T324 PolarHBondContact O-N 3.32Å; Q320-T324 PolarHBondContact O-OG1 3.01Å; D321-T324 WeakPolarHBondContact O-CB 3.38Å; D321-T324 PolarHBondContact O-N 3.49Å; I322-T324 PolarHBondContact O-N 3.47Å; T324-C326 VanDerWaalsContact C-N 3.27Å; T324-C326 PolarHBondContact O-N 3.28Å; T324-N327 PolarHBondContact O-N 3.33Å
325Q89.4Confident89.7Confident145 Ų14566.6 Ų66.668%0.67835%0.345SS*.Hα-helixtrans-63.4-32.8174.3-71172.736.800112.4D321 I322 N327D321-Q325 WeakPolarHBondContact O-CG 3.49Å; D321-Q325 PolarHBondContact O-N 3.04Å; I322-Q325 WeakPolarHBondContact O-CB 3.49Å; I322-Q325 PolarHBondContact O-N 3.48Å; I322-Q325 VanDerWaalsContact O-N 3.14Å; Q325-N327 VanDerWaalsContact C-N 3.28Å; Q325-N327 PolarHBondContact O-N 3.12Å
326C90.1Very high89.6Confident5 Ų567 Ų673%0.03434%0.341CS..THydrogen-bonded Turntrans-85.513.2175.9-64.70000114I322 L323 T324 G328 D329 Q332 A333 L336I322-C326 PolarHBondContact O-N 3.44Å; I322-C326 PolarHBondContact O-SG 3.21Å; I322-C326 VanDerWaalsContact O-SG 3.39Å; L323-C326 CarbonylContact O-C 3.6Å; L323-C326 PolarHBondContact O-N 2.96Å; T324-C326 VanDerWaalsContact C-N 3.27Å; T324-C326 PolarHBondContact O-N 3.28Å; C326-G328 PolarHBondContact O-N 3.2Å; C326-G328 VanDerWaalsContact O-N 3.07Å; C326-D329 HydrophobicContact CB-CB 4.42Å; C326-D329 WeakPolarHBondContact O-CB 3.13Å; C326-D329 PolarHBondContact O-N 3.3Å; C326-Q332 HydrophobicContact CB-CB 4.03Å; C326-A333 HydrophobicContact CB-CB 4.27Å; C326-L336 VanDerWaalsContact SG-CD1 3.58Å
327N86.6Confident89.4Confident128 Ų12860.7 Ų60.768%0.68432%0.317SS*.THydrogen-bonded Turntrans58.216.8-178.2-63-57.3000115.6R300 L323 T324 Q325R300-N327 PolarHBondContact NE-O 3.06Å; R300-N327 PolarHBondContact NH2-O 2.87Å; L323-N327 PolarHBondContact O-N 3Å; T324-N327 PolarHBondContact O-N 3.33Å; Q325-N327 VanDerWaalsContact C-N 3.28Å; Q325-N327 PolarHBondContact O-N 3.12Å
328G83.6Confident89.2Confident11 Ų1159.1 Ų59.111%0.11331%0.312CS..THydrogen-bonded Turntrans93.43-172.600000115N303 L323 C326 Y330N303-G328 PolarHBondContact ND2-O 3Å; L323-G328 PolarHBondContact O-N 2.85Å; C326-G328 PolarHBondContact O-N 3.2Å; C326-G328 VanDerWaalsContact O-N 3.07Å; G328-Y330 PolarHBondContact O-N 3.47Å
329D88.8Confident88.7Confident62 Ų6258.9 Ų58.933%0.33232%0.32SS..  trans-73.7114.9176.7-170.5-22.3000110.8C326 E331 Q332 A333C326-D329 HydrophobicContact CB-CB 4.42Å; C326-D329 WeakPolarHBondContact O-CB 3.13Å; C326-D329 PolarHBondContact O-N 3.3Å; D329-E331 PolarHBondContact OD1-N 3.17Å; D329-Q332 HydrophobicContact CB-CB 4.22Å; D329-Q332 HydrophobicContact CB-CG 4.29Å; D329-Q332 PolarHBondContact OD1-N 3.48Å; D329-Q332 WeakPolarHBondContact OD2-CG 3.39Å; D329-Q332 PolarHBondContact OD2-NE2 3.23Å; D329-A333 WeakPolarHBondContact O-CB 3.3Å; D329-A333 PolarHBondContact O-N 3.3Å; D329-A333 VanDerWaalsContact O-N 3.17Å
