A0A077ZFE3_TRITR Loading...

YEATS family protein

AlphaFold DB , UniProt , Accession A0A077ZFE3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 282 aa.

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(Predicted Aligned Error values between residue pairs)
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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M44Very low49.6Very low230 Ų230148.9 Ų148.9100%1.13382%0.822SS**  0118.20-66.1165.118000106.1
2Q47.2Very low49.8Very low174 Ų174152.4 Ų152.481%0.81382%0.822SS**  61.9126.876.5-79.8-171.3-15.600111
3I49.8Very low50.1Low143 Ų143148.2 Ų148.273%0.73382%0.821SS**  cis-160.2163.419.6-99.1148000111.1
4A47.5Very low50.4Low85 Ų85147.3 Ų147.370%0.70281%0.813SS**  trans63.5135161.500000118.8
5R50.6Low50.2Low236 Ų236149.4 Ų149.489%0.89181%0.814SS**  cis63.6107.715.3-73.1-172.8174.6162.2-0.7117.7
6N50.8Low49.7Very low170 Ų170145.3 Ų145.391%0.90982%0.817SS**  trans172.4149136.2-84-12.5000108.8
7G43.7Very low49.4Very low59 Ų59140.8 Ų140.861%0.60881%0.811SS**  cis122.976.1-8.900000115.5
8T52.5Low49.3Very low137 Ų137142.1 Ų142.184%0.8482%0.815SS**  trans-166.6120.216518.90000108.1
9H51.2Low49.3Very low177 Ų177145 Ų14582%0.81982%0.817SS**  79107.751.8-70.3-70.4000116.2
10S47.5Very low49.4Very low102 Ų102144.7 Ų144.771%0.71382%0.818SS**  trans61.6122.1135.1-174.20000120.7
11S61.1Low49.3Very low125 Ų125146.5 Ų146.587%0.87482%0.817SS**  -153.4139129.4-83.90000111.6
12K51.6Low49.2Very low191 Ų191143.2 Ų143.283%0.8380%0.803SS**  trans-99.6143175.2-64.8174.2177.8175.60109.7
13A53.5Low49.3Very low98 Ų98141.1 Ų141.181%0.8180%0.802SS**  trans-137.9122149.900000105.8
14L54Low48.7Very low135 Ų135141.8 Ų141.871%0.70781%0.807SS**  cis77.510738-65.6-171.7000115.6
15H47.4Very low48.8Very low179 Ų179141.9 Ų141.983%0.82981%0.807SS**  trans77.2144.1152-63.8109000121.1
16G42.9Very low48.4Very low83 Ų83138.3 Ų138.386%0.85681%0.806SS**  trans87.5130.417300000113.4
17G44.5Very low48.1Very low69 Ų69135.1 Ų135.171%0.71180%0.797SS**  cis167152.5-0.400000110
18D48Very low48Very low165 Ų165138.4 Ų138.488%0.88281%0.81SS**  trans57.1127.7167.5-79.4-80.5000123.6
19K48.2Very low47.4Very low197 Ų197136.4 Ų136.486%0.85781%0.807SS**  trans-84.4125.3177.4-50.2164.9-176.7177.10108.3
20V53.1Low47.1Very low138 Ų138132.2 Ų132.284%0.83680%0.802SS**  trans-132.2122.9157-175.70000111.5
21K46.8Very low47.5Very low184 Ų184137 Ų13780%0.881%0.811SS**  trans-10.8117.1167.9-67.8174.6175.3178.50118.6V23K21-V23 PolarHBondContact O-N 3.19Å
22L42.4Very low46.8Very low161 Ų161140 Ų14084%0.84381%0.811SS**  -17.3117123.3-173.4145.7000114.3
23V48.9Very low46Very low130 Ų130136 Ų13679%0.78881%0.813SS**  trans-137.8105.5150.7-179.90000107.7K21K21-V23 PolarHBondContact O-N 3.19Å
24D37.6Very low46Very low157 Ų157135.1 Ų135.184%0.8481%0.806SS**  trans-88.3124.4161.6-146-56000106.4
25A49.3Very low46Very low86 Ų86134.8 Ų134.871%0.71181%0.809SS**  trans-172.6131.7164.400000112.6
26D41.9Very low46.6Very low161 Ų161134.9 Ų134.986%0.86181%0.814SS**  trans-72.7171.8172.6-130.8-67.8000113.5
27S43.3Very low46.8Very low104 Ų104136.7 Ų136.773%0.72780%0.804SS**  trans65.7117.3160.2-161.60000119.9
28C41.6Very low47.2Very low128 Ų128142.2 Ų142.287%0.86580%0.803SS**  -165.5136.297.8-142.50000112.1
29A41.5Very low47.6Very low95 Ų95142 Ų14279%0.78579%0.794SS**  trans-100.4146.8174.600000111.1
30A44.1Very low47.7Very low88 Ų88140.6 Ų140.673%0.72780%0.796SS**  trans177156141.900000112.3
31K56.6Low47.4Very low204 Ų204137.8 Ų137.889%0.88779%0.787SS**  trans68.1115.2169.1-49.8174.3-174.91780114.2
32E45.3Very low47.6Very low187 Ų187138.6 Ų138.687%0.87479%0.79SS**  cis-143.5143.232.4-77.1178.393.200112.6
33A35.1Very low48.1Very low107 Ų107140.9 Ų140.988%0.88479%0.794SS**  trans-136.8106.2161.100000107.3
34A53.9Low48Very low79 Ų79144.4 Ų144.465%0.65380%0.798SS**  trans-146.5120.1-177.300000111.9
35V53.3Low48.6Very low129 Ų129145 Ų14578%0.78280%0.8SS**  trans61105.9144.1-171.60000118.7
36I61Low48.9Very low180 Ų180146.9 Ų146.992%0.92381%0.805SS**  -134.3117.3117.9-77110.9000107.4
37D46.7Very low48.9Very low121 Ų121144.4 Ų144.465%0.64780%0.801SS**  trans-123.1131172167.835.2000107.4
38R52.6Low49Very low185 Ų185145 Ų14570%0.69880%0.8SS**  161128.5123.2-86-172.4174.9176.30.6116.9
39K55.8Low49.1Very low160 Ų160144.9 Ų144.970%0.69680%0.798SS**  trans58.4115.7133.4-62.3179.8178.8-174.10121.1
40L50Low49.1Very low169 Ų169145.3 Ų145.389%0.88580%0.795SS**  175.194.5106.6-94.6147.2000108
41A47.7Very low49.3Very low79 Ų79151.3 Ų151.365%0.65381%0.805SS**  71.697.572.700000116
42K51.8Low48.4Very low200 Ų200146.5 Ų146.587%0.8780%0.797SS**  trans64.1108.6144.2-56.6176.8179.6178.90119.2
43K52.9Low48.2Very low210 Ų210142.9 Ų142.991%0.91379%0.79SS**  -165.5127.9113.7-106.8167.3-176.5179.40114.3
44K46.6Very low48.6Very low204 Ų204145.5 Ų145.589%0.88779%0.785SS**  trans4.6122.7163.8-73.7-179.6167.7-176.10120.5
45L50.5Low47.9Very low168 Ų168149.2 Ų149.288%0.8879%0.793SS**  trans-73.4155.1142.7-69.6164.2000111
46P54.9Low47.2Very low126 Ų126146.7 Ų146.782%0.81879%0.793SS**  trans-113.3153.4147.633.5-24000112.9
47S40.9Very low46.2Very low110 Ų110148.1 Ų148.177%0.76979%0.793SS**  trans-71.6152.8-168.5173.20000116.7
48V46Very low46.1Very low115 Ų115148.6 Ų148.670%0.69780%0.8SS**  trans-27.7155.7150.5-129.60000115.6
49P43.9Very low45.6Very low127 Ų127144 Ų14483%0.82580%0.802SS**  -142.115887.139.1-24.6000117.1
50S41.1Very low45.5Very low104 Ų104145.5 Ų145.573%0.72781%0.809SS**  trans-71.5149.2177.7-32.50000113.9
51K47.9Very low45.4Very low214 Ų214143.7 Ų143.793%0.9381%0.807SS**  trans-166.8169.8135.6-107.6160.5-171.2-178.90113.3
52S37.6Very low45.6Very low103 Ų103146.2 Ų146.272%0.7281%0.814SS**  trans-94.5-169.4-15754.30000115.5
53C42.8Very low45.2Very low110 Ų110146.2 Ų146.274%0.74381%0.814SS**  trans91.1108.1170.3-51.80000113.5
54Q42Very low45.3Very low163 Ų163142.9 Ų142.976%0.76281%0.811SS**  91111.656.4-176.1-177.823.800112
55N38.9Very low45.3Very low156 Ų156140.7 Ų140.783%0.83481%0.809SS**  trans54.8145.5159.9-61.111.8000119.5
56G39.7Very low45.1Very low76 Ų76136.6 Ų136.678%0.78480%0.8SS**  trans151.365.4160.300000116.4V58G56-V58 PolarHBondContact O-N 3.1Å
57F39.5Very low44.9Very low210 Ų210138.9 Ų138.992%0.92181%0.805SS**  trans-79.599170.6-148.4-83.6000109.7
58V45.4Very low45.1Very low131 Ų131137.3 Ų137.379%0.79481%0.806SS**  trans-143.9115.7161.7-1780000109.9G56G56-V58 PolarHBondContact O-N 3.1Å
59A41.8Very low45.3Very low89 Ų89136.9 Ų136.974%0.73682%0.815SS**  trans-88.1141.2167.600000110.7
60K54.6Low46Very low192 Ų192137.7 Ų137.784%0.83581%0.812SS**  trans-141.6120.1159.5-99-173.2175.5-179.80109
61P46.3Very low46.4Very low130 Ų130141.3 Ų141.384%0.84482%0.823SS**  trans-88.5136.6170.833.8-30.1000110.2
62T53.3Low46.4Very low133 Ų133133.6 Ų133.682%0.81680%0.804SS**  trans-126.1128.2169.9-45.10000108.8
63K41.7Very low47Very low199 Ų199134.1 Ų134.187%0.86581%0.808SS**  trans-71.6144.8178.5-58.1174.3177.9-179.20110.8
64V55.5Low46.7Very low141 Ų141132.4 Ų132.486%0.85581%0.809SS**  trans-140.5145.9152.7-174.40000108.4
65D46.4Very low46.5Very low157 Ų157130.9 Ų130.984%0.8482%0.815SS**  trans-71.7168-165.4-74.6-95.3000117.3
66A47.6Very low46.5Very low83 Ų83128.3 Ų128.369%0.68681%0.809SS**  trans-75.7143174.800000112.5
67N49.1Very low46.6Very low174 Ų174130.2 Ų130.293%0.9381%0.81SS**  trans160.198.4139.4-83.1-35.9000108.7
68G45.3Very low46.4Very low76 Ų76125.4 Ų125.478%0.78480%0.803SS**  trans-170.7100.617800000109.7
69A50.4Low45.8Very low106 Ų106126 Ų12688%0.87680%0.801SS**  trans-78.1126.8169.700000108.6
70D58.6Low45.4Very low145 Ų145125.5 Ų125.578%0.77579%0.79SS**  trans-141.4111.1169.3-169.2-115.6000108.5G72D70-G72 PolarHBondContact O-N 2.6Å
71D50.9Low44.3Very low179 Ų179121.9 Ų121.996%0.95778%0.783SS**  trans-74.175.8173.6-95.6-78.8000109.1
72G48.1Very low43.8Very low52 Ų52121.4 Ų121.454%0.53677%0.773SS.*  trans-114.873.3-161.500000116D70D70-G72 PolarHBondContact O-N 2.6Å
73S49.9Very low42.9Very low114 Ų114120.7 Ų120.780%0.79777%0.772SS**  trans52.199.6147.3-178.10000120.1
74G36.7Very low42.7Very low74 Ų74115.7 Ų115.776%0.76376%0.758SS**  66.756.7117.700000119.2S76G74-S76 VanDerWaalsContact C-N 3.29Å; G74-S76 PolarHBondContact O-N 2.97Å
75C36.2Very low42Very low131 Ų131118 Ų11889%0.88576%0.76SS**  trans-7583.5158.7-72.10000110.2S77C75-S77 PolarHBondContact O-N 2.92Å
76S39.2Very low41.8Very low102 Ų102114.9 Ų114.971%0.71375%0.746SS**  trans-59.3119.5167.4-174.60000109G74 S78G74-S76 VanDerWaalsContact C-N 3.29Å; G74-S76 PolarHBondContact O-N 2.97Å; S76-S78 PolarHBondContact O-N 3.45Å
77S41.7Very low42.1Very low116 Ų116115.2 Ų115.281%0.81174%0.742SS**  trans-48.7116.4178.9-60.90000110.1C75 D79C75-S77 PolarHBondContact O-N 2.92Å; S77-D79 VanDerWaalsContact C-N 3.3Å; S77-D79 PolarHBondContact O-N 3.38Å
78S34.9Very low42.7Very low109 Ų109109.6 Ų109.676%0.76271%0.714SS**  trans-76.984.7-175.3-60.50000109.7S76 T80S76-S78 PolarHBondContact O-N 3.45Å; S78-T80 PolarHBondContact O-N 3.4Å
79D33.7Very low43.9Very low143 Ų143111 Ų11177%0.76570%0.698SS**  trans-57.7124.1163.7-132.5-54.3000108.3S77 V81S77-D79 VanDerWaalsContact C-N 3.3Å; S77-D79 PolarHBondContact O-N 3.38Å; D79-V81 PolarHBondContact O-N 3.43Å
80T33.6Very low45.3Very low80 Ų80106.6 Ų106.649%0.49166%0.66SS.*  trans-80.782.1-150.546.50000112.6S78 L82 H216S78-T80 PolarHBondContact O-N 3.4Å; T80-L82 PolarHBondContact O-N 3.41Å; T80-H216 PolarHBondContact OG1-CE1 3.43Å
81V32Very low46.4Very low115 Ų115105.2 Ų105.270%0.69765%0.647SS**  trans-73.460.9164.7-164.50000109.9D79 C83D79-V81 PolarHBondContact O-N 3.43Å; V81-C83 HydrophobicContact CG1-CB 4.13Å; V81-C83 PolarHBondContact O-N 3.3Å
