X2JK78_DROME Loading...

b(0,+)-type amino acid transporter 1

AlphaFold DB , UniProt , Accession X2JK78, Species DROME (Drosophila melanogaster, Fruit fly), Gene sbm, Length 459 aa.

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(Predicted Aligned Error values between residue pairs)
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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M47.2Very low37.6Very low159 Ų159103.5 Ų103.578%0.78353%0.528SS*.  0-80-151.8167-171.100113V391M1-V391 WeakPolarHBondContact O-CG2 3.15Å; M1-V391 PolarHBondContact O-N 2.92Å
2Y42.3Very low36.7Very low103 Ų103108.8 Ų108.840%0.40455%0.549SS..EExtended strand (participates in β ladder)trans-123.9150.5171-64-92.3000109.1Y388 V389 H390 A397 P398Y2-Y388 VanDerWaalsContact CB-CD1 3.47Å; Y2-V389 WeakPolarHBondContact CA-O 3.29Å; Y2-H390 HydrophobicContact CD1-CB 4.22Å; Y2-H390 HydrophobicContact CE1-CB 3.92Å; Y2-H390 AromaticContact CE1-CD2 3.98Å; Y2-H390 AromaticContact CZ-CD2 3.94Å; Y2-A397 HydrophobicContact CE1-CB 4.37Å; Y2-P398 HydrophobicContact CE1-CG 4.3Å
3Q39.9Very low36Very low99 Ų99112.7 Ų112.746%0.46357%0.569SS.*EExtended strand (participates in β ladder)trans-120.1137.1177.7-120.9171.1-21.700109.7V389 V391Q3-V389 PolarHBondContact N-O 3.16Å; Q3-V389 VanDerWaalsContact N-O 3.17Å; Q3-V389 PolarHBondContact O-N 3.15Å; Q3-V391 HydrophobicContact CB-CG2 4.11Å; Q3-V391 HydrophobicContact CG-CG2 4.48Å
4H40.4Very low35.3Very low64 Ų64115.3 Ų115.330%0.29658%0.578SS.*  trans-78.8127.2172.2-171.6-83.3000109.1S387 Y388H4-S387 PolarHBondContact CD2-OG 2.97Å; H4-S387 PolarHBondContact NE2-OG 2.77Å; H4-Y388 HydrophobicContact CB-CE1 4.38Å
5V49.6Very low35.1Very low9 Ų9114.1 Ų114.16%0.05559%0.593CS.*  trans-90.5110.5173.6178.10000106.9V69 F374V5-V69 HydrophobicContact CG2-CB 4.32Å; V5-F374 HydrophobicContact CB-CE2 4.18Å; V5-F374 HydrophobicContact CB-CZ 4.05Å; V5-F374 HydrophobicContact CG1-CZ 4.2Å; V5-F374 HydrophobicContact CG2-CE2 4.01Å; V5-F374 HydrophobicContact CG2-CZ 3.94Å
6Q32.5Very low34.5Very low137 Ų137115.4 Ų115.464%0.6460%0.601SS**PPolyproline II helixtrans-66.1144177.5-72.9-87.7-27.200110.3
7P36.8Very low34.3Very low51 Ų51112.6 Ų112.633%0.33161%0.607SS.*PPolyproline II helixtrans-59.414617223.8-30.6000110.4N9 R378P7-N9 PolarHBondContact O-N 2.97Å; P7-R378 HydrophobicContact CB-CG 4.24Å
8N36.7Very low33.9Very low114 Ų114116.1 Ų116.161%0.6162%0.618SS**PPolyproline II helixtrans-68119.5179.6-152.918.6000107.5T10N8-T10 PolarHBondContact O-N 3.44Å; N8-T10 PolarHBondContact O-OG1 3.18Å
9N28.6Very low33.5Very low159 Ų159117.7 Ų117.785%0.8563%0.627SS**  trans-76.167.1173.3-135.418.6000108.1P7 N11P7-N9 PolarHBondContact O-N 2.97Å; N9-N11 PolarHBondContact O-N 2.99Å
10T32.3Very low33.1Very low94 Ų94118.4 Ų118.458%0.57764%0.636SS**  trans-68.5114.7165.110000105.9N8 H12N8-T10 PolarHBondContact O-N 3.44Å; N8-T10 PolarHBondContact O-OG1 3.18Å; T10-H12 VanDerWaalsContact C-N 3.33Å; T10-H12 PolarHBondContact O-N 3.31Å
11N27.5Very low32.9Very low150 Ų150118.4 Ų118.480%0.80264%0.642SS**  trans-48.895.3175.1-76.4-29.3000110.3N9 I13N9-N11 PolarHBondContact O-N 2.99Å; N11-I13 VanDerWaalsContact C-N 3.33Å; N11-I13 PolarHBondContact O-N 3.3Å
12H26.9Very low31.8Very low167 Ų167116.9 Ų116.977%0.77364%0.642SS**  trans-64.4102.2156.5-79.2-75.1000105.7T10 H14T10-H12 VanDerWaalsContact C-N 3.33Å; T10-H12 PolarHBondContact O-N 3.31Å; H12-H14 PolarHBondContact O-N 2.92Å
13I27.8Very low31Very low159 Ų159121.3 Ų121.382%0.81566%0.663SS**  trans-64.690167.4-60.7175.8000105.9N11 A15N11-I13 VanDerWaalsContact C-N 3.33Å; N11-I13 PolarHBondContact O-N 3.3Å; I13-A15 PolarHBondContact O-N 3.3Å; I13-A15 VanDerWaalsContact O-N 3.12Å
14H25.9Very low30.3Very low149 Ų149122.4 Ų122.469%0.6968%0.677SS**  trans-63.8105.7161.5-97.6-86.1000107H12 N16H12-H14 PolarHBondContact O-N 2.92Å; H14-N16 PolarHBondContact O-N 3.13Å
15A31.7Very low29.6Very low98 Ų98125.6 Ų125.681%0.8170%0.701SS**  trans-68.279.816200000108.4I13I13-A15 PolarHBondContact O-N 3.3Å; I13-A15 VanDerWaalsContact O-N 3.12Å
16N25.9Very low28.4Very low134 Ų134129.5 Ų129.572%0.71773%0.729SS**  trans-95.2112.8165.3-87.3-4.2000108.2H14H14-N16 PolarHBondContact O-N 3.13Å
17G31.8Very low28.1Very low68 Ų68130.7 Ų130.770%0.70174%0.739SS**  trans-62.3135.3174.300000111.6
18H26.9Very low27.6Very low175 Ų175131.4 Ų131.481%0.8176%0.756SS**  trans-147.7114.1153.4-95.3-50.5000110.4
19N26.5Very low27.2Very low147 Ų147132.3 Ų132.379%0.78677%0.766SS**  trans39.8101140.6-64.4-13.5000118.3
20V25.3Very low27Very low132 Ų132132.8 Ų132.880%0.877%0.765SS**  trans-62.8136.2152.31770000109.6
21P27.7Very low26.6Very low119 Ų119133.5 Ų133.577%0.77377%0.773SS**  trans-110.6124.6141.726-11.6000109.6
22T25.9Very low26.5Very low126 Ų126130.5 Ų130.577%0.77377%0.769SS**  trans-53.2138.616730.80000111.9
23K25.3Very low26.5Very low196 Ų196130.5 Ų130.585%0.85278%0.775SS**  trans-162.598.1140.1-107170.7-171-174.60111
24T24.2Very low26.3Very low123 Ų123126.4 Ų126.476%0.75577%0.771SS**  trans13.8122.2132.116.10000118.7
25T26Very low26.3Very low130 Ų130124.3 Ų124.380%0.79877%0.774SS**  167.6102.2115.123.30000107.6
26S23.9Very low26.1Very low92 Ų92128.2 Ų128.264%0.64378%0.78SS**  71.3124.589.983.30000115
27N26.4Very low26.1Very low161 Ų161124.9 Ų124.986%0.86178%0.777SS**  trans89.5115.7152.5-61.2-7.8000118.7
28G26.7Very low25.8Very low67 Ų67127.9 Ų127.969%0.69178%0.782SS**  133.385.1117.400000116.9
29T27.1Very low25.8Very low133 Ų133128.7 Ų128.782%0.81679%0.786SS**  62107.2123.5-34.80000120.2
30M24.6Very low25.7Very low169 Ų169125.1 Ų125.183%0.83378%0.784SS**  45.7129.6126.9-82.5-176.6156.600123
31C24.5Very low26.7Very low108 Ų108124.8 Ų124.873%0.7379%0.785SS**  81.3115.8125.6-68.10000122.1
32A26.3Very low26.7Very low87 Ų87128.7 Ų128.772%0.71979%0.793SS**  84.9122.9114.400000122
33N26.1Very low26.9Very low168 Ų168127.1 Ų127.190%0.89879%0.792SS**  trans72.7132.4131.4-82.70.9000123.6
34G24.8Very low27.3Very low72 Ų72123.5 Ų123.574%0.74279%0.789SS**  trans82.2146.4142.500000115.3
35S25.5Very low27.4Very low106 Ų106126.1 Ų126.174%0.74179%0.792SS**  cis174.6145.61.236.50000106.7
36L26Very low27.5Very low180 Ų180125.4 Ų125.494%0.94279%0.788SS**  trans51.5138.5148.4-86.286.4000122.9
37G26.1Very low27.5Very low63 Ų63128 Ų12865%0.64980%0.795SS**  trans141.782.7152.500000112.6
38T27Very low27.6Very low131 Ų131126 Ų12680%0.80479%0.794SS**  49.3112.998.455.40000115.7
39E26.6Very low27.6Very low192 Ų192128.8 Ų128.890%0.89780%0.803SS**  157.9122.2126.7-85.4177.5175.500109.8
40G24.1Very low27.6Very low73 Ų73126.1 Ų126.175%0.75380%0.801SS**  trans-93.1-152.7159.300000109.1
41P45.6Very low28Very low125 Ų125125.6 Ų125.681%0.81281%0.808SS**  cis-125.2158.6-35.936.5-23.1000110.2
42E27.2Very low28.2Very low201 Ų201124.1 Ų124.194%0.93981%0.811SS**  trans-157.2120.1160.9-120.1168-164.600112.1
43A30.3Very low28.3Very low92 Ų92131.9 Ų131.976%0.7682%0.821SS**  trans-112.8154.7160.400000107.3
44P34.5Very low28.5Very low121 Ų121132.4 Ų132.479%0.78682%0.821SS**  -137.4138.9129.526.7-8.8000114.3
45E26.9Very low28.7Very low177 Ų177140.4 Ų140.483%0.82783%0.829SS**  trans2.1146.9131.7-75.2178.9175.500117.9
46T27.2Very low28.8Very low115 Ų115145.1 Ų145.171%0.70684%0.836SS**  cis-174.616036.617.10000111.8
47D25Very low29Very low147 Ų147142.3 Ų142.379%0.78683%0.828SS**  trans54.8123146.7-71.4-11.9000124.7
48S27.8Very low29.3Very low120 Ų120147.6 Ų147.684%0.83984%0.841SS**  171.4145.198.649.80000113.7
49S26.1Very low29.4Very low125 Ų125150.1 Ų150.187%0.87484%0.843SS**  trans-70.8137.3-179.551.70000114.4
50G28.4Very low29.5Very low77 Ų77152.7 Ų152.779%0.79485%0.845SS**  trans-159106.4168.300000112.3G52G50-G52 PolarHBondContact O-N 3.02Å
51T31.6Very low29.9Very low157 Ų157157.2 Ų157.296%0.96385%0.852SS**  trans-64.2121.2175.241.90000112.2
52G28.7Very low29.3Very low77 Ų77154.3 Ų154.379%0.79485%0.845SS**  trans-147.3110.4172.400000111.5G50G50-G52 PolarHBondContact O-N 3.02Å
53R29.6Very low29.3Very low250 Ų250149.8 Ų149.894%0.94384%0.835SS**  trans-76.9139.1179.1-154.6176.5-169.7-179.92.5109.7
54M29.2Very low29.4Very low179 Ų179151.7 Ų151.788%0.88284%0.838SS**  trans83.5105.5157.3-115.1176.6159.800119.8
55R28.8Very low29.4Very low241 Ų241152.8 Ų152.891%0.90983%0.832SS**  -177.7108.3111-96.7174.3179-176.80.4109.6
56K29Very low29.7Very low204 Ų204151.3 Ų151.389%0.88783%0.83SS**  trans-68.5136.7164.3-81.2-178.2174.6-178.60108.1L58K56-L58 PolarHBondContact O-N 3.42Å
57P29Very low30.1Very low121 Ų121153 Ų15379%0.78683%0.829SS**  trans-64.4133170.5-10.925.9000108.6E59P57-E59 PolarHBondContact O-N 3.19Å
58L32Very low31.3Very low174 Ų174149.1 Ų149.191%0.91181%0.811SS**  trans-56.7106.7168.9-82.5145.8000108.6K56 R60K56-L58 PolarHBondContact O-N 3.42Å; L58-R60 PolarHBondContact O-N 3.48Å; L58-R60 VanDerWaalsContact O-N 3.16Å
59E30.8Very low32.5Very low185 Ų185145.4 Ų145.486%0.86478%0.783SS**  trans-59.1115.9161-84.6-176.3130.300107.9P57 N61P57-E59 PolarHBondContact O-N 3.19Å; E59-N61 VanDerWaalsContact C-N 3.28Å; E59-N61 PolarHBondContact O-N 2.9Å
60R28.2Very low34.1Very low246 Ų246145.7 Ų145.793%0.92877%0.771SS**  trans-65.989.1170.6-177.5179.1179.4-178.5-0.3108.3L58 G62L58-R60 PolarHBondContact O-N 3.48Å; L58-R60 VanDerWaalsContact O-N 3.16Å; R60-G62 PolarHBondContact O-N 3.11Å
61N31.5Very low35.9Very low168 Ų168143.9 Ų143.990%0.89874%0.742SS**  trans-63.7121.4163.8-112.3-9.1000108.9E59E59-N61 VanDerWaalsContact C-N 3.28Å; E59-N61 PolarHBondContact O-N 2.9Å
62G33Very low37.9Very low64 Ų64141.3 Ų141.366%0.6672%0.719SS**  trans15145.1172.700000115.4R60R60-G62 PolarHBondContact O-N 3.11Å
63S28.3Very low40.3Very low106 Ų106144.3 Ų144.374%0.74171%0.707SS**  trans-94.599.6147.4530000107Q65S63-Q65 PolarHBondContact O-N 3.46Å
64T32.7Very low42.6Very low132 Ų132137.6 Ų137.681%0.8168%0.681SS**  trans-59.590.5163.2-28.50000106.2N66T64-N66 PolarHBondContact O-N 3.48Å
65Q33.6Very low45.2Very low144 Ų144129.4 Ų129.467%0.67364%0.641SS**  trans-61.1109.1166-80.1-167.8-3.500105.6S63 H67S63-Q65 PolarHBondContact O-N 3.46Å; Q65-H67 PolarHBondContact O-N 3.49Å
66N32.7Very low48Very low145 Ų145119 Ų11978%0.77561%0.609SS**  trans-55.593.6160.7-81.5-22.5000106.3T64 V68T64-N66 PolarHBondContact O-N 3.48Å; N66-V68 PolarHBondContact O-N 3.37Å
67H36.6Very low50.9Low150 Ų150112 Ų11269%0.69458%0.581SS**  trans-67.783.5170.5-102.4-60.7000106.9Q65 V69Q65-H67 PolarHBondContact O-N 3.49Å; H67-V69 PolarHBondContact O-N 2.84Å; H67-V69 VanDerWaalsContact O-N 3.08Å
68V49.9Very low53.8Low66 Ų66113.2 Ų113.240%0.457%0.574SS.*  trans-62.3110.8165-174.60000105.2N66 H70N66-V68 PolarHBondContact O-N 3.37Å; V68-H70 PolarHBondContact O-CD2 3.13Å; V68-H70 PolarHBondContact O-N 3.31Å; V68-H70 VanDerWaalsContact O-N 3.11Å
69V53.8Low56.5Low43 Ų43106.1 Ų106.126%0.26154%0.539SS..  trans-70.1108.7-179.5177.40000107.2V5 H67 L394V5-V69 HydrophobicContact CG2-CB 4.32Å; H67-V69 PolarHBondContact O-N 2.84Å; H67-V69 VanDerWaalsContact O-N 3.08Å; V69-L394 HydrophobicContact CG1-CD2 3.7Å
70H58.9Low59.3Low131 Ų13197.4 Ų97.461%0.60650%0.499SS*.PPolyproline II helixtrans-95.1145.4173.3-70.6-78.7000110.5V68 E72V68-H70 PolarHBondContact O-CD2 3.13Å; V68-H70 PolarHBondContact O-N 3.31Å; V68-H70 VanDerWaalsContact O-N 3.11Å; H70-E72 PolarHBondContact O-N 3.22Å
71L66.6Low62.4Low38 Ų3886.9 Ų86.920%0.19946%0.462CS..PPolyproline II helixtrans-64.2131.7169.3-75.2158.4000109.3E289 F374L71-E289 HydrophobicContact CB-CG 3.92Å; L71-E289 HydrophobicContact CD2-CG 4.48Å; L71-F374 HydrophobicContact CD1-CD1 4.37Å; L71-F374 HydrophobicContact CD1-CE1 4.08Å
72E72.6Confident65.2Low103 Ų10379.2 Ų79.248%0.48142%0.422SS..PPolyproline II helixtrans-79136.6-179-76.1-172.5-159.900112.3H70 R74H70-E72 PolarHBondContact O-N 3.22Å; E72-R74 HydrophobicContact CB-CG 3.99Å; E72-R74 VanDerWaalsContact CD-NH2 3.3Å; E72-R74 PolarHBondContact O-N 3.26Å; E72-R74 IonicContact OE1-NH2 3.45Å; E72-R74 PolarHBondContact OE1-NH2 3.5Å; E72-R74 IonicContact OE2-CZ 3.09Å; E72-R74 IonicContact OE2-NE 2.73Å; E72-R74 PolarHBondContact OE2-NE 2.78Å; E72-R74 IonicContact OE2-NH2 2.65Å; E72-R74 PolarHBondContact OE2-NH2 3.08Å
73R79.8Confident67.9Low140 Ų14076.2 Ų76.253%0.52839%0.391SS..  trans-71.287.2175.7-71.8-179.6179.9176.60.5112.4E288 E289 K291R73-E288 VanDerWaalsContact CG-O 3.23Å; R73-E288 WeakPolarHBondContact CG-O 2.88Å; R73-E289 CarbonylContact C-O 3.51Å; R73-E289 WeakPolarHBondContact CA-O 3.42Å; R73-K291 HydrophobicContact CB-CG 4.4Å; R73-K291 VanDerWaalsContact O-CE 3.26Å; R73-K291 WeakPolarHBondContact O-CE 3.48Å; R73-K291 WeakPolarHBondContact O-CG 3.46Å
74R77.8Confident71Confident110 Ų11071.1 Ų71.142%0.41536%0.355SS..  trans-108.2-17.8-175.1-66.8-178.4174.4-157.23.1114.3E72 N216 E289E72-R74 HydrophobicContact CB-CG 3.99Å; E72-R74 VanDerWaalsContact CD-NH2 3.3Å; E72-R74 PolarHBondContact O-N 3.26Å; E72-R74 IonicContact OE1-NH2 3.45Å; E72-R74 PolarHBondContact OE1-NH2 3.5Å; E72-R74 IonicContact OE2-CZ 3.09Å; E72-R74 IonicContact OE2-NE 2.73Å; E72-R74 PolarHBondContact OE2-NE 2.78Å; E72-R74 IonicContact OE2-NH2 2.65Å; E72-R74 PolarHBondContact OE2-NH2 3.08Å; R74-N216 PolarHBondContact NH1-ND2 3.01Å; R74-N216 VanDerWaalsContact NH1-ND2 3.14Å; R74-N216 PolarHBondContact NH1-OD1 2.66Å; R74-E289 PolarHBondContact N-O 2.78Å
75L83Confident73.8Confident6 Ų664.9 Ų64.93%0.03132%0.317CS..BIsolated β-bridgetrans-86.9114.7-173.8-56.5174.4000111.5M219 V286 E289 I290 K291L75-M219 HydrophobicContact CD2-CE 3.51Å; L75-M219 HydrophobicContact CD2-CG 3.81Å; L75-M219 HydrophobicContact CD2-SD 3.73Å; L75-V286 HydrophobicContact CD1-CB 3.92Å; L75-V286 HydrophobicContact CD1-CG2 3.84Å; L75-E289 WeakPolarHBondContact CB-O 3.49Å; L75-E289 HydrophobicContact CD1-CB 3.77Å; L75-E289 HydrophobicContact CG-CB 4.07Å; L75-E289 PolarHBondContact N-O 2.86Å; L75-I290 HydrophobicContact CB-CG1 4.36Å; L75-I290 HydrophobicContact CD1-CG1 4.43Å; L75-K291 WeakPolarHBondContact O-CB 3.49Å; L75-K291 PolarHBondContact O-N 3.47Å
76G88.4Confident76.5Confident23 Ų2358 Ų5824%0.23729%0.285CS..  trans-84.6178.4171.400000112.9F78 S79 G80G76-F78 PolarHBondContact O-N 2.93Å; G76-S79 PolarHBondContact O-N 2.85Å; G76-G80 PolarHBondContact O-N 2.96Å
77L90.1Very high79.3Confident57 Ų5751.3 Ų51.330%0.29825%0.249SC..Hα-helixtrans-56.8-45.7177.8179.364.4000112.6S79 G80 V81 N296 R299L77-S79 PolarHBondContact O-N 3.47Å; L77-G80 PolarHBondContact O-N 3.28Å; L77-G80 VanDerWaalsContact O-N 3.15Å; L77-V81 HydrophobicContact CD1-CG2 4.42Å; L77-V81 WeakPolarHBondContact O-CG2 3.37Å; L77-V81 PolarHBondContact O-N 3.4Å; L77-N296 HydrophobicContact CD1-CB 4.48Å; L77-R299 HydrophobicContact CD1-CB 3.73Å
78F89.6Confident81.9Confident147 Ų14744.3 Ų44.365%0.64522%0.217SC*.Hα-helixtrans-60.9-46.3179.5-179.7-96.2000111.9G76 G80 V81 A82G76-F78 PolarHBondContact O-N 2.93Å; F78-G80 VanDerWaalsContact C-N 3.28Å; F78-G80 PolarHBondContact O-N 2.79Å; F78-V81 PolarHBondContact O-N 3.31Å; F78-A82 WeakPolarHBondContact O-CB 3.21Å; F78-A82 PolarHBondContact O-N 2.87Å
79S88.2Confident83.9Confident24 Ų2441.2 Ų41.217%0.16820%0.198CC..Hα-helixtrans-65.3-31.3176-56.10000112.4G76 L77 L83 N223G76-S79 PolarHBondContact O-N 2.85Å; L77-S79 PolarHBondContact O-N 3.47Å; S79-L83 VanDerWaalsContact O-CB 3.27Å; S79-L83 WeakPolarHBondContact O-CB 3.18Å; S79-L83 PolarHBondContact O-N 2.92Å; S79-N223 PolarHBondContact OG-ND2 3.39Å
80G90.6Very high85.4Confident3 Ų339.2 Ų39.23%0.03119%0.186CC..Hα-helixtrans-67.9-47.9174.800000112.7G76 L77 F78 A82 L83 I84G76-G80 PolarHBondContact O-N 2.96Å; L77-G80 PolarHBondContact O-N 3.28Å; L77-G80 VanDerWaalsContact O-N 3.15Å; F78-G80 VanDerWaalsContact C-N 3.28Å; F78-G80 PolarHBondContact O-N 2.79Å; G80-A82 VanDerWaalsContact C-N 3.33Å; G80-L83 PolarHBondContact O-N 3.28Å; G80-I84 PolarHBondContact O-N 3.32Å
81V92.3Very high86.4Confident24 Ų2433.2 Ų33.215%0.14516%0.159CC..Hα-helixtrans-61-45.2172.4175.70000110.3L77 F78 L83 I84 V85 I303L77-V81 HydrophobicContact CD1-CG2 4.42Å; L77-V81 WeakPolarHBondContact O-CG2 3.37Å; L77-V81 PolarHBondContact O-N 3.4Å; F78-V81 PolarHBondContact O-N 3.31Å; V81-L83 VanDerWaalsContact C-N 3.29Å; V81-L83 PolarHBondContact O-N 3.3Å; V81-I84 PolarHBondContact O-N 3.02Å; V81-V85 HydrophobicContact CG1-CG2 3.99Å; V81-V85 WeakPolarHBondContact O-CB 3.43Å; V81-V85 VanDerWaalsContact O-CG2 3.28Å; V81-V85 WeakPolarHBondContact O-CG2 3.41Å; V81-V85 PolarHBondContact O-N 2.9Å; V81-I303 HydrophobicContact CG1-CG2 4.13Å; V81-I303 HydrophobicContact CG2-CB 4.21Å; V81-I303 HydrophobicContact CG2-CG2 4.17Å
82A90.7Very high87.2Confident7 Ų731.5 Ų31.56%0.05815%0.151CC..Hα-helixtrans-64.5-33.2179.100000112.2F78 G80 G86 N223 T226F78-A82 WeakPolarHBondContact O-CB 3.21Å; F78-A82 PolarHBondContact O-N 2.87Å; G80-A82 VanDerWaalsContact C-N 3.33Å; A82-G86 WeakPolarHBondContact O-CA 3.37Å; A82-G86 PolarHBondContact O-N 3.39Å; A82-N223 WeakPolarHBondContact CB-OD1 3.32Å; A82-T226 HydrophobicContact CB-CG2 4.18Å; A82-T226 WeakPolarHBondContact O-CG2 3.22Å; A82-T226 PolarHBondContact O-OG1 3.2Å
83L90Very high87.9Confident1 Ų126.6 Ų26.61%0.00513%0.128CC..Hα-helixtrans-68.1-47.9173.3-173.166.6000110.9S79 G80 V81 G86 T87 Q222 L283 V286S79-L83 VanDerWaalsContact O-CB 3.27Å; S79-L83 WeakPolarHBondContact O-CB 3.18Å; S79-L83 PolarHBondContact O-N 2.92Å; G80-L83 PolarHBondContact O-N 3.28Å; V81-L83 VanDerWaalsContact C-N 3.29Å; V81-L83 PolarHBondContact O-N 3.3Å; L83-G86 CarbonylContact O-C 3.39Å; L83-G86 WeakPolarHBondContact O-CA 3.46Å; L83-G86 PolarHBondContact O-N 2.93Å; L83-T87 HydrophobicContact CD1-CG2 4.26Å; L83-T87 WeakPolarHBondContact O-CG2 3.5Å; L83-T87 PolarHBondContact O-N 3.14Å; L83-T87 PolarHBondContact O-OG1 2.9Å; L83-Q222 HydrophobicContact CD1-CG 4.06Å; L83-L283 HydrophobicContact CD2-CD1 3.97Å; L83-V286 HydrophobicContact CD2-CG1 4.4Å; L83-V286 HydrophobicContact CD2-CG2 3.74Å
84I92.6Very high88Confident0 Ų020.7 Ų20.70%011%0.106CC..Hα-helixtrans-60.2-56.2178.7-75.1-178.9000111.4G80 V81 G86 T87 M88 L283 I301 I305G80-I84 PolarHBondContact O-N 3.32Å; V81-I84 PolarHBondContact O-N 3.02Å; I84-G86 PolarHBondContact O-N 3.14Å; I84-T87 PolarHBondContact O-N 3.36Å; I84-T87 PolarHBondContact O-OG1 3.47Å; I84-M88 HydrophobicContact CG2-CE 3.19Å; I84-M88 HydrophobicContact CG2-SD 4.3Å; I84-M88 WeakPolarHBondContact O-CB 3.35Å; I84-M88 WeakPolarHBondContact O-CG 3.28Å; I84-M88 PolarHBondContact O-N 3.49Å; I84-L283 HydrophobicContact CD1-CB 3.94Å; I84-L283 HydrophobicContact CD1-CD2 3.44Å; I84-L283 VanDerWaalsContact CD1-CD2 3.44Å; I84-L283 HydrophobicContact CD1-CG 4.28Å; I84-L283 HydrophobicContact CG1-CB 3.78Å; I84-L283 HydrophobicContact CG1-CD2 3.94Å; I84-L283 HydrophobicContact CG1-CG 4.37Å; I84-I301 HydrophobicContact CD1-CB 4.4Å; I84-I301 HydrophobicContact CD1-CG1 3.61Å; I84-I305 HydrophobicContact CG2-CG1 4.31Å
85V93.3Very high87.9Confident1 Ų116.6 Ų16.61%0.0069%0.093CC..Hα-helixtrans-61.8-39.2177.9176.80000109.3V81 I89 T226 K229 L230 L307 V308V81-V85 HydrophobicContact CG1-CG2 3.99Å; V81-V85 WeakPolarHBondContact O-CB 3.43Å; V81-V85 VanDerWaalsContact O-CG2 3.28Å; V81-V85 WeakPolarHBondContact O-CG2 3.41Å; V81-V85 PolarHBondContact O-N 2.9Å; V85-I89 HydrophobicContact CG1-CD1 3.7Å; V85-I89 HydrophobicContact CG1-CG1 4.26Å; V85-I89 WeakPolarHBondContact O-CB 3.47Å; V85-I89 PolarHBondContact O-N 2.95Å; V85-T226 HydrophobicContact CB-CG2 4.17Å; V85-T226 HydrophobicContact CG1-CG2 4.04Å; V85-K229 WeakPolarHBondContact O-CE 3.39Å; V85-K229 PolarHBondContact O-NZ 3.28Å; V85-L230 HydrophobicContact CG1-CD1 4.41Å; V85-L230 HydrophobicContact CG1-CD2 3.97Å; V85-L230 HydrophobicContact CG1-CG 4.35Å; V85-L307 HydrophobicContact CG2-CD2 4.09Å; V85-V308 HydrophobicContact CB-CG2 4.35Å; V85-V308 HydrophobicContact CG1-CG2 4.17Å; V85-V308 HydrophobicContact CG2-CG2 4.17Å
86G90.2Very high88.1Confident0 Ų016.4 Ų16.40%09%0.092CC..Hα-helixtrans-51.8-46.8174.600000115.2A82 L83 I84 T226 K229 S361A82-G86 WeakPolarHBondContact O-CA 3.37Å; A82-G86 PolarHBondContact O-N 3.39Å; L83-G86 CarbonylContact O-C 3.39Å; L83-G86 WeakPolarHBondContact O-CA 3.46Å; L83-G86 PolarHBondContact O-N 2.93Å; I84-G86 PolarHBondContact O-N 3.14Å; G86-T226 VanDerWaalsContact CA-OG1 3.3Å; G86-T226 WeakPolarHBondContact CA-OG1 3.29Å; G86-K229 PolarHBondContact O-NZ 3.28Å; G86-S361 WeakPolarHBondContact O-CA 3.47Å
87T90.6Very high87.9Confident3 Ų315.3 Ų15.32%0.0188%0.081CC..Hα-helixtrans-85.7-41.3-178.350.10000111.7L83 I84 G279 N282 S361L83-T87 HydrophobicContact CD1-CG2 4.26Å; L83-T87 WeakPolarHBondContact O-CG2 3.5Å; L83-T87 PolarHBondContact O-N 3.14Å; L83-T87 PolarHBondContact O-OG1 2.9Å; I84-T87 PolarHBondContact O-N 3.36Å; I84-T87 PolarHBondContact O-OG1 3.47Å; T87-G279 PolarHBondContact OG1-O 3.05Å; T87-N282 WeakPolarHBondContact CB-ND2 3.47Å; T87-N282 HydrophobicContact CG2-CB 4.32Å; T87-N282 WeakPolarHBondContact CG2-ND2 3.21Å; T87-S361 PolarHBondContact O-OG 3.1Å
88M92Very high87.7Confident4 Ų413 Ų132%0.027%0.07CC..Hα-helixtrans-68.3-51.7-177.5-68.1-171.3-59.300112.7I84 G90 D278 W280 I305 V308 Y312I84-M88 HydrophobicContact CG2-CE 3.19Å; I84-M88 HydrophobicContact CG2-SD 4.3Å; I84-M88 WeakPolarHBondContact O-CB 3.35Å; I84-M88 WeakPolarHBondContact O-CG 3.28Å; I84-M88 PolarHBondContact O-N 3.49Å; M88-G90 VanDerWaalsContact C-N 3.27Å; M88-G90 PolarHBondContact O-N 2.95Å; M88-D278 WeakPolarHBondContact CA-O 3.49Å; M88-W280 HydrophobicContact SD-CB 3.77Å; M88-I305 HydrophobicContact CE-CB 4.29Å; M88-I305 HydrophobicContact CE-CG1 3.73Å; M88-I305 HydrophobicContact SD-CG1 4.03Å; M88-V308 HydrophobicContact CB-CG1 4.17Å; M88-V308 HydrophobicContact CB-CG2 4.3Å; M88-V308 HydrophobicContact CE-CB 3.9Å; M88-V308 HydrophobicContact CE-CG1 4.37Å; M88-V308 HydrophobicContact CE-CG2 3.53Å; M88-Y312 PolarHBondContact O-OH 3.32Å
89I91.4Very high87.3Confident0 Ų06.3 Ų6.30%04%0.042CC..SBendtrans-72.587.1175-52.9-179.8000108.3V85 I93 K229 L230 V233 V308 Y312 S357V85-I89 HydrophobicContact CG1-CD1 3.7Å; V85-I89 HydrophobicContact CG1-CG1 4.26Å; V85-I89 WeakPolarHBondContact O-CB 3.47Å; V85-I89 PolarHBondContact O-N 2.95Å; I89-I93 HydrophobicContact CG2-CG2 4.45Å; I89-K229 HydrophobicContact CB-CD 4.28Å; I89-K229 HydrophobicContact CG2-CD 4.25Å; I89-K229 PolarHBondContact O-NZ 2.73Å; I89-L230 HydrophobicContact CD1-CD2 4.08Å; I89-V233 HydrophobicContact CG2-CG2 4.42Å; I89-V308 HydrophobicContact CD1-CG2 4Å; I89-V308 HydrophobicContact CG1-CB 4.42Å; I89-V308 HydrophobicContact CG1-CG1 3.99Å; I89-V308 HydrophobicContact CG1-CG2 3.72Å; I89-Y312 WeakPolarHBondContact CA-OH 3.32Å; I89-Y312 HydrophobicContact CB-CE1 4.45Å; I89-Y312 HydrophobicContact CG1-CE1 3.94Å; I89-Y312 HydrophobicContact CG2-CE1 4.43Å; I89-S357 PolarHBondContact O-OG 2.72Å; I89-S357 VanDerWaalsContact O-OG 3.07Å
90G85.6Confident87.3Confident2 Ų25.1 Ų5.12%0.0213%0.034CC..SBendtrans-127.1-138.6-178.600000112.1M88 G92 F94M88-G90 VanDerWaalsContact C-N 3.27Å; M88-G90 PolarHBondContact O-N 2.95Å; G90-G92 VanDerWaalsContact C-N 3.29Å; G90-G92 PolarHBondContact O-N 3.03Å; G90-F94 VanDerWaalsContact O-CD2 3.25Å; G90-F94 WeakPolarHBondContact O-CD2 3.12Å; G90-F94 VanDerWaalsContact O-CE2 3.28Å; G90-F94 WeakPolarHBondContact O-CE2 3.45Å
91S79.1Confident87.1Confident4 Ų45.3 Ų5.33%0.0283%0.034CC..SBendtrans-68.8-27.4176.450.90000113.1I93 F94 V95 S176S91-I93 PolarHBondContact O-N 3.37Å; S91-F94 PolarHBondContact O-N 3.36Å; S91-F94 VanDerWaalsContact O-N 3.08Å; S91-V95 PolarHBondContact O-N 2.92Å; S91-S176 VanDerWaalsContact CB-CB 3.44Å; S91-S176 WeakPolarHBondContact CB-OG 3.39Å
92G83.5Confident86.9Confident3 Ų35.8 Ų5.83%0.0314%0.037CC..Hα-helixtrans-58.3-43.1-172.300000114.3G90 F94 V95 S96G90-G92 VanDerWaalsContact C-N 3.29Å; G90-G92 PolarHBondContact O-N 3.03Å; G92-F94 PolarHBondContact O-N 2.73Å; G92-V95 PolarHBondContact O-N 3.1Å; G92-S96 WeakPolarHBondContact O-CA 3.49Å; G92-S96 WeakPolarHBondContact O-CB 3.3Å; G92-S96 PolarHBondContact O-N 3.32Å; G92-S96 PolarHBondContact O-OG 3.09Å; G92-S96 VanDerWaalsContact O-OG 3.06Å
93I87Confident86.7Confident0 Ų08 Ų80%04%0.044CC..Hα-helixtrans-67.1-19.3179.6-168.453.2000114I89 S91 P97 W114 Y312 I315I89-I93 HydrophobicContact CG2-CG2 4.45Å; S91-I93 PolarHBondContact O-N 3.37Å; I93-P97 WeakPolarHBondContact O-CD 3.44Å; I93-P97 WeakPolarHBondContact O-CG 3.36Å; I93-W114 HydrophobicContact CD1-CH2 3.8Å; I93-W114 HydrophobicContact CD1-CZ2 4.21Å; I93-W114 HydrophobicContact CD1-CZ3 4.27Å; I93-Y312 HydrophobicContact CB-CD1 4Å; I93-Y312 HydrophobicContact CB-CE1 3.51Å; I93-Y312 HydrophobicContact CD1-CD1 3.54Å; I93-Y312 HydrophobicContact CD1-CD2 4.28Å; I93-Y312 HydrophobicContact CD1-CE1 3.99Å; I93-Y312 HydrophobicContact CD1-CG 3.68Å; I93-Y312 HydrophobicContact CG1-CD1 3.57Å; I93-Y312 HydrophobicContact CG1-CE1 3.65Å; I93-Y312 HydrophobicContact CG1-CG 4.24Å; I93-Y312 HydrophobicContact CG2-CE1 4.06Å; I93-I315 HydrophobicContact CD1-CG2 4.29Å; I93-I315 HydrophobicContact CG1-CD1 3.86Å; I93-I315 HydrophobicContact CG1-CG2 4.1Å
94F81.6Confident86.6Confident16 Ų168.1 Ų8.17%0.074%0.044CC..Hα-helixtrans-92.1-19.4179.7-54-60.5000112.7G90 S91 G92 Y180 A335 V354G90-F94 VanDerWaalsContact O-CD2 3.25Å; G90-F94 WeakPolarHBondContact O-CD2 3.12Å; G90-F94 VanDerWaalsContact O-CE2 3.28Å; G90-F94 WeakPolarHBondContact O-CE2 3.45Å; S91-F94 PolarHBondContact O-N 3.36Å; S91-F94 VanDerWaalsContact O-N 3.08Å; G92-F94 PolarHBondContact O-N 2.73Å; F94-Y180 HydrophobicContact CB-CE2 4.4Å; F94-Y180 WeakPolarHBondContact CB-OH 3.33Å; F94-Y180 PolarHBondContact O-OH 3.49Å; F94-A335 HydrophobicContact CD1-CB 3.68Å; F94-A335 HydrophobicContact CE1-CB 4.2Å; F94-V354 HydrophobicContact CD1-CG2 3.82Å; F94-V354 HydrophobicContact CD2-CB 4.29Å; F94-V354 HydrophobicContact CD2-CG1 3.61Å; F94-V354 HydrophobicContact CD2-CG2 4.05Å; F94-V354 HydrophobicContact CE1-CG2 3.75Å; F94-V354 HydrophobicContact CE2-CB 4.2Å; F94-V354 HydrophobicContact CE2-CG1 3.92Å; F94-V354 HydrophobicContact CE2-CG2 3.98Å; F94-V354 HydrophobicContact CG-CG1 4.04Å; F94-V354 HydrophobicContact CG-CG2 3.95Å; F94-V354 HydrophobicContact CZ-CB 4.43Å; F94-V354 HydrophobicContact CZ-CG2 3.82Å
95V76.9Confident86.2Confident24 Ų249.9 Ų9.915%0.1456%0.063CC..Hα-helixtrans-108-44.8-177.1175.50000111.8S91 G92 L431S91-V95 PolarHBondContact O-N 2.92Å; G92-V95 PolarHBondContact O-N 3.1Å; V95-L431 HydrophobicContact CG1-CD2 3.51Å; V95-L431 HydrophobicContact CG1-CG 4.36Å
96S85.8Confident85.9Confident2 Ų210.1 Ų10.11%0.0147%0.065CC..Hα-helixtrans-62.7-30-173.8-64.70000115.8G92 S98 G99 L100 T272G92-S96 WeakPolarHBondContact O-CA 3.49Å; G92-S96 WeakPolarHBondContact O-CB 3.3Å; G92-S96 PolarHBondContact O-N 3.32Å; G92-S96 PolarHBondContact O-OG 3.09Å; G92-S96 VanDerWaalsContact O-OG 3.06Å; S96-S98 PolarHBondContact O-N 3.19Å; S96-G99 PolarHBondContact O-N 3.49Å; S96-L100 WeakPolarHBondContact O-CB 3.43Å; S96-L100 PolarHBondContact O-N 3.2Å; S96-T272 WeakPolarHBondContact CB-O 3.37Å; S96-T272 PolarHBondContact OG-O 3.06Å
97P85.8Confident85.9Confident0 Ų010.7 Ų10.70%07%0.068CC..Hα-helixtrans-57.9-43.6179.8-28.936.8000114.1I93 L101 W114 Y319 M328I93-P97 WeakPolarHBondContact O-CD 3.44Å; I93-P97 WeakPolarHBondContact O-CG 3.36Å; P97-L101 PolarHBondContact O-N 3.01Å; P97-L101 VanDerWaalsContact O-N 3.12Å; P97-W114 HydrophobicContact CG-CZ2 4.11Å; P97-Y319 HydrophobicContact CB-CD2 4.46Å; P97-Y319 HydrophobicContact CG-CD2 4.36Å; P97-Y319 HydrophobicContact CG-CE2 4.16Å; P97-M328 HydrophobicContact CB-CE 4.19Å; P97-M328 HydrophobicContact CB-SD 3.94Å
98S84.5Confident85.9Confident8 Ų810.8 Ų10.86%0.0567%0.069CC..Hα-helixtrans-63.9-52175.4173.90000110.5S96 L100 L101 V102 M328 I329S96-S98 PolarHBondContact O-N 3.19Å; S98-L100 VanDerWaalsContact C-N 3.27Å; S98-L100 PolarHBondContact O-N 3.17Å; S98-L101 PolarHBondContact O-N 3.11Å; S98-L101 VanDerWaalsContact O-N 3.16Å; S98-V102 WeakPolarHBondContact O-CG2 3.36Å; S98-V102 PolarHBondContact O-N 3.47Å; S98-M328 WeakPolarHBondContact CB-O 3.44Å; S98-M328 PolarHBondContact OG-O 3.27Å; S98-I329 WeakPolarHBondContact OG-CA 3.49Å; S98-I329 PolarHBondContact OG-O 3.06Å
99G82.9Confident85.8Confident6 Ų612 Ų126%0.0628%0.077CC..Hα-helixtrans-60.3-32.9179.800000114.1S96 R103S96-G99 PolarHBondContact O-N 3.49Å; G99-R103 WeakPolarHBondContact O-CD 3.38Å; G99-R103 VanDerWaalsContact O-CG 3.24Å; G99-R103 WeakPolarHBondContact O-CG 3.48Å; G99-R103 PolarHBondContact O-N 3.37Å
100L87.2Confident85.8Confident0 Ų012.2 Ų12.20%08%0.079CC..Hα-helixtrans-72.1-45.4176.2-144.873.4000111.2S96 S98 V102 R103 T104 S110 I113 W114 A269 T272S96-L100 WeakPolarHBondContact O-CB 3.43Å; S96-L100 PolarHBondContact O-N 3.2Å; S98-L100 VanDerWaalsContact C-N 3.27Å; S98-L100 PolarHBondContact O-N 3.17Å; L100-V102 PolarHBondContact O-N 3.43Å; L100-R103 PolarHBondContact O-N 2.89Å; L100-T104 WeakPolarHBondContact O-CG2 3.48Å; L100-T104 PolarHBondContact O-N 3.25Å; L100-T104 PolarHBondContact O-OG1 3.43Å; L100-T104 VanDerWaalsContact O-OG1 3.08Å; L100-S110 WeakPolarHBondContact CD2-O 3.48Å; L100-S110 WeakPolarHBondContact CD2-OG 3.26Å; L100-I113 HydrophobicContact CD1-CG2 4.06Å; L100-I113 HydrophobicContact CD2-CB 4.2Å; L100-I113 HydrophobicContact CD2-CG2 4.09Å; L100-I113 HydrophobicContact CG-CG2 4.46Å; L100-W114 HydrophobicContact CD2-CD2 4.16Å; L100-W114 HydrophobicContact CD2-CG 3.77Å; L100-W114 VanDerWaalsContact CD2-NE1 3.3Å; L100-A269 HydrophobicContact CD1-CB 3.79Å; L100-A269 WeakPolarHBondContact CD1-O 3.42Å; L100-A269 HydrophobicContact CG-CB 4.43Å; L100-T272 HydrophobicContact CD1-CG2 4.44Å
