A0A087WZC3_HUMAN Loading...

Synaptonemal complex protein 1

AlphaFold DB , UniProt , Accession A0A087WZC3, Species HUMAN (Homo sapiens, Human), Gene SYCP1, Length 951 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
1M38.5Very low39.2Very low244 Ų244166.5 Ų166.5100%1.20283%0.829SS**  0138.90-52.4178.4-164.400105.6
2E37.4Very low40.9Very low194 Ų194161.8 Ų161.891%0.90782%0.819SS**  cis-112.8-163.810.7-64.9178.898.700113
3K39.8Very low41.4Very low193 Ų193159.2 Ų159.284%0.83982%0.82SS**  trans-98168.8165.8-59.1168.9-175.5171.30106.3
4Q36.9Very low40.9Very low185 Ų185164.5 Ų164.586%0.86482%0.824SS**  cis-164.2158.933.1-155.8158.1-5.800112.5
5K43.9Very low40.7Very low185 Ų185160.8 Ų160.880%0.80482%0.82SS**  trans-58.9-176.9170.5-95.2-177.2179.7-176.70114.7
6P58.9Low40.2Very low86 Ų86158.1 Ų158.156%0.55882%0.82SS**  cis-149.6-172.4-2840.1-20.7000117.1
7F34.3Very low39.8Very low195 Ų195155.9 Ų155.986%0.85582%0.822SS**  trans68.9156.5145-66.9-33.4000120.4
8A33.7Very low39.4Very low88 Ų88152.2 Ų152.273%0.72781%0.81SS**  cis-161.9-175.1-13.400000112.5
9L37.3Very low39.2Very low146 Ų146153.6 Ų153.676%0.76481%0.812SS**  trans-52149.6-178-70.862.9000116.7
10F33Very low38.9Very low191 Ų191152 Ų15284%0.83881%0.808SS**  -179-170.8103-113.6-84.8000112.6
11V36.9Very low38.6Very low125 Ų125150.2 Ų150.276%0.75881%0.808SS**  trans-115.6-155.1-158.2-146.50000113.6
12P59.9Low38.4Very low110 Ų110142.5 Ų142.571%0.71478%0.783SS**  trans-97.5-170.8-140.743.9-30.6000114.3
13P47Very low38.2Very low127 Ų127140.3 Ų140.383%0.82578%0.782SS**  -147.5-174.9115.139.3-24000115.8
14R35.6Very low37.9Very low234 Ų234140.2 Ų140.288%0.88378%0.782SS**  trans-107.5162.4173.1-75.4-178.1169.4-176.4-2.6112.6
15S37.9Very low38.4Very low109 Ų109135.6 Ų135.676%0.76277%0.768SS**  trans75.7130.5138.758.90000123.9
16S32.1Very low37.7Very low117 Ų117134.8 Ų134.882%0.81877%0.767SS**  114.9158.8129.478.20000120.1
17S33.2Very low36.4Very low122 Ų122136.4 Ų136.485%0.85378%0.776SS**  trans74.6143.2-176.1-115.40000117.1
18S32.6Very low36.3Very low88 Ų88135 Ų13562%0.61578%0.776SS**  cis-152.7154.22.460.60000114.1
19Q35.8Very low36.2Very low180 Ų180134.8 Ų134.884%0.84178%0.782SS**  trans56.8151.1142.3-74.7175.8-17.600122.2
20V33.2Very low35.9Very low121 Ų121131.5 Ų131.573%0.73378%0.784SS**  cis-165149.1-23.5114.80000110.2
21S33.2Very low35.8Very low115 Ų115130.9 Ų130.980%0.80479%0.789SS**  trans64.8151.6164.2-88.10000119.8
22A34.1Very low35.5Very low82 Ų82130 Ų13068%0.67879%0.788SS**  cis-154.8175.2-2.300000112.9
23V33.2Very low34.2Very low147 Ų147131.2 Ų131.289%0.89179%0.794SS**  trans84.2147.2167.2-167.30000116.6
24K32.9Very low33.5Very low192 Ų192134.6 Ų134.684%0.83580%0.796SS**  trans-135.8173-166.6-126.6-171.7176.6-177.30107.4
25P47.4Very low33.3Very low87 Ų87132 Ų13257%0.56579%0.791SS**  cis-139.1173.1-6.841.6-24.5000116.5
26Q30.1Very low32.8Very low169 Ų169136.7 Ų136.779%0.7980%0.798SS**  trans78.5147.6137.9-94.2167.1-5200124.6
27T31.5Very low32.5Very low120 Ų120134.4 Ų134.474%0.73678%0.782SS**  trans76.8115.5159.345.80000121.6
28L32.6Very low32.4Very low166 Ų166137.6 Ų137.687%0.86978%0.781SS**  trans26.6108.3144.4-77.864.6000119.4
29G29.6Very low32.4Very low82 Ų82140.3 Ų140.385%0.84579%0.788SS**  80.613893.800000119.7
30G31.8Very low32.3Very low78 Ų78138.9 Ų138.980%0.80478%0.78SS**  trans106.2132.9167.600000114.2
31D31Very low32.1Very low177 Ų177138.1 Ų138.195%0.94778%0.778SS**  trans-68.7144.4177.1-65.4-71.2000112.2
32S31.4Very low32.1Very low107 Ų107136.7 Ų136.775%0.74877%0.765SS**  trans-105.9126.2-172.764.70000112.8
33T31.1Very low32Very low135 Ų135140.6 Ų140.683%0.82877%0.769SS**  trans-172.1102.9150.29.80000110
34F33.4Very low31.9Very low199 Ų199140.6 Ų140.687%0.87376%0.764SS**  trans-173157.7149.1-105.1-61.3000113.1
35F30.6Very low31.9Very low178 Ų178138.2 Ų138.278%0.78176%0.76SS**  trans64.8120.2167.4-77-70.9000121.7
36K28.1Very low31.1Very low209 Ų209142 Ų14291%0.90977%0.768SS**  -141.5159.1113-149.4165.3-174174.50110.2
37S26.8Very low31.1Very low68 Ų68142.3 Ų142.348%0.47677%0.77SS.*  trans-149.9-177.1-161.549.10000113.6
38F30.6Very low31.3Very low189 Ų189146.3 Ų146.383%0.82978%0.777SS**  trans77141.5-178.6-53.9-79.4000115.4
39N32.4Very low31.6Very low145 Ų145143.9 Ų143.978%0.77577%0.771SS**  cis-147.3-178.4-3.8-136.9-8.5000107.9
40K33.2Very low31.6Very low151 Ų151149.8 Ų149.866%0.65777%0.774SS**  cis-136.3-172.29.9-139.9-131.3163-164.70105.6T42K40-T42 PolarHBondContact NZ-OG1 3.23Å
41C28.9Very low31.2Very low105 Ų105150.5 Ų150.571%0.70977%0.772SS**  cis69150.127.7-90.70000115.5
42T33Very low31.6Very low84 Ų84152 Ų15252%0.51577%0.771SS.*  cis-137.1145-0.317.30000111.5K40K40-T42 PolarHBondContact NZ-OG1 3.23Å
43E32.7Very low31.5Very low165 Ų165152.8 Ų152.877%0.77177%0.771SS**  trans29.5124.4140.3-66.3157.1162.300123.5
44D31.3Very low31.6Very low147 Ų147154.4 Ų154.479%0.78678%0.775SS**  59.6139.1124.6-58.8-3.3000126.5
45D32.1Very low31.5Very low141 Ų141152.8 Ų152.875%0.75477%0.774SS**  trans87.5151.6139-94.9-6000125.1
46F31.3Very low31.6Very low167 Ų167149.1 Ų149.173%0.73277%0.771SS**  trans71.5113.4170.8-72.4-78.4000123.3
47E29Very low32.1Very low175 Ų175147.8 Ų147.882%0.81877%0.765SS**  trans42150.5132.6-64.1-171.1127.700125
48F36Very low32.4Very low204 Ų204150.7 Ų150.790%0.89578%0.775SS**  trans-55.9147.8173.1-83.1-87.7000113.9
49P40Very low32.4Very low115 Ų115144.8 Ų144.875%0.74777%0.767SS**  -145.8175.895.737.7-21.4000117.1
50F28.1Very low32.2Very low207 Ų207147.2 Ų147.291%0.90877%0.774SS**  trans-32.9143.5171.6-67.3-103.4000118
51A25.3Very low32.4Very low92 Ų92147.9 Ų147.976%0.7678%0.784SS**  -173.3148102.400000113.7
52K39Very low32.6Very low210 Ų210150.3 Ų150.391%0.91379%0.789SS**  trans-103.8130.1156.8-76.9-178.4178177.30108.4
53T28.9Very low32.6Very low122 Ų122154 Ų15475%0.74881%0.805SS**  trans-145.9118164.441.90000111.4
54N32.8Very low32.6Very low170 Ų170150.8 Ų150.891%0.90980%0.801SS**  trans-105.8138.3163-72.9-31.4000108.6
55L31.1Very low32.6Very low165 Ų165150.8 Ų150.886%0.86480%0.801SS**  trans-156147.7172.6-88.8150.5000106.6
56S32.7Very low33.1Very low101 Ų101149.4 Ų149.471%0.70680%0.8SS**  cis-156.3-175-10.765.10000106.8
57K38.9Very low33Very low181 Ų181145 Ų14579%0.78779%0.794SS**  cis-157.8168.84.6-137.9-169.3157.9-161.60104.5
58N32.7Very low33.2Very low129 Ų129144.4 Ų144.469%0.6980%0.796SS**  cis-106.2-172.13.5-71.7-44.2000109.8
59G30.4Very low32.8Very low64 Ų64143.7 Ų143.766%0.6680%0.795SS**  cis104118.5800000110.8
60E29.4Very low32.3Very low196 Ų196147.8 Ų147.892%0.91680%0.801SS**  cis-139.5156.35.9-66.6177.1125.800112
61N36.5Very low32.5Very low165 Ų165144.3 Ų144.388%0.88280%0.797SS**  trans-146.7121.1175.3-110.1-14.7000107.3
62I33.6Very low32.7Very low157 Ų157146 Ų14681%0.80579%0.793SS**  trans-140.4120.8157.4-64.3-172.8000108.4S64I62-S64 WeakPolarHBondContact CG2-OG 3.45Å
63D33.7Very low32.2Very low161 Ų161145.4 Ų145.486%0.86179%0.791SS**  trans-94.9139.4157.1178.122.5000107.8
64S32Very low32.2Very low97 Ų97146.6 Ų146.668%0.67879%0.792SS**  trans-168.1116.6-179.4-77.70000113.3I62I62-S64 WeakPolarHBondContact CG2-OG 3.45Å
65D31.3Very low32.2Very low147 Ų147144.1 Ų144.179%0.78679%0.785SS**  trans-112.3130.7145.5-178.833.5000106A67D65-A67 PolarHBondContact OD1-N 3.39Å
66P41.9Very low32Very low112 Ų112142.2 Ų142.273%0.72778%0.78SS**  -147.4141.299.536.1-18.6000116.5
67A29.5Very low31.8Very low74 Ų74144.9 Ų144.961%0.61279%0.786SS**  trans73.6118.7134.200000122.1D65D65-A67 PolarHBondContact OD1-N 3.39Å
68L32.8Very low31.1Very low164 Ų164144.3 Ų144.386%0.85979%0.786SS**  trans59.392133.3-61.6173.6000120.5
69Q28.8Very low31.1Very low189 Ų189146 Ų14688%0.88379%0.79SS**  -156.188.3129.2-119.4176.149.400116.7V71Q69-V71 PolarHBondContact O-N 3.48Å
70K29.6Very low30.9Very low201 Ų201149.5 Ų149.587%0.87480%0.797SS**  34.586.4124.4-168.3-170.8180-179.30118.7
71V30.9Very low30.7Very low133 Ų133142.8 Ų142.881%0.80678%0.781SS**  trans-138.8147.1144.1-174.20000109.5Q69Q69-V71 PolarHBondContact O-N 3.48Å
72N30Very low30.1Very low129 Ų129142.7 Ų142.769%0.6978%0.781SS**  trans-57.3156.3176.6-52.5-34.3000111.4
73F28.2Very low30Very low196 Ų196140.2 Ų140.286%0.8678%0.777SS**  cis-140168.747.9-77.1-92.3000115.2
74L29.7Very low29.6Very low147 Ų147138.4 Ų138.477%0.7777%0.767SS**  trans-76.1152.7-171.4-67118.2000114.6
75P33.6Very low29.3Very low119 Ų119139.7 Ų139.777%0.77378%0.775SS**  trans-74.7118.6151.832.2-29.6000109.6L77P75-L77 PolarHBondContact O-N 3.33Å; P75-L77 VanDerWaalsContact O-N 3.1Å
76V25.2Very low29.1Very low124 Ų124140.6 Ų140.675%0.75277%0.774SS**  trans-82.689.8174.8-178.10000109.7E78V76-E78 HydrophobicContact CG1-CB 4Å
77L29.2Very low28.6Very low158 Ų158144.8 Ų144.883%0.82778%0.777SS**  trans-90.8101.2151.5-179.477000107.2P75P75-L77 PolarHBondContact O-N 3.33Å; P75-L77 VanDerWaalsContact O-N 3.1Å
78E25.1Very low28.5Very low169 Ų169149 Ų14979%0.7978%0.784SS**  trans-108.4102.1172.3-166.8163.8-142.800109.5V76V76-E78 HydrophobicContact CG1-CB 4Å
79Q32.2Very low28.3Very low165 Ų165148.9 Ų148.977%0.77178%0.779SS**  trans-118.5153.3158.7-76.9-167.9-2.300108
80V26.1Very low28.3Very low136 Ų136142.8 Ų142.882%0.82477%0.767SS**  trans71.9128.5-177.2-166.60000112.8
81G25Very low28.3Very low56 Ų56140.1 Ų140.158%0.57776%0.761SS**  cis167.7174.2-4.400000113
82N24.6Very low28.4Very low163 Ų163141.4 Ų141.487%0.87276%0.756SS**  trans67.6151.6-177.6-45.2-25.9000113.7
83S30.2Very low28.3Very low104 Ų104140.5 Ų140.573%0.72775%0.751SS**  cis-131.8138.7-6-118.80000108.2
84D24.9Very low28.6Very low123 Ų123135.9 Ų135.966%0.65874%0.744SS**  50.3105.5100.8-174.921.6000115.4H86D84-H86 IonicContact OD1-CD2 3.37Å; D84-H86 PolarHBondContact OD1-N 3.27Å
85C25.5Very low28.7Very low125 Ų125136 Ų13685%0.84575%0.745SS**  trans-150.296.613859.60000110.7
86H28.7Very low28.9Very low165 Ų165137.7 Ų137.776%0.76475%0.747SS**  trans1.4150.5161.4-94-97.1000124D84D84-H86 IonicContact OD1-CD2 3.37Å; D84-H86 PolarHBondContact OD1-N 3.27Å
87Y30.3Very low29.5Very low201 Ų201139.5 Ų139.579%0.78875%0.747SS**  trans-58.4167.3159.4-83.9-102.2000114.7
88Q28.6Very low29.9Very low163 Ų163139.6 Ų139.676%0.76275%0.748SS**  trans68.2165.6154.1-77.3171.4-81.500116
89E28.2Very low31.1Very low161 Ų161136.1 Ų136.175%0.75274%0.742SS**  cis-173.7155.4-26.7176164.6-158.100106.8
90G28.2Very low31.9Very low61 Ų61136 Ų13663%0.62974%0.742SS**  trans135106.1-179.700000111
91L30.7Very low33.5Very low144 Ų144132.3 Ų132.375%0.75473%0.731SS**  75.1114.971.9-89.470.4000113.8
92K32.5Very low35.5Very low160 Ų160134.9 Ų134.970%0.69673%0.731SS**  trans71.1150.3134.9-67.2-173143.3-70.70118
93D27.6Very low37.6Very low110 Ų110131 Ų13159%0.58872%0.717SS**  cis-150.1165.1-7.2-103-29000108.2
94S34.3Very low39.8Very low100 Ų100135.9 Ų135.970%0.69972%0.72SS**  trans62.1149.4157.761.20000119.5
95D32.9Very low42.3Very low148 Ų148134.5 Ų134.579%0.79172%0.716SS**  cis-161.8-177.2-20.9-100.5-35.2000108.9