82L34.4Very low47.9Very low121 Ų12196.8 Ų96.863%0.63460%0.602SS**  trans-77.148.8168.1-97.1168.2000110.9T80 V84 A219T80-L82 PolarHBondContact O-N 3.41Å; L82-V84 HydrophobicContact CD2-CB 4.29Å; L82-V84 PolarHBondContact O-N 2.77Å; L82-A219 HydrophobicContact CD1-CB 4.24Å
83C35.8Very low49.6Very low117 Ų117101.7 Ų101.779%0.79160%0.604SS**  trans-7633.7162.4-66.30000111.2V81V81-C83 HydrophobicContact CG1-CB 4.13Å; V81-C83 PolarHBondContact O-N 3.3Å
84V36.9Very low51.2Low94 Ų9496.3 Ų96.357%0.5757%0.566SS**  trans-107.389.9-175.4-174.30000109.6L82 T86L82-V84 HydrophobicContact CD2-CB 4.29Å; L82-V84 PolarHBondContact O-N 2.77Å; V84-T86 PolarHBondContact O-N 2.95Å; V84-T86 VanDerWaalsContact O-N 3.1Å
85E40.5Very low53.1Low191 Ų19194.7 Ų94.789%0.89354%0.543SS*.  trans56.144132.2-147.4172.5-179.800117.5
86T42.6Very low54.9Low91 Ų9195.1 Ų95.156%0.55853%0.532SS*.  trans-104.2149.915456.70000109.6V84 T88V84-T86 PolarHBondContact O-N 2.95Å; V84-T86 VanDerWaalsContact O-N 3.1Å; T86-T88 VanDerWaalsContact C-N 3.29Å; T86-T88 WeakPolarHBondContact O-CG2 3.38Å; T86-T88 PolarHBondContact O-N 3.35Å
87P53.1Low56.7Low90 Ų9091.4 Ų91.458%0.58450%0.504SS*.  trans-67.892.9173.427.9-33.7000108.7K89P87-K89 PolarHBondContact O-N 2.83Å
88T61.8Low58.3Low56 Ų5690 Ų9034%0.34449%0.488SS..  trans-60.1-29-173.963.90000112.2T86 L90 D262T86-T88 VanDerWaalsContact C-N 3.29Å; T86-T88 WeakPolarHBondContact O-CG2 3.38Å; T86-T88 PolarHBondContact O-N 3.35Å; T88-L90 PolarHBondContact O-N 2.65Å; T88-L90 VanDerWaalsContact O-N 3.15Å; T88-D262 VanDerWaalsContact CB-CG 3.45Å; T88-D262 VanDerWaalsContact CB-OD1 3.3Å; T88-D262 WeakPolarHBondContact CB-OD1 3.06Å; T88-D262 WeakPolarHBondContact CB-OD2 3.45Å; T88-D262 PolarHBondContact OG1-OD2 3.08Å
89K70.3Confident60.1Low105 Ų10586.7 Ų86.746%0.45746%0.462SS..EExtended strand (participates in β ladder)trans-70.9100.4173.7-64.3-155.3172.3-163.80112.6P87 D252 Q260 F261P87-K89 PolarHBondContact O-N 2.83Å; K89-D252 IonicContact NZ-OD2 2.74Å; K89-D252 PolarHBondContact NZ-OD2 3.26Å; K89-Q260 HydrophobicContact CB-CG 3.93Å; K89-Q260 HydrophobicContact CD-CG 4.19Å; K89-F261 CarbonylContact C-O 3.55Å; K89-F261 VanDerWaalsContact CA-O 3.31Å; K89-F261 WeakPolarHBondContact CA-O 3.26Å
90L79.5Confident61.9Low14 Ų1485.9 Ų85.97%0.07346%0.458CS..EExtended strand (participates in β ladder)trans-75159.6168.2-57.1-164.2000111.6T88 R226 I229 Q260 F261 L263T88-L90 PolarHBondContact O-N 2.65Å; T88-L90 VanDerWaalsContact O-N 3.15Å; L90-R226 HydrophobicContact CD1-CB 3.95Å; L90-R226 HydrophobicContact CD1-CG 4.12Å; L90-R226 HydrophobicContact CD2-CB 4.18Å; L90-R226 HydrophobicContact CD2-CG 3.56Å; L90-I229 HydrophobicContact CD1-CD1 4.23Å; L90-I229 HydrophobicContact CD1-CG2 4.45Å; L90-Q260 WeakPolarHBondContact O-CA 3.42Å; L90-Q260 WeakPolarHBondContact O-CG 3.48Å; L90-F261 HydrophobicContact CB-CD2 4.4Å; L90-F261 HydrophobicContact CB-CE1 4.49Å; L90-F261 HydrophobicContact CB-CE2 4Å; L90-F261 HydrophobicContact CB-CZ 4.07Å; L90-F261 HydrophobicContact CD1-CE2 4.1Å; L90-F261 HydrophobicContact CD1-CZ 4.45Å; L90-F261 HydrophobicContact CG-CE2 4.42Å; L90-F261 PolarHBondContact N-O 2.82Å; L90-F261 PolarHBondContact O-N 3.22Å; L90-F261 VanDerWaalsContact O-N 3.12Å; L90-L263 HydrophobicContact CD1-CD1 3.61Å; L90-L263 HydrophobicContact CD1-CD2 4.39Å; L90-L263 HydrophobicContact CD1-CG 3.7Å; L90-L263 HydrophobicContact CG-CG 4.34Å
91K81.9Confident63.9Low115 Ų11586.9 Ų86.950%0.546%0.457SS..EExtended strand (participates in β ladder)trans-128.3112.2173.4-68.9178-178.8173.30109.9F258 L259 Q260K91-F258 HydrophobicContact CB-CB 4.45Å; K91-F258 HydrophobicContact CB-CD1 4.3Å; K91-L259 WeakPolarHBondContact CA-O 3.32Å; K91-Q260 HydrophobicContact CG-CB 4.22Å; K91-Q260 HydrophobicContact CG-CG 4.08Å
92L84.1Confident65.7Low3 Ų381.6 Ų81.62%0.01643%0.425CS..EExtended strand (participates in β ladder)trans-89.2131.4167.9174.169.7000109.1I94 I229 V232 A238 I241 A242 F258 L259 F261L92-I94 HydrophobicContact CD2-CG2 4.1Å; L92-I94 HydrophobicContact CG-CG2 4.1Å; L92-I94 PolarHBondContact O-N 2.96Å; L92-I229 HydrophobicContact CD1-CG2 4.48Å; L92-V232 HydrophobicContact CD1-CB 4.16Å; L92-V232 HydrophobicContact CD1-CG1 4.37Å; L92-A238 HydrophobicContact CD1-CB 4.38Å; L92-I241 HydrophobicContact CD2-CB 4.17Å; L92-I241 HydrophobicContact CD2-CG2 3.78Å; L92-A242 HydrophobicContact CD2-CB 4.43Å; L92-F258 CarbonylContact O-C 3.47Å; L92-F258 VanDerWaalsContact O-CA 3.26Å; L92-F258 WeakPolarHBondContact O-CA 3.42Å; L92-L259 HydrophobicContact CB-CB 4.33Å; L92-L259 HydrophobicContact CD2-CD2 4.49Å; L92-L259 PolarHBondContact N-O 2.83Å; L92-L259 PolarHBondContact O-N 3.06Å; L92-F261 HydrophobicContact CB-CE1 3.82Å
93R83.5Confident67.4Low155 Ų15579.5 Ų79.559%0.58542%0.415SS*.EExtended strand (participates in β ladder)trans-76.4118.5174.3-177.1177.4175.2169.9-0.9109.7S95 F258R93-S95 PolarHBondContact NE-OG 3.26Å; R93-F258 HydrophobicContact CB-CD1 4.28Å; R93-F258 HydrophobicContact CB-CE1 4.12Å; R93-F258 HydrophobicContact CG-CE1 4.28Å
94I82.1Confident69.2Low1 Ų180.1 Ų80.11%0.00540%0.404CS..  trans-11618-178.763.6168000112.7L92 H96 L97 V99 I102 H257 L259L92-I94 HydrophobicContact CD2-CG2 4.1Å; L92-I94 HydrophobicContact CG-CG2 4.1Å; L92-I94 PolarHBondContact O-N 2.96Å; I94-H96 PolarHBondContact O-N 3.16Å; I94-L97 HydrophobicContact CB-CB 4.33Å; I94-L97 HydrophobicContact CB-CD1 3.96Å; I94-L97 HydrophobicContact CB-CG 4.25Å; I94-L97 HydrophobicContact CG2-CD1 3.85Å; I94-L97 PolarHBondContact O-N 3.33Å; I94-V99 HydrophobicContact CD1-CG2 4.06Å; I94-I102 HydrophobicContact CD1-CD1 4.38Å; I94-H257 WeakPolarHBondContact CG1-O 3.45Å; I94-H257 PolarHBondContact N-O 3.34Å; I94-L259 HydrophobicContact CD1-CB 4.19Å; I94-L259 HydrophobicContact CD1-CD1 4.5Å; I94-L259 HydrophobicContact CG2-CB 3.82Å
95S77.6Confident70.4Confident40 Ų4081 Ų8128%0.2840%0.402SS..THydrogen-bonded Turntrans-60.4-6.8-176.1580000115.9R93R93-S95 PolarHBondContact NE-OG 3.26Å
96H74.6Confident71.5Confident139 Ų13973.6 Ų73.664%0.64437%0.368SS*.THydrogen-bonded Turntrans-113.83.9179.2-54.1-72.7000112.6I94 P235I94-H96 PolarHBondContact O-N 3.16Å; H96-P235 HydrophobicContact CB-CB 4.46Å
97L77.1Confident72.2Confident25 Ų2578.5 Ų78.513%0.13138%0.382CS..SBendtrans-110.5153.6-174.8-51.6-174.5000110.8I94 V99 I102 P235 A238 Q239 A242I94-L97 HydrophobicContact CB-CB 4.33Å; I94-L97 HydrophobicContact CB-CD1 3.96Å; I94-L97 HydrophobicContact CB-CG 4.25Å; I94-L97 HydrophobicContact CG2-CD1 3.85Å; I94-L97 PolarHBondContact O-N 3.33Å; L97-V99 PolarHBondContact O-N 3.13Å; L97-V99 VanDerWaalsContact O-N 3.09Å; L97-I102 HydrophobicContact CB-CD1 3.98Å; L97-I102 HydrophobicContact CD1-CD1 4.08Å; L97-P235 HydrophobicContact CD2-CB 4.3Å; L97-A238 HydrophobicContact CD1-CB 4.14Å; L97-Q239 HydrophobicContact CD1-CB 4.27Å; L97-Q239 HydrophobicContact CD2-CB 4.04Å; L97-A242 HydrophobicContact CD1-CB 4.36Å
98N75.1Confident72.4Confident87 Ų8783.5 Ų83.547%0.46539%0.394SS..  trans-77.995.9176.7-169.3-0.3000110.6D100 E101 I102N98-D100 PolarHBondContact O-N 3.14Å; N98-D100 PolarHBondContact OD1-N 3.38Å; N98-E101 HydrophobicContact CB-CB 4.18Å; N98-E101 WeakPolarHBondContact O-CB 3.49Å; N98-E101 PolarHBondContact O-N 2.93Å; N98-I102 PolarHBondContact O-N 3.42Å
99V71.8Confident71.9Confident38 Ų3883.7 Ų83.723%0.2341%0.408CS..Hα-helixtrans-57.5-35.4-176.8-1760000112.1I94 L97 E101 I102 N103 V253I94-V99 HydrophobicContact CD1-CG2 4.06Å; L97-V99 PolarHBondContact O-N 3.13Å; L97-V99 VanDerWaalsContact O-N 3.09Å; V99-E101 PolarHBondContact O-N 3.35Å; V99-I102 PolarHBondContact O-N 2.87Å; V99-N103 WeakPolarHBondContact O-CB 3.37Å; V99-N103 PolarHBondContact O-N 3.2Å; V99-V253 HydrophobicContact CG1-CG1 4.02Å; V99-V253 HydrophobicContact CG1-CG2 4.4Å
100D72.6Confident71.3Confident127 Ų12788.4 Ų88.468%0.67943%0.428SS*.Hα-helixtrans-65-25.9178.2-71.1-42.5000112.7N98 K104N98-D100 PolarHBondContact O-N 3.14Å; N98-D100 PolarHBondContact OD1-N 3.38Å; D100-K104 WeakPolarHBondContact O-CG 3.34Å
101E74.4Confident70.2Confident101 Ų10197.8 Ų97.847%0.47247%0.468SS..Hα-helixtrans-79.1-45.5176.9-171.7155-156.400111.9N98 V99 N103 K104N98-E101 HydrophobicContact CB-CB 4.18Å; N98-E101 WeakPolarHBondContact O-CB 3.49Å; N98-E101 PolarHBondContact O-N 2.93Å; V99-E101 PolarHBondContact O-N 3.35Å; E101-N103 PolarHBondContact O-N 2.94Å; E101-K104 HydrophobicContact CG-CD 4.49Å; E101-K104 WeakPolarHBondContact O-CB 3.37Å; E101-K104 PolarHBondContact O-N 3.19Å
102I70.9Confident68.9Low3 Ų3103.4 Ų103.42%0.01549%0.486CS..Hα-helixtrans-58.8-39.7175.3-59.2167.7000110.4I94 L97 N98 V99 K104 A242 A246 F251 L259I94-I102 HydrophobicContact CD1-CD1 4.38Å; L97-I102 HydrophobicContact CB-CD1 3.98Å; L97-I102 HydrophobicContact CD1-CD1 4.08Å; N98-I102 PolarHBondContact O-N 3.42Å; V99-I102 PolarHBondContact O-N 2.87Å; I102-K104 VanDerWaalsContact C-N 3.3Å; I102-K104 PolarHBondContact O-N 3.43Å; I102-A242 HydrophobicContact CD1-CB 4.03Å; I102-A242 HydrophobicContact CG1-CB 4.46Å; I102-A246 HydrophobicContact CG2-CB 4.26Å; I102-F251 HydrophobicContact CG2-CE2 4.36Å; I102-F251 HydrophobicContact CG2-CZ 4.1Å; I102-L259 HydrophobicContact CG2-CD1 4.26Å
103N70.1Confident67.6Low78 Ų78111.1 Ų111.142%0.41752%0.52SS..THydrogen-bonded Turntrans-74.9-12.3-175.5-155.937.1000114.2V99 E101 H105 N106V99-N103 WeakPolarHBondContact O-CB 3.37Å; V99-N103 PolarHBondContact O-N 3.2Å; E101-N103 PolarHBondContact O-N 2.94Å; N103-H105 PolarHBondContact O-N 3.07Å; N103-N106 PolarHBondContact O-N 2.97Å; N103-N106 VanDerWaalsContact O-N 3.12Å