101L87Confident86.1Confident6 Ų613.9 Ų13.93%0.0319%0.085CC..Hα-helixtrans-61.4-42.3177.3-84.3-166.9000113.1P97 S98 R103 T104 G105 V107 P325 M328 I329P97-L101 PolarHBondContact O-N 3.01Å; P97-L101 VanDerWaalsContact O-N 3.12Å; S98-L101 PolarHBondContact O-N 3.11Å; S98-L101 VanDerWaalsContact O-N 3.16Å; L101-R103 PolarHBondContact O-N 3.21Å; L101-T104 PolarHBondContact O-N 3.06Å; L101-G105 PolarHBondContact O-N 2.98Å; L101-V107 HydrophobicContact CD2-CB 4.49Å; L101-V107 HydrophobicContact CD2-CG2 4.02Å; L101-P325 HydrophobicContact CD1-CB 4Å; L101-M328 HydrophobicContact CD1-CB 4.45Å; L101-M328 HydrophobicContact CD1-CE 3.07Å; L101-M328 HydrophobicContact CG-CE 3.69Å; L101-I329 HydrophobicContact CB-CD1 4.25Å; L101-I329 HydrophobicContact CB-CG1 4.11Å; L101-I329 HydrophobicContact CD1-CG1 4.5Å
102V86.8Confident86.8Confident35 Ų3518.3 Ų18.321%0.21211%0.108CC..Hα-helixtrans-57.1-41177.4170.70000111S98 L100 I329 G433S98-V102 WeakPolarHBondContact O-CG2 3.36Å; S98-V102 PolarHBondContact O-N 3.47Å; L100-V102 PolarHBondContact O-N 3.43Å; V102-I329 HydrophobicContact CG2-CB 4.23Å; V102-I329 HydrophobicContact CG2-CD1 4.2Å; V102-I329 HydrophobicContact CG2-CG1 3.85Å; V102-I329 HydrophobicContact CG2-CG2 3.5Å; V102-I329 VanDerWaalsContact CG2-CG2 3.5Å; V102-G433 WeakPolarHBondContact CG1-O 3.27Å
103R86.4Confident87.2Confident54 Ų5418.4 Ų18.420%0.20411%0.108CC..Hα-helixtrans-80.4-35.6-176.7-65.3172.9-172-71.6-1.3112.8G99 L100 L101 T268 A269 T272 A429G99-R103 WeakPolarHBondContact O-CD 3.38Å; G99-R103 VanDerWaalsContact O-CG 3.24Å; G99-R103 WeakPolarHBondContact O-CG 3.48Å; G99-R103 PolarHBondContact O-N 3.37Å; L100-R103 PolarHBondContact O-N 2.89Å; L101-R103 PolarHBondContact O-N 3.21Å; R103-T268 VanDerWaalsContact CD-C 3.48Å; R103-T268 WeakPolarHBondContact CD-O 3.36Å; R103-T268 PolarHBondContact NH1-OG1 2.96Å; R103-A269 HydrophobicContact CB-CB 4.02Å; R103-T272 PolarHBondContact NE-OG1 3.37Å; R103-T272 VanDerWaalsContact NE-OG1 3.1Å; R103-A429 PolarHBondContact NH2-O 3.46Å
104T87.7Confident87.6Confident2 Ų218.5 Ų18.51%0.01211%0.108CC..Hα-helixtrans-85.2-25.8-178.260.90000113.2L100 L101 S106 V109 S110 I113 A269L100-T104 WeakPolarHBondContact O-CG2 3.48Å; L100-T104 PolarHBondContact O-N 3.25Å; L100-T104 PolarHBondContact O-OG1 3.43Å; L100-T104 VanDerWaalsContact O-OG1 3.08Å; L101-T104 PolarHBondContact O-N 3.06Å; T104-S106 PolarHBondContact O-N 3.21Å; T104-S106 PolarHBondContact OG1-O 3.44Å; T104-V109 HydrophobicContact CG2-CB 4.45Å; T104-V109 HydrophobicContact CG2-CG1 3.95Å; T104-S110 WeakPolarHBondContact OG1-CB 3.33Å; T104-I113 HydrophobicContact CG2-CD1 3.57Å; T104-A269 HydrophobicContact CG2-CB 4.12Å
105G84.3Confident88.2Confident38 Ų3821.9 Ų21.939%0.39213%0.126SC..SBendtrans64.1-2.7-176.100000114.7L101 G258L101-G105 PolarHBondContact O-N 2.98Å; G105-G258 WeakPolarHBondContact O-CA 3.46Å
106S88.7Confident89.1Confident6 Ų622.2 Ų22.24%0.04213%0.131CC..SBendtrans-140.3135.7-177.1163.20000109.6T104 G108 V109 S110 A255T104-S106 PolarHBondContact O-N 3.21Å; T104-S106 PolarHBondContact OG1-O 3.44Å; S106-G108 PolarHBondContact OG-N 2.97Å; S106-V109 PolarHBondContact OG-N 3.22Å; S106-S110 WeakPolarHBondContact O-CB 3.5Å; S106-S110 PolarHBondContact O-N 3.43Å; S106-A255 PolarHBondContact OG-O 2.98Å
107V89.9Confident89.6Confident11 Ų1122.1 Ų22.17%0.06713%0.131CC..Hα-helixtrans-63-45.4177170.50000111.2L101 V109 S110 F111 A255 L320 P325L101-V107 HydrophobicContact CD2-CB 4.49Å; L101-V107 HydrophobicContact CD2-CG2 4.02Å; V107-V109 PolarHBondContact O-N 2.89Å; V107-S110 WeakPolarHBondContact O-CB 3.49Å; V107-S110 PolarHBondContact O-N 3.3Å; V107-F111 HydrophobicContact CG1-CD2 3.86Å; V107-F111 HydrophobicContact CG1-CE2 3.74Å; V107-F111 VanDerWaalsContact O-CD2 3.29Å; V107-F111 WeakPolarHBondContact O-CD2 3.39Å; V107-F111 PolarHBondContact O-N 3.48Å; V107-A255 HydrophobicContact CB-CB 4.42Å; V107-A255 HydrophobicContact CG1-CB 4.33Å; V107-A255 PolarHBondContact N-O 2.96Å; V107-L320 HydrophobicContact CG1-CD1 3.42Å; V107-L320 VanDerWaalsContact CG1-CD1 3.42Å; V107-L320 HydrophobicContact CG1-CD2 4.43Å; V107-L320 HydrophobicContact CG2-CD2 4.08Å; V107-P325 HydrophobicContact CG2-CB 4.17Å; V107-P325 HydrophobicContact CG2-CG 3.7Å
108G89.8Confident90Very high5 Ų522.1 Ų22.15%0.05213%0.131CC..Hα-helixtrans-63.7-42.8-17900000112.3S106 F111 I112 A255S106-G108 PolarHBondContact OG-N 2.97Å; G108-F111 PolarHBondContact O-N 3.28Å; G108-I112 WeakPolarHBondContact O-CG1 3.4Å; G108-I112 PolarHBondContact O-N 3.24Å; G108-I112 VanDerWaalsContact O-N 3.12Å; G108-A255 PolarHBondContact N-O 3.31Å
109V90.7Very high90.6Very high31 Ų3125.7 Ų25.719%0.18815%0.152CC..Hα-helixtrans-66.6-40176.1-178.30000111.3T104 S106 V107 F111 I112 I113 P261T104-V109 HydrophobicContact CG2-CB 4.45Å; T104-V109 HydrophobicContact CG2-CG1 3.95Å; S106-V109 PolarHBondContact OG-N 3.22Å; V107-V109 PolarHBondContact O-N 2.89Å; V109-F111 VanDerWaalsContact C-N 3.34Å; V109-F111 PolarHBondContact O-N 3.44Å; V109-I112 PolarHBondContact O-N 2.99Å; V109-I113 HydrophobicContact CG1-CD1 4.24Å; V109-I113 WeakPolarHBondContact O-CG1 3.32Å; V109-I113 PolarHBondContact O-N 3.03Å; V109-P261 HydrophobicContact CG1-CG 4.01Å
110S90.8Very high91.2Very high4 Ų429.6 Ų29.63%0.02817%0.171CC..Hα-helixtrans-56.9-45.6173.9-179.70000111.9L100 T104 S106 V107 I112 I113 W114L100-S110 WeakPolarHBondContact CD2-O 3.48Å; L100-S110 WeakPolarHBondContact CD2-OG 3.26Å; T104-S110 WeakPolarHBondContact OG1-CB 3.33Å; S106-S110 WeakPolarHBondContact O-CB 3.5Å; S106-S110 PolarHBondContact O-N 3.43Å; V107-S110 WeakPolarHBondContact O-CB 3.49Å; V107-S110 PolarHBondContact O-N 3.3Å; S110-I112 PolarHBondContact O-N 2.88Å; S110-I113 PolarHBondContact O-N 3.45Å; S110-W114 PolarHBondContact O-N 2.96Å
111F91.4Very high91.6Very high36 Ų3629.7 Ų29.716%0.15817%0.172CC..Hα-helixtrans-61.5-43.2175.7-88.2-67.3000113.7V107 G108 V109 I113 W114 L115 L252 N316 I317 L320V107-F111 HydrophobicContact CG1-CD2 3.86Å; V107-F111 HydrophobicContact CG1-CE2 3.74Å; V107-F111 VanDerWaalsContact O-CD2 3.29Å; V107-F111 WeakPolarHBondContact O-CD2 3.39Å; V107-F111 PolarHBondContact O-N 3.48Å; G108-F111 PolarHBondContact O-N 3.28Å; V109-F111 VanDerWaalsContact C-N 3.34Å; V109-F111 PolarHBondContact O-N 3.44Å; F111-I113 VanDerWaalsContact C-N 3.29Å; F111-I113 PolarHBondContact O-N 2.93Å; F111-W114 WeakPolarHBondContact O-CB 3.36Å; F111-W114 PolarHBondContact O-N 3.07Å; F111-L115 PolarHBondContact O-N 3.24Å; F111-L252 HydrophobicContact CE2-CD2 4.4Å; F111-N316 HydrophobicContact CD1-CB 4.42Å; F111-N316 HydrophobicContact CE1-CB 3.51Å; F111-N316 HydrophobicContact CZ-CB 3.79Å; F111-I317 HydrophobicContact CE1-CD1 4.43Å; F111-I317 HydrophobicContact CE1-CG1 3.58Å; F111-I317 HydrophobicContact CE2-CG1 4.46Å; F111-I317 HydrophobicContact CZ-CB 4.27Å; F111-I317 HydrophobicContact CZ-CG1 3.45Å; F111-I317 VanDerWaalsContact CZ-CG1 3.45Å; F111-L320 HydrophobicContact CD2-CD1 4.44Å; F111-L320 HydrophobicContact CE2-CD1 3.37Å; F111-L320 HydrophobicContact CZ-CD1 3.73Å
112I93.3Very high92Very high97 Ų9731.5 Ų31.550%0.49718%0.182SC..Hα-helixtrans-60.1-44.1177.4-68.3167.7000110G108 V109 S110 L115 A116 F256G108-I112 WeakPolarHBondContact O-CG1 3.4Å; G108-I112 PolarHBondContact O-N 3.24Å; G108-I112 VanDerWaalsContact O-N 3.12Å; V109-I112 PolarHBondContact O-N 2.99Å; S110-I112 PolarHBondContact O-N 2.88Å; I112-L115 PolarHBondContact O-N 2.92Å; I112-A116 VanDerWaalsContact O-CB 3.27Å; I112-A116 WeakPolarHBondContact O-CB 3.4Å; I112-A116 PolarHBondContact O-N 2.72Å; I112-F256 HydrophobicContact CD1-CE1 3.97Å; I112-F256 HydrophobicContact CD1-CZ 4.3Å
113I93.4Very high92.5Very high6 Ų634.8 Ų34.83%0.03120%0.197CC..Hα-helixtrans-65.9-40.2178.5-65.2-179.6000111.2L100 T104 V109 S110 F111 L115 A116 C117 I266 A269 F270L100-I113 HydrophobicContact CD1-CG2 4.06Å; L100-I113 HydrophobicContact CD2-CB 4.2Å; L100-I113 HydrophobicContact CD2-CG2 4.09Å; L100-I113 HydrophobicContact CG-CG2 4.46Å; T104-I113 HydrophobicContact CG2-CD1 3.57Å; V109-I113 HydrophobicContact CG1-CD1 4.24Å; V109-I113 WeakPolarHBondContact O-CG1 3.32Å; V109-I113 PolarHBondContact O-N 3.03Å; S110-I113 PolarHBondContact O-N 3.45Å; F111-I113 VanDerWaalsContact C-N 3.29Å; F111-I113 PolarHBondContact O-N 2.93Å; I113-L115 PolarHBondContact O-N 3.24Å; I113-A116 PolarHBondContact O-N 3.48Å; I113-C117 WeakPolarHBondContact O-CB 3.22Å; I113-C117 PolarHBondContact O-N 2.93Å; I113-C117 PolarHBondContact O-SG 2.91Å; I113-I266 HydrophobicContact CD1-CG2 4.43Å; I113-A269 HydrophobicContact CD1-CB 3.64Å; I113-A269 HydrophobicContact CG2-CB 4.38Å; I113-F270 HydrophobicContact CG1-CE2 4.38Å; I113-F270 HydrophobicContact CG2-CD1 4.35Å; I113-F270 HydrophobicContact CG2-CD2 4.43Å; I113-F270 HydrophobicContact CG2-CE1 4.39Å; I113-F270 HydrophobicContact CG2-CE2 4.48Å; I113-F270 HydrophobicContact CG2-CG 4.36Å; I113-F270 HydrophobicContact CG2-CZ 4.46Å
114W93.8Very high92.8Very high2 Ų233.4 Ų33.41%0.00820%0.199CC..Hα-helixtrans-57.4-46.1174.3-91.7114.4000112.9I93 P97 L100 S110 F111 G118 A276 Y277 Y312 N316I93-W114 HydrophobicContact CD1-CH2 3.8Å; I93-W114 HydrophobicContact CD1-CZ2 4.21Å; I93-W114 HydrophobicContact CD1-CZ3 4.27Å; P97-W114 HydrophobicContact CG-CZ2 4.11Å; L100-W114 HydrophobicContact CD2-CD2 4.16Å; L100-W114 HydrophobicContact CD2-CG 3.77Å; L100-W114 VanDerWaalsContact CD2-NE1 3.3Å; S110-W114 PolarHBondContact O-N 2.96Å; F111-W114 WeakPolarHBondContact O-CB 3.36Å; F111-W114 PolarHBondContact O-N 3.07Å; W114-G118 PolarHBondContact O-N 3.34Å; W114-A276 HydrophobicContact CH2-CB 3.33Å; W114-A276 HydrophobicContact CZ3-CB 3.47Å; W114-A276 VanDerWaalsContact CZ3-CB 3.47Å; W114-Y277 AromaticContact CE3-CE2 3.68Å; W114-Y277 HydrophobicContact CE3-CE2 3.68Å; W114-Y277 HydrophobicContact CZ3-CD2 4.41Å; W114-Y277 AromaticContact CZ3-CE2 3.89Å; W114-Y277 HydrophobicContact CZ3-CE2 3.89Å; W114-Y277 WeakPolarHBondContact O-CE2 3.21Å; W114-Y277 PolarHBondContact O-OH 3.14Å; W114-Y312 HydrophobicContact CE3-CD2 4.04Å; W114-Y312 HydrophobicContact CH2-CD2 4.38Å; W114-Y312 AromaticContact CZ3-CD2 3.48Å; W114-Y312 HydrophobicContact CZ3-CD2 3.48Å; W114-Y312 VanDerWaalsContact CZ3-CD2 3.48Å; W114-Y312 AromaticContact CZ3-CE2 3.99Å; W114-Y312 HydrophobicContact CZ3-CE2 3.99Å; W114-Y312 HydrophobicContact CZ3-CG 4.16Å; W114-N316 PolarHBondContact NE1-ND2 3.02Å; W114-N316 PolarHBondContact NE1-OD1 3.46Å
115L95.3Very high93.1Very high87 Ų8733.3 Ų33.346%0.45520%0.199SC..Hα-helixtrans-69.1-42177.7-68.5176.8000111.4F111 I112 I113 C117 G118 V119 T309 A313F111-L115 PolarHBondContact O-N 3.24Å; I112-L115 PolarHBondContact O-N 2.92Å; I113-L115 PolarHBondContact O-N 3.24Å; L115-C117 VanDerWaalsContact C-N 3.33Å; L115-C117 PolarHBondContact O-N 2.84Å; L115-G118 PolarHBondContact O-N 3.16Å; L115-V119 WeakPolarHBondContact O-CG2 3.49Å; L115-V119 PolarHBondContact O-N 3.3Å; L115-T309 HydrophobicContact CD2-CG2 4.17Å; L115-A313 HydrophobicContact CD2-CB 4.16Å
116A96Very high93.6Very high30 Ų3034.7 Ų34.725%0.24820%0.197CC..Hα-helixtrans-60.6-42.4176.700000111.6I112 I113 G118 V119 L120 F270I112-A116 VanDerWaalsContact O-CB 3.27Å; I112-A116 WeakPolarHBondContact O-CB 3.4Å; I112-A116 PolarHBondContact O-N 2.72Å; I113-A116 PolarHBondContact O-N 3.48Å; A116-G118 VanDerWaalsContact C-N 3.34Å; A116-G118 PolarHBondContact O-N 3.47Å; A116-V119 PolarHBondContact O-N 3.22Å; A116-L120 WeakPolarHBondContact O-CB 3.48Å; A116-L120 VanDerWaalsContact O-CG 3.26Å; A116-L120 WeakPolarHBondContact O-CG 3.21Å; A116-L120 PolarHBondContact O-N 3.49Å; A116-F270 HydrophobicContact CB-CE1 3.85Å; A116-F270 HydrophobicContact CB-CZ 3.89Å
117C95.4Very high93.9Very high0 Ų036.8 Ų36.80%022%0.215CC..Hα-helixtrans-59.4-44.7174.2-68.40000111.4I113 L115 V119 L120 S121 F270 L274 Y277I113-C117 WeakPolarHBondContact O-CB 3.22Å; I113-C117 PolarHBondContact O-N 2.93Å; I113-C117 PolarHBondContact O-SG 2.91Å; L115-C117 VanDerWaalsContact C-N 3.33Å; L115-C117 PolarHBondContact O-N 2.84Å; C117-V119 PolarHBondContact O-N 2.91Å; C117-L120 PolarHBondContact O-N 3.38Å; C117-S121 WeakPolarHBondContact O-CB 3.5Å; C117-S121 PolarHBondContact O-N 3.02Å; C117-S121 PolarHBondContact O-OG 3.46Å; C117-F270 VanDerWaalsContact SG-CD1 3.55Å; C117-L274 HydrophobicContact CB-CD2 4.23Å; C117-Y277 HydrophobicContact CB-CD2 3.66Å; C117-Y277 HydrophobicContact CB-CE2 3.6Å
118G95.4Very high94Very high1 Ų139.1 Ų39.11%0.0122%0.223CC..Hα-helixtrans-63.4-39.8177.700000113.5W114 L115 A116 L122 Y277W114-G118 PolarHBondContact O-N 3.34Å; L115-G118 PolarHBondContact O-N 3.16Å; A116-G118 VanDerWaalsContact C-N 3.34Å; A116-G118 PolarHBondContact O-N 3.47Å; G118-L122 WeakPolarHBondContact O-CB 3.36Å; G118-L122 PolarHBondContact O-N 2.93Å; G118-Y277 VanDerWaalsContact CA-CZ 3.45Å
119V96.4Very high94.1Very high83 Ų8339.1 Ų39.150%0.50322%0.223SC..Hα-helixtrans-65.5-45.5174.1173.30000110.9L115 A116 C117 S121 L122 L123L115-V119 WeakPolarHBondContact O-CG2 3.49Å; L115-V119 PolarHBondContact O-N 3.3Å; A116-V119 PolarHBondContact O-N 3.22Å; C117-V119 PolarHBondContact O-N 2.91Å; V119-S121 VanDerWaalsContact C-N 3.34Å; V119-S121 PolarHBondContact O-N 3Å; V119-L122 PolarHBondContact O-N 2.85Å; V119-L123 HydrophobicContact CG1-CD1 4.06Å; V119-L123 HydrophobicContact CG1-CG 4.38Å; V119-L123 WeakPolarHBondContact O-CG 3.44Å; V119-L123 PolarHBondContact O-N 2.97Å
120L96.2Very high94.2Very high87 Ų8744.6 Ų44.646%0.45525%0.246SC..Hα-helixtrans-60.4-43.5177-72.6173.1000111.7A116 C117 L122 L123 G124 F270A116-L120 WeakPolarHBondContact O-CB 3.48Å; A116-L120 VanDerWaalsContact O-CG 3.26Å; A116-L120 WeakPolarHBondContact O-CG 3.21Å; A116-L120 PolarHBondContact O-N 3.49Å; C117-L120 PolarHBondContact O-N 3.38Å; L120-L122 VanDerWaalsContact C-N 3.35Å; L120-L122 PolarHBondContact O-N 2.88Å; L120-L123 PolarHBondContact O-N 3.41Å; L120-G124 PolarHBondContact O-N 3.06Å; L120-F270 HydrophobicContact CD1-CD1 4.1Å; L120-F270 HydrophobicContact CD1-CE1 3.72Å
121S95.4Very high94.2Very high3 Ų347.3 Ų47.32%0.02126%0.26CS..Hα-helixtrans-63.9-38.4175.8-59.90000112.2C117 V119 A125 Y277C117-S121 WeakPolarHBondContact O-CB 3.5Å; C117-S121 PolarHBondContact O-N 3.02Å; C117-S121 PolarHBondContact O-OG 3.46Å; V119-S121 VanDerWaalsContact C-N 3.34Å; V119-S121 PolarHBondContact O-N 3Å; S121-A125 WeakPolarHBondContact O-CB 3.47Å; S121-A125 PolarHBondContact O-N 3.09Å; S121-Y277 WeakPolarHBondContact OG-CB 3.3Å
122L95.3Very high94Very high44 Ų4445.6 Ų45.623%0.2325%0.252CS..Hα-helixtrans-64.4-47.6175.2178.762.8000111.8G118 V119 L120 A125 L126 I301 I305 P306G118-L122 WeakPolarHBondContact O-CB 3.36Å; G118-L122 PolarHBondContact O-N 2.93Å; V119-L122 PolarHBondContact O-N 2.85Å; L120-L122 VanDerWaalsContact C-N 3.35Å; L120-L122 PolarHBondContact O-N 2.88Å; L122-A125 PolarHBondContact O-N 3.37Å; L122-L126 HydrophobicContact CD1-CD1 4.28Å; L122-L126 HydrophobicContact CD1-CG 4.29Å; L122-L126 HydrophobicContact CG-CD1 4.18Å; L122-L126 VanDerWaalsContact O-CG 3.31Å; L122-L126 WeakPolarHBondContact O-CG 3.28Å; L122-L126 PolarHBondContact O-N 3.35Å; L122-I301 HydrophobicContact CD1-CG2 4.36Å; L122-I305 HydrophobicContact CB-CG2 3.93Å; L122-I305 HydrophobicContact CD1-CB 4.2Å; L122-I305 HydrophobicContact CD1-CD1 4.46Å; L122-I305 HydrophobicContact CD1-CG2 4.41Å; L122-P306 HydrophobicContact CD1-CG 4.33Å; L122-P306 HydrophobicContact CD2-CG 4.28Å
123L96.2Very high93.8Very high104 Ų10443.6 Ų43.655%0.54525%0.245SC..Hα-helixtrans-62.8-44.1178.9-66.8175.9000111.4V119 L120 L126 A127V119-L123 HydrophobicContact CG1-CD1 4.06Å; V119-L123 HydrophobicContact CG1-CG 4.38Å; V119-L123 WeakPolarHBondContact O-CG 3.44Å; V119-L123 PolarHBondContact O-N 2.97Å; L120-L123 PolarHBondContact O-N 3.41Å; L123-L126 PolarHBondContact O-N 3.02Å; L123-A127 PolarHBondContact O-N 2.95Å; L123-A127 VanDerWaalsContact O-N 3.13Å
124G94.5Very high93.6Very high24 Ų2450.1 Ų50.125%0.24728%0.277CS..Hα-helixtrans-60.9-44.3174.800000112.4L120 L126 A127 Y128L120-G124 PolarHBondContact O-N 3.06Å; G124-L126 PolarHBondContact O-N 3.39Å; G124-A127 PolarHBondContact O-N 3.24Å; G124-Y128 VanDerWaalsContact O-CD2 3.3Å; G124-Y128 WeakPolarHBondContact O-CD2 3.24Å; G124-Y128 PolarHBondContact O-N 3.45Å
125A94.1Very high93.2Very high0 Ų051 Ų510%028%0.282CS..Hα-helixtrans-66.9-34.9178.100000113S121 L122 Y128 A129 W280 I301 I305S121-A125 WeakPolarHBondContact O-CB 3.47Å; S121-A125 PolarHBondContact O-N 3.09Å; L122-A125 PolarHBondContact O-N 3.37Å; A125-Y128 CarbonylContact O-C 3.59Å; A125-Y128 PolarHBondContact O-N 3.46Å; A125-A129 WeakPolarHBondContact O-CB 3.25Å; A125-A129 PolarHBondContact O-N 2.99Å; A125-W280 HydrophobicContact CB-CB 4.48Å; A125-W280 HydrophobicContact CB-CD2 4.48Å; A125-W280 HydrophobicContact CB-CE3 3.72Å; A125-W280 HydrophobicContact CB-CZ3 4.43Å; A125-I301 HydrophobicContact CB-CD1 4.42Å; A125-I301 HydrophobicContact CB-CG2 3.57Å; A125-I305 HydrophobicContact CB-CD1 3.18Å
126L94.1Very high92.4Very high67 Ų6749.5 Ų49.535%0.35128%0.276SS..Hα-helixtrans-66.6-42175.4-73.8172.2000111.9L122 L123 G124 Y128 A129 E130 I301 I302L122-L126 HydrophobicContact CD1-CD1 4.28Å; L122-L126 HydrophobicContact CD1-CG 4.29Å; L122-L126 HydrophobicContact CG-CD1 4.18Å; L122-L126 VanDerWaalsContact O-CG 3.31Å; L122-L126 WeakPolarHBondContact O-CG 3.28Å; L122-L126 PolarHBondContact O-N 3.35Å; L123-L126 PolarHBondContact O-N 3.02Å; G124-L126 PolarHBondContact O-N 3.39Å; L126-Y128 VanDerWaalsContact C-N 3.28Å; L126-Y128 PolarHBondContact O-N 3.43Å; L126-A129 WeakPolarHBondContact O-CB 3.31Å; L126-A129 PolarHBondContact O-N 2.96Å; L126-A129 VanDerWaalsContact O-N 3.13Å; L126-E130 PolarHBondContact O-N 3.4Å; L126-E130 VanDerWaalsContact O-N 3.14Å; L126-I301 HydrophobicContact CD2-CG2 4.36Å; L126-I302 HydrophobicContact CD2-CD1 4.23Å; L126-I302 HydrophobicContact CD2-CG1 3.9Å
127A94.2Very high91.6Very high51 Ų5149.9 Ų49.942%0.42128%0.277SS..Hα-helixtrans-60.9-40172.400000111.4L123 G124 A129 E130 L131L123-A127 PolarHBondContact O-N 2.95Å; L123-A127 VanDerWaalsContact O-N 3.13Å; G124-A127 PolarHBondContact O-N 3.24Å; A127-A129 VanDerWaalsContact C-N 3.34Å; A127-E130 PolarHBondContact O-N 3.4Å; A127-L131 PolarHBondContact O-N 2.95Å
128Y91.9Very high90.5Very high60 Ų6049.9 Ų49.924%0.23528%0.277CS..Hα-helixtrans-69.4-31.2174.4-88.8-126.6000112.7G124 A125 L126 E130 L131 G132 E141 Y144 W280 N281 N284G124-Y128 VanDerWaalsContact O-CD2 3.3Å; G124-Y128 WeakPolarHBondContact O-CD2 3.24Å; G124-Y128 PolarHBondContact O-N 3.45Å; A125-Y128 CarbonylContact O-C 3.59Å; A125-Y128 PolarHBondContact O-N 3.46Å; L126-Y128 VanDerWaalsContact C-N 3.28Å; L126-Y128 PolarHBondContact O-N 3.43Å; Y128-E130 VanDerWaalsContact C-N 3.33Å; Y128-L131 PolarHBondContact O-N 3.46Å; Y128-G132 PolarHBondContact O-N 3.39Å; Y128-E141 HydrophobicContact CE1-CG 3.5Å; Y128-E141 VanDerWaalsContact CE1-CG 3.5Å; Y128-E141 WeakPolarHBondContact CE1-OE1 3.45Å; Y128-E141 WeakPolarHBondContact OH-CG 3.36Å; Y128-Y144 HydrophobicContact CD1-CE2 4.13Å; Y128-Y144 HydrophobicContact CE1-CE2 4.39Å; Y128-W280 HydrophobicContact CD1-CH2 4.28Å; Y128-W280 AromaticContact CD1-CZ3 3.87Å; Y128-W280 HydrophobicContact CD1-CZ3 3.87Å; Y128-W280 HydrophobicContact CD2-CH2 4.03Å; Y128-W280 AromaticContact CD2-CZ3 3.86Å; Y128-W280 HydrophobicContact CD2-CZ3 3.86Å; Y128-W280 HydrophobicContact CE1-CH2 4.15Å; Y128-W280 HydrophobicContact CE1-CZ3 4.2Å; Y128-W280 AromaticContact CE2-CH2 3.93Å; Y128-W280 HydrophobicContact CE2-CH2 3.93Å; Y128-W280 HydrophobicContact CE2-CZ3 4.22Å; Y128-W280 HydrophobicContact CG-CH2 4.22Å; Y128-W280 AromaticContact CG-CZ3 3.69Å; Y128-W280 HydrophobicContact CG-CZ3 3.69Å; Y128-N281 HydrophobicContact CD1-CB 4.13Å; Y128-N281 HydrophobicContact CE1-CB 4.23Å; Y128-N284 PolarHBondContact O-ND2 3.29Å
129A91.8Very high89.6Confident5 Ų549.9 Ų49.94%0.04128%0.277CS..Hα-helixtrans-62.9-44.1175.900000110.2A125 L126 A127 G132 T133 P298 I301A125-A129 WeakPolarHBondContact O-CB 3.25Å; A125-A129 PolarHBondContact O-N 2.99Å; L126-A129 WeakPolarHBondContact O-CB 3.31Å; L126-A129 PolarHBondContact O-N 2.96Å; L126-A129 VanDerWaalsContact O-N 3.13Å; A127-A129 VanDerWaalsContact C-N 3.34Å; A129-G132 PolarHBondContact O-N 3.46Å; A129-T133 WeakPolarHBondContact O-CG2 3.25Å; A129-T133 PolarHBondContact O-N 3.24Å; A129-T133 PolarHBondContact O-OG1 2.93Å; A129-P298 HydrophobicContact CB-CB 4.44Å; A129-I301 HydrophobicContact CB-CD1 3.69Å
130E92.8Very high89.1Confident145 Ų14545.9 Ų45.968%0.67825%0.253SS*.Hα-helixtrans-57.3-52.3175-174.4175.9-176.100110.9L126 A127 Y128 G132 T133 M134L126-E130 PolarHBondContact O-N 3.4Å; L126-E130 VanDerWaalsContact O-N 3.14Å; A127-E130 PolarHBondContact O-N 3.4Å; Y128-E130 VanDerWaalsContact C-N 3.33Å; E130-G132 PolarHBondContact O-N 2.9Å; E130-T133 PolarHBondContact O-N 3.36Å; E130-T133 VanDerWaalsContact O-N 3.12Å; E130-T133 PolarHBondContact O-OG1 3.02Å; E130-M134 PolarHBondContact O-N 3.41Å
131L91.3Very high88.8Confident62 Ų6242.1 Ų42.133%0.32523%0.233SC..Hα-helixtrans-57.9-44176.8-67.7173.1000112.7A127 Y128 T133 M134 N135 Y144A127-L131 PolarHBondContact O-N 2.95Å; Y128-L131 PolarHBondContact O-N 3.46Å; L131-T133 VanDerWaalsContact C-N 3.3Å; L131-T133 PolarHBondContact O-N 3.39Å; L131-M134 HydrophobicContact CD2-CE 4.2Å; L131-M134 PolarHBondContact O-N 3.16Å; L131-N135 PolarHBondContact O-N 3.24Å; L131-Y144 HydrophobicContact CB-CD1 4.06Å; L131-Y144 HydrophobicContact CB-CD2 4.02Å; L131-Y144 HydrophobicContact CB-CE1 3.85Å; L131-Y144 HydrophobicContact CB-CE2 3.79Å; L131-Y144 HydrophobicContact CB-CG 4.17Å; L131-Y144 HydrophobicContact CD1-CD2 3.82Å; L131-Y144 HydrophobicContact CD1-CE2 4.18Å; L131-Y144 HydrophobicContact CD1-CG 4.25Å
132G87.1Confident88.5Confident0 Ų042.4 Ų42.40%023%0.233CC..Hα-helixtrans-71.2-22.3178.900000114Y128 A129 E130 N135 Y144 T287Y128-G132 PolarHBondContact O-N 3.39Å; A129-G132 PolarHBondContact O-N 3.46Å; E130-G132 PolarHBondContact O-N 2.9Å; G132-N135 CarbonylContact O-C 3.59Å; G132-Y144 WeakPolarHBondContact CA-OH 3.34Å; G132-Y144 PolarHBondContact N-OH 3Å; G132-T287 WeakPolarHBondContact O-CG2 3.28Å
133T89Confident88.2Confident54 Ų5440.5 Ų40.533%0.33122%0.224SC..Hα-helixtrans-83-27.2170.458.30000113.1A129 E130 L131 L297A129-T133 WeakPolarHBondContact O-CG2 3.25Å; A129-T133 PolarHBondContact O-N 3.24Å; A129-T133 PolarHBondContact O-OG1 2.93Å; E130-T133 PolarHBondContact O-N 3.36Å; E130-T133 VanDerWaalsContact O-N 3.12Å; E130-T133 PolarHBondContact O-OG1 3.02Å; L131-T133 VanDerWaalsContact C-N 3.3Å; L131-T133 PolarHBondContact O-N 3.39Å; T133-L297 HydrophobicContact CG2-CD2 4.17Å
134M89.4Confident87.9Confident143 Ų14336.5 Ų36.570%0.70420%0.202SC*.Hα-helixtrans-76.4-51.4175.3-173.5179.472.300111.2E130 L131E130-M134 PolarHBondContact O-N 3.41Å; L131-M134 HydrophobicContact CD2-CE 4.2Å; L131-M134 PolarHBondContact O-N 3.16Å
135N85.4Confident87.8Confident21 Ų2138.5 Ų38.511%0.11220%0.204CC..  trans-109.6104.6171.9-172.8-7.8000109.9L131 G132 S137 Y144 D147L131-N135 PolarHBondContact O-N 3.24Å; G132-N135 CarbonylContact O-C 3.59Å; N135-S137 PolarHBondContact O-N 3.11Å; N135-S137 WeakPolarHBondContact OD1-CB 3.45Å; N135-S137 PolarHBondContact OD1-N 2.95Å; N135-S137 PolarHBondContact OD1-OG 3.2Å; N135-Y144 HydrophobicContact CB-CD1 4.49Å; N135-Y144 HydrophobicContact CB-CE1 4.46Å; N135-D147 PolarHBondContact ND2-OD2 3.27Å
136T79.3Confident87.6Confident55 Ų5541 Ų4134%0.33722%0.216SC..  trans-84.58-179.760.40000114T287 E288 P293T136-T287 HydrophobicContact CG2-CG2 4.32Å; T136-E288 WeakPolarHBondContact O-CG 3.43Å; T136-P293 HydrophobicContact CG2-CB 4.44Å; T136-P293 HydrophobicContact CG2-CG 4.01Å
137S77.4Confident87.3Confident38 Ų3842.8 Ų42.827%0.26623%0.226SC..  trans-69.8153.1178.4-53.20000112N135 E288N135-S137 PolarHBondContact O-N 3.11Å; N135-S137 WeakPolarHBondContact OD1-CB 3.45Å; N135-S137 PolarHBondContact OD1-N 2.95Å; N135-S137 PolarHBondContact OD1-OG 3.2Å; S137-E288 VanDerWaalsContact CA-OE1 3.29Å; S137-E288 WeakPolarHBondContact CA-OE1 3.31Å
138S74.3Confident87.3Confident1 Ų143.7 Ų43.71%0.00723%0.234CC..THydrogen-bonded Turntrans-72.1149.3175.5178.70000109.8Y285 E288 A375S138-Y285 PolarHBondContact OG-O 3.4Å; S138-E288 VanDerWaalsContact CB-CD 3.44Å; S138-E288 VanDerWaalsContact N-CG 3.32Å; S138-E288 PolarHBondContact N-OE1 3.09Å; S138-A375 WeakPolarHBondContact O-CB 3.07Å
139G75.8Confident87.3Confident0 Ų048.9 Ų48.90%025%0.254CS..THydrogen-bonded Turntrans108.3-5.3178.200000115.8E141 W142G139-E141 PolarHBondContact O-N 3.06Å; G139-W142 WeakPolarHBondContact O-CB 3.26Å; G139-W142 PolarHBondContact O-N 3.16Å
140A86.6Confident87.3Confident0 Ų049.6 Ų49.60%026%0.261CS..THydrogen-bonded Turntrans48.9-114.9172.800000113.5W142 A143 Y144 N284 Y285A140-W142 PolarHBondContact O-N 3.4Å; A140-W142 VanDerWaalsContact O-N 3.16Å; A140-A143 WeakPolarHBondContact O-CA 3.29Å; A140-A143 WeakPolarHBondContact O-CB 3.41Å; A140-A143 PolarHBondContact O-N 3.28Å; A140-Y144 WeakPolarHBondContact O-CD1 3.41Å; A140-Y144 PolarHBondContact O-N 2.87Å; A140-Y144 VanDerWaalsContact O-N 3.07Å; A140-N284 HydrophobicContact CB-CB 3.84Å; A140-Y285 HydrophobicContact CB-CD1 3.74Å; A140-Y285 HydrophobicContact CB-CD2 3.86Å; A140-Y285 HydrophobicContact CB-CE1 3.91Å; A140-Y285 HydrophobicContact CB-CE2 4.04Å; A140-Y285 HydrophobicContact CB-CG 3.74Å
141E89.4Confident87.2Confident8 Ų846.1 Ų46.14%0.03725%0.251CS..Hα-helixtrans-57.9-32.9-174.6-58.588.5157.600112.6Y128 G139 A143 Y144 F145 F157 N281 Y285Y128-E141 HydrophobicContact CE1-CG 3.5Å; Y128-E141 VanDerWaalsContact CE1-CG 3.5Å; Y128-E141 WeakPolarHBondContact CE1-OE1 3.45Å; Y128-E141 WeakPolarHBondContact OH-CG 3.36Å; G139-E141 PolarHBondContact O-N 3.06Å; E141-A143 VanDerWaalsContact C-N 3.31Å; E141-A143 PolarHBondContact O-N 3.05Å; E141-Y144 PolarHBondContact O-N 3.43Å; E141-F145 HydrophobicContact CB-CD2 4.3Å; E141-F145 HydrophobicContact CB-CE2 4.12Å; E141-F145 WeakPolarHBondContact O-CB 3.5Å; E141-F145 WeakPolarHBondContact O-CD2 3.49Å; E141-F145 WeakPolarHBondContact O-CG 3.49Å; E141-F145 PolarHBondContact O-N 3.07Å; E141-F157 HydrophobicContact CB-CD1 4.27Å; E141-F157 HydrophobicContact CB-CD2 4.49Å; E141-F157 HydrophobicContact CB-CE1 3.67Å; E141-F157 HydrophobicContact CB-CE2 3.88Å; E141-F157 HydrophobicContact CB-CZ 3.45Å; E141-F157 VanDerWaalsContact CB-CZ 3.45Å; E141-F157 HydrophobicContact CG-CE2 4.33Å; E141-F157 HydrophobicContact CG-CZ 4.01Å; E141-N281 PolarHBondContact OE1-ND2 3.48Å; E141-Y285 PolarHBondContact OE1-OH 3.22Å; E141-Y285 WeakPolarHBondContact OE2-CE1 3.35Å; E141-Y285 WeakPolarHBondContact OE2-CE2 2.9Å; E141-Y285 PolarHBondContact OE2-OH 3.37Å
142W89.3Confident87.2Confident9 Ų946.3 Ų46.33%0.03426%0.262CS..Hα-helixtrans-59.2-45.1174.6174.582.5000111.2G139 A140 F145 M146 A154 F157 L372 A375 A376 E379 H381G139-W142 WeakPolarHBondContact O-CB 3.26Å; G139-W142 PolarHBondContact O-N 3.16Å; A140-W142 PolarHBondContact O-N 3.4Å; A140-W142 VanDerWaalsContact O-N 3.16Å; W142-F145 PolarHBondContact O-N 3.32Å; W142-M146 HydrophobicContact CH2-CB 4.4Å; W142-M146 HydrophobicContact CH2-CG 4.25Å; W142-M146 HydrophobicContact CZ2-CG 4.43Å; W142-M146 WeakPolarHBondContact O-CB 3.4Å; W142-M146 PolarHBondContact O-N 3.35Å; W142-A154 VanDerWaalsContact CD1-O 3.29Å; W142-F157 HydrophobicContact CB-CD1 4.01Å; W142-F157 HydrophobicContact CB-CE1 4.18Å; W142-L372 HydrophobicContact CB-CD1 3.75Å; W142-A375 HydrophobicContact CE3-CB 4.11Å; W142-A375 HydrophobicContact CZ3-CB 4.48Å; W142-A376 HydrophobicContact CD2-CB 4.25Å; W142-A376 HydrophobicContact CG-CB 4.2Å; W142-E379 HydrophobicContact CH2-CB 3.82Å; W142-E379 HydrophobicContact CH2-CG 3.5Å; W142-E379 HydrophobicContact CZ2-CB 3.74Å; W142-E379 HydrophobicContact CZ2-CG 3.98Å; W142-E379 HydrophobicContact CZ3-CG 4.42Å; W142-H381 AromaticContact NE1-ND1 3.61Å
143A87.7Confident87.4Confident3 Ų348.7 Ų48.73%0.02528%0.277CS..Hα-helixtrans-68.5-38.6179.100000111.1A140 E141 M146 D147A140-A143 WeakPolarHBondContact O-CA 3.29Å; A140-A143 WeakPolarHBondContact O-CB 3.41Å; A140-A143 PolarHBondContact O-N 3.28Å; E141-A143 VanDerWaalsContact C-N 3.31Å; E141-A143 PolarHBondContact O-N 3.05Å; A143-M146 WeakPolarHBondContact O-CB 3.46Å; A143-M146 PolarHBondContact O-N 3.5Å; A143-D147 PolarHBondContact O-N 3.45Å
144Y91.2Very high87.4Confident21 Ų2146.1 Ų46.18%0.08226%0.262CS..Hα-helixtrans-65.8-40.9177.2-49.5-26.5000112Y128 L131 G132 N135 A140 E141 M146 D147 A148 N284Y128-Y144 HydrophobicContact CD1-CE2 4.13Å; Y128-Y144 HydrophobicContact CE1-CE2 4.39Å; L131-Y144 HydrophobicContact CB-CD1 4.06Å; L131-Y144 HydrophobicContact CB-CD2 4.02Å; L131-Y144 HydrophobicContact CB-CE1 3.85Å; L131-Y144 HydrophobicContact CB-CE2 3.79Å; L131-Y144 HydrophobicContact CB-CG 4.17Å; L131-Y144 HydrophobicContact CD1-CD2 3.82Å; L131-Y144 HydrophobicContact CD1-CE2 4.18Å; L131-Y144 HydrophobicContact CD1-CG 4.25Å; G132-Y144 WeakPolarHBondContact CA-OH 3.34Å; G132-Y144 PolarHBondContact N-OH 3Å; N135-Y144 HydrophobicContact CB-CD1 4.49Å; N135-Y144 HydrophobicContact CB-CE1 4.46Å; A140-Y144 WeakPolarHBondContact O-CD1 3.41Å; A140-Y144 PolarHBondContact O-N 2.87Å; A140-Y144 VanDerWaalsContact O-N 3.07Å; E141-Y144 PolarHBondContact O-N 3.43Å; Y144-M146 VanDerWaalsContact C-N 3.32Å; Y144-D147 PolarHBondContact O-N 3.32Å; Y144-A148 VanDerWaalsContact O-CB 3.27Å; Y144-A148 WeakPolarHBondContact O-CB 3.36Å; Y144-A148 PolarHBondContact O-N 3.29Å; Y144-N284 PolarHBondContact OH-ND2 3.45Å