330Y90.4Very high88.1Confident53 Ų5362.6 Ų62.621%0.20834%0.343CS..Hα-helixtrans-66.5-39.4-178.5172.9-97.9000112.9N303 K306 L307 I310 G328 A333 C334N303-Y330 HydrophobicContact CB-CD2 4.2Å; K306-Y330 HydrophobicContact CB-CD2 4.46Å; K306-Y330 HydrophobicContact CB-CE2 3.77Å; K306-Y330 HydrophobicContact CD-CE2 4.18Å; L307-Y330 HydrophobicContact CD1-CD2 4.42Å; L307-Y330 HydrophobicContact CD2-CD2 4.06Å; L307-Y330 HydrophobicContact CD2-CE2 3.78Å; L307-Y330 HydrophobicContact CG-CD2 3.93Å; L307-Y330 HydrophobicContact CG-CE2 3.88Å; I310-Y330 HydrophobicContact CD1-CE2 4.42Å; I310-Y330 WeakPolarHBondContact CD1-OH 3.47Å; G328-Y330 PolarHBondContact O-N 3.47Å; Y330-A333 PolarHBondContact O-N 3.4Å; Y330-C334 VanDerWaalsContact CE1-SG 3.56Å; Y330-C334 WeakPolarHBondContact O-CB 3.47Å; Y330-C334 PolarHBondContact O-N 3.27Å; Y330-C334 PolarHBondContact O-SG 2.75Å
331E89.5Confident87.1Confident131 Ų13163.6 Ų63.661%0.61235%0.35SS*.Hα-helixtrans-72.2-40.8-174.2-66.5-63.7149.400110.5D329 C334 A335D329-E331 PolarHBondContact OD1-N 3.17Å; E331-C334 PolarHBondContact O-N 3.09Å; E331-A335 PolarHBondContact O-N 3.19Å
332Q88.9Confident85.5Confident104 Ų10466.7 Ų66.749%0.48637%0.373SS..Hα-helixtrans-65.9-43.6174.6-68-177.536.300111.8C326 D329 C334 A335 L336C326-Q332 HydrophobicContact CB-CB 4.03Å; D329-Q332 HydrophobicContact CB-CB 4.22Å; D329-Q332 HydrophobicContact CB-CG 4.29Å; D329-Q332 PolarHBondContact OD1-N 3.48Å; D329-Q332 WeakPolarHBondContact OD2-CG 3.39Å; D329-Q332 PolarHBondContact OD2-NE2 3.23Å; Q332-C334 VanDerWaalsContact C-N 3.34Å; Q332-C334 PolarHBondContact O-N 2.9Å; Q332-A335 PolarHBondContact O-N 3.43Å; Q332-L336 WeakPolarHBondContact O-CG 3.47Å; Q332-L336 PolarHBondContact O-N 3.44Å
333A89.8Confident85.2Confident0 Ų069.6 Ų69.60%039%0.389CS..Hα-helixtrans-63.4-40.2177.100000111.7L307 I322 L323 C326 D329 Y330 L336 L337L307-A333 HydrophobicContact CD1-CB 3.7Å; I322-A333 HydrophobicContact CG2-CB 3.99Å; L323-A333 HydrophobicContact CD1-CB 3.89Å; C326-A333 HydrophobicContact CB-CB 4.27Å; D329-A333 WeakPolarHBondContact O-CB 3.3Å; D329-A333 PolarHBondContact O-N 3.3Å; D329-A333 VanDerWaalsContact O-N 3.17Å; Y330-A333 PolarHBondContact O-N 3.4Å; A333-L336 PolarHBondContact O-N 3.05Å; A333-L337 WeakPolarHBondContact O-CB 3.33Å; A333-L337 WeakPolarHBondContact O-CD1 3.14Å; A333-L337 WeakPolarHBondContact O-CG 3.41Å; A333-L337 PolarHBondContact O-N 3.48Å