104K71.8Confident66.1Low129 Ų129114.1 Ų114.156%0.56153%0.531SS*.THydrogen-bonded Turntrans-58.8-29.5176.9-72.1166-170.2167.70113.1D100 E101 I102D100-K104 WeakPolarHBondContact O-CG 3.34Å; E101-K104 HydrophobicContact CG-CD 4.49Å; E101-K104 WeakPolarHBondContact O-CB 3.37Å; E101-K104 PolarHBondContact O-N 3.19Å; I102-K104 VanDerWaalsContact C-N 3.3Å; I102-K104 PolarHBondContact O-N 3.43Å
105H63.8Low64.7Low113 Ų113121 Ų12152%0.52356%0.563SS.*SBendtrans-83-25.7179.4-68.2-77.3000112.9N103 K107 A246N103-H105 PolarHBondContact O-N 3.07Å; H105-K107 PolarHBondContact O-N 3.33Å; H105-A246 HydrophobicContact CB-CB 4.31Å; H105-A246 WeakPolarHBondContact CB-O 3.31Å
106N62.5Low63.3Low35 Ų35128.9 Ų128.919%0.18759%0.587CS.*  trans-87.972.6-177.6-166.6-20.4000112.1N103 K108 F251N103-N106 PolarHBondContact O-N 2.97Å; N103-N106 VanDerWaalsContact O-N 3.12Å; N106-K108 PolarHBondContact O-N 2.67Å; N106-F251 HydrophobicContact CB-CE1 3.68Å; N106-F251 HydrophobicContact CB-CE2 4.18Å; N106-F251 HydrophobicContact CB-CZ 3.44Å; N106-F251 VanDerWaalsContact CB-CZ 3.44Å; N106-F251 WeakPolarHBondContact ND2-CZ 3.3Å; N106-F251 PolarHBondContact ND2-O 3.21Å
107K58.6Low62.3Low195 Ų195127.4 Ų127.485%0.84859%0.592SS**THydrogen-bonded Turntrans-73.814.5-179.1-68.7-172.7175.6-179.60115H105H105-K107 PolarHBondContact O-N 3.33Å
108K56Low61.3Low194 Ų194133.2 Ų133.284%0.84362%0.623SS**THydrogen-bonded Turntrans-135.835.2-174.9-73.1-171.9177.4176.90115.8N106 K110N106-K108 PolarHBondContact O-N 2.67Å; K108-K110 PolarHBondContact O-N 3.28Å
109G52Low59.9Low61 Ų61134.3 Ų134.363%0.62964%0.638SS**  trans-87.594.9171.700000114.9K111G109-K111 PolarHBondContact O-N 2.93Å
110K57.5Low58.9Low204 Ų204136.3 Ų136.389%0.88767%0.666SS**  trans-62.6106.9168.6-90.6-175.4175.7177.80110.4K108 R112K108-K110 PolarHBondContact O-N 3.28Å; K110-R112 PolarHBondContact O-N 2.95Å
111K56.1Low57.9Low210 Ų210138.5 Ų138.591%0.91368%0.677SS**  trans-62.688.5173.7-74.3-176176.7178.20111.9G109 K113G109-K111 PolarHBondContact O-N 2.93Å; K111-K113 VanDerWaalsContact C-N 3.34Å; K111-K113 PolarHBondContact O-N 3.35Å
112R54Low57Low234 Ų234141.4 Ų141.488%0.88370%0.696SS**  trans-73.786.9165.6-77.5-175.672.3176.93.6110.1K110 R114K110-R112 PolarHBondContact O-N 2.95Å; R112-R114 PolarHBondContact O-N 3.17Å
113K58Low55.7Low164 Ų164145.9 Ų145.971%0.71373%0.727SS**  trans-60.1105169.5-170.2-170.7-173.6-163.10109.2K111 Q115K111-K113 VanDerWaalsContact C-N 3.34Å; K111-K113 PolarHBondContact O-N 3.35Å; K113-Q115 VanDerWaalsContact CE-OE1 3.26Å; K113-Q115 PolarHBondContact O-N 3.25Å
114R51.4Low54.7Low218 Ų218151.7 Ų151.782%0.82375%0.752SS**  trans-78.592.2167.3-70.9-179.4105.7-174.58.2108.2R112R112-R114 PolarHBondContact O-N 3.17Å
115Q53.8Low53.6Low146 Ų146149.2 Ų149.268%0.68276%0.763SS**  trans-85.9122.9167.2-154.1159.5-22.100107.5K113K113-Q115 VanDerWaalsContact CE-OE1 3.26Å; K113-Q115 PolarHBondContact O-N 3.25Å
116R48.1Very low52.9Low206 Ų206149.7 Ų149.778%0.77778%0.779SS**  trans-111.3146.8173-88.6179.4161.2168.6-9.2107.7
117S51.7Low52Low108 Ų108153.9 Ų153.976%0.75581%0.811SS**  trans69.2147177.2-43.50000113.9
118D56.3Low51.3Low146 Ų146148.9 Ų148.978%0.78181%0.806SS**  cis-147.8175.6-3.2-144.7-44.4000110.5
119S46.9Very low50.6Low111 Ų111147.6 Ų147.678%0.77680%0.803SS**  trans-52.4158.1177.550.40000117.3
120G49.8Very low50.3Low80 Ų80153.2 Ų153.283%0.82582%0.818SS**  trans169.779.517400000112.8
121L52.9Low50.3Low173 Ų173150.7 Ų150.791%0.90681%0.811SS**  trans-85.2130.3168.7-66165.6000108.9
122D53.8Low50.3Low161 Ų161145.8 Ų145.886%0.86180%0.801SS**  trans-166.5170.1130.2-130.1-57.6000112.1
123S43.8Very low50Low98 Ų98141.6 Ų141.669%0.68580%0.802SS**  trans-128.6173.8-152.6-52.80000116.1
124E50.9Low49.7Very low199 Ų199141.2 Ų141.293%0.9380%0.802SS**  trans80.3140.5156.7-45-142.994.600119.6
125G48.5Very low49.6Very low77 Ų77136 Ų13679%0.79480%0.797SS**  trans158.460.9173.500000119.9
126S49Very low49.4Very low123 Ų123133.9 Ų133.986%0.8680%0.798SS**  trans39.7104.9152.5-66.90000123.9
127S43.3Very low49.5Very low124 Ų124129.6 Ų129.687%0.86780%0.797SS**  0.9142.4125.3-166.90000121.8
128A43.2Very low49Very low90 Ų90129.7 Ų129.774%0.74480%0.798SS**  trans-164.713314300000113.7
129Q41.5Very low48.4Very low166 Ų166127.7 Ų127.778%0.77680%0.795SS**  166.8122.4118.8-91.4-167.812.300113.5
130L44.9Very low48.2Very low179 Ų179131.7 Ų131.794%0.93780%0.801SS**  trans-137.8149.3148.7-80176.7000108.2
131M58.9Low48.4Very low151 Ų151135.5 Ų135.574%0.74480%0.802SS**  trans-93.6-170.4-168.1-62.8-98.292.800112.1
132P55.4Low48.5Very low108 Ų108133.4 Ų133.470%0.70180%0.799SS**  -131.8177.6-7040.2-25.4000112.4
133T47.9Very low47.8Very low146 Ų146130.7 Ų130.790%0.89679%0.792SS**  trans-167.7144.9144.7-71.40000110.4
134E52.4Low48Very low155 Ų155131.6 Ų131.672%0.72480%0.799SS**  trans-80.8-172.9-177.6-117.2-153.292.300113.5S136E134-S136 PolarHBondContact OE1-N 3.31Å
135P49.3Very low47.7Very low109 Ų109129.5 Ų129.571%0.70879%0.794SS**  cis-139.716115.340.4-20.3000120.6
136S47.9Very low47.4Very low102 Ų102130.3 Ų130.371%0.71379%0.787SS**  trans71.3157.1140.1-77.60000124.3E134E134-S136 PolarHBondContact OE1-N 3.31Å
137P51.2Low47.3Very low116 Ų116135.8 Ų135.875%0.75379%0.789SS**  trans-133.1166.5-146.142.5-26.4000117.9
138S42.2Very low47.6Very low110 Ų110139.4 Ų139.477%0.76979%0.789SS**  trans-164.7122.4145.2-120.60000117.2
139S43.2Very low47.8Very low104 Ų104140.5 Ų140.573%0.72779%0.786SS**  70.4137.6122.2-54.60000124.1
140Q43Very low48Very low194 Ų194138.1 Ų138.191%0.90778%0.783SS**  trans87.5109.6156-68.5177.43.800121
141L53.3Low47.9Very low160 Ų160138.5 Ų138.584%0.83878%0.78SS**  trans-93.2163.2151.6-66.7170000109.7
142P55.6Low47Very low130 Ų130135.1 Ų135.184%0.84478%0.777SS**  -137.2160125.536.7-25.8000114.7
143S37.7Very low46.6Very low103 Ų103137.1 Ų137.172%0.7279%0.787SS**  trans-94.2165.3-172.8-58.30000114.9
144S48Very low46.3Very low118 Ų118136.8 Ų136.883%0.82579%0.785SS**  trans72.4129.2149.770.90000120.3
145N45.2Very low45.9Very low155 Ų155132.6 Ų132.683%0.82978%0.783SS**  -167.6156.5100.5-157.8-3.8000112.6
146S42.3Very low45.7Very low93 Ų93135.9 Ų135.965%0.6579%0.789SS**  trans-79.3160.3-176.964.90000116.4
147R47.4Very low45.7Very low238 Ų238137.6 Ų137.690%0.89879%0.789SS**  trans-155.6124.1144.4-66.4-161.4-179.5-177.21.4113.3
148K49.3Very low45.5Very low200 Ų200140.2 Ų140.287%0.8779%0.794SS**  trans41.4151.6132.6-66.1-168.7173.4-174.10120.8
149V48.1Very low45.4Very low113 Ų113140.5 Ų140.569%0.68580%0.796SS**  cis-169.3130.61.3121.70000106
150T44.3Very low45.9Very low116 Ų116141.1 Ų141.171%0.71280%0.797SS**  60132.589.7-36.90000113.4
151Q44.3Very low46.1Very low187 Ų187138 Ų13887%0.87479%0.791SS**  cis-136.2-112.528-153.4176.2111.400116.4
152A39.8Very low45.5Very low81 Ų81135.6 Ų135.667%0.66979%0.787SS**  trans-165.6179.5-156.500000113.9
153V47Very low45.3Very low150 Ų150135 Ų13591%0.90979%0.786SS**  trans-167.7146.3143137.80000111.4
154T40.4Very low45.5Very low139 Ų139137.6 Ų137.685%0.85379%0.792SS**  trans-129.4142.8-176.4-24.70000110.9
155G44.4Very low46Very low67 Ų67137 Ų13769%0.69179%0.785SS**  trans-170.7107167.400000109
156Q46.2Very low46.3Very low177 Ų177134.2 Ų134.283%0.82778%0.778SS**  77.4135.475.5-80.1-151.321.300115.1
157L46Very low46.6Very low139 Ų139138.6 Ų138.673%0.72879%0.788SS**  trans95.9121147.9-78.3159.5000121.7
158M48.2Very low47.1Very low171 Ų171138.4 Ų138.484%0.84279%0.787SS**  trans95.6132.2146.2-41.1-135.580.500120
159S38.8Very low46.9Very low116 Ų116134.9 Ų134.981%0.81178%0.778SS**  trans-121.9156.6170.9-41.90000109.6
160P54.2Low47.1Very low117 Ų117134.1 Ų134.176%0.7678%0.778SS**  trans-128.5138.713834.3-23.9000109.7
161V46.9Very low47.2Very low129 Ų129132.3 Ų132.378%0.78277%0.77SS**  cis73.5117.243.196.20000114.9
162S42.3Very low47.8Very low108 Ų108131.7 Ų131.776%0.75577%0.767SS**  trans64.5142170.4-58.30000116.8
163S49.8Very low48.4Very low118 Ų118137 Ų13783%0.82578%0.775SS**  cis-155.2157.642-55.80000113.7
164N43.4Very low48.3Very low157 Ų157134.4 Ų134.484%0.8477%0.768SS**  trans-121.6133.1173.1-167.539.6000109.2
165P57.1Low49Very low105 Ų105133 Ų13368%0.68276%0.764SS**  trans-128.5109.6155.128.1-10.9000110.2
166S51Low49.2Very low97 Ų97135 Ų13568%0.67877%0.768SS**  79.1113.987.874.60000114.6
167H50.2Low49.1Very low185 Ų185132.4 Ų132.486%0.85677%0.769SS**  trans-14.6137.2162.1-61.8-101.2000118.1
168R56.4Low49.2Very low235 Ų235131.5 Ų131.589%0.88777%0.774SS**  trans-121.3111.6135.5-97-154.1171.7-140.20.5110.8
169D45.6Very low49Very low126 Ų126129.3 Ų129.367%0.67478%0.776SS**  trans-73.6146.9155.5-161.3-41.7000108.5S171D169-S171 PolarHBondContact OD1-N 3.37Å; D169-S171 VanDerWaalsContact OD1-N 3.1Å; D169-S171 PolarHBondContact OD1-OG 3.22Å
170S51.7Low49.3Very low97 Ų97127.3 Ų127.368%0.67877%0.774SS**  trans-16065.2168.3-73.30000109.2
171S47.8Very low48.8Very low78 Ų78131.5 Ų131.555%0.54578%0.783SS.*  trans-65171.4152.745.40000111.3D169D169-S171 PolarHBondContact OD1-N 3.37Å; D169-S171 VanDerWaalsContact OD1-N 3.1Å; D169-S171 PolarHBondContact OD1-OG 3.22Å
172H57Low48.7Very low174 Ų174131.2 Ų131.281%0.80679%0.786SS**  trans94.9136.9-168.1-48.8-32000113.9
173K51.9Low48.6Very low193 Ų193131.7 Ų131.784%0.83979%0.789SS**  cis-154.4147.9-5.7-126.7-174.4-178.2-1720109.2
174A45.7Very low48.3Very low94 Ų94132.1 Ų132.178%0.77779%0.792SS**  trans-87.3137.7167.500000111.1
175S54.8Low48.2Very low110 Ų110128.6 Ų128.677%0.76979%0.793SS**  trans-158.9105.7159.4-72.30000105.9
176S48.3Very low47.1Very low110 Ų110127.5 Ų127.577%0.76980%0.8SS**  74.9101.173.6-62.60000114