145F91.5Very high87.4Confident66 Ų6643.3 Ų43.329%0.28925%0.246SC..Hα-helixtrans-65.5-38174.6-75.2-53.7000111.8E141 W142 Y149 G150 A154 F157E141-F145 HydrophobicContact CB-CD2 4.3Å; E141-F145 HydrophobicContact CB-CE2 4.12Å; E141-F145 WeakPolarHBondContact O-CB 3.5Å; E141-F145 WeakPolarHBondContact O-CD2 3.49Å; E141-F145 WeakPolarHBondContact O-CG 3.49Å; E141-F145 PolarHBondContact O-N 3.07Å; W142-F145 PolarHBondContact O-N 3.32Å; F145-Y149 AromaticContact CD1-CD2 3.76Å; F145-Y149 HydrophobicContact CD1-CD2 3.76Å; F145-Y149 HydrophobicContact CD1-CE2 4.06Å; F145-Y149 HydrophobicContact CE1-CD2 4.41Å; F145-Y149 HydrophobicContact CE1-CE2 4.3Å; F145-Y149 CarbonylContact O-C 3.47Å; F145-Y149 PolarHBondContact O-N 2.98Å; F145-G150 PolarHBondContact O-N 3.04Å; F145-G150 VanDerWaalsContact O-N 3.1Å; F145-A154 HydrophobicContact CB-CB 3.96Å; F145-F157 HydrophobicContact CD2-CB 3.66Å; F145-F157 HydrophobicContact CD2-CD1 4.19Å; F145-F157 HydrophobicContact CD2-CD2 4.13Å; F145-F157 AromaticContact CD2-CG 3.71Å; F145-F157 HydrophobicContact CD2-CG 3.71Å; F145-F157 HydrophobicContact CE2-CB 3.84Å; F145-F157 HydrophobicContact CE2-CD1 4.43Å; F145-F157 AromaticContact CE2-CD2 3.59Å; F145-F157 HydrophobicContact CE2-CD2 3.59Å; F145-F157 HydrophobicContact CE2-CE2 4.28Å; F145-F157 AromaticContact CE2-CG 3.67Å; F145-F157 HydrophobicContact CE2-CG 3.67Å
146M89.1Confident87.7Confident53 Ų5347.4 Ų47.426%0.26127%0.267SS..Hα-helixtrans-61.7-45.7177-167.564.4171.100111.2W142 A143 Y144 G150 P151 A154W142-M146 HydrophobicContact CH2-CB 4.4Å; W142-M146 HydrophobicContact CH2-CG 4.25Å; W142-M146 HydrophobicContact CZ2-CG 4.43Å; W142-M146 WeakPolarHBondContact O-CB 3.4Å; W142-M146 PolarHBondContact O-N 3.35Å; A143-M146 WeakPolarHBondContact O-CB 3.46Å; A143-M146 PolarHBondContact O-N 3.5Å; Y144-M146 VanDerWaalsContact C-N 3.32Å; M146-G150 VanDerWaalsContact O-CA 3.31Å; M146-G150 WeakPolarHBondContact O-CA 3.31Å; M146-G150 PolarHBondContact O-N 3.11Å; M146-P151 HydrophobicContact CE-CB 4.26Å; M146-P151 HydrophobicContact SD-CB 4.09Å; M146-A154 HydrophobicContact CB-CB 4.18Å; M146-A154 HydrophobicContact SD-CB 4.19Å
147D89.6Confident88.2Confident103 Ų10346.6 Ų46.655%0.55126%0.259SS*.Hα-helixtrans-69.8-40.6179.7-68-16.2000112.9N135 A143 Y144N135-D147 PolarHBondContact ND2-OD2 3.27Å; A143-D147 PolarHBondContact O-N 3.45Å; Y144-D147 PolarHBondContact O-N 3.32Å
148A93.1Very high88.6Confident71 Ų7144.8 Ų44.859%0.58725%0.246SC*.Hα-helixtrans-88.2-38.5-171.500000114Y144Y144-A148 VanDerWaalsContact O-CB 3.27Å; Y144-A148 WeakPolarHBondContact O-CB 3.36Å; Y144-A148 PolarHBondContact O-N 3.29Å
149Y92.8Very high89.2Confident169 Ų16951.1 Ų51.166%0.66327%0.27SS*.Hα-helixtrans-126.9-4.4-171.1-54.5-84.2000113.9F145F145-Y149 AromaticContact CD1-CD2 3.76Å; F145-Y149 HydrophobicContact CD1-CD2 3.76Å; F145-Y149 HydrophobicContact CD1-CE2 4.06Å; F145-Y149 HydrophobicContact CE1-CD2 4.41Å; F145-Y149 HydrophobicContact CE1-CE2 4.3Å; F145-Y149 CarbonylContact O-C 3.47Å; F145-Y149 PolarHBondContact O-N 2.98Å
150G90.9Very high89.8Confident19 Ų1954.2 Ų54.220%0.19629%0.289CS..  trans81.5-165.1179.100000114.5F145 M146 A152F145-G150 PolarHBondContact O-N 3.04Å; F145-G150 VanDerWaalsContact O-N 3.1Å; M146-G150 VanDerWaalsContact O-CA 3.31Å; M146-G150 WeakPolarHBondContact O-CA 3.31Å; M146-G150 PolarHBondContact O-N 3.11Å; G150-A152 PolarHBondContact O-N 3.32Å
151P90.6Very high89.8Confident72 Ų7254.3 Ų54.347%0.46829%0.289SS..Hα-helixtrans-74-32.9-161.624.7-33.3000115M146 A154 F155M146-P151 HydrophobicContact CE-CB 4.26Å; M146-P151 HydrophobicContact SD-CB 4.09Å; P151-A154 PolarHBondContact O-N 3.48Å; P151-F155 VanDerWaalsContact O-CB 3.31Å; P151-F155 WeakPolarHBondContact O-CB 3.32Å; P151-F155 PolarHBondContact O-N 2.9Å
152A91.4Very high89.4Confident67 Ų6754 Ų5455%0.55429%0.288SS*.Hα-helixtrans-67.2-49.4-174.700000113.2G150 A154 F155 L156G150-A152 PolarHBondContact O-N 3.32Å; A152-A154 PolarHBondContact O-N 3.41Å; A152-F155 PolarHBondContact O-N 3.28Å; A152-L156 WeakPolarHBondContact O-CG 3.45Å; A152-L156 PolarHBondContact O-N 3.38Å
153P92.3Very high89Confident49 Ų4955.2 Ų55.232%0.31830%0.295SS..Hα-helixtrans-64.6-37173.2-2639.2000113.1F155 L156 F157P153-F155 PolarHBondContact O-N 3.48Å; P153-L156 PolarHBondContact O-N 3.14Å; P153-F157 PolarHBondContact O-N 2.88Å
154A89.3Confident88.8Confident0 Ų058.8 Ų58.80%032%0.316CS..Hα-helixtrans-62.7-41.6175.900000112.1W142 F145 M146 P151 A152 S158W142-A154 VanDerWaalsContact CD1-O 3.29Å; F145-A154 HydrophobicContact CB-CB 3.96Å; M146-A154 HydrophobicContact CB-CB 4.18Å; M146-A154 HydrophobicContact SD-CB 4.19Å; P151-A154 PolarHBondContact O-N 3.48Å; A152-A154 PolarHBondContact O-N 3.41Å; A154-S158 WeakPolarHBondContact O-CB 3.36Å; A154-S158 PolarHBondContact O-N 3.14Å
155F88.6Confident88.5Confident85 Ų8561.7 Ų61.737%0.37333%0.333SS..Hα-helixtrans-62.8-47.9174.1174.1-96.3000111.9P151 A152 P153 F157 S158 W159 H381P151-F155 VanDerWaalsContact O-CB 3.31Å; P151-F155 WeakPolarHBondContact O-CB 3.32Å; P151-F155 PolarHBondContact O-N 2.9Å; A152-F155 PolarHBondContact O-N 3.28Å; P153-F155 PolarHBondContact O-N 3.48Å; F155-F157 VanDerWaalsContact C-N 3.32Å; F155-F157 PolarHBondContact O-N 2.97Å; F155-S158 PolarHBondContact O-N 3.19Å; F155-S158 VanDerWaalsContact O-N 3.17Å; F155-W159 HydrophobicContact CZ-CE3 4.47Å; F155-W159 WeakPolarHBondContact O-CB 3.41Å; F155-W159 PolarHBondContact O-N 3.04Å; F155-H381 HydrophobicContact CD2-CB 4.09Å; F155-H381 WeakPolarHBondContact CD2-O 3.33Å; F155-H381 VanDerWaalsContact CE2-O 3.22Å; F155-H381 WeakPolarHBondContact CE2-O 3.3Å
156L91Very high88.1Confident107 Ų10759 Ų5956%0.5632%0.321SS*.Hα-helixtrans-58.8-43.8178-74.2172.9000111.8A152 P153 W159 V160A152-L156 WeakPolarHBondContact O-CG 3.45Å; A152-L156 PolarHBondContact O-N 3.38Å; P153-L156 PolarHBondContact O-N 3.14Å; L156-W159 PolarHBondContact O-N 3.47Å; L156-V160 WeakPolarHBondContact O-CG2 3.17Å; L156-V160 PolarHBondContact O-N 2.97Å
157F90.1Very high87.9Confident37 Ų3756.8 Ų56.816%0.16231%0.311CS..Hα-helixtrans-61.2-47.6174.8173.5-97.1000111.7E141 W142 F145 P153 F155 W159 V160 S161 L372E141-F157 HydrophobicContact CB-CD1 4.27Å; E141-F157 HydrophobicContact CB-CD2 4.49Å; E141-F157 HydrophobicContact CB-CE1 3.67Å; E141-F157 HydrophobicContact CB-CE2 3.88Å; E141-F157 HydrophobicContact CB-CZ 3.45Å; E141-F157 VanDerWaalsContact CB-CZ 3.45Å; E141-F157 HydrophobicContact CG-CE2 4.33Å; E141-F157 HydrophobicContact CG-CZ 4.01Å; W142-F157 HydrophobicContact CB-CD1 4.01Å; W142-F157 HydrophobicContact CB-CE1 4.18Å; F145-F157 HydrophobicContact CD2-CB 3.66Å; F145-F157 HydrophobicContact CD2-CD1 4.19Å; F145-F157 HydrophobicContact CD2-CD2 4.13Å; F145-F157 AromaticContact CD2-CG 3.71Å; F145-F157 HydrophobicContact CD2-CG 3.71Å; F145-F157 HydrophobicContact CE2-CB 3.84Å; F145-F157 HydrophobicContact CE2-CD1 4.43Å; F145-F157 AromaticContact CE2-CD2 3.59Å; F145-F157 HydrophobicContact CE2-CD2 3.59Å; F145-F157 HydrophobicContact CE2-CE2 4.28Å; F145-F157 AromaticContact CE2-CG 3.67Å; F145-F157 HydrophobicContact CE2-CG 3.67Å; P153-F157 PolarHBondContact O-N 2.88Å; F155-F157 VanDerWaalsContact C-N 3.32Å; F155-F157 PolarHBondContact O-N 2.97Å; F157-W159 VanDerWaalsContact C-N 3.31Å; F157-W159 PolarHBondContact O-N 3.23Å; F157-V160 PolarHBondContact O-N 3.38Å; F157-S161 WeakPolarHBondContact CE2-OG 3.47Å; F157-S161 WeakPolarHBondContact CZ-OG 3.28Å; F157-S161 WeakPolarHBondContact O-CB 3.35Å; F157-S161 PolarHBondContact O-N 3.49Å; F157-S161 PolarHBondContact O-OG 2.95Å; F157-L372 HydrophobicContact CE1-CD1 3.99Å
158S86.8Confident87.7Confident0 Ų054.3 Ų54.30%030%0.302CS..Hα-helixtrans-59.1-43.8178.6-174.40000111.7A154 F155 T162 A376 L382A154-S158 WeakPolarHBondContact O-CB 3.36Å; A154-S158 PolarHBondContact O-N 3.14Å; F155-S158 PolarHBondContact O-N 3.19Å; F155-S158 VanDerWaalsContact O-N 3.17Å; S158-T162 WeakPolarHBondContact O-CB 3.42Å; S158-T162 PolarHBondContact O-N 3.48Å; S158-T162 PolarHBondContact O-OG1 3.36Å; S158-A376 VanDerWaalsContact OG-CB 3.26Å; S158-A376 WeakPolarHBondContact OG-CB 3.41Å; S158-L382 WeakPolarHBondContact OG-CD1 3.5Å
159W86.7Confident87.3Confident135 Ų13552.4 Ų52.451%0.51128%0.28SS..Hα-helixtrans-60.2-54.1178179.5-99.1000112F155 L156 F157 L163F155-W159 HydrophobicContact CZ-CE3 4.47Å; F155-W159 WeakPolarHBondContact O-CB 3.41Å; F155-W159 PolarHBondContact O-N 3.04Å; L156-W159 PolarHBondContact O-N 3.47Å; F157-W159 VanDerWaalsContact C-N 3.31Å; F157-W159 PolarHBondContact O-N 3.23Å; W159-L163 HydrophobicContact CD2-CD1 3.43Å; W159-L163 VanDerWaalsContact CD2-CD1 3.43Å; W159-L163 HydrophobicContact CD2-CG 4.45Å; W159-L163 HydrophobicContact CE3-CD1 3.65Å; W159-L163 HydrophobicContact CG-CD1 4.15Å; W159-L163 HydrophobicContact CH2-CD1 3.51Å; W159-L163 HydrophobicContact CZ2-CD1 3.26Å; W159-L163 HydrophobicContact CZ3-CD1 3.69Å; W159-L163 VanDerWaalsContact O-CB 3.31Å; W159-L163 WeakPolarHBondContact O-CB 3.45Å; W159-L163 WeakPolarHBondContact O-CG 3.49Å; W159-L163 PolarHBondContact O-N 3.31Å
160V88.8Confident87Confident64 Ų6444.9 Ų44.939%0.38825%0.251SS..Hα-helixtrans-65.1-44-179173.40000111.1L156 F157 T162 V164 L165L156-V160 WeakPolarHBondContact O-CG2 3.17Å; L156-V160 PolarHBondContact O-N 2.97Å; F157-V160 PolarHBondContact O-N 3.38Å; V160-T162 PolarHBondContact O-N 3.33Å; V160-V164 WeakPolarHBondContact O-CA 3.45Å; V160-V164 VanDerWaalsContact O-CB 3.3Å; V160-V164 WeakPolarHBondContact O-CB 3.36Å; V160-V164 PolarHBondContact O-N 2.9Å; V160-L165 HydrophobicContact CG1-CD1 4.32Å; V160-L165 HydrophobicContact CG1-CG 4.16Å; V160-L165 PolarHBondContact O-N 3.33Å; V160-L165 VanDerWaalsContact O-N 3.1Å
161S85.6Confident86.7Confident2 Ų244.5 Ų44.51%0.01425%0.247CC..Iπ-helixtrans-65.6-42-178.8-67.30000112.4F157 L165 K166F157-S161 WeakPolarHBondContact CE2-OG 3.47Å; F157-S161 WeakPolarHBondContact CZ-OG 3.28Å; F157-S161 WeakPolarHBondContact O-CB 3.35Å; F157-S161 PolarHBondContact O-N 3.49Å; F157-S161 PolarHBondContact O-OG 2.95Å; S161-L165 PolarHBondContact O-N 2.93Å; S161-K166 WeakPolarHBondContact O-CB 3.48Å; S161-K166 WeakPolarHBondContact O-CG 3.28Å; S161-K166 PolarHBondContact O-N 3.21Å
162T81.8Confident86.4Confident2 Ų244 Ų441%0.01224%0.24CC..Iπ-helixtrans-76.7-37.4-175.7-550000112.1S158 V160 P167 F402 H403S158-T162 WeakPolarHBondContact O-CB 3.42Å; S158-T162 PolarHBondContact O-N 3.48Å; S158-T162 PolarHBondContact O-OG1 3.36Å; V160-T162 PolarHBondContact O-N 3.33Å; T162-P167 VanDerWaalsContact O-CD 3.32Å; T162-P167 WeakPolarHBondContact O-CD 3.42Å; T162-P167 VanDerWaalsContact O-CG 3.27Å; T162-P167 WeakPolarHBondContact O-CG 3.43Å; T162-F402 HydrophobicContact CG2-CD1 3.98Å; T162-F402 HydrophobicContact CG2-CE1 3.75Å; T162-H403 PolarHBondContact O-CE1 3.42Å
163L80.9Confident86.1Confident34 Ų3441 Ų4118%0.17821%0.214CC..Iπ-helixtrans-91.7-32.1-176.4-65.4179.2000114.5W159 F402W159-L163 HydrophobicContact CD2-CD1 3.43Å; W159-L163 VanDerWaalsContact CD2-CD1 3.43Å; W159-L163 HydrophobicContact CD2-CG 4.45Å; W159-L163 HydrophobicContact CE3-CD1 3.65Å; W159-L163 HydrophobicContact CG-CD1 4.15Å; W159-L163 HydrophobicContact CH2-CD1 3.51Å; W159-L163 HydrophobicContact CZ2-CD1 3.26Å; W159-L163 HydrophobicContact CZ3-CD1 3.69Å; W159-L163 VanDerWaalsContact O-CB 3.31Å; W159-L163 WeakPolarHBondContact O-CB 3.45Å; W159-L163 WeakPolarHBondContact O-CG 3.49Å; W159-L163 PolarHBondContact O-N 3.31Å; L163-F402 HydrophobicContact CD2-CE1 3.91Å; L163-F402 HydrophobicContact CD2-CZ 3.75Å
164V83.1Confident85.9Confident79 Ų7938.8 Ų38.848%0.47920%0.2SC..Iπ-helixtrans-112.6-60-172.1-174.10000110.5V160 S168V160-V164 WeakPolarHBondContact O-CA 3.45Å; V160-V164 VanDerWaalsContact O-CB 3.3Å; V160-V164 WeakPolarHBondContact O-CB 3.36Å; V160-V164 PolarHBondContact O-N 2.9Å; V164-S168 WeakPolarHBondContact O-CB 3.35Å; V164-S168 PolarHBondContact O-N 3.49Å; V164-S168 PolarHBondContact O-OG 3.24Å
165L84.4Confident85.7Confident82 Ų8240.5 Ų40.543%0.42921%0.209SC..Iπ-helixtrans-68.4-58.8-167-56.2179.5000112.6V160 S161 S168 Q169V160-L165 HydrophobicContact CG1-CD1 4.32Å; V160-L165 HydrophobicContact CG1-CG 4.16Å; V160-L165 PolarHBondContact O-N 3.33Å; V160-L165 VanDerWaalsContact O-N 3.1Å; S161-L165 PolarHBondContact O-N 2.93Å; L165-S168 PolarHBondContact O-N 2.91Å; L165-Q169 WeakPolarHBondContact O-CB 3.36Å; L165-Q169 WeakPolarHBondContact O-CG 3.47Å; L165-Q169 PolarHBondContact O-N 3.47Å
166K84.4Confident85.5Confident8 Ų837.1 Ų37.14%0.03520%0.195CC..Hα-helixtrans-63.4-43.4-174.9-64.8-63.6-178-172.10113.2S161 M170 A369S161-K166 WeakPolarHBondContact O-CB 3.48Å; S161-K166 WeakPolarHBondContact O-CG 3.28Å; S161-K166 PolarHBondContact O-N 3.21Å; K166-M170 PolarHBondContact O-N 3.33Å; K166-M170 VanDerWaalsContact O-N 3.09Å; K166-A369 HydrophobicContact CB-CB 4.23Å; K166-A369 HydrophobicContact CD-CB 4.1Å; K166-A369 HydrophobicContact CG-CB 4.1Å
167P83.6Confident85.4Confident7 Ų733.7 Ų33.75%0.04518%0.176CC..Hα-helixtrans-62.4-41.7174.5-25.436.7000113.3T162 M170 A171 L407T162-P167 VanDerWaalsContact O-CD 3.32Å; T162-P167 WeakPolarHBondContact O-CD 3.42Å; T162-P167 VanDerWaalsContact O-CG 3.27Å; T162-P167 WeakPolarHBondContact O-CG 3.43Å; P167-M170 PolarHBondContact O-N 2.99Å; P167-A171 WeakPolarHBondContact O-CB 3.41Å; P167-A171 PolarHBondContact O-N 3.19Å; P167-L407 HydrophobicContact CB-CD1 3.97Å
168S85Confident85.3Confident52 Ų5231.9 Ų31.936%0.36417%0.168SC..Hα-helixtrans-67.3-44.1-179.8-55.90000111.5V164 L165 M170 A171 I172V164-S168 WeakPolarHBondContact O-CB 3.35Å; V164-S168 PolarHBondContact O-N 3.49Å; V164-S168 PolarHBondContact O-OG 3.24Å; L165-S168 PolarHBondContact O-N 2.91Å; S168-M170 VanDerWaalsContact C-N 3.29Å; S168-M170 PolarHBondContact O-N 3.3Å; S168-A171 PolarHBondContact O-N 2.98Å; S168-I172 VanDerWaalsContact O-CG1 3.31Å; S168-I172 WeakPolarHBondContact O-CG1 3.37Å; S168-I172 PolarHBondContact O-N 2.92Å
169Q85.3Confident85Confident30 Ų3033.6 Ų33.614%0.1418%0.176CC..Hα-helixtrans-54.7-47.3173.1-76.4178.7-26.600111L165 A171 I172 I173 W275 D278 T365L165-Q169 WeakPolarHBondContact O-CB 3.36Å; L165-Q169 WeakPolarHBondContact O-CG 3.47Å; L165-Q169 PolarHBondContact O-N 3.47Å; Q169-A171 PolarHBondContact O-N 3.31Å; Q169-I172 PolarHBondContact O-N 3.43Å; Q169-I173 VanDerWaalsContact O-CG1 3.3Å; Q169-I173 WeakPolarHBondContact O-CG1 3.41Å; Q169-I173 PolarHBondContact O-N 3.37Å; Q169-I173 VanDerWaalsContact O-N 3.12Å; Q169-W275 HydrophobicContact CG-CZ3 4.19Å; Q169-D278 PolarHBondContact NE2-OD1 2.94Å; Q169-D278 VanDerWaalsContact NE2-OD1 3.17Å; Q169-D278 PolarHBondContact NE2-OD2 3.5Å; Q169-T365 HydrophobicContact CB-CG2 4.47Å
170M85.6Confident84.9Confident11 Ų1127.4 Ų27.45%0.05415%0.153CC..Hα-helixtrans-64.2-42.8179.5-106.5-52.5-160.700113.6K166 P167 S168 I173 C174 I207 A362 L366K166-M170 PolarHBondContact O-N 3.33Å; K166-M170 VanDerWaalsContact O-N 3.09Å; P167-M170 PolarHBondContact O-N 2.99Å; S168-M170 VanDerWaalsContact C-N 3.29Å; S168-M170 PolarHBondContact O-N 3.3Å; M170-I173 PolarHBondContact O-N 2.87Å; M170-C174 WeakPolarHBondContact O-CB 3.39Å; M170-C174 PolarHBondContact O-N 3.02Å; M170-C174 PolarHBondContact O-SG 2.97Å; M170-I207 HydrophobicContact CE-CG2 4.31Å; M170-A362 VanDerWaalsContact CE-C 3.43Å; M170-A362 HydrophobicContact CE-CB 3.75Å; M170-A362 WeakPolarHBondContact CE-O 3.12Å; M170-A362 HydrophobicContact SD-CB 3.68Å; M170-L366 HydrophobicContact CE-CB 3.54Å; M170-L366 HydrophobicContact CE-CD1 4.49Å; M170-L366 HydrophobicContact CE-CG 4.37Å
171A85.3Confident84.7Confident12 Ų1225.2 Ų25.210%0.09914%0.141CC..Hα-helixtrans-59.8-47.5177.500000111.4P167 S168 Q169 C174 L175 L407 L410P167-A171 WeakPolarHBondContact O-CB 3.41Å; P167-A171 PolarHBondContact O-N 3.19Å; S168-A171 PolarHBondContact O-N 2.98Å; Q169-A171 PolarHBondContact O-N 3.31Å; A171-C174 PolarHBondContact O-N 3.34Å; A171-L175 VanDerWaalsContact O-CB 3.3Å; A171-L175 WeakPolarHBondContact O-CB 3.42Å; A171-L175 VanDerWaalsContact O-CG 3.22Å; A171-L175 WeakPolarHBondContact O-CG 3.3Å; A171-L175 PolarHBondContact O-N 3.34Å; A171-L407 HydrophobicContact CB-CD2 4.35Å; A171-L410 HydrophobicContact CB-CD1 3.83Å; A171-L410 HydrophobicContact CB-CD2 4.21Å; A171-L410 HydrophobicContact CB-CG 4.33Å
172I83.9Confident84.6Confident62 Ų6225.7 Ų25.732%0.31814%0.144SC..Hα-helixtrans-61.8-48.4-179.6-63.1163.7000110.4S168 Q169 C174 L175 S176 W275S168-I172 VanDerWaalsContact O-CG1 3.31Å; S168-I172 WeakPolarHBondContact O-CG1 3.37Å; S168-I172 PolarHBondContact O-N 2.92Å; Q169-I172 PolarHBondContact O-N 3.43Å; I172-C174 PolarHBondContact O-N 2.91Å; I172-L175 PolarHBondContact O-N 2.98Å; I172-S176 PolarHBondContact O-N 3.44Å; I172-S176 PolarHBondContact O-OG 2.94Å; I172-S176 VanDerWaalsContact O-OG 3.12Å; I172-W275 HydrophobicContact CB-CH2 3.87Å; I172-W275 HydrophobicContact CB-CZ2 3.88Å; I172-W275 HydrophobicContact CD1-CH2 3.93Å; I172-W275 HydrophobicContact CD1-CZ2 4.41Å; I172-W275 HydrophobicContact CD1-CZ3 4.2Å; I172-W275 HydrophobicContact CG2-CH2 3.82Å; I172-W275 HydrophobicContact CG2-CZ2 3.31Å
173I86.4Confident84.4Confident3 Ų327.8 Ų27.82%0.01515%0.154CC..Hα-helixtrans-62.6-43.5-178.9-61.4164.7000111.2Q169 M170 S176 F177 W275 T358 A362Q169-I173 VanDerWaalsContact O-CG1 3.3Å; Q169-I173 WeakPolarHBondContact O-CG1 3.41Å; Q169-I173 PolarHBondContact O-N 3.37Å; Q169-I173 VanDerWaalsContact O-N 3.12Å; M170-I173 PolarHBondContact O-N 2.87Å; I173-S176 PolarHBondContact O-N 3.17Å; I173-F177 PolarHBondContact O-N 2.67Å; I173-W275 HydrophobicContact CG1-CH2 4.41Å; I173-W275 HydrophobicContact CG1-CZ2 4.33Å; I173-T358 VanDerWaalsContact CG2-O 3.24Å; I173-T358 WeakPolarHBondContact CG2-O 3.47Å; I173-A362 HydrophobicContact CG2-CB 3.8Å
174C88.2Confident84.2Confident2 Ų228.5 Ų28.51%0.01417%0.165CC..Hα-helixtrans-73.4-30.6-178.5-64.90000113M170 A171 I172 F177 A178 A200 I204M170-C174 WeakPolarHBondContact O-CB 3.39Å; M170-C174 PolarHBondContact O-N 3.02Å; M170-C174 PolarHBondContact O-SG 2.97Å; A171-C174 PolarHBondContact O-N 3.34Å; I172-C174 PolarHBondContact O-N 2.91Å; C174-F177 WeakPolarHBondContact O-CB 3.3Å; C174-F177 PolarHBondContact O-N 2.91Å; C174-A178 WeakPolarHBondContact O-CB 3.42Å; C174-A178 PolarHBondContact O-N 3.01Å; C174-A200 HydrophobicContact CB-CB 4.24Å; C174-A200 WeakPolarHBondContact O-CB 3.19Å; C174-I204 HydrophobicContact CB-CD1 3.98Å; C174-I204 HydrophobicContact CB-CG1 3.73Å; C174-I204 WeakPolarHBondContact SG-CG1 3.28Å
175L84.9Confident83.9Confident36 Ų3633.2 Ų33.219%0.18818%0.179CC..Hα-helixtrans-67.1-43.6171.1-76.8168.9000111A171 I172 A178 Q179 V196 A200 L410A171-L175 VanDerWaalsContact O-CB 3.3Å; A171-L175 WeakPolarHBondContact O-CB 3.42Å; A171-L175 VanDerWaalsContact O-CG 3.22Å; A171-L175 WeakPolarHBondContact O-CG 3.3Å; A171-L175 PolarHBondContact O-N 3.34Å; I172-L175 PolarHBondContact O-N 2.98Å; L175-A178 PolarHBondContact O-N 3.5Å; L175-Q179 PolarHBondContact O-N 2.7Å; L175-V196 HydrophobicContact CD2-CG1 4.47Å; L175-A200 HydrophobicContact CD2-CB 4.25Å; L175-L410 HydrophobicContact CD1-CD2 4.21Å
176S84.4Confident83.2Confident14 Ų1431.7 Ų31.710%0.09817%0.173CC..Hα-helixtrans-60.3-45.4172.4-58.10000111.4S91 I172 I173 A178 Q179 Y180S91-S176 VanDerWaalsContact CB-CB 3.44Å; S91-S176 WeakPolarHBondContact CB-OG 3.39Å; I172-S176 PolarHBondContact O-N 3.44Å; I172-S176 PolarHBondContact O-OG 2.94Å; I172-S176 VanDerWaalsContact O-OG 3.12Å; I173-S176 PolarHBondContact O-N 3.17Å; S176-A178 VanDerWaalsContact C-N 3.28Å; S176-A178 PolarHBondContact O-N 3.07Å; S176-Q179 PolarHBondContact O-N 3.34Å; S176-Y180 VanDerWaalsContact O-CD2 3.3Å; S176-Y180 WeakPolarHBondContact O-CD2 3.46Å; S176-Y180 PolarHBondContact O-N 3.08Å; S176-Y180 VanDerWaalsContact O-N 3.16Å
177F88.2Confident82.1Confident35 Ų3537.5 Ų37.515%0.15421%0.209CC..Hα-helixtrans-51.9-49.5173.3167.5-92.4000111.4I173 C174 A181 V199 A203 T355 T358 F359I173-F177 PolarHBondContact O-N 2.67Å; C174-F177 WeakPolarHBondContact O-CB 3.3Å; C174-F177 PolarHBondContact O-N 2.91Å; F177-A181 HydrophobicContact CE1-CB 4.44Å; F177-A181 WeakPolarHBondContact O-CB 3.47Å; F177-A181 PolarHBondContact O-N 3.24Å; F177-V199 HydrophobicContact CD1-CG1 4.34Å; F177-V199 HydrophobicContact CE1-CG1 3.9Å; F177-A203 HydrophobicContact CD1-CB 3.75Å; F177-A203 HydrophobicContact CE1-CB 3.68Å; F177-A203 HydrophobicContact CZ-CB 4.46Å; F177-T355 HydrophobicContact CD2-CG2 4.16Å; F177-T355 VanDerWaalsContact CD2-O 3.3Å; F177-T355 WeakPolarHBondContact CD2-O 3.38Å; F177-T355 HydrophobicContact CE2-CG2 4.13Å; F177-T358 WeakPolarHBondContact CA-OG1 3.47Å; F177-T358 WeakPolarHBondContact CB-OG1 3.23Å; F177-T358 WeakPolarHBondContact CD2-OG1 3.48Å; F177-F359 HydrophobicContact CD2-CB 4.23Å; F177-F359 HydrophobicContact CE2-CB 4.2Å; F177-F359 HydrophobicContact CE2-CD2 4.28Å
178A87.4Confident81Confident0 Ų045.7 Ų45.70%025%0.247CC..Hα-helixtrans-68.7-37.5-176.300000113C174 L175 S176 A181 V182 V196 V199 A200C174-A178 WeakPolarHBondContact O-CB 3.42Å; C174-A178 PolarHBondContact O-N 3.01Å; L175-A178 PolarHBondContact O-N 3.5Å; S176-A178 VanDerWaalsContact C-N 3.28Å; S176-A178 PolarHBondContact O-N 3.07Å; A178-A181 PolarHBondContact O-N 2.82Å; A178-V182 WeakPolarHBondContact O-CB 3.42Å; A178-V182 WeakPolarHBondContact O-CG2 3.45Å; A178-V182 PolarHBondContact O-N 3.4Å; A178-V196 HydrophobicContact CB-CG1 3.7Å; A178-V196 WeakPolarHBondContact CB-O 3.36Å; A178-V199 HydrophobicContact CB-CB 3.94Å; A178-V199 HydrophobicContact CB-CG1 3.85Å; A178-A200 HydrophobicContact CB-CB 3.86Å
179Q82.1Confident80.2Confident36 Ų3647.7 Ų47.717%0.16826%0.26CS..Hα-helixtrans-60.4-52.4176.8-172.4167-100110.4L175 S176 A181 V182 E183 E332L175-Q179 PolarHBondContact O-N 2.7Å; S176-Q179 PolarHBondContact O-N 3.34Å; Q179-A181 VanDerWaalsContact C-N 3.33Å; Q179-A181 PolarHBondContact O-N 3.18Å; Q179-V182 PolarHBondContact O-N 3.41Å; Q179-E183 VanDerWaalsContact O-CB 3.24Å; Q179-E183 WeakPolarHBondContact O-CB 3.24Å; Q179-E183 PolarHBondContact O-N 3.16Å; Q179-E332 PolarHBondContact NE2-OE2 3.28Å
180Y82.8Confident79.3Confident4 Ų452.7 Ų52.72%0.01629%0.288CS..Hα-helixtrans-65.9-32.8177.8-80-93.4000113.3F94 S176 A184 A333 A335 V336 V354F94-Y180 HydrophobicContact CB-CE2 4.4Å; F94-Y180 WeakPolarHBondContact CB-OH 3.33Å; F94-Y180 PolarHBondContact O-OH 3.49Å; S176-Y180 VanDerWaalsContact O-CD2 3.3Å; S176-Y180 WeakPolarHBondContact O-CD2 3.46Å; S176-Y180 PolarHBondContact O-N 3.08Å; S176-Y180 VanDerWaalsContact O-N 3.16Å; Y180-A184 PolarHBondContact O-N 2.76Å; Y180-A333 HydrophobicContact CD1-CB 4.22Å; Y180-A333 HydrophobicContact CE1-CB 3.58Å; Y180-A333 WeakPolarHBondContact OH-CA 3.46Å; Y180-A335 HydrophobicContact CE1-CB 4.45Å; Y180-V336 HydrophobicContact CD1-CG2 3.93Å; Y180-V336 HydrophobicContact CE1-CG2 4.03Å; Y180-V354 HydrophobicContact CD1-CB 3.86Å; Y180-V354 HydrophobicContact CD1-CG1 3.52Å; Y180-V354 HydrophobicContact CD1-CG2 3.99Å; Y180-V354 HydrophobicContact CD2-CG1 3.76Å; Y180-V354 HydrophobicContact CE1-CB 4.33Å; Y180-V354 HydrophobicContact CE1-CG1 3.88Å; Y180-V354 HydrophobicContact CE1-CG2 4.04Å; Y180-V354 HydrophobicContact CE2-CG1 4.14Å; Y180-V354 HydrophobicContact CG-CB 4.15Å; Y180-V354 HydrophobicContact CG-CG1 3.43Å; Y180-V354 VanDerWaalsContact CG-CG1 3.43Å
181A86.2Confident78.5Confident18 Ų1853.2 Ų53.215%0.14929%0.292CS..Hα-helixtrans-68.8-41176.500000112.2F177 A178 Q179 A184 F185 V199 T355F177-A181 HydrophobicContact CE1-CB 4.44Å; F177-A181 WeakPolarHBondContact O-CB 3.47Å; F177-A181 PolarHBondContact O-N 3.24Å; A178-A181 PolarHBondContact O-N 2.82Å; Q179-A181 VanDerWaalsContact C-N 3.33Å; Q179-A181 PolarHBondContact O-N 3.18Å; A181-A184 WeakPolarHBondContact O-CB 3.32Å; A181-F185 WeakPolarHBondContact O-CD2 3.25Å; A181-F185 WeakPolarHBondContact O-CE2 3.18Å; A181-V199 HydrophobicContact CB-CG1 4.34Å; A181-T355 HydrophobicContact CB-CG2 3.72Å
182V83.6Confident78.3Confident12 Ų1256.1 Ų56.17%0.07331%0.31CS..Hα-helixtrans-77.5-39.9-178.6178.30000111A178 Q179 A184 F185 V186 P191 V195 V196 V199A178-V182 WeakPolarHBondContact O-CB 3.42Å; A178-V182 WeakPolarHBondContact O-CG2 3.45Å; A178-V182 PolarHBondContact O-N 3.4Å; Q179-V182 PolarHBondContact O-N 3.41Å; V182-A184 PolarHBondContact O-N 3.39Å; V182-F185 PolarHBondContact O-N 2.72Å; V182-V186 HydrophobicContact CG1-CG2 4.22Å; V182-V186 PolarHBondContact O-N 3.28Å; V182-V186 VanDerWaalsContact O-N 3.14Å; V182-P191 HydrophobicContact CB-CB 4.09Å; V182-P191 HydrophobicContact CG1-CB 3.5Å; V182-V195 HydrophobicContact CG1-CG1 4.32Å; V182-V195 HydrophobicContact CG2-CG1 3.96Å; V182-V196 HydrophobicContact CB-CG2 4.4Å; V182-V196 HydrophobicContact CG2-CG2 4.26Å; V182-V199 HydrophobicContact CG2-CG2 4.05Å
183E76.2Confident78Confident46 Ų4661.4 Ų61.422%0.21533%0.326CS..Hα-helixtrans-60.3-29.3177-169.4177.6170.400112.3Q179 F185 V186 A333Q179-E183 VanDerWaalsContact O-CB 3.24Å; Q179-E183 WeakPolarHBondContact O-CB 3.24Å; Q179-E183 PolarHBondContact O-N 3.16Å; E183-F185 PolarHBondContact O-N 3.36Å; E183-F185 VanDerWaalsContact O-N 3.14Å; E183-V186 CarbonylContact O-C 3.5Å; E183-V186 PolarHBondContact O-N 3.01Å; E183-V186 VanDerWaalsContact O-O 3.14Å; E183-A333 VanDerWaalsContact OE1-CB 3.31Å; E183-A333 WeakPolarHBondContact OE1-CB 3.25Å; E183-A333 VanDerWaalsContact OE2-CB 3.25Å; E183-A333 WeakPolarHBondContact OE2-CB 3.28Å
184A76.3Confident77.8Confident50 Ų5063.5 Ų63.541%0.41335%0.349SS..THydrogen-bonded Turntrans-59.6-24.3172.200000113.9Y180 A181 V182 P351Y180-A184 PolarHBondContact O-N 2.76Å; A181-A184 WeakPolarHBondContact O-CB 3.32Å; V182-A184 PolarHBondContact O-N 3.39Å; A184-P351 HydrophobicContact CB-CB 3.89Å; A184-P351 HydrophobicContact CB-CG 3.99Å
185F77.8Confident77.6Confident178 Ų17866.7 Ų66.778%0.78137%0.368SS*.THydrogen-bonded Turntrans-106.2-15.1179.9-60.9-77.1000113.4A181 V182 E183A181-F185 WeakPolarHBondContact O-CD2 3.25Å; A181-F185 WeakPolarHBondContact O-CE2 3.18Å; V182-F185 PolarHBondContact O-N 2.72Å; E183-F185 PolarHBondContact O-N 3.36Å; E183-F185 VanDerWaalsContact O-N 3.14Å
186V70.1Confident77.5Confident50 Ų5065.8 Ų65.830%0.30336%0.364SS..  trans-123.797-177-172.20000108.3V182 E183 C189V182-V186 HydrophobicContact CG1-CG2 4.22Å; V182-V186 PolarHBondContact O-N 3.28Å; V182-V186 VanDerWaalsContact O-N 3.14Å; E183-V186 CarbonylContact O-C 3.5Å; E183-V186 PolarHBondContact O-N 3.01Å; E183-V186 VanDerWaalsContact O-O 3.14Å; V186-C189 HydrophobicContact CG1-CB 4.01Å; V186-C189 VanDerWaalsContact CG1-O 3.32Å; V186-C189 WeakPolarHBondContact CG1-O 3.15Å
187T61.3Low77.5Confident129 Ų12967.3 Ų67.379%0.79137%0.369SS*.SBendtrans-87.7-14.7-172.2470000114.8
188E60.9Low77.4Confident180 Ų18072.2 Ų72.284%0.84139%0.394SS*.SBendtrans-127.90.2-168.6-64.3-171.6-178.700114.8
189C67.6Low77.5Confident94 Ų9474.2 Ų74.264%0.63541%0.406SS*.SBendtrans-143.6150.4-176.8-700000111.9V186V186-C189 HydrophobicContact CG1-CB 4.01Å; V186-C189 VanDerWaalsContact CG1-O 3.32Å; V186-C189 WeakPolarHBondContact CG1-O 3.15Å
190D67.1Low77.8Confident134 Ų13472.6 Ų72.672%0.71740%0.399SS*.PPolyproline II helixtrans-57130.2172.5-63.5-20.4000110.2
191P68.8Low78Confident22 Ų2276 Ų7614%0.14342%0.417CS..PPolyproline II helixtrans-64130.8-176.424.2-32.4000110V182 R193 V196V182-P191 HydrophobicContact CB-CB 4.09Å; V182-P191 HydrophobicContact CG1-CB 3.5Å; P191-R193 PolarHBondContact O-N 3.42Å; P191-R193 VanDerWaalsContact O-N 3.14Å; P191-V196 HydrophobicContact CB-CG2 3.77Å; P191-V196 HydrophobicContact CG-CG2 4.12Å
192P79.9Confident78.2Confident74 Ų7480 Ų8048%0.48144%0.439SS..PPolyproline II helixtrans-57.2123.5-178.5-23.831.6000111.1G194 V195 V196P192-G194 PolarHBondContact O-N 2.8Å; P192-V195 HydrophobicContact CB-CB 4.43Å; P192-V195 HydrophobicContact CB-CG2 4.04Å; P192-V195 HydrophobicContact CG-CG2 4.38Å; P192-V195 PolarHBondContact O-N 3.3Å; P192-V196 PolarHBondContact O-N 3.48Å
193R78.8Confident78.5Confident172 Ų17279.6 Ų79.665%0.64944%0.437SS*.Hα-helixtrans-51.1-37.5-175.9-65.6-178.8179.9174.3-1.4113P191 K197P191-R193 PolarHBondContact O-N 3.42Å; P191-R193 VanDerWaalsContact O-N 3.14Å; R193-K197 WeakPolarHBondContact O-CG 3.33Å; R193-K197 PolarHBondContact O-N 3.41Å
194G81.1Confident79.1Confident48 Ų4877.9 Ų77.950%0.49543%0.429SS..Hα-helixtrans-63-40.2177.100000113.7P192 M198P192-G194 PolarHBondContact O-N 2.8Å; G194-M198 WeakPolarHBondContact O-CG 3.46Å; G194-M198 PolarHBondContact O-N 3.4Å
195V84.4Confident79.6Confident69 Ų6979.1 Ų79.142%0.41843%0.431SS..Hα-helixtrans-69.7-45.9179.4178.30000110.2V182 P192 K197 M198 V199V182-V195 HydrophobicContact CG1-CG1 4.32Å; V182-V195 HydrophobicContact CG2-CG1 3.96Å; P192-V195 HydrophobicContact CB-CB 4.43Å; P192-V195 HydrophobicContact CB-CG2 4.04Å; P192-V195 HydrophobicContact CG-CG2 4.38Å; P192-V195 PolarHBondContact O-N 3.3Å; V195-K197 VanDerWaalsContact C-N 3.32Å; V195-K197 PolarHBondContact O-N 3.12Å; V195-M198 PolarHBondContact O-N 3.31Å; V195-M198 VanDerWaalsContact O-N 3.14Å; V195-V199 HydrophobicContact CG1-CG2 4.31Å; V195-V199 WeakPolarHBondContact O-CG2 2.98Å; V195-V199 PolarHBondContact O-N 3.42Å
