A0A061IH31_CRIGR Loading...

RING-type E3 ubiquitin transferase

AlphaFold DB , UniProt , Accession A0A061IH31, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene n/a, Length 280 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M39.6Very low44.8Very low221 Ų221137.4 Ų137.4100%1.08981%0.806SS**  0135.90-71.1172.4123.100107.9
2P57Low44Very low121 Ų121142.2 Ų142.279%0.78682%0.815SS**  cis-103.5144.80.816.45.2000111
3D35.7Very low43.5Very low122 Ų122140.9 Ų140.965%0.65282%0.82SS**  69.795.262.5-67.7-63.8000113
4V51.3Low43.5Very low145 Ų145147.5 Ų147.588%0.87982%0.824SS**  trans-135.396.5148.3179.40000107.6
5C40.7Very low43.2Very low106 Ų106149.6 Ų149.672%0.71683%0.825SS**  trans-103.4122.2163.3-174.50000106
6C46.5Very low42.9Very low125 Ų125150.9 Ų150.985%0.84582%0.824SS**  trans-115.6118159.8-780000108
7Q43.1Very low42.4Very low172 Ų172149 Ų14980%0.80482%0.818SS**  trans-70.5142.9-173.4-71.3164.5-27.200112.4V9Q7-V9 HydrophobicContact CB-CG2 4.45Å
8Q44.5Very low41.9Very low187 Ų187144.1 Ų144.187%0.87481%0.807SS**  trans-105126.9158.8-168.892.8-19.900107.5
9V48.2Very low41.8Very low122 Ų122143 Ų14374%0.73981%0.81SS**  trans-151.9166.1164.2-137.10000109.7Q7Q7-V9 HydrophobicContact CB-CG2 4.45Å
10P51.4Low42.2Very low124 Ų124141.8 Ų141.881%0.80581%0.805SS**  -131.4-177.6-9544-26.9000113.2
11G34.5Very low42.6Very low66 Ų66141.2 Ų141.268%0.6881%0.807SS**  trans152.6100.1159.500000111.9
12Q35.2Very low42.6Very low195 Ų195136.8 Ų136.891%0.91179%0.793SS**  94110.589.1-126.8-176.25.400111.5
13S38.5Very low41.7Very low126 Ų126140.9 Ų140.988%0.88179%0.793SS**  168.8145.2120.153.90000111
14R43.1Very low42.6Very low233 Ų233140.4 Ų140.488%0.87980%0.796SS**  trans-107.2160-167.2-152.5-179.5-166.8167.11108.2
15E38.7Very low41.9Very low179 Ų179140.3 Ų140.384%0.83679%0.786SS**  trans87.2112.7160-51.9-160.2103.700119.3
16E38.4Very low41.7Very low171 Ų171140.7 Ų140.780%0.79979%0.79SS**  176.7116.8114.1-92.2-125.69400107.9
17T34.9Very low41.3Very low118 Ų118144.2 Ų144.272%0.72480%0.796SS**  97.7118.783.3-540000111.6
18G33.1Very low41.2Very low61 Ų61144.4 Ų144.463%0.62980%0.797SS**  trans98.8129138.100000118.9
19S39.1Very low40.9Very low123 Ų123141.5 Ų141.586%0.8679%0.792SS**  trans91.3105.614359.60000120.9
20V50.8Low41Very low118 Ų118141.2 Ų141.272%0.71579%0.793SS**  trans-28.4146.51491780000115.3T22V20-T22 HydrophobicContact CG1-CG2 4.43Å
21P50.4Low40.1Very low131 Ų131140 Ų14085%0.85179%0.793SS**  trans-110.6113.9151.429.7-15.1000111.5
22T39.8Very low40.3Very low128 Ų128141.1 Ų141.179%0.78580%0.796SS**  trans-111.3117.1160.420.60000107.7V20V20-T22 HydrophobicContact CG1-CG2 4.43Å
23R38.5Very low41.1Very low207 Ų207137.2 Ų137.278%0.78179%0.787SS**  trans-171.9134.8131.6-163.8168.4177.7141.9-1.7112.1E25R23-E25 IonicContact CZ-OE2 2.78Å; R23-E25 VanDerWaalsContact CZ-OE2 3.29Å; R23-E25 IonicContact NE-OE2 2.86Å; R23-E25 PolarHBondContact NE-OE2 2.91Å; R23-E25 IonicContact NH2-OE2 2.81Å; R23-E25 PolarHBondContact NH2-OE2 2.81Å
24P54.3Low41Very low111 Ų111136.9 Ų136.972%0.72178%0.78SS**  trans-99.1159.7167.638.2-30000111.5
25E36.1Very low40.6Very low144 Ų144133.1 Ų133.167%0.67378%0.777SS**  trans175.8112.1153.8-100.2166.411500106.1R23R23-E25 IonicContact CZ-OE2 2.78Å; R23-E25 VanDerWaalsContact CZ-OE2 3.29Å; R23-E25 IonicContact NE-OE2 2.86Å; R23-E25 PolarHBondContact NE-OE2 2.91Å; R23-E25 IonicContact NH2-OE2 2.81Å; R23-E25 PolarHBondContact NH2-OE2 2.81Å
26S36.3Very low40.6Very low113 Ų113130.8 Ų130.879%0.7978%0.775SS**  52.895.556.477.60000114.1
27M39Very low41.1Very low200 Ų200127.6 Ų127.699%0.98577%0.77SS**  trans-115.8121.2167.2-140163.8-159.100108.8
28Q39.9Very low41Very low175 Ų175128 Ų12882%0.81878%0.776SS**  trans-96.3136.7176.9-85.91750.100110.6
29V38.8Very low40.8Very low127 Ų127128.9 Ų128.977%0.7779%0.785SS**  60.8142.8124.4-165.20000115.8
30P50.3Low40.4Very low116 Ų116129.1 Ų129.175%0.75379%0.785SS**  cis-157171.849.243.8-20.9000122
31A33.1Very low39.9Very low97 Ų97129.4 Ų129.480%0.80279%0.789SS**  trans88123.7140.800000122
32A37.2Very low38.9Very low91 Ų91128.9 Ų128.975%0.75279%0.787SS**  trans-81.4-169.7165.600000110.6
33P51.9Low38.5Very low112 Ų112128.6 Ų128.673%0.72779%0.785SS**  cis-149.4-171.122.233.7-6.1000118.2
34V36.5Very low38.1Very low120 Ų120126.8 Ų126.873%0.72779%0.785SS**  trans86.9122.5159.4-1740000114.6
35D36.4Very low36.9Very low154 Ų154130.3 Ų130.382%0.82479%0.792SS**  cis-148.6163.940-98.1-53000113.3
36T38.8Very low36.6Very low130 Ų130129.9 Ų129.980%0.79879%0.794SS**  trans-102.6179.1178.7-15.70000109.5
37P48.3Very low36.3Very low104 Ų104132.9 Ų132.968%0.67580%0.795SS**  cis-139.2-174.8-13.534.6-11.7000115.7
38C31.7Very low35.7Very low127 Ų127129.6 Ų129.686%0.85878%0.781SS**  trans98.5114.5145.6-71.70000120.6
39G29.7Very low35.3Very low79 Ų79127.2 Ų127.281%0.81478%0.784SS**  97.398.5118.500000117.9
40C29.9Very low35Very low128 Ų128127.9 Ų127.987%0.86578%0.783SS**  trans-105.1160.8148.1-69.30000107.8
41P40.9Very low34.4Very low124 Ų124128.1 Ų128.181%0.80579%0.787SS**  cis-137.8177.119.734.6-12.1000116.4
42C28.5Very low34.9Very low119 Ų119129.3 Ų129.380%0.80478%0.784SS**  trans-58.5155.6-177.2-47.30000116.4
43V32Very low35.2Very low122 Ų122131.4 Ų131.474%0.73979%0.79SS**  169125.2112.5161.50000111.5
44E31.2Very low34.7Very low170 Ų170136.7 Ų136.779%0.79480%0.796SS**  trans35.7121.9151.4-75.814869.100123.7
45Q29.2Very low34.6Very low185 Ų185139.4 Ų139.486%0.86480%0.803SS**  -165.5153.9124.5-136.8153.7-37.100115.6
46L28.5Very low34.3Very low135 Ų135137.1 Ų137.171%0.70780%0.799SS**  trans89.3127.4165.1-67136.9000116.4
47H30.3Very low33.9Very low176 Ų176136.6 Ų136.682%0.81580%0.799SS**  -147.6128.151.1-76.2-104.3000111.6
48L27.5Very low33Very low130 Ų130137.8 Ų137.868%0.68180%0.804SS**  48.8111.888.3-157.276.6000117.5
49S31.1Very low32.9Very low126 Ų126140.7 Ų140.788%0.88181%0.805SS**  trans-163137.3131.8-79.90000112.2
50N32.5Very low33.2Very low140 Ų140140.9 Ų140.975%0.74980%0.799SS**  trans-79.2154.7-163.1-72.6-35.3000116
51S36.5Very low33.5Very low122 Ų122141 Ų14185%0.85380%0.799SS**  -170.2124.4122.851.40000111.9
52V44.5Very low33.1Very low122 Ų122143 Ų14374%0.73980%0.797SS**  trans-111.3154.8171.5-175.70000107.4
53P43.3Very low33.6Very low135 Ų135143.3 Ų143.388%0.87780%0.798SS**  -137.9148.9101.417.64.6000114.7
54R40.6Very low33.7Very low223 Ų223144.6 Ų144.684%0.84280%0.799SS**  trans-94.1162.4168-99.3-177.5141.796.7-1.5110.4
55M34.3Very low34.1Very low177 Ų177141.9 Ų141.987%0.87280%0.796SS**  157.5109.2129.6-85.8169.2-172.300111.4
56S30.9Very low34.2Very low106 Ų106139.7 Ų139.774%0.74180%0.795SS**  67.3146.7101.155.20000115.6
57C31.2Very low34.6Very low119 Ų119136.9 Ų136.980%0.80480%0.798SS**  cis-170.4171.9-10.2-93.20000105.2
58T29.3Very low35.1Very low128 Ų128133.5 Ų133.579%0.78580%0.801SS**  trans138.5113.8144.7-52.70000116
59E29.6Very low35.4Very low188 Ų188133.8 Ų133.888%0.87981%0.808SS**  trans64.9138.7136.3-135.7145.7113.600125.3
60A34.3Very low35.6Very low83 Ų83134 Ų13469%0.68680%0.804SS**  trans-95162.2176.600000111.8
61P36.4Very low35.9Very low132 Ų132132.6 Ų132.686%0.85780%0.801SS**  -152.2162.688.929.5-6.2000117
62Q33.6Very low36.2Very low165 Ų165132.5 Ų132.577%0.77180%0.795SS**  trans-78159.4175.5-73.5-102.22.200113.4
63P37.8Very low36.1Very low125 Ų125132.6 Ų132.681%0.81280%0.797SS**  -149.5159.99733.5-12.4000118.8
64I34.2Very low36.3Very low149 Ų149132.8 Ų132.876%0.76479%0.789SS**  trans-70.3160.4177.7-55.3160000110.7
65P41.4Very low36.6Very low114 Ų114129.2 Ų129.274%0.7479%0.785SS**  cis-142.9170.342.637.2-12000115.1
66V31Very low36.7Very low139 Ų139124.6 Ų124.684%0.84277%0.774SS**  -169.9137.953.2170.40000106.7
67G36.2Very low37.5Very low75 Ų75128 Ų12877%0.77378%0.784SS**  trans95.680.8145.400000119.2
68A40.2Very low37.6Very low105 Ų105125.2 Ų125.287%0.86878%0.775SS**  156.887.2123.800000110.4
69T34.7Very low38.8Very low136 Ų136124.7 Ų124.783%0.83477%0.773SS**  trans-99.9124.4167.4-46.20000108.6
70T35.2Very low39.8Very low131 Ų131122.9 Ų122.980%0.80478%0.775SS**  trans153.5126.9152.238.70000106.6
71T39.4Very low39.9Very low111 Ų111122 Ų12268%0.68178%0.775SS**  cis-165130.910.9-790000106.9T73T71-T73 PolarHBondContact O-N 3.26Å; T71-T73 VanDerWaalsContact O-N 3.12Å
72T42.3Very low40.6Very low119 Ų119123.8 Ų123.873%0.7377%0.772SS**  trans-47.1112.1159.5-54.50000109.3I74T72-I74 HydrophobicContact CG2-CG1 3.85Å; T72-I74 PolarHBondContact O-N 3.13Å
73T43.1Very low41.2Very low125 Ų125122.8 Ų122.877%0.76777%0.771SS**  trans-75.980.4169.8-26.70000108.1T71 I75T71-T73 PolarHBondContact O-N 3.26Å; T71-T73 VanDerWaalsContact O-N 3.12Å; T73-I75 VanDerWaalsContact C-N 3.34Å; T73-I75 HydrophobicContact CG2-CG1 4.29Å; T73-I75 PolarHBondContact O-N 2.98Å; T73-I75 VanDerWaalsContact O-N 3.13Å
74I46.8Very low41.5Very low139 Ų139123.4 Ų123.471%0.71377%0.767SS**  trans-63.5104.2152.9-60.8-175.6000104.4T72 A76T72-I74 HydrophobicContact CG2-CG1 3.85Å; T72-I74 PolarHBondContact O-N 3.13Å; I74-A76 PolarHBondContact O-N 3.14Å
75I47.2Very low41.9Very low148 Ų148122.6 Ų122.676%0.75976%0.763SS**  trans-70.792.7169.5-59.2-178.4000105.8T73 L77T73-I75 VanDerWaalsContact C-N 3.34Å; T73-I75 HydrophobicContact CG2-CG1 4.29Å; T73-I75 PolarHBondContact O-N 2.98Å; T73-I75 VanDerWaalsContact O-N 3.13Å; I75-L77 PolarHBondContact O-N 3.02Å
76A34.8Very low42Very low79 Ų79121.1 Ų121.165%0.65376%0.755SS**  trans-59.6126.1169.800000108.7I74 G78I74-A76 PolarHBondContact O-N 3.14Å; A76-G78 VanDerWaalsContact C-N 3.33Å; A76-G78 PolarHBondContact O-N 3.13Å
77L49.7Very low43Very low178 Ų178117.8 Ų117.893%0.93274%0.742SS**  trans-61.3100.4157.9-80.5103.6000107.7I75I75-L77 PolarHBondContact O-N 3.02Å
78G32.6Very low43.6Very low60 Ų60121 Ų12162%0.61974%0.737SS**  trans-91.4132.7159.400000109.3A76A76-G78 VanDerWaalsContact C-N 3.33Å; A76-G78 PolarHBondContact O-N 3.13Å
79P53.8Low44.2Very low117 Ų117117.7 Ų117.776%0.7671%0.713SS**SBendtrans-73.1145.5173.130.9-30.6000109.3
80T51.5Low45.6Very low150 Ų150116 Ų11692%0.9270%0.699SS**  trans79.654.7178.471.50000116.7
81G35.3Very low47.8Very low66 Ų66112.5 Ų112.568%0.6868%0.675SS**  trans-97.690.5155.300000109.8L83G81-L83 VanDerWaalsContact C-N 3.25Å; G81-L83 PolarHBondContact O-N 3.15Å
82H51.3Low50Low169 Ų169110.3 Ų110.378%0.78266%0.657SS**  trans-69.589.2167.9-149-100.5000107.1N84H82-N84 VanDerWaalsContact C-N 3.33Å; H82-N84 PolarHBondContact ND1-OD1 2.8Å; H82-N84 PolarHBondContact O-N 2.79Å
83L45.8Very low52.3Low144 Ų144104.6 Ų104.675%0.75462%0.622SS**  trans-66.2101.4166.9-73174.3000106.4G81 I85G81-L83 VanDerWaalsContact C-N 3.25Å; G81-L83 PolarHBondContact O-N 3.15Å; L83-I85 HydrophobicContact CB-CG1 4.49Å; L83-I85 PolarHBondContact O-N 2.91Å
84N45.6Very low54.5Low137 Ų137103.6 Ų103.673%0.73361%0.611SS**  trans-68.668.4165.4-61-20.7000108.4H82 S86H82-N84 VanDerWaalsContact C-N 3.33Å; H82-N84 PolarHBondContact ND1-OD1 2.8Å; H82-N84 PolarHBondContact O-N 2.79Å; N84-S86 PolarHBondContact O-N 2.92Å