96L36.9Very low44.8Very low155 Ų155135.9 Ų135.981%0.81270%0.704SS**  trans90.180.8175.9-69.191.6000118.6
97E37.4Very low47.6Very low162 Ų162130.9 Ų130.976%0.75769%0.688SS**  60.2108.3124.6-61.4-170.1141.800121.7
98N37.9Very low50.3Low161 Ų161128.2 Ų128.286%0.86168%0.68SS**SBendtrans61.653.9131.5-64.1-28.5000119.6
99S51.3Low53.1Low95 Ų95125.7 Ų125.766%0.66467%0.672SS**  trans-141-16.7158.3-160.40000115.1G101S99-G101 VanDerWaalsContact C-N 3.3Å; S99-G101 PolarHBondContact O-N 3.37Å
100E48.5Very low56Low162 Ų162125.8 Ų125.876%0.75767%0.666SS**Hα-helixtrans-67.5-14.6-158-62-163.1102.300117.7L102 R104E100-L102 VanDerWaalsContact C-N 3.27Å; E100-L102 PolarHBondContact O-N 3.12Å; E100-R104 VanDerWaalsContact O-CB 3.29Å; E100-R104 WeakPolarHBondContact O-CB 3.21Å; E100-R104 PolarHBondContact O-N 2.87Å; E100-R104 VanDerWaalsContact O-N 3.16Å
101G60Low59Low59 Ų59128.8 Ų128.861%0.60866%0.662SS**Hα-helixtrans-55.8-41.3-178.200000113S99 V105S99-G101 VanDerWaalsContact C-N 3.3Å; S99-G101 PolarHBondContact O-N 3.37Å; G101-V105 WeakPolarHBondContact O-CG2 3.48Å; G101-V105 PolarHBondContact O-N 3.16Å
102L65.2Low61.9Low110 Ų110125.5 Ų125.558%0.57664%0.643SS**Hα-helixtrans-77.6-49.2-173.8-171.760.2000112.4E100 R104 V105 Y106E100-L102 VanDerWaalsContact C-N 3.27Å; E100-L102 PolarHBondContact O-N 3.12Å; L102-R104 VanDerWaalsContact C-N 3.3Å; L102-R104 PolarHBondContact O-N 2.76Å; L102-V105 PolarHBondContact O-N 3.35Å; L102-V105 VanDerWaalsContact O-N 3.16Å; L102-Y106 HydrophobicContact CD1-CD2 4.09Å; L102-Y106 HydrophobicContact CD1-CE2 3.61Å; L102-Y106 HydrophobicContact CD2-CE2 4.22Å; L102-Y106 HydrophobicContact CG-CD2 3.93Å; L102-Y106 HydrophobicContact CG-CE2 3.66Å; L102-Y106 WeakPolarHBondContact O-CD2 3.34Å; L102-Y106 PolarHBondContact O-N 3.4Å
103S70.6Confident64.6Low82 Ų82120.4 Ų120.457%0.57363%0.631SS**Hα-helixtrans-62.6-35.4179.5-60.90000112.6Y106 S107S103-Y106 PolarHBondContact O-N 3.14Å; S103-S107 WeakPolarHBondContact O-CB 3.48Å; S103-S107 PolarHBondContact O-N 3.3Å
104R74.8Confident67.7Low206 Ų206118.6 Ų118.678%0.77762%0.618SS**Hα-helixtrans-65.9-37.1175.8-164.1178.1-168.8-143.76.7112.1E100 L102 K108E100-R104 VanDerWaalsContact O-CB 3.29Å; E100-R104 WeakPolarHBondContact O-CB 3.21Å; E100-R104 PolarHBondContact O-N 2.87Å; E100-R104 VanDerWaalsContact O-N 3.16Å; L102-R104 VanDerWaalsContact C-N 3.3Å; L102-R104 PolarHBondContact O-N 2.76Å; R104-K108 WeakPolarHBondContact O-CB 3.48Å; R104-K108 PolarHBondContact O-N 3.37Å; R104-K108 VanDerWaalsContact O-N 3.11Å
105V77.4Confident70.5Confident95 Ų95119.3 Ų119.358%0.57661%0.609SS**Hα-helixtrans-67.8-47.9173.9170.20000110.9G101 L102 S107 K108 L109G101-V105 WeakPolarHBondContact O-CG2 3.48Å; G101-V105 PolarHBondContact O-N 3.16Å; L102-V105 PolarHBondContact O-N 3.35Å; L102-V105 VanDerWaalsContact O-N 3.16Å; V105-S107 PolarHBondContact O-N 3.38Å; V105-K108 PolarHBondContact O-N 3.43Å; V105-L109 WeakPolarHBondContact O-CB 3.26Å; V105-L109 PolarHBondContact O-N 3.37Å
106Y79.4Confident73.4Confident153 Ų153117.6 Ų117.660%0.660%0.599SS**Hα-helixtrans-60.1-44.5177.1-81.1-63.9000112.9L102 S103 K108 L109 Y110L102-Y106 HydrophobicContact CD1-CD2 4.09Å; L102-Y106 HydrophobicContact CD1-CE2 3.61Å; L102-Y106 HydrophobicContact CD2-CE2 4.22Å; L102-Y106 HydrophobicContact CG-CD2 3.93Å; L102-Y106 HydrophobicContact CG-CE2 3.66Å; L102-Y106 WeakPolarHBondContact O-CD2 3.34Å; L102-Y106 PolarHBondContact O-N 3.4Å; S103-Y106 PolarHBondContact O-N 3.14Å; Y106-K108 VanDerWaalsContact C-N 3.34Å; Y106-K108 PolarHBondContact O-N 3.47Å; Y106-L109 PolarHBondContact O-N 3.27Å; Y106-Y110 WeakPolarHBondContact O-CB 3.42Å; Y106-Y110 PolarHBondContact O-N 3.21Å
107S86.1Confident76.1Confident61 Ų61117.1 Ų117.143%0.42759%0.59SS.*Hα-helixtrans-65-37178.2-168.20000112.3S103 V105 K111S103-S107 WeakPolarHBondContact O-CB 3.48Å; S103-S107 PolarHBondContact O-N 3.3Å; V105-S107 PolarHBondContact O-N 3.38Å; S107-K111 WeakPolarHBondContact O-CG 3.5Å; S107-K111 PolarHBondContact O-N 3.37Å; S107-K111 VanDerWaalsContact O-N 3.1Å
108K87.6Confident78.9Confident145 Ų145115.3 Ų115.363%0.6358%0.58SS**Hα-helixtrans-69.3-43.8174.8-166.6173.2-177.2-179.10111.7R104 V105 Y106 Y110 K111 E112R104-K108 WeakPolarHBondContact O-CB 3.48Å; R104-K108 PolarHBondContact O-N 3.37Å; R104-K108 VanDerWaalsContact O-N 3.11Å; V105-K108 PolarHBondContact O-N 3.43Å; Y106-K108 VanDerWaalsContact C-N 3.34Å; Y106-K108 PolarHBondContact O-N 3.47Å; K108-Y110 VanDerWaalsContact C-N 3.33Å; K108-Y110 PolarHBondContact O-N 3.27Å; K108-K111 PolarHBondContact O-N 3.33Å; K108-E112 PolarHBondContact O-N 3.49Å
109L88.3Confident81.6Confident110 Ų110116.3 Ų116.358%0.57657%0.571SS**Hα-helixtrans-59.4-42.2175.1-17962.2000111.7V105 Y106 E112 A113V105-L109 WeakPolarHBondContact O-CB 3.26Å; V105-L109 PolarHBondContact O-N 3.37Å; Y106-L109 PolarHBondContact O-N 3.27Å; L109-E112 PolarHBondContact O-N 3.4Å; L109-A113 WeakPolarHBondContact O-CB 3.4Å; L109-A113 PolarHBondContact O-N 3.33Å
110Y89.4Confident83.8Confident163 Ų163117.1 Ų117.164%0.63956%0.563SS**Hα-helixtrans-62.4-43.6175.2-171.7-87.6000112.1Y106 K108 A113 E114Y106-Y110 WeakPolarHBondContact O-CB 3.42Å; Y106-Y110 PolarHBondContact O-N 3.21Å; K108-Y110 VanDerWaalsContact C-N 3.33Å; K108-Y110 PolarHBondContact O-N 3.27Å; Y110-A113 PolarHBondContact O-N 3Å; Y110-E114 HydrophobicContact CD1-CG 4.22Å; Y110-E114 HydrophobicContact CE1-CG 3.84Å; Y110-E114 PolarHBondContact O-N 3.19Å
111K91.2Very high86Confident124 Ų124113.4 Ų113.454%0.53955%0.551SS.*Hα-helixtrans-65.8-37.1177.6-73.5174.3-179-179.80112.8S107 K108 K115S107-K111 WeakPolarHBondContact O-CG 3.5Å; S107-K111 PolarHBondContact O-N 3.37Å; S107-K111 VanDerWaalsContact O-N 3.1Å; K108-K111 PolarHBondContact O-N 3.33Å; K111-K115 WeakPolarHBondContact O-CG 3.45Å; K111-K115 PolarHBondContact O-N 3.17Å
112E90.8Very high87.7Confident74 Ų74114.2 Ų114.235%0.34655%0.547SS..Hα-helixtrans-71.4-37.4171.9-59.1-46.2132.800112.1K108 L109 E114 K115 I116K108-E112 PolarHBondContact O-N 3.49Å; L109-E112 PolarHBondContact O-N 3.4Å; E112-E114 VanDerWaalsContact C-N 3.34Å; E112-E114 PolarHBondContact O-N 3.32Å; E112-K115 PolarHBondContact O-N 3.37Å; E112-K115 IonicContact OE1-NZ 3.1Å; E112-K115 PolarHBondContact OE1-NZ 3.4Å; E112-K115 WeakPolarHBondContact OE2-CD 3.36Å; E112-K115 IonicContact OE2-NZ 2.6Å; E112-K115 PolarHBondContact OE2-NZ 3.48Å; E112-I116 WeakPolarHBondContact O-CB 3.47Å; E112-I116 VanDerWaalsContact O-CG1 3.27Å; E112-I116 WeakPolarHBondContact O-CG1 3.47Å; E112-I116 PolarHBondContact O-N 3.26Å
113A89.7Confident89.1Confident54 Ų54111 Ų11145%0.44653%0.533SS..Hα-helixtrans-62.9-38.717300000112.3L109 Y110 I116 K117L109-A113 WeakPolarHBondContact O-CB 3.4Å; L109-A113 PolarHBondContact O-N 3.33Å; Y110-A113 PolarHBondContact O-N 3Å; A113-I116 PolarHBondContact O-N 3.14Å; A113-K117 WeakPolarHBondContact O-CB 3.45Å; A113-K117 PolarHBondContact O-N 3.06Å
114E91.8Very high90.2Very high71 Ų71111.6 Ų111.633%0.33253%0.526SS..Hα-helixtrans-62.3-44.7170.6-91.9-134.7116.900112.7Y110 E112 K117 K118Y110-E114 HydrophobicContact CD1-CG 4.22Å; Y110-E114 HydrophobicContact CE1-CG 3.84Å; Y110-E114 PolarHBondContact O-N 3.19Å; E112-E114 VanDerWaalsContact C-N 3.34Å; E112-E114 PolarHBondContact O-N 3.32Å; E114-K117 PolarHBondContact O-N 2.68Å; E114-K118 WeakPolarHBondContact O-CB 3.38Å; E114-K118 VanDerWaalsContact O-CG 3.32Å; E114-K118 WeakPolarHBondContact O-CG 3.48Å; E114-K118 PolarHBondContact O-N 3.15Å; E114-K118 IonicContact OE1-NZ 2.74Å; E114-K118 PolarHBondContact OE1-NZ 3.38Å; E114-K118 VanDerWaalsContact OE1-NZ 3.13Å; E114-K118 IonicContact OE2-NZ 3.38Å; E114-K118 PolarHBondContact OE2-NZ 3.02Å
115K94.5Very high91.2Very high116 Ų116104.5 Ų104.550%0.50451%0.512SS..Hα-helixtrans-61.1-45.6175.5-75.8161.8167.1-179.20111.2K111 E112 K117 K118 W119K111-K115 WeakPolarHBondContact O-CG 3.45Å; K111-K115 PolarHBondContact O-N 3.17Å; E112-K115 PolarHBondContact O-N 3.37Å; E112-K115 IonicContact OE1-NZ 3.1Å; E112-K115 PolarHBondContact OE1-NZ 3.4Å; E112-K115 WeakPolarHBondContact OE2-CD 3.36Å; E112-K115 IonicContact OE2-NZ 2.6Å; E112-K115 PolarHBondContact OE2-NZ 3.48Å; K115-K117 VanDerWaalsContact C-N 3.32Å; K115-K117 PolarHBondContact O-N 3.36Å; K115-K118 PolarHBondContact O-N 3.3Å; K115-W119 VanDerWaalsContact O-CB 3.29Å; K115-W119 WeakPolarHBondContact O-CB 3.35Å; K115-W119 PolarHBondContact O-N 3.12Å
116I92.9Very high92.1Very high111 Ų111104.4 Ų104.457%0.56951%0.505SS*.Hα-helixtrans-60.9-42175.9-68.6163.8000110.4E112 A113 K120E112-I116 WeakPolarHBondContact O-CB 3.47Å; E112-I116 VanDerWaalsContact O-CG1 3.27Å; E112-I116 WeakPolarHBondContact O-CG1 3.47Å; E112-I116 PolarHBondContact O-N 3.26Å; A113-I116 PolarHBondContact O-N 3.14Å; I116-K120 WeakPolarHBondContact O-CB 3.46Å; I116-K120 PolarHBondContact O-N 3.16Å
117K94.4Very high92.8Very high146 Ų146102.2 Ų102.264%0.63550%0.503SS*.Hα-helixtrans-63.2-46.3175.2-175.5-178.6178.1-175.30112.1A113 E114 K115 K120 V121A113-K117 WeakPolarHBondContact O-CB 3.45Å; A113-K117 PolarHBondContact O-N 3.06Å; E114-K117 PolarHBondContact O-N 2.68Å; K115-K117 VanDerWaalsContact C-N 3.32Å; K115-K117 PolarHBondContact O-N 3.36Å; K117-K120 PolarHBondContact O-N 3.48Å; K117-V121 WeakPolarHBondContact O-CB 3.2Å; K117-V121 WeakPolarHBondContact O-CG2 3.44Å; K117-V121 PolarHBondContact O-N 3Å
118K94.5Very high93.2Very high124 Ų124109.1 Ų109.154%0.53952%0.52SS..Hα-helixtrans-64.1-45.5178.2-74.2163.9-178.81620111E114 K115 S122E114-K118 WeakPolarHBondContact O-CB 3.38Å; E114-K118 VanDerWaalsContact O-CG 3.32Å; E114-K118 WeakPolarHBondContact O-CG 3.48Å; E114-K118 PolarHBondContact O-N 3.15Å; E114-K118 IonicContact OE1-NZ 2.74Å; E114-K118 PolarHBondContact OE1-NZ 3.38Å; E114-K118 VanDerWaalsContact OE1-NZ 3.13Å; E114-K118 IonicContact OE2-NZ 3.38Å; E114-K118 PolarHBondContact OE2-NZ 3.02Å; K115-K118 PolarHBondContact O-N 3.3Å; K118-S122 VanDerWaalsContact O-CB 3.29Å; K118-S122 WeakPolarHBondContact O-CB 3.42Å; K118-S122 PolarHBondContact O-N 2.96Å
119W96.4Very high93.6Very high181 Ų181107.4 Ų107.469%0.68651%0.514SS*.Hα-helixtrans-62.3-45.6174.7176.575.7000112.3K115 S122 T123K115-W119 VanDerWaalsContact O-CB 3.29Å; K115-W119 WeakPolarHBondContact O-CB 3.35Å; K115-W119 PolarHBondContact O-N 3.12Å; W119-S122 PolarHBondContact O-N 3.32Å; W119-T123 WeakPolarHBondContact O-CB 3.4Å; W119-T123 PolarHBondContact O-N 3.26Å; W119-T123 PolarHBondContact O-OG1 3.44Å
120K96Very high93.9Very high112 Ų112107.4 Ų107.449%0.48751%0.509SS..Hα-helixtrans-58.4-53.9176.1177.4176.6175178.30111I116 K117 S122 T123 E124I116-K120 WeakPolarHBondContact O-CB 3.46Å; I116-K120 PolarHBondContact O-N 3.16Å; K117-K120 PolarHBondContact O-N 3.48Å; K120-S122 VanDerWaalsContact C-N 3.33Å; K120-S122 PolarHBondContact O-N 3.01Å; K120-T123 PolarHBondContact O-N 3.29Å; K120-E124 WeakPolarHBondContact CE-OE1 3.26Å; K120-E124 WeakPolarHBondContact CE-OE2 3.41Å; K120-E124 HydrophobicContact CG-CG 4.28Å; K120-E124 IonicContact NZ-OE1 3.73Å; K120-E124 WeakPolarHBondContact O-CB 3.45Å; K120-E124 WeakPolarHBondContact O-CG 3.49Å; K120-E124 PolarHBondContact O-N 3.39Å