196V83.6Confident80.1Confident17 Ų1775.8 Ų75.810%0.10342%0.42CS..Hα-helixtrans-56.9-46.5176.4178.50000110.6L175 A178 V182 P191 P192 M198 V199 A200L175-V196 HydrophobicContact CD2-CG1 4.47Å; A178-V196 HydrophobicContact CB-CG1 3.7Å; A178-V196 WeakPolarHBondContact CB-O 3.36Å; V182-V196 HydrophobicContact CB-CG2 4.4Å; V182-V196 HydrophobicContact CG2-CG2 4.26Å; P191-V196 HydrophobicContact CB-CG2 3.77Å; P191-V196 HydrophobicContact CG-CG2 4.12Å; P192-V196 PolarHBondContact O-N 3.48Å; V196-M198 PolarHBondContact O-N 3.1Å; V196-V199 PolarHBondContact O-N 2.83Å; V196-A200 WeakPolarHBondContact O-CB 3.46Å; V196-A200 PolarHBondContact O-N 2.99Å
197K83.4Confident81Confident45 Ų4573.5 Ų73.520%0.19641%0.406CS..Hα-helixtrans-61.8-42.6176.3-72.7-174.7-174.1-168.10112.5R193 V195 A200 L201 D414R193-K197 WeakPolarHBondContact O-CG 3.33Å; R193-K197 PolarHBondContact O-N 3.41Å; V195-K197 VanDerWaalsContact C-N 3.32Å; V195-K197 PolarHBondContact O-N 3.12Å; K197-A200 PolarHBondContact O-N 2.82Å; K197-L201 WeakPolarHBondContact O-CG 3.3Å; K197-L201 PolarHBondContact O-N 3.42Å; K197-D414 IonicContact NZ-OD1 2.74Å; K197-D414 PolarHBondContact NZ-OD1 2.67Å; K197-D414 IonicContact NZ-OD2 3.11Å; K197-D414 PolarHBondContact NZ-OD2 3.24Å
198M87Confident82.1Confident138 Ų13868.1 Ų68.168%0.6837%0.372SS*.Hα-helixtrans-64.5-44.2178.3-78-167.1162.200112.3G194 V195 V196 A200 L201 V202G194-M198 WeakPolarHBondContact O-CG 3.46Å; G194-M198 PolarHBondContact O-N 3.4Å; V195-M198 PolarHBondContact O-N 3.31Å; V195-M198 VanDerWaalsContact O-N 3.14Å; V196-M198 PolarHBondContact O-N 3.1Å; M198-A200 VanDerWaalsContact C-N 3.34Å; M198-A200 PolarHBondContact O-N 3.09Å; M198-L201 PolarHBondContact O-N 3.39Å; M198-V202 WeakPolarHBondContact O-CG2 3.39Å; M198-V202 PolarHBondContact O-N 2.93Å
199V89Confident83.3Confident43 Ų4366.1 Ų66.126%0.26136%0.361SS..Hα-helixtrans-62.5-42.2176.6173.20000110.8F177 A178 A181 V182 V195 V196 L201 V202 A203F177-V199 HydrophobicContact CD1-CG1 4.34Å; F177-V199 HydrophobicContact CE1-CG1 3.9Å; A178-V199 HydrophobicContact CB-CB 3.94Å; A178-V199 HydrophobicContact CB-CG1 3.85Å; A181-V199 HydrophobicContact CB-CG1 4.34Å; V182-V199 HydrophobicContact CG2-CG2 4.05Å; V195-V199 HydrophobicContact CG1-CG2 4.31Å; V195-V199 WeakPolarHBondContact O-CG2 2.98Å; V195-V199 PolarHBondContact O-N 3.42Å; V196-V199 PolarHBondContact O-N 2.83Å; V199-L201 PolarHBondContact O-N 3.43Å; V199-V202 PolarHBondContact O-N 3.2Å; V199-A203 PolarHBondContact O-N 3.39Å
200A87.9Confident84.1Confident2 Ų262.6 Ų62.62%0.01734%0.336CS..Hα-helixtrans-60-46.1175.300000111.6C174 L175 A178 V196 K197 M198 V202 A203 I204C174-A200 HydrophobicContact CB-CB 4.24Å; C174-A200 WeakPolarHBondContact O-CB 3.19Å; L175-A200 HydrophobicContact CD2-CB 4.25Å; A178-A200 HydrophobicContact CB-CB 3.86Å; V196-A200 WeakPolarHBondContact O-CB 3.46Å; V196-A200 PolarHBondContact O-N 2.99Å; K197-A200 PolarHBondContact O-N 2.82Å; M198-A200 VanDerWaalsContact C-N 3.34Å; M198-A200 PolarHBondContact O-N 3.09Å; A200-V202 PolarHBondContact O-N 2.92Å; A200-A203 WeakPolarHBondContact O-CB 3.49Å; A200-A203 PolarHBondContact O-N 2.81Å; A200-I204 WeakPolarHBondContact O-CD1 3.4Å; A200-I204 VanDerWaalsContact O-CG1 3.25Å; A200-I204 WeakPolarHBondContact O-CG1 3.37Å; A200-I204 PolarHBondContact O-N 3.5Å
201L87.4Confident84.9Confident76 Ų7656.5 Ų56.540%0.39830%0.304SS..Hα-helixtrans-61-43.4177.2-73.6172.3000112.3K197 M198 V199 A203 I204 V205K197-L201 WeakPolarHBondContact O-CG 3.3Å; K197-L201 PolarHBondContact O-N 3.42Å; M198-L201 PolarHBondContact O-N 3.39Å; V199-L201 PolarHBondContact O-N 3.43Å; L201-A203 VanDerWaalsContact C-N 3.32Å; L201-A203 PolarHBondContact O-N 3.29Å; L201-I204 PolarHBondContact O-N 3.03Å; L201-V205 WeakPolarHBondContact O-CG2 3.4Å; L201-V205 PolarHBondContact O-N 3Å
202V90Very high85.5Confident100 Ų10056.7 Ų56.761%0.60631%0.305SS*.Hα-helixtrans-60.4-44.1175.9170.60000110.7M198 V199 A200 I204 V205 M206M198-V202 WeakPolarHBondContact O-CG2 3.39Å; M198-V202 PolarHBondContact O-N 2.93Å; V199-V202 PolarHBondContact O-N 3.2Å; A200-V202 PolarHBondContact O-N 2.92Å; V202-I204 PolarHBondContact O-N 3.42Å; V202-V205 PolarHBondContact O-N 3.38Å; V202-M206 WeakPolarHBondContact O-CB 3.44Å; V202-M206 PolarHBondContact O-N 3.36Å
203A89.6Confident85.6Confident5 Ų558.4 Ų58.44%0.04130%0.303CS..Hα-helixtrans-60.4-46.3177.200000111.8F177 V199 A200 L201 V205 M206 I207F177-A203 HydrophobicContact CD1-CB 3.75Å; F177-A203 HydrophobicContact CE1-CB 3.68Å; F177-A203 HydrophobicContact CZ-CB 4.46Å; V199-A203 PolarHBondContact O-N 3.39Å; A200-A203 WeakPolarHBondContact O-CB 3.49Å; A200-A203 PolarHBondContact O-N 2.81Å; L201-A203 VanDerWaalsContact C-N 3.32Å; L201-A203 PolarHBondContact O-N 3.29Å; A203-V205 PolarHBondContact O-N 3.39Å; A203-M206 PolarHBondContact O-N 2.92Å; A203-I207 VanDerWaalsContact O-CG1 3.23Å; A203-I207 WeakPolarHBondContact O-CG1 3.47Å; A203-I207 PolarHBondContact O-N 3.03Å
204I88.2Confident85.6Confident9 Ų951.8 Ų51.85%0.04628%0.283CS..Hα-helixtrans-61.2-46.9178.7-61.3152.8000110.8C174 A200 L201 V202 M206 I207 L208 L404 L407C174-I204 HydrophobicContact CB-CD1 3.98Å; C174-I204 HydrophobicContact CB-CG1 3.73Å; C174-I204 WeakPolarHBondContact SG-CG1 3.28Å; A200-I204 WeakPolarHBondContact O-CD1 3.4Å; A200-I204 VanDerWaalsContact O-CG1 3.25Å; A200-I204 WeakPolarHBondContact O-CG1 3.37Å; A200-I204 PolarHBondContact O-N 3.5Å; L201-I204 PolarHBondContact O-N 3.03Å; V202-I204 PolarHBondContact O-N 3.42Å; I204-M206 VanDerWaalsContact C-N 3.3Å; I204-M206 PolarHBondContact O-N 3.46Å; I204-I207 PolarHBondContact O-N 3.22Å; I204-L208 WeakPolarHBondContact O-CB 3.38Å; I204-L208 PolarHBondContact O-N 2.76Å; I204-L404 HydrophobicContact CB-CD1 4.33Å; I204-L404 HydrophobicContact CG2-CD1 3.45Å; I204-L404 VanDerWaalsContact CG2-CD1 3.45Å; I204-L407 HydrophobicContact CD1-CD2 3.25Å; I204-L407 HydrophobicContact CG1-CD2 4.16Å; I204-L407 HydrophobicContact CG2-CD2 4.4Å
205V88.1Confident85.3Confident76 Ų7650.6 Ų50.646%0.46127%0.266SS..Hα-helixtrans-62.5-39.6179.2171.70000111.1L201 V202 A203 L208 F209 L404L201-V205 WeakPolarHBondContact O-CG2 3.4Å; L201-V205 PolarHBondContact O-N 3Å; V202-V205 PolarHBondContact O-N 3.38Å; A203-V205 PolarHBondContact O-N 3.39Å; V205-L208 PolarHBondContact O-N 3.29Å; V205-F209 WeakPolarHBondContact O-CB 3.41Å; V205-F209 PolarHBondContact O-N 3.49Å; V205-L404 HydrophobicContact CG2-CD1 4.18Å; V205-L404 HydrophobicContact CG2-CD2 4.32Å
206M88.6Confident85.2Confident109 Ų10951.4 Ų51.454%0.53727%0.268SS..Hα-helixtrans-64.7-47.7176.7-172.6-177.8-172.100111.8V202 A203 I204 L208 F209 V210 F359V202-M206 WeakPolarHBondContact O-CB 3.44Å; V202-M206 PolarHBondContact O-N 3.36Å; A203-M206 PolarHBondContact O-N 2.92Å; I204-M206 VanDerWaalsContact C-N 3.3Å; I204-M206 PolarHBondContact O-N 3.46Å; M206-L208 VanDerWaalsContact C-N 3.3Å; M206-L208 PolarHBondContact O-N 3.41Å; M206-F209 PolarHBondContact O-N 3.21Å; M206-V210 WeakPolarHBondContact O-CG2 3.41Å; M206-V210 PolarHBondContact O-N 3.47Å; M206-F359 HydrophobicContact CG-CZ 4.34Å; M206-F359 HydrophobicContact SD-CE2 4.01Å; M206-F359 HydrophobicContact SD-CZ 4.13Å
207I87.8Confident85.2Confident1 Ų154.1 Ų54.11%0.00528%0.282CS..Hα-helixtrans-61.3-43.1177.9-65.7165.7000110.1M170 A203 I204 F209 V210 N211 F359 A362 N363 L366M170-I207 HydrophobicContact CE-CG2 4.31Å; A203-I207 VanDerWaalsContact O-CG1 3.23Å; A203-I207 WeakPolarHBondContact O-CG1 3.47Å; A203-I207 PolarHBondContact O-N 3.03Å; I204-I207 PolarHBondContact O-N 3.22Å; I207-F209 PolarHBondContact O-N 3.27Å; I207-V210 PolarHBondContact O-N 3Å; I207-N211 WeakPolarHBondContact O-CB 3.26Å; I207-N211 PolarHBondContact O-N 2.89Å; I207-N211 PolarHBondContact O-ND2 2.99Å; I207-F359 HydrophobicContact CD1-CD1 4.49Å; I207-F359 HydrophobicContact CD1-CD2 4.04Å; I207-F359 HydrophobicContact CD1-CE1 4.44Å; I207-F359 HydrophobicContact CD1-CE2 3.99Å; I207-F359 HydrophobicContact CD1-CG 4.31Å; I207-F359 HydrophobicContact CD1-CZ 4.21Å; I207-F359 HydrophobicContact CG1-CD1 4.27Å; I207-F359 HydrophobicContact CG1-CD2 4.07Å; I207-F359 HydrophobicContact CG1-CE1 3.74Å; I207-F359 HydrophobicContact CG1-CE2 3.52Å; I207-F359 HydrophobicContact CG1-CG 4.42Å; I207-F359 HydrophobicContact CG1-CZ 3.35Å; I207-A362 HydrophobicContact CD1-CB 3.56Å; I207-N363 HydrophobicContact CG2-CB 4.16Å; I207-L366 HydrophobicContact CG2-CB 4.26Å; I207-L366 HydrophobicContact CG2-CD2 3.72Å
208L85.1Confident85.2Confident17 Ų1752 Ų529%0.08927%0.272CS..Hα-helixtrans-58.6-48.3174.9175.965.1000111.4I204 V205 M206 V210 N211 C212 L366 L400 I401 L404I204-L208 WeakPolarHBondContact O-CB 3.38Å; I204-L208 PolarHBondContact O-N 2.76Å; V205-L208 PolarHBondContact O-N 3.29Å; M206-L208 VanDerWaalsContact C-N 3.3Å; M206-L208 PolarHBondContact O-N 3.41Å; L208-V210 VanDerWaalsContact C-N 3.34Å; L208-V210 PolarHBondContact O-N 3.47Å; L208-N211 PolarHBondContact O-N 3.35Å; L208-C212 VanDerWaalsContact O-CB 3.29Å; L208-C212 WeakPolarHBondContact O-CB 3.29Å; L208-C212 PolarHBondContact O-N 3.07Å; L208-C212 PolarHBondContact O-SG 2.9Å; L208-C212 VanDerWaalsContact O-SG 3.33Å; L208-L366 HydrophobicContact CB-CD2 4.34Å; L208-L366 HydrophobicContact CD1-CD2 4.39Å; L208-L400 HydrophobicContact CD1-CB 3.39Å; L208-I401 HydrophobicContact CD1-CG1 4.49Å; L208-I401 HydrophobicContact CD2-CG1 4.26Å; L208-L404 HydrophobicContact CD2-CB 3.99Å; L208-L404 HydrophobicContact CD2-CD2 3.55Å; L208-L404 HydrophobicContact CD2-CG 4.26Å
209F85.6Confident85Confident137 Ų13746.1 Ų46.160%0.60124%0.244SC*.Hα-helixtrans-58.8-46.2180179.1-98000111.6V205 M206 I207 C212 Y213V205-F209 WeakPolarHBondContact O-CB 3.41Å; V205-F209 PolarHBondContact O-N 3.49Å; M206-F209 PolarHBondContact O-N 3.21Å; I207-F209 PolarHBondContact O-N 3.27Å; F209-C212 PolarHBondContact O-N 3.43Å; F209-Y213 HydrophobicContact CZ-CD2 4.31Å; F209-Y213 VanDerWaalsContact O-CB 3.27Å; F209-Y213 WeakPolarHBondContact O-CB 3.37Å; F209-Y213 PolarHBondContact O-N 3.33Å
210V85.7Confident85Confident20 Ų2046.5 Ų46.512%0.12125%0.251CS..Hα-helixtrans-60.2-47.6177.8171.70000111.2M206 I207 L208 Y213 S214 L217 V221M206-V210 WeakPolarHBondContact O-CG2 3.41Å; M206-V210 PolarHBondContact O-N 3.47Å; I207-V210 PolarHBondContact O-N 3Å; L208-V210 VanDerWaalsContact C-N 3.34Å; L208-V210 PolarHBondContact O-N 3.47Å; V210-Y213 PolarHBondContact O-N 3Å; V210-S214 PolarHBondContact O-N 3.47Å; V210-L217 HydrophobicContact CG1-CD2 4.03Å; V210-L217 HydrophobicContact CG1-CG 4.04Å; V210-V221 HydrophobicContact CG1-CG2 4.4Å
211N83.2Confident85Confident7 Ų747.9 Ų47.94%0.03726%0.259CS..Hα-helixtrans-68.8-34.2-179.2-79.6-82.2000112.9I207 L208 Y213 N363 L366 T395 L400I207-N211 WeakPolarHBondContact O-CB 3.26Å; I207-N211 PolarHBondContact O-N 2.89Å; I207-N211 PolarHBondContact O-ND2 2.99Å; L208-N211 PolarHBondContact O-N 3.35Å; N211-Y213 VanDerWaalsContact C-N 3.35Å; N211-N363 PolarHBondContact ND2-OD1 2.89Å; N211-L366 HydrophobicContact CB-CD2 4.23Å; N211-T395 VanDerWaalsContact O-CG2 3.28Å; N211-T395 WeakPolarHBondContact O-CG2 3.43Å; N211-L400 HydrophobicContact CB-CD1 4.12Å
212C80.3Confident85Confident25 Ų2544.3 Ų44.317%0.16924%0.241CC..Hα-helixtrans-71.7-30.3173.2-74.40000112.2L208 F209 T395 A397L208-C212 VanDerWaalsContact O-CB 3.29Å; L208-C212 WeakPolarHBondContact O-CB 3.29Å; L208-C212 PolarHBondContact O-N 3.07Å; L208-C212 PolarHBondContact O-SG 2.9Å; L208-C212 VanDerWaalsContact O-SG 3.33Å; F209-C212 PolarHBondContact O-N 3.43Å; C212-T395 PolarHBondContact O-OG1 3.41Å; C212-A397 HydrophobicContact CB-CB 4.45Å
213Y82.2Confident85Confident111 Ų11141.1 Ų41.144%0.43522%0.22SC..Hα-helixtrans-74-48.9-176.3-172.4-85.7000112.8F209 V210 N211 L217 R393F209-Y213 HydrophobicContact CZ-CD2 4.31Å; F209-Y213 VanDerWaalsContact O-CB 3.27Å; F209-Y213 WeakPolarHBondContact O-CB 3.37Å; F209-Y213 PolarHBondContact O-N 3.33Å; V210-Y213 PolarHBondContact O-N 3Å; N211-Y213 VanDerWaalsContact C-N 3.35Å; Y213-L217 HydrophobicContact CD1-CD2 4.27Å; Y213-R393 VanDerWaalsContact O-CD 3.23Å; Y213-R393 WeakPolarHBondContact O-CD 3.09Å
214S79.8Confident85.1Confident32 Ų3245.4 Ų45.422%0.22425%0.246CC..  trans-161.5130.3178.4-178.60000112.1V210 N216 L217 G218V210-S214 PolarHBondContact O-N 3.47Å; S214-N216 VanDerWaalsContact C-N 3.27Å; S214-N216 PolarHBondContact O-N 3.21Å; S214-N216 PolarHBondContact OG-N 2.9Å; S214-L217 PolarHBondContact O-N 3.43Å; S214-G218 PolarHBondContact O-N 3.22Å
215V75.1Confident85.1Confident24 Ų2447.5 Ų47.515%0.14525%0.254CS..Hα-helixtrans-58.1-40.7171.5-178.20000111.2L217 G218 M219 F367 T395V215-L217 VanDerWaalsContact C-N 3.35Å; V215-L217 PolarHBondContact O-N 3.39Å; V215-G218 PolarHBondContact O-N 2.85Å; V215-M219 PolarHBondContact O-N 2.83Å; V215-F367 HydrophobicContact CG1-CE2 3.71Å; V215-F367 HydrophobicContact CG1-CZ 3.93Å; V215-T395 HydrophobicContact CG2-CG2 3.59Å
216N81.2Confident85.2Confident85 Ų8544.1 Ų44.146%0.45523%0.234SC..Hα-helixtrans-64.4-40.7179.5-69.8-8.4000111.5R74 S214 A220R74-N216 PolarHBondContact NH1-ND2 3.01Å; R74-N216 VanDerWaalsContact NH1-ND2 3.14Å; R74-N216 PolarHBondContact NH1-OD1 2.66Å; S214-N216 VanDerWaalsContact C-N 3.27Å; S214-N216 PolarHBondContact O-N 3.21Å; S214-N216 PolarHBondContact OG-N 2.9Å; N216-A220 WeakPolarHBondContact O-CB 3.41Å; N216-A220 PolarHBondContact O-N 3.3Å
217L84.6Confident85.3Confident75 Ų7541.4 Ų41.439%0.39323%0.229SC..Hα-helixtrans-65.6-46.6176.6-176.166.4000110.5V210 Y213 S214 V215 M219 A220 V221V210-L217 HydrophobicContact CG1-CD2 4.03Å; V210-L217 HydrophobicContact CG1-CG 4.04Å; Y213-L217 HydrophobicContact CD1-CD2 4.27Å; S214-L217 PolarHBondContact O-N 3.43Å; V215-L217 VanDerWaalsContact C-N 3.35Å; V215-L217 PolarHBondContact O-N 3.39Å; L217-M219 VanDerWaalsContact C-N 3.3Å; L217-M219 PolarHBondContact O-N 3Å; L217-A220 PolarHBondContact O-N 3.39Å; L217-V221 HydrophobicContact CD1-CG2 4.31Å; L217-V221 HydrophobicContact CG-CG2 4.34Å; L217-V221 WeakPolarHBondContact O-CB 3.34Å; L217-V221 VanDerWaalsContact O-CG2 3.23Å; L217-V221 WeakPolarHBondContact O-CG2 3.38Å; L217-V221 PolarHBondContact O-N 3.33Å
218G82.6Confident85.4Confident0 Ų043.3 Ų43.30%025%0.245CC..Hα-helixtrans-56.1-42.3176.900000112.9S214 V215 Q222 N363S214-G218 PolarHBondContact O-N 3.22Å; V215-G218 PolarHBondContact O-N 2.85Å; G218-Q222 WeakPolarHBondContact O-CB 3.34Å; G218-Q222 PolarHBondContact O-N 3.44Å; G218-N363 PolarHBondContact O-ND2 3.14Å
219M83.8Confident85.6Confident15 Ų1542.7 Ų42.77%0.07424%0.241CC..Hα-helixtrans-72.9-36.9176.1-72.9-58.2-47.700113.7L75 V215 L217 Q222 N223 F367L75-M219 HydrophobicContact CD2-CE 3.51Å; L75-M219 HydrophobicContact CD2-CG 3.81Å; L75-M219 HydrophobicContact CD2-SD 3.73Å; V215-M219 PolarHBondContact O-N 2.83Å; L217-M219 VanDerWaalsContact C-N 3.3Å; L217-M219 PolarHBondContact O-N 3Å; M219-Q222 WeakPolarHBondContact O-CB 3.36Å; M219-Q222 PolarHBondContact O-N 2.92Å; M219-N223 PolarHBondContact O-N 3.24Å; M219-F367 HydrophobicContact CG-CE2 3.92Å; M219-F367 HydrophobicContact CG-CZ 3.73Å; M219-F367 HydrophobicContact SD-CD1 4.28Å; M219-F367 HydrophobicContact SD-CD2 4.48Å; M219-F367 HydrophobicContact SD-CE1 3.69Å; M219-F367 HydrophobicContact SD-CE2 3.91Å; M219-F367 HydrophobicContact SD-CZ 3.46Å; M219-F367 WeakPolarHBondContact SD-CZ 3.38Å
220A87.9Confident85.8Confident51 Ų5138.6 Ų38.642%0.42123%0.226SC..Hα-helixtrans-63.3-45.9174.800000110.8N216 L217 Q222 N223 V224N216-A220 WeakPolarHBondContact O-CB 3.41Å; N216-A220 PolarHBondContact O-N 3.3Å; L217-A220 PolarHBondContact O-N 3.39Å; A220-Q222 VanDerWaalsContact C-N 3.32Å; A220-Q222 PolarHBondContact O-N 2.99Å; A220-N223 PolarHBondContact O-N 3.42Å; A220-V224 WeakPolarHBondContact O-CG2 3.33Å; A220-V224 PolarHBondContact O-N 3.43Å
221V87.8Confident86Confident31 Ų3142.2 Ų42.219%0.18825%0.247CC..Hα-helixtrans-58.1-45173.8171.10000110.6V210 L217 N223 V224 F225 F359V210-V221 HydrophobicContact CG1-CG2 4.4Å; L217-V221 HydrophobicContact CD1-CG2 4.31Å; L217-V221 HydrophobicContact CG-CG2 4.34Å; L217-V221 WeakPolarHBondContact O-CB 3.34Å; L217-V221 VanDerWaalsContact O-CG2 3.23Å; L217-V221 WeakPolarHBondContact O-CG2 3.38Å; L217-V221 PolarHBondContact O-N 3.33Å; V221-N223 PolarHBondContact O-N 3.12Å; V221-V224 PolarHBondContact O-N 3.01Å; V221-F225 HydrophobicContact CG1-CD2 3.47Å; V221-F225 VanDerWaalsContact CG1-CD2 3.47Å; V221-F225 HydrophobicContact CG1-CE2 3.21Å; V221-F225 HydrophobicContact CG1-CG 4.48Å; V221-F225 HydrophobicContact CG1-CZ 4.06Å; V221-F225 WeakPolarHBondContact O-CB 3.42Å; V221-F225 WeakPolarHBondContact O-CD2 3.49Å; V221-F225 WeakPolarHBondContact O-CG 3.27Å; V221-F225 PolarHBondContact O-N 3.06Å; V221-F359 HydrophobicContact CG1-CE1 4.46Å
222Q88.5Confident86.2Confident1 Ų142.5 Ų42.51%0.00525%0.251CS..Hα-helixtrans-56.9-48.5175.5-17063.243.700112.4L83 G218 M219 A220 T226 G360 N363L83-Q222 HydrophobicContact CD1-CG 4.06Å; G218-Q222 WeakPolarHBondContact O-CB 3.34Å; G218-Q222 PolarHBondContact O-N 3.44Å; M219-Q222 WeakPolarHBondContact O-CB 3.36Å; M219-Q222 PolarHBondContact O-N 2.92Å; A220-Q222 VanDerWaalsContact C-N 3.32Å; A220-Q222 PolarHBondContact O-N 2.99Å; Q222-T226 PolarHBondContact NE2-OG1 2.99Å; Q222-T226 VanDerWaalsContact O-CB 3.25Å; Q222-T226 WeakPolarHBondContact O-CB 3.25Å; Q222-T226 PolarHBondContact O-N 2.99Å; Q222-T226 PolarHBondContact O-OG1 3.4Å; Q222-G360 PolarHBondContact NE2-O 3.38Å; Q222-G360 PolarHBondContact OE1-O 2.89Å; Q222-N363 PolarHBondContact OE1-ND2 3.18Å
223N89.4Confident86.6Confident33 Ų3341.6 Ų41.618%0.17625%0.245CC..Hα-helixtrans-64.8-43.8-178.1-73.8-6.3000111.5S79 A82 M219 A220 V221 T226 A227S79-N223 PolarHBondContact OG-ND2 3.39Å; A82-N223 WeakPolarHBondContact CB-OD1 3.32Å; M219-N223 PolarHBondContact O-N 3.24Å; A220-N223 PolarHBondContact O-N 3.42Å; V221-N223 PolarHBondContact O-N 3.12Å; N223-T226 PolarHBondContact O-N 3.38Å; N223-A227 PolarHBondContact O-N 3.33Å
224V91.3Very high87.1Confident95 Ų9540.2 Ų40.258%0.57625%0.248SC*.Hα-helixtrans-63.7-48.1178.71720000111.1A220 V221 T226 A227 A228A220-V224 WeakPolarHBondContact O-CG2 3.33Å; A220-V224 PolarHBondContact O-N 3.43Å; V221-V224 PolarHBondContact O-N 3.01Å; V224-T226 VanDerWaalsContact C-N 3.28Å; V224-T226 PolarHBondContact O-N 3.34Å; V224-A227 PolarHBondContact O-N 2.8Å; V224-A228 WeakPolarHBondContact O-CB 3.23Å; V224-A228 PolarHBondContact O-N 2.89Å
225F89.8Confident87.5Confident53 Ų5340.9 Ų40.923%0.23225%0.25CS..Hα-helixtrans-67.7-30.4178.3-67.5-28000112.9V221 A228 K229 I356 F359V221-F225 HydrophobicContact CG1-CD2 3.47Å; V221-F225 VanDerWaalsContact CG1-CD2 3.47Å; V221-F225 HydrophobicContact CG1-CE2 3.21Å; V221-F225 HydrophobicContact CG1-CG 4.48Å; V221-F225 HydrophobicContact CG1-CZ 4.06Å; V221-F225 WeakPolarHBondContact O-CB 3.42Å; V221-F225 WeakPolarHBondContact O-CD2 3.49Å; V221-F225 WeakPolarHBondContact O-CG 3.27Å; V221-F225 PolarHBondContact O-N 3.06Å; F225-A228 PolarHBondContact O-N 3.42Å; F225-K229 WeakPolarHBondContact O-CB 3.22Å; F225-K229 WeakPolarHBondContact O-CG 3.23Å; F225-K229 PolarHBondContact O-N 3.37Å; F225-I356 HydrophobicContact CB-CG2 4.08Å; F225-I356 HydrophobicContact CD1-CG2 3.64Å; F225-I356 HydrophobicContact CE1-CG2 4.35Å; F225-I356 HydrophobicContact CG-CG2 4.07Å; F225-F359 AromaticContact CD2-CD1 3.83Å; F225-F359 HydrophobicContact CD2-CD1 3.83Å; F225-F359 HydrophobicContact CD2-CE1 4.4Å; F225-F359 AromaticContact CE2-CD1 3.28Å; F225-F359 HydrophobicContact CE2-CD1 3.28Å; F225-F359 AromaticContact CE2-CE1 3.58Å; F225-F359 HydrophobicContact CE2-CE1 3.58Å; F225-F359 HydrophobicContact CE2-CG 4.27Å; F225-F359 HydrophobicContact CZ-CD1 4.19Å; F225-F359 HydrophobicContact CZ-CE1 4.41Å
226T89.6Confident88.2Confident4 Ų440 Ų403%0.02525%0.245CC..Hα-helixtrans-69.2-38.7173.5-56.20000112.2A82 V85 G86 Q222 N223 V224 K229 L230A82-T226 HydrophobicContact CB-CG2 4.18Å; A82-T226 WeakPolarHBondContact O-CG2 3.22Å; A82-T226 PolarHBondContact O-OG1 3.2Å; V85-T226 HydrophobicContact CB-CG2 4.17Å; V85-T226 HydrophobicContact CG1-CG2 4.04Å; G86-T226 VanDerWaalsContact CA-OG1 3.3Å; G86-T226 WeakPolarHBondContact CA-OG1 3.29Å; Q222-T226 PolarHBondContact NE2-OG1 2.99Å; Q222-T226 VanDerWaalsContact O-CB 3.25Å; Q222-T226 WeakPolarHBondContact O-CB 3.25Å; Q222-T226 PolarHBondContact O-N 2.99Å; Q222-T226 PolarHBondContact O-OG1 3.4Å; N223-T226 PolarHBondContact O-N 3.38Å; V224-T226 VanDerWaalsContact C-N 3.28Å; V224-T226 PolarHBondContact O-N 3.34Å; T226-K229 VanDerWaalsContact O-CG 3.28Å; T226-K229 WeakPolarHBondContact O-CG 3.3Å; T226-L230 VanDerWaalsContact O-CG 3.32Å; T226-L230 WeakPolarHBondContact O-CG 3.49Å; T226-L230 PolarHBondContact O-N 2.8Å
227A90.6Very high88.7Confident52 Ų5237.6 Ų37.643%0.4323%0.232SC..Hα-helixtrans-64.7-47.6172.200000111N223 V224 K229 L230 V231N223-A227 PolarHBondContact O-N 3.33Å; V224-A227 PolarHBondContact O-N 2.8Å; A227-K229 PolarHBondContact O-N 3.12Å; A227-L230 PolarHBondContact O-N 3.49Å; A227-V231 WeakPolarHBondContact O-CG2 3.46Å; A227-V231 PolarHBondContact O-N 3.14Å; A227-V231 VanDerWaalsContact O-N 3.11Å
228A89.6Confident89Confident42 Ų4237.8 Ų37.835%0.34724%0.238SC..Hα-helixtrans-59.2-43.6-179.400000112.7V224 F225 V231 A232 I356V224-A228 WeakPolarHBondContact O-CB 3.23Å; V224-A228 PolarHBondContact O-N 2.89Å; F225-A228 PolarHBondContact O-N 3.42Å; A228-V231 WeakPolarHBondContact O-CB 3.36Å; A228-V231 PolarHBondContact O-N 2.92Å; A228-A232 PolarHBondContact O-N 3.19Å; A228-A232 VanDerWaalsContact O-N 3.09Å; A228-I356 HydrophobicContact CB-CG2 3.94Å
229K88.5Confident89.3Confident3 Ų338.2 Ų38.21%0.01324%0.243CC..Hα-helixtrans-70.4-32.4178.173.4-170.5-172.3162.70113.3V85 G86 I89 F225 T226 A227 V231 A232 V233V85-K229 WeakPolarHBondContact O-CE 3.39Å; V85-K229 PolarHBondContact O-NZ 3.28Å; G86-K229 PolarHBondContact O-NZ 3.28Å; I89-K229 HydrophobicContact CB-CD 4.28Å; I89-K229 HydrophobicContact CG2-CD 4.25Å; I89-K229 PolarHBondContact O-NZ 2.73Å; F225-K229 WeakPolarHBondContact O-CB 3.22Å; F225-K229 WeakPolarHBondContact O-CG 3.23Å; F225-K229 PolarHBondContact O-N 3.37Å; T226-K229 VanDerWaalsContact O-CG 3.28Å; T226-K229 WeakPolarHBondContact O-CG 3.3Å; A227-K229 PolarHBondContact O-N 3.12Å; K229-V231 VanDerWaalsContact C-N 3.3Å; K229-V231 PolarHBondContact O-N 2.65Å; K229-A232 WeakPolarHBondContact O-CB 3.41Å; K229-A232 PolarHBondContact O-N 3.04Å; K229-V233 WeakPolarHBondContact O-CG2 3.41Å; K229-V233 PolarHBondContact O-N 2.73Å
230L89.8Confident89.6Confident52 Ų5237.5 Ų37.527%0.27224%0.239SC..Hα-helixtrans-64.5-38.3174-75.8175.8000110.9V85 I89 T226 A227 V233 V234V85-L230 HydrophobicContact CG1-CD1 4.41Å; V85-L230 HydrophobicContact CG1-CD2 3.97Å; V85-L230 HydrophobicContact CG1-CG 4.35Å; I89-L230 HydrophobicContact CD1-CD2 4.08Å; T226-L230 VanDerWaalsContact O-CG 3.32Å; T226-L230 WeakPolarHBondContact O-CG 3.49Å; T226-L230 PolarHBondContact O-N 2.8Å; A227-L230 PolarHBondContact O-N 3.49Å; L230-V233 PolarHBondContact O-N 3.02Å; L230-V234 WeakPolarHBondContact O-CG2 3.3Å; L230-V234 PolarHBondContact O-N 3.19Å
231V90.2Very high89.7Confident95 Ų9537.2 Ų37.258%0.57624%0.237SC*.Hα-helixtrans-60-46.8171.51770000110.6A227 A228 K229 V233 V234 V235A227-V231 WeakPolarHBondContact O-CG2 3.46Å; A227-V231 PolarHBondContact O-N 3.14Å; A227-V231 VanDerWaalsContact O-N 3.11Å; A228-V231 WeakPolarHBondContact O-CB 3.36Å; A228-V231 PolarHBondContact O-N 2.92Å; K229-V231 VanDerWaalsContact C-N 3.3Å; K229-V231 PolarHBondContact O-N 2.65Å; V231-V233 VanDerWaalsContact C-N 3.35Å; V231-V233 PolarHBondContact O-N 2.9Å; V231-V234 WeakPolarHBondContact O-CB 3.04Å; V231-V234 PolarHBondContact O-N 3.17Å; V231-V235 WeakPolarHBondContact O-CG2 3.09Å; V231-V235 PolarHBondContact O-N 3.45Å
232A87.2Confident89.9Confident13 Ų1341.9 Ų41.911%0.10725%0.251CS..Hα-helixtrans-60.8-42.217800000113A228 K229 V234 V235 V236 S353A228-A232 PolarHBondContact O-N 3.19Å; A228-A232 VanDerWaalsContact O-N 3.09Å; K229-A232 WeakPolarHBondContact O-CB 3.41Å; K229-A232 PolarHBondContact O-N 3.04Å; A232-V234 VanDerWaalsContact C-N 3.33Å; A232-V234 PolarHBondContact O-N 2.98Å; A232-V235 WeakPolarHBondContact O-CB 3.42Å; A232-V235 PolarHBondContact O-N 2.67Å; A232-V236 WeakPolarHBondContact O-CG2 3.49Å; A232-V236 PolarHBondContact O-N 2.78Å; A232-S353 VanDerWaalsContact CB-CB 3.41Å; A232-S353 WeakPolarHBondContact CB-OG 3.44Å
233V90Very high89.8Confident7 Ų744 Ų444%0.04226%0.26CS..Hα-helixtrans-60.3-43.7174.5165.50000110.9I89 K229 L230 V231 V235 V236 I237 C311 I315I89-V233 HydrophobicContact CG2-CG2 4.42Å; K229-V233 WeakPolarHBondContact O-CG2 3.41Å; K229-V233 PolarHBondContact O-N 2.73Å; L230-V233 PolarHBondContact O-N 3.02Å; V231-V233 VanDerWaalsContact C-N 3.35Å; V231-V233 PolarHBondContact O-N 2.9Å; V233-V235 VanDerWaalsContact C-N 3.32Å; V233-V235 PolarHBondContact O-N 2.8Å; V233-V236 PolarHBondContact O-N 2.83Å; V233-I237 HydrophobicContact CG1-CD1 3.64Å; V233-I237 HydrophobicContact CG1-CG1 4.35Å; V233-I237 VanDerWaalsContact O-CG1 3.26Å; V233-I237 WeakPolarHBondContact O-CG1 3.42Å; V233-I237 PolarHBondContact O-N 3.26Å; V233-C311 HydrophobicContact CG1-CB 3.91Å; V233-I315 HydrophobicContact CB-CD1 4.39Å; V233-I315 HydrophobicContact CG1-CD1 3.84Å; V233-I315 HydrophobicContact CG1-CG1 4.17Å; V233-I315 HydrophobicContact CG2-CD1 3.88Å
234V91.1Very high89.8Confident82 Ų8245.3 Ų45.350%0.49727%0.267SS..Hα-helixtrans-61.1-41.6175.9170.20000111.2L230 V231 A232 V236 I237 C238L230-V234 WeakPolarHBondContact O-CG2 3.3Å; L230-V234 PolarHBondContact O-N 3.19Å; V231-V234 WeakPolarHBondContact O-CB 3.04Å; V231-V234 PolarHBondContact O-N 3.17Å; A232-V234 VanDerWaalsContact C-N 3.33Å; A232-V234 PolarHBondContact O-N 2.98Å; V234-V236 VanDerWaalsContact C-N 3.34Å; V234-V236 PolarHBondContact O-N 3.22Å; V234-I237 PolarHBondContact O-N 3.24Å; V234-C238 WeakPolarHBondContact O-CB 3.35Å; V234-C238 PolarHBondContact O-N 2.99Å; V234-C238 PolarHBondContact O-SG 3.47Å
235V89.1Confident89.6Confident46 Ų4647.9 Ų47.928%0.27928%0.275SS..Hα-helixtrans-59-44.7176171.30000111.4V231 A232 V233 C238 G239 L343V231-V235 WeakPolarHBondContact O-CG2 3.09Å; V231-V235 PolarHBondContact O-N 3.45Å; A232-V235 WeakPolarHBondContact O-CB 3.42Å; A232-V235 PolarHBondContact O-N 2.67Å; V233-V235 VanDerWaalsContact C-N 3.32Å; V233-V235 PolarHBondContact O-N 2.8Å; V235-C238 PolarHBondContact O-N 3.06Å; V235-G239 PolarHBondContact O-N 2.85Å; V235-L343 HydrophobicContact CG1-CD1 4.33Å; V235-L343 HydrophobicContact CG1-CD2 4.31Å
236V89.3Confident89.5Confident5 Ų550.3 Ų50.33%0.0329%0.287CS..Hα-helixtrans-61.8-46.8176.2173.30000111.1A232 V233 V234 C238 G239 G240 I315 Y319 F338 M350A232-V236 WeakPolarHBondContact O-CG2 3.49Å; A232-V236 PolarHBondContact O-N 2.78Å; V233-V236 PolarHBondContact O-N 2.83Å; V234-V236 VanDerWaalsContact C-N 3.34Å; V234-V236 PolarHBondContact O-N 3.22Å; V236-C238 PolarHBondContact O-N 3.3Å; V236-G239 PolarHBondContact O-N 3.45Å; V236-G240 PolarHBondContact O-N 3.32Å; V236-I315 HydrophobicContact CG1-CG1 4.34Å; V236-I315 HydrophobicContact CG1-CG2 4.34Å; V236-Y319 HydrophobicContact CG1-CD1 4.45Å; V236-Y319 HydrophobicContact CG1-CE1 3.97Å; V236-F338 HydrophobicContact CB-CE1 4.16Å; V236-F338 HydrophobicContact CB-CZ 4.45Å; V236-F338 HydrophobicContact CG1-CD1 4.4Å; V236-F338 HydrophobicContact CG1-CE1 3.88Å; V236-F338 HydrophobicContact CG1-CE2 4.42Å; V236-F338 HydrophobicContact CG1-CZ 3.87Å; V236-F338 HydrophobicContact CG2-CD1 4.42Å; V236-F338 HydrophobicContact CG2-CE1 4.1Å; V236-F338 WeakPolarHBondContact O-CZ 3.25Å; V236-M350 HydrophobicContact CG2-CE 3.54Å; V236-M350 HydrophobicContact CG2-SD 4.06Å
237I91.7Very high89.2Confident35 Ų3552.4 Ų52.418%0.17931%0.309CS..Hα-helixtrans-62.5-44.8-179.7-66.4169.2000111.1V233 V234 G240 A241 L314 I315V233-I237 HydrophobicContact CG1-CD1 3.64Å; V233-I237 HydrophobicContact CG1-CG1 4.35Å; V233-I237 VanDerWaalsContact O-CG1 3.26Å; V233-I237 WeakPolarHBondContact O-CG1 3.42Å; V233-I237 PolarHBondContact O-N 3.26Å; V234-I237 PolarHBondContact O-N 3.24Å; I237-G240 PolarHBondContact O-N 2.85Å; I237-A241 WeakPolarHBondContact O-CB 3.5Å; I237-A241 PolarHBondContact O-N 2.83Å; I237-L314 HydrophobicContact CD1-CB 3.73Å; I237-L314 HydrophobicContact CD1-CD1 3.95Å; I237-L314 HydrophobicContact CG1-CB 3.76Å; I237-L314 HydrophobicContact CG2-CB 4.25Å; I237-L314 HydrophobicContact CG2-CD1 4.29Å; I237-I315 HydrophobicContact CG1-CG1 4.41Å
238C91.9Very high88.8Confident78 Ų7852.1 Ų52.153%0.52730%0.3SS..Hα-helixtrans-64.4-41.7177-70.60000111.9V234 V235 V236 A241 W242V234-C238 WeakPolarHBondContact O-CB 3.35Å; V234-C238 PolarHBondContact O-N 2.99Å; V234-C238 PolarHBondContact O-SG 3.47Å; V235-C238 PolarHBondContact O-N 3.06Å; V236-C238 PolarHBondContact O-N 3.3Å; C238-A241 PolarHBondContact O-N 3.29Å; C238-W242 WeakPolarHBondContact O-CB 3.41Å; C238-W242 PolarHBondContact O-N 3.22Å
239G89.1Confident88.5Confident10 Ų1053.5 Ų53.510%0.10330%0.304CS..Hα-helixtrans-62.3-42.2175.600000112.7V235 V236 W242 K243V235-G239 PolarHBondContact O-N 2.85Å; V236-G239 PolarHBondContact O-N 3.45Å; G239-W242 PolarHBondContact O-N 2.97Å; G239-K243 PolarHBondContact O-N 3.16Å
240G88.8Confident88Confident0 Ų060 Ų600%033%0.334CS..Hα-helixtrans-62.9-49.7173.100000112.2V236 I237 W242 K243 L244V236-G240 PolarHBondContact O-N 3.32Å; I237-G240 PolarHBondContact O-N 2.85Å; G240-W242 VanDerWaalsContact C-N 3.26Å; G240-W242 PolarHBondContact O-N 3.18Å; G240-K243 WeakPolarHBondContact O-CA 3.24Å; G240-K243 WeakPolarHBondContact O-CB 3.42Å; G240-K243 PolarHBondContact O-N 2.86Å; G240-L244 WeakPolarHBondContact O-CD1 3.38Å; G240-L244 PolarHBondContact O-N 2.76Å