85I43Very low56.5Low133 Ų133100.3 Ų100.368%0.68260%0.598SS**  trans-63.7117.6147.8-64.4160.8000103.1L83 A87L83-I85 HydrophobicContact CB-CG1 4.49Å; L83-I85 PolarHBondContact O-N 2.91Å; I85-A87 PolarHBondContact O-N 2.86Å
86S41.7Very low58.4Low82 Ų8294.9 Ų94.957%0.57357%0.572SS**  trans-39.3114.2178.4-161.30000109.5N84 E88 G89N84-S86 PolarHBondContact O-N 2.92Å; S86-E88 PolarHBondContact O-N 2.98Å; S86-G89 PolarHBondContact O-N 3.37Å
87A52Low60.9Low69 Ų6997.5 Ų97.557%0.5757%0.565SS**THydrogen-bonded Turntrans-58.7-12.5-174.100000113I85 G89I85-A87 PolarHBondContact O-N 2.86Å; A87-G89 VanDerWaalsContact C-N 3.33Å; A87-G89 PolarHBondContact O-N 3.03Å
88E49.4Very low62.6Low144 Ų14491 Ų9167%0.67353%0.53SS*.THydrogen-bonded Turntrans-56.5-36.2167.9-98.364.9-152.400115.1S86S86-E88 PolarHBondContact O-N 2.98Å
89G53.4Low65.1Low34 Ų3491.5 Ų91.535%0.35152%0.522SS..THydrogen-bonded Turntrans-79.4-24.2-17400000114S86 A87S86-G89 PolarHBondContact O-N 3.37Å; A87-G89 VanDerWaalsContact C-N 3.33Å; A87-G89 PolarHBondContact O-N 3.03Å
90D64Low66.6Low101 Ų10186.6 Ų86.654%0.5449%0.489SS..THydrogen-bonded Turntrans-75.8-35.5-179.3-15125.2000109.8E92 M158D90-E92 PolarHBondContact O-N 3.38Å; D90-M158 VanDerWaalsContact C-SD 3.57Å; D90-M158 HydrophobicContact CB-SD 3.88Å; D90-M158 WeakPolarHBondContact O-CE 3.39Å; D90-M158 VanDerWaalsContact OD2-SD 3.41Å
91L80.1Confident68Low58 Ų5882.3 Ų82.330%0.30446%0.46SS..SBendtrans-88.97.4-175.7-63170.2000115P99 Y100 M158L91-P99 CarbonylContact O-C 3.58Å; L91-P99 WeakPolarHBondContact O-CA 3.45Å; L91-Y100 WeakPolarHBondContact O-CD2 3.09Å; L91-Y100 PolarHBondContact O-N 3.08Å; L91-M158 HydrophobicContact CD2-CB 4.27Å; L91-M158 HydrophobicContact CD2-CE 4.3Å; L91-M158 HydrophobicContact CD2-CG 4.47Å; L91-M158 HydrophobicContact CD2-SD 3.6Å; L91-M158 VanDerWaalsContact CD2-SD 3.6Å; L91-M158 HydrophobicContact CG-SD 4.27Å
92E87.4Confident70.1Confident64 Ų6484.1 Ų84.130%0.29946%0.461SS..BIsolated β-bridgetrans-117.1151.7177.468.7172.4-177.500113.3D90 L94 E98 Y100D90-E92 PolarHBondContact O-N 3.38Å; E92-L94 PolarHBondContact O-N 2.97Å; E92-E98 WeakPolarHBondContact CA-O 3.4Å; E92-Y100 WeakPolarHBondContact O-CE2 3.32Å; E92-Y100 PolarHBondContact O-OH 3.23Å
93C89.3Confident71.5Confident0 Ų079.9 Ų79.90%046%0.455CS..  trans-77.9125.4176.6-175.80000112.1V95 C96 R97 E98 Y100 C116 C119C93-V95 PolarHBondContact O-N 2.87Å; C93-C96 VanDerWaalsContact CB-SG 3.59Å; C93-C96 PolarHBondContact O-N 2.85Å; C93-R97 WeakPolarHBondContact O-CA 3.38Å; C93-R97 PolarHBondContact O-N 3.09Å; C93-E98 PolarHBondContact N-O 3.14Å; C93-Y100 WeakPolarHBondContact CA-OH 3.16Å; C93-Y100 HydrophobicContact CB-CE1 3.72Å; C93-C116 HydrophobicContact CB-CB 3.84Å; C93-C116 PolarHBondContact SG-N 2.94Å; C93-C119 PolarHBondContact SG-SG 3.47Å
94L88.8Confident73.3Confident103 Ų10374.4 Ų74.454%0.53943%0.425SS..THydrogen-bonded Turntrans-61.8-16.7179.1-60.8175.8000115E92 F115 L137E92-L94 PolarHBondContact O-N 2.97Å; L94-F115 HydrophobicContact CB-CE1 4.32Å; L94-L137 HydrophobicContact CD1-CD1 3.96Å; L94-L137 HydrophobicContact CD1-CD2 4.4Å
95V88.9Confident75.2Confident71 Ų7169.3 Ų69.343%0.4340%0.4SS..THydrogen-bonded Turntrans-89.8-51.8178.6174.60000111.6C93 F115 C119 P136C93-V95 PolarHBondContact O-N 2.87Å; V95-F115 HydrophobicContact CB-CD1 4.49Å; V95-F115 HydrophobicContact CG2-CD1 3.49Å; V95-F115 VanDerWaalsContact CG2-CD1 3.49Å; V95-F115 HydrophobicContact CG2-CE1 3.8Å; V95-F115 HydrophobicContact CG2-CG 4.44Å; V95-C119 HydrophobicContact CB-CB 4.24Å; V95-C119 HydrophobicContact CG1-CB 4.23Å; V95-P136 HydrophobicContact CG2-CB 4.23Å; V95-P136 HydrophobicContact CG2-CG 3.88Å
96C87.5Confident77.4Confident33 Ų3363.1 Ų63.122%0.22337%0.368CS..THydrogen-bonded Turntrans-100.2-8.9-175.767.30000114.4C93 E98 C119C93-C96 VanDerWaalsContact CB-SG 3.59Å; C93-C96 PolarHBondContact O-N 2.85Å; C96-E98 PolarHBondContact O-N 2.96Å; C96-E98 VanDerWaalsContact SG-CB 3.54Å; C96-C119 PolarHBondContact SG-SG 3.22Å
97R88.1Confident79.8Confident135 Ų13559.8 Ų59.851%0.50934%0.343SS..  trans49.639-174.1-59.1-176.9179151.8-1.4112.4C93 R207C93-R97 WeakPolarHBondContact O-CA 3.38Å; C93-R97 PolarHBondContact O-N 3.09Å; R97-R207 PolarHBondContact O-NH2 2.87Å
98E85.3Confident81.6Confident42 Ų4257.5 Ų57.520%0.19632%0.321CS..  trans-108.5138.8174.7-163.864.8-142.200107.9E92 C93 C96 V203E92-E98 WeakPolarHBondContact CA-O 3.4Å; C93-E98 PolarHBondContact N-O 3.14Å; C96-E98 PolarHBondContact O-N 2.96Å; C96-E98 VanDerWaalsContact SG-CB 3.54Å; E98-V203 WeakPolarHBondContact OE2-CG1 3.44Å
99P84.7Confident83.7Confident69 Ų6950.9 Ų50.945%0.44829%0.29SS..BIsolated β-bridgetrans-55.5143.4172.722.3-34.8000111.6L91L91-P99 CarbonylContact O-C 3.58Å; L91-P99 WeakPolarHBondContact O-CA 3.45Å
100Y84.7Confident85.4Confident15 Ų1552.4 Ų52.46%0.05930%0.296CS..  trans-65.8147.6169.7-62.9-58.8000110L91 E92 C93 R104 P106 C116 M158 L162L91-Y100 WeakPolarHBondContact O-CD2 3.09Å; L91-Y100 PolarHBondContact O-N 3.08Å; E92-Y100 WeakPolarHBondContact O-CE2 3.32Å; E92-Y100 PolarHBondContact O-OH 3.23Å; C93-Y100 WeakPolarHBondContact CA-OH 3.16Å; C93-Y100 HydrophobicContact CB-CE1 3.72Å; Y100-R104 WeakPolarHBondContact CD1-O 3.18Å; Y100-P106 HydrophobicContact CD1-CB 3.84Å; Y100-P106 HydrophobicContact CD1-CG 4.31Å; Y100-P106 HydrophobicContact CD2-CB 4.24Å; Y100-P106 HydrophobicContact CD2-CG 4.4Å; Y100-P106 HydrophobicContact CE1-CB 3.69Å; Y100-P106 HydrophobicContact CE2-CB 4.14Å; Y100-P106 HydrophobicContact CG-CB 4.12Å; Y100-P106 HydrophobicContact CG-CG 4.2Å; Y100-C116 HydrophobicContact CD1-CB 4.35Å; Y100-C116 HydrophobicContact CE1-CB 4.08Å; Y100-M158 HydrophobicContact CD2-CE 3.87Å; Y100-M158 HydrophobicContact CE2-CE 3.8Å; Y100-L162 WeakPolarHBondContact O-CD2 3.08Å
101N82.1Confident86.7Confident60 Ų6048.8 Ų48.832%0.32128%0.278SS..BIsolated β-bridgetrans-152.6177.9173.565.641.5000109.4A103 R104 S105N101-A103 PolarHBondContact O-N 3.27Å; N101-A103 WeakPolarHBondContact OD1-CA 3.33Å; N101-A103 WeakPolarHBondContact OD1-CB 3.42Å; N101-A103 PolarHBondContact OD1-N 3.46Å; N101-R104 CarbonylContact O-C 3.03Å; N101-R104 WeakPolarHBondContact O-CA 3.4Å; N101-R104 PolarHBondContact O-N 3.37Å; N101-R104 WeakPolarHBondContact OD1-CB 3.41Å; N101-R104 PolarHBondContact OD1-N 3.48Å; N101-S105 PolarHBondContact O-N 3.14Å; N101-S105 VanDerWaalsContact O-N 3.1Å
102C79.4Confident87.2Confident104 Ų10451.1 Ų51.170%0.70329%0.287SS*.THydrogen-bonded Turntrans-57.6-31.1179.653.60000113.9
103A79.4Confident87.3Confident79 Ų7951.1 Ų51.165%0.65329%0.287SS*.THydrogen-bonded Turntrans-85.8-18.1174.400000113.4N101N101-A103 PolarHBondContact O-N 3.27Å; N101-A103 WeakPolarHBondContact OD1-CA 3.33Å; N101-A103 WeakPolarHBondContact OD1-CB 3.42Å; N101-A103 PolarHBondContact OD1-N 3.46Å
104R84Confident87.4Confident30 Ų3051.7 Ų51.711%0.11329%0.292CS..BIsolated β-bridgetrans-12351.5-177.4-66.6-179.2164.4-97.4-12.9109.9Y100 N101 V118 V200Y100-R104 WeakPolarHBondContact CD1-O 3.18Å; N101-R104 CarbonylContact O-C 3.03Å; N101-R104 WeakPolarHBondContact O-CA 3.4Å; N101-R104 PolarHBondContact O-N 3.37Å; N101-R104 WeakPolarHBondContact OD1-CB 3.41Å; N101-R104 PolarHBondContact OD1-N 3.48Å; R104-V118 HydrophobicContact CG-CG2 4.15Å; R104-V200 VanDerWaalsContact CZ-CG1 3.46Å
105S86.1Confident87.5Confident29 Ų2946.9 Ų46.920%0.20327%0.267CS..  trans-65.1144.2-176.678.40000111.6N101 K107 A117 D154N101-S105 PolarHBondContact O-N 3.14Å; N101-S105 VanDerWaalsContact O-N 3.1Å; S105-K107 PolarHBondContact O-N 3.05Å; S105-K107 WeakPolarHBondContact OG-CE 3.25Å; S105-A117 PolarHBondContact O-N 3.44Å; S105-D154 PolarHBondContact OG-OD1 3.41Å
106P90Very high87.6Confident3 Ų343.5 Ų43.52%0.01925%0.247CC..EExtended strand (participates in β ladder)trans-73.8117.217528.2-31.7000110.3Y100 A114 D154 Q155Y100-P106 HydrophobicContact CD1-CB 3.84Å; Y100-P106 HydrophobicContact CD1-CG 4.31Å; Y100-P106 HydrophobicContact CD2-CB 4.24Å; Y100-P106 HydrophobicContact CD2-CG 4.4Å; Y100-P106 HydrophobicContact CE1-CB 3.69Å; Y100-P106 HydrophobicContact CE2-CB 4.14Å; Y100-P106 HydrophobicContact CG-CB 4.12Å; Y100-P106 HydrophobicContact CG-CG 4.2Å; P106-A114 HydrophobicContact CB-CB 4.2Å; P106-D154 WeakPolarHBondContact O-CA 3.18Å; P106-Q155 HydrophobicContact CB-CB 4.4Å; P106-Q155 HydrophobicContact CG-CB 4.34Å; P106-Q155 PolarHBondContact O-N 2.95Å; P106-Q155 VanDerWaalsContact O-N 3.16Å
107K90.4Very high87.8Confident12 Ų1243.1 Ų43.15%0.05225%0.246CC..EExtended strand (participates in β ladder)trans-106.4130.8-179.5-69.8-65.6-176.1-174.20111S105 A114 F115 A117 L120 I149 C150 L152 D154S105-K107 PolarHBondContact O-N 3.05Å; S105-K107 WeakPolarHBondContact OG-CE 3.25Å; K107-A114 WeakPolarHBondContact O-CA 3.39Å; K107-F115 PolarHBondContact N-O 3.33Å; K107-F115 PolarHBondContact O-N 3.26Å; K107-F115 VanDerWaalsContact O-N 3.1Å; K107-A117 HydrophobicContact CG-CB 4.1Å; K107-L120 HydrophobicContact CB-CD1 3.4Å; K107-L120 VanDerWaalsContact CB-CD1 3.4Å; K107-L120 HydrophobicContact CG-CD1 4.37Å; K107-I149 HydrophobicContact CG-CG2 4.43Å; K107-C150 PolarHBondContact NZ-O 2.95Å; K107-C150 VanDerWaalsContact NZ-O 3.13Å; K107-L152 HydrophobicContact CB-CB 4.25Å; K107-L152 HydrophobicContact CD-CB 4.18Å; K107-L152 VanDerWaalsContact CD-O 3.27Å; K107-L152 WeakPolarHBondContact CD-O 3.36Å; K107-L152 PolarHBondContact NZ-O 3.32Å; K107-D154 VanDerWaalsContact CD-OD1 3.27Å; K107-D154 WeakPolarHBondContact CD-OD1 3.31Å; K107-D154 WeakPolarHBondContact CE-OD1 3.33Å; K107-D154 IonicContact NZ-OD1 2.91Å; K107-D154 PolarHBondContact NZ-OD1 3.47Å; K107-D154 IonicContact NZ-OD2 3.29Å; K107-D154 PolarHBondContact NZ-OD2 2.94Å
108L91.3Very high87.9Confident21 Ų2139.4 Ų39.411%0.1124%0.238CC..EExtended strand (participates in β ladder)trans-85.9130.9-178.4-72.2164.4000111.9Q112 A114 R153 Q155L108-Q112 WeakPolarHBondContact CD2-O 3.43Å; L108-A114 HydrophobicContact CD2-CB 3.86Å; L108-A114 HydrophobicContact CG-CB 4.42Å; L108-R153 WeakPolarHBondContact CB-O 3.34Å; L108-R153 HydrophobicContact CD1-CB 4.46Å; L108-R153 PolarHBondContact N-O 3.4Å; L108-Q155 HydrophobicContact CD1-CB 4.13Å; L108-Q155 HydrophobicContact CD2-CB 4.33Å; L108-Q155 HydrophobicContact CG-CB 4.09Å
109L92.2Very high88.2Confident5 Ų537.8 Ų37.83%0.02623%0.231CC..  trans-82.1171.3168.7-71.3149.4000111.1C111 Q112 H113 F115 L120 I133 C135 T142L109-C111 PolarHBondContact O-N 3.07Å; L109-C111 VanDerWaalsContact O-N 3.07Å; L109-Q112 PolarHBondContact O-N 3.35Å; L109-H113 PolarHBondContact N-O 3.21Å; L109-F115 HydrophobicContact CD1-CD2 3.41Å; L109-F115 VanDerWaalsContact CD1-CD2 3.41Å; L109-F115 HydrophobicContact CD1-CE2 3.4Å; L109-F115 VanDerWaalsContact CD1-CE2 3.4Å; L109-L120 HydrophobicContact CD1-CD2 4.14Å; L109-L120 HydrophobicContact CD2-CD2 4.29Å; L109-L120 HydrophobicContact CG-CD2 4.31Å; L109-I133 HydrophobicContact CD2-CB 3.93Å; L109-I133 HydrophobicContact CD2-CG2 3.85Å; L109-C135 HydrophobicContact CD1-CB 4.07Å; L109-T142 WeakPolarHBondContact CB-OG1 3Å; L109-T142 HydrophobicContact CD2-CG2 4.17Å; L109-T142 VanDerWaalsContact CD2-OG1 3.25Å; L109-T142 WeakPolarHBondContact CD2-OG1 3.17Å