177S43Very low46.8Very low122 Ų122128.7 Ų128.785%0.85381%0.809SS**  trans50.6117.5137.4-49.70000121.1
178S49Very low46.5Very low119 Ų119125.8 Ų125.883%0.83280%0.804SS**  -156.7119.6124.563.90000112
179S44.4Very low45.8Very low125 Ų125119.8 Ų119.887%0.87479%0.794SS**  trans-68.7130.6164.147.60000110.7
180G44.3Very low45.9Very low75 Ų75122.8 Ų122.877%0.77380%0.801SS**  trans-130.785.5176.200000111.9
181Q43.3Very low45.5Very low204 Ų204126.8 Ų126.895%0.95381%0.806SS**  trans-82.8121.7160-75.5178.7-36.400108.5
182C45.2Very low45.4Very low123 Ų123130.7 Ų130.783%0.83182%0.816SS**  trans-149.7114.1159.156.40000111
183S41.3Very low44.5Very low118 Ų118128.3 Ų128.383%0.82581%0.813SS**  trans-65.5152.1170.9-43.20000111.6
184S43.5Very low44.1Very low127 Ų127125.2 Ų125.289%0.88881%0.814SS**  trans-176.6137.5144.4-85.40000112.6
185G40.7Very low44.1Very low83 Ų83126.2 Ų126.286%0.85682%0.816SS**  trans57.7116.7154.700000118.1
186G33.9Very low43.4Very low82 Ų82127 Ų12785%0.84582%0.821SS**  cis95.188.626.500000110.8
187S44.5Very low43Very low122 Ų122125.6 Ų125.685%0.85382%0.824SS**  trans-150.5140.6158.4-167.90000109.4
188T43.5Very low43Very low124 Ų124129.7 Ų129.776%0.76183%0.827SS**  trans-116.8161.9-161.454.60000112.1
189V42.6Very low42.7Very low110 Ų110129.7 Ų129.767%0.66783%0.827SS**  trans62.8103.6163.4-165.60000116.6
190F48.3Very low42.3Very low189 Ų189127.6 Ų127.683%0.82983%0.825SS**  -140.7114.7125.3-94.3-72.1000110.2H192F190-H192 AromaticContact CD1-NE2 3.96Å
191K41.7Very low41.8Very low180 Ų180127.7 Ų127.778%0.78383%0.825SS**  trans-87.5126.9170.7-69.6178.8176179.50108.3
192H47.2Very low41.7Very low161 Ų161123.3 Ų123.375%0.74582%0.818SS**  trans-123.392.4162.9-66.5-62.1000109.8F190F190-H192 AromaticContact CD1-NE2 3.96Å
193T38.1Very low41.5Very low123 Ų123124.7 Ų124.776%0.75582%0.816SS**  trans-82.5124.1169.845.40000109.9
194C43.7Very low41.4Very low128 Ų128125.1 Ų125.187%0.86582%0.816SS**  trans-125.9112.5167.6-63.80000109.4
195S45.4Very low41.2Very low115 Ų115123.7 Ų123.780%0.80481%0.807SS**  trans-60.6140.8-166-51.20000117.5
196S38.6Very low41Very low127 Ų127127.7 Ų127.789%0.88881%0.809SS**  trans17.1122.3136.6-50.40000120.8
197G41.3Very low41.8Very low80 Ų80129.8 Ų129.883%0.82580%0.804SS**  trans-153.1104.215900000112.2
198K41.9Very low41.5Very low209 Ų209129 Ų12991%0.90979%0.791SS**  trans-71.5161.3168.6-79.7-179.6173.2-177.80109.7
199S42.5Very low41.3Very low119 Ų119131.6 Ų131.683%0.83280%0.8SS**  cis-169.61621927.50000112.4
200G36.5Very low41.1Very low81 Ų81131.8 Ų131.884%0.83580%0.801SS**  trans93.7118.6165.600000112.4
201G34.9Very low40.6Very low76 Ų76129.9 Ų129.978%0.78480%0.799SS**  cis116.9123.142.500000105.9
202S39.4Very low40.4Very low113 Ų113126.1 Ų126.179%0.7980%0.801SS**  cis-153.8163.323.2-57.60000112.2
203N41.9Very low40.2Very low151 Ų151125.5 Ų125.581%0.80780%0.803SS**  trans66.5100.9167.6-64-4.3000119.4
204P38.4Very low40.4Very low127 Ų127127 Ų12783%0.82581%0.806SS**  trans-92.4105.2152.633.5-22.9000109.5
205S40.3Very low40.6Very low98 Ų98123 Ų12369%0.68578%0.78SS**  trans-95.8111.6165.655.10000109.4V207S205-V207 PolarHBondContact O-N 2.99Å
206D35.9Very low40.9Very low167 Ų167124 Ų12489%0.89377%0.771SS**  trans-41.1101.7162-95.7-94.1000111.7
207V52.1Low42.1Very low125 Ų125119.6 Ų119.676%0.75874%0.737SS**  trans-148.4104.9160.7-80.70000110.5S205S205-V207 PolarHBondContact O-N 2.99Å
208D37.6Very low43.5Very low106 Ų106118.3 Ų118.357%0.56772%0.716SS**  trans62.685.6151.4-140.5-78000119.3T210D208-T210 PolarHBondContact O-N 3.33Å; D208-T210 WeakPolarHBondContact OD1-CA 3.49Å; D208-T210 WeakPolarHBondContact OD1-CB 3.48Å; D208-T210 PolarHBondContact OD1-N 2.92Å; D208-T210 PolarHBondContact OD1-OG1 3.44Å
209D39Very low44.9Very low179 Ų179111.3 Ų111.396%0.95770%0.696SS**THydrogen-bonded Turntrans-76.440.8168.8-141.5-34.4000112.3
210T39.1Very low46.6Very low113 Ų113110 Ų11069%0.69368%0.684SS**THydrogen-bonded Turntrans-135.21.6-172.3-5.30000115.6D208D208-T210 PolarHBondContact O-N 3.33Å; D208-T210 WeakPolarHBondContact OD1-CA 3.49Å; D208-T210 WeakPolarHBondContact OD1-CB 3.48Å; D208-T210 PolarHBondContact OD1-N 2.92Å; D208-T210 PolarHBondContact OD1-OG1 3.44Å
211I36.7Very low48.7Very low150 Ų150107.6 Ų107.677%0.76965%0.654SS**  trans-13257.4-175.5-39.7179.6000112.9
212A37.2Very low51Low101 Ų101106 Ų10684%0.83563%0.627SS**  trans-124.433.3169.400000112.8
213N43.2Very low53.1Low147 Ų147102.8 Ų102.879%0.78661%0.608SS**  trans-92.48.1177.6-112.6-22.6000113.6C215N213-C215 PolarHBondContact O-N 2.92Å
214D43Very low55.2Low154 Ų154103.9 Ų103.982%0.82460%0.601SS**  trans-7783.3169.8-137.2-56.4000109.2H216D214-H216 VanDerWaalsContact C-N 3.32Å; D214-H216 PolarHBondContact O-N 3.44Å
215C46.8Very low57.6Low45 Ų4597.9 Ų97.930%0.30456%0.561SS.*  trans-75.684.6-165.4-136.30000110N213 M217 Q272N213-C215 PolarHBondContact O-N 2.92Å; C215-M217 HydrophobicContact CB-CE 3.67Å; C215-M217 PolarHBondContact O-N 2.98Å; C215-M217 WeakPolarHBondContact SG-CE 3.28Å; C215-Q272 PolarHBondContact SG-NE2 3.19Å
216H52.8Low59.9Low136 Ų13698 Ų9863%0.6355%0.547SS*.  trans-64.984.2173.7-160.9-72.9000109.5T80 D214 S218T80-H216 PolarHBondContact OG1-CE1 3.43Å; D214-H216 VanDerWaalsContact C-N 3.32Å; D214-H216 PolarHBondContact O-N 3.44Å; H216-S218 PolarHBondContact O-N 3.27Å
217M64.3Low62.3Low34 Ų3494.9 Ų94.917%0.16753%0.53CS..  trans-52.5111-177.4-73.2-71.4121.900109.4C215 L222 I271 Q272C215-M217 HydrophobicContact CB-CE 3.67Å; C215-M217 PolarHBondContact O-N 2.98Å; C215-M217 WeakPolarHBondContact SG-CE 3.28Å; M217-L222 HydrophobicContact CB-CD2 4.1Å; M217-L222 HydrophobicContact CB-CG 4.25Å; M217-I271 HydrophobicContact CG-CB 4.45Å; M217-I271 HydrophobicContact CG-CD1 4.38Å; M217-I271 HydrophobicContact CG-CG2 4.01Å; M217-I271 HydrophobicContact SD-CB 4.42Å; M217-I271 HydrophobicContact SD-CG2 3.68Å; M217-Q272 HydrophobicContact CE-CG 3.85Å
218S69Low64.1Low54 Ų5493.5 Ų93.538%0.37851%0.514SS..  trans-61.9144.5-179.166.70000109.9H216 T220 S221 L222H216-S218 PolarHBondContact O-N 3.27Å; S218-T220 PolarHBondContact O-N 2.92Å; S218-T220 PolarHBondContact OG-OG1 3.32Å; S218-S221 PolarHBondContact O-N 2.88Å; S218-S221 PolarHBondContact OG-N 3.33Å; S218-S221 VanDerWaalsContact OG-N 3.16Å; S218-L222 PolarHBondContact O-N 2.99Å; S218-L222 VanDerWaalsContact O-N 3.12Å
219A72.9Confident66.6Low61 Ų6188.6 Ų88.650%0.50449%0.488SS..Hα-helixtrans-54-27.9174.500000112L82 A223L82-A219 HydrophobicContact CD1-CB 4.24Å; A219-A223 WeakPolarHBondContact O-CB 3.43Å; A219-A223 PolarHBondContact O-N 3.45Å
220T77Confident68.8Low92 Ų9283.9 Ų83.956%0.56447%0.474SS*.Hα-helixtrans-71.4-34174.254.40000113.8S218 R224S218-T220 PolarHBondContact O-N 2.92Å; S218-T220 PolarHBondContact OG-OG1 3.32Å; T220-R224 WeakPolarHBondContact O-CB 3.47Å; T220-R224 WeakPolarHBondContact O-CD 3.19Å; T220-R224 VanDerWaalsContact O-CG 3.23Å; T220-R224 WeakPolarHBondContact O-CG 3.34Å; T220-R224 PolarHBondContact O-N 2.88Å; T220-R224 VanDerWaalsContact O-N 3.11Å
221S81.9Confident71.1Confident31 Ų3181.8 Ų81.822%0.21747%0.468CS..Hα-helixtrans-71.4-42.4172.4-136.30000111.2S218 A223 R224 L225 E275S218-S221 PolarHBondContact O-N 2.88Å; S218-S221 PolarHBondContact OG-N 3.33Å; S218-S221 VanDerWaalsContact OG-N 3.16Å; S221-A223 PolarHBondContact O-N 3.48Å; S221-R224 PolarHBondContact O-N 3.26Å; S221-L225 WeakPolarHBondContact O-CB 3.46Å; S221-L225 PolarHBondContact O-N 3.22Å; S221-E275 PolarHBondContact OG-OE1 3.44Å
222L82.7Confident73.6Confident41 Ų4175.7 Ų75.722%0.21544%0.437CS..Hα-helixtrans-61.7-41.3176.1-62-179.5000112.4M217 S218 L225 R226 I271M217-L222 HydrophobicContact CB-CD2 4.1Å; M217-L222 HydrophobicContact CB-CG 4.25Å; S218-L222 PolarHBondContact O-N 2.99Å; S218-L222 VanDerWaalsContact O-N 3.12Å; L222-L225 PolarHBondContact O-N 3.11Å; L222-R226 WeakPolarHBondContact O-CB 3.5Å; L222-R226 PolarHBondContact O-N 3.38Å; L222-I271 HydrophobicContact CD2-CD1 3.98Å; L222-I271 HydrophobicContact CD2-CG2 3.79Å
223A82.6Confident75.9Confident46 Ų4680.2 Ų80.238%0.3844%0.438SS..Hα-helixtrans-61.3-48.5173.200000111.7A219 S221 L225 R226 D227A219-A223 WeakPolarHBondContact O-CB 3.43Å; A219-A223 PolarHBondContact O-N 3.45Å; S221-A223 PolarHBondContact O-N 3.48Å; A223-L225 VanDerWaalsContact C-N 3.32Å; A223-L225 PolarHBondContact O-N 2.97Å; A223-R226 WeakPolarHBondContact O-CB 3.23Å; A223-R226 PolarHBondContact O-N 2.77Å; A223-D227 VanDerWaalsContact O-CG 3.29Å; A223-D227 PolarHBondContact O-N 2.83Å
224R86.5Confident78Confident175 Ų17576.1 Ų76.166%0.6642%0.416SS*.Hα-helixtrans-60.9-39176.3-73.7169.5175.8-172.3-0.8112.6T220 S221 D227 K228T220-R224 WeakPolarHBondContact O-CB 3.47Å; T220-R224 WeakPolarHBondContact O-CD 3.19Å; T220-R224 VanDerWaalsContact O-CG 3.23Å; T220-R224 WeakPolarHBondContact O-CG 3.34Å; T220-R224 PolarHBondContact O-N 2.88Å; T220-R224 VanDerWaalsContact O-N 3.11Å; S221-R224 PolarHBondContact O-N 3.26Å; R224-D227 PolarHBondContact O-N 3.47Å; R224-K228 WeakPolarHBondContact O-CB 3.33Å; R224-K228 VanDerWaalsContact O-CG 3.28Å; R224-K228 WeakPolarHBondContact O-CG 3.5Å; R224-K228 PolarHBondContact O-N 3.3Å