121V95.8Very high94.2Very high85 Ų85103.1 Ų103.152%0.51550%0.495SS..Hα-helixtrans-61.9-40.1-179.7171.50000111.5K117 A125K117-V121 WeakPolarHBondContact O-CB 3.2Å; K117-V121 WeakPolarHBondContact O-CG2 3.44Å; K117-V121 PolarHBondContact O-N 3Å; V121-A125 VanDerWaalsContact O-CB 3.25Å; V121-A125 WeakPolarHBondContact O-CB 3.41Å; V121-A125 PolarHBondContact O-N 2.92Å
122S95.7Very high94.4Very high75 Ų75100.5 Ų100.552%0.52449%0.493SS..Hα-helixtrans-62.9-44.1175.3-168.50000112K118 W119 K120 A125 E126K118-S122 VanDerWaalsContact O-CB 3.29Å; K118-S122 WeakPolarHBondContact O-CB 3.42Å; K118-S122 PolarHBondContact O-N 2.96Å; W119-S122 PolarHBondContact O-N 3.32Å; K120-S122 VanDerWaalsContact C-N 3.33Å; K120-S122 PolarHBondContact O-N 3.01Å; S122-A125 PolarHBondContact O-N 3.24Å; S122-E126 WeakPolarHBondContact O-CB 3.4Å; S122-E126 PolarHBondContact O-N 3.13Å
123T93.8Very high94.6Very high43 Ų43101.9 Ų101.926%0.26450%0.497SS..Hα-helixtrans-69.1-41.2179.7-530000111W119 K120 E126 L127W119-T123 WeakPolarHBondContact O-CB 3.4Å; W119-T123 PolarHBondContact O-N 3.26Å; W119-T123 PolarHBondContact O-OG1 3.44Å; K120-T123 PolarHBondContact O-N 3.29Å; T123-E126 PolarHBondContact O-N 3.4Å; T123-L127 HydrophobicContact CG2-CD1 4.11Å; T123-L127 HydrophobicContact CG2-CG 4.49Å; T123-L127 WeakPolarHBondContact O-CB 3.46Å; T123-L127 VanDerWaalsContact O-CG 3.23Å; T123-L127 WeakPolarHBondContact O-CG 3.39Å; T123-L127 PolarHBondContact O-N 3.27Å
124E94.9Very high94.9Very high94 Ų94103.7 Ų103.744%0.43950%0.499SS..Hα-helixtrans-63.8-40.4174.5-73.6176.315200111.5K120 R128K120-E124 WeakPolarHBondContact CE-OE1 3.26Å; K120-E124 WeakPolarHBondContact CE-OE2 3.41Å; K120-E124 HydrophobicContact CG-CG 4.28Å; K120-E124 IonicContact NZ-OE1 3.73Å; K120-E124 WeakPolarHBondContact O-CB 3.45Å; K120-E124 WeakPolarHBondContact O-CG 3.49Å; K120-E124 PolarHBondContact O-N 3.39Å; E124-R128 WeakPolarHBondContact O-CB 3.47Å; E124-R128 WeakPolarHBondContact O-CG 3.32Å; E124-R128 PolarHBondContact O-N 3.2Å
125A93.9Very high95.1Very high57 Ų57104.9 Ų104.947%0.47151%0.505SS..Hα-helixtrans-65.7-43.2174.600000112.3V121 S122 R128 Q129V121-A125 VanDerWaalsContact O-CB 3.25Å; V121-A125 WeakPolarHBondContact O-CB 3.41Å; V121-A125 PolarHBondContact O-N 2.92Å; S122-A125 PolarHBondContact O-N 3.24Å; A125-R128 PolarHBondContact O-N 3.21Å; A125-Q129 WeakPolarHBondContact O-CB 3.46Å; A125-Q129 PolarHBondContact O-N 2.81Å
126E96.6Very high95.1Very high94 Ų94104.5 Ų104.544%0.43951%0.505SS..Hα-helixtrans-64.3-43.4176.4-164.5-165.2144.500111.7S122 T123 Q129 K130S122-E126 WeakPolarHBondContact O-CB 3.4Å; S122-E126 PolarHBondContact O-N 3.13Å; T123-E126 PolarHBondContact O-N 3.4Å; E126-Q129 PolarHBondContact O-N 3.26Å; E126-K130 HydrophobicContact CG-CD 4.36Å; E126-K130 WeakPolarHBondContact O-CB 3.5Å; E126-K130 WeakPolarHBondContact O-CG 3.48Å; E126-K130 PolarHBondContact O-N 3.45Å; E126-K130 WeakPolarHBondContact OE1-CE 3.45Å; E126-K130 IonicContact OE1-NZ 3.55Å; E126-K130 PolarHBondContact OE1-NZ 3.04Å
127L95.2Very high95.3Very high107 Ų107103.2 Ų103.256%0.5650%0.499SS*.Hα-helixtrans-62.8-42174.8-73.8170.9000111.8T123 K130 E131T123-L127 HydrophobicContact CG2-CD1 4.11Å; T123-L127 HydrophobicContact CG2-CG 4.49Å; T123-L127 WeakPolarHBondContact O-CB 3.46Å; T123-L127 VanDerWaalsContact O-CG 3.23Å; T123-L127 WeakPolarHBondContact O-CG 3.39Å; T123-L127 PolarHBondContact O-N 3.27Å; L127-K130 PolarHBondContact O-N 3.47Å; L127-E131 WeakPolarHBondContact O-CB 3.28Å; L127-E131 PolarHBondContact O-N 3.04Å
128R94.1Very high95.4Very high205 Ų205102.5 Ų102.577%0.77449%0.492SS*.Hα-helixtrans-63.6-41174.1-73.6-73.3-175.6171.31.4112E124 A125 S132E124-R128 WeakPolarHBondContact O-CB 3.47Å; E124-R128 WeakPolarHBondContact O-CG 3.32Å; E124-R128 PolarHBondContact O-N 3.2Å; A125-R128 PolarHBondContact O-N 3.21Å; R128-S132 WeakPolarHBondContact O-CB 3.46Å; R128-S132 PolarHBondContact O-N 3.15Å
129Q95.2Very high95.5Very high110 Ų110104 Ų10451%0.51450%0.499SS..Hα-helixtrans-65.6-42.4176-163.1-160.67100111.5A125 E126 S132 K133A125-Q129 WeakPolarHBondContact O-CB 3.46Å; A125-Q129 PolarHBondContact O-N 2.81Å; E126-Q129 PolarHBondContact O-N 3.26Å; Q129-S132 PolarHBondContact O-N 3.46Å; Q129-K133 HydrophobicContact CG-CD 4.47Å; Q129-K133 WeakPolarHBondContact O-CG 3.37Å; Q129-K133 PolarHBondContact O-N 3.32Å
130K95.4Very high95.4Very high109 Ų10999 Ų9947%0.47449%0.485SS..Hα-helixtrans-63.1-45.7175.8-79.4172.8167.7172.60111.9E126 L127 S132 K133 L134E126-K130 HydrophobicContact CG-CD 4.36Å; E126-K130 WeakPolarHBondContact O-CB 3.5Å; E126-K130 WeakPolarHBondContact O-CG 3.48Å; E126-K130 PolarHBondContact O-N 3.45Å; E126-K130 WeakPolarHBondContact OE1-CE 3.45Å; E126-K130 IonicContact OE1-NZ 3.55Å; E126-K130 PolarHBondContact OE1-NZ 3.04Å; L127-K130 PolarHBondContact O-N 3.47Å; K130-S132 PolarHBondContact O-N 2.87Å; K130-K133 PolarHBondContact O-N 3.22Å; K130-L134 WeakPolarHBondContact O-CG 3.46Å; K130-L134 PolarHBondContact O-N 3.14Å
131E94.7Very high95.5Very high73 Ų7397.5 Ų97.534%0.34148%0.481SS..Hα-helixtrans-65-39.2176.5177.252.7-158.600111.8L127 K133 L134 Q135 R138L127-E131 WeakPolarHBondContact O-CB 3.28Å; L127-E131 PolarHBondContact O-N 3.04Å; E131-K133 PolarHBondContact O-N 3.48Å; E131-L134 PolarHBondContact O-N 3.46Å; E131-Q135 WeakPolarHBondContact O-CG 3.43Å; E131-Q135 PolarHBondContact O-N 3.42Å; E131-Q135 VanDerWaalsContact OE1-CG 3.3Å; E131-Q135 WeakPolarHBondContact OE1-CG 3.33Å; E131-Q135 PolarHBondContact OE1-NE2 3.41Å; E131-R138 VanDerWaalsContact CD-NH2 3.28Å; E131-R138 IonicContact OE1-CZ 2.69Å; E131-R138 IonicContact OE1-NH1 2.65Å; E131-R138 IonicContact OE1-NH2 2.97Å; E131-R138 PolarHBondContact OE1-NH2 2.84Å; E131-R138 IonicContact OE2-NH2 3.6Å; E131-R138 PolarHBondContact OE2-NH2 3.44Å
132S95.2Very high95.5Very high70 Ų7097.1 Ų97.149%0.4947%0.474SS..Hα-helixtrans-59.4-46.6173.7-167.30000111.9R128 Q129 K130 L134 Q135 E136R128-S132 WeakPolarHBondContact O-CB 3.46Å; R128-S132 PolarHBondContact O-N 3.15Å; Q129-S132 PolarHBondContact O-N 3.46Å; K130-S132 PolarHBondContact O-N 2.87Å; S132-L134 VanDerWaalsContact C-N 3.32Å; S132-L134 PolarHBondContact O-N 3.4Å; S132-Q135 PolarHBondContact O-N 3.46Å; S132-E136 WeakPolarHBondContact O-CB 3.44Å; S132-E136 PolarHBondContact O-N 3.42Å
133K96.5Very high95.5Very high102 Ų10296.5 Ų96.544%0.44347%0.473SS..Hα-helixtrans-63-35.9175.1-73.3170175.2172.50112.3Q129 K130 E131 N137Q129-K133 HydrophobicContact CG-CD 4.47Å; Q129-K133 WeakPolarHBondContact O-CG 3.37Å; Q129-K133 PolarHBondContact O-N 3.32Å; K130-K133 PolarHBondContact O-N 3.22Å; E131-K133 PolarHBondContact O-N 3.48Å; K133-N137 WeakPolarHBondContact O-CB 3.41Å; K133-N137 PolarHBondContact O-N 2.95Å; K133-N137 PolarHBondContact O-ND2 3.41Å
134L95.4Very high95.7Very high92 Ų9299.9 Ų99.948%0.48249%0.486SS..Hα-helixtrans-69.1-35.9174-71.4170.9000112.2K130 E131 S132 R138K130-L134 WeakPolarHBondContact O-CG 3.46Å; K130-L134 PolarHBondContact O-N 3.14Å; E131-L134 PolarHBondContact O-N 3.46Å; S132-L134 VanDerWaalsContact C-N 3.32Å; S132-L134 PolarHBondContact O-N 3.4Å; L134-R138 WeakPolarHBondContact O-CB 3.47Å; L134-R138 VanDerWaalsContact O-CG 3.28Å; L134-R138 WeakPolarHBondContact O-CG 3.42Å; L134-R138 PolarHBondContact O-N 3.01Å; L134-R138 PolarHBondContact O-NE 3.25Å
135Q95.2Very high95.7Very high97 Ų97102.3 Ų102.345%0.45349%0.491SS..Hα-helixtrans-68.9-39.6174-69.9-178.415.600111.9E131 S132 R138 K139E131-Q135 WeakPolarHBondContact O-CG 3.43Å; E131-Q135 PolarHBondContact O-N 3.42Å; E131-Q135 VanDerWaalsContact OE1-CG 3.3Å; E131-Q135 WeakPolarHBondContact OE1-CG 3.33Å; E131-Q135 PolarHBondContact OE1-NE2 3.41Å; S132-Q135 PolarHBondContact O-N 3.46Å; Q135-R138 VanDerWaalsContact CG-NH2 3.27Å; Q135-R138 PolarHBondContact O-N 2.67Å; Q135-K139 WeakPolarHBondContact O-CG 3.39Å; Q135-K139 PolarHBondContact O-N 3.23Å; Q135-K139 VanDerWaalsContact O-N 3.12Å
136E95.2Very high95.8Very high108 Ų108104.6 Ų104.651%0.50549%0.49SS..Hα-helixtrans-62.6-51.9173.1-175.8171.7-15700111.7S132 R138 K139 I140S132-E136 WeakPolarHBondContact O-CB 3.44Å; S132-E136 PolarHBondContact O-N 3.42Å; E136-R138 VanDerWaalsContact C-N 3.28Å; E136-R138 PolarHBondContact O-N 3.13Å; E136-K139 WeakPolarHBondContact O-CA 3.5Å; E136-K139 WeakPolarHBondContact O-CB 3.47Å; E136-K139 PolarHBondContact O-N 3.45Å; E136-I140 HydrophobicContact CG-CD1 4.03Å; E136-I140 WeakPolarHBondContact O-CG1 3.3Å; E136-I140 PolarHBondContact O-N 3.43Å
137N96.4Very high95.8Very high83 Ų83102.3 Ų102.344%0.44449%0.488SS..Hα-helixtrans-57.6-38.5175.6-73.3-13.2000112.4K133 K139 I140 I141K133-N137 WeakPolarHBondContact O-CB 3.41Å; K133-N137 PolarHBondContact O-N 2.95Å; K133-N137 PolarHBondContact O-ND2 3.41Å; N137-K139 PolarHBondContact O-N 3.13Å; N137-I140 PolarHBondContact O-N 3.19Å; N137-I141 WeakPolarHBondContact O-CB 3.38Å; N137-I141 WeakPolarHBondContact O-CD1 3.2Å; N137-I141 VanDerWaalsContact O-CG1 3.24Å; N137-I141 WeakPolarHBondContact O-CG1 3.47Å; N137-I141 PolarHBondContact O-N 2.96Å
138R96.4Very high95.9Very high132 Ų132101.7 Ų101.750%0.49848%0.484SS..Hα-helixtrans-62.3-39.9174.1-81.2172.5-74.6-163.70.7112.2E131 L134 Q135 E136 E142E131-R138 VanDerWaalsContact CD-NH2 3.28Å; E131-R138 IonicContact OE1-CZ 2.69Å; E131-R138 IonicContact OE1-NH1 2.65Å; E131-R138 IonicContact OE1-NH2 2.97Å; E131-R138 PolarHBondContact OE1-NH2 2.84Å; E131-R138 IonicContact OE2-NH2 3.6Å; E131-R138 PolarHBondContact OE2-NH2 3.44Å; L134-R138 WeakPolarHBondContact O-CB 3.47Å; L134-R138 VanDerWaalsContact O-CG 3.28Å; L134-R138 WeakPolarHBondContact O-CG 3.42Å; L134-R138 PolarHBondContact O-N 3.01Å; L134-R138 PolarHBondContact O-NE 3.25Å; Q135-R138 VanDerWaalsContact CG-NH2 3.27Å; Q135-R138 PolarHBondContact O-N 2.67Å; E136-R138 VanDerWaalsContact C-N 3.28Å; E136-R138 PolarHBondContact O-N 3.13Å; R138-E142 WeakPolarHBondContact O-CB 3.26Å; R138-E142 PolarHBondContact O-N 2.63Å; R138-E142 VanDerWaalsContact O-N 3.14Å
139K96.5Very high96Very high154 Ų15497.5 Ų97.567%0.6747%0.473SS*.Hα-helixtrans-66.7-42.4174.2-68.6170.6-177.7178.50112Q135 E136 N137 E142 A143Q135-K139 WeakPolarHBondContact O-CG 3.39Å; Q135-K139 PolarHBondContact O-N 3.23Å; Q135-K139 VanDerWaalsContact O-N 3.12Å; E136-K139 WeakPolarHBondContact O-CA 3.5Å; E136-K139 WeakPolarHBondContact O-CB 3.47Å; E136-K139 PolarHBondContact O-N 3.45Å; N137-K139 PolarHBondContact O-N 3.13Å; K139-E142 PolarHBondContact O-N 2.78Å; K139-A143 WeakPolarHBondContact O-CB 3.33Å; K139-A143 PolarHBondContact O-N 3.02Å