110S90.4Very high88.6Confident67 Ų6734.5 Ų34.547%0.46921%0.21SC..THydrogen-bonded Turntrans-61.2-18.5176.867.30000113.9V141 T142S110-V141 PolarHBondContact OG-O 2.8Å; S110-T142 PolarHBondContact N-OG1 2.96Å; S110-T142 PolarHBondContact OG-OG1 2.78Å
111C91.3Very high88.9Confident24 Ų2440.9 Ų40.916%0.16224%0.238CC..THydrogen-bonded Turntrans-89.24.9175.357.60000114.2L109 H113 C135 C138 K140L109-C111 PolarHBondContact O-N 3.07Å; L109-C111 VanDerWaalsContact O-N 3.07Å; C111-H113 PolarHBondContact O-N 3.47Å; C111-H113 PolarHBondContact SG-ND1 3.41Å; C111-C135 PolarHBondContact SG-SG 3.43Å; C111-C138 WeakPolarHBondContact CB-SG 3.46Å; C111-K140 HydrophobicContact CB-CB 4.08Å; C111-K140 HydrophobicContact CB-CD 4.02Å; C111-K140 HydrophobicContact CB-CG 4.44Å
112Q89.6Confident89.3Confident107 Ų10744.8 Ų44.850%0.526%0.258SS..SBendtrans68.99.6-179.1-13262.372.700115.8L108 L109L108-Q112 WeakPolarHBondContact CD2-O 3.43Å; L109-Q112 PolarHBondContact O-N 3.35Å
113H90.5Very high89.9Confident65 Ų6542.5 Ų42.530%0.30124%0.238SC..  trans-83.8139.6167.3-63.6119.5000111.1L109 C111 F115 C135 L137L109-H113 PolarHBondContact N-O 3.21Å; C111-H113 PolarHBondContact O-N 3.47Å; C111-H113 PolarHBondContact SG-ND1 3.41Å; H113-F115 HydrophobicContact CB-CE2 3.69Å; H113-F115 HydrophobicContact CB-CZ 4.16Å; H113-C135 PolarHBondContact ND1-SG 2.86Å; H113-C135 VanDerWaalsContact ND1-SG 3.41Å; H113-L137 HydrophobicContact CB-CD1 4.11Å; H113-L137 WeakPolarHBondContact CD2-CD1 3.1Å
114A90.4Very high90.5Very high12 Ų1240.3 Ų40.310%0.09922%0.216CC..EExtended strand (participates in β ladder)trans-105.8142.6177.200000113.1P106 K107 L108 Q155P106-A114 HydrophobicContact CB-CB 4.2Å; K107-A114 WeakPolarHBondContact O-CA 3.39Å; L108-A114 HydrophobicContact CD2-CB 3.86Å; L108-A114 HydrophobicContact CG-CB 4.42Å; A114-Q155 HydrophobicContact CB-CB 4.34Å
115F91.9Very high90.9Very high1 Ų142.7 Ų42.70%0.00423%0.225CC..EExtended strand (participates in β ladder)trans-143.9162.1172.8-56.2-86.8000110.3L94 V95 K107 L109 H113 L120 P136 L137L94-F115 HydrophobicContact CB-CE1 4.32Å; V95-F115 HydrophobicContact CB-CD1 4.49Å; V95-F115 HydrophobicContact CG2-CD1 3.49Å; V95-F115 VanDerWaalsContact CG2-CD1 3.49Å; V95-F115 HydrophobicContact CG2-CE1 3.8Å; V95-F115 HydrophobicContact CG2-CG 4.44Å; K107-F115 PolarHBondContact N-O 3.33Å; K107-F115 PolarHBondContact O-N 3.26Å; K107-F115 VanDerWaalsContact O-N 3.1Å; L109-F115 HydrophobicContact CD1-CD2 3.41Å; L109-F115 VanDerWaalsContact CD1-CD2 3.41Å; L109-F115 HydrophobicContact CD1-CE2 3.4Å; L109-F115 VanDerWaalsContact CD1-CE2 3.4Å; H113-F115 HydrophobicContact CB-CE2 3.69Å; H113-F115 HydrophobicContact CB-CZ 4.16Å; F115-L120 HydrophobicContact CB-CD2 3.83Å; F115-L120 HydrophobicContact CB-CG 4.09Å; F115-L120 HydrophobicContact CD2-CD2 4.1Å; F115-L120 HydrophobicContact CG-CD2 4.31Å; F115-P136 HydrophobicContact CD1-CG 4.37Å; F115-P136 HydrophobicContact CE1-CB 4.08Å; F115-P136 HydrophobicContact CE1-CG 3.91Å; F115-P136 HydrophobicContact CE2-CG 4.31Å; F115-P136 HydrophobicContact CZ-CB 4.06Å; F115-P136 HydrophobicContact CZ-CG 3.89Å; F115-L137 HydrophobicContact CE1-CD1 4.35Å; F115-L137 HydrophobicContact CE1-CG 4.35Å; F115-L137 HydrophobicContact CZ-CD1 3.77Å; F115-L137 HydrophobicContact CZ-CG 3.81Å
116C90.5Very high91.3Very high1 Ų145 Ų451%0.00724%0.238CC..EExtended strand (participates in β ladder)trans-63.6140.9179.890.70000111.2C93 Y100 V118 C119 L120C93-C116 HydrophobicContact CB-CB 3.84Å; C93-C116 PolarHBondContact SG-N 2.94Å; Y100-C116 HydrophobicContact CD1-CB 4.35Å; Y100-C116 HydrophobicContact CE1-CB 4.08Å; C116-V118 PolarHBondContact O-N 3.28Å; C116-V118 VanDerWaalsContact O-N 3.14Å; C116-C119 HydrophobicContact CB-CB 4.26Å; C116-C119 WeakPolarHBondContact CB-SG 3.26Å; C116-C119 WeakPolarHBondContact O-CA 3.31Å; C116-C119 VanDerWaalsContact O-CB 3.26Å; C116-C119 WeakPolarHBondContact O-CB 2.97Å; C116-C119 PolarHBondContact O-N 3.13Å; C116-C119 WeakPolarHBondContact SG-CB 3.4Å; C116-C119 PolarHBondContact SG-N 3.09Å; C116-C119 CovalentContact SG-SG 2.08Å; C116-C119 PolarHBondContact SG-SG 3.33Å; C116-L120 PolarHBondContact O-N 3.43Å
117A90.7Very high91.1Very high25 Ų2551.2 Ų51.221%0.20727%0.266CS..Hα-helixtrans-53.3-36.9178.700000113.1S105 K107 L120 K121 I149S105-A117 PolarHBondContact O-N 3.44Å; K107-A117 HydrophobicContact CG-CB 4.1Å; A117-L120 PolarHBondContact O-N 3.13Å; A117-K121 PolarHBondContact O-N 3.23Å; A117-K121 VanDerWaalsContact O-N 3.09Å; A117-I149 HydrophobicContact CB-CG2 4.44Å
118V90.8Very high91Very high56 Ų5653.8 Ų53.834%0.33930%0.297SS..Hα-helixtrans-60.7-47.3174.6-1780000110.8R104 C116 L120 K121 L122R104-V118 HydrophobicContact CG-CG2 4.15Å; C116-V118 PolarHBondContact O-N 3.28Å; C116-V118 VanDerWaalsContact O-N 3.14Å; V118-L120 PolarHBondContact O-N 3.16Å; V118-K121 VanDerWaalsContact O-CB 3.31Å; V118-K121 WeakPolarHBondContact O-CB 3.2Å; V118-K121 PolarHBondContact O-N 3.02Å; V118-K121 VanDerWaalsContact O-N 3.16Å; V118-L122 HydrophobicContact CG1-CD1 4.13Å; V118-L122 WeakPolarHBondContact O-CD1 3.46Å; V118-L122 PolarHBondContact O-N 3.06Å
119C91.6Very high90.8Very high8 Ų860.6 Ų60.65%0.05433%0.333CS..Hα-helixtrans-63.1-43-178.2-51.70000111.2C93 V95 C96 C116 K121 L122 L123C93-C119 PolarHBondContact SG-SG 3.47Å; V95-C119 HydrophobicContact CB-CB 4.24Å; V95-C119 HydrophobicContact CG1-CB 4.23Å; C96-C119 PolarHBondContact SG-SG 3.22Å; C116-C119 HydrophobicContact CB-CB 4.26Å; C116-C119 WeakPolarHBondContact CB-SG 3.26Å; C116-C119 WeakPolarHBondContact O-CA 3.31Å; C116-C119 VanDerWaalsContact O-CB 3.26Å; C116-C119 WeakPolarHBondContact O-CB 2.97Å; C116-C119 PolarHBondContact O-N 3.13Å; C116-C119 WeakPolarHBondContact SG-CB 3.4Å; C116-C119 PolarHBondContact SG-N 3.09Å; C116-C119 CovalentContact SG-SG 2.08Å; C116-C119 PolarHBondContact SG-SG 3.33Å; C119-K121 VanDerWaalsContact C-N 3.28Å; C119-K121 PolarHBondContact O-N 2.92Å; C119-L122 PolarHBondContact O-N 3.14Å; C119-L123 WeakPolarHBondContact O-CG 3.45Å; C119-L123 PolarHBondContact O-N 2.88Å
120L93.1Very high90.7Very high0 Ų063.9 Ų63.90%035%0.353CS..Hα-helixtrans-64-33.6176.2-68.9-172.1000112.4K107 L109 F115 C116 A117 V118 L122 L123 L124 I133 I149 L152K107-L120 HydrophobicContact CB-CD1 3.4Å; K107-L120 VanDerWaalsContact CB-CD1 3.4Å; K107-L120 HydrophobicContact CG-CD1 4.37Å; L109-L120 HydrophobicContact CD1-CD2 4.14Å; L109-L120 HydrophobicContact CD2-CD2 4.29Å; L109-L120 HydrophobicContact CG-CD2 4.31Å; F115-L120 HydrophobicContact CB-CD2 3.83Å; F115-L120 HydrophobicContact CB-CG 4.09Å; F115-L120 HydrophobicContact CD2-CD2 4.1Å; F115-L120 HydrophobicContact CG-CD2 4.31Å; C116-L120 PolarHBondContact O-N 3.43Å; A117-L120 PolarHBondContact O-N 3.13Å; V118-L120 PolarHBondContact O-N 3.16Å; L120-L122 VanDerWaalsContact C-N 3.32Å; L120-L122 PolarHBondContact O-N 3.46Å; L120-L123 PolarHBondContact O-N 3.33Å; L120-L124 PolarHBondContact O-N 3.18Å; L120-L124 VanDerWaalsContact O-N 3.08Å; L120-I133 HydrophobicContact CB-CD1 4.04Å; L120-I133 HydrophobicContact CD2-CD1 4.4Å; L120-I133 HydrophobicContact CD2-CG2 4.15Å; L120-I149 HydrophobicContact CB-CG2 3.67Å; L120-I149 HydrophobicContact CD1-CG2 3.91Å; L120-I149 HydrophobicContact CG-CG2 4.45Å; L120-L152 HydrophobicContact CD1-CD1 3.87Å
121K91.1Very high90.8Very high149 Ų14965.8 Ų65.865%0.64835%0.351SS*.Hα-helixtrans-62.1-38.3174-166.4176.4178.5178.70112.8A117 V118 C119 L123 I149A117-K121 PolarHBondContact O-N 3.23Å; A117-K121 VanDerWaalsContact O-N 3.09Å; V118-K121 VanDerWaalsContact O-CB 3.31Å; V118-K121 WeakPolarHBondContact O-CB 3.2Å; V118-K121 PolarHBondContact O-N 3.02Å; V118-K121 VanDerWaalsContact O-N 3.16Å; C119-K121 VanDerWaalsContact C-N 3.28Å; C119-K121 PolarHBondContact O-N 2.92Å; K121-L123 VanDerWaalsContact C-N 3.31Å; K121-I149 VanDerWaalsContact CA-CD1 3.47Å; K121-I149 HydrophobicContact CB-CD1 3.63Å; K121-I149 HydrophobicContact CG-CD1 3.82Å
122L90.6Very high90.9Very high142 Ų14265 Ų6574%0.74335%0.345SS*.Hα-helixtrans-72.2-26.7177.6-79.881.3000112.7V118 C119 L120V118-L122 HydrophobicContact CG1-CD1 4.13Å; V118-L122 WeakPolarHBondContact O-CD1 3.46Å; V118-L122 PolarHBondContact O-N 3.06Å; C119-L122 PolarHBondContact O-N 3.14Å; L120-L122 VanDerWaalsContact C-N 3.32Å; L120-L122 PolarHBondContact O-N 3.46Å
123L91.8Very high91.2Very high56 Ų5659.9 Ų59.929%0.29332%0.321SS..Hα-helixtrans-92.1-5.6-178.8-66.5165.6000113.2C119 L120 K121 I133 P134 P136C119-L123 WeakPolarHBondContact O-CG 3.45Å; C119-L123 PolarHBondContact O-N 2.88Å; L120-L123 PolarHBondContact O-N 3.33Å; K121-L123 VanDerWaalsContact C-N 3.31Å; L123-I133 HydrophobicContact CB-CG2 3.86Å; L123-P134 WeakPolarHBondContact O-CD 3.4Å; L123-P136 HydrophobicContact CD1-CG 3.62Å
124L93.1Very high91.4Very high34 Ų3459 Ų5918%0.17832%0.321CS..  trans-72.2126.3179.2-171.172.9000110L120 W131 I133 V144 I149L120-L124 PolarHBondContact O-N 3.18Å; L120-L124 VanDerWaalsContact O-N 3.08Å; L124-W131 HydrophobicContact CD1-CB 4.02Å; L124-W131 HydrophobicContact CD1-CE3 4.42Å; L124-W131 HydrophobicContact CD2-CD2 4.31Å; L124-W131 HydrophobicContact CD2-CE3 3.5Å; L124-W131 HydrophobicContact CD2-CZ3 3.94Å; L124-W131 HydrophobicContact CG-CE3 3.73Å; L124-W131 HydrophobicContact CG-CZ3 4.37Å; L124-I133 HydrophobicContact CB-CG1 4.25Å; L124-I133 HydrophobicContact CD1-CD1 3.88Å; L124-I133 HydrophobicContact CD1-CG1 3.43Å; L124-I133 VanDerWaalsContact CD1-CG1 3.43Å; L124-I133 HydrophobicContact CG-CG1 4.45Å; L124-V144 HydrophobicContact CD1-CB 4.11Å; L124-V144 HydrophobicContact CD1-CG2 3.99Å; L124-I149 HydrophobicContact CD2-CD1 4.15Å; L124-I149 HydrophobicContact CD2-CG1 4.49Å
125Y92.8Very high91.5Very high80 Ų8058.5 Ų58.531%0.31432%0.317SS..EExtended strand (participates in β ladder)trans-133.3164.9174.673.6-82.7000110.8Q127 W131 S132 P134Y125-Q127 HydrophobicContact CD2-CB 4.45Å; Y125-Q127 HydrophobicContact CE2-CB 3.92Å; Y125-W131 CarbonylContact O-C 3.58Å; Y125-W131 WeakPolarHBondContact O-CA 3.27Å; Y125-S132 WeakPolarHBondContact CD1-O 3.33Å; Y125-S132 WeakPolarHBondContact CE1-O 3.27Å; Y125-S132 PolarHBondContact N-O 3.1Å; Y125-S132 PolarHBondContact O-N 3.5Å; Y125-P134 HydrophobicContact CD1-CG 4.43Å; Y125-P134 HydrophobicContact CE1-CG 4.04Å