225L88.9Confident80Confident1 Ų172.1 Ų72.11%0.00540%0.399CS..Hα-helixtrans-67.9-43.1177.1179.160.6000111.3S221 L222 A223 D227 K228 I229 L263 I271 L274 E275 F278S221-L225 WeakPolarHBondContact O-CB 3.46Å; S221-L225 PolarHBondContact O-N 3.22Å; L222-L225 PolarHBondContact O-N 3.11Å; A223-L225 VanDerWaalsContact C-N 3.32Å; A223-L225 PolarHBondContact O-N 2.97Å; L225-D227 VanDerWaalsContact C-N 3.33Å; L225-D227 PolarHBondContact O-N 3.21Å; L225-K228 PolarHBondContact O-N 3.01Å; L225-I229 HydrophobicContact CD1-CD1 4.03Å; L225-I229 HydrophobicContact CD1-CG1 4.23Å; L225-I229 HydrophobicContact CG-CD1 3.88Å; L225-I229 HydrophobicContact CG-CG1 4.48Å; L225-I229 WeakPolarHBondContact O-CB 3.41Å; L225-I229 VanDerWaalsContact O-CG1 3.27Å; L225-I229 WeakPolarHBondContact O-CG1 3.43Å; L225-I229 PolarHBondContact O-N 3.25Å; L225-L263 HydrophobicContact CD2-CD1 4.25Å; L225-L263 HydrophobicContact CD2-CD2 4.29Å; L225-L263 HydrophobicContact CG-CD1 4.4Å; L225-I271 HydrophobicContact CD2-CG2 3.77Å; L225-L274 HydrophobicContact CD1-CB 4.07Å; L225-L274 HydrophobicContact CD2-CB 4Å; L225-L274 HydrophobicContact CD2-CD1 4.21Å; L225-E275 HydrophobicContact CD1-CG 4.01Å; L225-E275 HydrophobicContact CD2-CG 4.2Å; L225-E275 HydrophobicContact CG-CG 4.47Å; L225-F278 HydrophobicContact CD1-CD2 4.09Å; L225-F278 HydrophobicContact CD1-CE2 3.67Å
226R88.6Confident82Confident100 Ų10072.6 Ų72.638%0.37740%0.402SS..Hα-helixtrans-54.4-48.7171.9164.3176.8-165.5-143.41111.6L90 L222 A223 I229 A230L90-R226 HydrophobicContact CD1-CB 3.95Å; L90-R226 HydrophobicContact CD1-CG 4.12Å; L90-R226 HydrophobicContact CD2-CB 4.18Å; L90-R226 HydrophobicContact CD2-CG 3.56Å; L222-R226 WeakPolarHBondContact O-CB 3.5Å; L222-R226 PolarHBondContact O-N 3.38Å; A223-R226 WeakPolarHBondContact O-CB 3.23Å; A223-R226 PolarHBondContact O-N 2.77Å; R226-I229 PolarHBondContact O-N 3.4Å; R226-A230 WeakPolarHBondContact O-CB 3.5Å; R226-A230 PolarHBondContact O-N 2.8Å
227D86.5Confident83.8Confident101 Ų10166.6 Ų66.654%0.5438%0.375SS..Hα-helixtrans-66.4-41.4-178.6-65.2-23.4000111.3A223 R224 L225 A230 A231A223-D227 VanDerWaalsContact O-CG 3.29Å; A223-D227 PolarHBondContact O-N 2.83Å; R224-D227 PolarHBondContact O-N 3.47Å; L225-D227 VanDerWaalsContact C-N 3.33Å; L225-D227 PolarHBondContact O-N 3.21Å; D227-A230 PolarHBondContact O-N 3.11Å; D227-A231 WeakPolarHBondContact O-CB 3.38Å; D227-A231 PolarHBondContact O-N 3.43Å
228K89.7Confident85Confident97 Ų9765.3 Ų65.342%0.42237%0.37SS..Hα-helixtrans-58.2-47172.1-78176.1178.2-177.60112.3R224 L225 A231 V232 F278R224-K228 WeakPolarHBondContact O-CB 3.33Å; R224-K228 VanDerWaalsContact O-CG 3.28Å; R224-K228 WeakPolarHBondContact O-CG 3.5Å; R224-K228 PolarHBondContact O-N 3.3Å; L225-K228 PolarHBondContact O-N 3.01Å; K228-A231 PolarHBondContact O-N 2.97Å; K228-V232 WeakPolarHBondContact O-CG2 3.35Å; K228-V232 PolarHBondContact O-N 2.88Å; K228-F278 HydrophobicContact CB-CD1 3.98Å; K228-F278 HydrophobicContact CB-CD2 4.35Å; K228-F278 HydrophobicContact CB-CE1 3.68Å; K228-F278 HydrophobicContact CB-CE2 4.1Å; K228-F278 HydrophobicContact CB-CG 4.31Å; K228-F278 HydrophobicContact CB-CZ 3.76Å; K228-F278 HydrophobicContact CD-CB 4.32Å; K228-F278 HydrophobicContact CD-CD1 4.34Å; K228-F278 HydrophobicContact CD-CD2 4.23Å; K228-F278 HydrophobicContact CD-CG 4.03Å; K228-F278 HydrophobicContact CG-CD1 4.43Å; K228-F278 WeakPolarHBondContact O-CE1 3.46Å
229I89.7Confident85.9Confident3 Ų364.8 Ų64.82%0.01536%0.361CS..Hα-helixtrans-61.6-43.9177.2-72.6169.5000111.1L90 L92 L225 R226 A231 V232 F261 L263 L274 F278L90-I229 HydrophobicContact CD1-CD1 4.23Å; L90-I229 HydrophobicContact CD1-CG2 4.45Å; L92-I229 HydrophobicContact CD1-CG2 4.48Å; L225-I229 HydrophobicContact CD1-CD1 4.03Å; L225-I229 HydrophobicContact CD1-CG1 4.23Å; L225-I229 HydrophobicContact CG-CD1 3.88Å; L225-I229 HydrophobicContact CG-CG1 4.48Å; L225-I229 WeakPolarHBondContact O-CB 3.41Å; L225-I229 VanDerWaalsContact O-CG1 3.27Å; L225-I229 WeakPolarHBondContact O-CG1 3.43Å; L225-I229 PolarHBondContact O-N 3.25Å; R226-I229 PolarHBondContact O-N 3.4Å; I229-A231 PolarHBondContact O-N 3.12Å; I229-V232 WeakPolarHBondContact O-CB 3.46Å; I229-V232 WeakPolarHBondContact O-CG2 3.34Å; I229-V232 PolarHBondContact O-N 3.16Å; I229-F261 HydrophobicContact CD1-CE2 4.36Å; I229-F261 HydrophobicContact CD1-CZ 4.26Å; I229-F261 HydrophobicContact CG2-CZ 3.92Å; I229-L263 HydrophobicContact CD1-CD2 4.32Å; I229-L274 HydrophobicContact CD1-CD1 4.48Å; I229-F278 HydrophobicContact CG1-CE2 4.07Å; I229-F278 HydrophobicContact CG1-CZ 3.82Å
230A85.9Confident86.7Confident80 Ų8066.6 Ų66.666%0.66136%0.355SS*.Hα-helixtrans-65.5-28177.600000112.9R226 D227R226-A230 WeakPolarHBondContact O-CB 3.5Å; R226-A230 PolarHBondContact O-N 2.8Å; D227-A230 PolarHBondContact O-N 3.11Å
231A87.3Confident87.4Confident69 Ų6962.2 Ų62.257%0.5733%0.328SS*.THydrogen-bonded Turntrans-84-5.4177.300000114.7D227 K228 I229 K233D227-A231 WeakPolarHBondContact O-CB 3.38Å; D227-A231 PolarHBondContact O-N 3.43Å; K228-A231 PolarHBondContact O-N 2.97Å; I229-A231 PolarHBondContact O-N 3.12Å; A231-K233 PolarHBondContact O-N 2.91Å; A231-K233 VanDerWaalsContact O-N 3.17Å
232V88.2Confident87.8Confident21 Ų2160.8 Ų60.813%0.12732%0.318CS..  trans-62.2117.9-179177.60000111.1L92 K228 I229 L237 A238 I241 F278L92-V232 HydrophobicContact CD1-CB 4.16Å; L92-V232 HydrophobicContact CD1-CG1 4.37Å; K228-V232 WeakPolarHBondContact O-CG2 3.35Å; K228-V232 PolarHBondContact O-N 2.88Å; I229-V232 WeakPolarHBondContact O-CB 3.46Å; I229-V232 WeakPolarHBondContact O-CG2 3.34Å; I229-V232 PolarHBondContact O-N 3.16Å; V232-L237 HydrophobicContact CG1-CB 4.32Å; V232-L237 HydrophobicContact CG1-CD2 4.38Å; V232-L237 HydrophobicContact CG1-CG 4.26Å; V232-L237 HydrophobicContact CG2-CD2 4.11Å; V232-L237 HydrophobicContact CG2-CG 4.36Å; V232-A238 HydrophobicContact CG1-CB 3.89Å; V232-I241 HydrophobicContact CG2-CD1 3.84Å; V232-F278 HydrophobicContact CG2-CE1 3.62Å; V232-F278 HydrophobicContact CG2-CZ 3.86Å
233K86.7Confident88.1Confident196 Ų19661.5 Ų61.585%0.85232%0.322SS*.  trans-113.4-19.6170.1-64.3177.8-175.7175.20113.3A231 P235A231-K233 PolarHBondContact O-N 2.91Å; A231-K233 VanDerWaalsContact O-N 3.17Å; K233-P235 WeakPolarHBondContact O-CD 3.44Å
234D86.9Confident88.5Confident62 Ų6260.6 Ų60.633%0.33231%0.311SS..  trans-74.4120.3178.8169.723.6000110.5S236 L237 A238D234-S236 VanDerWaalsContact C-N 3.26Å; D234-S236 PolarHBondContact O-N 3.11Å; D234-S236 WeakPolarHBondContact OD1-CB 3.45Å; D234-S236 PolarHBondContact OD1-N 2.92Å; D234-S236 PolarHBondContact OD1-OG 3.22Å; D234-S236 PolarHBondContact OD2-OG 2.99Å; D234-L237 HydrophobicContact CB-CB 4.04Å; D234-L237 PolarHBondContact O-N 3.01Å; D234-L237 WeakPolarHBondContact OD2-CB 3.27Å; D234-L237 PolarHBondContact OD2-N 2.84Å; D234-L237 VanDerWaalsContact OD2-N 3.08Å; D234-A238 WeakPolarHBondContact O-CB 3.43Å; D234-A238 PolarHBondContact O-N 3.24Å
235P85.9Confident88.7Confident69 Ų6952.2 Ų52.245%0.44828%0.279SS..Hα-helixtrans-62.3-30.7176.226.7-35.1000112.9H96 L97 K233 A238 Q239H96-P235 HydrophobicContact CB-CB 4.46Å; L97-P235 HydrophobicContact CD2-CB 4.3Å; K233-P235 WeakPolarHBondContact O-CD 3.44Å; P235-A238 PolarHBondContact O-N 3.4Å; P235-Q239 WeakPolarHBondContact O-CB 3.26Å; P235-Q239 PolarHBondContact O-N 2.89Å
236S87.6Confident88.7Confident55 Ų5552.8 Ų52.839%0.38528%0.284SS..Hα-helixtrans-69.8-35.6-179.694.80000112.2D234 R240D234-S236 VanDerWaalsContact C-N 3.26Å; D234-S236 PolarHBondContact O-N 3.11Å; D234-S236 WeakPolarHBondContact OD1-CB 3.45Å; D234-S236 PolarHBondContact OD1-N 2.92Å; D234-S236 PolarHBondContact OD1-OG 3.22Å; D234-S236 PolarHBondContact OD2-OG 2.99Å; S236-R240 WeakPolarHBondContact O-CG 3.38Å; S236-R240 PolarHBondContact O-N 2.78Å; S236-R240 PolarHBondContact O-NE 2.99Å; S236-R240 PolarHBondContact OG-NH2 2.87Å
237L90.3Very high88.6Confident11 Ų1154.2 Ų54.26%0.05829%0.293CS..Hα-helixtrans-76.2-41.2173.9-178.958.2000111V232 D234 Q239 R240 I241 C277 F278V232-L237 HydrophobicContact CG1-CB 4.32Å; V232-L237 HydrophobicContact CG1-CD2 4.38Å; V232-L237 HydrophobicContact CG1-CG 4.26Å; V232-L237 HydrophobicContact CG2-CD2 4.11Å; V232-L237 HydrophobicContact CG2-CG 4.36Å; D234-L237 HydrophobicContact CB-CB 4.04Å; D234-L237 PolarHBondContact O-N 3.01Å; D234-L237 WeakPolarHBondContact OD2-CB 3.27Å; D234-L237 PolarHBondContact OD2-N 2.84Å; D234-L237 VanDerWaalsContact OD2-N 3.08Å; L237-Q239 VanDerWaalsContact C-N 3.35Å; L237-Q239 PolarHBondContact O-N 2.83Å; L237-R240 PolarHBondContact O-N 2.85Å; L237-I241 HydrophobicContact CD1-CD1 4.08Å; L237-I241 HydrophobicContact CD1-CG1 4.38Å; L237-I241 HydrophobicContact CG-CD1 3.95Å; L237-I241 WeakPolarHBondContact O-CG1 3.5Å; L237-I241 PolarHBondContact O-N 2.91Å; L237-C277 HydrophobicContact CD1-CB 3.77Å; L237-C277 WeakPolarHBondContact CD1-O 3.48Å; L237-F278 HydrophobicContact CD2-CD1 3.87Å; L237-F278 HydrophobicContact CD2-CE1 3.83Å
238A89.5Confident88.5Confident6 Ų654.1 Ų54.15%0.0529%0.289CS..Hα-helixtrans-59.3-42.9175.500000112.1L92 L97 V232 D234 P235 I241 A242L92-A238 HydrophobicContact CD1-CB 4.38Å; L97-A238 HydrophobicContact CD1-CB 4.14Å; V232-A238 HydrophobicContact CG1-CB 3.89Å; D234-A238 WeakPolarHBondContact O-CB 3.43Å; D234-A238 PolarHBondContact O-N 3.24Å; P235-A238 PolarHBondContact O-N 3.4Å; A238-I241 PolarHBondContact O-N 3.09Å; A238-A242 WeakPolarHBondContact O-CB 3.39Å; A238-A242 PolarHBondContact O-N 2.95Å
239Q88.4Confident88.3Confident44 Ų4450.4 Ų50.421%0.20628%0.276CS..Hα-helixtrans-62.9-47.7175.2-172.265.75000111.5L97 P235 L237 I241 A242 D243L97-Q239 HydrophobicContact CD1-CB 4.27Å; L97-Q239 HydrophobicContact CD2-CB 4.04Å; P235-Q239 WeakPolarHBondContact O-CB 3.26Å; P235-Q239 PolarHBondContact O-N 2.89Å; L237-Q239 VanDerWaalsContact C-N 3.35Å; L237-Q239 PolarHBondContact O-N 2.83Å; Q239-I241 VanDerWaalsContact C-N 3.28Å; Q239-I241 PolarHBondContact O-N 3.42Å; Q239-A242 PolarHBondContact O-N 3.23Å; Q239-A242 VanDerWaalsContact O-N 3.11Å; Q239-D243 PolarHBondContact NE2-OD1 3.07Å; Q239-D243 WeakPolarHBondContact O-CB 3.45Å; Q239-D243 VanDerWaalsContact O-CG 3.24Å; Q239-D243 PolarHBondContact O-N 3.4Å