140I96.3Very high96Very high76 Ų7699 Ų9939%0.3948%0.48SS..Hα-helixtrans-63.5-47.5178.5-66.5167.6000110.8E136 N137 E142 A143 Q144E136-I140 HydrophobicContact CG-CD1 4.03Å; E136-I140 WeakPolarHBondContact O-CG1 3.3Å; E136-I140 PolarHBondContact O-N 3.43Å; N137-I140 PolarHBondContact O-N 3.19Å; I140-E142 VanDerWaalsContact C-N 3.29Å; I140-E142 PolarHBondContact O-N 2.94Å; I140-A143 PolarHBondContact O-N 2.69Å; I140-Q144 HydrophobicContact CG2-CG 4.4Å; I140-Q144 WeakPolarHBondContact O-CB 3.23Å; I140-Q144 WeakPolarHBondContact O-CG 3.44Å; I140-Q144 PolarHBondContact O-N 3.35Å
141I96.7Very high96Very high81 Ų8199.2 Ų99.242%0.41549%0.486SS..Hα-helixtrans-59.6-40.5177.2-70.9164.7000111N137 Q144 R145N137-I141 WeakPolarHBondContact O-CB 3.38Å; N137-I141 WeakPolarHBondContact O-CD1 3.2Å; N137-I141 VanDerWaalsContact O-CG1 3.24Å; N137-I141 WeakPolarHBondContact O-CG1 3.47Å; N137-I141 PolarHBondContact O-N 2.96Å; I141-Q144 PolarHBondContact O-N 2.97Å; I141-R145 WeakPolarHBondContact O-CB 3.42Å; I141-R145 VanDerWaalsContact O-CG 3.23Å; I141-R145 WeakPolarHBondContact O-CG 3.44Å; I141-R145 PolarHBondContact O-N 3.19Å
142E96.4Very high96.1Very high78 Ų78101.5 Ų101.536%0.36450%0.496SS..Hα-helixtrans-71.2-36.6178.9-172.457.9-160.800112.8R138 K139 I140 R145 K146R138-E142 WeakPolarHBondContact O-CB 3.26Å; R138-E142 PolarHBondContact O-N 2.63Å; R138-E142 VanDerWaalsContact O-N 3.14Å; K139-E142 PolarHBondContact O-N 2.78Å; I140-E142 VanDerWaalsContact C-N 3.29Å; I140-E142 PolarHBondContact O-N 2.94Å; E142-R145 PolarHBondContact O-N 3.32Å; E142-R145 IonicContact OE2-NH1 3.7Å; E142-K146 WeakPolarHBondContact O-CG 3.4Å; E142-K146 PolarHBondContact O-N 2.99Å; E142-K146 VanDerWaalsContact OE1-CE 3.23Å; E142-K146 WeakPolarHBondContact OE1-CE 3.45Å; E142-K146 IonicContact OE1-NZ 2.64Å
143A95.6Very high96.1Very high61 Ų61104.6 Ų104.650%0.50450%0.501SS..Hα-helixtrans-65.1-43.6171.500000111.8K139 I140 R145 K146 A147K139-A143 WeakPolarHBondContact O-CB 3.33Å; K139-A143 PolarHBondContact O-N 3.02Å; I140-A143 PolarHBondContact O-N 2.69Å; A143-R145 PolarHBondContact O-N 3.42Å; A143-K146 PolarHBondContact O-N 3.47Å; A143-A147 PolarHBondContact O-N 3.37Å
144Q96.9Very high96.1Very high114 Ų114101.2 Ų101.253%0.53350%0.495SS..Hα-helixtrans-62.6-40.2175.7-74.6175.5-23.400112.1I140 I141 K146 A147 I148I140-Q144 HydrophobicContact CG2-CG 4.4Å; I140-Q144 WeakPolarHBondContact O-CB 3.23Å; I140-Q144 WeakPolarHBondContact O-CG 3.44Å; I140-Q144 PolarHBondContact O-N 3.35Å; I141-Q144 PolarHBondContact O-N 2.97Å; Q144-K146 PolarHBondContact O-N 2.94Å; Q144-A147 PolarHBondContact O-N 2.91Å; Q144-I148 WeakPolarHBondContact O-CB 3.32Å; Q144-I148 WeakPolarHBondContact O-CD1 3.43Å; Q144-I148 VanDerWaalsContact O-CG1 3.24Å; Q144-I148 WeakPolarHBondContact O-CG1 3.43Å; Q144-I148 PolarHBondContact O-N 3.47Å
145R95.9Very high96.1Very high146 Ų146101.8 Ų101.855%0.55150%0.499SS*.Hα-helixtrans-58.9-45.1174.6-79166170.5-165.5-5.3112.3I141 E142 A143 I148 Q149I141-R145 WeakPolarHBondContact O-CB 3.42Å; I141-R145 VanDerWaalsContact O-CG 3.23Å; I141-R145 WeakPolarHBondContact O-CG 3.44Å; I141-R145 PolarHBondContact O-N 3.19Å; E142-R145 PolarHBondContact O-N 3.32Å; E142-R145 IonicContact OE2-NH1 3.7Å; A143-R145 PolarHBondContact O-N 3.42Å; R145-I148 PolarHBondContact O-N 3.08Å; R145-Q149 WeakPolarHBondContact O-CG 3.35Å; R145-Q149 PolarHBondContact O-N 3.2Å
146K96.8Very high96.2Very high105 Ų105102.8 Ų102.846%0.45750%0.503SS..Hα-helixtrans-66.2-45178.2-69.9175.5-177.2179.70111.9E142 A143 Q144 I148 Q149 E150E142-K146 WeakPolarHBondContact O-CG 3.4Å; E142-K146 PolarHBondContact O-N 2.99Å; E142-K146 VanDerWaalsContact OE1-CE 3.23Å; E142-K146 WeakPolarHBondContact OE1-CE 3.45Å; E142-K146 IonicContact OE1-NZ 2.64Å; A143-K146 PolarHBondContact O-N 3.47Å; Q144-K146 PolarHBondContact O-N 2.94Å; K146-I148 VanDerWaalsContact C-N 3.28Å; K146-I148 PolarHBondContact O-N 2.77Å; K146-Q149 WeakPolarHBondContact O-CB 3.45Å; K146-Q149 PolarHBondContact O-N 3.07Å; K146-Q149 VanDerWaalsContact O-N 3.11Å; K146-E150 WeakPolarHBondContact O-CG 3.21Å; K146-E150 PolarHBondContact O-N 2.76Å
147A95.8Very high96.3Very high46 Ų46103.6 Ų103.638%0.3851%0.505SS..Hα-helixtrans-58.8-38.9173.800000112.4A143 Q144 L151A143-A147 PolarHBondContact O-N 3.37Å; Q144-A147 PolarHBondContact O-N 2.91Å; A147-L151 WeakPolarHBondContact O-CB 3.49Å; A147-L151 VanDerWaalsContact O-CG 3.23Å; A147-L151 WeakPolarHBondContact O-CG 3.33Å; A147-L151 PolarHBondContact O-N 3.34Å
148I96.7Very high96.3Very high93 Ų93104.2 Ų104.248%0.47751%0.512SS..Hα-helixtrans-66.1-41.8174.6-70.9164.1000111.4Q144 R145 K146 L151 Q152Q144-I148 WeakPolarHBondContact O-CB 3.32Å; Q144-I148 WeakPolarHBondContact O-CD1 3.43Å; Q144-I148 VanDerWaalsContact O-CG1 3.24Å; Q144-I148 WeakPolarHBondContact O-CG1 3.43Å; Q144-I148 PolarHBondContact O-N 3.47Å; R145-I148 PolarHBondContact O-N 3.08Å; K146-I148 VanDerWaalsContact C-N 3.28Å; K146-I148 PolarHBondContact O-N 2.77Å; I148-L151 PolarHBondContact O-N 3.06Å; I148-Q152 HydrophobicContact CG2-CG 4.46Å; I148-Q152 WeakPolarHBondContact O-CB 3.4Å; I148-Q152 VanDerWaalsContact O-CG 3.24Å; I148-Q152 WeakPolarHBondContact O-CG 3.47Å; I148-Q152 PolarHBondContact O-N 2.76Å
149Q96.1Very high96.3Very high118 Ų118101.3 Ų101.355%0.55151%0.512SS*.Hα-helixtrans-64.3-42.2176.4-73.3169-23.100112.1R145 K146 Q152 F153R145-Q149 WeakPolarHBondContact O-CG 3.35Å; R145-Q149 PolarHBondContact O-N 3.2Å; K146-Q149 WeakPolarHBondContact O-CB 3.45Å; K146-Q149 PolarHBondContact O-N 3.07Å; K146-Q149 VanDerWaalsContact O-N 3.11Å; Q149-Q152 PolarHBondContact O-N 2.99Å; Q149-F153 PolarHBondContact O-N 3.28Å
150E95.6Very high96.3Very high142 Ų14299 Ų9966%0.66451%0.506SS*.Hα-helixtrans-65-40.9175.8-72.3170.8-167.400111.7K146 F153 G154K146-E150 WeakPolarHBondContact O-CG 3.21Å; K146-E150 PolarHBondContact O-N 2.76Å; E150-F153 PolarHBondContact O-N 3.35Å; E150-G154 PolarHBondContact O-N 3.2Å
151L96.8Very high96.4Very high113 Ų113102 Ų10259%0.59252%0.517SS*.Hα-helixtrans-66.1-37.3173.2-73.8169.4000112.6A147 I148 G154 N155A147-L151 WeakPolarHBondContact O-CB 3.49Å; A147-L151 VanDerWaalsContact O-CG 3.23Å; A147-L151 WeakPolarHBondContact O-CG 3.33Å; A147-L151 PolarHBondContact O-N 3.34Å; I148-L151 PolarHBondContact O-N 3.06Å; L151-G154 PolarHBondContact O-N 3.11Å; L151-N155 WeakPolarHBondContact O-CB 3.4Å; L151-N155 PolarHBondContact O-N 3.1Å; L151-N155 PolarHBondContact O-ND2 3.1Å
152Q95.6Very high96.4Very high120 Ų120103.4 Ų103.456%0.56152%0.524SS*.Hα-helixtrans-63-49.2174.5-77.7169.2-19.300111.2I148 Q149 G154 N155 E156I148-Q152 HydrophobicContact CG2-CG 4.46Å; I148-Q152 WeakPolarHBondContact O-CB 3.4Å; I148-Q152 VanDerWaalsContact O-CG 3.24Å; I148-Q152 WeakPolarHBondContact O-CG 3.47Å; I148-Q152 PolarHBondContact O-N 2.76Å; Q149-Q152 PolarHBondContact O-N 2.99Å; Q152-G154 VanDerWaalsContact C-N 3.34Å; Q152-G154 PolarHBondContact O-N 3.38Å; Q152-N155 PolarHBondContact O-N 2.96Å; Q152-E156 WeakPolarHBondContact O-CB 3.42Å; Q152-E156 PolarHBondContact O-N 2.58Å
153F95.8Very high96.4Very high136 Ų136104.6 Ų104.660%0.59653%0.53SS*.Hα-helixtrans-64.4-36.9176.5-176.1-110.7000112.6Q149 E150 K157Q149-F153 PolarHBondContact O-N 3.28Å; E150-F153 PolarHBondContact O-N 3.35Å; F153-K157 VanDerWaalsContact O-CB 3.29Å; F153-K157 WeakPolarHBondContact O-CB 3.47Å; F153-K157 PolarHBondContact O-N 3.32Å
154G96.3Very high96.5Very high30 Ų30107.7 Ų107.731%0.30953%0.534SS..Hα-helixtrans-61-47.8172.300000112.4E150 L151 Q152 K157 V158E150-G154 PolarHBondContact O-N 3.2Å; L151-G154 PolarHBondContact O-N 3.11Å; Q152-G154 VanDerWaalsContact C-N 3.34Å; Q152-G154 PolarHBondContact O-N 3.38Å; G154-K157 PolarHBondContact O-N 3.45Å; G154-V158 WeakPolarHBondContact O-CG2 3.18Å; G154-V158 PolarHBondContact O-N 3.36Å
155N95.7Very high96.4Very high104 Ų104103.9 Ų103.956%0.55653%0.525SS*.Hα-helixtrans-64.8-40.3177.6-74.1-24.8000112.4L151 Q152 V158 S159L151-N155 WeakPolarHBondContact O-CB 3.4Å; L151-N155 PolarHBondContact O-N 3.1Å; L151-N155 PolarHBondContact O-ND2 3.1Å; Q152-N155 PolarHBondContact O-N 2.96Å; N155-V158 PolarHBondContact O-N 3.18Å; N155-S159 VanDerWaalsContact O-CB 3.31Å; N155-S159 WeakPolarHBondContact O-CB 3.33Å; N155-S159 PolarHBondContact O-N 3.18Å; N155-S159 PolarHBondContact O-OG 3.43Å
156E96.8Very high96.5Very high118 Ų118100.2 Ų100.255%0.55152%0.516SS*.Hα-helixtrans-60.8-49.4174.3-177.4174.4-153.600110.9Q152 V158 S159 L160Q152-E156 WeakPolarHBondContact O-CB 3.42Å; Q152-E156 PolarHBondContact O-N 2.58Å; E156-V158 VanDerWaalsContact C-N 3.31Å; E156-V158 PolarHBondContact O-N 3.47Å; E156-S159 PolarHBondContact O-N 2.91Å; E156-S159 VanDerWaalsContact O-N 3.1Å; E156-L160 HydrophobicContact CG-CD1 4.38Å; E156-L160 WeakPolarHBondContact O-CG 3.46Å; E156-L160 PolarHBondContact O-N 3.12Å
157K96.6Very high96.5Very high126 Ų12699 Ų9955%0.54851%0.512SS..Hα-helixtrans-61.6-35177.6-174.5175.2-177.4175.70113.5F153 G154 K161F153-K157 VanDerWaalsContact O-CB 3.29Å; F153-K157 WeakPolarHBondContact O-CB 3.47Å; F153-K157 PolarHBondContact O-N 3.32Å; G154-K157 PolarHBondContact O-N 3.45Å; K157-K161 WeakPolarHBondContact O-CG 3.33Å; K157-K161 PolarHBondContact O-N 3.17Å
158V97.7Very high96.6Very high95 Ų95102.9 Ų102.958%0.57652%0.522SS*.Hα-helixtrans-73.9-37.6173.6170.70000111.2G154 N155 E156 K161 L162G154-V158 WeakPolarHBondContact O-CG2 3.18Å; G154-V158 PolarHBondContact O-N 3.36Å; N155-V158 PolarHBondContact O-N 3.18Å; E156-V158 VanDerWaalsContact C-N 3.31Å; E156-V158 PolarHBondContact O-N 3.47Å; V158-K161 PolarHBondContact O-N 2.92Å; V158-L162 WeakPolarHBondContact O-CB 3.47Å; V158-L162 PolarHBondContact O-N 3.47Å
159S96.1Very high96.6Very high72 Ų72102.8 Ų102.850%0.50352%0.522SS..Hα-helixtrans-66.9-40.5178.6-57.80000112.2N155 E156 L162 E163N155-S159 VanDerWaalsContact O-CB 3.31Å; N155-S159 WeakPolarHBondContact O-CB 3.33Å; N155-S159 PolarHBondContact O-N 3.18Å; N155-S159 PolarHBondContact O-OG 3.43Å; E156-S159 PolarHBondContact O-N 2.91Å; E156-S159 VanDerWaalsContact O-N 3.1Å; S159-L162 WeakPolarHBondContact O-CB 3.29Å; S159-L162 PolarHBondContact O-N 3.31Å; S159-E163 PolarHBondContact O-N 3.39Å
160L96.6Very high96.7Very high106 Ų106101.6 Ų101.656%0.55552%0.515SS*.Hα-helixtrans-59.6-49.5173-71.3170.5000111E156 L162 E163 E164E156-L160 HydrophobicContact CG-CD1 4.38Å; E156-L160 WeakPolarHBondContact O-CG 3.46Å; E156-L160 PolarHBondContact O-N 3.12Å; L160-L162 PolarHBondContact O-N 3.06Å; L160-E163 PolarHBondContact O-N 2.91Å; L160-E164 WeakPolarHBondContact O-CG 3.36Å; L160-E164 PolarHBondContact O-N 3.41Å
161K97.4Very high96.7Very high139 Ų13998.1 Ų98.160%0.60450%0.501SS*.Hα-helixtrans-60.9-31.6175-76.8-169.5167.2-1470114K157 V158 G165K157-K161 WeakPolarHBondContact O-CG 3.33Å; K157-K161 PolarHBondContact O-N 3.17Å; V158-K161 PolarHBondContact O-N 2.92Å; K161-G165 PolarHBondContact O-N 3.01Å