126V92.8Very high91.6Very high78 Ų7861.5 Ų61.547%0.47334%0.337SS..EExtended strand (participates in β ladder)trans-106.1130.6177.7-178.90000109.2G128 W131V126-G128 WeakPolarHBondContact CG1-O 3.4Å; V126-W131 HydrophobicContact CG2-CD2 3.63Å; V126-W131 HydrophobicContact CG2-CE3 3.35Å; V126-W131 HydrophobicContact CG2-CG 4.4Å; V126-W131 HydrophobicContact CG2-CH2 3.75Å; V126-W131 HydrophobicContact CG2-CZ2 3.97Å; V126-W131 HydrophobicContact CG2-CZ3 3.43Å; V126-W131 VanDerWaalsContact CG2-CZ3 3.43Å
127Q86.7Confident91.6Very high132 Ų13265.9 Ų65.962%0.61736%0.36SS*.EExtended strand (participates in β ladder)trans-124.3109.7169.9-172.1172.15900108.7Y125 D129 T130Y125-Q127 HydrophobicContact CD2-CB 4.45Å; Y125-Q127 HydrophobicContact CE2-CB 3.92Å; Q127-D129 PolarHBondContact O-N 3.03Å; Q127-T130 PolarHBondContact N-O 2.81Å; Q127-T130 PolarHBondContact O-N 3.4Å; Q127-T130 VanDerWaalsContact O-N 3.13Å
128G87.4Confident91.7Very high67 Ų6767.4 Ų67.469%0.69137%0.368SS*.THydrogen-bonded Turntrans61.8-119.3-168.500000110.4V126V126-G128 WeakPolarHBondContact CG1-O 3.4Å
129D87.1Confident91.8Very high164 Ų16475.1 Ų75.188%0.87739%0.391SS*.THydrogen-bonded Turntrans-1025177.8-58.5-38.9000113.4Q127Q127-D129 PolarHBondContact O-N 3.03Å
130T90.6Very high91.9Very high73 Ų7380.6 Ų80.645%0.44841%0.414SS..EExtended strand (participates in β ladder)trans-110.7125.6-175.2-54.80000111.5Q127 A143Q127-T130 PolarHBondContact N-O 2.81Å; Q127-T130 PolarHBondContact O-N 3.4Å; Q127-T130 VanDerWaalsContact O-N 3.13Å; T130-A143 HydrophobicContact CG2-CB 4.05Å
131W93.6Very high92Very high108 Ų10883.8 Ų83.841%0.40943%0.433SS..EExtended strand (participates in β ladder)trans-76134.4169.9-58.782.3000110.2L124 Y125 V126 V144L124-W131 HydrophobicContact CD1-CB 4.02Å; L124-W131 HydrophobicContact CD1-CE3 4.42Å; L124-W131 HydrophobicContact CD2-CD2 4.31Å; L124-W131 HydrophobicContact CD2-CE3 3.5Å; L124-W131 HydrophobicContact CD2-CZ3 3.94Å; L124-W131 HydrophobicContact CG-CE3 3.73Å; L124-W131 HydrophobicContact CG-CZ3 4.37Å; Y125-W131 CarbonylContact O-C 3.58Å; Y125-W131 WeakPolarHBondContact O-CA 3.27Å; V126-W131 HydrophobicContact CG2-CD2 3.63Å; V126-W131 HydrophobicContact CG2-CE3 3.35Å; V126-W131 HydrophobicContact CG2-CG 4.4Å; V126-W131 HydrophobicContact CG2-CH2 3.75Å; V126-W131 HydrophobicContact CG2-CZ2 3.97Å; V126-W131 HydrophobicContact CG2-CZ3 3.43Å; V126-W131 VanDerWaalsContact CG2-CZ3 3.43Å; W131-V144 HydrophobicContact CB-CB 4.35Å; W131-V144 WeakPolarHBondContact CB-O 3.32Å; W131-V144 PolarHBondContact O-N 2.86Å
132S93.3Very high92.1Very high6 Ų677.1 Ų77.14%0.04241%0.405CS..EExtended strand (participates in β ladder)trans-140146.5-170-69.30000111.1Y125 T142Y125-S132 WeakPolarHBondContact CD1-O 3.33Å; Y125-S132 WeakPolarHBondContact CE1-O 3.27Å; Y125-S132 PolarHBondContact N-O 3.1Å; Y125-S132 PolarHBondContact O-N 3.5Å; S132-T142 WeakPolarHBondContact CA-O 3.27Å
133I94.8Very high92.1Very high0 Ų073.1 Ų73.10%039%0.393CS..EExtended strand (participates in β ladder)trans-126.3125.7173.5-55.3175.1000108.8L109 L120 L123 L124 V141 T142 V144 I149 L152L109-I133 HydrophobicContact CD2-CB 3.93Å; L109-I133 HydrophobicContact CD2-CG2 3.85Å; L120-I133 HydrophobicContact CB-CD1 4.04Å; L120-I133 HydrophobicContact CD2-CD1 4.4Å; L120-I133 HydrophobicContact CD2-CG2 4.15Å; L123-I133 HydrophobicContact CB-CG2 3.86Å; L124-I133 HydrophobicContact CB-CG1 4.25Å; L124-I133 HydrophobicContact CD1-CD1 3.88Å; L124-I133 HydrophobicContact CD1-CG1 3.43Å; L124-I133 VanDerWaalsContact CD1-CG1 3.43Å; L124-I133 HydrophobicContact CG-CG1 4.45Å; I133-V141 WeakPolarHBondContact O-CA 3.34Å; I133-T142 PolarHBondContact N-O 2.82Å; I133-T142 PolarHBondContact O-N 2.92Å; I133-V144 HydrophobicContact CD1-CG2 3.7Å; I133-V144 HydrophobicContact CG1-CG2 3.86Å; I133-I149 HydrophobicContact CD1-CG1 4.38Å; I133-L152 HydrophobicContact CD1-CD1 4.34Å
134P94.4Very high92.1Very high46 Ų4670.5 Ų70.530%0.29938%0.379SS..EExtended strand (participates in β ladder)trans-83.4129.2170.531.3-21.5000109.5L123 Y125 P136L123-P134 WeakPolarHBondContact O-CD 3.4Å; Y125-P134 HydrophobicContact CD1-CG 4.43Å; Y125-P134 HydrophobicContact CE1-CG 4.04Å; P134-P136 WeakPolarHBondContact O-CD 3.33Å
135C94.1Very high91.6Very high3 Ų373.6 Ų73.62%0.0240%0.401CS..  trans-63.2126.2175.3-179.90000111.3L109 C111 H113 L137 C138 R139 K140L109-C135 HydrophobicContact CD1-CB 4.07Å; C111-C135 PolarHBondContact SG-SG 3.43Å; H113-C135 PolarHBondContact ND1-SG 2.86Å; H113-C135 VanDerWaalsContact ND1-SG 3.41Å; C135-L137 PolarHBondContact O-N 3.27Å; C135-L137 PolarHBondContact SG-N 3.29Å; C135-L137 VanDerWaalsContact SG-N 3.43Å; C135-C138 VanDerWaalsContact SG-SG 3.61Å; C135-R139 WeakPolarHBondContact O-CA 3.25Å; C135-R139 PolarHBondContact O-N 3.27Å; C135-K140 WeakPolarHBondContact CB-O 3.42Å; C135-K140 PolarHBondContact N-O 3.26Å
136P93Very high91.1Very high63 Ų6372.6 Ų72.641%0.40942%0.415SS..THydrogen-bonded Turntrans-59.5-27.3176-27.235.1000114.8V95 F115 L123 P134V95-P136 HydrophobicContact CG2-CB 4.23Å; V95-P136 HydrophobicContact CG2-CG 3.88Å; F115-P136 HydrophobicContact CD1-CG 4.37Å; F115-P136 HydrophobicContact CE1-CB 4.08Å; F115-P136 HydrophobicContact CE1-CG 3.91Å; F115-P136 HydrophobicContact CE2-CG 4.31Å; F115-P136 HydrophobicContact CZ-CB 4.06Å; F115-P136 HydrophobicContact CZ-CG 3.89Å; L123-P136 HydrophobicContact CD1-CG 3.62Å; P134-P136 WeakPolarHBondContact O-CD 3.33Å
137L91.1Very high90.7Very high94 Ų9469.6 Ų69.649%0.49240%0.4SS..THydrogen-bonded Turntrans-88.5-48.8-176.8-67.4170.3000112.5L94 H113 F115 C135L94-L137 HydrophobicContact CD1-CD1 3.96Å; L94-L137 HydrophobicContact CD1-CD2 4.4Å; H113-L137 HydrophobicContact CB-CD1 4.11Å; H113-L137 WeakPolarHBondContact CD2-CD1 3.1Å; F115-L137 HydrophobicContact CE1-CD1 4.35Å; F115-L137 HydrophobicContact CE1-CG 4.35Å; F115-L137 HydrophobicContact CZ-CD1 3.77Å; F115-L137 HydrophobicContact CZ-CG 3.81Å; C135-L137 PolarHBondContact O-N 3.27Å; C135-L137 PolarHBondContact SG-N 3.29Å; C135-L137 VanDerWaalsContact SG-N 3.43Å
138C91.9Very high90.7Very high57 Ų5768 Ų6839%0.38540%0.395SS..THydrogen-bonded Turntrans-120.24.1-170.173.60000114.2C111 C135 K140C111-C138 WeakPolarHBondContact CB-SG 3.46Å; C135-C138 VanDerWaalsContact SG-SG 3.61Å; C138-K140 PolarHBondContact O-N 2.9Å
139R93.8Very high90.6Very high218 Ų21865.7 Ų65.782%0.82337%0.366SS*.  trans58.81.2179.6-55.6-177.3-179.6-136.70.5116.2C135 V141C135-R139 WeakPolarHBondContact O-CA 3.25Å; C135-R139 PolarHBondContact O-N 3.27Å; R139-V141 PolarHBondContact O-N 3.2Å
140K94.4Very high90.2Very high122 Ų12262 Ų6253%0.5335%0.353SS..  trans-61.7130.6174-176.5174.3-72.2-165.30109.5C111 C135 C138C111-K140 HydrophobicContact CB-CB 4.08Å; C111-K140 HydrophobicContact CB-CD 4.02Å; C111-K140 HydrophobicContact CB-CG 4.44Å; C135-K140 WeakPolarHBondContact CB-O 3.42Å; C135-K140 PolarHBondContact N-O 3.26Å; C138-K140 PolarHBondContact O-N 2.9Å
141V93.1Very high89.6Confident68 Ų6862 Ų6241%0.41236%0.356SS..EExtended strand (participates in β ladder)trans-82135179.7-1780000110S110 I133 R139S110-V141 PolarHBondContact OG-O 2.8Å; I133-V141 WeakPolarHBondContact O-CA 3.34Å; R139-V141 PolarHBondContact O-N 3.2Å
142T93.6Very high89Confident8 Ų857.8 Ų57.85%0.04934%0.341CS..EExtended strand (participates in β ladder)trans-112.1120171.4-56.80000108.4L109 S110 S132 I133 L152L109-T142 WeakPolarHBondContact CB-OG1 3Å; L109-T142 HydrophobicContact CD2-CG2 4.17Å; L109-T142 VanDerWaalsContact CD2-OG1 3.25Å; L109-T142 WeakPolarHBondContact CD2-OG1 3.17Å; S110-T142 PolarHBondContact N-OG1 2.96Å; S110-T142 PolarHBondContact OG-OG1 2.78Å; S132-T142 WeakPolarHBondContact CA-O 3.27Å; I133-T142 PolarHBondContact N-O 2.82Å; I133-T142 PolarHBondContact O-N 2.92Å; T142-L152 HydrophobicContact CG2-CD2 4.15Å
143A91.8Very high88.5Confident59 Ų5966.2 Ų66.249%0.48837%0.372SS..EExtended strand (participates in β ladder)trans-72.5135.7170.700000109.5T130T130-A143 HydrophobicContact CG2-CB 4.05Å
144V90.8Very high87.9Confident0 Ų068.6 Ų68.60%039%0.385CS..  trans-11997.5-180-174.80000107.9L124 W131 I133 G146 G147 L152L124-V144 HydrophobicContact CD1-CB 4.11Å; L124-V144 HydrophobicContact CD1-CG2 3.99Å; W131-V144 HydrophobicContact CB-CB 4.35Å; W131-V144 WeakPolarHBondContact CB-O 3.32Å; W131-V144 PolarHBondContact O-N 2.86Å; I133-V144 HydrophobicContact CD1-CG2 3.7Å; I133-V144 HydrophobicContact CG1-CG2 3.86Å; V144-G146 PolarHBondContact O-N 3.05Å; V144-G146 VanDerWaalsContact O-N 3.15Å; V144-G147 PolarHBondContact O-N 3.06Å; V144-L152 HydrophobicContact CG2-CD1 4.48Å
145P83.4Confident86.9Confident100 Ų10068.7 Ų68.765%0.64938%0.381SS*.G310 helixtrans-54.5123.8178.4-25.134.6000111G147P145-G147 PolarHBondContact O-N 2.08Å; P145-G147 VanDerWaalsContact O-N 3.14Å
146G82.4Confident85.2Confident59 Ų5975.8 Ų75.861%0.60841%0.414SS*.G310 helixtrans64.912.2-179.400000115.8V144 L148V144-G146 PolarHBondContact O-N 3.05Å; V144-G146 VanDerWaalsContact O-N 3.15Å; G146-L148 PolarHBondContact O-N 2.89Å; G146-L148 VanDerWaalsContact O-N 3.13Å
147G83.7Confident83.3Confident14 Ų1477.1 Ų77.114%0.14443%0.431CS..G310 helixtrans68.97.7178.200000114.8V144 P145 I149V144-G147 PolarHBondContact O-N 3.06Å; P145-G147 PolarHBondContact O-N 2.08Å; P145-G147 VanDerWaalsContact O-N 3.14Å; G147-I149 PolarHBondContact O-N 3.36Å; G147-I149 VanDerWaalsContact O-N 3.09Å
148L86.1Confident81.6Confident98 Ų9873.2 Ų73.251%0.51341%0.41SS..  trans-79.491.8-178.7-71.7122.8000110.6G146 C150 S151G146-L148 PolarHBondContact O-N 2.89Å; G146-L148 VanDerWaalsContact O-N 3.13Å; L148-C150 PolarHBondContact O-N 3.38Å; L148-C150 VanDerWaalsContact O-N 3.14Å; L148-S151 WeakPolarHBondContact O-CB 3.26Å; L148-S151 PolarHBondContact O-N 3.33Å; L148-S151 PolarHBondContact O-OG 2.94Å
149I85.3Confident79.7Confident19 Ų1973.6 Ų73.610%0.09741%0.411CS..G310 helixtrans-58.8-28.4177.1-59.9127000112K107 A117 L120 K121 L124 I133 G147 S151 L152K107-I149 HydrophobicContact CG-CG2 4.43Å; A117-I149 HydrophobicContact CB-CG2 4.44Å; L120-I149 HydrophobicContact CB-CG2 3.67Å; L120-I149 HydrophobicContact CD1-CG2 3.91Å; L120-I149 HydrophobicContact CG-CG2 4.45Å; K121-I149 VanDerWaalsContact CA-CD1 3.47Å; K121-I149 HydrophobicContact CB-CD1 3.63Å; K121-I149 HydrophobicContact CG-CD1 3.82Å; L124-I149 HydrophobicContact CD2-CD1 4.15Å; L124-I149 HydrophobicContact CD2-CG1 4.49Å; I133-I149 HydrophobicContact CD1-CG1 4.38Å; G147-I149 PolarHBondContact O-N 3.36Å; G147-I149 VanDerWaalsContact O-N 3.09Å; I149-S151 PolarHBondContact O-N 3.31Å; I149-L152 HydrophobicContact CG2-CD1 4.36Å; I149-L152 WeakPolarHBondContact O-CB 2.86Å; I149-L152 PolarHBondContact O-N 3.38Å; I149-L152 VanDerWaalsContact O-N 3.13Å
150C78.9Confident77.8Confident88 Ų8866.3 Ų66.360%0.59540%0.403SS*.G310 helixtrans-61.6-2217552.30000113.6K107 L148 L152K107-C150 PolarHBondContact NZ-O 2.95Å; K107-C150 VanDerWaalsContact NZ-O 3.13Å; L148-C150 PolarHBondContact O-N 3.38Å; L148-C150 VanDerWaalsContact O-N 3.14Å; C150-L152 VanDerWaalsContact C-N 3.26Å; C150-L152 PolarHBondContact O-N 3Å