241A90.8Very high87.5Confident44 Ų4460.1 Ų60.136%0.36433%0.334SS..Hα-helixtrans-56.8-40.2177.600000112.1I237 C238 K243 L244 M245I237-A241 WeakPolarHBondContact O-CB 3.5Å; I237-A241 PolarHBondContact O-N 2.83Å; C238-A241 PolarHBondContact O-N 3.29Å; A241-K243 PolarHBondContact O-N 3.01Å; A241-L244 PolarHBondContact O-N 2.79Å; A241-M245 WeakPolarHBondContact O-CG 3.46Å; A241-M245 PolarHBondContact O-N 3.39Å
242W91Very high86.9Confident129 Ų12957.7 Ų57.749%0.48932%0.317SS..Hα-helixtrans-61-42.1174.3-179.561.8000112.8C238 G239 G240 M245 Q246C238-W242 WeakPolarHBondContact O-CB 3.41Å; C238-W242 PolarHBondContact O-N 3.22Å; G239-W242 PolarHBondContact O-N 2.97Å; G240-W242 VanDerWaalsContact C-N 3.26Å; G240-W242 PolarHBondContact O-N 3.18Å; W242-M245 HydrophobicContact CB-CE 4.43Å; W242-M245 PolarHBondContact O-N 3.34Å; W242-Q246 WeakPolarHBondContact O-CG 3.35Å; W242-Q246 PolarHBondContact O-N 2.81Å
243K87.6Confident86.4Confident47 Ų4761.6 Ų61.620%0.20434%0.344CS..Hα-helixtrans-66.6-37174.3-75.2-69.6-178-176.80113.2G239 G240 A241 M245 Q246 N248 A321 I342G239-K243 PolarHBondContact O-N 3.16Å; G240-K243 WeakPolarHBondContact O-CA 3.24Å; G240-K243 WeakPolarHBondContact O-CB 3.42Å; G240-K243 PolarHBondContact O-N 2.86Å; A241-K243 PolarHBondContact O-N 3.01Å; K243-M245 VanDerWaalsContact C-N 3.35Å; K243-Q246 PolarHBondContact O-N 3.26Å; K243-N248 WeakPolarHBondContact O-CB 3.27Å; K243-N248 PolarHBondContact O-N 3.03Å; K243-A321 HydrophobicContact CB-CB 4.23Å; K243-I342 HydrophobicContact CG-CD1 4.05Å; K243-I342 HydrophobicContact CG-CG1 4.1Å
244L88.6Confident85.9Confident59 Ų5966 Ų6631%0.30937%0.367SS..Hα-helixtrans-62.6-42.5172-88.596.2000111.5G240 A241 Q246 G247 L252 I317 A321G240-L244 WeakPolarHBondContact O-CD1 3.38Å; G240-L244 PolarHBondContact O-N 2.76Å; A241-L244 PolarHBondContact O-N 2.79Å; L244-Q246 PolarHBondContact O-N 3.41Å; L244-G247 WeakPolarHBondContact O-CA 3.39Å; L244-G247 PolarHBondContact O-N 3.08Å; L244-L252 HydrophobicContact CD2-CD1 4.36Å; L244-I317 HydrophobicContact CD1-CG2 4.08Å; L244-I317 HydrophobicContact CD2-CG2 4.44Å; L244-A321 HydrophobicContact CD1-CB 3.32Å; L244-A321 HydrophobicContact CG-CB 4.16Å
245M88.5Confident85.3Confident150 Ų15063 Ų6374%0.73935%0.351SS*.Hα-helixtrans-64.3-26.1178.3-72.2-174.3-70.100113A241 W242 K243 G247A241-M245 WeakPolarHBondContact O-CG 3.46Å; A241-M245 PolarHBondContact O-N 3.39Å; W242-M245 HydrophobicContact CB-CE 4.43Å; W242-M245 PolarHBondContact O-N 3.34Å; K243-M245 VanDerWaalsContact C-N 3.35Å; M245-G247 PolarHBondContact O-N 3.13Å
246Q87.3Confident85.1Confident104 Ų10467.3 Ų67.349%0.48637%0.366SS..THydrogen-bonded Turntrans-73.3-2.2171.1-69.5175.55.300113.6W242 K243 L244W242-Q246 WeakPolarHBondContact O-CG 3.35Å; W242-Q246 PolarHBondContact O-N 2.81Å; K243-Q246 PolarHBondContact O-N 3.26Å; L244-Q246 PolarHBondContact O-N 3.41Å
247G83.4Confident84.5Confident48 Ų4872.9 Ų72.950%0.49540%0.396SS..THydrogen-bonded Turntrans87.913.6179.900000114.5L244 M245 T249L244-G247 WeakPolarHBondContact O-CA 3.39Å; L244-G247 PolarHBondContact O-N 3.08Å; M245-G247 PolarHBondContact O-N 3.13Å; G247-T249 PolarHBondContact O-N 2.91Å
248N81.6Confident83.8Confident46 Ų4672.7 Ų72.725%0.24640%0.403CS..  trans-80.860.3-179.4-156.926.7000112.9K243 A321K243-N248 WeakPolarHBondContact O-CB 3.27Å; K243-N248 PolarHBondContact O-N 3.03Å; N248-A321 PolarHBondContact ND2-O 2.89Å
249T82.3Confident83.2Confident70 Ų7073.9 Ų73.943%0.42941%0.409SS..  trans-98.85.8-17956.50000113.3G247 H251 L252 S253G247-T249 PolarHBondContact O-N 2.91Å; T249-H251 VanDerWaalsContact C-N 3.29Å; T249-H251 PolarHBondContact O-N 2.88Å; T249-L252 PolarHBondContact O-N 2.96Å; T249-S253 PolarHBondContact O-N 3.41Å
250Q79.4Confident82.6Confident139 Ų13982 Ų8265%0.6545%0.447SS*.Hα-helixtrans-58.3-39.3-172.3-59.2-177.78.200112.6L252Q250-L252 VanDerWaalsContact C-N 3.32Å; Q250-L252 PolarHBondContact O-N 2.94Å
251H78.8Confident82.3Confident55 Ų5583.1 Ų83.126%0.25545%0.454SS..Hα-helixtrans-77.2-16179.1-56.4-48.8000113.8T249 L320T249-H251 VanDerWaalsContact C-N 3.29Å; T249-H251 PolarHBondContact O-N 2.88Å; H251-L320 WeakPolarHBondContact CB-O 3.12Å; H251-L320 PolarHBondContact CD2-O 2.81Å
252L77.1Confident82.2Confident45 Ų4586.3 Ų86.324%0.23647%0.465CS..Hα-helixtrans-94.6-28.5177.7-71.7151.7000112F111 L244 T249 Q250 N254 A255F111-L252 HydrophobicContact CE2-CD2 4.4Å; L244-L252 HydrophobicContact CD2-CD1 4.36Å; T249-L252 PolarHBondContact O-N 2.96Å; Q250-L252 VanDerWaalsContact C-N 3.32Å; Q250-L252 PolarHBondContact O-N 2.94Å; L252-N254 VanDerWaalsContact C-N 3.26Å; L252-N254 PolarHBondContact O-N 3.15Å; L252-A255 WeakPolarHBondContact O-CB 3.2Å; L252-A255 PolarHBondContact O-N 2.65Å
253S77.1Confident82.2Confident95 Ų9586 Ų8666%0.66448%0.478SS*.Hα-helixtrans-62.9-30.5-177.4-174.60000113.6T249T249-S253 PolarHBondContact O-N 3.41Å
254N79Confident82.3Confident100 Ų10085.9 Ų85.954%0.53549%0.489SS..THydrogen-bonded Turntrans-110.436.9-178.9-74.6-33.6000111.6L252 F256 N257L252-N254 VanDerWaalsContact C-N 3.26Å; L252-N254 PolarHBondContact O-N 3.15Å; N254-F256 PolarHBondContact O-N 2.93Å; N254-F256 VanDerWaalsContact O-N 3.11Å; N254-N257 HydrophobicContact CB-CB 4.25Å; N254-N257 WeakPolarHBondContact CB-ND2 3.49Å; N254-N257 WeakPolarHBondContact O-CB 3.4Å; N254-N257 PolarHBondContact O-N 3.48Å; N254-N257 PolarHBondContact OD1-ND2 3.22Å
255A79.8Confident82.2Confident19 Ų1984 Ų8416%0.15748%0.482CS..THydrogen-bonded Turntrans-56.1-34.3-169.800000114.1S106 V107 G108 L252S106-A255 PolarHBondContact OG-O 2.98Å; V107-A255 HydrophobicContact CB-CB 4.42Å; V107-A255 HydrophobicContact CG1-CB 4.33Å; V107-A255 PolarHBondContact N-O 2.96Å; G108-A255 PolarHBondContact N-O 3.31Å; L252-A255 WeakPolarHBondContact O-CB 3.2Å; L252-A255 PolarHBondContact O-N 2.65Å
256F84.5Confident82.3Confident136 Ų13679.7 Ų79.760%0.59646%0.461SS*.THydrogen-bonded Turntrans-94.34.3-178.2-65.3-78.9000114.4I112 N254 G258I112-F256 HydrophobicContact CD1-CE1 3.97Å; I112-F256 HydrophobicContact CD1-CZ 4.3Å; N254-F256 PolarHBondContact O-N 2.93Å; N254-F256 VanDerWaalsContact O-N 3.11Å; F256-G258 PolarHBondContact O-N 2.95Å
257N76.9Confident82.5Confident121 Ų12176.9 Ų76.965%0.64746%0.456SS*.  trans-78.789.3174.7-73.6-14.6000109.4N254N254-N257 HydrophobicContact CB-CB 4.25Å; N254-N257 WeakPolarHBondContact CB-ND2 3.49Å; N254-N257 WeakPolarHBondContact O-CB 3.4Å; N254-N257 PolarHBondContact O-N 3.48Å; N254-N257 PolarHBondContact OD1-ND2 3.22Å
258G76.7Confident82.7Confident32 Ų3277 Ų7733%0.3345%0.447SS..SBendtrans-166.5160.6173.800000110.2G105 F256 M260G105-G258 WeakPolarHBondContact O-CA 3.46Å; F256-G258 PolarHBondContact O-N 2.95Å; G258-M260 PolarHBondContact O-N 3.27Å
259P78.3Confident83.1Confident102 Ų10274.8 Ų74.866%0.66244%0.435SS*.PPolyproline II helixtrans-60.5139.3174.826.1-32.3000109.8P261P259-P261 WeakPolarHBondContact O-CD 3.36Å
260M77.6Confident83.5Confident180 Ų18073.9 Ų73.989%0.88743%0.426SS*.PPolyproline II helixtrans-61.8120.5172.2-85.7-89.1-100.100109G258G258-M260 PolarHBondContact O-N 3.27Å
261P82Confident84Confident25 Ų2575.9 Ų75.916%0.16243%0.428CS..PPolyproline II helixtrans-68.6142.8-178.524.5-30.1000110.4V109 P259 A265 I266V109-P261 HydrophobicContact CG1-CG 4.01Å; P259-P261 WeakPolarHBondContact O-CD 3.36Å; P261-A265 HydrophobicContact CB-CB 4.02Å; P261-I266 HydrophobicContact CB-CG1 4.04Å; P261-I266 HydrophobicContact CG-CD1 4.25Å; P261-I266 HydrophobicContact CG-CG1 3.84Å
262N89.1Confident84.5Confident111 Ų11174 Ų7459%0.59442%0.42SS*.PPolyproline II helixtrans-69.7165.217370.822.5000110.6G264 A265 I266N262-G264 PolarHBondContact O-N 3.28Å; N262-G264 PolarHBondContact OD1-N 3.44Å; N262-A265 PolarHBondContact O-N 3.03Å; N262-A265 VanDerWaalsContact O-N 3.1Å; N262-A265 WeakPolarHBondContact OD1-CB 2.98Å; N262-A265 PolarHBondContact OD1-N 3.36Å; N262-I266 WeakPolarHBondContact O-CG1 3.38Å; N262-I266 PolarHBondContact O-N 3.48Å
263V90.3Very high85.1Confident123 Ų12371.8 Ų71.875%0.74541%0.409SS*.Hα-helixtrans-58.4-35.8-177.9179.50000112.1I266 A267V263-I266 PolarHBondContact O-N 3.06Å; V263-A267 WeakPolarHBondContact O-CB 3.46Å; V263-A267 PolarHBondContact O-N 3.46Å
264G89.4Confident85.8Confident43 Ų4370.5 Ų70.544%0.44339%0.394SS..Hα-helixtrans-67.2-38.617700000113.4N262 A267 T268N262-G264 PolarHBondContact O-N 3.28Å; N262-G264 PolarHBondContact OD1-N 3.44Å; G264-A267 PolarHBondContact O-N 2.93Å; G264-T268 WeakPolarHBondContact O-CG2 3.3Å; G264-T268 PolarHBondContact O-N 3.49Å; G264-T268 PolarHBondContact O-OG1 3.45Å; G264-T268 VanDerWaalsContact O-OG1 3.14Å
265A87.6Confident86.3Confident19 Ų1968.9 Ų68.916%0.15738%0.381CS..Hα-helixtrans-67.6-40.9176.200000110.6P261 N262 T268 A269P261-A265 HydrophobicContact CB-CB 4.02Å; N262-A265 PolarHBondContact O-N 3.03Å; N262-A265 VanDerWaalsContact O-N 3.1Å; N262-A265 WeakPolarHBondContact OD1-CB 2.98Å; N262-A265 PolarHBondContact OD1-N 3.36Å; A265-T268 PolarHBondContact O-N 3.43Å; A265-T268 PolarHBondContact O-OG1 3.18Å; A265-T268 VanDerWaalsContact O-OG1 3.12Å; A265-A269 VanDerWaalsContact O-CB 3.29Å; A265-A269 WeakPolarHBondContact O-CB 3.48Å; A265-A269 PolarHBondContact O-N 2.99Å
266I89.8Confident86.9Confident60 Ų6068 Ų6831%0.30837%0.374SS..Hα-helixtrans-61.1-47.9172.3-63.8170.2000110.5I113 P261 N262 V263 T268 A269 F270I113-I266 HydrophobicContact CD1-CG2 4.43Å; P261-I266 HydrophobicContact CB-CG1 4.04Å; P261-I266 HydrophobicContact CG-CD1 4.25Å; P261-I266 HydrophobicContact CG-CG1 3.84Å; N262-I266 WeakPolarHBondContact O-CG1 3.38Å; N262-I266 PolarHBondContact O-N 3.48Å; V263-I266 PolarHBondContact O-N 3.06Å; I266-T268 PolarHBondContact O-N 3.25Å; I266-A269 WeakPolarHBondContact O-CB 3.42Å; I266-A269 PolarHBondContact O-N 3.45Å; I266-F270 HydrophobicContact CG2-CD2 3.9Å; I266-F270 HydrophobicContact CG2-CE2 3.8Å; I266-F270 WeakPolarHBondContact O-CD2 3.48Å; I266-F270 PolarHBondContact O-N 3.36Å
267A91.2Very high87.3Confident46 Ų4661.6 Ų61.638%0.3835%0.345SS..Hα-helixtrans-59.9-44.3179.100000112.2V263 G264 A269 F270 Y271V263-A267 WeakPolarHBondContact O-CB 3.46Å; V263-A267 PolarHBondContact O-N 3.46Å; G264-A267 PolarHBondContact O-N 2.93Å; A267-A269 VanDerWaalsContact C-N 3.34Å; A267-F270 WeakPolarHBondContact O-CB 3.47Å; A267-F270 PolarHBondContact O-N 2.83Å; A267-Y271 VanDerWaalsContact O-CD2 3.23Å; A267-Y271 WeakPolarHBondContact O-CD2 3.45Å; A267-Y271 PolarHBondContact O-N 2.98Å; A267-Y271 VanDerWaalsContact O-N 3.17Å
268T87.6Confident87.9Confident49 Ų4957.4 Ų57.430%0.30132%0.323SS..Hα-helixtrans-71.3-27.7177.161.70000113.7R103 G264 A265 I266 Y271 T272R103-T268 VanDerWaalsContact CD-C 3.48Å; R103-T268 WeakPolarHBondContact CD-O 3.36Å; R103-T268 PolarHBondContact NH1-OG1 2.96Å; G264-T268 WeakPolarHBondContact O-CG2 3.3Å; G264-T268 PolarHBondContact O-N 3.49Å; G264-T268 PolarHBondContact O-OG1 3.45Å; G264-T268 VanDerWaalsContact O-OG1 3.14Å; A265-T268 PolarHBondContact O-N 3.43Å; A265-T268 PolarHBondContact O-OG1 3.18Å; A265-T268 VanDerWaalsContact O-OG1 3.12Å; I266-T268 PolarHBondContact O-N 3.25Å; T268-Y271 PolarHBondContact O-N 2.7Å; T268-T272 PolarHBondContact O-N 3.09Å; T268-T272 PolarHBondContact O-OG1 3.04Å; T268-T272 VanDerWaalsContact O-OG1 3.05Å
269A89.9Confident88.4Confident0 Ų056 Ų560%031%0.308CS..Hα-helixtrans-65.2-43.9169.400000110.4L100 R103 T104 I113 A265 I266 A267 Y271 T272 G273L100-A269 HydrophobicContact CD1-CB 3.79Å; L100-A269 WeakPolarHBondContact CD1-O 3.42Å; L100-A269 HydrophobicContact CG-CB 4.43Å; R103-A269 HydrophobicContact CB-CB 4.02Å; T104-A269 HydrophobicContact CG2-CB 4.12Å; I113-A269 HydrophobicContact CD1-CB 3.64Å; I113-A269 HydrophobicContact CG2-CB 4.38Å; A265-A269 VanDerWaalsContact O-CB 3.29Å; A265-A269 WeakPolarHBondContact O-CB 3.48Å; A265-A269 PolarHBondContact O-N 2.99Å; I266-A269 WeakPolarHBondContact O-CB 3.42Å; I266-A269 PolarHBondContact O-N 3.45Å; A267-A269 VanDerWaalsContact C-N 3.34Å; A269-Y271 VanDerWaalsContact C-N 3.31Å; A269-Y271 PolarHBondContact O-N 3.1Å; A269-T272 WeakPolarHBondContact O-CB 3.48Å; A269-T272 PolarHBondContact O-N 2.97Å; A269-G273 PolarHBondContact O-N 2.85Å
270F92.5Very high89Confident52 Ų5253.4 Ų53.423%0.22829%0.285CS..Hα-helixtrans-58.1-39.8173.2-88.5-78.5000112.8I113 A116 C117 L120 I266 A267 T272 G273 L274I113-F270 HydrophobicContact CG1-CE2 4.38Å; I113-F270 HydrophobicContact CG2-CD1 4.35Å; I113-F270 HydrophobicContact CG2-CD2 4.43Å; I113-F270 HydrophobicContact CG2-CE1 4.39Å; I113-F270 HydrophobicContact CG2-CE2 4.48Å; I113-F270 HydrophobicContact CG2-CG 4.36Å; I113-F270 HydrophobicContact CG2-CZ 4.46Å; A116-F270 HydrophobicContact CB-CE1 3.85Å; A116-F270 HydrophobicContact CB-CZ 3.89Å; C117-F270 VanDerWaalsContact SG-CD1 3.55Å; L120-F270 HydrophobicContact CD1-CD1 4.1Å; L120-F270 HydrophobicContact CD1-CE1 3.72Å; I266-F270 HydrophobicContact CG2-CD2 3.9Å; I266-F270 HydrophobicContact CG2-CE2 3.8Å; I266-F270 WeakPolarHBondContact O-CD2 3.48Å; I266-F270 PolarHBondContact O-N 3.36Å; A267-F270 WeakPolarHBondContact O-CB 3.47Å; A267-F270 PolarHBondContact O-N 2.83Å; F270-T272 VanDerWaalsContact C-N 3.31Å; F270-T272 PolarHBondContact O-N 3.3Å; F270-G273 PolarHBondContact O-N 3.12Å; F270-L274 VanDerWaalsContact O-CB 3.23Å; F270-L274 WeakPolarHBondContact O-CB 3.43Å; F270-L274 VanDerWaalsContact O-CG 3.22Å; F270-L274 WeakPolarHBondContact O-CG 3.45Å; F270-L274 PolarHBondContact O-N 2.76Å
271Y89.6Confident89.6Confident181 Ų18145.7 Ų45.771%0.7125%0.248SC*.Hα-helixtrans-59-42.7173.5-79.7-72.1000112.4A267 T268 A269 W275A267-Y271 VanDerWaalsContact O-CD2 3.23Å; A267-Y271 WeakPolarHBondContact O-CD2 3.45Å; A267-Y271 PolarHBondContact O-N 2.98Å; A267-Y271 VanDerWaalsContact O-N 3.17Å; T268-Y271 PolarHBondContact O-N 2.7Å; A269-Y271 VanDerWaalsContact C-N 3.31Å; A269-Y271 PolarHBondContact O-N 3.1Å; Y271-W275 WeakPolarHBondContact O-CB 3.34Å; Y271-W275 PolarHBondContact O-N 3.05Å
272T87.7Confident89.8Confident14 Ų1444.6 Ų44.69%0.08624%0.241CC..Hα-helixtrans-69.5-38.8179.8-51.40000111.9S96 L100 R103 T268 A269 F270S96-T272 WeakPolarHBondContact CB-O 3.37Å; S96-T272 PolarHBondContact OG-O 3.06Å; L100-T272 HydrophobicContact CD1-CG2 4.44Å; R103-T272 PolarHBondContact NE-OG1 3.37Å; R103-T272 VanDerWaalsContact NE-OG1 3.1Å; T268-T272 PolarHBondContact O-N 3.09Å; T268-T272 PolarHBondContact O-OG1 3.04Å; T268-T272 VanDerWaalsContact O-OG1 3.05Å; A269-T272 WeakPolarHBondContact O-CB 3.48Å; A269-T272 PolarHBondContact O-N 2.97Å; F270-T272 VanDerWaalsContact C-N 3.31Å; F270-T272 PolarHBondContact O-N 3.3Å
273G90.7Very high89.8Confident0 Ų039.4 Ų39.40%021%0.212CC..Hα-helixtrans-70.1-46.7176.300000112.3A269 F270 W275 A276 Y277A269-G273 PolarHBondContact O-N 2.85Å; F270-G273 PolarHBondContact O-N 3.12Å; G273-W275 VanDerWaalsContact C-N 3.28Å; G273-W275 PolarHBondContact O-N 2.71Å; G273-A276 WeakPolarHBondContact O-CB 3.23Å; G273-A276 PolarHBondContact O-N 3.42Å; G273-Y277 WeakPolarHBondContact O-CD2 3.45Å; G273-Y277 PolarHBondContact O-N 3.1Å
274L91.8Very high89.7Confident68 Ų6833.5 Ų33.536%0.35618%0.177SC..Hα-helixtrans-64.8-31.5178.7-71.9170.7000112.4C117 F270 A276 Y277 D278C117-L274 HydrophobicContact CB-CD2 4.23Å; F270-L274 VanDerWaalsContact O-CB 3.23Å; F270-L274 WeakPolarHBondContact O-CB 3.43Å; F270-L274 VanDerWaalsContact O-CG 3.22Å; F270-L274 WeakPolarHBondContact O-CG 3.45Å; F270-L274 PolarHBondContact O-N 2.76Å; L274-A276 VanDerWaalsContact C-N 3.26Å; L274-A276 PolarHBondContact O-N 3.36Å; L274-Y277 CarbonylContact O-C 3.53Å; L274-Y277 PolarHBondContact O-N 3.33Å; L274-Y277 VanDerWaalsContact O-N 3.13Å; L274-D278 PolarHBondContact O-N 2.96Å; L274-D278 VanDerWaalsContact O-N 3.12Å
275W90.2Very high89.5Confident65 Ų6531.7 Ų31.725%0.24616%0.157CC..Hα-helixtrans-56.7-40.5169.2171.1-106.5000112Q169 I172 I173 Y271 G273 Y277 D278Q169-W275 HydrophobicContact CG-CZ3 4.19Å; I172-W275 HydrophobicContact CB-CH2 3.87Å; I172-W275 HydrophobicContact CB-CZ2 3.88Å; I172-W275 HydrophobicContact CD1-CH2 3.93Å; I172-W275 HydrophobicContact CD1-CZ2 4.41Å; I172-W275 HydrophobicContact CD1-CZ3 4.2Å; I172-W275 HydrophobicContact CG2-CH2 3.82Å; I172-W275 HydrophobicContact CG2-CZ2 3.31Å; I173-W275 HydrophobicContact CG1-CH2 4.41Å; I173-W275 HydrophobicContact CG1-CZ2 4.33Å; Y271-W275 WeakPolarHBondContact O-CB 3.34Å; Y271-W275 PolarHBondContact O-N 3.05Å; G273-W275 VanDerWaalsContact C-N 3.28Å; G273-W275 PolarHBondContact O-N 2.71Å; W275-Y277 PolarHBondContact O-N 3.26Å; W275-D278 VanDerWaalsContact O-CB 3.28Å; W275-D278 WeakPolarHBondContact O-CB 3.46Å; W275-D278 PolarHBondContact O-N 2.92Å; W275-D278 VanDerWaalsContact O-N 3.16Å
276A90.9Very high89.3Confident1 Ų130.9 Ų30.91%0.00815%0.15CC..Hα-helixtrans-69.7-22.8178.600000114W114 G273 L274 Y312W114-A276 HydrophobicContact CH2-CB 3.33Å; W114-A276 HydrophobicContact CZ3-CB 3.47Å; W114-A276 VanDerWaalsContact CZ3-CB 3.47Å; G273-A276 WeakPolarHBondContact O-CB 3.23Å; G273-A276 PolarHBondContact O-N 3.42Å; L274-A276 VanDerWaalsContact C-N 3.26Å; L274-A276 PolarHBondContact O-N 3.36Å; A276-Y312 HydrophobicContact CB-CE2 4.1Å; A276-Y312 WeakPolarHBondContact O-CE2 3.22Å; A276-Y312 PolarHBondContact O-OH 2.86Å
277Y92.8Very high89Confident1 Ų128 Ų280%0.00414%0.135CC..THydrogen-bonded Turntrans-94.43.8173.8-72.3-86.1000113.3W114 C117 G118 S121 G273 L274 W275 W280 V308 T309 Y312W114-Y277 AromaticContact CE3-CE2 3.68Å; W114-Y277 HydrophobicContact CE3-CE2 3.68Å; W114-Y277 HydrophobicContact CZ3-CD2 4.41Å; W114-Y277 AromaticContact CZ3-CE2 3.89Å; W114-Y277 HydrophobicContact CZ3-CE2 3.89Å; W114-Y277 WeakPolarHBondContact O-CE2 3.21Å; W114-Y277 PolarHBondContact O-OH 3.14Å; C117-Y277 HydrophobicContact CB-CD2 3.66Å; C117-Y277 HydrophobicContact CB-CE2 3.6Å; G118-Y277 VanDerWaalsContact CA-CZ 3.45Å; S121-Y277 WeakPolarHBondContact OG-CB 3.3Å; G273-Y277 WeakPolarHBondContact O-CD2 3.45Å; G273-Y277 PolarHBondContact O-N 3.1Å; L274-Y277 CarbonylContact O-C 3.53Å; L274-Y277 PolarHBondContact O-N 3.33Å; L274-Y277 VanDerWaalsContact O-N 3.13Å; W275-Y277 PolarHBondContact O-N 3.26Å; Y277-W280 VanDerWaalsContact O-CD1 3.29Å; Y277-V308 HydrophobicContact CD1-CG1 4.39Å; Y277-V308 HydrophobicContact CE1-CG1 4.28Å; Y277-T309 WeakPolarHBondContact CE1-OG1 3.17Å; Y277-Y312 HydrophobicContact CD1-CD2 4.32Å; Y277-Y312 HydrophobicContact CD1-CE2 4.21Å; Y277-Y312 HydrophobicContact CD2-CD2 4.46Å; Y277-Y312 HydrophobicContact CD2-CE2 4.46Å; Y277-Y312 AromaticContact CE1-CD2 3.79Å; Y277-Y312 HydrophobicContact CE1-CD2 3.79Å; Y277-Y312 HydrophobicContact CE1-CE2 4.14Å; Y277-Y312 AromaticContact CE2-CD2 3.98Å; Y277-Y312 HydrophobicContact CE2-CD2 3.98Å; Y277-Y312 HydrophobicContact CE2-CE2 4.42Å; Y277-Y312 HydrophobicContact CG-CE2 4.37Å; Y277-Y312 AromaticContact CZ-CD2 3.62Å
278D90.1Very high88.5Confident34 Ų3427.6 Ų27.618%0.18213%0.125CC..THydrogen-bonded Turntrans-55.9140.6179.9-176.954.7000112.1M88 Q169 L274 W275M88-D278 WeakPolarHBondContact CA-O 3.49Å; Q169-D278 PolarHBondContact NE2-OD1 2.94Å; Q169-D278 VanDerWaalsContact NE2-OD1 3.17Å; Q169-D278 PolarHBondContact NE2-OD2 3.5Å; L274-D278 PolarHBondContact O-N 2.96Å; L274-D278 VanDerWaalsContact O-N 3.12Å; W275-D278 VanDerWaalsContact O-CB 3.28Å; W275-D278 WeakPolarHBondContact O-CB 3.46Å; W275-D278 PolarHBondContact O-N 2.92Å; W275-D278 VanDerWaalsContact O-N 3.16Å
279G88.1Confident88.3Confident1 Ų125.6 Ų25.61%0.0111%0.112CC..THydrogen-bonded Turntrans100.53.8-178.900000115.7T87 N281 N282T87-G279 PolarHBondContact OG1-O 3.05Å; G279-N281 PolarHBondContact O-N 3.26Å; G279-N282 WeakPolarHBondContact CA-ND2 3.32Å; G279-N282 WeakPolarHBondContact O-CB 3.4Å; G279-N282 PolarHBondContact O-N 3Å; G279-N282 VanDerWaalsContact O-N 3.16Å
280W91.2Very high88.2Confident49 Ų4925.8 Ų25.819%0.18611%0.113CC..THydrogen-bonded Turntrans-58.6-28.5170.757.9-99000113.1M88 A125 Y128 Y277 I305M88-W280 HydrophobicContact SD-CB 3.77Å; A125-W280 HydrophobicContact CB-CB 4.48Å; A125-W280 HydrophobicContact CB-CD2 4.48Å; A125-W280 HydrophobicContact CB-CE3 3.72Å; A125-W280 HydrophobicContact CB-CZ3 4.43Å; Y128-W280 HydrophobicContact CD1-CH2 4.28Å; Y128-W280 AromaticContact CD1-CZ3 3.87Å; Y128-W280 HydrophobicContact CD1-CZ3 3.87Å; Y128-W280 HydrophobicContact CD2-CH2 4.03Å; Y128-W280 AromaticContact CD2-CZ3 3.86Å; Y128-W280 HydrophobicContact CD2-CZ3 3.86Å; Y128-W280 HydrophobicContact CE1-CH2 4.15Å; Y128-W280 HydrophobicContact CE1-CZ3 4.2Å; Y128-W280 AromaticContact CE2-CH2 3.93Å; Y128-W280 HydrophobicContact CE2-CH2 3.93Å; Y128-W280 HydrophobicContact CE2-CZ3 4.22Å; Y128-W280 HydrophobicContact CG-CH2 4.22Å; Y128-W280 AromaticContact CG-CZ3 3.69Å; Y128-W280 HydrophobicContact CG-CZ3 3.69Å; Y277-W280 VanDerWaalsContact O-CD1 3.29Å; W280-I305 HydrophobicContact CB-CD1 3.93Å; W280-I305 HydrophobicContact CB-CG1 4.5Å
281N89.3Confident88Confident18 Ų1828.4 Ų28.410%0.09613%0.125CC..THydrogen-bonded Turntrans-88.2-8.7177.961-25.6000114.1Y128 E141 G279 L283 N284 Y285Y128-N281 HydrophobicContact CD1-CB 4.13Å; Y128-N281 HydrophobicContact CE1-CB 4.23Å; E141-N281 PolarHBondContact OE1-ND2 3.48Å; G279-N281 PolarHBondContact O-N 3.26Å; N281-L283 PolarHBondContact O-N 2.74Å; N281-L283 VanDerWaalsContact O-N 3.16Å; N281-N284 WeakPolarHBondContact O-CB 3.27Å; N281-N284 PolarHBondContact O-N 3.28Å; N281-Y285 WeakPolarHBondContact O-CD2 3.33Å
282N87.1Confident87.9Confident2 Ų224.8 Ų24.81%0.01112%0.118CC..G310 helixtrans-61.9-29-173.8-81.3-25.9000113.1T87 G279 N284 Y285 A368T87-N282 WeakPolarHBondContact CB-ND2 3.47Å; T87-N282 HydrophobicContact CG2-CB 4.32Å; T87-N282 WeakPolarHBondContact CG2-ND2 3.21Å; G279-N282 WeakPolarHBondContact CA-ND2 3.32Å; G279-N282 WeakPolarHBondContact O-CB 3.4Å; G279-N282 PolarHBondContact O-N 3Å; G279-N282 VanDerWaalsContact O-N 3.16Å; N282-N284 VanDerWaalsContact C-N 3.27Å; N282-N284 PolarHBondContact O-N 3.42Å; N282-Y285 PolarHBondContact O-N 3.37Å; N282-A368 HydrophobicContact CB-CB 4.16Å; N282-A368 WeakPolarHBondContact OD1-CB 3.41Å
283L87.3Confident87.9Confident1 Ų124.6 Ų24.61%0.00512%0.117CC..G310 helixtrans-66.6-29.2178.5-168.863.6000112.4L83 I84 N281 Y285 V286 I290 L297L83-L283 HydrophobicContact CD2-CD1 3.97Å; I84-L283 HydrophobicContact CD1-CB 3.94Å; I84-L283 HydrophobicContact CD1-CD2 3.44Å; I84-L283 VanDerWaalsContact CD1-CD2 3.44Å; I84-L283 HydrophobicContact CD1-CG 4.28Å; I84-L283 HydrophobicContact CG1-CB 3.78Å; I84-L283 HydrophobicContact CG1-CD2 3.94Å; I84-L283 HydrophobicContact CG1-CG 4.37Å; N281-L283 PolarHBondContact O-N 2.74Å; N281-L283 VanDerWaalsContact O-N 3.16Å; L283-Y285 VanDerWaalsContact C-N 3.27Å; L283-Y285 PolarHBondContact O-N 2.73Å; L283-V286 HydrophobicContact CD1-CG2 3.79Å; L283-V286 WeakPolarHBondContact O-CG2 3.38Å; L283-V286 PolarHBondContact O-N 3.48Å; L283-I290 HydrophobicContact CD1-CD1 3.71Å; L283-I290 HydrophobicContact CD1-CG1 4.44Å; L283-I290 HydrophobicContact CD2-CD1 4.33Å; L283-I290 HydrophobicContact CG-CD1 3.77Å; L283-L297 HydrophobicContact CB-CD1 4.22Å; L283-L297 HydrophobicContact CD2-CD1 3.71Å; L283-L297 HydrophobicContact CG-CD1 3.67Å
284N89.6Confident87.8Confident0 Ų028.4 Ų28.40%014%0.144CC..G310 helixtrans-67.1-28.7177.6-72.977.6000112.6Y128 A140 Y144 N281 N282 V286 T287Y128-N284 PolarHBondContact O-ND2 3.29Å; A140-N284 HydrophobicContact CB-CB 3.84Å; Y144-N284 PolarHBondContact OH-ND2 3.45Å; N281-N284 WeakPolarHBondContact O-CB 3.27Å; N281-N284 PolarHBondContact O-N 3.28Å; N282-N284 VanDerWaalsContact C-N 3.27Å; N282-N284 PolarHBondContact O-N 3.42Å; N284-V286 PolarHBondContact O-N 3.1Å; N284-T287 WeakPolarHBondContact CA-OG1 3.4Å; N284-T287 PolarHBondContact O-N 3.36Å; N284-T287 PolarHBondContact O-OG1 2.75Å
285Y85.2Confident87.7Confident5 Ų531.3 Ų31.32%0.0215%0.153CC..G310 helixtrans-69.5-20.3178-70-91.8000112.9S138 A140 E141 N281 N282 L283 A368 L372S138-Y285 PolarHBondContact OG-O 3.4Å; A140-Y285 HydrophobicContact CB-CD1 3.74Å; A140-Y285 HydrophobicContact CB-CD2 3.86Å; A140-Y285 HydrophobicContact CB-CE1 3.91Å; A140-Y285 HydrophobicContact CB-CE2 4.04Å; A140-Y285 HydrophobicContact CB-CG 3.74Å; E141-Y285 PolarHBondContact OE1-OH 3.22Å; E141-Y285 WeakPolarHBondContact OE2-CE1 3.35Å; E141-Y285 WeakPolarHBondContact OE2-CE2 2.9Å; E141-Y285 PolarHBondContact OE2-OH 3.37Å; N281-Y285 WeakPolarHBondContact O-CD2 3.33Å; N282-Y285 PolarHBondContact O-N 3.37Å; L283-Y285 VanDerWaalsContact C-N 3.27Å; L283-Y285 PolarHBondContact O-N 2.73Å; Y285-A368 HydrophobicContact CD2-CB 4.24Å; Y285-A368 HydrophobicContact CG-CB 4.17Å; Y285-L372 HydrophobicContact CD1-CB 4.04Å; Y285-L372 HydrophobicContact CE1-CB 3.92Å; Y285-L372 HydrophobicContact CE1-CD1 4.19Å; Y285-L372 HydrophobicContact CE1-CD2 4.25Å; Y285-L372 HydrophobicContact CE1-CG 4.34Å
286V82.9Confident87.8Confident1 Ų129.3 Ų29.31%0.00615%0.147CC..G310 helixtrans-109.717.2-175.6-58.30000112L75 L83 L283 N284 E288 E289 I290 F367L75-V286 HydrophobicContact CD1-CB 3.92Å; L75-V286 HydrophobicContact CD1-CG2 3.84Å; L83-V286 HydrophobicContact CD2-CG1 4.4Å; L83-V286 HydrophobicContact CD2-CG2 3.74Å; L283-V286 HydrophobicContact CD1-CG2 3.79Å; L283-V286 WeakPolarHBondContact O-CG2 3.38Å; L283-V286 PolarHBondContact O-N 3.48Å; N284-V286 PolarHBondContact O-N 3.1Å; V286-E288 VanDerWaalsContact C-N 3.29Å; V286-E288 PolarHBondContact O-N 3.21Å; V286-E289 PolarHBondContact O-N 3.43Å; V286-I290 HydrophobicContact CG2-CD1 4.46Å; V286-I290 PolarHBondContact O-N 3Å; V286-F367 HydrophobicContact CB-CE1 4.33Å; V286-F367 HydrophobicContact CG1-CD1 3.62Å; V286-F367 HydrophobicContact CG1-CE1 3.44Å; V286-F367 VanDerWaalsContact CG1-CE1 3.44Å
287T83.4Confident87.8Confident1 Ų129.3 Ų29.31%0.00615%0.147CC..G310 helixtrans-57.8-37.7-173.1-55.90000113.3G132 T136 N284 E289 I290 P293G132-T287 WeakPolarHBondContact O-CG2 3.28Å; T136-T287 HydrophobicContact CG2-CG2 4.32Å; N284-T287 WeakPolarHBondContact CA-OG1 3.4Å; N284-T287 PolarHBondContact O-N 3.36Å; N284-T287 PolarHBondContact O-OG1 2.75Å; T287-E289 PolarHBondContact O-N 3.37Å; T287-E289 VanDerWaalsContact O-N 3.16Å; T287-I290 PolarHBondContact O-N 2.81Å; T287-I290 VanDerWaalsContact O-N 3.11Å; T287-P293 HydrophobicContact CG2-CB 3.81Å
288E81.2Confident87.9Confident36 Ų3630.8 Ų30.817%0.16816%0.157CC..G310 helixtrans-59.5-26.2176.4-75.4-176-17300113.1R73 T136 S137 S138 V286R73-E288 VanDerWaalsContact CG-O 3.23Å; R73-E288 WeakPolarHBondContact CG-O 2.88Å; T136-E288 WeakPolarHBondContact O-CG 3.43Å; S137-E288 VanDerWaalsContact CA-OE1 3.29Å; S137-E288 WeakPolarHBondContact CA-OE1 3.31Å; S138-E288 VanDerWaalsContact CB-CD 3.44Å; S138-E288 VanDerWaalsContact N-CG 3.32Å; S138-E288 PolarHBondContact N-OE1 3.09Å; V286-E288 VanDerWaalsContact C-N 3.29Å; V286-E288 PolarHBondContact O-N 3.21Å
289E83.9Confident88.1Confident7 Ų735.7 Ų35.73%0.03317%0.173CC..G310 helixtrans-95.1-6.4-178.4-69.6172.9-12700113.3L71 R73 R74 L75 V286 T287 R371L71-E289 HydrophobicContact CB-CG 3.92Å; L71-E289 HydrophobicContact CD2-CG 4.48Å; R73-E289 CarbonylContact C-O 3.51Å; R73-E289 WeakPolarHBondContact CA-O 3.42Å; R74-E289 PolarHBondContact N-O 2.78Å; L75-E289 WeakPolarHBondContact CB-O 3.49Å; L75-E289 HydrophobicContact CD1-CB 3.77Å; L75-E289 HydrophobicContact CG-CB 4.07Å; L75-E289 PolarHBondContact N-O 2.86Å; V286-E289 PolarHBondContact O-N 3.43Å; T287-E289 PolarHBondContact O-N 3.37Å; T287-E289 VanDerWaalsContact O-N 3.16Å; E289-R371 IonicContact OE1-CZ 2.76Å; E289-R371 IonicContact OE1-NE 3.75Å; E289-R371 PolarHBondContact OE1-NE 3.02Å; E289-R371 IonicContact OE1-NH2 2.71Å; E289-R371 PolarHBondContact OE1-NH2 3.08Å; E289-R371 IonicContact OE2-CZ 2.66Å; E289-R371 IonicContact OE2-NE 3.97Å; E289-R371 IonicContact OE2-NH2 3.22Å; E289-R371 PolarHBondContact OE2-NH2 3.48Å
290I87.4Confident88.3Confident4 Ų435.7 Ų35.72%0.02117%0.173CC..BIsolated β-bridgetrans-77.6130178.4-61.7175000110.2L75 L283 V286 T287 N292 P293 N296 L297L75-I290 HydrophobicContact CB-CG1 4.36Å; L75-I290 HydrophobicContact CD1-CG1 4.43Å; L283-I290 HydrophobicContact CD1-CD1 3.71Å; L283-I290 HydrophobicContact CD1-CG1 4.44Å; L283-I290 HydrophobicContact CD2-CD1 4.33Å; L283-I290 HydrophobicContact CG-CD1 3.77Å; V286-I290 HydrophobicContact CG2-CD1 4.46Å; V286-I290 PolarHBondContact O-N 3Å; T287-I290 PolarHBondContact O-N 2.81Å; T287-I290 VanDerWaalsContact O-N 3.11Å; I290-N292 PolarHBondContact O-N 2.74Å; I290-P293 HydrophobicContact CB-CB 4.39Å; I290-P293 HydrophobicContact CG2-CB 4.39Å; I290-N296 HydrophobicContact CG2-CB 3.88Å; I290-L297 HydrophobicContact CD1-CD1 4Å
291K87.8Confident88.5Confident107 Ų10733.4 Ų33.447%0.46516%0.164SC..SBendtrans-68.4124.6168-67.3-179.8178.9-178.40108.5R73 L75 N296R73-K291 HydrophobicContact CB-CG 4.4Å; R73-K291 VanDerWaalsContact O-CE 3.26Å; R73-K291 WeakPolarHBondContact O-CE 3.48Å; R73-K291 WeakPolarHBondContact O-CG 3.46Å; L75-K291 WeakPolarHBondContact O-CB 3.49Å; L75-K291 PolarHBondContact O-N 3.47Å; K291-N296 WeakPolarHBondContact O-CB 3.14Å; K291-N296 PolarHBondContact O-ND2 3.34Å
292N87.9Confident88.8Confident105 Ų10537.2 Ų37.256%0.56118%0.183SC*.SBendtrans50.864.9-179.7-60.9-30.1000113.2I290 S294 K295 N296I290-N292 PolarHBondContact O-N 2.74Å; N292-S294 VanDerWaalsContact C-N 3.27Å; N292-S294 PolarHBondContact O-N 2.72Å; N292-K295 PolarHBondContact O-N 2.66Å; N292-K295 VanDerWaalsContact O-N 3.08Å; N292-N296 PolarHBondContact O-N 3.17Å