162L97Very high96.8Very high110 Ų11097 Ų9758%0.57650%0.495SS*.Hα-helixtrans-70.4-43.5176.4-178.559.6000111.1V158 S159 L160 G165 I166V158-L162 WeakPolarHBondContact O-CB 3.47Å; V158-L162 PolarHBondContact O-N 3.47Å; S159-L162 WeakPolarHBondContact O-CB 3.29Å; S159-L162 PolarHBondContact O-N 3.31Å; L160-L162 PolarHBondContact O-N 3.06Å; L162-G165 PolarHBondContact O-N 3.26Å; L162-I166 HydrophobicContact CD1-CD1 3.99Å; L162-I166 HydrophobicContact CD1-CG1 4.32Å; L162-I166 HydrophobicContact CG-CD1 3.85Å; L162-I166 VanDerWaalsContact O-CB 3.24Å; L162-I166 WeakPolarHBondContact O-CB 3.47Å; L162-I166 WeakPolarHBondContact O-CD1 3.41Å; L162-I166 WeakPolarHBondContact O-CG1 3.47Å; L162-I166 PolarHBondContact O-N 2.89Å
163E96.8Very high96.8Very high102 Ų10295.2 Ų95.248%0.47749%0.489SS..Hα-helixtrans-69.6-36.8174.9-169.659.6-136.400112S159 L160 I166 Q167 K170S159-E163 PolarHBondContact O-N 3.39Å; L160-E163 PolarHBondContact O-N 2.91Å; E163-I166 PolarHBondContact O-N 3.37Å; E163-Q167 WeakPolarHBondContact O-CB 3.49Å; E163-Q167 PolarHBondContact O-N 3.45Å; E163-K170 IonicContact OE1-NZ 2.68Å; E163-K170 PolarHBondContact OE1-NZ 2.89Å
164E97Very high96.9Very high126 Ų12695.4 Ų95.459%0.58949%0.49SS*.Hα-helixtrans-54.4-53.9170.5-74.4169.8173.700111L160 I166 Q167 E168L160-E164 WeakPolarHBondContact O-CG 3.36Å; L160-E164 PolarHBondContact O-N 3.41Å; E164-I166 PolarHBondContact O-N 2.91Å; E164-Q167 PolarHBondContact O-N 3.44Å; E164-E168 PolarHBondContact O-N 3Å
165G96.6Very high97Very high34 Ų3499.9 Ų99.935%0.35150%0.502SS..Hα-helixtrans-68.5-30.8178.700000114K161 L162 N169K161-G165 PolarHBondContact O-N 3.01Å; L162-G165 PolarHBondContact O-N 3.26Å; G165-N169 VanDerWaalsContact O-CB 3.25Å; G165-N169 WeakPolarHBondContact O-CB 3.5Å; G165-N169 PolarHBondContact O-N 3.35Å
166I96.8Very high97.1Very high70 Ų7099.1 Ų99.136%0.35950%0.498SS..Hα-helixtrans-66.2-39.8171.2-79.7168.7000110.4L162 E163 E164 K170L162-I166 HydrophobicContact CD1-CD1 3.99Å; L162-I166 HydrophobicContact CD1-CG1 4.32Å; L162-I166 HydrophobicContact CG-CD1 3.85Å; L162-I166 VanDerWaalsContact O-CB 3.24Å; L162-I166 WeakPolarHBondContact O-CB 3.47Å; L162-I166 WeakPolarHBondContact O-CD1 3.41Å; L162-I166 WeakPolarHBondContact O-CG1 3.47Å; L162-I166 PolarHBondContact O-N 2.89Å; E163-I166 PolarHBondContact O-N 3.37Å; E164-I166 PolarHBondContact O-N 2.91Å; I166-K170 WeakPolarHBondContact O-CE 3.47Å; I166-K170 WeakPolarHBondContact O-CG 3.45Å; I166-K170 PolarHBondContact O-N 2.81Å
167Q96.9Very high97.1Very high79 Ų7997.2 Ų97.237%0.36949%0.492SS..Hα-helixtrans-71.2-45.6176.8-175.155.742.600112.1E163 E164 N169 K170 D171E163-Q167 WeakPolarHBondContact O-CB 3.49Å; E163-Q167 PolarHBondContact O-N 3.45Å; E164-Q167 PolarHBondContact O-N 3.44Å; Q167-N169 VanDerWaalsContact C-N 3.26Å; Q167-N169 PolarHBondContact O-N 3.06Å; Q167-K170 WeakPolarHBondContact O-CB 3.5Å; Q167-K170 PolarHBondContact O-N 3.34Å; Q167-K170 VanDerWaalsContact O-N 3.08Å; Q167-D171 PolarHBondContact NE2-OD2 2.93Å; Q167-D171 PolarHBondContact O-N 2.92Å
168E97.4Very high97.2Very high128 Ų12894.1 Ų94.160%0.59849%0.49SS*.Hα-helixtrans-53.9-45.3173-175.1-177.8-174.200110.9E164 K170 D171 L172E164-E168 PolarHBondContact O-N 3Å; E168-K170 PolarHBondContact O-N 2.9Å; E168-D171 PolarHBondContact O-N 3.35Å; E168-L172 HydrophobicContact CG-CD1 4Å; E168-L172 HydrophobicContact CG-CG 4.42Å; E168-L172 WeakPolarHBondContact O-CB 3.32Å; E168-L172 WeakPolarHBondContact O-CG 3.07Å; E168-L172 PolarHBondContact O-N 3.13Å
169N97.3Very high97.2Very high91 Ų9192.8 Ų92.849%0.48748%0.482SS..Hα-helixtrans-64.9-38.5176.8-170.221.5000113G165 Q167 D171 L172 I173G165-N169 VanDerWaalsContact O-CB 3.25Å; G165-N169 WeakPolarHBondContact O-CB 3.5Å; G165-N169 PolarHBondContact O-N 3.35Å; Q167-N169 VanDerWaalsContact C-N 3.26Å; Q167-N169 PolarHBondContact O-N 3.06Å; N169-D171 VanDerWaalsContact C-N 3.31Å; N169-D171 PolarHBondContact O-N 2.88Å; N169-L172 PolarHBondContact O-N 3.46Å; N169-I173 WeakPolarHBondContact O-CB 3.3Å; N169-I173 WeakPolarHBondContact O-CD1 3.42Å; N169-I173 WeakPolarHBondContact O-CG1 3.24Å; N169-I173 PolarHBondContact O-N 3.01Å
170K97.7Very high97.2Very high93 Ų9394.7 Ų94.740%0.40448%0.478SS..Hα-helixtrans-58-44.6172.6-72168.7-129.8157.90111E163 I166 Q167 E168 K174E163-K170 IonicContact OE1-NZ 2.68Å; E163-K170 PolarHBondContact OE1-NZ 2.89Å; I166-K170 WeakPolarHBondContact O-CE 3.47Å; I166-K170 WeakPolarHBondContact O-CG 3.45Å; I166-K170 PolarHBondContact O-N 2.81Å; Q167-K170 WeakPolarHBondContact O-CB 3.5Å; Q167-K170 PolarHBondContact O-N 3.34Å; Q167-K170 VanDerWaalsContact O-N 3.08Å; E168-K170 PolarHBondContact O-N 2.9Å; K170-K174 WeakPolarHBondContact O-CB 3.25Å; K170-K174 PolarHBondContact O-N 3.43Å; K170-K174 VanDerWaalsContact O-N 3.07Å
171D96.6Very high97.3Very high69 Ų6995.4 Ų95.437%0.36948%0.478SS..Hα-helixtrans-74.6-38-178.6-74.8-52.5000112.7Q167 E168 N169 I173 K174 E175Q167-D171 PolarHBondContact NE2-OD2 2.93Å; Q167-D171 PolarHBondContact O-N 2.92Å; E168-D171 PolarHBondContact O-N 3.35Å; N169-D171 VanDerWaalsContact C-N 3.31Å; N169-D171 PolarHBondContact O-N 2.88Å; D171-I173 VanDerWaalsContact C-N 3.34Å; D171-I173 PolarHBondContact O-N 2.69Å; D171-K174 WeakPolarHBondContact O-CB 3.48Å; D171-K174 PolarHBondContact O-N 2.69Å; D171-K174 IonicContact OD1-NZ 3.44Å; D171-E175 PolarHBondContact O-N 3.49Å
172L97.4Very high97.3Very high88 Ų8893.4 Ų93.446%0.46147%0.474SS..Hα-helixtrans-61.9-38.5170.6-73.3171.7000112.4E168 N169 N176E168-L172 HydrophobicContact CG-CD1 4Å; E168-L172 HydrophobicContact CG-CG 4.42Å; E168-L172 WeakPolarHBondContact O-CB 3.32Å; E168-L172 WeakPolarHBondContact O-CG 3.07Å; E168-L172 PolarHBondContact O-N 3.13Å; N169-L172 PolarHBondContact O-N 3.46Å; L172-N176 WeakPolarHBondContact O-CB 3.45Å; L172-N176 PolarHBondContact O-N 3.03Å
173I97.4Very high97.3Very high83 Ų8390.8 Ų90.843%0.42646%0.464SS..Hα-helixtrans-64.3-43.1173.7-73165.4000110.5N169 D171 N177N169-I173 WeakPolarHBondContact O-CB 3.3Å; N169-I173 WeakPolarHBondContact O-CD1 3.42Å; N169-I173 WeakPolarHBondContact O-CG1 3.24Å; N169-I173 PolarHBondContact O-N 3.01Å; D171-I173 VanDerWaalsContact C-N 3.34Å; D171-I173 PolarHBondContact O-N 2.69Å; I173-N177 WeakPolarHBondContact O-CB 3.47Å; I173-N177 PolarHBondContact O-N 3.31Å; I173-N177 PolarHBondContact O-ND2 3.5Å
174K97.6Very high97.4Very high141 Ų14189.1 Ų89.161%0.61346%0.459SS*.Hα-helixtrans-63-44.3176.7174.1-176.3165.5-163.10111.9K170 D171 N177 A178K170-K174 WeakPolarHBondContact O-CB 3.25Å; K170-K174 PolarHBondContact O-N 3.43Å; K170-K174 VanDerWaalsContact O-N 3.07Å; D171-K174 WeakPolarHBondContact O-CB 3.48Å; D171-K174 PolarHBondContact O-N 2.69Å; D171-K174 IonicContact OD1-NZ 3.44Å; K174-N177 PolarHBondContact O-N 3.48Å; K174-A178 PolarHBondContact O-N 3.04Å
175E97.1Very high97.4Very high123 Ų12386.6 Ų86.658%0.57545%0.449SS*.Hα-helixtrans-63.1-50.7174.8-172.3-173.4163.700111.5D171 N177 A178 T179D171-E175 PolarHBondContact O-N 3.49Å; E175-N177 PolarHBondContact O-N 3.22Å; E175-A178 WeakPolarHBondContact O-CB 3.49Å; E175-A178 PolarHBondContact O-N 3.1Å; E175-T179 WeakPolarHBondContact O-CB 3.36Å; E175-T179 PolarHBondContact O-N 3.02Å; E175-T179 PolarHBondContact O-OG1 2.96Å
176N97.8Very high97.4Very high89 Ų8989.6 Ų89.648%0.47646%0.456SS..Hα-helixtrans-58.1-36177.5-175.74.8000111.9L172 R180L172-N176 WeakPolarHBondContact O-CB 3.45Å; L172-N176 PolarHBondContact O-N 3.03Å; N176-R180 PolarHBondContact ND2-NH2 3.07Å; N176-R180 VanDerWaalsContact O-CB 3.26Å; N176-R180 WeakPolarHBondContact O-CB 3.46Å; N176-R180 PolarHBondContact O-N 3.47Å; N176-R180 PolarHBondContact OD1-NH2 2.67Å
177N97.8Very high97.5Very high78 Ų7892.7 Ų92.742%0.41747%0.467SS..Hα-helixtrans-68.7-41.8173.7-70.3-20.2000112.6I173 K174 E175 R180 H181I173-N177 WeakPolarHBondContact O-CB 3.47Å; I173-N177 PolarHBondContact O-N 3.31Å; I173-N177 PolarHBondContact O-ND2 3.5Å; K174-N177 PolarHBondContact O-N 3.48Å; E175-N177 PolarHBondContact O-N 3.22Å; N177-R180 PolarHBondContact O-N 3.13Å; N177-R180 PolarHBondContact OD1-NH1 2.73Å; N177-H181 PolarHBondContact O-N 2.97Å
178A97.6Very high97.5Very high61 Ų6194.1 Ų94.150%0.50447%0.473SS..Hα-helixtrans-64.4-46174.600000111.9K174 E175 R180 H181 L182K174-A178 PolarHBondContact O-N 3.04Å; E175-A178 WeakPolarHBondContact O-CB 3.49Å; E175-A178 PolarHBondContact O-N 3.1Å; A178-R180 VanDerWaalsContact C-N 3.33Å; A178-R180 PolarHBondContact O-N 3.13Å; A178-H181 WeakPolarHBondContact O-CB 3.27Å; A178-H181 PolarHBondContact O-N 3.1Å; A178-H181 VanDerWaalsContact O-N 3.16Å; A178-L182 PolarHBondContact O-N 3.08Å
179T97.5Very high97.5Very high67 Ų6791.3 Ų91.341%0.41147%0.465SS..Hα-helixtrans-60.7-40.6175-65.20000111.5E175 H181 L182 C183E175-T179 WeakPolarHBondContact O-CB 3.36Å; E175-T179 PolarHBondContact O-N 3.02Å; E175-T179 PolarHBondContact O-OG1 2.96Å; T179-H181 PolarHBondContact O-N 3.49Å; T179-L182 PolarHBondContact O-N 3.38Å; T179-C183 WeakPolarHBondContact O-CB 3.3Å; T179-C183 PolarHBondContact O-N 3Å; T179-C183 PolarHBondContact O-SG 3.39Å
180R97.5Very high97.5Very high112 Ų11291 Ų9142%0.42347%0.469SS..Hα-helixtrans-64.9-37.9174.6-166.1178.7-50.8107.812.8112.7N176 N177 A178 C183 N184N176-R180 PolarHBondContact ND2-NH2 3.07Å; N176-R180 VanDerWaalsContact O-CB 3.26Å; N176-R180 WeakPolarHBondContact O-CB 3.46Å; N176-R180 PolarHBondContact O-N 3.47Å; N176-R180 PolarHBondContact OD1-NH2 2.67Å; N177-R180 PolarHBondContact O-N 3.13Å; N177-R180 PolarHBondContact OD1-NH1 2.73Å; A178-R180 VanDerWaalsContact C-N 3.33Å; A178-R180 PolarHBondContact O-N 3.13Å; R180-C183 PolarHBondContact O-N 3.33Å; R180-N184 PolarHBondContact O-N 3.01Å; R180-N184 VanDerWaalsContact O-N 3.08Å
181H97.8Very high97.4Very high121 Ų12189.5 Ų89.556%0.5647%0.474SS*.Hα-helixtrans-64.7-45173.7-179.950.7000111.5N177 A178 T179 C183 N184 L185N177-H181 PolarHBondContact O-N 2.97Å; A178-H181 WeakPolarHBondContact O-CB 3.27Å; A178-H181 PolarHBondContact O-N 3.1Å; A178-H181 VanDerWaalsContact O-N 3.16Å; T179-H181 PolarHBondContact O-N 3.49Å; H181-C183 PolarHBondContact O-N 2.86Å; H181-N184 PolarHBondContact O-N 3.09Å; H181-N184 VanDerWaalsContact O-N 3.1Å; H181-L185 PolarHBondContact O-N 3.4Å
182L97.9Very high97.5Very high96 Ų9693.3 Ų93.350%0.50348%0.483SS..Hα-helixtrans-59.1-44.8173.4179.160.6000111.9A178 T179 N184 L185 L186A178-L182 PolarHBondContact O-N 3.08Å; T179-L182 PolarHBondContact O-N 3.38Å; L182-N184 PolarHBondContact O-N 3.1Å; L182-L185 PolarHBondContact O-N 2.85Å; L182-L186 HydrophobicContact CD1-CD1 4.31Å; L182-L186 HydrophobicContact CD1-CG 4.3Å; L182-L186 HydrophobicContact CG-CD1 4.08Å; L182-L186 WeakPolarHBondContact O-CB 3.37Å; L182-L186 VanDerWaalsContact O-CG 3.28Å; L182-L186 WeakPolarHBondContact O-CG 3.36Å; L182-L186 PolarHBondContact O-N 2.88Å
183C97.1Very high97.4Very high56 Ų5692.4 Ų92.438%0.37848%0.484SS..Hα-helixtrans-60.6-31.4175-70.50000113.1T179 R180 H181 K187T179-C183 WeakPolarHBondContact O-CB 3.3Å; T179-C183 PolarHBondContact O-N 3Å; T179-C183 PolarHBondContact O-SG 3.39Å; R180-C183 PolarHBondContact O-N 3.33Å; H181-C183 PolarHBondContact O-N 2.86Å; C183-K187 WeakPolarHBondContact O-CD 3.15Å; C183-K187 VanDerWaalsContact O-CG 3.22Å; C183-K187 WeakPolarHBondContact O-CG 3.04Å; C183-K187 PolarHBondContact O-N 2.85Å