151S78.1Confident75.7Confident72 Ų7268.2 Ų68.250%0.50341%0.414SS..G310 helixtrans-77.2-10176.980.10000113.6L148 I149L148-S151 WeakPolarHBondContact O-CB 3.26Å; L148-S151 PolarHBondContact O-N 3.33Å; L148-S151 PolarHBondContact O-OG 2.94Å; I149-S151 PolarHBondContact O-N 3.31Å
152L82.3Confident73.7Confident20 Ų2067.6 Ų67.611%0.10541%0.408CS..SBendtrans-72.7146174.2-62.3176.9000110K107 L120 I133 T142 V144 I149 C150 D154K107-L152 HydrophobicContact CB-CB 4.25Å; K107-L152 HydrophobicContact CD-CB 4.18Å; K107-L152 VanDerWaalsContact CD-O 3.27Å; K107-L152 WeakPolarHBondContact CD-O 3.36Å; K107-L152 PolarHBondContact NZ-O 3.32Å; L120-L152 HydrophobicContact CD1-CD1 3.87Å; I133-L152 HydrophobicContact CD1-CD1 4.34Å; T142-L152 HydrophobicContact CG2-CD2 4.15Å; V144-L152 HydrophobicContact CG2-CD1 4.48Å; I149-L152 HydrophobicContact CG2-CD1 4.36Å; I149-L152 WeakPolarHBondContact O-CB 2.86Å; I149-L152 PolarHBondContact O-N 3.38Å; I149-L152 VanDerWaalsContact O-N 3.13Å; C150-L152 VanDerWaalsContact C-N 3.26Å; C150-L152 PolarHBondContact O-N 3Å; L152-D154 PolarHBondContact O-N 2.88Å
153R82.3Confident71.3Confident182 Ų18270.5 Ų70.569%0.68743%0.433SS*.PPolyproline II helixtrans-62.5135.3-179.5-69-168.8-77.2176.5-2110.3L108L108-R153 WeakPolarHBondContact CB-O 3.34Å; L108-R153 HydrophobicContact CD1-CB 4.46Å; L108-R153 PolarHBondContact N-O 3.4Å
154D81.3Confident69.1Low51 Ų5174.9 Ų74.927%0.27345%0.447SS..BIsolated β-bridgetrans-75.7150.2170-65.6-69.1000109.9S105 P106 K107 L152 E156S105-D154 PolarHBondContact OG-OD1 3.41Å; P106-D154 WeakPolarHBondContact O-CA 3.18Å; K107-D154 VanDerWaalsContact CD-OD1 3.27Å; K107-D154 WeakPolarHBondContact CD-OD1 3.31Å; K107-D154 WeakPolarHBondContact CE-OD1 3.33Å; K107-D154 IonicContact NZ-OD1 2.91Å; K107-D154 PolarHBondContact NZ-OD1 3.47Å; K107-D154 IonicContact NZ-OD2 3.29Å; K107-D154 PolarHBondContact NZ-OD2 2.94Å; L152-D154 PolarHBondContact O-N 2.88Å; D154-E156 VanDerWaalsContact C-N 3.34Å; D154-E156 PolarHBondContact O-N 2.8Å
155Q73.6Confident66.6Low47 Ų4780.1 Ų80.122%0.2248%0.481CS..  trans-77.987.4172.8-174.5166-45.200109.7P106 L108 A114 A157 M158P106-Q155 HydrophobicContact CB-CB 4.4Å; P106-Q155 HydrophobicContact CG-CB 4.34Å; P106-Q155 PolarHBondContact O-N 2.95Å; P106-Q155 VanDerWaalsContact O-N 3.16Å; L108-Q155 HydrophobicContact CD1-CB 4.13Å; L108-Q155 HydrophobicContact CD2-CB 4.33Å; L108-Q155 HydrophobicContact CG-CB 4.09Å; A114-Q155 HydrophobicContact CB-CB 4.34Å; Q155-A157 PolarHBondContact O-N 3.14Å; Q155-M158 PolarHBondContact O-N 3.42Å
156E59.1Low64.4Low152 Ų15278.9 Ų78.971%0.7147%0.474SS*.Hα-helixtrans-51.6-26.6-176.8-63.2-74.6112.400114.2D154 M158D154-E156 VanDerWaalsContact C-N 3.34Å; D154-E156 PolarHBondContact O-N 2.8Å; E156-M158 VanDerWaalsContact C-N 3.28Å; E156-M158 PolarHBondContact O-N 3.42Å
157A53.5Low62.5Low92 Ų9281.9 Ų81.976%0.7648%0.483SS*.Hα-helixtrans-71.1-14.9-176.400000115Q155Q155-A157 PolarHBondContact O-N 3.14Å
158M53.6Low60.6Low11 Ų1189.5 Ų89.55%0.05452%0.515CS..Hα-helixtrans-117.1-1.6179.2-69-146.7-61.700114.5D90 L91 Y100 Q155 E156 G160 L162D90-M158 VanDerWaalsContact C-SD 3.57Å; D90-M158 HydrophobicContact CB-SD 3.88Å; D90-M158 WeakPolarHBondContact O-CE 3.39Å; D90-M158 VanDerWaalsContact OD2-SD 3.41Å; L91-M158 HydrophobicContact CD2-CB 4.27Å; L91-M158 HydrophobicContact CD2-CE 4.3Å; L91-M158 HydrophobicContact CD2-CG 4.47Å; L91-M158 HydrophobicContact CD2-SD 3.6Å; L91-M158 VanDerWaalsContact CD2-SD 3.6Å; L91-M158 HydrophobicContact CG-SD 4.27Å; Y100-M158 HydrophobicContact CD2-CE 3.87Å; Y100-M158 HydrophobicContact CE2-CE 3.8Å; Q155-M158 PolarHBondContact O-N 3.42Å; E156-M158 VanDerWaalsContact C-N 3.28Å; E156-M158 PolarHBondContact O-N 3.42Å; M158-G160 PolarHBondContact O-N 3.32Å; M158-L162 WeakPolarHBondContact O-CD1 3.47Å; M158-L162 PolarHBondContact O-N 2.91Å
159V53.7Low58.8Low66 Ų6690.5 Ų90.540%0.453%0.525SS..Hα-helixtrans-71.1-24.5175.31800000110.8Q161 L162 A163V159-Q161 VanDerWaalsContact C-N 3.28Å; V159-Q161 PolarHBondContact O-N 2.88Å; V159-L162 PolarHBondContact O-N 3.46Å; V159-A163 WeakPolarHBondContact O-CB 3.34Å; V159-A163 PolarHBondContact O-N 2.89Å
160G53Low56.3Low65 Ų6599.6 Ų99.667%0.6756%0.558SS**Hα-helixtrans-64.4-25.117700000115.2M158M158-G160 PolarHBondContact O-N 3.32Å
161Q50.3Low54.6Low161 Ų161102.9 Ų102.975%0.75257%0.569SS**Hα-helixtrans-97.6-21.8176.2-64.5-81.3900112.4V159 A163V159-Q161 VanDerWaalsContact C-N 3.28Å; V159-Q161 PolarHBondContact O-N 2.88Å; Q161-A163 VanDerWaalsContact C-N 3.3Å
162L50.7Low52.6Low55 Ų55102.3 Ų102.329%0.28856%0.564SS.*Hα-helixtrans-83.4-8.2173.9-75159.4000112.9Y100 M158 V159 L164Y100-L162 WeakPolarHBondContact O-CD2 3.08Å; M158-L162 WeakPolarHBondContact O-CD1 3.47Å; M158-L162 PolarHBondContact O-N 2.91Å; V159-L162 PolarHBondContact O-N 3.46Å; L162-L164 PolarHBondContact O-N 3.47Å
163A44.4Very low50.9Low70 Ų70107.5 Ų107.558%0.57960%0.599SS**  trans-72.941171.700000112.4V159 Q161 P165V159-A163 WeakPolarHBondContact O-CB 3.34Å; V159-A163 PolarHBondContact O-N 2.89Å; Q161-A163 VanDerWaalsContact C-N 3.3Å; A163-P165 WeakPolarHBondContact O-CD 3.3Å
164L44.2Very low48.8Very low150 Ų150106.8 Ų106.879%0.78560%0.603SS**SBendtrans-67.4118.5149.3-140.781.4000104.6L162 C166L162-L164 PolarHBondContact O-N 3.47Å; L164-C166 PolarHBondContact O-N 3.3Å
165P38.3Very low46.7Very low110 Ų110107.9 Ų107.971%0.71463%0.627SS**PPolyproline II helixtrans-56116.9-178.2-18.929.5000107.5A163A163-P165 WeakPolarHBondContact O-CD 3.3Å
166C37.3Very low45.2Very low74 Ų74114 Ų11450%0.566%0.66SS.*PPolyproline II helixtrans-46.5133.9151.1-61.60000105.3L164 E168L164-C166 PolarHBondContact O-N 3.3Å; C166-E168 PolarHBondContact O-N 2.88Å
167P43.8Very low44.2Very low122 Ų122113.6 Ų113.679%0.79267%0.668SS**  trans-54.998177.2-23.132.2000108.1V169P167-V169 VanDerWaalsContact C-N 3.31Å; P167-V169 PolarHBondContact O-N 3.39Å
168E42.7Very low43.4Very low175 Ų175112.7 Ų112.782%0.81867%0.668SS**  trans-65.2104.2172.7-173.9157.5156.600103.3C166 R170C166-E168 PolarHBondContact O-N 2.88Å; E168-R170 PolarHBondContact O-N 3.19Å
169V47.6Very low42.4Very low119 Ų119118 Ų11872%0.72171%0.706SS**  trans-63.188.9169.4177.60000104.7P167 L171P167-V169 VanDerWaalsContact C-N 3.31Å; P167-V169 PolarHBondContact O-N 3.39Å; V169-L171 HydrophobicContact CG1-CD2 4.19Å; V169-L171 HydrophobicContact CG1-CG 4.23Å; V169-L171 PolarHBondContact O-N 2.89Å
170R34.6Very low41.9Very low210 Ų210118.8 Ų118.879%0.79272%0.719SS**  trans-6785.9177.2-162.5-177.7-174.5136.21106E168 C172E168-R170 PolarHBondContact O-N 3.19Å; R170-C172 PolarHBondContact O-N 3.49Å
171L42.3Very low41.1Very low156 Ų156122.1 Ų122.182%0.81773%0.727SS**  trans-68.283.8165.3-67.8173.9000106.6V169V169-L171 HydrophobicContact CG1-CD2 4.19Å; V169-L171 HydrophobicContact CG1-CG 4.23Å; V169-L171 PolarHBondContact O-N 2.89Å
172C35.8Very low40.4Very low60 Ų60119.6 Ų119.641%0.40573%0.727SS.*  trans-62.4135165.6-70.70000108.1R170 Q174R170-C172 PolarHBondContact O-N 3.49Å; C172-Q174 VanDerWaalsContact C-N 3.29Å; C172-Q174 HydrophobicContact CB-CG 4.19Å; C172-Q174 PolarHBondContact O-N 3.46Å
173P47.7Very low40Very low130 Ų130121.9 Ų121.984%0.84475%0.753SS**  trans-76.188.7167.330.5-28.1000107.4G175P173-G175 PolarHBondContact O-N 3.45Å
174Q37.4Very low39.6Very low166 Ų166123.3 Ų123.378%0.77677%0.766SS**  trans-80.9115.7172.9-47.1-7920.800107.6C172C172-Q174 VanDerWaalsContact C-N 3.29Å; C172-Q174 HydrophobicContact CB-CG 4.19Å; C172-Q174 PolarHBondContact O-N 3.46Å
175G37.2Very low39.3Very low75 Ų75127 Ų12777%0.77377%0.769SS**  trans-53.8141.4-176.900000114.4P173 V177P173-G175 PolarHBondContact O-N 3.45Å; G175-V177 PolarHBondContact O-N 3.16Å
176L41.8Very low39.3Very low174 Ų174127.6 Ų127.691%0.91177%0.773SS**  trans-33.8120.3158.9-152.984.3000112.9
177V37.8Very low39.3Very low145 Ų145127.9 Ų127.988%0.87978%0.78SS**  trans-178.8120.4137.6145.70000110.1G175G175-V177 PolarHBondContact O-N 3.16Å
178G37.6Very low39.3Very low73 Ų73128.1 Ų128.175%0.75378%0.775SS**  trans93.996.9136.500000120.9
179S33.4Very low38.7Very low122 Ų122129.3 Ų129.385%0.85377%0.772SS**  90.996.3128.2-138.40000121.4
180A41.1Very low38.7Very low82 Ų82128.9 Ų128.968%0.67877%0.77SS**  64.411612100000122.1
181T36.9Very low39.4Very low136 Ų136122 Ų12283%0.83477%0.765SS**  trans80.5103.1135.3-44.10000118.2
182S35.8Very low39.5Very low108 Ų108122.5 Ų122.576%0.75576%0.763SS**  179.7143.289.477.80000112.3
183A43.1Very low39.9Very low102 Ų102125.8 Ų125.884%0.84378%0.776SS**  trans-1.5113.716100000119.5
184A35.9Very low39.9Very low101 Ų101125.5 Ų125.584%0.83577%0.768SS**  trans-139.9118.1138.500000109
185R36.3Very low40.2Very low227 Ų227125.7 Ų125.786%0.85777%0.769SS**  trans-44.7142.7178.1-170.2-179.8-81.9113.4-7.6112.1A187R185-A187 PolarHBondContact O-N 3.16Å; R185-A187 VanDerWaalsContact O-N 3.08Å
186P40.2Very low40.7Very low123 Ų123128 Ų12880%0.79976%0.763SS**  trans-70.1108.6171.527.9-29.2000108.4N188P186-N188 PolarHBondContact O-N 2.83Å; P186-N188 VanDerWaalsContact O-N 3.13Å
187A36.3Very low41.3Very low79 Ų79124.5 Ų124.565%0.65375%0.749SS**  trans-72.4101.216200000106.8R185 W189R185-A187 PolarHBondContact O-N 3.16Å; R185-A187 VanDerWaalsContact O-N 3.08Å; A187-W189 PolarHBondContact O-N 3.28Å
188N42.8Very low42Very low127 Ų127120.3 Ų120.368%0.67972%0.723SS**  trans-52.4101.6160-176.750.9000108.9P186 T190P186-N188 PolarHBondContact O-N 2.83Å; P186-N188 VanDerWaalsContact O-N 3.13Å; N188-T190 PolarHBondContact ND2-OG1 3.41Å
189W32.2Very low42.8Very low201 Ų201119.3 Ų119.376%0.76171%0.705SS**  trans-112.475.8158.4-78.4101.1000108A187 G191A187-W189 PolarHBondContact O-N 3.28Å; W189-G191 PolarHBondContact O-N 2.71Å
190T45.5Very low44Very low109 Ų109116.2 Ų116.267%0.66968%0.681SS**  trans-52.2112.7142.531.40000109N188N188-T190 PolarHBondContact ND2-OG1 3.41Å
191G49.9Very low45.1Very low67 Ų67117.6 Ų117.669%0.69168%0.677SS**  trans138.332.4165.700000117.8W189W189-G191 PolarHBondContact O-N 2.71Å
192E45.5Very low46.7Very low166 Ų166118.1 Ų118.178%0.77666%0.664SS**  trans-125.570.2173.5-78.716186.800110.1
193D44.4Very low48.2Very low128 Ų128115.6 Ų115.668%0.68464%0.643SS**SBendtrans-149.2-20165-167.615000110.6Q195D193-Q195 VanDerWaalsContact C-N 3.29Å; D193-Q195 PolarHBondContact O-N 3.4Å
194D47.1Very low49.5Very low125 Ų125113 Ų11367%0.66862%0.622SS**Hα-helixtrans-72.2-15.2178.2-112.4-78.9000114.5V198D194-V198 VanDerWaalsContact O-CB 3.31Å; D194-V198 WeakPolarHBondContact O-CB 3.46Å; D194-V198 WeakPolarHBondContact O-CG2 3.48Å; D194-V198 PolarHBondContact O-N 3.02Å
195Q42.9Very low51.3Low170 Ų170110.3 Ų110.379%0.79460%0.6SS**Hα-helixtrans-82.8-31.2-173.5-151.8123.383.700113D193 S199D193-Q195 VanDerWaalsContact C-N 3.29Å; D193-Q195 PolarHBondContact O-N 3.4Å; Q195-S199 PolarHBondContact O-N 3.39Å