334C88Confident84.9Confident20 Ų2072.7 Ų72.714%0.13541%0.407CS..Hα-helixtrans-58.4-49.8172.4-75.10000111.7L307 Y330 E331 Q332 L336 L337 V338L307-C334 HydrophobicContact CD2-CB 4.43Å; L307-C334 WeakPolarHBondContact CD2-SG 3.33Å; Y330-C334 VanDerWaalsContact CE1-SG 3.56Å; Y330-C334 WeakPolarHBondContact O-CB 3.47Å; Y330-C334 PolarHBondContact O-N 3.27Å; Y330-C334 PolarHBondContact O-SG 2.75Å; E331-C334 PolarHBondContact O-N 3.09Å; Q332-C334 VanDerWaalsContact C-N 3.34Å; Q332-C334 PolarHBondContact O-N 2.9Å; C334-L336 VanDerWaalsContact C-N 3.33Å; C334-L336 PolarHBondContact O-N 3.06Å; C334-L337 PolarHBondContact O-N 3.07Å; C334-V338 VanDerWaalsContact O-CG2 3.29Å; C334-V338 WeakPolarHBondContact O-CG2 3.39Å; C334-V338 PolarHBondContact O-N 2.7Å
335A89.5Confident84.6Confident56 Ų5671.6 Ų71.646%0.46340%0.398SS..Hα-helixtrans-61.7-40.2-177.700000112.5E331 Q332 S339E331-A335 PolarHBondContact O-N 3.19Å; Q332-A335 PolarHBondContact O-N 3.43Å; A335-S339 WeakPolarHBondContact O-CB 3.25Å; A335-S339 PolarHBondContact O-N 2.98Å; A335-S339 VanDerWaalsContact O-N 3.09Å; A335-S339 PolarHBondContact O-OG 3.29Å
336L87.3Confident84.3Confident81 Ų8167.2 Ų67.242%0.42438%0.381SS..Hα-helixtrans-66.7-46.1175.1-70.6179.5000111.5I322 C326 Q332 A333 C334 V338 S339 T340I322-L336 HydrophobicContact CG2-CB 4.2Å; I322-L336 HydrophobicContact CG2-CD1 4.28Å; C326-L336 VanDerWaalsContact SG-CD1 3.58Å; Q332-L336 WeakPolarHBondContact O-CG 3.47Å; Q332-L336 PolarHBondContact O-N 3.44Å; A333-L336 PolarHBondContact O-N 3.05Å; C334-L336 VanDerWaalsContact C-N 3.33Å; C334-L336 PolarHBondContact O-N 3.06Å; L336-V338 PolarHBondContact O-N 2.93Å; L336-S339 PolarHBondContact O-N 2.84Å; L336-T340 WeakPolarHBondContact O-CG2 3.29Å; L336-T340 PolarHBondContact O-N 3.18Å; L336-T340 PolarHBondContact O-OG1 3.49Å
337L87.2Confident83.9Confident0 Ų071.1 Ų71.10%040%0.403CS..Hα-helixtrans-61.3-42.7179.1-79.3162.9000112.3L307 F311 F318 V319 I322 A333 C334 S339 T340 L341L307-L337 HydrophobicContact CB-CD1 4.42Å; L307-L337 HydrophobicContact CD1-CD1 4.31Å; L307-L337 HydrophobicContact CD2-CD1 3.9Å; L307-L337 HydrophobicContact CG-CD1 4.45Å; F311-L337 HydrophobicContact CD2-CB 4.13Å; F311-L337 HydrophobicContact CD2-CD1 3.84Å; F311-L337 HydrophobicContact CD2-CG 4.47Å; F311-L337 HydrophobicContact CE1-CB 4.32Å; F311-L337 HydrophobicContact CE2-CB 3.76Å; F311-L337 HydrophobicContact CE2-CD1 3.93Å; F311-L337 HydrophobicContact CE2-CG 4.45Å; F311-L337 HydrophobicContact CZ-CB 3.86Å; F318-L337 HydrophobicContact CD1-CD2 4.22Å; F318-L337 HydrophobicContact CE1-CD2 3.8Å; V319-L337 HydrophobicContact CG1-CD1 4.19Å; V319-L337 HydrophobicContact CG2-CD1 4.48Å; V319-L337 HydrophobicContact CG2-CD2 4.36Å; I322-L337 HydrophobicContact CD1-CD2 3.46Å; I322-L337 VanDerWaalsContact CD1-CD2 3.46Å; I322-L337 HydrophobicContact CD1-CG 3.87Å; I322-L337 HydrophobicContact CG2-CG 4.39Å; A333-L337 WeakPolarHBondContact O-CB 3.33Å; A333-L337 WeakPolarHBondContact O-CD1 