184N97.8Very high97.4Very high67 Ų6791.4 Ų91.436%0.35849%0.488SS..Hα-helixtrans-75-45.5175.7-70.8-8.8000111.6R180 H181 L182 L186 K187 E188R180-N184 PolarHBondContact O-N 3.01Å; R180-N184 VanDerWaalsContact O-N 3.08Å; H181-N184 PolarHBondContact O-N 3.09Å; H181-N184 VanDerWaalsContact O-N 3.1Å; L182-N184 PolarHBondContact O-N 3.1Å; N184-L186 VanDerWaalsContact C-N 3.25Å; N184-L186 PolarHBondContact O-N 3.39Å; N184-K187 WeakPolarHBondContact O-CB 3.41Å; N184-K187 PolarHBondContact O-N 3.35Å; N184-K187 VanDerWaalsContact O-N 3.07Å; N184-E188 WeakPolarHBondContact O-CG 3.47Å; N184-E188 PolarHBondContact O-N 2.77Å
185L97.8Very high97.4Very high73 Ų7391.4 Ų91.438%0.38249%0.491SS..Hα-helixtrans-56.5-39.3172.3-72.1167.9000112.3H181 L182 T189H181-L185 PolarHBondContact O-N 3.4Å; L182-L185 PolarHBondContact O-N 2.85Å; L185-T189 VanDerWaalsContact O-CB 3.31Å; L185-T189 WeakPolarHBondContact O-CB 3.4Å; L185-T189 PolarHBondContact O-N 2.86Å; L185-T189 PolarHBondContact O-OG1 2.75Å
186L97.3Very high97.4Very high96 Ų9691.3 Ų91.350%0.50349%0.488SS..Hα-helixtrans-65.9-45.7173.7-71.6171000111.5L182 N184 E188 T189 C190L182-L186 HydrophobicContact CD1-CD1 4.31Å; L182-L186 HydrophobicContact CD1-CG 4.3Å; L182-L186 HydrophobicContact CG-CD1 4.08Å; L182-L186 WeakPolarHBondContact O-CB 3.37Å; L182-L186 VanDerWaalsContact O-CG 3.28Å; L182-L186 WeakPolarHBondContact O-CG 3.36Å; L182-L186 PolarHBondContact O-N 2.88Å; N184-L186 VanDerWaalsContact C-N 3.25Å; N184-L186 PolarHBondContact O-N 3.39Å; L186-E188 PolarHBondContact O-N 3.19Å; L186-T189 PolarHBondContact O-N 2.9Å; L186-C190 WeakPolarHBondContact O-CB 3.37Å; L186-C190 PolarHBondContact O-N 3.25Å; L186-C190 PolarHBondContact O-SG 3.35Å
187K97.8Very high97.3Very high136 Ų13690.4 Ų90.459%0.59149%0.486SS*.Hα-helixtrans-59.4-45.8175.2-75.3165.8-173.9171.60112.5C183 N184 T189 C190 A191C183-K187 WeakPolarHBondContact O-CD 3.15Å; C183-K187 VanDerWaalsContact O-CG 3.22Å; C183-K187 WeakPolarHBondContact O-CG 3.04Å; C183-K187 PolarHBondContact O-N 2.85Å; N184-K187 WeakPolarHBondContact O-CB 3.41Å; N184-K187 PolarHBondContact O-N 3.35Å; N184-K187 VanDerWaalsContact O-N 3.07Å; K187-T189 VanDerWaalsContact C-N 3.26Å; K187-T189 PolarHBondContact O-N 2.7Å; K187-C190 PolarHBondContact O-N 2.93Å; K187-A191 WeakPolarHBondContact O-CB 3.29Å; K187-A191 PolarHBondContact O-N 2.95Å
188E97.9Very high97.3Very high108 Ų10894.3 Ų94.351%0.50550%0.5SS..Hα-helixtrans-62.3-34.5176.5-71.7166.6-151.800112N184 L186 R192N184-E188 WeakPolarHBondContact O-CG 3.47Å; N184-E188 PolarHBondContact O-N 2.77Å; L186-E188 PolarHBondContact O-N 3.19Å; E188-R192 WeakPolarHBondContact O-CB 3.5Å; E188-R192 VanDerWaalsContact O-CG 3.28Å; E188-R192 WeakPolarHBondContact O-CG 3.43Å; E188-R192 PolarHBondContact O-N 2.84Å; E188-R192 VanDerWaalsContact O-N 3.09Å; E188-R192 PolarHBondContact O-NE 3.42Å; E188-R192 VanDerWaalsContact O-NE 3.1Å
189T97.3Very high97.3Very high69 Ų6997.3 Ų97.342%0.42350%0.501SS..Hα-helixtrans-75.3-40.2176.6-57.20000111.6L185 L186 K187 R192 S193L185-T189 VanDerWaalsContact O-CB 3.31Å; L185-T189 WeakPolarHBondContact O-CB 3.4Å; L185-T189 PolarHBondContact O-N 2.86Å; L185-T189 PolarHBondContact O-OG1 2.75Å; L186-T189 PolarHBondContact O-N 2.9Å; K187-T189 VanDerWaalsContact C-N 3.26Å; K187-T189 PolarHBondContact O-N 2.7Å; T189-R192 PolarHBondContact OG1-NH2 3.42Å; T189-S193 WeakPolarHBondContact O-CB 3.27Å; T189-S193 PolarHBondContact O-N 3.13Å
190C96.1Very high97.3Very high85 Ų85100.2 Ų100.257%0.57451%0.506SS*.Hα-helixtrans-62.9-39.9171-69.50000112.3L186 K187 S193 A194L186-C190 WeakPolarHBondContact O-CB 3.37Å; L186-C190 PolarHBondContact O-N 3.25Å; L186-C190 PolarHBondContact O-SG 3.35Å; K187-C190 PolarHBondContact O-N 2.93Å; C190-S193 PolarHBondContact O-N 3.47Å; C190-A194 WeakPolarHBondContact O-CB 3.36Å; C190-A194 PolarHBondContact O-N 2.82Å
191A97.5Very high97.2Very high61 Ų6199.4 Ų99.450%0.50451%0.507SS..Hα-helixtrans-64.2-52.6177.600000111.6K187 S193 A194 E195K187-A191 WeakPolarHBondContact O-CB 3.29Å; K187-A191 PolarHBondContact O-N 2.95Å; A191-S193 VanDerWaalsContact C-N 3.26Å; A191-S193 PolarHBondContact O-N 3.2Å; A191-A194 PolarHBondContact O-N 3.38Å; A191-E195 WeakPolarHBondContact O-CB 2.99Å; A191-E195 PolarHBondContact O-N 2.92Å
192R97.3Very high97.1Very high150 Ų150101 Ų10157%0.56651%0.509SS*.Hα-helixtrans-59.3-36.9174.9-70.5177.9-63.61632112.3E188 T189 K196E188-R192 WeakPolarHBondContact O-CB 3.5Å; E188-R192 VanDerWaalsContact O-CG 3.28Å; E188-R192 WeakPolarHBondContact O-CG 3.43Å; E188-R192 PolarHBondContact O-N 2.84Å; E188-R192 VanDerWaalsContact O-N 3.09Å; E188-R192 PolarHBondContact O-NE 3.42Å; E188-R192 VanDerWaalsContact O-NE 3.1Å; T189-R192 PolarHBondContact OG1-NH2 3.42Å; R192-K196 WeakPolarHBondContact O-CB 3.5Å; R192-K196 PolarHBondContact O-N 3.31Å
193S96.6Very high97.1Very high68 Ų68100 Ų10048%0.47650%0.501SS..Hα-helixtrans-65.1-49.5175.1-170.40000111.5T189 C190 A191 E195 K196 T197T189-S193 WeakPolarHBondContact O-CB 3.27Å; T189-S193 PolarHBondContact O-N 3.13Å; C190-S193 PolarHBondContact O-N 3.47Å; A191-S193 VanDerWaalsContact C-N 3.26Å; A191-S193 PolarHBondContact O-N 3.2Å; S193-E195 PolarHBondContact O-N 3.09Å; S193-K196 PolarHBondContact O-N 3.27Å; S193-T197 PolarHBondContact O-N 3.32Å; S193-T197 PolarHBondContact O-OG1 3.33Å; S193-T197 VanDerWaalsContact O-OG1 3.14Å
194A96.7Very high97Very high62 Ų62102.4 Ų102.451%0.51250%0.502SS..Hα-helixtrans-63.9-38.5179.500000112.9C190 A191 K198C190-A194 WeakPolarHBondContact O-CB 3.36Å; C190-A194 PolarHBondContact O-N 2.82Å; A191-A194 PolarHBondContact O-N 3.38Å; A194-K198 WeakPolarHBondContact O-CB 3.27Å; A194-K198 PolarHBondContact O-N 2.9Å
195E96.9Very high96.8Very high141 Ų141104.1 Ų104.166%0.65951%0.508SS*.Hα-helixtrans-62.6-47.7172.3-179.3175-149.200111.4A191 S193 T197 K198 K199A191-E195 WeakPolarHBondContact O-CB 2.99Å; A191-E195 PolarHBondContact O-N 2.92Å; S193-E195 PolarHBondContact O-N 3.09Å; E195-T197 PolarHBondContact O-N 3.1Å; E195-K198 PolarHBondContact O-N 2.62Å; E195-K199 PolarHBondContact O-N 2.95Å
196K97.8Very high96.7Very high121 Ų121105.6 Ų105.653%0.52651%0.513SS..Hα-helixtrans-62.3-41.7177.1-173.7173.7-177.4179.40112.2R192 S193 K199 Y200R192-K196 WeakPolarHBondContact O-CB 3.5Å; R192-K196 PolarHBondContact O-N 3.31Å; S193-K196 PolarHBondContact O-N 3.27Å; K196-K199 PolarHBondContact O-N 3.41Å; K196-Y200 HydrophobicContact CD-CE2 4.15Å; K196-Y200 WeakPolarHBondContact CE-OH 3.32Å; K196-Y200 HydrophobicContact CG-CD2 4.15Å; K196-Y200 HydrophobicContact CG-CE2 3.62Å; K196-Y200 WeakPolarHBondContact O-CD2 3.3Å; K196-Y200 PolarHBondContact O-N 2.85Å
197T96.4Very high96.5Very high71 Ų71104.7 Ų104.744%0.43651%0.512SS..Hα-helixtrans-59.5-52.7171.4-63.20000110.6S193 E195 K199 Y200 E201S193-T197 PolarHBondContact O-N 3.32Å; S193-T197 PolarHBondContact O-OG1 3.33Å; S193-T197 VanDerWaalsContact O-OG1 3.14Å; E195-T197 PolarHBondContact O-N 3.1Å; T197-K199 VanDerWaalsContact C-N 3.26Å; T197-K199 PolarHBondContact O-N 3.3Å; T197-Y200 PolarHBondContact O-N 2.93Å; T197-Y200 VanDerWaalsContact O-N 3.08Å; T197-E201 HydrophobicContact CG2-CG 4.22Å; T197-E201 WeakPolarHBondContact O-CG 3.32Å; T197-E201 PolarHBondContact O-N 3.03Å
198K97.4Very high96.4Very high160 Ų160103.6 Ų103.670%0.69650%0.504SS*.Hα-helixtrans-56.9-39.8179.5-175.2-172.5175-167.70112.1A194 E195 E201 Y202A194-K198 WeakPolarHBondContact O-CB 3.27Å; A194-K198 PolarHBondContact O-N 2.9Å; E195-K198 PolarHBondContact O-N 2.62Å; K198-E201 PolarHBondContact O-N 2.61Å; K198-Y202 PolarHBondContact O-N 2.94Å
199K97.6Very high96.2Very high124 Ų124103 Ų10354%0.53950%0.501SS..Hα-helixtrans-60.5-51.4173.8175.9170.6172171.10111.4E195 K196 T197 E201 Y202 E203E195-K199 PolarHBondContact O-N 2.95Å; K196-K199 PolarHBondContact O-N 3.41Å; T197-K199 VanDerWaalsContact C-N 3.26Å; T197-K199 PolarHBondContact O-N 3.3Å; K199-E201 VanDerWaalsContact C-N 3.28Å; K199-E201 PolarHBondContact O-N 3.1Å; K199-Y202 WeakPolarHBondContact O-CB 3.48Å; K199-Y202 PolarHBondContact O-N 2.82Å; K199-Y202 VanDerWaalsContact O-N 3.11Å; K199-E203 WeakPolarHBondContact CE-OE1 3.45Å; K199-E203 HydrophobicContact CG-CG 4.35Å; K199-E203 IonicContact NZ-OE1 2.61Å; K199-E203 PolarHBondContact NZ-OE1 2.88Å; K199-E203 WeakPolarHBondContact O-CG 3.46Å; K199-E203 PolarHBondContact O-N 3.3Å
200Y96.4Very high96.2Very high128 Ų128104.3 Ų104.350%0.50251%0.509SS..Hα-helixtrans-62.9-32177.1-66.1-36000113.4K196 T197 E203 R204K196-Y200 HydrophobicContact CD-CE2 4.15Å; K196-Y200 WeakPolarHBondContact CE-OH 3.32Å; K196-Y200 HydrophobicContact CG-CD2 4.15Å; K196-Y200 HydrophobicContact CG-CE2 3.62Å; K196-Y200 WeakPolarHBondContact O-CD2 3.3Å; K196-Y200 PolarHBondContact O-N 2.85Å; T197-Y200 PolarHBondContact O-N 2.93Å; T197-Y200 VanDerWaalsContact O-N 3.08Å; Y200-E203 WeakPolarHBondContact CD1-OE2 3.4Å; Y200-R204 WeakPolarHBondContact O-CB 3.43Å; Y200-R204 PolarHBondContact O-N 3.05Å; Y200-R204 VanDerWaalsContact O-N 3.1Å
201E95.9Very high96.1Very high95 Ų95108.1 Ų108.144%0.44451%0.512SS..Hα-helixtrans-69.1-35.3174.1-63.3-147107.100112.3T197 K198 K199 R204 E205T197-E201 HydrophobicContact CG2-CG 4.22Å; T197-E201 WeakPolarHBondContact O-CG 3.32Å; T197-E201 PolarHBondContact O-N 3.03Å; K198-E201 PolarHBondContact O-N 2.61Å; K199-E201 VanDerWaalsContact C-N 3.28Å; K199-E201 PolarHBondContact O-N 3.1Å; E201-R204 IonicContact OE1-CZ 3.71Å; E201-R204 IonicContact OE1-NH1 2.92Å; E201-R204 PolarHBondContact OE1-NH1 2.8Å; E201-R204 IonicContact OE1-NH2 3.63Å; E201-R204 PolarHBondContact OE1-NH2 2.82Å; E201-E205 PolarHBondContact O-N 2.92Å
202Y96.6Very high96Very high155 Ų155110.5 Ų110.561%0.60851%0.514SS*.Hα-helixtrans-69.2-52.7174.1-174.8-82.9000111.8K198 K199 R204 E205 E206K198-Y202 PolarHBondContact O-N 2.94Å; K199-Y202 WeakPolarHBondContact O-CB 3.48Å; K199-Y202 PolarHBondContact O-N 2.82Å; K199-Y202 VanDerWaalsContact O-N 3.11Å; Y202-R204 PolarHBondContact O-N 3.2Å; Y202-E205 PolarHBondContact O-N 3.16Å; Y202-E206 HydrophobicContact CE1-CB 4.41Å; Y202-E206 WeakPolarHBondContact O-CB 3.46Å; Y202-E206 PolarHBondContact O-N 2.87Å
203E96.3Very high95.9Very high73 Ų73107 Ų10734%0.34151%0.507SS..Hα-helixtrans-57.1-37.5178.8-69.9172.9147.600111.6K199 Y200 T207K199-E203 WeakPolarHBondContact CE-OE1 3.45Å; K199-E203 HydrophobicContact CG-CG 4.35Å; K199-E203 IonicContact NZ-OE1 2.61Å; K199-E203 PolarHBondContact NZ-OE1 2.88Å; K199-E203 WeakPolarHBondContact O-CG 3.46Å; K199-E203 PolarHBondContact O-N 3.3Å; Y200-E203 WeakPolarHBondContact CD1-OE2 3.4Å; E203-T207 WeakPolarHBondContact O-CB 3.43Å; E203-T207 PolarHBondContact O-N 3.21Å; E203-T207 PolarHBondContact O-OG1 3.4Å