196D49.2Very low53.3Low123 Ų123107.6 Ų107.666%0.65859%0.59SS**Hα-helixtrans-85.5-29.8-179.7-102.8-39.1000113.2V198 S199D196-V198 VanDerWaalsContact C-N 3.34Å; D196-S199 PolarHBondContact O-OG 2.9Å; D196-S199 VanDerWaalsContact O-OG 3.05Å
197V53.1Low55.3Low101 Ų101106.6 Ų106.661%0.61257%0.57SS**Hα-helixtrans-71.5-32.2172.6-178.70000111.2
198V52.3Low57.7Low56 Ų56107.9 Ų107.934%0.33957%0.565SS.*Hα-helixtrans-77.2-29.3179169.70000112.7D194 D196 R202D194-V198 VanDerWaalsContact O-CB 3.31Å; D194-V198 WeakPolarHBondContact O-CB 3.46Å; D194-V198 WeakPolarHBondContact O-CG2 3.48Å; D194-V198 PolarHBondContact O-N 3.02Å; D196-V198 VanDerWaalsContact C-N 3.34Å; V198-R202 VanDerWaalsContact O-CG 3.29Å; V198-R202 WeakPolarHBondContact O-CG 3.32Å; V198-R202 PolarHBondContact O-N 3.39Å
199S55.7Low59.7Low53 Ų53104.4 Ų104.437%0.37155%0.554SS.*Hα-helixtrans-71-42.6-176.771.70000112.3Q195 D196 R202Q195-S199 PolarHBondContact O-N 3.39Å; D196-S199 PolarHBondContact O-OG 2.9Å; D196-S199 VanDerWaalsContact O-OG 3.05Å; S199-R202 PolarHBondContact O-N 2.94Å
200V57.3Low62.4Low57 Ų5799.2 Ų99.235%0.34555%0.545SS..Hα-helixtrans-71.4-34.2-177.6178.90000112R104 R202R104-V200 VanDerWaalsContact CZ-CG1 3.46Å; V200-R202 VanDerWaalsContact C-N 3.34Å
201N65.5Low64.5Low110 Ų11099.2 Ų99.259%0.58854%0.537SS*.Hα-helixtrans-71.5-29.1175.9-170.29.2000111.9V203 A205N201-V203 PolarHBondContact O-N 3.04Å; N201-A205 WeakPolarHBondContact O-CB 3.29Å; N201-A205 PolarHBondContact O-N 2.88Å
202R69.3Low66.6Low148 Ų148100.9 Ų100.956%0.55853%0.529SS*.Hα-helixtrans-66.9-36.4-176.7-83.4178.1-171.8-128.34.4113.8V198 S199 V200 R206V198-R202 VanDerWaalsContact O-CG 3.29Å; V198-R202 WeakPolarHBondContact O-CG 3.32Å; V198-R202 PolarHBondContact O-N 3.39Å; S199-R202 PolarHBondContact O-N 2.94Å; V200-R202 VanDerWaalsContact C-N 3.34Å; R202-R206 VanDerWaalsContact O-CB 3.26Å; R202-R206 WeakPolarHBondContact O-CB 3.49Å; R202-R206 WeakPolarHBondContact O-CD 3.38Å; R202-R206 WeakPolarHBondContact O-CG 3.5Å; R202-R206 PolarHBondContact O-N 2.92Å
203V67.6Low68.8Low54 Ų5499 Ų9933%0.32752%0.524SS..Hα-helixtrans-72.8-44.7179.5-1770000110.5E98 N201 A205 R206 R207E98-V203 WeakPolarHBondContact OE2-CG1 3.44Å; N201-V203 PolarHBondContact O-N 3.04Å; V203-A205 PolarHBondContact O-N 3.13Å; V203-R206 PolarHBondContact O-N 2.83Å; V203-R207 WeakPolarHBondContact O-CG 3.41Å; V203-R207 PolarHBondContact O-N 3.36Å
204A70.4Confident71.1Confident47 Ų4798.1 Ų98.139%0.38852%0.519SS..Hα-helixtrans-61-42.9173.600000112.2R207 L208A204-R207 PolarHBondContact O-N 3.48Å; A204-L208 PolarHBondContact O-N 3.39Å
205A74.4Confident73.4Confident46 Ų4696.7 Ų96.738%0.3851%0.51SS..Hα-helixtrans-66.1-38.9175.900000112.4N201 V203 L208 A209N201-A205 WeakPolarHBondContact O-CB 3.29Å; N201-A205 PolarHBondContact O-N 2.88Å; V203-A205 PolarHBondContact O-N 3.13Å; A205-L208 PolarHBondContact O-N 2.87Å; A205-A209 WeakPolarHBondContact O-CB 3.31Å; A205-A209 PolarHBondContact O-N 3.12Å
206R77Confident75.7Confident170 Ų17090.9 Ų90.964%0.64249%0.492SS*.Hα-helixtrans-62.9-42.9173.4-78.6170.2-179.2-159.20.6111.4R202 V203 A209 V210R202-R206 VanDerWaalsContact O-CB 3.26Å; R202-R206 WeakPolarHBondContact O-CB 3.49Å; R202-R206 WeakPolarHBondContact O-CD 3.38Å; R202-R206 WeakPolarHBondContact O-CG 3.5Å; R202-R206 PolarHBondContact O-N 2.92Å; V203-R206 PolarHBondContact O-N 2.83Å; R206-A209 PolarHBondContact O-N 2.83Å; R206-V210 WeakPolarHBondContact O-CG2 3.24Å; R206-V210 PolarHBondContact O-N 3.47Å
207R82.4Confident77.6Confident102 Ų10290 Ų9039%0.38549%0.486SS..Hα-helixtrans-62.5-44.1176.2-71.1179.6-173.8-71.78.3111.5R97 V203 A204 V210 H211R97-R207 PolarHBondContact O-NH2 2.87Å; V203-R207 WeakPolarHBondContact O-CG 3.41Å; V203-R207 PolarHBondContact O-N 3.36Å; A204-R207 PolarHBondContact O-N 3.48Å; R207-V210 PolarHBondContact O-N 3.44Å; R207-H211 PolarHBondContact O-N 2.88Å; R207-H211 PolarHBondContact O-ND1 3.28Å
208L86.5Confident79.4Confident105 Ų10589.3 Ų89.355%0.5548%0.479SS..Hα-helixtrans-61.5-45.2174.5-176.766.9000111.3A204 A205 V210 H211 L212A204-L208 PolarHBondContact O-N 3.39Å; A205-L208 PolarHBondContact O-N 2.87Å; L208-V210 VanDerWaalsContact C-N 3.34Å; L208-V210 PolarHBondContact O-N 3.28Å; L208-H211 PolarHBondContact O-N 3.39Å; L208-H211 VanDerWaalsContact O-N 3.14Å; L208-L212 HydrophobicContact CD1-CG 4.36Å; L208-L212 HydrophobicContact CG-CD1 4.04Å; L208-L212 HydrophobicContact CG-CG 4.28Å; L208-L212 WeakPolarHBondContact O-CB 3.14Å; L208-L212 VanDerWaalsContact O-CG 3.3Å; L208-L212 WeakPolarHBondContact O-CG 3.41Å; L208-L212 PolarHBondContact O-N 2.95Å
209A86.1Confident81.1Confident55 Ų5590.8 Ų90.846%0.45548%0.484SS..Hα-helixtrans-60.4-42.1177.800000112.1A205 R206 L212 L213A205-A209 WeakPolarHBondContact O-CB 3.31Å; A205-A209 PolarHBondContact O-N 3.12Å; R206-A209 PolarHBondContact O-N 2.83Å; A209-L212 PolarHBondContact O-N 2.89Å; A209-L213 VanDerWaalsContact O-CB 3.3Å; A209-L213 WeakPolarHBondContact O-CB 3.39Å; A209-L213 PolarHBondContact O-N 2.93Å
210V88.7Confident82.5Confident92 Ų9291 Ų9156%0.55848%0.483SS*.Hα-helixtrans-63-42.3174.4172.40000111.1R206 R207 L208 L213 L214R206-V210 WeakPolarHBondContact O-CG2 3.24Å; R206-V210 PolarHBondContact O-N 3.47Å; R207-V210 PolarHBondContact O-N 3.44Å; L208-V210 VanDerWaalsContact C-N 3.34Å; L208-V210 PolarHBondContact O-N 3.28Å; V210-L213 PolarHBondContact O-N 2.96Å; V210-L214 WeakPolarHBondContact O-CB 3.47Å; V210-L214 PolarHBondContact O-N 2.85Å
211H90.1Very high83.7Confident109 Ų10993.4 Ų93.451%0.50549%0.493SS..Hα-helixtrans-67-41.4177.8-78.655.1000112.1R207 L208 L213 L214 L215R207-H211 PolarHBondContact O-N 2.88Å; R207-H211 PolarHBondContact O-ND1 3.28Å; L208-H211 PolarHBondContact O-N 3.39Å; L208-H211 VanDerWaalsContact O-N 3.14Å; H211-L213 VanDerWaalsContact C-N 3.34Å; H211-L214 PolarHBondContact O-N 3.1Å; H211-L215 WeakPolarHBondContact O-CB 3.25Å; H211-L215 PolarHBondContact O-N 2.76Å
212L92.7Very high84.6Confident101 Ų10192 Ų9253%0.52949%0.485SS..Hα-helixtrans-63.8-40.1174.9-70176.3000111.5L208 A209 L215 A216L208-L212 HydrophobicContact CD1-CG 4.36Å; L208-L212 HydrophobicContact CG-CD1 4.04Å; L208-L212 HydrophobicContact CG-CG 4.28Å; L208-L212 WeakPolarHBondContact O-CB 3.14Å; L208-L212 VanDerWaalsContact O-CG 3.3Å; L208-L212 WeakPolarHBondContact O-CG 3.41Å; L208-L212 PolarHBondContact O-N 2.95Å; A209-L212 PolarHBondContact O-N 2.89Å; L212-L215 PolarHBondContact O-N 3.22Å; L212-A216 WeakPolarHBondContact O-CB 3.48Å; L212-A216 PolarHBondContact O-N 2.87Å
213L92.7Very high85.2Confident127 Ų12788.4 Ų88.467%0.66548%0.476SS*.Hα-helixtrans-64.7-45.1175.8-175.569.5000111.6A209 V210 H211 A216 L217A209-L213 VanDerWaalsContact O-CB 3.3Å; A209-L213 WeakPolarHBondContact O-CB 3.39Å; A209-L213 PolarHBondContact O-N 2.93Å; V210-L213 PolarHBondContact O-N 2.96Å; H211-L213 VanDerWaalsContact C-N 3.34Å; L213-A216 PolarHBondContact O-N 2.85Å; L213-L217 WeakPolarHBondContact O-CB 3.26Å; L213-L217 PolarHBondContact O-N 3.45Å
214L92.8Very high85.7Confident110 Ų11086.8 Ų86.858%0.57647%0.467SS*.Hα-helixtrans-62.4-43.5176.9-177.566000111.4V210 H211 L217 L218V210-L214 WeakPolarHBondContact O-CB 3.47Å; V210-L214 PolarHBondContact O-N 2.85Å; H211-L214 PolarHBondContact O-N 3.1Å; L214-L217 PolarHBondContact O-N 3.28Å; L214-L218 WeakPolarHBondContact O-CB 3.44Å; L214-L218 PolarHBondContact O-N 3.29Å
215L94Very high86Confident94 Ų9492.7 Ų92.749%0.49248%0.484SS..Hα-helixtrans-61.8-45.2175.6-178.267.2000111.2H211 L212 L218 I219H211-L215 WeakPolarHBondContact O-CB 3.25Å; H211-L215 PolarHBondContact O-N 2.76Å; L212-L215 PolarHBondContact O-N 3.22Å; L215-L218 PolarHBondContact O-N 2.88Å; L215-I219 HydrophobicContact CD1-CD1 4.42Å; L215-I219 HydrophobicContact CG-CD1 3.99Å; L215-I219 VanDerWaalsContact O-CG1 3.27Å; L215-I219 WeakPolarHBondContact O-CG1 3.34Å; L215-I219 PolarHBondContact O-N 2.96Å
216A91.5Very high86.3Confident49 Ų4995.5 Ų95.541%0.40549%0.492SS..Hα-helixtrans-61.8-43.8177.300000111.8L212 L213 L218 I219 V220L212-A216 WeakPolarHBondContact O-CB 3.48Å; L212-A216 PolarHBondContact O-N 2.87Å; L213-A216 PolarHBondContact O-N 2.85Å; A216-L218 VanDerWaalsContact C-N 3.33Å; A216-L218 PolarHBondContact O-N 2.94Å; A216-I219 PolarHBondContact O-N 3.25Å; A216-V220 WeakPolarHBondContact O-CB 3.03Å; A216-V220 VanDerWaalsContact O-CG2 3.29Å; A216-V220 WeakPolarHBondContact O-CG2 3.33Å; A216-V220 PolarHBondContact O-N 2.78Å
217L88.6Confident86.5Confident103 Ų10393.8 Ų93.854%0.53949%0.486SS..Hα-helixtrans-60.3-44.5175.3-173.771.7000111.1L213 L214 V220 L221L213-L217 WeakPolarHBondContact O-CB 3.26Å; L213-L217 PolarHBondContact O-N 3.45Å; L214-L217 PolarHBondContact O-N 3.28Å; L217-V220 PolarHBondContact O-N 2.98Å; L217-L221 HydrophobicContact CG-CD1 4.17Å; L217-L221 WeakPolarHBondContact O-CB 3.4Å; L217-L221 VanDerWaalsContact O-CG 3.26Å; L217-L221 WeakPolarHBondContact O-CG 3.34Å; L217-L221 PolarHBondContact O-N 3.3Å
218L91.4Very high85.9Confident88 Ų8893.7 Ų93.746%0.46150%0.499SS..Hα-helixtrans-63.4-41.5177.6-177139.9000111.9L214 L215 A216 L221 I222L214-L218 WeakPolarHBondContact O-CB 3.44Å; L214-L218 PolarHBondContact O-N 3.29Å; L215-L218 PolarHBondContact O-N 2.88Å; A216-L218 VanDerWaalsContact C-N 3.33Å; A216-L218 PolarHBondContact O-N 2.94Å; L218-L221 PolarHBondContact O-N 3.47Å; L218-I222 HydrophobicContact CD2-CD1 3.39Å; L218-I222 HydrophobicContact CD2-CG1 4.47Å; L218-I222 HydrophobicContact CG-CD1 3.72Å; L218-I222 HydrophobicContact CG-CG1 4.49Å; L218-I222 WeakPolarHBondContact O-CB 3.1Å; L218-I222 VanDerWaalsContact O-CG1 3.25Å; L218-I222 WeakPolarHBondContact O-CG1 3.26Å; L218-I222 PolarHBondContact O-N 3.23Å
219I88.3Confident85.3Confident87 Ų8791.9 Ų91.945%0.44651%0.505SS..Hα-helixtrans-61.1-47.8173-68.6164.4000110.2L215 A216 L221 I222 L223L215-I219 HydrophobicContact CD1-CD1 4.42Å; L215-I219 HydrophobicContact CG-CD1 3.99Å; L215-I219 VanDerWaalsContact O-CG1 3.27Å; L215-I219 WeakPolarHBondContact O-CG1 3.34Å; L215-I219 PolarHBondContact O-N 2.96Å; A216-I219 PolarHBondContact O-N 3.25Å; I219-L221 PolarHBondContact O-N 3.05Å; I219-I222 PolarHBondContact O-N 3Å; I219-L223 WeakPolarHBondContact O-CB 3.11Å; I219-L223 PolarHBondContact O-N 3.43Å
220V84.4Confident84.8Confident58 Ų5892.2 Ų92.235%0.35250%0.502SS..Hα-helixtrans-60.9-33178.1168.70000112.1A216 L217 P224 I238A216-V220 WeakPolarHBondContact O-CB 3.03Å; A216-V220 VanDerWaalsContact O-CG2 3.29Å; A216-V220 WeakPolarHBondContact O-CG2 3.33Å; A216-V220 PolarHBondContact O-N 2.78Å; L217-V220 PolarHBondContact O-N 2.98Å; V220-P224 WeakPolarHBondContact O-CD 3.39Å; V220-P224 VanDerWaalsContact O-CG 3.32Å; V220-P224 WeakPolarHBondContact O-CG 3.48Å; V220-I238 HydrophobicContact CG1-CD1 3.57Å; V220-I238 HydrophobicContact CG1-CG1 4.31Å