3.14Å; A333-L337 WeakPolarHBondContact O-CG 3.41Å; A333-L337 PolarHBondContact O-N 3.48Å; C334-L337 PolarHBondContact O-N 3.07Å; L337-S339 VanDerWaalsContact C-N 3.34Å; L337-S339 PolarHBondContact O-N 3.43Å; L337-T340 WeakPolarHBondContact CA-OG1 3Å; L337-T340 PolarHBondContact O-N 2.76Å; L337-T340 PolarHBondContact O-OG1 3.37Å; L337-L341 WeakPolarHBondContact O-CB 3.48Å; L337-L341 WeakPolarHBondContact O-CD1 3.25Å; L337-L341 VanDerWaalsContact O-CG 3.27Å; L337-L341 WeakPolarHBondContact O-CG 3.27Å; L337-L341 PolarHBondContact O-N 3.16Å
338V85.3Confident83.8Confident76 Ų7667.3 Ų67.346%0.46138%0.384SS..Hα-helixtrans-61.8-43.8174.8172.70000111F311 C334 L336 T340 L341 T342F311-V338 HydrophobicContact CE1-CG2 4.2Å; F311-V338 HydrophobicContact CZ-CG2 3.82Å; C334-V338 VanDerWaalsContact O-CG2 3.29Å; C334-V338 WeakPolarHBondContact O-CG2 3.39Å; C334-V338 PolarHBondContact O-N 2.7Å; L336-V338 PolarHBondContact O-N 2.93Å; V338-T340 VanDerWaalsContact C-N 3.31Å; V338-T340 PolarHBondContact O-N 3.2Å; V338-L341 PolarHBondContact O-N 3.46Å; V338-T342 PolarHBondContact O-N 3.23Å; V338-T342 PolarHBondContact O-OG1 3.4Å
339S80.3Confident83.8Confident79 Ų7971.4 Ų71.455%0.55240%0.404SS*.Hα-helixtrans-69.2-25178.7-55.50000113.8A335 L336 L337A335-S339 WeakPolarHBondContact O-CB 3.25Å; A335-S339 PolarHBondContact O-N 2.98Å; A335-S339 VanDerWaalsContact O-N 3.09Å; A335-S339 PolarHBondContact O-OG 3.29Å; L336-S339 PolarHBondContact O-N 2.84Å; L337-S339 VanDerWaalsContact C-N 3.34Å; L337-S339 PolarHBondContact O-N 3.43Å
340T78.8Confident83.4Confident78 Ų7872.1 Ų72.148%0.47941%0.409SS..Hα-helixtrans-84-19.8176.454.40000114.1L336 L337 V338L336-T340 WeakPolarHBondContact O-CG2 3.29Å; L336-T340 PolarHBondContact O-N 3.18Å; L336-T340 PolarHBondContact O-OG1 3.49Å; L337-T340 WeakPolarHBondContact CA-OG1 3Å; L337-T340 PolarHBondContact O-N 2.76Å; L337-T340 PolarHBondContact O-OG1 3.37Å; V338-T340 VanDerWaalsContact C-N 3.31Å; V338-T340 PolarHBondContact O-N 3.2Å
341L72Confident82.8Confident96 Ų9673.7 Ų73.750%0.50343%0.426SS..Hα-helixtrans-104-0.3-177.9-64.5170.5000112.8F311 L337 V338F311-L341 HydrophobicContact CD1-CD1 3.34Å; F311-L341 HydrophobicContact CE1-CD1 3.8Å; F311-L341 HydrophobicContact CG-CD1 4.18Å; L337-L341 WeakPolarHBondContact O-CB 3.48Å; L337-L341 WeakPolarHBondContact O-CD1 3.25Å; L337-L341 VanDerWaalsContact O-CG 3.27Å; L337-L341 WeakPolarHBondContact O-CG 3.27Å; L337-L341 PolarHBondContact O-N 3.16Å; V338-L341 PolarHBondContact O-N 3.46Å
342T57.1Low82.2Confident163 Ų16368.5 Ų68.5100%141%0.409SS*.  trans-103.10166.832.50000109.6V338V338-T342 PolarHBondContact O-N 3.23Å; V338-T342 PolarHBondContact O-OG1 3.4Å

Retrieved 342 of 342 residues in 654.7 ms (Link to these results)