204R94.7Very high95.9Very high107 Ų107108 Ų10840%0.40451%0.507SS..Hα-helixtrans-66.8-34.3174.1-178.3-17267.6-161.4-5.2113Y200 E201 Y202 R208Y200-R204 WeakPolarHBondContact O-CB 3.43Å; Y200-R204 PolarHBondContact O-N 3.05Å; Y200-R204 VanDerWaalsContact O-N 3.1Å; E201-R204 IonicContact OE1-CZ 3.71Å; E201-R204 IonicContact OE1-NH1 2.92Å; E201-R204 PolarHBondContact OE1-NH1 2.8Å; E201-R204 IonicContact OE1-NH2 3.63Å; E201-R204 PolarHBondContact OE1-NH2 2.82Å; Y202-R204 PolarHBondContact O-N 3.2Å; R204-R208 WeakPolarHBondContact O-CG 3.49Å; R204-R208 PolarHBondContact O-N 3.3Å
205E95Very high95.9Very high103 Ų103108.8 Ų108.848%0.48150%0.502SS..Hα-helixtrans-81.1-37.3178.9-152.864.9-160.200111.9E201 Y202 T207 R208 Q209E201-E205 PolarHBondContact O-N 2.92Å; Y202-E205 PolarHBondContact O-N 3.16Å; E205-T207 VanDerWaalsContact C-N 3.33Å; E205-T207 PolarHBondContact O-N 3.3Å; E205-R208 WeakPolarHBondContact O-CB 3.31Å; E205-R208 PolarHBondContact O-N 2.78Å; E205-R208 VanDerWaalsContact O-N 3.12Å; E205-R208 WeakPolarHBondContact OE2-CD 3.39Å; E205-R208 IonicContact OE2-CZ 3.62Å; E205-R208 IonicContact OE2-NE 2.69Å; E205-R208 IonicContact OE2-NH1 2.71Å; E205-R208 PolarHBondContact OE2-NH1 3.22Å; E205-Q209 PolarHBondContact O-N 2.87Å
206E95.4Very high95.9Very high105 Ų105105.2 Ų105.249%0.49149%0.488SS..Hα-helixtrans-58.2-45.4168.7-178.7167.5-140.100110.8Y202 R208 Q209 V210Y202-E206 HydrophobicContact CE1-CB 4.41Å; Y202-E206 WeakPolarHBondContact O-CB 3.46Å; Y202-E206 PolarHBondContact O-N 2.87Å; E206-R208 VanDerWaalsContact C-N 3.32Å; E206-R208 PolarHBondContact O-N 2.87Å; E206-Q209 PolarHBondContact O-N 3.48Å; E206-V210 WeakPolarHBondContact O-CG2 3.25Å; E206-V210 PolarHBondContact O-N 3.16Å
207T93.4Very high95.9Very high76 Ų76104.3 Ų104.347%0.46649%0.488SS..Hα-helixtrans-58.5-41.1172.4-58.20000112.1E203 E205 V210 Y211E203-T207 WeakPolarHBondContact O-CB 3.43Å; E203-T207 PolarHBondContact O-N 3.21Å; E203-T207 PolarHBondContact O-OG1 3.4Å; E205-T207 VanDerWaalsContact C-N 3.33Å; E205-T207 PolarHBondContact O-N 3.3Å; T207-V210 PolarHBondContact O-N 3.39Å; T207-Y211 HydrophobicContact CG2-CD2 3.92Å; T207-Y211 HydrophobicContact CG2-CE2 3.73Å; T207-Y211 WeakPolarHBondContact O-CD2 3.43Å; T207-Y211 PolarHBondContact O-N 3.07Å
208R94.8Very high95.9Very high114 Ų114104.3 Ų104.343%0.4349%0.485SS..Hα-helixtrans-65.6-40.7175.3-76.1167.4-179.6152.90.3112.4R204 E205 E206 Y211 M212R204-R208 WeakPolarHBondContact O-CG 3.49Å; R204-R208 PolarHBondContact O-N 3.3Å; E205-R208 WeakPolarHBondContact O-CB 3.31Å; E205-R208 PolarHBondContact O-N 2.78Å; E205-R208 VanDerWaalsContact O-N 3.12Å; E205-R208 WeakPolarHBondContact OE2-CD 3.39Å; E205-R208 IonicContact OE2-CZ 3.62Å; E205-R208 IonicContact OE2-NE 2.69Å; E205-R208 IonicContact OE2-NH1 2.71Å; E205-R208 PolarHBondContact OE2-NH1 3.22Å; E206-R208 VanDerWaalsContact C-N 3.32Å; E206-R208 PolarHBondContact O-N 2.87Å; R208-Y211 PolarHBondContact O-N 3.49Å; R208-M212 WeakPolarHBondContact O-CG 3.36Å; R208-M212 PolarHBondContact O-N 2.86Å
209Q94.9Very high95.8Very high95 Ų95101.7 Ų101.744%0.44448%0.475SS..Hα-helixtrans-62-44.6177-175.357.749.500110.5E205 E206 Y211 M212 D213E205-Q209 PolarHBondContact O-N 2.87Å; E206-Q209 PolarHBondContact O-N 3.48Å; Q209-Y211 VanDerWaalsContact C-N 3.34Å; Q209-Y211 PolarHBondContact O-N 3.32Å; Q209-M212 PolarHBondContact O-N 2.91Å; Q209-M212 VanDerWaalsContact O-N 3.11Å; Q209-D213 PolarHBondContact NE2-OD1 2.99Å; Q209-D213 PolarHBondContact NE2-OD2 2.93Å; Q209-D213 PolarHBondContact O-N 2.66Å
210V95.9Very high95.8Very high97 Ų97102.7 Ų102.759%0.58848%0.479SS*.Hα-helixtrans-59.7-41.7173.7173.80000111.9E206 T207 D213 L214E206-V210 WeakPolarHBondContact O-CG2 3.25Å; E206-V210 PolarHBondContact O-N 3.16Å; T207-V210 PolarHBondContact O-N 3.39Å; V210-D213 PolarHBondContact O-N 3.31Å; V210-L214 VanDerWaalsContact O-CB 3.29Å; V210-L214 WeakPolarHBondContact O-CB 3.37Å; V210-L214 PolarHBondContact O-N 3.15Å
211Y94.1Very high95.8Very high164 Ų164101.3 Ų101.364%0.64348%0.479SS*.Hα-helixtrans-64.8-37.7173.2-84.1-64.4000113.2T207 R208 Q209 N215T207-Y211 HydrophobicContact CG2-CD2 3.92Å; T207-Y211 HydrophobicContact CG2-CE2 3.73Å; T207-Y211 WeakPolarHBondContact O-CD2 3.43Å; T207-Y211 PolarHBondContact O-N 3.07Å; R208-Y211 PolarHBondContact O-N 3.49Å; Q209-Y211 VanDerWaalsContact C-N 3.34Å; Q209-Y211 PolarHBondContact O-N 3.32Å; Y211-N215 WeakPolarHBondContact O-CB 3.33Å; Y211-N215 PolarHBondContact O-N 3.14Å
212M95.5Very high95.8Very high111 Ų111101.6 Ų101.655%0.54748%0.482SS..Hα-helixtrans-67.2-41.4175.4-74.7179.65900111.6R208 Q209 N215 N216R208-M212 WeakPolarHBondContact O-CG 3.36Å; R208-M212 PolarHBondContact O-N 2.86Å; Q209-M212 PolarHBondContact O-N 2.91Å; Q209-M212 VanDerWaalsContact O-N 3.11Å; M212-N215 PolarHBondContact O-N 3.37Å; M212-N216 WeakPolarHBondContact O-CB 3.46Å; M212-N216 PolarHBondContact O-N 2.91Å; M212-N216 PolarHBondContact O-ND2 3.47Å; M212-N216 VanDerWaalsContact O-ND2 3.13Å
213D96.2Very high95.8Very high78 Ų7897.8 Ų97.842%0.41748%0.475SS..Hα-helixtrans-72-34178.2-69.2-35000112.5Q209 V210 N216 N217Q209-D213 PolarHBondContact NE2-OD1 2.99Å; Q209-D213 PolarHBondContact NE2-OD2 2.93Å; Q209-D213 PolarHBondContact O-N 2.66Å; V210-D213 PolarHBondContact O-N 3.31Å; D213-N216 PolarHBondContact O-N 3.27Å; D213-N216 PolarHBondContact OD1-ND2 2.85Å; D213-N217 WeakPolarHBondContact O-CB 3.49Å; D213-N217 PolarHBondContact O-N 3.29Å
214L96.1Very high95.8Very high89 Ų8996.4 Ų96.447%0.46648%0.476SS..Hα-helixtrans-62.5-45.6167.8178.559.7000111.3V210 N217 I218V210-L214 VanDerWaalsContact O-CB 3.29Å; V210-L214 WeakPolarHBondContact O-CB 3.37Å; V210-L214 PolarHBondContact O-N 3.15Å; L214-N217 WeakPolarHBondContact O-CB 3.44Å; L214-N217 PolarHBondContact O-N 2.95Å; L214-I218 HydrophobicContact CD1-CD1 4.14Å; L214-I218 HydrophobicContact CD1-CG1 4.42Å; L214-I218 HydrophobicContact CG-CD1 3.99Å; L214-I218 WeakPolarHBondContact O-CG1 3.4Å; L214-I218 PolarHBondContact O-N 3.01Å
215N96.3Very high95.9Very high78 Ų7897.6 Ų97.642%0.41749%0.485SS..Hα-helixtrans-62.5-44.3175.5-174.791.1000111.6Y211 M212 N217 I218 E219Y211-N215 WeakPolarHBondContact O-CB 3.33Å; Y211-N215 PolarHBondContact O-N 3.14Å; M212-N215 PolarHBondContact O-N 3.37Å; N215-N217 PolarHBondContact O-N 3.43Å; N215-I218 PolarHBondContact O-N 3.38Å; N215-I218 VanDerWaalsContact O-N 3.17Å; N215-E219 PolarHBondContact ND2-OE1 3.33Å; N215-E219 WeakPolarHBondContact O-CG 3.28Å; N215-E219 PolarHBondContact O-N 3.27Å
216N97.6Very high96Very high66 Ų6696.4 Ų96.435%0.35348%0.479SS..Hα-helixtrans-59.4-33.6174.1-68.9-30.7000112.2M212 D213 K220M212-N216 WeakPolarHBondContact O-CB 3.46Å; M212-N216 PolarHBondContact O-N 2.91Å; M212-N216 PolarHBondContact O-ND2 3.47Å; M212-N216 VanDerWaalsContact O-ND2 3.13Å; D213-N216 PolarHBondContact O-N 3.27Å; D213-N216 PolarHBondContact OD1-ND2 2.85Å; N216-K220 WeakPolarHBondContact O-CD 3.36Å; N216-K220 VanDerWaalsContact O-CG 3.25Å; N216-K220 WeakPolarHBondContact O-CG 3.43Å; N216-K220 PolarHBondContact O-N 2.98Å
217N97.6Very high96Very high101 Ų10197.6 Ų97.654%0.5449%0.485SS..Hα-helixtrans-73.5-42.4175.2-163.919.3000111.5D213 L214 N215 E219 K220 M221D213-N217 WeakPolarHBondContact O-CB 3.49Å; D213-N217 PolarHBondContact O-N 3.29Å; L214-N217 WeakPolarHBondContact O-CB 3.44Å; L214-N217 PolarHBondContact O-N 2.95Å; N215-N217 PolarHBondContact O-N 3.43Å; N217-E219 PolarHBondContact O-N 3.01Å; N217-K220 PolarHBondContact O-N 2.79Å; N217-M221 WeakPolarHBondContact O-CB 3.31Å; N217-M221 PolarHBondContact O-N 2.64Å
218I96.4Very high96.2Very high71 Ų7198.8 Ų98.836%0.36449%0.488SS..Hα-helixtrans-61-43.4174.1-69.4164.9000110.8L214 N215 K220 M221 I222L214-I218 HydrophobicContact CD1-CD1 4.14Å; L214-I218 HydrophobicContact CD1-CG1 4.42Å; L214-I218 HydrophobicContact CG-CD1 3.99Å; L214-I218 WeakPolarHBondContact O-CG1 3.4Å; L214-I218 PolarHBondContact O-N 3.01Å; N215-I218 PolarHBondContact O-N 3.38Å; N215-I218 VanDerWaalsContact O-N 3.17Å; I218-K220 PolarHBondContact O-N 3.34Å; I218-M221 PolarHBondContact O-N 3.15Å; I218-I222 HydrophobicContact CG2-CD1 3.71Å; I218-I222 HydrophobicContact CG2-CG1 4.34Å; I218-I222 WeakPolarHBondContact O-CB 3.45Å; I218-I222 VanDerWaalsContact O-CG1 3.26Å; I218-I222 WeakPolarHBondContact O-CG1 3.37Å; I218-I222 PolarHBondContact O-N 2.88Å
219E95.6Very high96.3Very high105 Ų105101 Ų10149%0.49150%0.496SS..Hα-helixtrans-63.5-40.1176.2-74.9179.2-16700112.5N215 N217 T223N215-E219 PolarHBondContact ND2-OE1 3.33Å; N215-E219 WeakPolarHBondContact O-CG 3.28Å; N215-E219 PolarHBondContact O-N 3.27Å; N217-E219 PolarHBondContact O-N 3.01Å; E219-T223 WeakPolarHBondContact O-CB 3.28Å; E219-T223 PolarHBondContact O-N 3.46Å; E219-T223 PolarHBondContact O-OG1 3.33Å
220K96.7Very high96.4Very high145 Ų14599.7 Ų99.763%0.6350%0.495SS*.Hα-helixtrans-62.9-43.4171.8-73.1166.8-174173.80111.9N216 N217 I218 T223 A224N216-K220 WeakPolarHBondContact O-CD 3.36Å; N216-K220 VanDerWaalsContact O-CG 3.25Å; N216-K220 WeakPolarHBondContact O-CG 3.43Å; N216-K220 PolarHBondContact O-N 2.98Å; N217-K220 PolarHBondContact O-N 2.79Å; I218-K220 PolarHBondContact O-N 3.34Å; K220-T223 WeakPolarHBondContact O-CB 2.94Å; K220-T223 PolarHBondContact O-N 3.35Å; K220-A224 PolarHBondContact O-N 3.18Å
221M96.2Very high96.3Very high99 Ų99100.9 Ų100.949%0.48849%0.494SS..Hα-helixtrans-65.6-42.2179-174.7176.169.200111.7N217 I218 T223 A224 F225N217-M221 WeakPolarHBondContact O-CB 3.31Å; N217-M221 PolarHBondContact O-N 2.64Å; I218-M221 PolarHBondContact O-N 3.15Å; M221-T223 VanDerWaalsContact C-N 3.32Å; M221-T223 PolarHBondContact O-N 2.93Å; M221-A224 PolarHBondContact O-N 2.78Å; M221-F225 HydrophobicContact CG-CD2 3.79Å; M221-F225 HydrophobicContact CG-CE2 3.56Å; M221-F225 WeakPolarHBondContact O-CD2 3.33Å; M221-F225 PolarHBondContact O-N 3.44Å; M221-F225 HydrophobicContact SD-CE2 4.07Å
222I95.6Very high96.3Very high102 Ų10296 Ų9652%0.52349%0.487SS..Hα-helixtrans-59.9-43.8171.9-71166000110.4I218 F225 E226I218-I222 HydrophobicContact CG2-CD1 3.71Å; I218-I222 HydrophobicContact CG2-CG1 4.34Å; I218-I222 WeakPolarHBondContact O-CB 3.45Å; I218-I222 VanDerWaalsContact O-CG1 3.26Å; I218-I222 WeakPolarHBondContact O-CG1 3.37Å; I218-I222 PolarHBondContact O-N 2.88Å; I222-F225 PolarHBondContact O-N 3.17Å; I222-E226 WeakPolarHBondContact O-CB 3.44Å; I222-E226 PolarHBondContact O-N 3.42Å
223T96.7Very high96.2Very high74 Ų7494.4 Ų94.445%0.45448%0.479SS..Hα-helixtrans-62.1-45.6177.6-54.10000111.2E219 K220 M221 F225 E226 E227E219-T223 WeakPolarHBondContact O-CB 3.28Å; E219-T223 PolarHBondContact O-N 3.46Å; E219-T223 PolarHBondContact O-OG1 3.33Å; K220-T223 WeakPolarHBondContact O-CB 2.94Å; K220-T223 PolarHBondContact O-N 3.35Å; M221-T223 VanDerWaalsContact C-N 3.32Å; M221-T223 PolarHBondContact O-N 2.93Å; T223-F225 PolarHBondContact O-N 2.89Å; T223-E226 PolarHBondContact O-N 3.02Å; T223-E227 WeakPolarHBondContact O-CG 3.25Å; T223-E227 PolarHBondContact O-N 2.95Å