240R90.5Very high88Confident99 Ų9956.8 Ų56.837%0.37431%0.31SS..Hα-helixtrans-57.6-40.3177.9-78.4178.9-83.6174-7.5112.6S236 L237 L244S236-R240 WeakPolarHBondContact O-CG 3.38Å; S236-R240 PolarHBondContact O-N 2.78Å; S236-R240 PolarHBondContact O-NE 2.99Å; S236-R240 PolarHBondContact OG-NH2 2.87Å; L237-R240 PolarHBondContact O-N 2.85Å; R240-L244 WeakPolarHBondContact O-CB 3.43Å; R240-L244 PolarHBondContact O-N 3.35Å
241I91.4Very high88.1Confident0 Ų053.6 Ų53.60%028%0.282CS..Hα-helixtrans-67.7-46.3175.1-68.2165.3000110.6L92 V232 L237 A238 Q239 D243 L244 I245 L274 F278L92-I241 HydrophobicContact CD2-CB 4.17Å; L92-I241 HydrophobicContact CD2-CG2 3.78Å; V232-I241 HydrophobicContact CG2-CD1 3.84Å; L237-I241 HydrophobicContact CD1-CD1 4.08Å; L237-I241 HydrophobicContact CD1-CG1 4.38Å; L237-I241 HydrophobicContact CG-CD1 3.95Å; L237-I241 WeakPolarHBondContact O-CG1 3.5Å; L237-I241 PolarHBondContact O-N 2.91Å; A238-I241 PolarHBondContact O-N 3.09Å; Q239-I241 VanDerWaalsContact C-N 3.28Å; Q239-I241 PolarHBondContact O-N 3.42Å; I241-D243 PolarHBondContact O-N 3.32Å; I241-L244 PolarHBondContact O-N 3.38Å; I241-I245 HydrophobicContact CG2-CD1 3.59Å; I241-I245 HydrophobicContact CG2-CG1 4.47Å; I241-I245 WeakPolarHBondContact O-CD1 3.34Å; I241-I245 VanDerWaalsContact O-CG1 3.26Å; I241-I245 WeakPolarHBondContact O-CG1 3.38Å; I241-I245 PolarHBondContact O-N 3.33Å; I241-L274 HydrophobicContact CB-CD2 4.4Å; I241-L274 HydrophobicContact CG1-CD2 4.29Å; I241-L274 HydrophobicContact CG2-CD2 3.87Å; I241-F278 HydrophobicContact CD1-CE1 4.36Å; I241-F278 HydrophobicContact CD1-CE2 4.12Å; I241-F278 HydrophobicContact CD1-CZ 3.65Å
242A90.1Very high88Confident0 Ų053.8 Ų53.80%027%0.273CS..Hα-helixtrans-61.1-42.9178.800000112.7L92 L97 I102 A238 Q239 L244 I245 A246 L259L92-A242 HydrophobicContact CD2-CB 4.43Å; L97-A242 HydrophobicContact CD1-CB 4.36Å; I102-A242 HydrophobicContact CD1-CB 4.03Å; I102-A242 HydrophobicContact CG1-CB 4.46Å; A238-A242 WeakPolarHBondContact O-CB 3.39Å; A238-A242 PolarHBondContact O-N 2.95Å; Q239-A242 PolarHBondContact O-N 3.23Å; Q239-A242 VanDerWaalsContact O-N 3.11Å; A242-L244 VanDerWaalsContact C-N 3.32Å; A242-L244 PolarHBondContact O-N 3.24Å; A242-I245 PolarHBondContact O-N 2.87Å; A242-A246 VanDerWaalsContact O-CB 3.27Å; A242-A246 WeakPolarHBondContact O-CB 3.35Å; A242-A246 PolarHBondContact O-N 3.46Å; A242-L259 HydrophobicContact CB-CD2 3.9Å
243D89.5Confident87.9Confident56 Ų5655.4 Ų55.430%0.29928%0.283SS..Hα-helixtrans-64.1-36.2176.8-67.5-21.9000112.4Q239 I241 K247Q239-D243 PolarHBondContact NE2-OD1 3.07Å; Q239-D243 WeakPolarHBondContact O-CB 3.45Å; Q239-D243 VanDerWaalsContact O-CG 3.24Å; Q239-D243 PolarHBondContact O-N 3.4Å; I241-D243 PolarHBondContact O-N 3.32Å; D243-K247 WeakPolarHBondContact O-CD 3.45Å; D243-K247 VanDerWaalsContact O-CG 3.26Å; D243-K247 WeakPolarHBondContact O-CG 3.48Å; D243-K247 PolarHBondContact O-N 3.29Å
244L91.3Very high87.7Confident27 Ų2748.1 Ų48.114%0.14126%0.255CS..Hα-helixtrans-69.1-46.2177.7-161.893.5000110.8R240 I241 A242 K247 H248 V270 M273 L274R240-L244 WeakPolarHBondContact O-CB 3.43Å; R240-L244 PolarHBondContact O-N 3.35Å; I241-L244 PolarHBondContact O-N 3.38Å; A242-L244 VanDerWaalsContact C-N 3.32Å; A242-L244 PolarHBondContact O-N 3.24Å; L244-K247 PolarHBondContact O-N 3.33Å; L244-H248 PolarHBondContact O-CD2 2.85Å; L244-H248 VanDerWaalsContact O-CD2 3.29Å; L244-H248 PolarHBondContact O-N 3.31Å; L244-V270 HydrophobicContact CD2-CG1 3.79Å; L244-V270 HydrophobicContact CG-CG1 4.38Å; L244-M273 HydrophobicContact CD1-CB 3.91Å; L244-M273 HydrophobicContact CD1-CE 4.05Å; L244-M273 HydrophobicContact CD1-SD 4.08Å; L244-M273 HydrophobicContact CD2-CB 3.79Å; L244-M273 HydrophobicContact CG-CB 4.47Å; L244-L274 HydrophobicContact CB-CD2 4.48Å; L244-L274 HydrophobicContact CD2-CB 4.42Å; L244-L274 HydrophobicContact CD2-CD2 3.51Å; L244-L274 HydrophobicContact CD2-CG 3.53Å
245I90Very high87.3Confident0 Ų048.9 Ų48.90%027%0.269CS..Hα-helixtrans-60.2-49.1176.1-66.7161000109.6I241 A242 K247 H248 A249 F251 L259 F261 M266I241-I245 HydrophobicContact CG2-CD1 3.59Å; I241-I245 HydrophobicContact CG2-CG1 4.47Å; I241-I245 WeakPolarHBondContact O-CD1 3.34Å; I241-I245 VanDerWaalsContact O-CG1 3.26Å; I241-I245 WeakPolarHBondContact O-CG1 3.38Å; I241-I245 PolarHBondContact O-N 3.33Å; A242-I245 PolarHBondContact O-N 2.87Å; I245-K247 PolarHBondContact O-N 3.13Å; I245-K247 VanDerWaalsContact O-N 3.07Å; I245-H248 PolarHBondContact O-N 3.03Å; I245-A249 HydrophobicContact CG2-CB 4.3Å; I245-A249 PolarHBondContact O-N 3.29Å; I245-A249 VanDerWaalsContact O-O 3.08Å; I245-F251 HydrophobicContact CG2-CB 4.02Å; I245-F251 HydrophobicContact CG2-CD1 4.31Å; I245-F251 HydrophobicContact CG2-CG 4.5Å; I245-L259 HydrophobicContact CB-CD2 4.25Å; I245-L259 HydrophobicContact CD1-CD2 3.89Å; I245-L259 HydrophobicContact CG2-CD2 4.12Å; I245-F261 HydrophobicContact CD1-CD1 3.59Å; I245-F261 HydrophobicContact CD1-CD2 4.02Å; I245-F261 HydrophobicContact CD1-CE1 3.39Å; I245-F261 HydrophobicContact CD1-CE2 3.82Å; I245-F261 HydrophobicContact CD1-CG 3.87Å; I245-F261 HydrophobicContact CD1-CZ 3.48Å; I245-F261 VanDerWaalsContact CD1-CZ 3.48Å; I245-F261 HydrophobicContact CG1-CD2 4.48Å; I245-F261 HydrophobicContact CG1-CG 4.46Å; I245-F261 HydrophobicContact CG2-CB 3.96Å; I245-F261 HydrophobicContact CG2-CD1 4.44Å; I245-F261 HydrophobicContact CG2-CG 4.17Å; I245-M266 HydrophobicContact CG1-CE 3.97Å
246A88Confident87Confident12 Ų1247.4 Ų47.410%0.09927%0.266CS..Hα-helixtrans-64.1-16.8-177.200000114.7I102 H105 A242 F251I102-A246 HydrophobicContact CG2-CB 4.26Å; H105-A246 HydrophobicContact CB-CB 4.31Å; H105-A246 WeakPolarHBondContact CB-O 3.31Å; A242-A246 VanDerWaalsContact O-CB 3.27Å; A242-A246 WeakPolarHBondContact O-CB 3.35Å; A242-A246 PolarHBondContact O-N 3.46Å; A246-F251 HydrophobicContact CB-CD1 4.33Å; A246-F251 HydrophobicContact CB-CE1 3.58Å; A246-F251 HydrophobicContact CB-CZ 4.16Å
247K88.1Confident86.8Confident130 Ų13049.7 Ų49.757%0.56527%0.271SS*.Hα-helixtrans-92.1-22.1174.2-73.4168.1-173.3167.20114.1D243 L244 I245D243-K247 WeakPolarHBondContact O-CD 3.45Å; D243-K247 VanDerWaalsContact O-CG 3.26Å; D243-K247 WeakPolarHBondContact O-CG 3.48Å; D243-K247 PolarHBondContact O-N 3.29Å; L244-K247 PolarHBondContact O-N 3.33Å; I245-K247 PolarHBondContact O-N 3.13Å; I245-K247 VanDerWaalsContact O-N 3.07Å
248H84.5Confident86.5Confident100 Ų10052.8 Ų52.846%0.46328%0.284SS..Hα-helixtrans-133.4-10.8-163.6-66.1-62.4000115.9L244 I245 V270L244-H248 PolarHBondContact O-CD2 2.85Å; L244-H248 VanDerWaalsContact O-CD2 3.29Å; L244-H248 PolarHBondContact O-N 3.31Å; I245-H248 PolarHBondContact O-N 3.03Å; H248-V270 HydrophobicContact CB-CB 4.48Å; H248-V270 HydrophobicContact CB-CG1 3.93Å; H248-V270 HydrophobicContact CB-CG2 3.64Å
249A83.8Confident86.5Confident18 Ų1852.5 Ų52.515%0.14928%0.282CS..SBendtrans-145.1152.6-175.400000112I245 M266I245-A249 HydrophobicContact CG2-CB 4.3Å; I245-A249 PolarHBondContact O-N 3.29Å; I245-A249 VanDerWaalsContact O-O 3.08Å; A249-M266 HydrophobicContact CB-CE 3.93Å; A249-M266 HydrophobicContact CB-CG 3.94Å; A249-M266 HydrophobicContact CB-SD 4.33Å
250D84.1Confident86.5Confident138 Ų13851.9 Ų51.974%0.73828%0.279SS*.  trans-70.2138.5169.3-71.8-52.4000110.8
251F88.4Confident86.4Confident13 Ų1347.4 Ų47.46%0.05726%0.262CS..EExtended strand (participates in β ladder)trans-139.7146178.267.9-94.7000112.4I102 N106 I245 A246 V253 L259 Q260 F261I102-F251 HydrophobicContact CG2-CE2 4.36Å; I102-F251 HydrophobicContact CG2-CZ 4.1Å; N106-F251 HydrophobicContact CB-CE1 3.68Å; N106-F251 HydrophobicContact CB-CE2 4.18Å; N106-F251 HydrophobicContact CB-CZ 3.44Å; N106-F251 VanDerWaalsContact CB-CZ 3.44Å; N106-F251 WeakPolarHBondContact ND2-CZ 3.3Å; N106-F251 PolarHBondContact ND2-O 3.21Å; I245-F251 HydrophobicContact CG2-CB 4.02Å; I245-F251 HydrophobicContact CG2-CD1 4.31Å; I245-F251 HydrophobicContact CG2-CG 4.5Å; A246-F251 HydrophobicContact CB-CD1 4.33Å; A246-F251 HydrophobicContact CB-CE1 3.58Å; A246-F251 HydrophobicContact CB-CZ 4.16Å; F251-V253 HydrophobicContact CD2-CG2 4.1Å; F251-V253 HydrophobicContact CE2-CG2 3.87Å; F251-L259 HydrophobicContact CB-CD1 4.11Å; F251-L259 HydrophobicContact CB-CG 4.3Å; F251-L259 HydrophobicContact CD2-CD1 3.26Å; F251-L259 HydrophobicContact CD2-CG 4.31Å; F251-L259 HydrophobicContact CE2-CD1 3.67Å; F251-L259 HydrophobicContact CG-CD1 3.77Å; F251-L259 HydrophobicContact CG-CG 4.44Å; F251-L259 HydrophobicContact CZ-CD1 4.49Å; F251-Q260 CarbonylContact C-O 3.54Å; F251-Q260 WeakPolarHBondContact CA-O 3.48Å; F251-F261 HydrophobicContact CB-CB 4.3Å
252D85.9Confident86.2Confident73 Ų7348.5 Ų48.539%0.3927%0.268SS..EExtended strand (participates in β ladder)trans-103.1126.7171-62.5-54.2000109.1K89 V254 Q260K89-D252 IonicContact NZ-OD2 2.74Å; K89-D252 PolarHBondContact NZ-OD2 3.26Å; D252-V254 HydrophobicContact CB-CG2 4.27Å; D252-V254 PolarHBondContact O-N 3.04Å; D252-Q260 HydrophobicContact CB-CB 4.24Å; D252-Q260 PolarHBondContact N-O 2.8Å; D252-Q260 WeakPolarHBondContact O-CB 3.27Å; D252-Q260 PolarHBondContact O-N 3.48Å; D252-Q260 PolarHBondContact OD2-NE2 2.86Å
253V85.3Confident85.9Confident55 Ų5549 Ų4933%0.33327%0.27SS..EExtended strand (participates in β ladder)trans-83113.6166.7-179.20000109V99 F251 L259V99-V253 HydrophobicContact CG1-CG1 4.02Å; V99-V253 HydrophobicContact CG1-CG2 4.4Å; F251-V253 HydrophobicContact CD2-CG2 4.1Å; F251-V253 HydrophobicContact CE2-CG2 3.87Å; V253-L259 HydrophobicContact CG2-CD1 4.38Å