293P86.9Confident89.1Confident11 Ų1141.2 Ų41.27%0.07120%0.204CC..Hα-helixtrans-57.5-37.6-172.922.8-32.7000112.7T136 T287 I290 K295 N296 L297T136-P293 HydrophobicContact CG2-CB 4.44Å; T136-P293 HydrophobicContact CG2-CG 4.01Å; T287-P293 HydrophobicContact CG2-CB 3.81Å; I290-P293 HydrophobicContact CB-CB 4.39Å; I290-P293 HydrophobicContact CG2-CB 4.39Å; P293-K295 PolarHBondContact O-N 3.11Å; P293-N296 PolarHBondContact O-N 3.16Å; P293-L297 WeakPolarHBondContact O-CB 3.24Å; P293-L297 PolarHBondContact O-N 3.07Å
294S87.9Confident89.4Confident80 Ų8041.1 Ų41.156%0.55920%0.204SC*.Hα-helixtrans-56.1-25.9178.1580000115N292 P298N292-S294 VanDerWaalsContact C-N 3.27Å; N292-S294 PolarHBondContact O-N 2.72Å; S294-P298 WeakPolarHBondContact O-CG 3.47Å
295K90.6Very high89.7Confident129 Ų12941.1 Ų41.156%0.56120%0.204SC*.Hα-helixtrans-108.8-42.7177.8-64.7-175.8-178.8179.70112.1N292 P293 R299N292-K295 PolarHBondContact O-N 2.66Å; N292-K295 VanDerWaalsContact O-N 3.08Å; P293-K295 PolarHBondContact O-N 3.11Å; K295-R299 VanDerWaalsContact O-CB 3.3Å; K295-R299 WeakPolarHBondContact O-CB 3.49Å; K295-R299 VanDerWaalsContact O-CD 3.3Å; K295-R299 WeakPolarHBondContact O-CD 3.03Å; K295-R299 WeakPolarHBondContact O-CG 3.47Å; K295-R299 PolarHBondContact O-N 3.06Å
296N92.4Very high90.2Very high23 Ų2343.3 Ų43.312%0.12322%0.218CC..Hα-helixtrans-80.9-29.1-170.9-74.9-12.1000113.2L77 I290 K291 N292 P293 S300L77-N296 HydrophobicContact CD1-CB 4.48Å; I290-N296 HydrophobicContact CG2-CB 3.88Å; K291-N296 WeakPolarHBondContact O-CB 3.14Å; K291-N296 PolarHBondContact O-ND2 3.34Å; N292-N296 PolarHBondContact O-N 3.17Å; P293-N296 PolarHBondContact O-N 3.16Å; N296-S300 VanDerWaalsContact O-CB 3.3Å; N296-S300 WeakPolarHBondContact O-CB 3.41Å; N296-S300 PolarHBondContact O-N 3.25Å; N296-S300 PolarHBondContact O-OG 3.16Å
297L91.4Very high90.8Very high0 Ų046.3 Ų46.30%023%0.234CC..Hα-helixtrans-62.3-59174.2-178.969.9000111.5T133 L283 I290 P293 R299 S300 I301T133-L297 HydrophobicContact CG2-CD2 4.17Å; L283-L297 HydrophobicContact CB-CD1 4.22Å; L283-L297 HydrophobicContact CD2-CD1 3.71Å; L283-L297 HydrophobicContact CG-CD1 3.67Å; I290-L297 HydrophobicContact CD1-CD1 4Å; P293-L297 WeakPolarHBondContact O-CB 3.24Å; P293-L297 PolarHBondContact O-N 3.07Å; L297-R299 VanDerWaalsContact C-N 3.34Å; L297-R299 PolarHBondContact O-N 2.96Å; L297-S300 PolarHBondContact O-N 2.96Å; L297-I301 HydrophobicContact CD1-CD1 4.37Å; L297-I301 HydrophobicContact CG-CD1 4.37Å; L297-I301 PolarHBondContact O-N 3.05Å
298P93.4Very high91.3Very high33 Ų3346.2 Ų46.221%0.21423%0.234CC..Hα-helixtrans-64.6-37-17924.4-34.5000112.6A129 S294 S300 I301 I302A129-P298 HydrophobicContact CB-CB 4.44Å; S294-P298 WeakPolarHBondContact O-CG 3.47Å; P298-S300 VanDerWaalsContact C-N 3.34Å; P298-S300 PolarHBondContact O-N 3.44Å; P298-I301 PolarHBondContact O-N 3.1Å; P298-I302 WeakPolarHBondContact O-CG1 3.44Å; P298-I302 PolarHBondContact O-N 3.38Å
299R94.6Very high92Very high137 Ų13745.5 Ų45.552%0.51723%0.232SC..Hα-helixtrans-62.5-40175.5-74.5175.4179.3-173.1-4.5112.3L77 K295 L297 I301 I303L77-R299 HydrophobicContact CD1-CB 3.73Å; K295-R299 VanDerWaalsContact O-CB 3.3Å; K295-R299 WeakPolarHBondContact O-CB 3.49Å; K295-R299 VanDerWaalsContact O-CD 3.3Å; K295-R299 WeakPolarHBondContact O-CD 3.03Å; K295-R299 WeakPolarHBondContact O-CG 3.47Å; K295-R299 PolarHBondContact O-N 3.06Å; L297-R299 VanDerWaalsContact C-N 3.34Å; L297-R299 PolarHBondContact O-N 2.96Å; R299-I301 VanDerWaalsContact C-N 3.29Å; R299-I301 PolarHBondContact O-N 2.95Å; R299-I303 WeakPolarHBondContact O-CB 3.49Å; R299-I303 WeakPolarHBondContact O-CD1 3.26Å; R299-I303 VanDerWaalsContact O-CG1 3.23Å; R299-I303 WeakPolarHBondContact O-CG1 3.4Å; R299-I303 PolarHBondContact O-N 2.92Å; R299-I303 VanDerWaalsContact O-N 3.1Å
300S93.8Very high92.5Very high1 Ų150.1 Ų50.11%0.00726%0.256CS..Hα-helixtrans-63.9-38.5178.2-59.70000111.6N296 L297 P298 G304N296-S300 VanDerWaalsContact O-CB 3.3Å; N296-S300 WeakPolarHBondContact O-CB 3.41Å; N296-S300 PolarHBondContact O-N 3.25Å; N296-S300 PolarHBondContact O-OG 3.16Å; L297-S300 PolarHBondContact O-N 2.96Å; P298-S300 VanDerWaalsContact C-N 3.34Å; P298-S300 PolarHBondContact O-N 3.44Å; S300-G304 WeakPolarHBondContact O-CA 3.46Å; S300-G304 PolarHBondContact O-N 3.12Å
301I93.9Very high92.9Very high0 Ų050.5 Ų50.50%026%0.259CS..Hα-helixtrans-68.7-49.7179.2-71.1167.6000111.3I84 L122 A125 L126 A129 L297 P298 R299 I303 G304 I305I84-I301 HydrophobicContact CD1-CB 4.4Å; I84-I301 HydrophobicContact CD1-CG1 3.61Å; L122-I301 HydrophobicContact CD1-CG2 4.36Å; A125-I301 HydrophobicContact CB-CD1 4.42Å; A125-I301 HydrophobicContact CB-CG2 3.57Å; L126-I301 HydrophobicContact CD2-CG2 4.36Å; A129-I301 HydrophobicContact CB-CD1 3.69Å; L297-I301 HydrophobicContact CD1-CD1 4.37Å; L297-I301 HydrophobicContact CG-CD1 4.37Å; L297-I301 PolarHBondContact O-N 3.05Å; P298-I301 PolarHBondContact O-N 3.1Å; R299-I301 VanDerWaalsContact C-N 3.29Å; R299-I301 PolarHBondContact O-N 2.95Å; I301-I303 PolarHBondContact O-N 3.16Å; I301-G304 PolarHBondContact O-N 3.39Å; I301-I305 HydrophobicContact CG2-CD1 3.8Å; I301-I305 PolarHBondContact O-N 3.27Å
302I95.1Very high93.2Very high98 Ų9845.4 Ų45.450%0.50324%0.237SC..Hα-helixtrans-63.8-29.5-179.3-69.6164.6000112L126 P298 P306L126-I302 HydrophobicContact CD2-CD1 4.23Å; L126-I302 HydrophobicContact CD2-CG1 3.9Å; P298-I302 WeakPolarHBondContact O-CG1 3.44Å; P298-I302 PolarHBondContact O-N 3.38Å; I302-P306 WeakPolarHBondContact O-CD 3.48Å; I302-P306 WeakPolarHBondContact O-CG 3.28Å
303I95Very high93.4Very high86 Ų8641.1 Ų41.144%0.44122%0.216SC..Hα-helixtrans-84.8-47.6175.5-64.1167.3000110.6V81 R299 I301 L307V81-I303 HydrophobicContact CG1-CG2 4.13Å; V81-I303 HydrophobicContact CG2-CB 4.21Å; V81-I303 HydrophobicContact CG2-CG2 4.17Å; R299-I303 WeakPolarHBondContact O-CB 3.49Å; R299-I303 WeakPolarHBondContact O-CD1 3.26Å; R299-I303 VanDerWaalsContact O-CG1 3.23Å; R299-I303 WeakPolarHBondContact O-CG1 3.4Å; R299-I303 PolarHBondContact O-N 2.92Å; R299-I303 VanDerWaalsContact O-N 3.1Å; I301-I303 PolarHBondContact O-N 3.16Å; I303-L307 VanDerWaalsContact O-CB 3.26Å; I303-L307 WeakPolarHBondContact O-CB 3.47Å; I303-L307 PolarHBondContact O-N 3.27Å
304G93.8Very high93.8Very high0 Ų043.5 Ų43.50%023%0.228CC..Hα-helixtrans-71.3-47.8-16900000114S300 I301 L307 V308S300-G304 WeakPolarHBondContact O-CA 3.46Å; S300-G304 PolarHBondContact O-N 3.12Å; I301-G304 PolarHBondContact O-N 3.39Å; G304-L307 PolarHBondContact O-N 3Å; G304-V308 WeakPolarHBondContact O-CG2 3.12Å; G304-V308 PolarHBondContact O-N 3.05Å; G304-V308 VanDerWaalsContact O-N 3.1Å
305I95.3Very high94Very high0 Ų039.8 Ų39.80%020%0.201CC..Hα-helixtrans-68.5-49.8-174.8-61.1176.6000111.7I84 M88 L122 A125 W280 I301 L307 V308 T309I84-I305 HydrophobicContact CG2-CG1 4.31Å; M88-I305 HydrophobicContact CE-CB 4.29Å; M88-I305 HydrophobicContact CE-CG1 3.73Å; M88-I305 HydrophobicContact SD-CG1 4.03Å; L122-I305 HydrophobicContact CB-CG2 3.93Å; L122-I305 HydrophobicContact CD1-CB 4.2Å; L122-I305 HydrophobicContact CD1-CD1 4.46Å; L122-I305 HydrophobicContact CD1-CG2 4.41Å; A125-I305 HydrophobicContact CB-CD1 3.18Å; W280-I305 HydrophobicContact CB-CD1 3.93Å; W280-I305 HydrophobicContact CB-CG1 4.5Å; I301-I305 HydrophobicContact CG2-CD1 3.8Å; I301-I305 PolarHBondContact O-N 3.27Å; I305-L307 VanDerWaalsContact C-N 3.26Å; I305-L307 PolarHBondContact O-N 3.35Å; I305-V308 PolarHBondContact O-N 3.21Å; I305-V308 VanDerWaalsContact O-N 3.09Å; I305-T309 PolarHBondContact O-N 2.95Å; I305-T309 PolarHBondContact O-OG1 3.37Å; I305-T309 VanDerWaalsContact O-OG1 3.09Å
306P95.8Very high94Very high51 Ų5133.8 Ų33.833%0.33118%0.176SC..Hα-helixtrans-61-34.9177.7-26.438.9000113.1L122 I302 T309 L310L122-P306 HydrophobicContact CD1-CG 4.33Å; L122-P306 HydrophobicContact CD2-CG 4.28Å; I302-P306 WeakPolarHBondContact O-CD 3.48Å; I302-P306 WeakPolarHBondContact O-CG 3.28Å; P306-T309 PolarHBondContact O-N 3.33Å; P306-L310 WeakPolarHBondContact O-CB 3.34Å; P306-L310 PolarHBondContact O-N 2.79Å
307L94.6Very high94Very high63 Ų6335.3 Ų35.333%0.3318%0.183SC..Hα-helixtrans-60-47173.3177.365.8000111.2V85 I303 G304 I305 L310 C311V85-L307 HydrophobicContact CG2-CD2 4.09Å; I303-L307 VanDerWaalsContact O-CB 3.26Å; I303-L307 WeakPolarHBondContact O-CB 3.47Å; I303-L307 PolarHBondContact O-N 3.27Å; G304-L307 PolarHBondContact O-N 3Å; I305-L307 VanDerWaalsContact C-N 3.26Å; I305-L307 PolarHBondContact O-N 3.35Å; L307-L310 PolarHBondContact O-N 2.85Å; L307-C311 WeakPolarHBondContact O-CB 3.32Å; L307-C311 PolarHBondContact O-N 3.41Å; L307-C311 PolarHBondContact O-SG 3.41Å
308V95.3Very high94Very high0 Ų035.5 Ų35.50%018%0.184CC..Hα-helixtrans-64.1-45177.41730000111.4V85 M88 I89 Y277 G304 I305 L310 C311 Y312V85-V308 HydrophobicContact CB-CG2 4.35Å; V85-V308 HydrophobicContact CG1-CG2 4.17Å; V85-V308 HydrophobicContact CG2-CG2 4.17Å; M88-V308 HydrophobicContact CB-CG1 4.17Å; M88-V308 HydrophobicContact CB-CG2 4.3Å; M88-V308 HydrophobicContact CE-CB 3.9Å; M88-V308 HydrophobicContact CE-CG1 4.37Å; M88-V308 HydrophobicContact CE-CG2 3.53Å; I89-V308 HydrophobicContact CD1-CG2 4Å; I89-V308 HydrophobicContact CG1-CB 4.42Å; I89-V308 HydrophobicContact CG1-CG1 3.99Å; I89-V308 HydrophobicContact CG1-CG2 3.72Å; Y277-V308 HydrophobicContact CD1-CG1 4.39Å; Y277-V308 HydrophobicContact CE1-CG1 4.28Å; G304-V308 WeakPolarHBondContact O-CG2 3.12Å; G304-V308 PolarHBondContact O-N 3.05Å; G304-V308 VanDerWaalsContact O-N 3.1Å; I305-V308 PolarHBondContact O-N 3.21Å; I305-V308 VanDerWaalsContact O-N 3.09Å; V308-L310 VanDerWaalsContact C-N 3.3Å; V308-L310 PolarHBondContact O-N 3.26Å; V308-C311 WeakPolarHBondContact O-CB 3.23Å; V308-C311 PolarHBondContact O-N 2.85Å; V308-Y312 HydrophobicContact CG1-CD1 4.08Å; V308-Y312 HydrophobicContact CG1-CD2 3.92Å; V308-Y312 HydrophobicContact CG1-CE1 3.78Å; V308-Y312 HydrophobicContact CG1-CE2 3.61Å; V308-Y312 HydrophobicContact CG1-CG 4.17Å; V308-Y312 WeakPolarHBondContact O-CB 3.37Å; V308-Y312 PolarHBondContact O-N 3.11Å
309T95.3Very high93.9Very high21 Ų2134 Ų3413%0.12917%0.174CC..Hα-helixtrans-56.8-45.1176.5-56.20000111.5L115 Y277 I305 P306 Y312 A313L115-T309 HydrophobicContact CD2-CG2 4.17Å; Y277-T309 WeakPolarHBondContact CE1-OG1 3.17Å; I305-T309 PolarHBondContact O-N 2.95Å; I305-T309 PolarHBondContact O-OG1 3.37Å; I305-T309 VanDerWaalsContact O-OG1 3.09Å; P306-T309 PolarHBondContact O-N 3.33Å; T309-Y312 PolarHBondContact O-N 2.9Å; T309-A313 WeakPolarHBondContact O-CB 3.43Å; T309-A313 PolarHBondContact O-N 3.18Å
310L95.1Very high93.6Very high103 Ų10327.6 Ų27.654%0.53915%0.151SC..Hα-helixtrans-63.6-47.4176.8179.462.4000111.3P306 L307 V308 Y312 A313 L314P306-L310 WeakPolarHBondContact O-CB 3.34Å; P306-L310 PolarHBondContact O-N 2.79Å; L307-L310 PolarHBondContact O-N 2.85Å; V308-L310 VanDerWaalsContact C-N 3.3Å; V308-L310 PolarHBondContact O-N 3.26Å; L310-Y312 VanDerWaalsContact C-N 3.33Å; L310-Y312 PolarHBondContact O-N 3.02Å; L310-A313 PolarHBondContact O-N 3.45Å; L310-L314 HydrophobicContact CD1-CD1 3.99Å; L310-L314 HydrophobicContact CD1-CG 4.2Å; L310-L314 HydrophobicContact CG-CD1 3.97Å; L310-L314 VanDerWaalsContact O-CG 3.28Å; L310-L314 WeakPolarHBondContact O-CG 3.42Å; L310-L314 PolarHBondContact O-N 3.17Å
311C94.3Very high93.4Very high13 Ų1327.6 Ų27.69%0.08815%0.15CC..Hα-helixtrans-57.2-46.2176-74.30000111.7V233 L307 V308 L314 I315V233-C311 HydrophobicContact CG1-CB 3.91Å; L307-C311 WeakPolarHBondContact O-CB 3.32Å; L307-C311 PolarHBondContact O-N 3.41Å; L307-C311 PolarHBondContact O-SG 3.41Å; V308-C311 WeakPolarHBondContact O-CB 3.23Å; V308-C311 PolarHBondContact O-N 2.85Å; C311-L314 PolarHBondContact O-N 3.39Å; C311-I315 WeakPolarHBondContact O-CB 3.17Å; C311-I315 WeakPolarHBondContact O-CD1 3.46Å; C311-I315 WeakPolarHBondContact O-CG1 3.44Å; C311-I315 PolarHBondContact O-N 3.43Å
312Y94.4Very high93Very high0 Ų027.9 Ų27.90%015%0.153CC..Hα-helixtrans-64.5-42.5-180-74.21.3000112.4M88 I89 I93 W114 A276 Y277 V308 T309 L310 I315 N316M88-Y312 PolarHBondContact O-OH 3.32Å; I89-Y312 WeakPolarHBondContact CA-OH 3.32Å; I89-Y312 HydrophobicContact CB-CE1 4.45Å; I89-Y312 HydrophobicContact CG1-CE1 3.94Å; I89-Y312 HydrophobicContact CG2-CE1 4.43Å; I93-Y312 HydrophobicContact CB-CD1 4Å; I93-Y312 HydrophobicContact CB-CE1 3.51Å; I93-Y312 HydrophobicContact CD1-CD1 3.54Å; I93-Y312 HydrophobicContact CD1-CD2 4.28Å; I93-Y312 HydrophobicContact CD1-CE1 3.99Å; I93-Y312 HydrophobicContact CD1-CG 3.68Å; I93-Y312 HydrophobicContact CG1-CD1 3.57Å; I93-Y312 HydrophobicContact CG1-CE1 3.65Å; I93-Y312 HydrophobicContact CG1-CG 4.24Å; I93-Y312 HydrophobicContact CG2-CE1 4.06Å; W114-Y312 HydrophobicContact CE3-CD2 4.04Å; W114-Y312 HydrophobicContact CH2-CD2 4.38Å; W114-Y312 AromaticContact CZ3-CD2 3.48Å; W114-Y312 HydrophobicContact CZ3-CD2 3.48Å; W114-Y312 VanDerWaalsContact CZ3-CD2 3.48Å; W114-Y312 AromaticContact CZ3-CE2 3.99Å; W114-Y312 HydrophobicContact CZ3-CE2 3.99Å; W114-Y312 HydrophobicContact CZ3-CG 4.16Å; A276-Y312 HydrophobicContact CB-CE2 4.1Å; A276-Y312 WeakPolarHBondContact O-CE2 3.22Å; A276-Y312 PolarHBondContact O-OH 2.86Å; Y277-Y312 HydrophobicContact CD1-CD2 4.32Å; Y277-Y312 HydrophobicContact CD1-CE2 4.21Å; Y277-Y312 HydrophobicContact CD2-CD2 4.46Å; Y277-Y312 HydrophobicContact CD2-CE2 4.46Å; Y277-Y312 AromaticContact CE1-CD2 3.79Å; Y277-Y312 HydrophobicContact CE1-CD2 3.79Å; Y277-Y312 HydrophobicContact CE1-CE2 4.14Å; Y277-Y312 AromaticContact CE2-CD2 3.98Å; Y277-Y312 HydrophobicContact CE2-CD2 3.98Å; Y277-Y312 HydrophobicContact CE2-CE2 4.42Å; Y277-Y312 HydrophobicContact CG-CE2 4.37Å; Y277-Y312 AromaticContact CZ-CD2 3.62Å; V308-Y312 HydrophobicContact CG1-CD1 4.08Å; V308-Y312 HydrophobicContact CG1-CD2 3.92Å; V308-Y312 HydrophobicContact CG1-CE1 3.78Å; V308-Y312 HydrophobicContact CG1-CE2 3.61Å; V308-Y312 HydrophobicContact CG1-CG 4.17Å; V308-Y312 WeakPolarHBondContact O-CB 3.37Å; V308-Y312 PolarHBondContact O-N 3.11Å; T309-Y312 PolarHBondContact O-N 2.9Å; L310-Y312 VanDerWaalsContact C-N 3.33Å; L310-Y312 PolarHBondContact O-N 3.02Å; Y312-I315 HydrophobicContact CD1-CD1 4.45Å; Y312-I315 PolarHBondContact O-N 3.47Å; Y312-N316 PolarHBondContact O-N 3.33Å; Y312-N316 PolarHBondContact O-ND2 2.92Å
313A93.5Very high92.7Very high15 Ų1523.2 Ų23.212%0.12413%0.129CC..Hα-helixtrans-59.8-47.5174.600000111.1L115 T309 L310 I315 N316 I317L115-A313 HydrophobicContact CD2-CB 4.16Å; T309-A313 WeakPolarHBondContact O-CB 3.43Å; T309-A313 PolarHBondContact O-N 3.18Å; L310-A313 PolarHBondContact O-N 3.45Å; A313-I315 PolarHBondContact O-N 3.14Å; A313-N316 PolarHBondContact O-N 3.45Å; A313-I317 WeakPolarHBondContact O-CG1 3.29Å; A313-I317 PolarHBondContact O-N 3.46Å
314L93.8Very high92.4Very high60 Ų6020.7 Ų20.731%0.31412%0.119SC..Hα-helixtrans-67.5-36.3-179.3-66.4173.3000113I237 L310 C311 I317 S318I237-L314 HydrophobicContact CD1-CB 3.73Å; I237-L314 HydrophobicContact CD1-CD1 3.95Å; I237-L314 HydrophobicContact CG1-CB 3.76Å; I237-L314 HydrophobicContact CG2-CB 4.25Å; I237-L314 HydrophobicContact CG2-CD1 4.29Å; L310-L314 HydrophobicContact CD1-CD1 3.99Å; L310-L314 HydrophobicContact CD1-CG 4.2Å; L310-L314 HydrophobicContact CG-CD1 3.97Å; L310-L314 VanDerWaalsContact O-CG 3.28Å; L310-L314 WeakPolarHBondContact O-CG 3.42Å; L310-L314 PolarHBondContact O-N 3.17Å; C311-L314 PolarHBondContact O-N 3.39Å; L314-I317 PolarHBondContact O-N 3.29Å; L314-S318 WeakPolarHBondContact O-CB 3.3Å; L314-S318 PolarHBondContact O-N 3.33Å; L314-S318 PolarHBondContact O-OG 3.37Å
315I92.4Very high92Very high2 Ų222.5 Ų22.51%0.0113%0.131CC..Hα-helixtrans-63.2-46.8174.3-71.6162.9000110.5I93 V233 V236 I237 C311 Y312 A313 I317 S318 Y319I93-I315 HydrophobicContact CD1-CG2 4.29Å; I93-I315 HydrophobicContact CG1-CD1 3.86Å; I93-I315 HydrophobicContact CG1-CG2 4.1Å; V233-I315 HydrophobicContact CB-CD1 4.39Å; V233-I315 HydrophobicContact CG1-CD1 3.84Å; V233-I315 HydrophobicContact CG1-CG1 4.17Å; V233-I315 HydrophobicContact CG2-CD1 3.88Å; V236-I315 HydrophobicContact CG1-CG1 4.34Å; V236-I315 HydrophobicContact CG1-CG2 4.34Å; I237-I315 HydrophobicContact CG1-CG1 4.41Å; C311-I315 WeakPolarHBondContact O-CB 3.17Å; C311-I315 WeakPolarHBondContact O-CD1 3.46Å; C311-I315 WeakPolarHBondContact O-CG1 3.44Å; C311-I315 PolarHBondContact O-N 3.43Å; Y312-I315 HydrophobicContact CD1-CD1 4.45Å; Y312-I315 PolarHBondContact O-N 3.47Å; A313-I315 PolarHBondContact O-N 3.14Å; I315-I317 VanDerWaalsContact C-N 3.32Å; I315-I317 PolarHBondContact O-N 2.85Å; I315-S318 WeakPolarHBondContact O-CA 3.2Å; I315-S318 WeakPolarHBondContact O-CB 3.47Å; I315-S318 PolarHBondContact O-N 3.45Å; I315-Y319 HydrophobicContact CG2-CD1 4.47Å; I315-Y319 HydrophobicContact CG2-CD2 3.91Å; I315-Y319 HydrophobicContact CG2-CE1 3.99Å; I315-Y319 HydrophobicContact CG2-CE2 3.35Å; I315-Y319 HydrophobicContact CG2-CG 4.45Å; I315-Y319 PolarHBondContact O-N 3.28Å
316N91.8Very high91.6Very high3 Ų327.8 Ų27.82%0.01616%0.155CC..Hα-helixtrans-61.7-40.5178.4-81-78.9000111.6F111 W114 Y312 A313 S318 Y319 L320F111-N316 HydrophobicContact CD1-CB 4.42Å; F111-N316 HydrophobicContact CE1-CB 3.51Å; F111-N316 HydrophobicContact CZ-CB 3.79Å; W114-N316 PolarHBondContact NE1-ND2 3.02Å; W114-N316 PolarHBondContact NE1-OD1 3.46Å; Y312-N316 PolarHBondContact O-N 3.33Å; Y312-N316 PolarHBondContact O-ND2 2.92Å; A313-N316 PolarHBondContact O-N 3.45Å; N316-S318 VanDerWaalsContact C-N 3.29Å; N316-S318 PolarHBondContact O-N 3.22Å; N316-Y319 PolarHBondContact O-N 3.23Å; N316-L320 WeakPolarHBondContact O-CG 3.37Å; N316-L320 PolarHBondContact O-N 3.49Å; N316-L320 VanDerWaalsContact O-N 3.16Å
317I91.6Very high91.1Very high55 Ų5527.4 Ų27.428%0.28215%0.149SC..Hα-helixtrans-61.1-42.2173.3-66.6168.3000110.4F111 L244 A313 L314 I315 L320 A321F111-I317 HydrophobicContact CE1-CD1 4.43Å; F111-I317 HydrophobicContact CE1-CG1 3.58Å; F111-I317 HydrophobicContact CE2-CG1 4.46Å; F111-I317 HydrophobicContact CZ-CB 4.27Å; F111-I317 HydrophobicContact CZ-CG1 3.45Å; F111-I317 VanDerWaalsContact CZ-CG1 3.45Å; L244-I317 HydrophobicContact CD1-CG2 4.08Å; L244-I317 HydrophobicContact CD2-CG2 4.44Å; A313-I317 WeakPolarHBondContact O-CG1 3.29Å; A313-I317 PolarHBondContact O-N 3.46Å; L314-I317 PolarHBondContact O-N 3.29Å; I315-I317 VanDerWaalsContact C-N 3.32Å; I315-I317 PolarHBondContact O-N 2.85Å; I317-L320 PolarHBondContact O-N 3.21Å; I317-A321 WeakPolarHBondContact O-CB 3.12Å; I317-A321 PolarHBondContact O-N 2.99Å
318S91.8Very high90.6Very high4 Ų424.5 Ų24.53%0.02813%0.134CC..Hα-helixtrans-64.3-43.3-179.8-58.60000112.1L314 I315 N316 A321 A322 F338L314-S318 WeakPolarHBondContact O-CB 3.3Å; L314-S318 PolarHBondContact O-N 3.33Å; L314-S318 PolarHBondContact O-OG 3.37Å; I315-S318 WeakPolarHBondContact O-CA 3.2Å; I315-S318 WeakPolarHBondContact O-CB 3.47Å; I315-S318 PolarHBondContact O-N 3.45Å; N316-S318 VanDerWaalsContact C-N 3.29Å; N316-S318 PolarHBondContact O-N 3.22Å; S318-A321 PolarHBondContact O-N 3.08Å; S318-A322 PolarHBondContact O-N 2.95Å; S318-F338 WeakPolarHBondContact O-CE2 3.45Å
319Y90.1Very high90.1Very high1 Ų126.6 Ų26.60%0.00415%0.145CC..Hα-helixtrans-59.4-49.3175.4-66.8-23.2000111.3P97 V236 I315 N316 A321 A322 M323 M328 V334 F338P97-Y319 HydrophobicContact CB-CD2 4.46Å; P97-Y319 HydrophobicContact CG-CD2 4.36Å; P97-Y319 HydrophobicContact CG-CE2 4.16Å; V236-Y319 HydrophobicContact CG1-CD1 4.45Å; V236-Y319 HydrophobicContact CG1-CE1 3.97Å; I315-Y319 HydrophobicContact CG2-CD1 4.47Å; I315-Y319 HydrophobicContact CG2-CD2 3.91Å; I315-Y319 HydrophobicContact CG2-CE1 3.99Å; I315-Y319 HydrophobicContact CG2-CE2 3.35Å; I315-Y319 HydrophobicContact CG2-CG 4.45Å; I315-Y319 PolarHBondContact O-N 3.28Å; N316-Y319 PolarHBondContact O-N 3.23Å; Y319-A321 PolarHBondContact O-N 2.91Å; Y319-A322 PolarHBondContact O-N 3.32Å; Y319-M323 WeakPolarHBondContact O-CG 3.31Å; Y319-M323 PolarHBondContact O-N 3.32Å; Y319-M328 HydrophobicContact CD2-SD 4.13Å; Y319-M328 HydrophobicContact CG-SD 4.4Å; Y319-V334 HydrophobicContact CD1-CG1 4.37Å; Y319-V334 HydrophobicContact CD2-CG1 3.7Å; Y319-V334 HydrophobicContact CE2-CG1 3.87Å; Y319-V334 HydrophobicContact CG-CG1 3.98Å; Y319-F338 HydrophobicContact CD1-CB 4Å; Y319-F338 AromaticContact CD1-CD2 3.65Å; Y319-F338 HydrophobicContact CD1-CD2 3.65Å; Y319-F338 HydrophobicContact CD1-CE2 4.27Å; Y319-F338 AromaticContact CD1-CG 3.89Å; Y319-F338 HydrophobicContact CD1-CG 3.89Å; Y319-F338 HydrophobicContact CE1-CB 4.03Å; Y319-F338 HydrophobicContact CE1-CD2 4.22Å; Y319-F338 HydrophobicContact CE1-CG 4.03Å
320L89.2Confident89.5Confident4 Ų432.2 Ų32.22%0.02117%0.169CC..Hα-helixtrans-68.2-19.3-179.5-68.4164000114V107 F111 H251 N316 I317 P325 M328V107-L320 HydrophobicContact CG1-CD1 3.42Å; V107-L320 VanDerWaalsContact CG1-CD1 3.42Å; V107-L320 HydrophobicContact CG1-CD2 4.43Å; V107-L320 HydrophobicContact CG2-CD2 4.08Å; F111-L320 HydrophobicContact CD2-CD1 4.44Å; F111-L320 HydrophobicContact CE2-CD1 3.37Å; F111-L320 HydrophobicContact CZ-CD1 3.73Å; H251-L320 WeakPolarHBondContact CB-O 3.12Å; H251-L320 PolarHBondContact CD2-O 2.81Å; N316-L320 WeakPolarHBondContact O-CG 3.37Å; N316-L320 PolarHBondContact O-N 3.49Å; N316-L320 VanDerWaalsContact O-N 3.16Å; I317-L320 PolarHBondContact O-N 3.21Å; L320-P325 HydrophobicContact CD2-CG 4.12Å; L320-M328 HydrophobicContact CD2-CE 4.03Å; L320-M328 HydrophobicContact CG-CE 4.36Å
321A88.8Confident88.5Confident0 Ų028.1 Ų28.10%015%0.149CC..Hα-helixtrans-79.6-19.5171.300000113.4K243 L244 N248 I317 S318 Y319K243-A321 HydrophobicContact CB-CB 4.23Å; L244-A321 HydrophobicContact CD1-CB 3.32Å; L244-A321 HydrophobicContact CG-CB 4.16Å; N248-A321 PolarHBondContact ND2-O 2.89Å; I317-A321 WeakPolarHBondContact O-CB 3.12Å; I317-A321 PolarHBondContact O-N 2.99Å; S318-A321 PolarHBondContact O-N 3.08Å; Y319-A321 PolarHBondContact O-N 2.91Å
322A87.3Confident87.3Confident6 Ų632.5 Ų32.55%0.0517%0.169CC..Hα-helixtrans-100.7-32.2-177.600000113.3S318 Y319 F338 R341 I342S318-A322 PolarHBondContact O-N 2.95Å; Y319-A322 PolarHBondContact O-N 3.32Å; A322-F338 HydrophobicContact CB-CD2 3.5Å; A322-F338 HydrophobicContact CB-CE2 3.72Å; A322-R341 VanDerWaalsContact O-CD 3.28Å; A322-R341 WeakPolarHBondContact O-CD 3.45Å; A322-R341 PolarHBondContact O-NH1 2.9Å; A322-R341 VanDerWaalsContact O-NH1 3.08Å; A322-I342 HydrophobicContact CB-CD1 3.68Å; A322-I342 HydrophobicContact CB-CG1 4.44Å
323M87.4Confident86.4Confident0 Ų032.6 Ų32.60%017%0.169CC..SBendtrans-139.4159.6-174.965.7-173.87500112.1Y319 E327 M328 V334 T337 F338Y319-M323 WeakPolarHBondContact O-CG 3.31Å; Y319-M323 PolarHBondContact O-N 3.32Å; M323-E327 HydrophobicContact CB-CB 4.37Å; M323-E327 HydrophobicContact CB-CG 4.19Å; M323-E327 WeakPolarHBondContact CB-OE2 3.43Å; M323-M328 HydrophobicContact CG-CB 4.29Å; M323-M328 HydrophobicContact SD-CB 3.92Å; M323-M328 HydrophobicContact SD-CG 4.31Å; M323-V334 HydrophobicContact CE-CG1 4.4Å; M323-V334 HydrophobicContact SD-CG1 4.15Å; M323-T337 HydrophobicContact CE-CG2 3.96Å; M323-T337 HydrophobicContact SD-CG2 4.36Å; M323-F338 HydrophobicContact CE-CB 3.73Å
324S89.2Confident85.8Confident34 Ų3431.9 Ų31.924%0.23816%0.164CC..  trans-74.8157.4176.9740000111.5Q326 E327 M328S324-Q326 PolarHBondContact O-N 3.48Å; S324-E327 PolarHBondContact O-N 3.25Å; S324-E327 WeakPolarHBondContact OG-CB 3.26Å; S324-E327 PolarHBondContact OG-N 3.09Å; S324-M328 PolarHBondContact O-N 3.4Å
325P85.9Confident85.3Confident37 Ų3729 Ų2924%0.2415%0.149CC..Hα-helixtrans-56.4-37.2175-2635000113.1L101 V107 L320 M328 I329L101-P325 HydrophobicContact CD1-CB 4Å; V107-P325 HydrophobicContact CG2-CB 4.17Å; V107-P325 HydrophobicContact CG2-CG 3.7Å; L320-P325 HydrophobicContact CD2-CG 4.12Å; P325-M328 PolarHBondContact O-N 2.86Å; P325-I329 VanDerWaalsContact O-CG1 3.31Å; P325-I329 WeakPolarHBondContact O-CG1 3.48Å; P325-I329 PolarHBondContact O-N 3.27Å; P325-I329 VanDerWaalsContact O-N 3.16Å
326Q85.5Confident84.8Confident111 Ų11129.9 Ų29.952%0.51915%0.154SC..Hα-helixtrans-67-44.4179.3-171.365.418.600111.7S324 M328 I329 E330S324-Q326 PolarHBondContact O-N 3.48Å; Q326-M328 VanDerWaalsContact C-N 3.3Å; Q326-M328 PolarHBondContact O-N 3.09Å; Q326-I329 WeakPolarHBondContact O-CB 3.36Å; Q326-I329 PolarHBondContact O-N 3.03Å; Q326-I329 VanDerWaalsContact O-N 3.11Å; Q326-E330 WeakPolarHBondContact CG-OE1 3.42Å; Q326-E330 PolarHBondContact NE2-OE1 3.39Å; Q326-E330 WeakPolarHBondContact O-CG 3.22Å; Q326-E330 PolarHBondContact O-N 3.14Å
327E85.3Confident84.4Confident44 Ų4431.1 Ų31.121%0.20616%0.162CC..Hα-helixtrans-63.6-36.4175.8-177.5178.6-172.400112.1M323 S324 I329 E330 S331 R341M323-E327 HydrophobicContact CB-CB 4.37Å; M323-E327 HydrophobicContact CB-CG 4.19Å; M323-E327 WeakPolarHBondContact CB-OE2 3.43Å; S324-E327 PolarHBondContact O-N 3.25Å; S324-E327 WeakPolarHBondContact OG-CB 3.26Å; S324-E327 PolarHBondContact OG-N 3.09Å; E327-I329 VanDerWaalsContact C-N 3.27Å; E327-I329 PolarHBondContact O-N 3.34Å; E327-E330 PolarHBondContact O-N 3.22Å; E327-S331 VanDerWaalsContact O-CB 3.26Å; E327-S331 WeakPolarHBondContact O-CB 3.45Å; E327-S331 PolarHBondContact O-N 3.38Å; E327-R341 VanDerWaalsContact CD-CZ 3.44Å; E327-R341 IonicContact OE1-CZ 3Å; E327-R341 IonicContact OE1-NE 2.86Å; E327-R341 PolarHBondContact OE1-NE 2.53Å; E327-R341 IonicContact OE1-NH2 2.66Å; E327-R341 PolarHBondContact OE1-NH2 2.8Å; E327-R341 IonicContact OE2-CZ 3.06Å; E327-R341 IonicContact OE2-NE 3.6Å; E327-R341 IonicContact OE2-NH1 3.5Å; E327-R341 PolarHBondContact OE2-NH1 3.36Å; E327-R341 IonicContact OE2-NH2 2.78Å; E327-R341 PolarHBondContact OE2-NH2 3.17Å
328M84.6Confident84.1Confident1 Ų128.6 Ų28.61%0.00515%0.149CC..Hα-helixtrans-66.1-31174.6-173.2159.771.800112.4P97 S98 L101 Y319 L320 M323 S324 P325 Q326 V334P97-M328 HydrophobicContact CB-CE 4.19Å; P97-M328 HydrophobicContact CB-SD 3.94Å; S98-M328 WeakPolarHBondContact CB-O 3.44Å; S98-M328 PolarHBondContact OG-O 3.27Å; L101-M328 HydrophobicContact CD1-CB 4.45Å; L101-M328 HydrophobicContact CD1-CE 3.07Å; L101-M328 HydrophobicContact CG-CE 3.69Å; Y319-M328 HydrophobicContact CD2-SD 4.13Å; Y319-M328 HydrophobicContact CG-SD 4.4Å; L320-M328 HydrophobicContact CD2-CE 4.03Å; L320-M328 HydrophobicContact CG-CE 4.36Å; M323-M328 HydrophobicContact CG-CB 4.29Å; M323-M328 HydrophobicContact SD-CB 3.92Å; M323-M328 HydrophobicContact SD-CG 4.31Å; S324-M328 PolarHBondContact O-N 3.4Å; P325-M328 PolarHBondContact O-N 2.86Å; Q326-M328 VanDerWaalsContact C-N 3.3Å; Q326-M328 PolarHBondContact O-N 3.09Å; M328-V334 HydrophobicContact CG-CB 4.48Å; M328-V334 HydrophobicContact CG-CG1 3.71Å; M328-V334 HydrophobicContact CG-CG2 3.88Å; M328-V334 HydrophobicContact SD-CG1 3.75Å
329I84.8Confident83.8Confident45 Ų4528.4 Ų28.423%0.23115%0.147CC..Hα-helixtrans-73-41.7176.2-69.1167.6000111S98 L101 V102 P325 Q326 E327 S331S98-I329 WeakPolarHBondContact OG-CA 3.49Å; S98-I329 PolarHBondContact OG-O 3.06Å; L101-I329 HydrophobicContact CB-CD1 4.25Å; L101-I329 HydrophobicContact CB-CG1 4.11Å; L101-I329 HydrophobicContact CD1-CG1 4.5Å; V102-I329 HydrophobicContact CG2-CB 4.23Å; V102-I329 HydrophobicContact CG2-CD1 4.2Å; V102-I329 HydrophobicContact CG2-CG1 3.85Å; V102-I329 HydrophobicContact CG2-CG2 3.5Å; V102-I329 VanDerWaalsContact CG2-CG2 3.5Å; P325-I329 VanDerWaalsContact O-CG1 3.31Å; P325-I329 WeakPolarHBondContact O-CG1 3.48Å; P325-I329 PolarHBondContact O-N 3.27Å; P325-I329 VanDerWaalsContact O-N 3.16Å; Q326-I329 WeakPolarHBondContact O-CB 3.36Å; Q326-I329 PolarHBondContact O-N 3.03Å; Q326-I329 VanDerWaalsContact O-N 3.11Å; E327-I329 VanDerWaalsContact C-N 3.27Å; E327-I329 PolarHBondContact O-N 3.34Å; I329-S331 VanDerWaalsContact C-N 3.34Å
330E82.7Confident83.6Confident138 Ų13833.1 Ų33.165%0.64517%0.173SC*.Hα-helixtrans-75.4-23.4-177.6-70.7169.6-169.300113.1Q326 E327 E332Q326-E330 WeakPolarHBondContact CG-OE1 3.42Å; Q326-E330 PolarHBondContact NE2-OE1 3.39Å; Q326-E330 WeakPolarHBondContact O-CG 3.22Å; Q326-E330 PolarHBondContact O-N 3.14Å; E327-E330 PolarHBondContact O-N 3.22Å; E330-E332 PolarHBondContact O-N 3.17Å
331S74.5Confident83.3Confident17 Ų1739.1 Ų39.112%0.11920%0.195CC..  trans-77118.3-179.7177.30000112.2E327 I329 A333 V334 T337E327-S331 VanDerWaalsContact O-CB 3.26Å; E327-S331 WeakPolarHBondContact O-CB 3.45Å; E327-S331 PolarHBondContact O-N 3.38Å; I329-S331 VanDerWaalsContact C-N 3.34Å; S331-A333 VanDerWaalsContact C-N 3.32Å; S331-A333 PolarHBondContact O-N 2.82Å; S331-A333 VanDerWaalsContact OG-C 3.28Å; S331-A333 PolarHBondContact OG-O 3.23Å; S331-V334 PolarHBondContact OG-N 3.22Å; S331-T337 PolarHBondContact OG-OG1 3.41Å
332E69.1Low83.1Confident106 Ų10640.5 Ų40.550%0.49520%0.202SC..THydrogen-bonded Turntrans-63.3-38.1171.2-62.9-159.6163.100112.4Q179 E330Q179-E332 PolarHBondContact NE2-OE2 3.28Å; E330-E332 PolarHBondContact O-N 3.17Å