221L83.1Confident84.2Confident107 Ų10791 Ų9156%0.5649%0.492SS*.Hα-helixtrans-76.5-35.7176.4-71.8170.4000112.9L217 L218 I219 F225L217-L221 HydrophobicContact CG-CD1 4.17Å; L217-L221 WeakPolarHBondContact O-CB 3.4Å; L217-L221 VanDerWaalsContact O-CG 3.26Å; L217-L221 WeakPolarHBondContact O-CG 3.34Å; L217-L221 PolarHBondContact O-N 3.3Å; L218-L221 PolarHBondContact O-N 3.47Å; I219-L221 PolarHBondContact O-N 3.05Å; L221-F225 WeakPolarHBondContact O-CD2 3.35Å; L221-F225 WeakPolarHBondContact O-CE2 3.32Å
222I83.9Confident83.7Confident79 Ų7996.2 Ų96.241%0.40551%0.507SS..Hα-helixtrans-87.3-36.5-176.2-65.9173.4000112.4L218 I219 P224 F225 I226L218-I222 HydrophobicContact CD2-CD1 3.39Å; L218-I222 HydrophobicContact CD2-CG1 4.47Å; L218-I222 HydrophobicContact CG-CD1 3.72Å; L218-I222 HydrophobicContact CG-CG1 4.49Å; L218-I222 WeakPolarHBondContact O-CB 3.1Å; L218-I222 VanDerWaalsContact O-CG1 3.25Å; L218-I222 WeakPolarHBondContact O-CG1 3.26Å; L218-I222 PolarHBondContact O-N 3.23Å; I219-I222 PolarHBondContact O-N 3Å; I222-P224 VanDerWaalsContact C-N 3.34Å; I222-F225 WeakPolarHBondContact O-CB 3.2Å; I222-F225 PolarHBondContact O-N 2.77Å; I222-I226 HydrophobicContact CG2-CD1 4.45Å; I222-I226 HydrophobicContact CG2-CG1 3.94Å; I222-I226 PolarHBondContact O-N 2.84Å
223L82.8Confident83.2Confident74 Ų74101.1 Ų101.139%0.38752%0.518SS..Hα-helixtrans-55.4-37.3-176.6-167.170.8000114.2I219 F225 I226 Y227I219-L223 WeakPolarHBondContact O-CB 3.11Å; I219-L223 PolarHBondContact O-N 3.43Å; L223-F225 PolarHBondContact O-N 3.33Å; L223-I226 PolarHBondContact O-N 3.33Å; L223-Y227 HydrophobicContact CD1-CD2 3.56Å; L223-Y227 HydrophobicContact CD1-CE2 3.53Å; L223-Y227 HydrophobicContact CG-CD2 4.14Å; L223-Y227 PolarHBondContact O-N 3.49Å; L223-Y227 VanDerWaalsContact O-N 3.14Å
224P77.4Confident82.7Confident19 Ų1996.6 Ų96.612%0.12350%0.496CS..Hα-helixtrans-57-46.5170.6-25.234.7000112V220 I222 I226 Y227 I231 V234V220-P224 WeakPolarHBondContact O-CD 3.39Å; V220-P224 VanDerWaalsContact O-CG 3.32Å; V220-P224 WeakPolarHBondContact O-CG 3.48Å; I222-P224 VanDerWaalsContact C-N 3.34Å; P224-I226 VanDerWaalsContact C-N 3.29Å; P224-I226 PolarHBondContact O-N 3.29Å; P224-Y227 CarbonylContact O-C 3.41Å; P224-Y227 PolarHBondContact O-N 3.46Å; P224-I231 VanDerWaalsContact C-CG1 3.48Å; P224-I231 HydrophobicContact CB-CB 4.43Å; P224-I231 HydrophobicContact CB-CG1 3.86Å; P224-I231 HydrophobicContact CB-CG2 4.39Å; P224-I231 WeakPolarHBondContact O-CD1 3.24Å; P224-I231 WeakPolarHBondContact O-CG1 3.49Å; P224-V234 HydrophobicContact CG-CB 4.32Å; P224-V234 HydrophobicContact CG-CG1 3.83Å
225F77.9Confident82.2Confident171 Ų17196.3 Ų96.375%0.7549%0.494SS*.Hα-helixtrans-64.7-33.6-178.1-68.1-87.1000113L221 I222 L223L221-F225 WeakPolarHBondContact O-CD2 3.35Å; L221-F225 WeakPolarHBondContact O-CE2 3.32Å; I222-F225 WeakPolarHBondContact O-CB 3.2Å; I222-F225 PolarHBondContact O-N 2.77Å; L223-F225 PolarHBondContact O-N 3.33Å
226I80.1Confident81.7Confident105 Ų10594.3 Ų94.354%0.53849%0.492SS..Hα-helixtrans-77.4-30.8-179.2-57.6-58.1000111.9I222 L223 P224 P228I222-I226 HydrophobicContact CG2-CD1 4.45Å; I222-I226 HydrophobicContact CG2-CG1 3.94Å; I222-I226 PolarHBondContact O-N 2.84Å; L223-I226 PolarHBondContact O-N 3.33Å; P224-I226 VanDerWaalsContact C-N 3.29Å; P224-I226 PolarHBondContact O-N 3.29Å; I226-P228 WeakPolarHBondContact O-CD 3.3Å
227Y81.1Confident81.4Confident134 Ų13498.5 Ų98.553%0.52550%0.501SS..  trans-121.481.6-176.7-63.3-79.2000110.5L223 P224 G229 V230 I231L223-Y227 HydrophobicContact CD1-CD2 3.56Å; L223-Y227 HydrophobicContact CD1-CE2 3.53Å; L223-Y227 HydrophobicContact CG-CD2 4.14Å; L223-Y227 PolarHBondContact O-N 3.49Å; L223-Y227 VanDerWaalsContact O-N 3.14Å; P224-Y227 CarbonylContact O-C 3.41Å; P224-Y227 PolarHBondContact O-N 3.46Å; Y227-G229 PolarHBondContact O-N 3.5Å; Y227-V230 VanDerWaalsContact CB-CG2 3.46Å; Y227-V230 VanDerWaalsContact O-CG2 3.31Å; Y227-V230 WeakPolarHBondContact O-CG2 3.49Å; Y227-V230 PolarHBondContact O-N 2.84Å; Y227-I231 PolarHBondContact O-N 2.7Å
228P70.1Confident81.2Confident100 Ų10097.2 Ų97.265%0.64949%0.494SS*.THydrogen-bonded Turntrans-59.1-26.9-173.521.6-32.8000113.8I226 V230 I231I226-P228 WeakPolarHBondContact O-CD 3.3Å; P228-V230 VanDerWaalsContact C-N 3.34Å; P228-V230 PolarHBondContact O-N 2.86Å; P228-I231 HydrophobicContact CB-CD1 4.23Å
229G74.1Confident81.1Confident67 Ų6797.2 Ų97.269%0.69149%0.493SS*.THydrogen-bonded Turntrans-70.6-21.9176.300000115.1Y227Y227-G229 PolarHBondContact O-N 3.5Å
230V74.4Confident81.1Confident63 Ų6395.6 Ų95.638%0.38249%0.493SS..THydrogen-bonded Turntrans-106.1-5.7-179.5-550000113.5Y227 P228 R232 W233 V234Y227-V230 VanDerWaalsContact CB-CG2 3.46Å; Y227-V230 VanDerWaalsContact O-CG2 3.31Å; Y227-V230 WeakPolarHBondContact O-CG2 3.49Å; Y227-V230 PolarHBondContact O-N 2.84Å; P228-V230 VanDerWaalsContact C-N 3.34Å; P228-V230 PolarHBondContact O-N 2.86Å; V230-R232 PolarHBondContact O-N 3.32Å; V230-W233 PolarHBondContact O-N 3.04Å; V230-V234 HydrophobicContact CB-CG2 4.48Å; V230-V234 HydrophobicContact CG2-CG2 4.23Å; V230-V234 WeakPolarHBondContact O-CG2 3.36Å; V230-V234 PolarHBondContact O-N 3.3Å
231I77.8Confident81.2Confident67 Ų6795.7 Ų95.734%0.34449%0.494SS..Hα-helixtrans-49.9-45.9178.1-65.6175.4000111.5P224 Y227 P228 W233 V234 L235P224-I231 VanDerWaalsContact C-CG1 3.48Å; P224-I231 HydrophobicContact CB-CB 4.43Å; P224-I231 HydrophobicContact CB-CG1 3.86Å; P224-I231 HydrophobicContact CB-CG2 4.39Å; P224-I231 WeakPolarHBondContact O-CD1 3.24Å; P224-I231 WeakPolarHBondContact O-CG1 3.49Å; Y227-I231 PolarHBondContact O-N 2.7Å; P228-I231 HydrophobicContact CB-CD1 4.23Å; I231-W233 VanDerWaalsContact C-N 3.3Å; I231-W233 PolarHBondContact O-N 3.28Å; I231-V234 PolarHBondContact O-N 3.44Å; I231-L235 VanDerWaalsContact O-CB 3.26Å; I231-L235 WeakPolarHBondContact O-CB 3.28Å; I231-L235 PolarHBondContact O-N 2.9Å
232R79Confident81.4Confident218 Ų21893 Ų9382%0.82349%0.487SS*.Hα-helixtrans-65.3-35.6-176.4-164.9162.8175.3151-3.8112V230 A236V230-R232 PolarHBondContact O-N 3.32Å; R232-A236 VanDerWaalsContact O-CB 3.24Å; R232-A236 WeakPolarHBondContact O-CB 3.41Å; R232-A236 PolarHBondContact O-N 3.44Å; R232-A236 VanDerWaalsContact O-N 3.16Å
233W81.1Confident81.7Confident204 Ų20494.3 Ų94.377%0.77349%0.494SS*.Hα-helixtrans-75.3-41.1175.6-69.6105.9000112.2V230 I231 A236 F237V230-W233 PolarHBondContact O-N 3.04Å; I231-W233 VanDerWaalsContact C-N 3.3Å; I231-W233 PolarHBondContact O-N 3.28Å; W233-A236 PolarHBondContact O-N 3.47Å; W233-F237 WeakPolarHBondContact O-CB 3.12Å; W233-F237 PolarHBondContact O-N 2.97Å
234V82.7Confident82Confident32 Ų3295.6 Ų95.619%0.19450%0.501CS..Hα-helixtrans-67.2-45178178.70000110.8P224 V230 I231 A236 F237 I238P224-V234 HydrophobicContact CG-CB 4.32Å; P224-V234 HydrophobicContact CG-CG1 3.83Å; V230-V234 HydrophobicContact CB-CG2 4.48Å; V230-V234 HydrophobicContact CG2-CG2 4.23Å; V230-V234 WeakPolarHBondContact O-CG2 3.36Å; V230-V234 PolarHBondContact O-N 3.3Å; I231-V234 PolarHBondContact O-N 3.44Å; V234-A236 VanDerWaalsContact C-N 3.34Å; V234-A236 PolarHBondContact O-N 2.93Å; V234-F237 WeakPolarHBondContact O-CB 3.31Å; V234-F237 PolarHBondContact O-N 3.02Å; V234-I238 HydrophobicContact CG1-CG1 4.37Å; V234-I238 VanDerWaalsContact O-CG1 3.31Å; V234-I238 WeakPolarHBondContact O-CG1 3.37Å; V234-I238 PolarHBondContact O-N 3.39Å
235L82.7Confident82.3Confident104 Ų104100.2 Ų100.255%0.54552%0.522SS..Hα-helixtrans-62.3-42.1175.9-175.864.3000111.5I231 F237 I238 I239I231-L235 VanDerWaalsContact O-CB 3.26Å; I231-L235 WeakPolarHBondContact O-CB 3.28Å; I231-L235 PolarHBondContact O-N 2.9Å; L235-F237 VanDerWaalsContact C-N 3.34Å; L235-F237 PolarHBondContact O-N 2.78Å; L235-I238 PolarHBondContact O-N 2.92Å; L235-I239 HydrophobicContact CD1-CD1 4.19Å; L235-I239 HydrophobicContact CD1-CG1 4.49Å; L235-I239 HydrophobicContact CG-CD1 3.92Å; L235-I239 WeakPolarHBondContact O-CB 3.48Å; L235-I239 VanDerWaalsContact O-CG1 3.25Å; L235-I239 WeakPolarHBondContact O-CG1 2.76Å; L235-I239 PolarHBondContact O-N 3.13Å
236A83.6Confident82.7Confident52 Ų5295.1 Ų95.143%0.4351%0.508SS..Hα-helixtrans-61.5-41.417400000112R232 W233 V234 A240R232-A236 VanDerWaalsContact O-CB 3.24Å; R232-A236 WeakPolarHBondContact O-CB 3.41Å; R232-A236 PolarHBondContact O-N 3.44Å; R232-A236 VanDerWaalsContact O-N 3.16Å; W233-A236 PolarHBondContact O-N 3.47Å; V234-A236 VanDerWaalsContact C-N 3.34Å; V234-A236 PolarHBondContact O-N 2.93Å; A236-A240 VanDerWaalsContact O-CB 3.24Å; A236-A240 WeakPolarHBondContact O-CB 3.2Å; A236-A240 PolarHBondContact O-N 3.38Å
237F84.4Confident82.9Confident136 Ų13693.8 Ų93.860%0.59651%0.505SS*.Hα-helixtrans-64.5-44.7176-177.8-98000112.1W233 V234 L235 A240 V241W233-F237 WeakPolarHBondContact O-CB 3.12Å; W233-F237 PolarHBondContact O-N 2.97Å; V234-F237 WeakPolarHBondContact O-CB 3.31Å; V234-F237 PolarHBondContact O-N 3.02Å; L235-F237 VanDerWaalsContact C-N 3.34Å; L235-F237 PolarHBondContact O-N 2.78Å; F237-A240 PolarHBondContact O-N 3.37Å; F237-V241 HydrophobicContact CD1-CG2 4.17Å; F237-V241 HydrophobicContact CD2-CG2 4.48Å; F237-V241 HydrophobicContact CE1-CG2 3.79Å; F237-V241 HydrophobicContact CE2-CG2 4.13Å; F237-V241 HydrophobicContact CZ-CG2 3.77Å; F237-V241 WeakPolarHBondContact O-CB 3.39Å; F237-V241 WeakPolarHBondContact O-CG2 3.33Å; F237-V241 PolarHBondContact O-N 2.8Å
238I85.8Confident83.1Confident76 Ų7692 Ų9239%0.3950%0.503SS..Hα-helixtrans-62.6-44.4177.2-65-65.4000111.4V220 V234 L235 V241 A242V220-I238 HydrophobicContact CG1-CD1 3.57Å; V220-I238 HydrophobicContact CG1-CG1 4.31Å; V234-I238 HydrophobicContact CG1-CG1 4.37Å; V234-I238 VanDerWaalsContact O-CG1 3.31Å; V234-I238 WeakPolarHBondContact O-CG1 3.37Å; V234-I238 PolarHBondContact O-N 3.39Å; L235-I238 PolarHBondContact O-N 2.92Å; I238-V241 PolarHBondContact O-N 2.91Å; I238-A242 VanDerWaalsContact O-CB 3.28Å; I238-A242 WeakPolarHBondContact O-CB 3.29Å; I238-A242 PolarHBondContact O-N 2.99Å
239I88.4Confident83.5Confident88 Ų8895.9 Ų95.945%0.45151%0.511SS..Hα-helixtrans-63.5-44.3175.9-67.1166.9000110.3L235 A242 L243L235-I239 HydrophobicContact CD1-CD1 4.19Å; L235-I239 HydrophobicContact CD1-CG1 4.49Å; L235-I239 HydrophobicContact CG-CD1 3.92Å; L235-I239 WeakPolarHBondContact O-CB 3.48Å; L235-I239 VanDerWaalsContact O-CG1 3.25Å; L235-I239 WeakPolarHBondContact O-CG1 2.76Å; L235-I239 PolarHBondContact O-N 3.13Å; I239-A242 PolarHBondContact O-N 2.64Å; I239-L243 HydrophobicContact CG2-CD1 3.87Å; I239-L243 HydrophobicContact CG2-CG 4.24Å; I239-L243 WeakPolarHBondContact O-CB 3.3Å; I239-L243 VanDerWaalsContact O-CG 3.24Å; I239-L243 WeakPolarHBondContact O-CG 3.21Å; I239-L243 PolarHBondContact O-N 3.3Å
240A87.6Confident83.6Confident54 Ų5497.9 Ų97.945%0.44651%0.512SS..Hα-helixtrans-62.3-44178.300000112.3A236 F237 L243 L244A236-A240 VanDerWaalsContact O-CB 3.24Å; A236-A240 WeakPolarHBondContact O-CB 3.2Å; A236-A240 PolarHBondContact O-N 3.38Å; F237-A240 PolarHBondContact O-N 3.37Å; A240-L243 PolarHBondContact O-N 3Å; A240-L244 WeakPolarHBondContact O-CB 3.49Å; A240-L244 PolarHBondContact O-N 2.95Å