254V82.5Confident85.4Confident43 Ų4350.7 Ų50.726%0.26129%0.286SS..EExtended strand (participates in β ladder)trans-103.1124-177.4-179.60000110.1D252 G256 H257 F258 Q260D252-V254 HydrophobicContact CB-CG2 4.27Å; D252-V254 PolarHBondContact O-N 3.04Å; V254-G256 PolarHBondContact O-N 2.91Å; V254-H257 PolarHBondContact O-N 2.91Å; V254-F258 HydrophobicContact CB-CB 4.3Å; V254-F258 PolarHBondContact N-O 3.27Å; V254-F258 PolarHBondContact O-N 3.06Å; V254-Q260 HydrophobicContact CG2-CB 3.68Å; V254-Q260 HydrophobicContact CG2-CG 4.38Å
255A78.8Confident84.9Confident77 Ų7753.7 Ų53.764%0.63631%0.306SS*.THydrogen-bonded Turntrans53.723.4177.600000115.3H257A255-H257 PolarHBondContact O-CD2 3.01Å; A255-H257 VanDerWaalsContact O-CD2 3.28Å; A255-H257 PolarHBondContact O-N 3.2Å
256G78.6Confident84.6Confident38 Ų3854.4 Ų54.439%0.39231%0.309SS..THydrogen-bonded Turntrans66.92.6-17900000115.5V254V254-G256 PolarHBondContact O-N 2.91Å
257H83.5Confident84.5Confident104 Ų10458.8 Ų58.848%0.48133%0.331SS..THydrogen-bonded Turntrans-129.1-10.9-172.8-59.4-38.8000113.7I94 V254 A255I94-H257 WeakPolarHBondContact CG1-O 3.45Å; I94-H257 PolarHBondContact N-O 3.34Å; V254-H257 PolarHBondContact O-N 2.91Å; A255-H257 PolarHBondContact O-CD2 3.01Å; A255-H257 VanDerWaalsContact O-CD2 3.28Å; A255-H257 PolarHBondContact O-N 3.2Å
258F84.9Confident84.3Confident76 Ų7654.5 Ų54.533%0.33332%0.317SS..EExtended strand (participates in β ladder)trans-128.8131.1-179.1-59.2-82.3000111.2K91 L92 R93 V254K91-F258 HydrophobicContact CB-CB 4.45Å; K91-F258 HydrophobicContact CB-CD1 4.3Å; L92-F258 CarbonylContact O-C 3.47Å; L92-F258 VanDerWaalsContact O-CA 3.26Å; L92-F258 WeakPolarHBondContact O-CA 3.42Å; R93-F258 HydrophobicContact CB-CD1 4.28Å; R93-F258 HydrophobicContact CB-CE1 4.12Å; R93-F258 HydrophobicContact CG-CE1 4.28Å; V254-F258 HydrophobicContact CB-CB 4.3Å; V254-F258 PolarHBondContact N-O 3.27Å; V254-F258 PolarHBondContact O-N 3.06Å
259L88Confident84.4Confident0 Ų056.4 Ų56.40%032%0.324CS..EExtended strand (participates in β ladder)trans-87.5116.2163.8-164.675.8000107.2K91 L92 I94 I102 A242 I245 F251 V253 F261K91-L259 WeakPolarHBondContact CA-O 3.32Å; L92-L259 HydrophobicContact CB-CB 4.33Å; L92-L259 HydrophobicContact CD2-CD2 4.49Å; L92-L259 PolarHBondContact N-O 2.83Å; L92-L259 PolarHBondContact O-N 3.06Å; I94-L259 HydrophobicContact CD1-CB 4.19Å; I94-L259 HydrophobicContact CD1-CD1 4.5Å; I94-L259 HydrophobicContact CG2-CB 3.82Å; I102-L259 HydrophobicContact CG2-CD1 4.26Å; A242-L259 HydrophobicContact CB-CD2 3.9Å; I245-L259 HydrophobicContact CB-CD2 4.25Å; I245-L259 HydrophobicContact CD1-CD2 3.89Å; I245-L259 HydrophobicContact CG2-CD2 4.12Å; F251-L259 HydrophobicContact CB-CD1 4.11Å; F251-L259 HydrophobicContact CB-CG 4.3Å; F251-L259 HydrophobicContact CD2-CD1 3.26Å; F251-L259 HydrophobicContact CD2-CG 4.31Å; F251-L259 HydrophobicContact CE2-CD1 3.67Å; F251-L259 HydrophobicContact CG-CD1 3.77Å; F251-L259 HydrophobicContact CG-CG 4.44Å; F251-L259 HydrophobicContact CZ-CD1 4.49Å; V253-L259 HydrophobicContact CG2-CD1 4.38Å; L259-F261 HydrophobicContact CD2-CD1 4.31Å; L259-F261 HydrophobicContact CG-CD1 4.31Å
260Q88.7Confident84.6Confident31 Ų3155.9 Ų55.915%0.14532%0.319CS..EExtended strand (participates in β ladder)trans-108.6125179.5-175.7-174.9-92.100110.1K89 L90 K91 F251 D252 V254K89-Q260 HydrophobicContact CB-CG 3.93Å; K89-Q260 HydrophobicContact CD-CG 4.19Å; L90-Q260 WeakPolarHBondContact O-CA 3.42Å; L90-Q260 WeakPolarHBondContact O-CG 3.48Å; K91-Q260 HydrophobicContact CG-CB 4.22Å; K91-Q260 HydrophobicContact CG-CG 4.08Å; F251-Q260 CarbonylContact C-O 3.54Å; F251-Q260 WeakPolarHBondContact CA-O 3.48Å; D252-Q260 HydrophobicContact CB-CB 4.24Å; D252-Q260 PolarHBondContact N-O 2.8Å; D252-Q260 WeakPolarHBondContact O-CB 3.27Å; D252-Q260 PolarHBondContact O-N 3.48Å; D252-Q260 PolarHBondContact OD2-NE2 2.86Å; V254-Q260 HydrophobicContact CG2-CB 3.68Å; V254-Q260 HydrophobicContact CG2-CG 4.38Å
261F89.1Confident84.8Confident4 Ų449.7 Ų49.72%0.01829%0.286CS..EExtended strand (participates in β ladder)trans-151.3164.2-172.158.4-90000109.7K89 L90 L92 I229 I245 F251 L259 L263 M266K89-F261 CarbonylContact C-O 3.55Å; K89-F261 VanDerWaalsContact CA-O 3.31Å; K89-F261 WeakPolarHBondContact CA-O 3.26Å; L90-F261 HydrophobicContact CB-CD2 4.4Å; L90-F261 HydrophobicContact CB-CE1 4.49Å; L90-F261 HydrophobicContact CB-CE2 4Å; L90-F261 HydrophobicContact CB-CZ 4.07Å; L90-F261 HydrophobicContact CD1-CE2 4.1Å; L90-F261 HydrophobicContact CD1-CZ 4.45Å; L90-F261 HydrophobicContact CG-CE2 4.42Å; L90-F261 PolarHBondContact N-O 2.82Å; L90-F261 PolarHBondContact O-N 3.22Å; L90-F261 VanDerWaalsContact O-N 3.12Å; L92-F261 HydrophobicContact CB-CE1 3.82Å; I229-F261 HydrophobicContact CD1-CE2 4.36Å; I229-F261 HydrophobicContact CD1-CZ 4.26Å; I229-F261 HydrophobicContact CG2-CZ 3.92Å; I245-F261 HydrophobicContact CD1-CD1 3.59Å; I245-F261 HydrophobicContact CD1-CD2 4.02Å; I245-F261 HydrophobicContact CD1-CE1 3.39Å; I245-F261 HydrophobicContact CD1-CE2 3.82Å; I245-F261 HydrophobicContact CD1-CG 3.87Å; I245-F261 HydrophobicContact CD1-CZ 3.48Å; I245-F261 VanDerWaalsContact CD1-CZ 3.48Å; I245-F261 HydrophobicContact CG1-CD2 4.48Å; I245-F261 HydrophobicContact CG1-CG 4.46Å; I245-F261 HydrophobicContact CG2-CB 3.96Å; I245-F261 HydrophobicContact CG2-CD1 4.44Å; I245-F261 HydrophobicContact CG2-CG 4.17Å; F251-F261 HydrophobicContact CB-CB 4.3Å; L259-F261 HydrophobicContact CD2-CD1 4.31Å; L259-F261 HydrophobicContact CG-CD1 4.31Å; F261-L263 HydrophobicContact CE2-CD2 4.02Å; F261-M266 HydrophobicContact CB-CE 4.36Å; F261-M266 HydrophobicContact CD2-CE 3.32Å; F261-M266 HydrophobicContact CE2-CE 3.88Å; F261-M266 HydrophobicContact CG-CE 4.14Å
262D86.3Confident84.8Confident23 Ų2352.4 Ų52.412%0.12330%0.299CS..EExtended strand (participates in β ladder)trans-112.6130.6-177.7-167.7-28.9000109.7T88 C264 T265 M266T88-D262 VanDerWaalsContact CB-CG 3.45Å; T88-D262 VanDerWaalsContact CB-OD1 3.3Å; T88-D262 WeakPolarHBondContact CB-OD1 3.06Å; T88-D262 WeakPolarHBondContact CB-OD2 3.45Å; T88-D262 PolarHBondContact OG1-OD2 3.08Å; D262-C264 WeakPolarHBondContact OD1-CA 3.4Å; D262-C264 VanDerWaalsContact OD1-CB 3.27Å; D262-C264 WeakPolarHBondContact OD1-CB 3.43Å; D262-C264 PolarHBondContact OD1-N 3.3Å; D262-T265 HydrophobicContact CB-CG2 3.99Å; D262-T265 PolarHBondContact O-OG1 3.01Å; D262-T265 VanDerWaalsContact O-OG1 3.13Å; D262-M266 WeakPolarHBondContact O-CE 3.49Å; D262-M266 WeakPolarHBondContact O-CG 3.26Å
263L84.7Confident84.9Confident10 Ų1051.8 Ų51.85%0.05229%0.294CS..SBendtrans-74.9-29.9174.5-71.7-177.2000112L90 L225 I229 F261 T265 M266 L274L90-L263 HydrophobicContact CD1-CD1 3.61Å; L90-L263 HydrophobicContact CD1-CD2 4.39Å; L90-L263 HydrophobicContact CD1-CG 3.7Å; L90-L263 HydrophobicContact CG-CG 4.34Å; L225-L263 HydrophobicContact CD2-CD1 4.25Å; L225-L263 HydrophobicContact CD2-CD2 4.29Å; L225-L263 HydrophobicContact CG-CD1 4.4Å; I229-L263 HydrophobicContact CD1-CD2 4.32Å; F261-L263 HydrophobicContact CE2-CD2 4.02Å; L263-T265 PolarHBondContact O-N 3.12Å; L263-M266 HydrophobicContact CD2-CE 4.03Å; L263-M266 HydrophobicContact CD2-SD 4.05Å; L263-M266 WeakPolarHBondContact O-CB 3.46Å; L263-M266 PolarHBondContact O-N 3.19Å; L263-M266 VanDerWaalsContact O-N 3.13Å; L263-L274 HydrophobicContact CD2-CD1 3.84Å
264C79.2Confident85.2Confident93 Ų9349.1 Ų49.163%0.62828%0.278SS*.THydrogen-bonded Turntrans-72.1-15.9-178-58.40000112.7D262D262-C264 WeakPolarHBondContact OD1-CA 3.4Å; D262-C264 VanDerWaalsContact OD1-CB 3.27Å; D262-C264 WeakPolarHBondContact OD1-CB 3.43Å; D262-C264 PolarHBondContact OD1-N 3.3Å
265T81.2Confident85.5Confident90 Ų9048.9 Ų48.955%0.55227%0.274SS*.THydrogen-bonded Turntrans-91.1-3.2172.762.40000113.2D262 L263D262-T265 HydrophobicContact CB-CG2 3.99Å; D262-T265 PolarHBondContact O-OG1 3.01Å; D262-T265 VanDerWaalsContact O-OG1 3.13Å; L263-T265 PolarHBondContact O-N 3.12Å
266M83.3Confident85.9Confident15 Ų1547.8 Ų47.87%0.07426%0.262CS..SBendtrans-90.1144.4-179.7-57.4-164.7-168.200112.1I245 A249 F261 D262 L263 V270 I271 L274I245-M266 HydrophobicContact CG1-CE 3.97Å; A249-M266 HydrophobicContact CB-CE 3.93Å; A249-M266 HydrophobicContact CB-CG 3.94Å; A249-M266 HydrophobicContact CB-SD 4.33Å; F261-M266 HydrophobicContact CB-CE 4.36Å; F261-M266 HydrophobicContact CD2-CE 3.32Å; F261-M266 HydrophobicContact CE2-CE 3.88Å; F261-M266 HydrophobicContact CG-CE 4.14Å; D262-M266 WeakPolarHBondContact O-CE 3.49Å; D262-M266 WeakPolarHBondContact O-CG 3.26Å; L263-M266 HydrophobicContact CD2-CE 4.03Å; L263-M266 HydrophobicContact CD2-SD 4.05Å; L263-M266 WeakPolarHBondContact O-CB 3.46Å; L263-M266 PolarHBondContact O-N 3.19Å; L263-M266 VanDerWaalsContact O-N 3.13Å; M266-V270 HydrophobicContact CB-CB 4.29Å; M266-V270 HydrophobicContact CB-CG1 4.44Å; M266-V270 HydrophobicContact SD-CG1 3.85Å; M266-I271 HydrophobicContact CB-CD1 4.31Å; M266-I271 HydrophobicContact CB-CG1 4.05Å; M266-L274 HydrophobicContact CE-CD1 4.46Å; M266-L274 HydrophobicContact SD-CD1 3.77Å
267N85.6Confident86.4Confident103 Ų10346.8 Ų46.855%0.55125%0.249SC*.  trans-65.5143.9169.1-177.9-65.7000110.6K269 V270 I271N267-K269 PolarHBondContact O-N 3.33Å; N267-K269 VanDerWaalsContact O-N 3.11Å; N267-K269 VanDerWaalsContact OD1-CB 3.3Å; N267-K269 WeakPolarHBondContact OD1-CB 3.19Å; N267-K269 PolarHBondContact OD1-N 2.79Å; N267-V270 HydrophobicContact CB-CG2 4.15Å; N267-V270 WeakPolarHBondContact O-CA 3.42Å; N267-V270 VanDerWaalsContact O-CB 3.31Å; N267-V270 WeakPolarHBondContact O-CB 3.35Å; N267-V270 PolarHBondContact O-N 2.78Å; N267-I271 PolarHBondContact O-N 2.81Å