333A75.6Confident82.8Confident1 Ų142 Ų421%0.00821%0.209CC..THydrogen-bonded Turntrans-12077.5-179.500000112.4Y180 E183 S331 A335 V336 T337Y180-A333 HydrophobicContact CD1-CB 4.22Å; Y180-A333 HydrophobicContact CE1-CB 3.58Å; Y180-A333 WeakPolarHBondContact OH-CA 3.46Å; E183-A333 VanDerWaalsContact OE1-CB 3.31Å; E183-A333 WeakPolarHBondContact OE1-CB 3.25Å; E183-A333 VanDerWaalsContact OE2-CB 3.25Å; E183-A333 WeakPolarHBondContact OE2-CB 3.28Å; S331-A333 VanDerWaalsContact C-N 3.32Å; S331-A333 PolarHBondContact O-N 2.82Å; S331-A333 VanDerWaalsContact OG-C 3.28Å; S331-A333 PolarHBondContact OG-O 3.23Å; A333-A335 PolarHBondContact O-N 3.1Å; A333-V336 HydrophobicContact CB-CB 3.96Å; A333-V336 HydrophobicContact CB-CG2 3.88Å; A333-V336 PolarHBondContact O-N 3.47Å; A333-T337 PolarHBondContact O-N 3.44Å; A333-T337 VanDerWaalsContact O-N 3.1Å; A333-T337 PolarHBondContact O-OG1 3.07Å
334V80.8Confident82.5Confident1 Ų144.2 Ų44.21%0.00623%0.232CC..Hα-helixtrans-49.4-40.7-175.8-179.50000112.8Y319 M323 M328 S331 F338Y319-V334 HydrophobicContact CD1-CG1 4.37Å; Y319-V334 HydrophobicContact CD2-CG1 3.7Å; Y319-V334 HydrophobicContact CE2-CG1 3.87Å; Y319-V334 HydrophobicContact CG-CG1 3.98Å; M323-V334 HydrophobicContact CE-CG1 4.4Å; M323-V334 HydrophobicContact SD-CG1 4.15Å; M328-V334 HydrophobicContact CG-CB 4.48Å; M328-V334 HydrophobicContact CG-CG1 3.71Å; M328-V334 HydrophobicContact CG-CG2 3.88Å; M328-V334 HydrophobicContact SD-CG1 3.75Å; S331-V334 PolarHBondContact OG-N 3.22Å; V334-F338 WeakPolarHBondContact O-CB 3.39Å; V334-F338 PolarHBondContact O-N 3.11Å
335A82.6Confident81.9Confident0 Ų047.2 Ų47.20%026%0.258CS..Hα-helixtrans-68.2-35-179.900000113.6F94 Y180 A333 G339 M350 V354F94-A335 HydrophobicContact CD1-CB 3.68Å; F94-A335 HydrophobicContact CE1-CB 4.2Å; Y180-A335 HydrophobicContact CE1-CB 4.45Å; A333-A335 PolarHBondContact O-N 3.1Å; A335-G339 PolarHBondContact O-N 3.34Å; A335-M350 HydrophobicContact CB-CE 3.92Å; A335-M350 WeakPolarHBondContact O-CE 2.9Å; A335-V354 HydrophobicContact CB-CG2 3.9Å
336V82.1Confident81.7Confident19 Ų1950 Ų5012%0.11527%0.271CS..Hα-helixtrans-71.9-44.4178.1177.70000109.4Y180 A333 F338 G339 N340 P351Y180-V336 HydrophobicContact CD1-CG2 3.93Å; Y180-V336 HydrophobicContact CE1-CG2 4.03Å; A333-V336 HydrophobicContact CB-CB 3.96Å; A333-V336 HydrophobicContact CB-CG2 3.88Å; A333-V336 PolarHBondContact O-N 3.47Å; V336-F338 VanDerWaalsContact C-N 3.3Å; V336-F338 PolarHBondContact O-N 2.98Å; V336-G339 WeakPolarHBondContact O-CA 3.32Å; V336-G339 PolarHBondContact O-N 3.34Å; V336-N340 PolarHBondContact O-N 3.4Å; V336-N340 PolarHBondContact O-ND2 3.25Å; V336-P351 HydrophobicContact CG2-CB 4.12Å; V336-P351 HydrophobicContact CG2-CG 4.48Å
337T83.4Confident81.5Confident30 Ų3045.2 Ų45.218%0.18425%0.25CS..Hα-helixtrans-57.8-42174.6-56.60000111.9M323 S331 A333 N340 R341M323-T337 HydrophobicContact CE-CG2 3.96Å; M323-T337 HydrophobicContact SD-CG2 4.36Å; S331-T337 PolarHBondContact OG-OG1 3.41Å; A333-T337 PolarHBondContact O-N 3.44Å; A333-T337 VanDerWaalsContact O-N 3.1Å; A333-T337 PolarHBondContact O-OG1 3.07Å; T337-N340 PolarHBondContact O-N 3.48Å; T337-R341 PolarHBondContact O-N 3.39Å
338F86.6Confident81.2Confident2 Ų250.8 Ų50.81%0.00927%0.269CS..Hα-helixtrans-60.4-46.3172.2176.3-88.8000112.1V236 S318 Y319 A322 M323 V334 V336 N340 R341 I342 M350V236-F338 HydrophobicContact CB-CE1 4.16Å; V236-F338 HydrophobicContact CB-CZ 4.45Å; V236-F338 HydrophobicContact CG1-CD1 4.4Å; V236-F338 HydrophobicContact CG1-CE1 3.88Å; V236-F338 HydrophobicContact CG1-CE2 4.42Å; V236-F338 HydrophobicContact CG1-CZ 3.87Å; V236-F338 HydrophobicContact CG2-CD1 4.42Å; V236-F338 HydrophobicContact CG2-CE1 4.1Å; V236-F338 WeakPolarHBondContact O-CZ 3.25Å; S318-F338 WeakPolarHBondContact O-CE2 3.45Å; Y319-F338 HydrophobicContact CD1-CB 4Å; Y319-F338 AromaticContact CD1-CD2 3.65Å; Y319-F338 HydrophobicContact CD1-CD2 3.65Å; Y319-F338 HydrophobicContact CD1-CE2 4.27Å; Y319-F338 AromaticContact CD1-CG 3.89Å; Y319-F338 HydrophobicContact CD1-CG 3.89Å; Y319-F338 HydrophobicContact CE1-CB 4.03Å; Y319-F338 HydrophobicContact CE1-CD2 4.22Å; Y319-F338 HydrophobicContact CE1-CG 4.03Å; A322-F338 HydrophobicContact CB-CD2 3.5Å; A322-F338 HydrophobicContact CB-CE2 3.72Å; M323-F338 HydrophobicContact CE-CB 3.73Å; V334-F338 WeakPolarHBondContact O-CB 3.39Å; V334-F338 PolarHBondContact O-N 3.11Å; V336-F338 VanDerWaalsContact C-N 3.3Å; V336-F338 PolarHBondContact O-N 2.98Å; F338-N340 PolarHBondContact O-N 2.88Å; F338-R341 PolarHBondContact O-N 3Å; F338-I342 HydrophobicContact CD1-CD1 4.26Å; F338-I342 HydrophobicContact CD2-CD1 3.71Å; F338-I342 HydrophobicContact CE1-CD1 3.73Å; F338-I342 HydrophobicContact CE2-CD1 3.13Å; F338-I342 HydrophobicContact CG-CD1 4.25Å; F338-I342 HydrophobicContact CZ-CD1 3.14Å; F338-I342 HydrophobicContact CZ-CG1 4.48Å; F338-I342 PolarHBondContact O-N 3.26Å; F338-I342 VanDerWaalsContact O-N 3.13Å; F338-M350 HydrophobicContact CD1-CE 4.47Å
339G85.1Confident81.1Confident0 Ų053.4 Ų53.40%028%0.283CS..Hα-helixtrans-57.8-46.5177.400000113A335 V336 R341 I342 L343 G344 M350A335-G339 PolarHBondContact O-N 3.34Å; V336-G339 WeakPolarHBondContact O-CA 3.32Å; V336-G339 PolarHBondContact O-N 3.34Å; G339-R341 VanDerWaalsContact C-N 3.26Å; G339-R341 PolarHBondContact O-N 3.27Å; G339-I342 PolarHBondContact O-N 3.06Å; G339-L343 WeakPolarHBondContact O-CA 3.09Å; G339-L343 WeakPolarHBondContact O-CB 3.43Å; G339-L343 PolarHBondContact O-N 3.02Å; G339-G344 PolarHBondContact O-N 2.99Å; G339-M350 VanDerWaalsContact CA-CG 3.48Å
340N84.9Confident81.1Confident100 Ų10051.5 Ų51.554%0.53527%0.274SS..Hα-helixtrans-59.6-36.5178.3-72.4-27.2000112.1V336 T337 F338 A347V336-N340 PolarHBondContact O-N 3.4Å; V336-N340 PolarHBondContact O-ND2 3.25Å; T337-N340 PolarHBondContact O-N 3.48Å; F338-N340 PolarHBondContact O-N 2.88Å; N340-A347 WeakPolarHBondContact OD1-CB 3.27Å
341R83.6Confident81.2Confident130 Ų13045.4 Ų45.449%0.49125%0.246SC..Hα-helixtrans-78.4-31.7-179.6-74.7-168170.5-135.1-7.4115.1A322 E327 T337 F338 G339A322-R341 VanDerWaalsContact O-CD 3.28Å; A322-R341 WeakPolarHBondContact O-CD 3.45Å; A322-R341 PolarHBondContact O-NH1 2.9Å; A322-R341 VanDerWaalsContact O-NH1 3.08Å; E327-R341 VanDerWaalsContact CD-CZ 3.44Å; E327-R341 IonicContact OE1-CZ 3Å; E327-R341 IonicContact OE1-NE 2.86Å; E327-R341 PolarHBondContact OE1-NE 2.53Å; E327-R341 IonicContact OE1-NH2 2.66Å; E327-R341 PolarHBondContact OE1-NH2 2.8Å; E327-R341 IonicContact OE2-CZ 3.06Å; E327-R341 IonicContact OE2-NE 3.6Å; E327-R341 IonicContact OE2-NH1 3.5Å; E327-R341 PolarHBondContact OE2-NH1 3.36Å; E327-R341 IonicContact OE2-NH2 2.78Å; E327-R341 PolarHBondContact OE2-NH2 3.17Å; T337-R341 PolarHBondContact O-N 3.39Å; F338-R341 PolarHBondContact O-N 3Å; G339-R341 VanDerWaalsContact C-N 3.26Å; G339-R341 PolarHBondContact O-N 3.27Å
342I84.8Confident81.8Confident28 Ų2848.1 Ų48.114%0.14426%0.258CS..Hα-helixtrans-107.4-45.2-172.6-73.2163000112.5K243 A322 F338 G339K243-I342 HydrophobicContact CG-CD1 4.05Å; K243-I342 HydrophobicContact CG-CG1 4.1Å; A322-I342 HydrophobicContact CB-CD1 3.68Å; A322-I342 HydrophobicContact CB-CG1 4.44Å; F338-I342 HydrophobicContact CD1-CD1 4.26Å; F338-I342 HydrophobicContact CD2-CD1 3.71Å; F338-I342 HydrophobicContact CE1-CD1 3.73Å; F338-I342 HydrophobicContact CE2-CD1 3.13Å; F338-I342 HydrophobicContact CG-CD1 4.25Å; F338-I342 HydrophobicContact CZ-CD1 3.14Å; F338-I342 HydrophobicContact CZ-CG1 4.48Å; F338-I342 PolarHBondContact O-N 3.26Å; F338-I342 VanDerWaalsContact O-N 3.13Å; G339-I342 PolarHBondContact O-N 3.06Å
343L80.1Confident82.6Confident39 Ų3943.9 Ų43.920%0.20424%0.241CC..THydrogen-bonded Turntrans-90.6-18.4-169.7-66.3175.9000112.7V235 G339 A345 L346 M350V235-L343 HydrophobicContact CG1-CD1 4.33Å; V235-L343 HydrophobicContact CG1-CD2 4.31Å; G339-L343 WeakPolarHBondContact O-CA 3.09Å; G339-L343 WeakPolarHBondContact O-CB 3.43Å; G339-L343 PolarHBondContact O-N 3.02Å; L343-A345 PolarHBondContact O-N 3.34Å; L343-L346 HydrophobicContact CB-CB 3.99Å; L343-L346 PolarHBondContact O-N 3.3Å; L343-M350 HydrophobicContact CD1-CG 3.91Å; L343-M350 HydrophobicContact CD1-SD 3.93Å
344G81.6Confident83.2Confident46 Ų4643.9 Ų43.947%0.47424%0.24SC..G310 helixtrans53.2-107.5176.400000111.8G339 L346 A347G339-G344 PolarHBondContact O-N 2.99Å; G344-L346 PolarHBondContact O-N 3.28Å; G344-L346 VanDerWaalsContact O-N 3.15Å; G344-A347 WeakPolarHBondContact O-CB 3.31Å; G344-A347 PolarHBondContact O-N 3.49Å
345A77.4Confident83.6Confident96 Ų9644.6 Ų44.679%0.79325%0.245SC*.G310 helixtrans-59.1-23.817700000114.4L343L343-A345 PolarHBondContact O-N 3.34Å
346L80.8Confident83.9Confident96 Ų9646.6 Ų46.650%0.50326%0.255SS..G310 helixtrans-95.112.4176.9-64.3176.7000113L343 G344 W348 L349L343-L346 HydrophobicContact CB-CB 3.99Å; L343-L346 PolarHBondContact O-N 3.3Å; G344-L346 PolarHBondContact O-N 3.28Å; G344-L346 VanDerWaalsContact O-N 3.15Å; L346-W348 PolarHBondContact O-N 3.44Å; L346-L349 WeakPolarHBondContact O-CB 3.35Å; L346-L349 PolarHBondContact O-N 3.17Å
347A80.4Confident84.3Confident11 Ų1145.8 Ų45.89%0.09125%0.25CS..THydrogen-bonded Turntrans-59-30.1-178.700000113.6N340 G344 L349 M350 P351N340-A347 WeakPolarHBondContact OD1-CB 3.27Å; G344-A347 WeakPolarHBondContact O-CB 3.31Å; G344-A347 PolarHBondContact O-N 3.49Å; A347-L349 PolarHBondContact O-N 3.28Å; A347-L349 VanDerWaalsContact O-N 3.13Å; A347-M350 PolarHBondContact O-N 3.36Å; A347-M350 VanDerWaalsContact O-N 3.11Å; A347-P351 VanDerWaalsContact O-CD 3.22Å; A347-P351 WeakPolarHBondContact O-CD 3.46Å
348W81Confident84.7Confident160 Ų16044.3 Ų44.361%0.60624%0.242SC*.THydrogen-bonded Turntrans-60.9-20175.869.3-92.2000113.7L346 M350 P351 L352L346-W348 PolarHBondContact O-N 3.44Å; W348-M350 VanDerWaalsContact C-N 3.27Å; W348-M350 PolarHBondContact O-N 3.45Å; W348-P351 WeakPolarHBondContact O-CD 3.37Å; W348-P351 WeakPolarHBondContact O-CG 3.41Å; W348-L352 HydrophobicContact CE3-CD2 4.29Å; W348-L352 HydrophobicContact CZ3-CD2 3.66Å; W348-L352 PolarHBondContact O-N 3.47Å
349L82.3Confident84.9Confident57 Ų5745.3 Ų45.330%0.29825%0.246SC..Hα-helixtrans-68.1-28177.1-168.469000112.1L346 A347 S353L346-L349 WeakPolarHBondContact O-CB 3.35Å; L346-L349 PolarHBondContact O-N 3.17Å; A347-L349 PolarHBondContact O-N 3.28Å; A347-L349 VanDerWaalsContact O-N 3.13Å; L349-S353 VanDerWaalsContact O-CB 3.3Å; L349-S353 WeakPolarHBondContact O-CB 3.32Å; L349-S353 PolarHBondContact O-N 3.1Å; L349-S353 PolarHBondContact O-OG 3.34Å
350M84.3Confident85.1Confident5 Ų545.3 Ų45.33%0.02525%0.246CC..Hα-helixtrans-67.4-56.6-179.4-70.4-52.7-61.100113.2V236 A335 F338 G339 L343 A347 W348 L352 S353 V354V236-M350 HydrophobicContact CG2-CE 3.54Å; V236-M350 HydrophobicContact CG2-SD 4.06Å; A335-M350 HydrophobicContact CB-CE 3.92Å; A335-M350 WeakPolarHBondContact O-CE 2.9Å; F338-M350 HydrophobicContact CD1-CE 4.47Å; G339-M350 VanDerWaalsContact CA-CG 3.48Å; L343-M350 HydrophobicContact CD1-CG 3.91Å; L343-M350 HydrophobicContact CD1-SD 3.93Å; A347-M350 PolarHBondContact O-N 3.36Å; A347-M350 VanDerWaalsContact O-N 3.11Å; W348-M350 VanDerWaalsContact C-N 3.27Å; W348-M350 PolarHBondContact O-N 3.45Å; M350-L352 VanDerWaalsContact C-N 3.25Å; M350-L352 PolarHBondContact O-N 2.82Å; M350-S353 WeakPolarHBondContact O-CB 3.27Å; M350-S353 PolarHBondContact O-N 3.23Å; M350-V354 WeakPolarHBondContact O-CG2 3.19Å; M350-V354 PolarHBondContact O-N 2.64Å
351P84.4Confident85.4Confident10 Ų1040.8 Ų40.87%0.06522%0.222CC..Hα-helixtrans-62.1-33.8176.823.2-31.7000112.1A184 V336 A347 W348 S353 V354 T355A184-P351 HydrophobicContact CB-CB 3.89Å; A184-P351 HydrophobicContact CB-CG 3.99Å; V336-P351 HydrophobicContact CG2-CB 4.12Å; V336-P351 HydrophobicContact CG2-CG 4.48Å; A347-P351 VanDerWaalsContact O-CD 3.22Å; A347-P351 WeakPolarHBondContact O-CD 3.46Å; W348-P351 WeakPolarHBondContact O-CD 3.37Å; W348-P351 WeakPolarHBondContact O-CG 3.41Å; P351-S353 VanDerWaalsContact C-N 3.35Å; P351-S353 PolarHBondContact O-N 3.14Å; P351-V354 PolarHBondContact O-N 3.37Å; P351-T355 WeakPolarHBondContact O-CB 3.23Å; P351-T355 VanDerWaalsContact O-CG2 3.28Å; P351-T355 WeakPolarHBondContact O-CG2 3.42Å; P351-T355 PolarHBondContact O-N 3.32Å; P351-T355 PolarHBondContact O-OG1 3.14Å
352L86.8Confident85.8Confident73 Ų7334.7 Ų34.738%0.38220%0.199SC..Hα-helixtrans-61-43.3171.7179.561.2000112.1W348 M350 T355 I356W348-L352 HydrophobicContact CE3-CD2 4.29Å; W348-L352 HydrophobicContact CZ3-CD2 3.66Å; W348-L352 PolarHBondContact O-N 3.47Å; M350-L352 VanDerWaalsContact C-N 3.25Å; M350-L352 PolarHBondContact O-N 2.82Å; L352-T355 WeakPolarHBondContact CA-OG1 3.39Å; L352-T355 PolarHBondContact O-N 2.92Å; L352-T355 PolarHBondContact O-OG1 3.12Å; L352-I356 HydrophobicContact CD1-CD1 4.03Å; L352-I356 HydrophobicContact CD1-CG1 4.36Å; L352-I356 HydrophobicContact CG-CD1 3.96Å; L352-I356 WeakPolarHBondContact O-CD1 3.23Å; L352-I356 VanDerWaalsContact O-CG1 3.25Å; L352-I356 WeakPolarHBondContact O-CG1 3.4Å; L352-I356 PolarHBondContact O-N 3.16Å
353S86.6Confident86.1Confident18 Ų1833.4 Ų33.413%0.12619%0.193CC..Hα-helixtrans-66.1-40.1178.3-63.80000112.3A232 L349 M350 P351 I356 S357A232-S353 VanDerWaalsContact CB-CB 3.41Å; A232-S353 WeakPolarHBondContact CB-OG 3.44Å; L349-S353 VanDerWaalsContact O-CB 3.3Å; L349-S353 WeakPolarHBondContact O-CB 3.32Å; L349-S353 PolarHBondContact O-N 3.1Å; L349-S353 PolarHBondContact O-OG 3.34Å; M350-S353 WeakPolarHBondContact O-CB 3.27Å; M350-S353 PolarHBondContact O-N 3.23Å; P351-S353 VanDerWaalsContact C-N 3.35Å; P351-S353 PolarHBondContact O-N 3.14Å; S353-I356 PolarHBondContact O-N 3.47Å; S353-S357 WeakPolarHBondContact O-CB 3.4Å; S353-S357 PolarHBondContact O-N 3.31Å
354V87Confident86.4Confident0 Ų031.5 Ų31.50%018%0.183CC..Hα-helixtrans-65.3-44.1177176.20000111F94 Y180 A335 M350 P351 S357 T358F94-V354 HydrophobicContact CD1-CG2 3.82Å; F94-V354 HydrophobicContact CD2-CB 4.29Å; F94-V354 HydrophobicContact CD2-CG1 3.61Å; F94-V354 HydrophobicContact CD2-CG2 4.05Å; F94-V354 HydrophobicContact CE1-CG2 3.75Å; F94-V354 HydrophobicContact CE2-CB 4.2Å; F94-V354 HydrophobicContact CE2-CG1 3.92Å; F94-V354 HydrophobicContact CE2-CG2 3.98Å; F94-V354 HydrophobicContact CG-CG1 4.04Å; F94-V354 HydrophobicContact CG-CG2 3.95Å; F94-V354 HydrophobicContact CZ-CB 4.43Å; F94-V354 HydrophobicContact CZ-CG2 3.82Å; Y180-V354 HydrophobicContact CD1-CB 3.86Å; Y180-V354 HydrophobicContact CD1-CG1 3.52Å; Y180-V354 HydrophobicContact CD1-CG2 3.99Å; Y180-V354 HydrophobicContact CD2-CG1 3.76Å; Y180-V354 HydrophobicContact CE1-CB 4.33Å; Y180-V354 HydrophobicContact CE1-CG1 3.88Å; Y180-V354 HydrophobicContact CE1-CG2 4.04Å; Y180-V354 HydrophobicContact CE2-CG1 4.14Å; Y180-V354 HydrophobicContact CG-CB 4.15Å; Y180-V354 HydrophobicContact CG-CG1 3.43Å; Y180-V354 VanDerWaalsContact CG-CG1 3.43Å; A335-V354 HydrophobicContact CB-CG2 3.9Å; M350-V354 WeakPolarHBondContact O-CG2 3.19Å; M350-V354 PolarHBondContact O-N 2.64Å; P351-V354 PolarHBondContact O-N 3.37Å; V354-S357 WeakPolarHBondContact O-CB 3.48Å; V354-S357 PolarHBondContact O-N 3.24Å; V354-T358 HydrophobicContact CG1-CG2 4.27Å; V354-T358 WeakPolarHBondContact O-CG2 3.34Å; V354-T358 PolarHBondContact O-N 3.25Å; V354-T358 PolarHBondContact O-OG1 3.33Å
355T89.3Confident86.7Confident16 Ų1629.4 Ų29.410%0.09816%0.161CC..Hα-helixtrans-64.3-41177.950.70000111.9F177 A181 P351 L352 S357 T358 F359F177-T355 HydrophobicContact CD2-CG2 4.16Å; F177-T355 VanDerWaalsContact CD2-O 3.3Å; F177-T355 WeakPolarHBondContact CD2-O 3.38Å; F177-T355 HydrophobicContact CE2-CG2 4.13Å; A181-T355 HydrophobicContact CB-CG2 3.72Å; P351-T355 WeakPolarHBondContact O-CB 3.23Å; P351-T355 VanDerWaalsContact O-CG2 3.28Å; P351-T355 WeakPolarHBondContact O-CG2 3.42Å; P351-T355 PolarHBondContact O-N 3.32Å; P351-T355 PolarHBondContact O-OG1 3.14Å; L352-T355 WeakPolarHBondContact CA-OG1 3.39Å; L352-T355 PolarHBondContact O-N 2.92Å; L352-T355 PolarHBondContact O-OG1 3.12Å; T355-S357 PolarHBondContact O-N 3.39Å; T355-T358 WeakPolarHBondContact CA-OG1 3.36Å; T355-T358 PolarHBondContact O-OG1 2.94Å; T355-T358 VanDerWaalsContact O-OG1 3.09Å; T355-F359 VanDerWaalsContact O-CB 3.29Å; T355-F359 WeakPolarHBondContact O-CB 3.42Å; T355-F359 PolarHBondContact O-N 3.35Å
356I90Very high87.2Confident42 Ų4225.3 Ų25.322%0.21513%0.125CC..Hα-helixtrans-61-44172.3-69.9166.9000111.3F225 A228 L352 S353 G360F225-I356 HydrophobicContact CB-CG2 4.08Å; F225-I356 HydrophobicContact CD1-CG2 3.64Å; F225-I356 HydrophobicContact CE1-CG2 4.35Å; F225-I356 HydrophobicContact CG-CG2 4.07Å; A228-I356 HydrophobicContact CB-CG2 3.94Å; L352-I356 HydrophobicContact CD1-CD1 4.03Å; L352-I356 HydrophobicContact CD1-CG1 4.36Å; L352-I356 HydrophobicContact CG-CD1 3.96Å; L352-I356 WeakPolarHBondContact O-CD1 3.23Å; L352-I356 VanDerWaalsContact O-CG1 3.25Å; L352-I356 WeakPolarHBondContact O-CG1 3.4Å; L352-I356 PolarHBondContact O-N 3.16Å; S353-I356 PolarHBondContact O-N 3.47Å; I356-G360 PolarHBondContact O-N 2.94Å
357S91.1Very high87.3Confident2 Ų220.9 Ų20.91%0.01410%0.102CC..Hα-helixtrans-64.3-47.7-179.1-172.40000112.3I89 S353 V354 T355 G360 S361I89-S357 PolarHBondContact O-OG 2.72Å; I89-S357 VanDerWaalsContact O-OG 3.07Å; S353-S357 WeakPolarHBondContact O-CB 3.4Å; S353-S357 PolarHBondContact O-N 3.31Å; V354-S357 WeakPolarHBondContact O-CB 3.48Å; V354-S357 PolarHBondContact O-N 3.24Å; T355-S357 PolarHBondContact O-N 3.39Å; S357-G360 PolarHBondContact O-N 3.36Å; S357-S361 PolarHBondContact O-N 2.93Å
358T90.4Very high87.4Confident0 Ų020.4 Ų20.40%010%0.098CC..Hα-helixtrans-66.6-40.6179.547.90000112.1I173 F177 V354 T355 S361 A362I173-T358 VanDerWaalsContact CG2-O 3.24Å; I173-T358 WeakPolarHBondContact CG2-O 3.47Å; F177-T358 WeakPolarHBondContact CA-OG1 3.47Å; F177-T358 WeakPolarHBondContact CB-OG1 3.23Å; F177-T358 WeakPolarHBondContact CD2-OG1 3.48Å; V354-T358 HydrophobicContact CG1-CG2 4.27Å; V354-T358 WeakPolarHBondContact O-CG2 3.34Å; V354-T358 PolarHBondContact O-N 3.25Å; V354-T358 PolarHBondContact O-OG1 3.33Å; T355-T358 WeakPolarHBondContact CA-OG1 3.36Å; T355-T358 PolarHBondContact O-OG1 2.94Å; T355-T358 VanDerWaalsContact O-OG1 3.09Å; T358-S361 PolarHBondContact O-N 3.07Å; T358-A362 WeakPolarHBondContact O-CB 3.34Å; T358-A362 PolarHBondContact O-N 2.74Å
359F90.3Very high87.5Confident22 Ų2213 Ų1310%0.0967%0.071CC..Hα-helixtrans-62.1-43.7173.1-169-76000111.8F177 M206 I207 V221 F225 T355 A362 N363F177-F359 HydrophobicContact CD2-CB 4.23Å; F177-F359 HydrophobicContact CE2-CB 4.2Å; F177-F359 HydrophobicContact CE2-CD2 4.28Å; M206-F359 HydrophobicContact CG-CZ 4.34Å; M206-F359 HydrophobicContact SD-CE2 4.01Å; M206-F359 HydrophobicContact SD-CZ 4.13Å; I207-F359 HydrophobicContact CD1-CD1 4.49Å; I207-F359 HydrophobicContact CD1-CD2 4.04Å; I207-F359 HydrophobicContact CD1-CE1 4.44Å; I207-F359 HydrophobicContact CD1-CE2 3.99Å; I207-F359 HydrophobicContact CD1-CG 4.31Å; I207-F359 HydrophobicContact CD1-CZ 4.21Å; I207-F359 HydrophobicContact CG1-CD1 4.27Å; I207-F359 HydrophobicContact CG1-CD2 4.07Å; I207-F359 HydrophobicContact CG1-CE1 3.74Å; I207-F359 HydrophobicContact CG1-CE2 3.52Å; I207-F359 HydrophobicContact CG1-CG 4.42Å; I207-F359 HydrophobicContact CG1-CZ 3.35Å; V221-F359 HydrophobicContact CG1-CE1 4.46Å; F225-F359 AromaticContact CD2-CD1 3.83Å; F225-F359 HydrophobicContact CD2-CD1 3.83Å; F225-F359 HydrophobicContact CD2-CE1 4.4Å; F225-F359 AromaticContact CE2-CD1 3.28Å; F225-F359 HydrophobicContact CE2-CD1 3.28Å; F225-F359 AromaticContact CE2-CE1 3.58Å; F225-F359 HydrophobicContact CE2-CE1 3.58Å; F225-F359 HydrophobicContact CE2-CG 4.27Å; F225-F359 HydrophobicContact CZ-CD1 4.19Å; F225-F359 HydrophobicContact CZ-CE1 4.41Å; T355-F359 VanDerWaalsContact O-CB 3.29Å; T355-F359 WeakPolarHBondContact O-CB 3.42Å; T355-F359 PolarHBondContact O-N 3.35Å; F359-A362 PolarHBondContact O-N 3.17Å; F359-N363 WeakPolarHBondContact O-CB 3.46Å; F359-N363 PolarHBondContact O-N 3.41Å
360G90.1Very high87.4Confident0 Ų010.2 Ų10.20%06%0.057CC..Hα-helixtrans-63.6-40.1176.500000113.3Q222 I356 S357 G364Q222-G360 PolarHBondContact NE2-O 3.38Å; Q222-G360 PolarHBondContact OE1-O 2.89Å; I356-G360 PolarHBondContact O-N 2.94Å; S357-G360 PolarHBondContact O-N 3.36Å; G360-G364 PolarHBondContact O-N 3.13Å
361S91.4Very high87.2Confident6 Ų610.5 Ų10.54%0.0426%0.057CC..Hα-helixtrans-66.4-45.3175.61760000111.4G86 T87 S357 T358 N363 G364 T365G86-S361 WeakPolarHBondContact O-CA 3.47Å; T87-S361 PolarHBondContact O-OG 3.1Å; S357-S361 PolarHBondContact O-N 2.93Å; T358-S361 PolarHBondContact O-N 3.07Å; S361-N363 PolarHBondContact O-N 2.87Å; S361-G364 PolarHBondContact O-N 2.76Å; S361-T365 PolarHBondContact O-N 3.44Å; S361-T365 PolarHBondContact O-OG1 3.02Å
362A90.9Very high87.1Confident1 Ų110 Ų101%0.0085%0.054CC..Hα-helixtrans-56.8-48.1174.400000111.5M170 I173 I207 T358 F359 G364 T365 L366M170-A362 VanDerWaalsContact CE-C 3.43Å; M170-A362 HydrophobicContact CE-CB 3.75Å; M170-A362 WeakPolarHBondContact CE-O 3.12Å; M170-A362 HydrophobicContact SD-CB 3.68Å; I173-A362 HydrophobicContact CG2-CB 3.8Å; I207-A362 HydrophobicContact CD1-CB 3.56Å; T358-A362 WeakPolarHBondContact O-CB 3.34Å; T358-A362 PolarHBondContact O-N 2.74Å; F359-A362 PolarHBondContact O-N 3.17Å; A362-G364 PolarHBondContact O-N 2.71Å; A362-T365 PolarHBondContact O-N 3.25Å; A362-L366 PolarHBondContact O-N 3.21Å
363N90.9Very high86.8Confident1 Ų16.5 Ų6.51%0.0054%0.036CC..Hα-helixtrans-55.5-47.7177.2179.874000112.8I207 N211 G218 Q222 F359 S361 T365 L366 F367I207-N363 HydrophobicContact CG2-CB 4.16Å; N211-N363 PolarHBondContact ND2-OD1 2.89Å; G218-N363 PolarHBondContact O-ND2 3.14Å; Q222-N363 PolarHBondContact OE1-ND2 3.18Å; F359-N363 WeakPolarHBondContact O-CB 3.46Å; F359-N363 PolarHBondContact O-N 3.41Å; S361-N363 PolarHBondContact O-N 2.87Å; N363-T365 PolarHBondContact O-N 2.78Å; N363-L366 PolarHBondContact O-N 3.05Å; N363-F367 WeakPolarHBondContact O-CB 3.46Å; N363-F367 PolarHBondContact O-N 3.43Å
364G87.5Confident86.2Confident0 Ų06.1 Ų6.10%03%0.032CC..Hα-helixtrans-65.7-36.517800000113.3G360 S361 A362 F367 A368G360-G364 PolarHBondContact O-N 3.13Å; S361-G364 PolarHBondContact O-N 2.76Å; A362-G364 PolarHBondContact O-N 2.71Å; G364-F367 WeakPolarHBondContact O-CB 3.33Å; G364-F367 PolarHBondContact O-N 3.35Å; G364-A368 PolarHBondContact O-N 2.92Å; G364-A368 VanDerWaalsContact O-N 3.11Å
365T88.1Confident85.7Confident2 Ų26.1 Ų6.11%0.0123%0.032CC..Hα-helixtrans-66.4-42.1175.5-63.40000111.8Q169 S361 A362 N363 F367 A368 A369Q169-T365 HydrophobicContact CB-CG2 4.47Å; S361-T365 PolarHBondContact O-N 3.44Å; S361-T365 PolarHBondContact O-OG1 3.02Å; A362-T365 PolarHBondContact O-N 3.25Å; N363-T365 PolarHBondContact O-N 2.78Å; T365-F367 VanDerWaalsContact C-N 3.31Å; T365-F367 PolarHBondContact O-N 3.01Å; T365-A368 PolarHBondContact O-N 3.38Å; T365-A369 WeakPolarHBondContact O-CB 3.33Å; T365-A369 PolarHBondContact O-N 3.13Å
366L87Confident85.1Confident9 Ų95.3 Ų5.35%0.0473%0.027CC..Hα-helixtrans-64.2-40.2175.4-17059.9000111.5M170 I207 L208 N211 A362 N363 A368 A369 G370 L400M170-L366 HydrophobicContact CE-CB 3.54Å; M170-L366 HydrophobicContact CE-CD1 4.49Å; M170-L366 HydrophobicContact CE-CG 4.37Å; I207-L366 HydrophobicContact CG2-CB 4.26Å; I207-L366 HydrophobicContact CG2-CD2 3.72Å; L208-L366 HydrophobicContact CB-CD2 4.34Å; L208-L366 HydrophobicContact CD1-CD2 4.39Å; N211-L366 HydrophobicContact CB-CD2 4.23Å; A362-L366 PolarHBondContact O-N 3.21Å; N363-L366 PolarHBondContact O-N 3.05Å; L366-A368 VanDerWaalsContact C-N 3.32Å; L366-A368 PolarHBondContact O-N 3.43Å; L366-A369 PolarHBondContact O-N 3.31Å; L366-G370 PolarHBondContact O-N 3.48Å; L366-G370 VanDerWaalsContact O-N 3.1Å; L366-L400 HydrophobicContact CD1-CD2 3.76Å; L366-L400 HydrophobicContact CD2-CD2 4.31Å; L366-L400 HydrophobicContact CG-CD2 3.68Å
367F83.5Confident84.5Confident4 Ų43.3 Ų3.32%0.0182%0.017CC..Hα-helixtrans-57.5-45.4177.2-169.7-97.7000111.3V215 M219 V286 N363 G364 T365 R371V215-F367 HydrophobicContact CG1-CE2 3.71Å; V215-F367 HydrophobicContact CG1-CZ 3.93Å; M219-F367 HydrophobicContact CG-CE2 3.92Å; M219-F367 HydrophobicContact CG-CZ 3.73Å; M219-F367 HydrophobicContact SD-CD1 4.28Å; M219-F367 HydrophobicContact SD-CD2 4.48Å; M219-F367 HydrophobicContact SD-CE1 3.69Å; M219-F367 HydrophobicContact SD-CE2 3.91Å; M219-F367 HydrophobicContact SD-CZ 3.46Å; M219-F367 WeakPolarHBondContact SD-CZ 3.38Å; V286-F367 HydrophobicContact CB-CE1 4.33Å; V286-F367 HydrophobicContact CG1-CD1 3.62Å; V286-F367 HydrophobicContact CG1-CE1 3.44Å; V286-F367 VanDerWaalsContact CG1-CE1 3.44Å; N363-F367 WeakPolarHBondContact O-CB 3.46Å; N363-F367 PolarHBondContact O-N 3.43Å; G364-F367 WeakPolarHBondContact O-CB 3.33Å; G364-F367 PolarHBondContact O-N 3.35Å; T365-F367 VanDerWaalsContact C-N 3.31Å; T365-F367 PolarHBondContact O-N 3.01Å; F367-R371 VanDerWaalsContact CD2-NH1 3.3Å; F367-R371 VanDerWaalsContact CE1-NH1 3.28Å; F367-R371 VanDerWaalsContact CE2-NH2 3.3Å; F367-R371 PolarHBondContact O-NH1 2.89Å
368A83.1Confident83.6Confident1 Ų15 Ų51%0.0082%0.023CC..Hα-helixtrans-67.2-41.7175.200000112.6N282 Y285 G364 T365 L366 G370 R371 L372N282-A368 HydrophobicContact CB-CB 4.16Å; N282-A368 WeakPolarHBondContact OD1-CB 3.41Å; Y285-A368 HydrophobicContact CD2-CB 4.24Å; Y285-A368 HydrophobicContact CG-CB 4.17Å; G364-A368 PolarHBondContact O-N 2.92Å; G364-A368 VanDerWaalsContact O-N 3.11Å; T365-A368 PolarHBondContact O-N 3.38Å; L366-A368 VanDerWaalsContact C-N 3.32Å; L366-A368 PolarHBondContact O-N 3.43Å; A368-G370 PolarHBondContact O-N 3.03Å; A368-R371 PolarHBondContact O-N 2.88Å; A368-R371 VanDerWaalsContact O-N 3.14Å; A368-L372 PolarHBondContact O-N 3.41Å
369A82.8Confident82.8Confident3 Ų38.5 Ų8.53%0.0254%0.039CC..Hα-helixtrans-60.7-39.8-177.500000113.4K166 T365 L366 R371 L372 C373K166-A369 HydrophobicContact CB-CB 4.23Å; K166-A369 HydrophobicContact CD-CB 4.1Å; K166-A369 HydrophobicContact CG-CB 4.1Å; T365-A369 WeakPolarHBondContact O-CB 3.33Å; T365-A369 PolarHBondContact O-N 3.13Å; L366-A369 PolarHBondContact O-N 3.31Å; A369-R371 PolarHBondContact O-N 3.14Å; A369-L372 PolarHBondContact O-N 3.42Å; A369-C373 PolarHBondContact O-N 3.36Å
370G79.9Confident82.1Confident0 Ų09.9 Ų9.90%06%0.06CC..Hα-helixtrans-59.6-31.5177.200000113.7L366 A368 F374L366-G370 PolarHBondContact O-N 3.48Å; L366-G370 VanDerWaalsContact O-N 3.1Å; A368-G370 PolarHBondContact O-N 3.03Å; G370-F374 WeakPolarHBondContact O-CB 3.22Å; G370-F374 PolarHBondContact O-N 3.08Å; G370-F374 VanDerWaalsContact O-N 3.1Å
371R80.4Confident81.3Confident10 Ų1011.5 Ų11.54%0.0387%0.067CC..Hα-helixtrans-80.9-32.5-178.2-76.5159.2179.784.92.4113.6E289 F367 A368 A369 A375E289-R371 IonicContact OE1-CZ 2.76Å; E289-R371 IonicContact OE1-NE 3.75Å; E289-R371 PolarHBondContact OE1-NE 3.02Å; E289-R371 IonicContact OE1-NH2 2.71Å; E289-R371 PolarHBondContact OE1-NH2 3.08Å; E289-R371 IonicContact OE2-CZ 2.66Å; E289-R371 IonicContact OE2-NE 3.97Å; E289-R371 IonicContact OE2-NH2 3.22Å; E289-R371 PolarHBondContact OE2-NH2 3.48Å; F367-R371 VanDerWaalsContact CD2-NH1 3.3Å; F367-R371 VanDerWaalsContact CE1-NH1 3.28Å; F367-R371 VanDerWaalsContact CE2-NH2 3.3Å; F367-R371 PolarHBondContact O-NH1 2.89Å; A368-R371 PolarHBondContact O-N 2.88Å; A368-R371 VanDerWaalsContact O-N 3.14Å; A369-R371 PolarHBondContact O-N 3.14Å; R371-A375 WeakPolarHBondContact O-CB 3.36Å; R371-A375 PolarHBondContact O-N 2.71Å
372L82.4Confident80.4Confident0 Ų012.4 Ų12.40%07%0.072CC..Hα-helixtrans-60.6-50169.2175.960.7000110.6W142 F157 Y285 A368 A369 F374 A375 A376W142-L372 HydrophobicContact CB-CD1 3.75Å; F157-L372 HydrophobicContact CE1-CD1 3.99Å; Y285-L372 HydrophobicContact CD1-CB 4.04Å; Y285-L372 HydrophobicContact CE1-CB 3.92Å; Y285-L372 HydrophobicContact CE1-CD1 4.19Å; Y285-L372 HydrophobicContact CE1-CD2 4.25Å; Y285-L372 HydrophobicContact CE1-CG 4.34Å; A368-L372 PolarHBondContact O-N 3.41Å; A369-L372 PolarHBondContact O-N 3.42Å; L372-F374 VanDerWaalsContact C-N 3.33Å; L372-F374 PolarHBondContact O-N 3.06Å; L372-A375 PolarHBondContact O-N 3.2Å; L372-A376 WeakPolarHBondContact O-CB 3.18Å; L372-A376 PolarHBondContact O-N 3.1Å
373C79.1Confident79.6Confident0 Ų018 Ų180%010%0.101CC..Hα-helixtrans-59.9-44.9178.1-73.10000111.7A369 S377 H403A369-C373 PolarHBondContact O-N 3.36Å; C373-S377 VanDerWaalsContact O-CB 3.3Å; C373-S377 WeakPolarHBondContact O-CB 3.43Å; C373-S377 PolarHBondContact O-N 3.43Å; C373-S377 PolarHBondContact O-OG 2.62Å; C373-H403 PolarHBondContact SG-NE2 3.18Å
374F75.1Confident78.5Confident9 Ų922.3 Ų22.34%0.03912%0.124CC..Hα-helixtrans-61-45.6178.8174.2-106.8000112.5V5 L71 G370 L372 S377 R378 S387 V389 P396V5-F374 HydrophobicContact CB-CE2 4.18Å; V5-F374 HydrophobicContact CB-CZ 4.05Å; V5-F374 HydrophobicContact CG1-CZ 4.2Å; V5-F374 HydrophobicContact CG2-CE2 4.01Å; V5-F374 HydrophobicContact CG2-CZ 3.94Å; L71-F374 HydrophobicContact CD1-CD1 4.37Å; L71-F374 HydrophobicContact CD1-CE1 4.08Å; G370-F374 WeakPolarHBondContact O-CB 3.22Å; G370-F374 PolarHBondContact O-N 3.08Å; G370-F374 VanDerWaalsContact O-N 3.1Å; L372-F374 VanDerWaalsContact C-N 3.33Å; L372-F374 PolarHBondContact O-N 3.06Å; F374-S377 PolarHBondContact O-OG 3.04Å; F374-S377 VanDerWaalsContact O-OG 3.1Å; F374-R378 PolarHBondContact O-N 3.36Å; F374-S387 WeakPolarHBondContact CD2-O 3.37Å; F374-S387 VanDerWaalsContact CE2-O 3.27Å; F374-S387 WeakPolarHBondContact CE2-O 3.13Å; F374-V389 HydrophobicContact CD2-CG2 3.72Å; F374-V389 HydrophobicContact CE2-CG2 3.34Å; F374-V389 HydrophobicContact CZ-CG2 4.09Å; F374-P396 HydrophobicContact CB-CB 4.33Å