241V86.7Confident83.3Confident60 Ų6099.8 Ų99.836%0.36453%0.527SS..Hα-helixtrans-65.5-42.8175.5171.90000110.9F237 I238 L243 L244 M245F237-V241 HydrophobicContact CD1-CG2 4.17Å; F237-V241 HydrophobicContact CD2-CG2 4.48Å; F237-V241 HydrophobicContact CE1-CG2 3.79Å; F237-V241 HydrophobicContact CE2-CG2 4.13Å; F237-V241 HydrophobicContact CZ-CG2 3.77Å; F237-V241 WeakPolarHBondContact O-CB 3.39Å; F237-V241 WeakPolarHBondContact O-CG2 3.33Å; F237-V241 PolarHBondContact O-N 2.8Å; I238-V241 PolarHBondContact O-N 2.91Å; V241-L243 PolarHBondContact O-N 2.82Å; V241-L244 PolarHBondContact O-N 3.25Å; V241-M245 HydrophobicContact CG1-CG 4.16Å; V241-M245 WeakPolarHBondContact O-CB 3.06Å; V241-M245 WeakPolarHBondContact O-CG 3.23Å; V241-M245 PolarHBondContact O-N 2.77Å
242A87.1Confident82.6Confident50 Ų50104.4 Ų104.441%0.41354%0.542SS..Hα-helixtrans-62.9-42.717700000112I238 I239 M245 S246I238-A242 VanDerWaalsContact O-CB 3.28Å; I238-A242 WeakPolarHBondContact O-CB 3.29Å; I238-A242 PolarHBondContact O-N 2.99Å; I239-A242 PolarHBondContact O-N 2.64Å; A242-M245 PolarHBondContact O-N 2.93Å; A242-S246 VanDerWaalsContact O-CB 3.3Å; A242-S246 WeakPolarHBondContact O-CB 3.37Å; A242-S246 PolarHBondContact O-N 2.82Å; A242-S246 PolarHBondContact O-OG 3.44Å
243L91.4Very high81.3Confident107 Ų10799.1 Ų99.156%0.5654%0.536SS*.Hα-helixtrans-64.8-43.1174.3-70.9175.8000111.2I239 A240 V241 S246 T247I239-L243 HydrophobicContact CG2-CD1 3.87Å; I239-L243 HydrophobicContact CG2-CG 4.24Å; I239-L243 WeakPolarHBondContact O-CB 3.3Å; I239-L243 VanDerWaalsContact O-CG 3.24Å; I239-L243 WeakPolarHBondContact O-CG 3.21Å; I239-L243 PolarHBondContact O-N 3.3Å; A240-L243 PolarHBondContact O-N 3Å; V241-L243 PolarHBondContact O-N 2.82Å; L243-S246 CarbonylContact O-C 3.58Å; L243-S246 WeakPolarHBondContact O-CB 3.24Å; L243-S246 PolarHBondContact O-N 3.16Å; L243-T247 WeakPolarHBondContact O-CG2 3.26Å; L243-T247 PolarHBondContact O-N 2.93Å; L243-T247 PolarHBondContact O-OG1 3.08Å
244L88.6Confident79.8Confident101 Ų10195.9 Ų95.953%0.52953%0.529SS..Hα-helixtrans-66-39.5177.8-173139.4000112A240 V241 S246 T247 L248A240-L244 WeakPolarHBondContact O-CB 3.49Å; A240-L244 PolarHBondContact O-N 2.95Å; V241-L244 PolarHBondContact O-N 3.25Å; L244-S246 VanDerWaalsContact C-N 3.32Å; L244-T247 WeakPolarHBondContact CA-OG1 3.24Å; L244-T247 PolarHBondContact O-OG1 3.43Å; L244-L248 HydrophobicContact CD2-CD1 3.52Å; L244-L248 HydrophobicContact CD2-CG 4.25Å; L244-L248 HydrophobicContact CG-CD1 4.37Å; L244-L248 VanDerWaalsContact O-CB 3.23Å; L244-L248 WeakPolarHBondContact O-CB 3.47Å; L244-L248 WeakPolarHBondContact O-CG 3.33Å; L244-L248 PolarHBondContact O-N 2.97Å
245M83.8Confident78.3Confident115 Ų11599.6 Ų99.657%0.56756%0.556SS**Hα-helixtrans-67.2-35.6172.6-70.6-59.5-65.600111.3V241 A242 L248 F249V241-M245 HydrophobicContact CG1-CG 4.16Å; V241-M245 WeakPolarHBondContact O-CB 3.06Å; V241-M245 WeakPolarHBondContact O-CG 3.23Å; V241-M245 PolarHBondContact O-N 2.77Å; A242-M245 PolarHBondContact O-N 2.93Å; M245-L248 HydrophobicContact SD-CD1 4.39Å; M245-F249 VanDerWaalsContact O-CB 3.24Å; M245-F249 WeakPolarHBondContact O-CB 3.13Å; M245-F249 PolarHBondContact O-N 2.7Å
246S86.9Confident76.5Confident65 Ų65101.7 Ų101.746%0.45556%0.563SS.*Hα-helixtrans-69.7-43175.5-58.60000111.7A242 L243 L244 F249 C250A242-S246 VanDerWaalsContact O-CB 3.3Å; A242-S246 WeakPolarHBondContact O-CB 3.37Å; A242-S246 PolarHBondContact O-N 2.82Å; A242-S246 PolarHBondContact O-OG 3.44Å; L243-S246 CarbonylContact O-C 3.58Å; L243-S246 WeakPolarHBondContact O-CB 3.24Å; L243-S246 PolarHBondContact O-N 3.16Å; L244-S246 VanDerWaalsContact C-N 3.32Å; S246-F249 PolarHBondContact O-N 2.96Å; S246-C250 VanDerWaalsContact O-CB 3.26Å; S246-C250 WeakPolarHBondContact O-CB 3.35Å; S246-C250 PolarHBondContact O-N 2.84Å; S246-C250 PolarHBondContact O-SG 3.2Å
247T84.6Confident74.7Confident77 Ų77104.4 Ų104.447%0.47258%0.579SS.*Hα-helixtrans-66.8-41.8174.5570000110.5L243 L244 F249 C250 C251L243-T247 WeakPolarHBondContact O-CG2 3.26Å; L243-T247 PolarHBondContact O-N 2.93Å; L243-T247 PolarHBondContact O-OG1 3.08Å; L244-T247 WeakPolarHBondContact CA-OG1 3.24Å; L244-T247 PolarHBondContact O-OG1 3.43Å; T247-F249 VanDerWaalsContact C-N 3.33Å; T247-F249 PolarHBondContact O-N 2.7Å; T247-C250 PolarHBondContact O-N 3.35Å; T247-C251 WeakPolarHBondContact O-CA 2.87Å; T247-C251 WeakPolarHBondContact O-CB 3.34Å; T247-C251 PolarHBondContact O-N 3.43Å; T247-C251 PolarHBondContact O-SG 3.15Å
248L83.6Confident72.7Confident95 Ų95103.1 Ų103.150%0.49759%0.587SS.*Hα-helixtrans-60.7-41.7172.3-73.4174.6000111.3L244 M245 C251 Y252L244-L248 HydrophobicContact CD2-CD1 3.52Å; L244-L248 HydrophobicContact CD2-CG 4.25Å; L244-L248 HydrophobicContact CG-CD1 4.37Å; L244-L248 VanDerWaalsContact O-CB 3.23Å; L244-L248 WeakPolarHBondContact O-CB 3.47Å; L244-L248 WeakPolarHBondContact O-CG 3.33Å; L244-L248 PolarHBondContact O-N 2.97Å; M245-L248 HydrophobicContact SD-CD1 4.39Å; L248-C251 PolarHBondContact O-N 2.84Å; L248-Y252 WeakPolarHBondContact O-CA 3.03Å; L248-Y252 WeakPolarHBondContact O-CB 3.41Å; L248-Y252 PolarHBondContact O-N 2.73Å
249F79Confident70.8Confident183 Ų183106.4 Ų106.480%0.80361%0.606SS**Hα-helixtrans-71.4-33.4179.1-155.3-103.6000112.9M245 S246 T247M245-F249 VanDerWaalsContact O-CB 3.24Å; M245-F249 WeakPolarHBondContact O-CB 3.13Å; M245-F249 PolarHBondContact O-N 2.7Å; S246-F249 PolarHBondContact O-N 2.96Å; T247-F249 VanDerWaalsContact C-N 3.33Å; T247-F249 PolarHBondContact O-N 2.7Å
250C76.4Confident68.3Low108 Ų108113.7 Ų113.773%0.7363%0.627SS**Hα-helixtrans-77.6-28.2174.6-68.50000113S246 T247S246-C250 VanDerWaalsContact O-CB 3.26Å; S246-C250 WeakPolarHBondContact O-CB 3.35Å; S246-C250 PolarHBondContact O-N 2.84Å; S246-C250 PolarHBondContact O-SG 3.2Å; T247-C250 PolarHBondContact O-N 3.35Å
251C68.7Low66.2Low103 Ų103116.2 Ų116.270%0.69664%0.64SS**Hα-helixtrans-104.5-7.2-177-59.40000113.5T247 L248 P253T247-C251 WeakPolarHBondContact O-CA 2.87Å; T247-C251 WeakPolarHBondContact O-CB 3.34Å; T247-C251 PolarHBondContact O-N 3.43Å; T247-C251 PolarHBondContact O-SG 3.15Å; L248-C251 PolarHBondContact O-N 2.84Å; C251-P253 VanDerWaalsContact C-CD 3.43Å; C251-P253 WeakPolarHBondContact O-CD 2.96Å
252Y62.3Low63.8Low165 Ų165119.1 Ų119.165%0.64766%0.661SS**SBendtrans-93.787167.3-169.8-93.8000106.6L248 H254L248-Y252 WeakPolarHBondContact O-CA 3.03Å; L248-Y252 WeakPolarHBondContact O-CB 3.41Å; L248-Y252 PolarHBondContact O-N 2.73Å; Y252-H254 PolarHBondContact O-N 3.44Å
253P52Low61.7Low107 Ų107122.7 Ų122.770%0.69568%0.68SS**  trans-59.1116.2172.126.9-33.2000106.8C251 S255C251-P253 VanDerWaalsContact C-CD 3.43Å; C251-P253 WeakPolarHBondContact O-CD 2.96Å; P253-S255 VanDerWaalsContact C-N 3.33Å; P253-S255 PolarHBondContact O-N 2.87Å
254H50.2Low59.2Low135 Ų135128.9 Ų128.963%0.62570%0.696SS**  trans-52.498.5169.3-17873.5000108Y252 Q256Y252-H254 PolarHBondContact O-N 3.44Å; H254-Q256 VanDerWaalsContact CD2-CB 3.46Å; H254-Q256 WeakPolarHBondContact CD2-CB 3.11Å; H254-Q256 WeakPolarHBondContact NE2-CB 3.46Å; H254-Q256 PolarHBondContact O-N 2.83Å
255S50.9Low56.9Low111 Ų111130.6 Ų130.678%0.77671%0.711SS**  trans-74.542.3176.356.20000111.7P253P253-S255 VanDerWaalsContact C-N 3.33Å; P253-S255 PolarHBondContact O-N 2.87Å
256Q44.5Very low55.2Low147 Ų147132.3 Ų132.369%0.68772%0.721SS**  trans-106.997.8170-139.316884.400108.1H254 S258H254-Q256 VanDerWaalsContact CD2-CB 3.46Å; H254-Q256 WeakPolarHBondContact CD2-CB 3.11Å; H254-Q256 WeakPolarHBondContact NE2-CB 3.46Å; H254-Q256 PolarHBondContact O-N 2.83Å; Q256-S258 PolarHBondContact O-N 3.15Å
257S45.1Very low52.6Low110 Ų110138.4 Ų138.477%0.76974%0.74SS**  trans-59.3122169.557.50000110.8
258S43.2Very low50.3Low108 Ų108140.1 Ų140.176%0.75575%0.754SS**  172.2119.611856.60000110.8Q256Q256-S258 PolarHBondContact O-N 3.15Å
259N45.8Very low48.2Very low146 Ų146145.8 Ų145.878%0.78177%0.769SS**  trans41.2113.8156.1-71.6-17.6000118.5
260W35.4Very low46.2Very low240 Ų240144.8 Ų144.891%0.90977%0.766SS**  174.1155.6111.2-95.682.8000109.1
261P44.3Very low44.4Very low108 Ų108146.3 Ų146.370%0.70176%0.763SS**PPolyproline II helixtrans-82.3146.4-150.715.4-6.1000115.2
262C36.7Very low43.2Very low120 Ų120151.1 Ų151.181%0.81177%0.772SS**PPolyproline II helixtrans-56.6138.6175.4-60.40000113.5
263P42.1Very low41.9Very low126 Ų126150.5 Ų150.582%0.81878%0.775SS**PPolyproline II helixtrans-74.8125.5154.16.110.4000108.9T265P263-T265 PolarHBondContact O-N 3.39Å
264R39.6Very low41.6Very low236 Ų236150 Ų15089%0.89178%0.78SS**  trans-44.2126.4177-72.2174.1172.8113-2.1112.9L266R264-L266 PolarHBondContact O-N 3.41Å; R264-L266 VanDerWaalsContact O-N 3.14Å
265T41Very low41.4Very low138 Ų138152.5 Ų152.585%0.84779%0.792SS**  trans-56.3105.5149.350.70000109P263P263-T265 PolarHBondContact O-N 3.39Å
266L46.3Very low41.5Very low150 Ų150154.2 Ų154.279%0.78579%0.791SS**  trans-88.6138.3157.7-105.6164.3000107.7R264R264-L266 PolarHBondContact O-N 3.41Å; R264-L266 VanDerWaalsContact O-N 3.14Å
267F33.1Very low41.8Very low194 Ų194153.5 Ų153.585%0.85180%0.797SS**  trans86.461.9-177.6-71.7-86.6000116.9
268C36.4Very low42Very low112 Ų112152.8 Ų152.876%0.75779%0.792SS**  trans-79136.6142.2-163.90000108.7
269R38.7Very low42.5Very low214 Ų214155.3 Ų155.381%0.80880%0.795SS**  trans81.7147.1147.1-146172.1-175.9157.90.7117
270E37.6Very low42.7Very low162 Ų162156.6 Ų156.676%0.75783%0.826SS**  trans82.5108.9-172.7-50.9-78.591.100110.9
271Q38Very low43.1Very low140 Ų140152.4 Ų152.465%0.65482%0.822SS**  cis-164.7119.822.8-169.6170.9-43.400109.1Q273Q271-Q273 PolarHBondContact O-N 3.14Å; Q271-Q273 VanDerWaalsContact O-N 3.15Å
272K43.2Very low43Very low205 Ų205154.7 Ų154.789%0.89183%0.828SS**  trans-57.9103.2161.8178-171.9-178.4-173.50108.6
273Q36.7Very low43.4Very low151 Ų151156.7 Ų156.771%0.70683%0.829SS**  trans-139.269.2161.5-135.7102.64.400110.6Q271 Q275Q271-Q273 PolarHBondContact O-N 3.14Å; Q271-Q273 VanDerWaalsContact O-N 3.15Å; Q273-Q275 PolarHBondContact O-N 3.4Å
274A45.4Very low43.5Very low97 Ų97158.5 Ų158.580%0.80283%0.83SS**  trans-75.8101.5147.100000107
275Q46.6Very low43.7Very low187 Ų187153.6 Ų153.687%0.87483%0.826SS**  trans-149.7116.4141.4-85.6-139.7-4800109.6Q273Q273-Q275 PolarHBondContact O-N 3.4Å
276I53Low43.9Very low148 Ų148154.7 Ų154.776%0.75982%0.824SS**  trans-80.1154165.5-67.7164.7000107.6
277T49.6Very low43.7Very low131 Ų131155 Ų15580%0.80483%0.827SS**  trans70.9120.4158.341.30000120.1
278S49.6Very low44.5Very low95 Ų95152 Ų15266%0.66483%0.825SS**  147.1114.4103-1760000113.7
279I53.5Low45.2Very low161 Ų161155.3 Ų155.383%0.82683%0.831SS**  trans46.8113.2130.6-41165.7000118.7
280A50.8Low45.8Very low173 Ų173150 Ų150100%1.4383%0.833SS**  1600119.300000110.6

Retrieved 280 of 280 residues in 175 ms (Link to these results)