268S83.6Confident86.6Confident41 Ų4143 Ų4329%0.28723%0.231SC..Hα-helixtrans-50.8-35.6178.754.40000113.7V270 I271 Q272S268-V270 VanDerWaalsContact C-N 3.32Å; S268-V270 PolarHBondContact O-N 3.15Å; S268-I271 WeakPolarHBondContact O-CB 3.43Å; S268-I271 PolarHBondContact O-N 3.1Å; S268-Q272 WeakPolarHBondContact O-CG 3.34Å; S268-Q272 PolarHBondContact O-N 3.12Å
269K87.5Confident86.4Confident140 Ų14046.1 Ų46.161%0.60925%0.246SC*.Hα-helixtrans-62.3-35.2174.1-173.3172.5-177.1171.50113.2N267 M273N267-K269 PolarHBondContact O-N 3.33Å; N267-K269 VanDerWaalsContact O-N 3.11Å; N267-K269 VanDerWaalsContact OD1-CB 3.3Å; N267-K269 WeakPolarHBondContact OD1-CB 3.19Å; N267-K269 PolarHBondContact OD1-N 2.79Å; K269-M273 WeakPolarHBondContact O-CG 3.35Å; K269-M273 PolarHBondContact O-N 3.13Å; K269-M273 VanDerWaalsContact O-N 3.07Å
270V88.3Confident85.5Confident7 Ų754.2 Ų54.24%0.04228%0.282CS..Hα-helixtrans-71.3-38.8176.9-175.10000110L244 H248 M266 N267 S268 M273 L274L244-V270 HydrophobicContact CD2-CG1 3.79Å; L244-V270 HydrophobicContact CG-CG1 4.38Å; H248-V270 HydrophobicContact CB-CB 4.48Å; H248-V270 HydrophobicContact CB-CG1 3.93Å; H248-V270 HydrophobicContact CB-CG2 3.64Å; M266-V270 HydrophobicContact CB-CB 4.29Å; M266-V270 HydrophobicContact CB-CG1 4.44Å; M266-V270 HydrophobicContact SD-CG1 3.85Å; N267-V270 HydrophobicContact CB-CG2 4.15Å; N267-V270 WeakPolarHBondContact O-CA 3.42Å; N267-V270 VanDerWaalsContact O-CB 3.31Å; N267-V270 WeakPolarHBondContact O-CB 3.35Å; N267-V270 PolarHBondContact O-N 2.78Å; S268-V270 VanDerWaalsContact C-N 3.32Å; S268-V270 PolarHBondContact O-N 3.15Å; V270-M273 HydrophobicContact CB-CE 4.37Å; V270-M273 HydrophobicContact CG2-CE 4.17Å; V270-M273 WeakPolarHBondContact O-CB 3.45Å; V270-M273 PolarHBondContact O-N 2.78Å; V270-L274 WeakPolarHBondContact O-CG 3.13Å; V270-L274 PolarHBondContact O-N 3.04Å
271I88Confident84Confident8 Ų855.5 Ų55.54%0.04129%0.294CS..Hα-helixtrans-63.7-44.7176.6-62.7165.7000110.4M217 L222 L225 M266 N267 S268 M273 L274 E275M217-I271 HydrophobicContact CG-CB 4.45Å; M217-I271 HydrophobicContact CG-CD1 4.38Å; M217-I271 HydrophobicContact CG-CG2 4.01Å; M217-I271 HydrophobicContact SD-CB 4.42Å; M217-I271 HydrophobicContact SD-CG2 3.68Å; L222-I271 HydrophobicContact CD2-CD1 3.98Å; L222-I271 HydrophobicContact CD2-CG2 3.79Å; L225-I271 HydrophobicContact CD2-CG2 3.77Å; M266-I271 HydrophobicContact CB-CD1 4.31Å; M266-I271 HydrophobicContact CB-CG1 4.05Å; N267-I271 PolarHBondContact O-N 2.81Å; S268-I271 WeakPolarHBondContact O-CB 3.43Å; S268-I271 PolarHBondContact O-N 3.1Å; I271-M273 VanDerWaalsContact C-N 3.34Å; I271-M273 PolarHBondContact O-N 2.92Å; I271-L274 WeakPolarHBondContact O-CB 3.31Å; I271-L274 PolarHBondContact O-N 2.81Å; I271-E275 PolarHBondContact O-N 3.28Å
272Q86.8Confident81.8Confident70 Ų7063.6 Ų63.633%0.32735%0.351SS..Hα-helixtrans-60.6-39.4171.9-71.1177.3-9.100112.9C215 M217 S268 E275 S276C215-Q272 PolarHBondContact SG-NE2 3.19Å; M217-Q272 HydrophobicContact CE-CG 3.85Å; S268-Q272 WeakPolarHBondContact O-CG 3.34Å; S268-Q272 PolarHBondContact O-N 3.12Å; Q272-E275 PolarHBondContact O-N 3.06Å; Q272-S276 WeakPolarHBondContact O-CB 3.3Å; Q272-S276 PolarHBondContact O-N 3.36Å; Q272-S276 PolarHBondContact O-OG 2.59Å
273M89.1Confident81.6Confident59 Ų5965.6 Ų65.629%0.29136%0.362SS..Hα-helixtrans-65.2-39.3174.7-74-172.6-6100111.9L244 K269 V270 I271 S276 C277L244-M273 HydrophobicContact CD1-CB 3.91Å; L244-M273 HydrophobicContact CD1-CE 4.05Å; L244-M273 HydrophobicContact CD1-SD 4.08Å; L244-M273 HydrophobicContact CD2-CB 3.79Å; L244-M273 HydrophobicContact CG-CB 4.47Å; K269-M273 WeakPolarHBondContact O-CG 3.35Å; K269-M273 PolarHBondContact O-N 3.13Å; K269-M273 VanDerWaalsContact O-N 3.07Å; V270-M273 HydrophobicContact CB-CE 4.37Å; V270-M273 HydrophobicContact CG2-CE 4.17Å; V270-M273 WeakPolarHBondContact O-CB 3.45Å; V270-M273 PolarHBondContact O-N 2.78Å; I271-M273 VanDerWaalsContact C-N 3.34Å; I271-M273 PolarHBondContact O-N 2.92Å; M273-S276 WeakPolarHBondContact O-CB 3.37Å; M273-S276 PolarHBondContact O-N 2.74Å; M273-C277 PolarHBondContact O-N 3.06Å; M273-C277 VanDerWaalsContact O-N 3.14Å; M273-C277 PolarHBondContact O-SG 3.43Å
274L90.6Very high81.5Confident0 Ų068.5 Ų68.50%038%0.379CS..Hα-helixtrans-62.3-47172.8-72.6174000111.6L225 I229 I241 L244 L263 M266 V270 I271 S276 C277 F278L225-L274 HydrophobicContact CD1-CB 4.07Å; L225-L274 HydrophobicContact CD2-CB 4Å; L225-L274 HydrophobicContact CD2-CD1 4.21Å; I229-L274 HydrophobicContact CD1-CD1 4.48Å; I241-L274 HydrophobicContact CB-CD2 4.4Å; I241-L274 HydrophobicContact CG1-CD2 4.29Å; I241-L274 HydrophobicContact CG2-CD2 3.87Å; L244-L274 HydrophobicContact CB-CD2 4.48Å; L244-L274 HydrophobicContact CD2-CB 4.42Å; L244-L274 HydrophobicContact CD2-CD2 3.51Å; L244-L274 HydrophobicContact CD2-CG 3.53Å; L263-L274 HydrophobicContact CD2-CD1 3.84Å; M266-L274 HydrophobicContact CE-CD1 4.46Å; M266-L274 HydrophobicContact SD-CD1 3.77Å; V270-L274 WeakPolarHBondContact O-CG 3.13Å; V270-L274 PolarHBondContact O-N 3.04Å; I271-L274 WeakPolarHBondContact O-CB 3.31Å; I271-L274 PolarHBondContact O-N 2.81Å; L274-S276 VanDerWaalsContact C-N 3.28Å; L274-S276 PolarHBondContact O-N 2.83Å; L274-C277 WeakPolarHBondContact O-CB 3.27Å; L274-C277 PolarHBondContact O-N 3.06Å; L274-C277 VanDerWaalsContact O-N 3.13Å; L274-F278 WeakPolarHBondContact O-CD2 3.48Å
275E88.7Confident81.6Confident37 Ų3767.2 Ų67.217%0.17337%0.365CS..Hα-helixtrans-59.4-40.3175.8-72.1-174.2157.900111.8S221 L225 I271 Q272 C277 F278S221-E275 PolarHBondContact OG-OE1 3.44Å; L225-E275 HydrophobicContact CD1-CG 4.01Å; L225-E275 HydrophobicContact CD2-CG 4.2Å; L225-E275 HydrophobicContact CG-CG 4.47Å; I271-E275 PolarHBondContact O-N 3.28Å; Q272-E275 PolarHBondContact O-N 3.06Å; E275-C277 VanDerWaalsContact C-N 3.26Å; E275-C277 PolarHBondContact O-N 3.07Å; E275-F278 PolarHBondContact O-N 2.99Å; E275-F278 VanDerWaalsContact O-N 3.16Å
276S88.2Confident81.6Confident54 Ų5465.8 Ų65.838%0.37835%0.354SS..Hα-helixtrans-63.7-27176.6-59.90000113.5Q272 M273 L274 F278 Q279Q272-S276 WeakPolarHBondContact O-CB 3.3Å; Q272-S276 PolarHBondContact O-N 3.36Å; Q272-S276 PolarHBondContact O-OG 2.59Å; M273-S276 WeakPolarHBondContact O-CB 3.37Å; M273-S276 PolarHBondContact O-N 2.74Å; L274-S276 VanDerWaalsContact C-N 3.28Å; L274-S276 PolarHBondContact O-N 2.83Å; S276-F278 VanDerWaalsContact C-N 3.27Å; S276-F278 PolarHBondContact O-N 3.19Å; S276-Q279 PolarHBondContact O-N 3.17Å
277C88.7Confident81.5Confident18 Ų1869 Ų6912%0.12237%0.371CS..Hα-helixtrans-62.8-34.5174.5-66.20000112.3L237 M273 L274 E275L237-C277 HydrophobicContact CD1-CB 3.77Å; L237-C277 WeakPolarHBondContact CD1-O 3.48Å; M273-C277 PolarHBondContact O-N 3.06Å; M273-C277 VanDerWaalsContact O-N 3.14Å; M273-C277 PolarHBondContact O-SG 3.43Å; L274-C277 WeakPolarHBondContact O-CB 3.27Å; L274-C277 PolarHBondContact O-N 3.06Å; L274-C277 VanDerWaalsContact O-N 3.13Å; E275-C277 VanDerWaalsContact C-N 3.26Å; E275-C277 PolarHBondContact O-N 3.07Å
278F87.5Confident81.2Confident23 Ų2366.7 Ų66.710%0.10136%0.359CS..Hα-helixtrans-79-26.9-179.9-65.8-83.4000113.8L225 K228 I229 V232 L237 I241 L274 E275 S276 K280 S281L225-F278 HydrophobicContact CD1-CD2 4.09Å; L225-F278 HydrophobicContact CD1-CE2 3.67Å; K228-F278 HydrophobicContact CB-CD1 3.98Å; K228-F278 HydrophobicContact CB-CD2 4.35Å; K228-F278 HydrophobicContact CB-CE1 3.68Å; K228-F278 HydrophobicContact CB-CE2 4.1Å; K228-F278 HydrophobicContact CB-CG 4.31Å; K228-F278 HydrophobicContact CB-CZ 3.76Å; K228-F278 HydrophobicContact CD-CB 4.32Å; K228-F278 HydrophobicContact CD-CD1 4.34Å; K228-F278 HydrophobicContact CD-CD2 4.23Å; K228-F278 HydrophobicContact CD-CG 4.03Å; K228-F278 HydrophobicContact CG-CD1 4.43Å; K228-F278 WeakPolarHBondContact O-CE1 3.46Å; I229-F278 HydrophobicContact CG1-CE2 4.07Å; I229-F278 HydrophobicContact CG1-CZ 3.82Å; V232-F278 HydrophobicContact CG2-CE1 3.62Å; V232-F278 HydrophobicContact CG2-CZ 3.86Å; L237-F278 HydrophobicContact CD2-CD1 3.87Å; L237-F278 HydrophobicContact CD2-CE1 3.83Å; I241-F278 HydrophobicContact CD1-CE1 4.36Å; I241-F278 HydrophobicContact CD1-CE2 4.12Å; I241-F278 HydrophobicContact CD1-CZ 3.65Å; L274-F278 WeakPolarHBondContact O-CD2 3.48Å; E275-F278 PolarHBondContact O-N 2.99Å; E275-F278 VanDerWaalsContact O-N 3.16Å; S276-F278 VanDerWaalsContact C-N 3.27Å; S276-F278 PolarHBondContact O-N 3.19Å; F278-K280 VanDerWaalsContact C-N 3.26Å; F278-K280 PolarHBondContact O-N 2.85Å; F278-S281 PolarHBondContact O-N 3.06Å; F278-S281 PolarHBondContact O-OG 3.43Å
279Q82.3Confident81.1Confident142 Ų14268.6 Ų68.666%0.66437%0.365SS*.Hα-helixtrans-68.9-24.8179.4-64-177.913.800112.7S276 S281S276-Q279 PolarHBondContact O-N 3.17Å; Q279-S281 VanDerWaalsContact C-N 3.28Å; Q279-S281 PolarHBondContact O-N 3.45Å
280K67.5Low80.6Confident171 Ų17163.1 Ų63.174%0.74335%0.346SS*.THydrogen-bonded Turntrans-87.711.9179-63.4-175.6178-177.80113.9F278F278-K280 VanDerWaalsContact C-N 3.26Å; F278-K280 PolarHBondContact O-N 2.85Å
281S56.9Low79.9Confident58 Ų5867.8 Ų67.841%0.40637%0.371SS..THydrogen-bonded Turntrans-134.320.7-173.652.10000113.7F278 Q279F278-S281 PolarHBondContact O-N 3.06Å; F278-S281 PolarHBondContact O-OG 3.43Å; Q279-S281 VanDerWaalsContact C-N 3.28Å; Q279-S281 PolarHBondContact O-N 3.45Å
282S44.8Very low79.2Confident173 Ų17373.2 Ų73.2100%1.2140%0.401SS*.  trans-116.60165-67.40000109.4

Retrieved 282 of 282 residues in 864 ms (Link to these results)