375A77.3Confident77.5Confident0 Ų027.8 Ų27.80%015%0.152CC..Hα-helixtrans-66.4-48-179.900000112.5S138 W142 R371 L372 S377 R378S138-A375 WeakPolarHBondContact O-CB 3.07Å; W142-A375 HydrophobicContact CE3-CB 4.11Å; W142-A375 HydrophobicContact CZ3-CB 4.48Å; R371-A375 WeakPolarHBondContact O-CB 3.36Å; R371-A375 PolarHBondContact O-N 2.71Å; L372-A375 PolarHBondContact O-N 3.2Å; A375-S377 VanDerWaalsContact C-N 3.33Å; A375-S377 PolarHBondContact O-N 3.48Å; A375-R378 PolarHBondContact O-N 3.43Å
376A76.3Confident76.5Confident0 Ų028.1 Ų28.10%015%0.154CC..Hα-helixtrans-70.1-28.8-177.400000113.4W142 S158 L372 H381 L382W142-A376 HydrophobicContact CD2-CB 4.25Å; W142-A376 HydrophobicContact CG-CB 4.2Å; S158-A376 VanDerWaalsContact OG-CB 3.26Å; S158-A376 WeakPolarHBondContact OG-CB 3.41Å; L372-A376 WeakPolarHBondContact O-CB 3.18Å; L372-A376 PolarHBondContact O-N 3.1Å; A376-H381 WeakPolarHBondContact O-CB 3.27Å; A376-H381 PolarHBondContact O-N 2.91Å; A376-L382 HydrophobicContact CB-CD1 3.72Å; A376-L382 HydrophobicContact CB-CG 4.05Å; A376-L382 PolarHBondContact O-N 3.49Å
377S76.1Confident75.4Confident0 Ų027.7 Ų27.70%015%0.151CC..Hα-helixtrans-78-28.1175.753.20000113.2C373 F374 A375 E379 G380 L386 S387C373-S377 VanDerWaalsContact O-CB 3.3Å; C373-S377 WeakPolarHBondContact O-CB 3.43Å; C373-S377 PolarHBondContact O-N 3.43Å; C373-S377 PolarHBondContact O-OG 2.62Å; F374-S377 PolarHBondContact O-OG 3.04Å; F374-S377 VanDerWaalsContact O-OG 3.1Å; A375-S377 VanDerWaalsContact C-N 3.33Å; A375-S377 PolarHBondContact O-N 3.48Å; S377-E379 PolarHBondContact O-N 3.1Å; S377-G380 PolarHBondContact O-N 2.84Å; S377-L386 VanDerWaalsContact OG-C 3.3Å; S377-S387 WeakPolarHBondContact OG-CA 3.14Å; S377-S387 WeakPolarHBondContact OG-CB 3.3Å; S377-S387 PolarHBondContact OG-N 2.6Å
378R73.3Confident74.5Confident37 Ų3731.5 Ų31.514%0.1417%0.166CC..Hα-helixtrans-59.2-27.7173.5-175.417371.6-164.50.3112.9P7 F374 A375P7-R378 HydrophobicContact CB-CG 4.24Å; F374-R378 PolarHBondContact O-N 3.36Å; A375-R378 PolarHBondContact O-N 3.43Å
379E74.3Confident73.6Confident73 Ų7332 Ų3234%0.34117%0.169SC..THydrogen-bonded Turntrans-105.213.1-173-64.9-85.9-179.100111.5W142 S377 H381W142-E379 HydrophobicContact CH2-CB 3.82Å; W142-E379 HydrophobicContact CH2-CG 3.5Å; W142-E379 HydrophobicContact CZ2-CB 3.74Å; W142-E379 HydrophobicContact CZ2-CG 3.98Å; W142-E379 HydrophobicContact CZ3-CG 4.42Å; S377-E379 PolarHBondContact O-N 3.1Å; E379-H381 PolarHBondContact O-CD2 2.77Å; E379-H381 VanDerWaalsContact O-CD2 3.3Å; E379-H381 PolarHBondContact O-N 3.18Å
380G73.7Confident72.7Confident52 Ų5232.9 Ų32.954%0.53617%0.173SC..THydrogen-bonded Turntrans72.97.3175.100000115.3S377S377-G380 PolarHBondContact O-N 2.84Å
381H74.3Confident71.6Confident33 Ų3336.2 Ų36.215%0.15319%0.193CC..SBendtrans-82.5-16.2178.9-70.3-170.4000112.8W142 F155 A376 E379W142-H381 AromaticContact NE1-ND1 3.61Å; F155-H381 HydrophobicContact CD2-CB 4.09Å; F155-H381 WeakPolarHBondContact CD2-O 3.33Å; F155-H381 VanDerWaalsContact CE2-O 3.22Å; F155-H381 WeakPolarHBondContact CE2-O 3.3Å; A376-H381 WeakPolarHBondContact O-CB 3.27Å; A376-H381 PolarHBondContact O-N 2.91Å; E379-H381 PolarHBondContact O-CD2 2.77Å; E379-H381 VanDerWaalsContact O-CD2 3.3Å; E379-H381 PolarHBondContact O-N 3.18Å
382L73.3Confident70.7Confident26 Ų2646.1 Ų46.114%0.13623%0.23CC..SBendtrans-127169.3171.6-74.6178.4000109.5S158 A376 D384 L386S158-L382 WeakPolarHBondContact OG-CD1 3.5Å; A376-L382 HydrophobicContact CB-CD1 3.72Å; A376-L382 HydrophobicContact CB-CG 4.05Å; A376-L382 PolarHBondContact O-N 3.49Å; L382-D384 PolarHBondContact O-N 3.11Å; L382-L386 HydrophobicContact CB-CD1 4.37Å
383L73.2Confident69.7Low117 Ų11751.1 Ų51.161%0.61325%0.249SC*.  trans-53.7128.2176.4-64.7170.3000110.9I385 L386L383-I385 PolarHBondContact O-N 2.78Å; L383-L386 HydrophobicContact CB-CD1 4.3Å; L383-L386 HydrophobicContact CB-CG 4.23Å; L383-L386 WeakPolarHBondContact O-CB 3.1Å; L383-L386 PolarHBondContact O-N 2.98Å
384D67.1Low69Low92 Ų9253.9 Ų53.949%0.49226%0.264SS..G310 helixtrans-54.4-28.1179.8-64.6-15.6000112.9L382 L386 S387 Y388L382-D384 PolarHBondContact O-N 3.11Å; D384-L386 PolarHBondContact O-N 3.45Å; D384-L386 VanDerWaalsContact O-N 3.14Å; D384-S387 PolarHBondContact O-N 3.18Å; D384-S387 VanDerWaalsContact O-N 3.08Å; D384-S387 PolarHBondContact O-OG 3.07Å; D384-Y388 WeakPolarHBondContact O-CD2 3.4Å; D384-Y388 WeakPolarHBondContact O-CE2 3.09Å
385I66.7Low68.5Low115 Ų11553.6 Ų53.659%0.5926%0.262SS*.G310 helixtrans-58.8-27176.8-65.1162.8000111.8L383 S387 Y388 P398L383-I385 PolarHBondContact O-N 2.78Å; I385-S387 VanDerWaalsContact C-N 3.35Å; I385-Y388 WeakPolarHBondContact O-CD2 3.1Å; I385-P398 HydrophobicContact CG2-CB 4.38Å; I385-P398 WeakPolarHBondContact O-CB 3.4Å
386L68.2Low68.1Low10 Ų1054.2 Ų54.25%0.05227%0.266CS..G310 helixtrans-80.5-13.5-179.1-54.5178.1000113.3S377 L382 L383 D384 F402S377-L386 VanDerWaalsContact OG-C 3.3Å; L382-L386 HydrophobicContact CB-CD1 4.37Å; L383-L386 HydrophobicContact CB-CD1 4.3Å; L383-L386 HydrophobicContact CB-CG 4.23Å; L383-L386 WeakPolarHBondContact O-CB 3.1Å; L383-L386 PolarHBondContact O-N 2.98Å; D384-L386 PolarHBondContact O-N 3.45Å; D384-L386 VanDerWaalsContact O-N 3.14Å; L386-F402 HydrophobicContact CD1-CG 4.39Å; L386-F402 HydrophobicContact CD2-CB 3.72Å; L386-F402 HydrophobicContact CD2-CD2 4.28Å; L386-F402 HydrophobicContact CD2-CG 4.1Å
387S62.7Low67.7Low0 Ų054.5 Ų54.50%027%0.269CS..G310 helixtrans-85.5-10.1178.176.60000113H4 F374 S377 D384 I385 V389H4-S387 PolarHBondContact CD2-OG 2.97Å; H4-S387 PolarHBondContact NE2-OG 2.77Å; F374-S387 WeakPolarHBondContact CD2-O 3.37Å; F374-S387 VanDerWaalsContact CE2-O 3.27Å; F374-S387 WeakPolarHBondContact CE2-O 3.13Å; S377-S387 WeakPolarHBondContact OG-CA 3.14Å; S377-S387 WeakPolarHBondContact OG-CB 3.3Å; S377-S387 PolarHBondContact OG-N 2.6Å; D384-S387 PolarHBondContact O-N 3.18Å; D384-S387 VanDerWaalsContact O-N 3.08Å; D384-S387 PolarHBondContact O-OG 3.07Å; I385-S387 VanDerWaalsContact C-N 3.35Å; S387-V389 PolarHBondContact O-N 2.93Å
388Y65.9Low67.4Low83 Ų8355.6 Ų55.633%0.32528%0.276SS..  trans-70.5125.6-174.6-80.6-90.5000112.1Y2 H4 D384 I385 P398Y2-Y388 VanDerWaalsContact CB-CD1 3.47Å; H4-Y388 HydrophobicContact CB-CE1 4.38Å; D384-Y388 WeakPolarHBondContact O-CD2 3.4Å; D384-Y388 WeakPolarHBondContact O-CE2 3.09Å; I385-Y388 WeakPolarHBondContact O-CD2 3.1Å; Y388-P398 WeakPolarHBondContact O-CD 3.5Å
389V64Low67Low11 Ų1153.9 Ų53.97%0.06727%0.27CS..EExtended strand (participates in β ladder)trans-104.2138.5175.1177.80000109.6Y2 Q3 F374 S387 V391 L394Y2-V389 WeakPolarHBondContact CA-O 3.29Å; Q3-V389 PolarHBondContact N-O 3.16Å; Q3-V389 VanDerWaalsContact N-O 3.17Å; Q3-V389 PolarHBondContact O-N 3.15Å; F374-V389 HydrophobicContact CD2-CG2 3.72Å; F374-V389 HydrophobicContact CE2-CG2 3.34Å; F374-V389 HydrophobicContact CZ-CG2 4.09Å; S387-V389 PolarHBondContact O-N 2.93Å; V389-V391 PolarHBondContact O-N 3.2Å; V389-L394 VanDerWaalsContact CG1-C 3.48Å; V389-L394 VanDerWaalsContact CG1-CA 3.49Å; V389-L394 HydrophobicContact CG1-CB 4.42Å; V389-L394 HydrophobicContact CG1-CD2 4.4Å
390H63.6Low66.8Low22 Ų2250.7 Ų50.710%0.10226%0.255CS..EExtended strand (participates in β ladder)trans-69.9121.4178.7-172.2-77.9000111.4Y2 R392 R393 L394 T395Y2-H390 HydrophobicContact CD1-CB 4.22Å; Y2-H390 HydrophobicContact CE1-CB 3.92Å; Y2-H390 AromaticContact CE1-CD2 3.98Å; Y2-H390 AromaticContact CZ-CD2 3.94Å; H390-R392 VanDerWaalsContact C-N 3.32Å; H390-R392 PolarHBondContact ND1-N 3.37Å; H390-R392 PolarHBondContact O-N 3.47Å; H390-R392 VanDerWaalsContact O-N 3.14Å; H390-R393 HydrophobicContact CB-CB 4.29Å; H390-R393 PolarHBondContact ND1-N 3.23Å; H390-R393 PolarHBondContact O-N 2.94Å; H390-R393 VanDerWaalsContact O-N 3.1Å; H390-L394 WeakPolarHBondContact O-CA 3.13Å; H390-L394 PolarHBondContact O-N 3.19Å; H390-T395 PolarHBondContact N-O 3.31Å
391V57Low66.7Low71 Ų7152.4 Ų52.443%0.4325%0.251SS..THydrogen-bonded Turntrans-58.1-36.5-168.9177.30000113.9M1 Q3 V389M1-V391 WeakPolarHBondContact O-CG2 3.15Å; M1-V391 PolarHBondContact O-N 2.92Å; Q3-V391 HydrophobicContact CB-CG2 4.11Å; Q3-V391 HydrophobicContact CG-CG2 4.48Å; V389-V391 PolarHBondContact O-N 3.2Å
392R61.3Low66.6Low218 Ų21852.9 Ų52.982%0.82325%0.253SS*.THydrogen-bonded Turntrans-90.5-18.5-179.9-65.4-172.5-180-177.60.4115.1H390H390-R392 VanDerWaalsContact C-N 3.32Å; H390-R392 PolarHBondContact ND1-N 3.37Å; H390-R392 PolarHBondContact O-N 3.47Å; H390-R392 VanDerWaalsContact O-N 3.14Å
393R60.6Low66.3Low105 Ų10552.1 Ų52.140%0.39625%0.249SC..THydrogen-bonded Turntrans-119.3-14.4-167.2-69.9177.4174.3-160.4-0.2113Y213 H390 T395Y213-R393 VanDerWaalsContact O-CD 3.23Å; Y213-R393 WeakPolarHBondContact O-CD 3.09Å; H390-R393 HydrophobicContact CB-CB 4.29Å; H390-R393 PolarHBondContact ND1-N 3.23Å; H390-R393 PolarHBondContact O-N 2.94Å; H390-R393 VanDerWaalsContact O-N 3.1Å; R393-T395 HydrophobicContact CB-CG2 4.42Å; R393-T395 PolarHBondContact O-N 3.38Å
394L64.3Low65.9Low58 Ų5848.9 Ų48.930%0.30423%0.231SC..  trans54.932.8179.8-58.2169.9000112.6V69 V389 H390V69-L394 HydrophobicContact CG1-CD2 3.7Å; V389-L394 VanDerWaalsContact CG1-C 3.48Å; V389-L394 VanDerWaalsContact CG1-CA 3.49Å; V389-L394 HydrophobicContact CG1-CB 4.42Å; V389-L394 HydrophobicContact CG1-CD2 4.4Å; H390-L394 WeakPolarHBondContact O-CA 3.13Å; H390-L394 PolarHBondContact O-N 3.19Å
395T66.4Low65.6Low2 Ų251 Ų511%0.01224%0.238CC..  trans-105.6138.7179.150.10000111.3N211 C212 V215 H390 R393 A397N211-T395 VanDerWaalsContact O-CG2 3.28Å; N211-T395 WeakPolarHBondContact O-CG2 3.43Å; C212-T395 PolarHBondContact O-OG1 3.41Å; V215-T395 HydrophobicContact CG2-CG2 3.59Å; H390-T395 PolarHBondContact N-O 3.31Å; R393-T395 HydrophobicContact CB-CG2 4.42Å; R393-T395 PolarHBondContact O-N 3.38Å; T395-A397 PolarHBondContact O-N 2.83Å
396P69Low65.3Low13 Ų1351.2 Ų51.28%0.08423%0.231CC..  trans-80.962174.634.1-35.4000111.2F374 G399 L400F374-P396 HydrophobicContact CB-CB 4.33Å; P396-G399 PolarHBondContact O-N 3.12Å; P396-L400 WeakPolarHBondContact O-CG 3.41Å; P396-L400 PolarHBondContact O-N 2.85Å
397A67.6Low64.8Low7 Ų751.2 Ų51.26%0.05823%0.231CC..Hα-helixtrans-57.8-41.3-172.200000114.7Y2 C212 T395 G399 L400 I401Y2-A397 HydrophobicContact CE1-CB 4.37Å; C212-A397 HydrophobicContact CB-CB 4.45Å; T395-A397 PolarHBondContact O-N 2.83Å; A397-G399 PolarHBondContact O-N 3.28Å; A397-L400 PolarHBondContact O-N 3.21Å; A397-I401 WeakPolarHBondContact O-CD1 3.41Å; A397-I401 VanDerWaalsContact O-CG1 3.25Å; A397-I401 WeakPolarHBondContact O-CG1 3.46Å; A397-I401 PolarHBondContact O-N 2.88Å
398P69.3Low64.1Low23 Ų2353.4 Ų53.415%0.14924%0.243CC..Hα-helixtrans-64.4-39.4179.3-24.637.2000114Y2 I385 Y388 L400 I401 F402Y2-P398 HydrophobicContact CE1-CG 4.3Å; I385-P398 HydrophobicContact CG2-CB 4.38Å; I385-P398 WeakPolarHBondContact O-CB 3.4Å; Y388-P398 WeakPolarHBondContact O-CD 3.5Å; P398-L400 VanDerWaalsContact C-N 3.33Å; P398-L400 PolarHBondContact O-N 2.95Å; P398-I401 PolarHBondContact O-N 2.81Å; P398-F402 PolarHBondContact O-N 3.42Å
399G63.8Low63.3Low0 Ų054.8 Ų54.80%026%0.255CS..Hα-helixtrans-61.8-40.4174.600000112.5P396 A397 F402 H403P396-G399 PolarHBondContact O-N 3.12Å; A397-G399 PolarHBondContact O-N 3.28Å; G399-F402 PolarHBondContact O-N 3.29Å; G399-H403 PolarHBondContact O-CD2 3.19Å; G399-H403 PolarHBondContact O-N 3.34Å
400L70Confident62.6Low6 Ų655.6 Ų55.63%0.03126%0.259CS..Hα-helixtrans-67.6-40.1176.9-63.5172.1000112.4L208 N211 L366 P396 A397 P398 F402 H403 L404L208-L400 HydrophobicContact CD1-CB 3.39Å; N211-L400 HydrophobicContact CB-CD1 4.12Å; L366-L400 HydrophobicContact CD1-CD2 3.76Å; L366-L400 HydrophobicContact CD2-CD2 4.31Å; L366-L400 HydrophobicContact CG-CD2 3.68Å; P396-L400 WeakPolarHBondContact O-CG 3.41Å; P396-L400 PolarHBondContact O-N 2.85Å; A397-L400 PolarHBondContact O-N 3.21Å; P398-L400 VanDerWaalsContact C-N 3.33Å; P398-L400 PolarHBondContact O-N 2.95Å; L400-F402 VanDerWaalsContact C-N 3.35Å; L400-H403 PolarHBondContact O-N 3.25Å; L400-L404 PolarHBondContact O-N 3.41Å
401I72.6Confident61.9Low88 Ų8863.9 Ų63.945%0.45129%0.289SS..Hα-helixtrans-68-34.9177.5-66.8162.9000111.3L208 A397 P398 H403 L404 H405L208-I401 HydrophobicContact CD1-CG1 4.49Å; L208-I401 HydrophobicContact CD2-CG1 4.26Å; A397-I401 WeakPolarHBondContact O-CD1 3.41Å; A397-I401 VanDerWaalsContact O-CG1 3.25Å; A397-I401 WeakPolarHBondContact O-CG1 3.46Å; A397-I401 PolarHBondContact O-N 2.88Å; P398-I401 PolarHBondContact O-N 2.81Å; I401-H403 VanDerWaalsContact C-N 3.31Å; I401-H403 PolarHBondContact O-N 3.45Å; I401-L404 WeakPolarHBondContact O-CB 3.3Å; I401-L404 PolarHBondContact O-N 3.36Å; I401-L404 VanDerWaalsContact O-N 3.11Å; I401-H405 PolarHBondContact O-N 3.01Å
402F71.7Confident61.3Low44 Ų4469.2 Ų69.219%0.19330%0.302CS..Hα-helixtrans-59.9-41.7176.7-179.4-93.5000112.3T162 L163 L386 P398 G399 L400 L404 H405 R406T162-F402 HydrophobicContact CG2-CD1 3.98Å; T162-F402 HydrophobicContact CG2-CE1 3.75Å; L163-F402 HydrophobicContact CD2-CE1 3.91Å; L163-F402 HydrophobicContact CD2-CZ 3.75Å; L386-F402 HydrophobicContact CD1-CG 4.39Å; L386-F402 HydrophobicContact CD2-CB 3.72Å; L386-F402 HydrophobicContact CD2-CD2 4.28Å; L386-F402 HydrophobicContact CD2-CG 4.1Å; P398-F402 PolarHBondContact O-N 3.42Å; G399-F402 PolarHBondContact O-N 3.29Å; L400-F402 VanDerWaalsContact C-N 3.35Å; F402-L404 VanDerWaalsContact C-N 3.3Å; F402-L404 PolarHBondContact O-N 2.86Å; F402-H405 PolarHBondContact O-N 3.41Å; F402-R406 HydrophobicContact CE1-CG 4.23Å; F402-R406 HydrophobicContact CZ-CG 4.21Å; F402-R406 PolarHBondContact O-N 3.43Å
403H67.8Low60.6Low10 Ų1060 Ų605%0.04627%0.271CS..Hα-helixtrans-60.6-38.8174.6-78.7-62.6000112.2T162 C373 G399 L400 I401 L407T162-H403 PolarHBondContact O-CE1 3.42Å; C373-H403 PolarHBondContact SG-NE2 3.18Å; G399-H403 PolarHBondContact O-CD2 3.19Å; G399-H403 PolarHBondContact O-N 3.34Å; L400-H403 PolarHBondContact O-N 3.25Å; I401-H403 VanDerWaalsContact C-N 3.31Å; I401-H403 PolarHBondContact O-N 3.45Å; H403-L407 WeakPolarHBondContact O-CD1 3.17Å
404L64.5Low59.9Low48 Ų4860.4 Ų60.425%0.25128%0.281SS..Hα-helixtrans-64.1-44.2175.6-178.674.2000112.1I204 V205 L208 L400 I401 F402 R406 L407I204-L404 HydrophobicContact CB-CD1 4.33Å; I204-L404 HydrophobicContact CG2-CD1 3.45Å; I204-L404 VanDerWaalsContact CG2-CD1 3.45Å; V205-L404 HydrophobicContact CG2-CD1 4.18Å; V205-L404 HydrophobicContact CG2-CD2 4.32Å; L208-L404 HydrophobicContact CD2-CB 3.99Å; L208-L404 HydrophobicContact CD2-CD2 3.55Å; L208-L404 HydrophobicContact CD2-CG 4.26Å; L400-L404 PolarHBondContact O-N 3.41Å; I401-L404 WeakPolarHBondContact O-CB 3.3Å; I401-L404 PolarHBondContact O-N 3.36Å; I401-L404 VanDerWaalsContact O-N 3.11Å; F402-L404 VanDerWaalsContact C-N 3.3Å; F402-L404 PolarHBondContact O-N 2.86Å; L404-R406 PolarHBondContact O-N 3.02Å; L404-L407 WeakPolarHBondContact O-CB 3.35Å; L404-L407 PolarHBondContact O-N 3.41Å
405H60.6Low59Low136 Ų13662 Ų6263%0.6330%0.302SS*.Hα-helixtrans-64-30.9-175.8-168.729.5000112.3I401 F402 L407 D408I401-H405 PolarHBondContact O-N 3.01Å; F402-H405 PolarHBondContact O-N 3.41Å; H405-L407 VanDerWaalsContact C-N 3.33Å; H405-D408 VanDerWaalsContact O-CB 3.22Å; H405-D408 WeakPolarHBondContact O-CB 3.42Å; H405-D408 PolarHBondContact O-N 3.01Å
406R61.3Low57.5Low120 Ų12063.7 Ų63.745%0.45332%0.32SS..Hα-helixtrans-79.4-12176.9-69.6-65.8-175.4162-1.1114.2F402 L404 D408 I409F402-R406 HydrophobicContact CE1-CG 4.23Å; F402-R406 HydrophobicContact CZ-CG 4.21Å; F402-R406 PolarHBondContact O-N 3.43Å; L404-R406 PolarHBondContact O-N 3.02Å; R406-D408 PolarHBondContact O-N 2.89Å; R406-I409 WeakPolarHBondContact O-CD1 3.13Å; R406-I409 VanDerWaalsContact O-CG1 3.31Å; R406-I409 WeakPolarHBondContact O-CG1 3.31Å; R406-I409 PolarHBondContact O-N 2.95Å
407L55.9Low55.9Low10 Ų1069.8 Ų69.85%0.05236%0.36CS..THydrogen-bonded Turntrans-70.9-4.8165.8-90.783.9000113.2P167 A171 I204 H403 L404 H405 I409 L410P167-L407 HydrophobicContact CB-CD1 3.97Å; A171-L407 HydrophobicContact CB-CD2 4.35Å; I204-L407 HydrophobicContact CD1-CD2 3.25Å; I204-L407 HydrophobicContact CG1-CD2 4.16Å; I204-L407 HydrophobicContact CG2-CD2 4.4Å; H403-L407 WeakPolarHBondContact O-CD1 3.17Å; L404-L407 WeakPolarHBondContact O-CB 3.35Å; L404-L407 PolarHBondContact O-N 3.41Å; H405-L407 VanDerWaalsContact C-N 3.33Å; L407-I409 PolarHBondContact O-N 2.72Å; L407-L410 HydrophobicContact CD2-CD1 3.97Å; L407-L410 HydrophobicContact CG-CD1 4.32Å; L407-L410 WeakPolarHBondContact O-CB 3.4Å; L407-L410 PolarHBondContact O-N 3.16Å
408D49.2Very low54.6Low47 Ų4776.8 Ų76.825%0.25140%0.396SS..THydrogen-bonded Turntrans-58.8-12.7166.7-164.249.3000112.6H405 R406 L410 R411 R412H405-D408 VanDerWaalsContact O-CB 3.22Å; H405-D408 WeakPolarHBondContact O-CB 3.42Å; H405-D408 PolarHBondContact O-N 3.01Å; R406-D408 PolarHBondContact O-N 2.89Å; D408-L410 PolarHBondContact O-N 3.39Å; D408-R411 WeakPolarHBondContact O-CB 3.26Å; D408-R411 PolarHBondContact O-N 2.8Å; D408-R411 VanDerWaalsContact O-N 3.09Å; D408-R411 WeakPolarHBondContact OD1-CB 3.4Å; D408-R411 VanDerWaalsContact OD1-CD 3.32Å; D408-R411 WeakPolarHBondContact OD1-CD 3.46Å; D408-R412 WeakPolarHBondContact O-CG 3.5Å; D408-R412 PolarHBondContact O-N 2.97Å; D408-R412 IonicContact OD2-CZ 2.81Å; D408-R412 IonicContact OD2-NE 3.85Å; D408-R412 PolarHBondContact OD2-NE 2.97Å; D408-R412 IonicContact OD2-NH2 3.89Å
409I49.8Very low53.4Low111 Ų11182.4 Ų82.457%0.56941%0.414SS*.Hα-helixtrans-56.8-37.9165.5-68.1169.7000111.5R406 L407 R411 R412 S413R406-I409 WeakPolarHBondContact O-CD1 3.13Å; R406-I409 VanDerWaalsContact O-CG1 3.31Å; R406-I409 WeakPolarHBondContact O-CG1 3.31Å; R406-I409 PolarHBondContact O-N 2.95Å; L407-I409 PolarHBondContact O-N 2.72Å; I409-R411 VanDerWaalsContact C-N 3.25Å; I409-R411 PolarHBondContact O-N 3.3Å; I409-R412 PolarHBondContact O-N 3Å; I409-S413 PolarHBondContact O-N 3.01Å
410L48.2Very low52.2Low29 Ų2988 Ų8815%0.15245%0.445CS..Hα-helixtrans-66.5-28.6175.8-67.3172.6000112.5A171 L175 L407 D408A171-L410 HydrophobicContact CB-CD1 3.83Å; A171-L410 HydrophobicContact CB-CD2 4.21Å; A171-L410 HydrophobicContact CB-CG 4.33Å; L175-L410 HydrophobicContact CD1-CD2 4.21Å; L407-L410 HydrophobicContact CD2-CD1 3.97Å; L407-L410 HydrophobicContact CG-CD1 4.32Å; L407-L410 WeakPolarHBondContact O-CB 3.4Å; L407-L410 PolarHBondContact O-N 3.16Å; D408-L410 PolarHBondContact O-N 3.39Å
411R48.5Very low50.4Low195 Ų19590.9 Ų90.974%0.73647%0.469SS*.Hα-helixtrans-81.8-39176.4-167.3-178.6-175.6163.31.1111.8D408 I409 S413D408-R411 WeakPolarHBondContact O-CB 3.26Å; D408-R411 PolarHBondContact O-N 2.8Å; D408-R411 VanDerWaalsContact O-N 3.09Å; D408-R411 WeakPolarHBondContact OD1-CB 3.4Å; D408-R411 VanDerWaalsContact OD1-CD 3.32Å; D408-R411 WeakPolarHBondContact OD1-CD 3.46Å; I409-R411 VanDerWaalsContact C-N 3.25Å; I409-R411 PolarHBondContact O-N 3.3Å; R411-S413 VanDerWaalsContact C-N 3.3Å; R411-S413 PolarHBondContact O-N 3.26Å
412R44.9Very low48.5Very low183 Ų18390.9 Ų90.969%0.69147%0.47SS*.Hα-helixtrans-74.6-17.1178.8-72-177.1-172.7-153.2-2.5114D408 I409 D414 A415D408-R412 WeakPolarHBondContact O-CG 3.5Å; D408-R412 PolarHBondContact O-N 2.97Å; D408-R412 IonicContact OD2-CZ 2.81Å; D408-R412 IonicContact OD2-NE 3.85Å; D408-R412 PolarHBondContact OD2-NE 2.97Å; D408-R412 IonicContact OD2-NH2 3.89Å; I409-R412 PolarHBondContact O-N 3Å; R412-D414 PolarHBondContact O-N 3.44Å; R412-D414 VanDerWaalsContact O-N 3.14Å; R412-A415 PolarHBondContact O-N 3.3Å
413S46.5Very low46.8Very low26 Ų2692.3 Ų92.318%0.18248%0.477CS..THydrogen-bonded Turntrans-64-14.3174.7-167.60000113.9I409 R411 H423I409-S413 PolarHBondContact O-N 3.01Å; R411-S413 VanDerWaalsContact C-N 3.3Å; R411-S413 PolarHBondContact O-N 3.26Å; S413-H423 VanDerWaalsContact CB-NE2 3.32Å; S413-H423 WeakPolarHBondContact CB-NE2 3.38Å; S413-H423 PolarHBondContact OG-CD2 3.45Å; S413-H423 PolarHBondContact OG-NE2 2.87Å; S413-H423 VanDerWaalsContact OG-NE2 3.17Å
414D46.1Very low45.2Very low113 Ų11396.9 Ų96.960%0.60450%0.498SS*.THydrogen-bonded Turntrans-89.70.6179.2-66.1-25.8000113.6K197 R412K197-D414 IonicContact NZ-OD1 2.74Å; K197-D414 PolarHBondContact NZ-OD1 2.67Å; K197-D414 IonicContact NZ-OD2 3.11Å; K197-D414 PolarHBondContact NZ-OD2 3.24Å; R412-D414 PolarHBondContact O-N 3.44Å; R412-D414 VanDerWaalsContact O-N 3.14Å
415A44.4Very low43.8Very low91 Ų9198.5 Ų98.575%0.75251%0.51SS*.SBendtrans-9612.5-172.500000115.7R412R412-A415 PolarHBondContact O-N 3.3Å
416G36Very low42.6Very low38 Ų3898.7 Ų98.739%0.39251%0.511SS..  trans-122.7132.7-179.200000112.3D418G416-D418 PolarHBondContact O-N 3.17Å; G416-D418 VanDerWaalsContact O-N 3.09Å
417P36.2Very low41.3Very low141 Ų14197.1 Ų97.192%0.91651%0.511SS*.THydrogen-bonded Turntrans-69-3.7-178.2-15.128.8000115.3
418D39.8Very low40.2Very low153 Ų15398.4 Ų98.482%0.81852%0.521SS*.THydrogen-bonded Turntrans-137.837-156.6-132.12.6000113.2G416G416-D418 PolarHBondContact O-N 3.17Å; G416-D418 VanDerWaalsContact O-N 3.09Å
419R43.7Very low39.5Very low141 Ų14198.8 Ų98.853%0.53253%0.531SS..  trans-13627.3-167.6-81.5-167.3169.1-166.6-3.1117.2A421 L422R419-A421 PolarHBondContact O-N 3.39Å; R419-A421 VanDerWaalsContact O-N 3.1Å; R419-L422 HydrophobicContact CG-CB 4.44Å; R419-L422 PolarHBondContact O-N 3.22Å
420D37.7Very low38.7Very low119 Ų11995.6 Ų95.664%0.63652%0.521SS*.THydrogen-bonded Turntrans-57.5-15154.5-70.9-37.1000111.5Q424D420-Q424 WeakPolarHBondContact O-CB 3.45Å; D420-Q424 PolarHBondContact O-OE1 3.27Å
421A32.7Very low38Very low66 Ų6696.4 Ų96.455%0.54553%0.525SS..THydrogen-bonded Turntrans-77.7-36.5173.700000114.3R419 T425R419-A421 PolarHBondContact O-N 3.39Å; R419-A421 VanDerWaalsContact O-N 3.1Å; A421-T425 VanDerWaalsContact O-CB 3.27Å; A421-T425 WeakPolarHBondContact O-CB 3.49Å; A421-T425 PolarHBondContact O-N 3.35Å; A421-T425 PolarHBondContact O-OG1 3.07Å
422L33.6Very low37.3Very low88 Ų8893.3 Ų93.346%0.46152%0.519SS..Hα-helixtrans-89.2-34.8-165.1-141.492.4000114.3R419 T425 Q426R419-L422 HydrophobicContact CG-CB 4.44Å; R419-L422 PolarHBondContact O-N 3.22Å; L422-T425 PolarHBondContact O-N 3.49Å; L422-Q426 PolarHBondContact O-N 3.38Å
423H34.9Very low36.6Very low74 Ų7487.2 Ų87.234%0.34351%0.514SS..Hα-helixtrans-81.7-53.6-179.9-115.1-92.4000112.2S413 Q426 L427S413-H423 VanDerWaalsContact CB-NE2 3.32Å; S413-H423 WeakPolarHBondContact CB-NE2 3.38Å; S413-H423 PolarHBondContact OG-CD2 3.45Å; S413-H423 PolarHBondContact OG-NE2 2.87Å; S413-H423 VanDerWaalsContact OG-NE2 3.17Å; H423-Q426 PolarHBondContact O-N 2.83Å; H423-L427 WeakPolarHBondContact O-CB 3.46Å; H423-L427 PolarHBondContact O-N 3.5Å
424Q34.9Very low35.8Very low106 Ų10689 Ų8950%0.49553%0.53SS..Hα-helix32.4-106.5107.8-72.1156.5-36.500115.9D420 Q426 S428D420-Q424 WeakPolarHBondContact O-CB 3.45Å; D420-Q424 PolarHBondContact O-OE1 3.27Å; Q424-Q426 PolarHBondContact O-N 3.43Å; Q424-S428 WeakPolarHBondContact O-CA 3.48Å; Q424-S428 WeakPolarHBondContact O-CB 3.04Å; Q424-S428 PolarHBondContact O-N 2.99Å; Q424-S428 PolarHBondContact O-OG 2.8Å
425T35.5Very low34.9Very low81 Ų8191.4 Ų91.450%0.49754%0.543SS..Hα-helixtrans-62.1-31.3-178.4-58.10000115.5A421 L422 S428 A429A421-T425 VanDerWaalsContact O-CB 3.27Å; A421-T425 WeakPolarHBondContact O-CB 3.49Å; A421-T425 PolarHBondContact O-N 3.35Å; A421-T425 PolarHBondContact O-OG1 3.07Å; L422-T425 PolarHBondContact O-N 3.49Å; T425-S428 VanDerWaalsContact CA-OG 3.24Å; T425-S428 WeakPolarHBondContact CA-OG 3.31Å; T425-A429 WeakPolarHBondContact O-CA 3.45Å; T425-A429 WeakPolarHBondContact O-CB 3.47Å; T425-A429 PolarHBondContact O-N 3.36Å
426Q35.8Very low34.1Very low140 Ų14095.5 Ų95.565%0.65455%0.546SS*.Hα-helixtrans-81.7-40.9179.6-77.7-90.5-49.800111.9L422 H423 Q424 A430L422-Q426 PolarHBondContact O-N 3.38Å; H423-Q426 PolarHBondContact O-N 2.83Å; Q424-Q426 PolarHBondContact O-N 3.43Å; Q426-A430 PolarHBondContact O-N 3.2Å
427L33.8Very low33.8Very low87 Ų87101.1 Ų101.146%0.45556%0.562SS.*Hα-helixtrans-74.3-36.6174.4-152.379.2000110.5H423 A430 L431H423-L427 WeakPolarHBondContact O-CB 3.46Å; H423-L427 PolarHBondContact O-N 3.5Å; L427-A430 CarbonylContact O-C 3.54Å; L427-A430 PolarHBondContact O-N 2.9Å; L427-L431 HydrophobicContact CD2-CD1 4.25Å; L427-L431 HydrophobicContact CG-CD1 3.91Å; L427-L431 WeakPolarHBondContact O-CA 3.22Å; L427-L431 WeakPolarHBondContact O-CB 3.32Å; L427-L431 WeakPolarHBondContact O-CG 3.31Å; L427-L431 PolarHBondContact O-N 3.1Å
428S32.6Very low33.3Very low38 Ų38100.2 Ų100.227%0.26656%0.559SS.*Hα-helixtrans-77.2-27.8173.772.50000113.7Q424 T425 A430 L431 Q432Q424-S428 WeakPolarHBondContact O-CA 3.48Å; Q424-S428 WeakPolarHBondContact O-CB 3.04Å; Q424-S428 PolarHBondContact O-N 2.99Å; Q424-S428 PolarHBondContact O-OG 2.8Å; T425-S428 VanDerWaalsContact CA-OG 3.24Å; T425-S428 WeakPolarHBondContact CA-OG 3.31Å; S428-A430 PolarHBondContact O-N 3.49Å; S428-L431 PolarHBondContact O-N 2.75Å; S428-Q432 CarbonylContact O-C 3.52Å; S428-Q432 PolarHBondContact O-N 3.02Å; S428-Q432 VanDerWaalsContact O-O 3.13Å
429A34.4Very low32.8Very low54 Ų54104.3 Ų104.345%0.44656%0.563SS.*Hα-helixtrans-65.3-27.9166.800000111.7R103 T425R103-A429 PolarHBondContact NH2-O 3.46Å; T425-A429 WeakPolarHBondContact O-CA 3.45Å; T425-A429 WeakPolarHBondContact O-CB 3.47Å; T425-A429 PolarHBondContact O-N 3.36Å
430A33Very low31.9Very low44 Ų44103.9 Ų103.936%0.36458%0.58SS.*Hα-helixtrans-87.2-27.5171.300000113.7Q426 L427 S428Q426-A430 PolarHBondContact O-N 3.2Å; L427-A430 CarbonylContact O-C 3.54Å; L427-A430 PolarHBondContact O-N 2.9Å; S428-A430 PolarHBondContact O-N 3.49Å
431L34Very low31.4Very low47 Ų47101.8 Ų101.825%0.24659%0.587CS.*Hα-helixtrans-122.4-16.4-168.4-72.1173.7000118.1V95 L427 S428V95-L431 HydrophobicContact CG1-CD2 3.51Å; V95-L431 HydrophobicContact CG1-CG 4.36Å; L427-L431 HydrophobicContact CD2-CD1 4.25Å; L427-L431 HydrophobicContact CG-CD1 3.91Å; L427-L431 WeakPolarHBondContact O-CA 3.22Å; L427-L431 WeakPolarHBondContact O-CB 3.32Å; L427-L431 WeakPolarHBondContact O-CG 3.31Å; L427-L431 PolarHBondContact O-N 3.1Å; S428-L431 PolarHBondContact O-N 2.75Å
432Q32.8Very low31.2Very low129 Ų129107.1 Ų107.160%0.60361%0.605SS**  trans-155.8114.3-177.6-10615514.700114.1S428S428-Q432 CarbonylContact O-C 3.52Å; S428-Q432 PolarHBondContact O-N 3.02Å; S428-Q432 VanDerWaalsContact O-O 3.13Å
433G30.8Very low30.8Very low56 Ų56106.1 Ų106.158%0.57762%0.616SS**  trans-107.367.2146.100000109V102V102-G433 WeakPolarHBondContact CG1-O 3.27Å
434A29.3Very low30.6Very low64 Ų64111.1 Ų111.153%0.52964%0.639SS.*  trans-149.389166.500000108
435D28Very low30.1Very low163 Ų163114.1 Ų114.187%0.87266%0.658SS**  trans-126.894.9164.5-123.5-16.5000107.8
436H26.7Very low29.7Very low177 Ų177121.1 Ų121.182%0.81968%0.675SS**  trans-157.3121.8137.2-113.9-20000112.1
437H28.9Very low29.3Very low155 Ų155120.5 Ų120.572%0.71868%0.68SS**  trans63.6110.2160.3-83.5-71.6000118.4
438S26.1Very low28.9Very low123 Ų123121.7 Ų121.786%0.8670%0.696SS**  -170.9143.6110.7-78.50000112.6
439R28.9Very low28.7Very low239 Ų239131.1 Ų131.190%0.90273%0.726SS**  trans-71.8144.6-174.3-65.2165.4177.5-177.5-0.8111.2
440C24.8Very low28.3Very low131 Ų131132.2 Ų132.289%0.88574%0.742SS**  trans-108.8119.4151.3-141.60000108.5
441G27.8Very low28Very low76 Ų76133.2 Ų133.278%0.78476%0.757SS**  trans-73.8122.5179.600000110.8
442L27.7Very low27.8Very low177 Ų177137.5 Ų137.593%0.92779%0.785SS**  trans-91.3113.4162.4-105.4130.1000108.5
443G26Very low27.5Very low67 Ų67137.9 Ų137.969%0.69179%0.792SS**  trans-59.1140.4170.700000111.7
444H30.1Very low27.5Very low179 Ų179141.3 Ų141.383%0.82980%0.796SS**  trans-7.9118.9155.6-89.3-95.8000116.7
445L25.7Very low27.4Very low170 Ų170148.7 Ų148.789%0.8981%0.81SS**  trans-149.887.6138.6-103.8156.9000108.6V447L445-V447 PolarHBondContact O-N 2.79Å
446R25.6Very low27.5Very low228 Ų228147.4 Ų147.486%0.8680%0.803SS**  trans-75.3107.1171.1-162.1-179.9-157.61675107.1S448R446-S448 PolarHBondContact O-N 3.12Å
447V29.3Very low27.6Very low126 Ų126144.9 Ų144.976%0.76480%0.8SS**  trans-65.9104.8168.5174.30000107.8L445 R449L445-V447 PolarHBondContact O-N 2.79Å; V447-R449 PolarHBondContact O-N 2.88Å
448S24.4Very low27.8Very low113 Ų113141.9 Ų141.979%0.7980%0.802SS**  trans-77.7110.1166-172.30000108.2R446R446-S448 PolarHBondContact O-N 3.12Å
449R29.4Very low28.1Very low235 Ų235151.4 Ų151.489%0.88782%0.819SS**  trans-107.6111.8157.1-98.2-174.3175.2178.3-0.5107.4V447V447-R449 PolarHBondContact O-N 2.88Å
450G25.7Very low28Very low77 Ų77147.1 Ų147.179%0.79482%0.815SS**  trans-66.6153.6171.700000112.1
451G26.3Very low28.2Very low66 Ų66147.9 Ų147.968%0.6881%0.811SS**  trans167.580.9174.600000110.9
452T29.2Very low28.2Very low136 Ų136151.9 Ų151.983%0.83481%0.813SS**  trans9.3141135.643.40000117
453N26.5Very low28.2Very low137 Ų137150.4 Ų150.473%0.73381%0.806SS**  cis178.3168.84.8-162.4-0.6000104.6
454I30.4Very low28.4Very low129 Ų129155.6 Ų155.666%0.66281%0.813SS**  trans89.6109.9155.6-55.6159.3000117.9
455R28.7Very low28.3Very low218 Ų218154.1 Ų154.182%0.82381%0.812SS**  43.5138.4129.3-59.3-178-174.3170.2-0118.1
456D28.7Very low28.5Very low136 Ų136152.9 Ų152.973%0.72781%0.807SS**  cis-167.1158.137-108.2-35.7000109.9
457T30.4Very low28.7Very low125 Ų125147.2 Ų147.277%0.76780%0.803SS**  trans-17.3137.6154.8420000119.1
458A31.4Very low28.6Very low91 Ų91148.9 Ų148.975%0.75281%0.806SS**  146.5127.9111.800000114.3
459R32.4Very low29Very low324 Ų324152.2 Ų152.2100%1.22381%0.807SS**  trans77.60161.2-69.7-174.1-178.1-1761.4119.5

Retrieved 459 of 459 residues in 103.9 ms (Link to these results)