224A96.9Very high96.2Very high44 Ų4495.3 Ų95.336%0.36448%0.483SS..Hα-helixtrans-64.7-38.817700000112.8K220 M221 E227 L228K220-A224 PolarHBondContact O-N 3.18Å; M221-A224 PolarHBondContact O-N 2.78Å; A224-E227 PolarHBondContact O-N 3.4Å; A224-L228 WeakPolarHBondContact O-CB 3.3Å; A224-L228 VanDerWaalsContact O-CG 3.3Å; A224-L228 WeakPolarHBondContact O-CG 3.3Å; A224-L228 PolarHBondContact O-N 2.83Å
225F97.4Very high96.2Very high133 Ų13394.2 Ų94.258%0.58348%0.483SS*.Hα-helixtrans-66.7-36173-81.1-57.5000112.5M221 I222 T223 R229M221-F225 HydrophobicContact CG-CD2 3.79Å; M221-F225 HydrophobicContact CG-CE2 3.56Å; M221-F225 WeakPolarHBondContact O-CD2 3.33Å; M221-F225 PolarHBondContact O-N 3.44Å; M221-F225 HydrophobicContact SD-CE2 4.07Å; I222-F225 PolarHBondContact O-N 3.17Å; T223-F225 PolarHBondContact O-N 2.89Å; F225-R229 VanDerWaalsContact O-CB 3.3Å; F225-R229 WeakPolarHBondContact O-CB 3.32Å; F225-R229 PolarHBondContact O-N 3.04Å
226E96.3Very high96.2Very high77 Ų7796.3 Ų96.336%0.3649%0.485SS..Hα-helixtrans-67.7-42.8174-173.960.8-121.500111.6I222 T223 L228 R229 V230I222-E226 WeakPolarHBondContact O-CB 3.44Å; I222-E226 PolarHBondContact O-N 3.42Å; T223-E226 PolarHBondContact O-N 3.02Å; E226-L228 PolarHBondContact O-N 3.28Å; E226-R229 WeakPolarHBondContact O-CB 3.41Å; E226-R229 PolarHBondContact O-N 3.19Å; E226-R229 IonicContact OE1-CZ 2.78Å; E226-R229 IonicContact OE1-NE 3.75Å; E226-R229 PolarHBondContact OE1-NE 3.23Å; E226-R229 IonicContact OE1-NH2 3.83Å; E226-R229 PolarHBondContact OE1-NH2 3.35Å; E226-R229 IonicContact OE2-CZ 3.18Å; E226-R229 IonicContact OE2-NE 3.97Å; E226-R229 PolarHBondContact OE2-NE 2.91Å; E226-R229 IonicContact OE2-NH2 2.77Å; E226-R229 PolarHBondContact OE2-NH2 3.01Å; E226-V230 WeakPolarHBondContact O-CB 3.1Å; E226-V230 WeakPolarHBondContact O-CG2 3.45Å; E226-V230 PolarHBondContact O-N 2.9Å
227E96.6Very high96.1Very high130 Ų13097.1 Ų97.161%0.60749%0.489SS*.Hα-helixtrans-59.7-45.3173.7-74.4175.4179.300111.6T223 A224 V230 Q231T223-E227 WeakPolarHBondContact O-CG 3.25Å; T223-E227 PolarHBondContact O-N 2.95Å; A224-E227 PolarHBondContact O-N 3.4Å; E227-V230 PolarHBondContact O-N 2.9Å; E227-Q231 WeakPolarHBondContact O-CB 3.48Å; E227-Q231 PolarHBondContact O-N 3.46Å
228L97.4Very high96Very high101 Ų10197.5 Ų97.553%0.52949%0.488SS..Hα-helixtrans-63.2-40174.2-74.1170.3000112.3A224 E226 Q231 A232A224-L228 WeakPolarHBondContact O-CB 3.3Å; A224-L228 VanDerWaalsContact O-CG 3.3Å; A224-L228 WeakPolarHBondContact O-CG 3.3Å; A224-L228 PolarHBondContact O-N 2.83Å; E226-L228 PolarHBondContact O-N 3.28Å; L228-Q231 PolarHBondContact O-N 3.29Å; L228-A232 WeakPolarHBondContact O-CB 3.11Å; L228-A232 PolarHBondContact O-N 3.34Å
229R97Very high95.9Very high160 Ų16099.8 Ų99.860%0.60450%0.498SS*.Hα-helixtrans-62.4-46.2175.6-174.4178.577.9158.54.1111.3F225 E226 Q231 A232 E233F225-R229 VanDerWaalsContact O-CB 3.3Å; F225-R229 WeakPolarHBondContact O-CB 3.32Å; F225-R229 PolarHBondContact O-N 3.04Å; E226-R229 WeakPolarHBondContact O-CB 3.41Å; E226-R229 PolarHBondContact O-N 3.19Å; E226-R229 IonicContact OE1-CZ 2.78Å; E226-R229 IonicContact OE1-NE 3.75Å; E226-R229 PolarHBondContact OE1-NE 3.23Å; E226-R229 IonicContact OE1-NH2 3.83Å; E226-R229 PolarHBondContact OE1-NH2 3.35Å; E226-R229 IonicContact OE2-CZ 3.18Å; E226-R229 IonicContact OE2-NE 3.97Å; E226-R229 PolarHBondContact OE2-NE 2.91Å; E226-R229 IonicContact OE2-NH2 2.77Å; E226-R229 PolarHBondContact OE2-NH2 3.01Å; R229-Q231 VanDerWaalsContact C-N 3.35Å; R229-A232 PolarHBondContact O-N 3.05Å; R229-E233 WeakPolarHBondContact O-CB 3.47Å; R229-E233 PolarHBondContact O-N 3.02Å
230V95.6Very high95.7Very high69 Ų69100.1 Ų100.142%0.41850%0.499SS..Hα-helixtrans-64.3-39.3175.9169.40000111E226 E227 N234E226-V230 WeakPolarHBondContact O-CB 3.1Å; E226-V230 WeakPolarHBondContact O-CG2 3.45Å; E226-V230 PolarHBondContact O-N 2.9Å; E227-V230 PolarHBondContact O-N 2.9Å; V230-N234 WeakPolarHBondContact CG1-ND2 3.39Å; V230-N234 VanDerWaalsContact O-CB 3.26Å; V230-N234 WeakPolarHBondContact O-CB 3.41Å; V230-N234 PolarHBondContact O-N 3.05Å; V230-N234 PolarHBondContact O-ND2 2.73Å; V230-N234 VanDerWaalsContact O-ND2 3.09Å
231Q95.3Very high95.5Very high122 Ų12298.3 Ų98.357%0.5749%0.492SS*.Hα-helixtrans-64.9-43.1175.4-174.6178.3-1.700112.3E227 L228 R229 N234 S235E227-Q231 WeakPolarHBondContact O-CB 3.48Å; E227-Q231 PolarHBondContact O-N 3.46Å; L228-Q231 PolarHBondContact O-N 3.29Å; R229-Q231 VanDerWaalsContact C-N 3.35Å; Q231-N234 PolarHBondContact O-N 3.24Å; Q231-S235 WeakPolarHBondContact O-CB 3.44Å; Q231-S235 PolarHBondContact O-N 2.83Å; Q231-S235 PolarHBondContact O-OG 3Å
232A92.9Very high95.5Very high62 Ų6298.6 Ų98.651%0.51249%0.49SS..Hα-helixtrans-64.4-44.9176.500000111.7L228 R229 S235 R236L228-A232 WeakPolarHBondContact O-CB 3.11Å; L228-A232 PolarHBondContact O-N 3.34Å; R229-A232 PolarHBondContact O-N 3.05Å; A232-S235 WeakPolarHBondContact O-CB 2.75Å; A232-S235 PolarHBondContact O-N 3.46Å; A232-R236 PolarHBondContact O-N 2.95Å
233E94.8Very high95.4Very high77 Ų7799 Ų9936%0.3649%0.493SS..Hα-helixtrans-65.1-41.9176.7179.160-171.900112R229 S235 R236 L237R229-E233 WeakPolarHBondContact O-CB 3.47Å; R229-E233 PolarHBondContact O-N 3.02Å; E233-S235 VanDerWaalsContact C-N 3.3Å; E233-S235 PolarHBondContact O-N 2.81Å; E233-R236 WeakPolarHBondContact O-CB 3.13Å; E233-R236 PolarHBondContact O-N 3.45Å; E233-R236 IonicContact OE1-CZ 2.81Å; E233-R236 IonicContact OE1-NE 2.77Å; E233-R236 IonicContact OE1-NH2 3.13Å; E233-R236 PolarHBondContact OE1-NH2 3.4Å; E233-R236 IonicContact OE2-CZ 2.68Å; E233-R236 IonicContact OE2-NE 3.84Å; E233-R236 PolarHBondContact OE2-NE 2.78Å; E233-R236 IonicContact OE2-NH2 3.63Å; E233-R236 PolarHBondContact OE2-NH2 2.82Å; E233-L237 HydrophobicContact CG-CD1 4.17Å; E233-L237 WeakPolarHBondContact O-CB 3.49Å; E233-L237 VanDerWaalsContact O-CG 3.29Å; E233-L237 WeakPolarHBondContact O-CG 3.49Å; E233-L237 PolarHBondContact O-N 2.99Å
234N96.3Very high95.3Very high96 Ų96100.2 Ų100.251%0.51349%0.492SS..Hα-helixtrans-59.9-40.8172.4-75.7-30.1000111.8V230 Q231 L237 E238V230-N234 WeakPolarHBondContact CG1-ND2 3.39Å; V230-N234 VanDerWaalsContact O-CB 3.26Å; V230-N234 WeakPolarHBondContact O-CB 3.41Å; V230-N234 PolarHBondContact O-N 3.05Å; V230-N234 PolarHBondContact O-ND2 2.73Å; V230-N234 VanDerWaalsContact O-ND2 3.09Å; Q231-N234 PolarHBondContact O-N 3.24Å; N234-L237 PolarHBondContact O-N 2.79Å; N234-E238 PolarHBondContact O-N 3.49Å
235S95.8Very high95.2Very high67 Ų67102.1 Ų102.147%0.46949%0.493SS..Hα-helixtrans-65.9-38.9177-55.40000111.8Q231 A232 E233 E238 M239Q231-S235 WeakPolarHBondContact O-CB 3.44Å; Q231-S235 PolarHBondContact O-N 2.83Å; Q231-S235 PolarHBondContact O-OG 3Å; A232-S235 WeakPolarHBondContact O-CB 2.75Å; A232-S235 PolarHBondContact O-N 3.46Å; E233-S235 VanDerWaalsContact C-N 3.3Å; E233-S235 PolarHBondContact O-N 2.81Å; S235-E238 PolarHBondContact O-N 2.97Å; S235-M239 PolarHBondContact O-N 2.89Å
236R95.9Very high94.9Very high122 Ų12299.3 Ų99.346%0.4648%0.484SS..Hα-helixtrans-64.6-41.3173.7-167.2-169.170.377.51.7111.7A232 E233 M239 H240A232-R236 PolarHBondContact O-N 2.95Å; E233-R236 WeakPolarHBondContact O-CB 3.13Å; E233-R236 PolarHBondContact O-N 3.45Å; E233-R236 IonicContact OE1-CZ 2.81Å; E233-R236 IonicContact OE1-NE 2.77Å; E233-R236 IonicContact OE1-NH2 3.13Å; E233-R236 PolarHBondContact OE1-NH2 3.4Å; E233-R236 IonicContact OE2-CZ 2.68Å; E233-R236 IonicContact OE2-NE 3.84Å; E233-R236 PolarHBondContact OE2-NE 2.78Å; E233-R236 IonicContact OE2-NH2 3.63Å; E233-R236 PolarHBondContact OE2-NH2 2.82Å; R236-M239 PolarHBondContact O-N 3.46Å; R236-H240 WeakPolarHBondContact O-CB 3.48Å; R236-H240 PolarHBondContact O-N 3.34Å
237L95.4Very high94.8Very high83 Ų83102.1 Ų102.144%0.43549%0.493SS..Hα-helixtrans-68.6-36.6175.8-70.3170.3000112.1E233 N234 H240 F241E233-L237 HydrophobicContact CG-CD1 4.17Å; E233-L237 WeakPolarHBondContact O-CB 3.49Å; E233-L237 VanDerWaalsContact O-CG 3.29Å; E233-L237 WeakPolarHBondContact O-CG 3.49Å; E233-L237 PolarHBondContact O-N 2.99Å; N234-L237 PolarHBondContact O-N 2.79Å; L237-H240 PolarHBondContact O-N 3.44Å; L237-F241 PolarHBondContact O-N 3.5Å
238E95.2Very high94.7Very high109 Ų109100.5 Ų100.551%0.50949%0.485SS..Hα-helixtrans-66.3-41.3173.4-165.5-171.6146.800111.6N234 S235 F241 K242N234-E238 PolarHBondContact O-N 3.49Å; S235-E238 PolarHBondContact O-N 2.97Å; E238-F241 PolarHBondContact O-N 3.31Å; E238-K242 WeakPolarHBondContact O-CG 3.12Å; E238-K242 PolarHBondContact O-N 3.44Å; E238-K242 WeakPolarHBondContact OE1-CE 3.34Å; E238-K242 IonicContact OE1-NZ 2.61Å; E238-K242 PolarHBondContact OE1-NZ 2.81Å
239M93.5Very high94.5Very high119 Ų119100.2 Ų100.259%0.58648%0.48SS*.Hα-helixtrans-59.8-47.1171.6-173-156.7-64.800111.1S235 R236 F241 K242 L243S235-M239 PolarHBondContact O-N 2.89Å; R236-M239 PolarHBondContact O-N 3.46Å; M239-F241 VanDerWaalsContact C-N 3.27Å; M239-F241 PolarHBondContact O-N 3.11Å; M239-K242 PolarHBondContact O-N 3.21Å; M239-L243 HydrophobicContact CG-CD1 3.99Å; M239-L243 HydrophobicContact CG-CG 4.41Å; M239-L243 WeakPolarHBondContact O-CB 3.36Å; M239-L243 WeakPolarHBondContact O-CG 3.4Å; M239-L243 PolarHBondContact O-N 3.19Å; M239-L243 HydrophobicContact SD-CD1 4.16Å
240H91.6Very high94.4Very high111 Ų11197 Ų9751%0.51447%0.474SS..Hα-helixtrans-62.6-34177-171.3-52.1000112.1R236 L237 K244R236-H240 WeakPolarHBondContact O-CB 3.48Å; R236-H240 PolarHBondContact O-N 3.34Å; L237-H240 PolarHBondContact O-N 3.44Å; H240-K244 WeakPolarHBondContact O-CB 3.25Å; H240-K244 PolarHBondContact O-N 2.93Å
241F94.3Very high94.3Very high107 Ų10797.5 Ų97.547%0.46947%0.471SS..Hα-helixtrans-65.2-47173.8-171.7-83.9000111.2L237 E238 M239 K244 E245L237-F241 PolarHBondContact O-N 3.5Å; E238-F241 PolarHBondContact O-N 3.31Å; M239-F241 VanDerWaalsContact C-N 3.27Å; M239-F241 PolarHBondContact O-N 3.11Å; F241-K244 PolarHBondContact O-N 2.87Å; F241-E245 PolarHBondContact O-N 2.88Å
242K95.6Very high94.2Very high105 Ų10596.8 Ų96.846%0.45747%0.468SS..Hα-helixtrans-62.2-47.8177.6-69.7169.7-174.6167.40112.1E238 M239 K244 E245 D246E238-K242 WeakPolarHBondContact O-CG 3.12Å; E238-K242 PolarHBondContact O-N 3.44Å; E238-K242 WeakPolarHBondContact OE1-CE 3.34Å; E238-K242 IonicContact OE1-NZ 2.61Å; E238-K242 PolarHBondContact OE1-NZ 2.81Å; M239-K242 PolarHBondContact O-N 3.21Å; K242-K244 VanDerWaalsContact C-N 3.25Å; K242-K244 PolarHBondContact O-N 3.3Å; K242-E245 WeakPolarHBondContact O-CB 3.43Å; K242-E245 PolarHBondContact O-N 2.87Å; K242-E245 VanDerWaalsContact O-N 3.08Å; K242-D246 PolarHBondContact O-N 3.33Å
243L93.9Very high94.2Very high111 Ų11197.9 Ų97.958%0.58146%0.464SS*.Hα-helixtrans-58.7-36.4175.8-72.2171.1000112.4M239 Y247M239-L243 HydrophobicContact CG-CD1 3.99Å; M239-L243 HydrophobicContact CG-CG 4.41Å; M239-L243 WeakPolarHBondContact O-CB 3.36Å; M239-L243 WeakPolarHBondContact O-CG 3.4Å; M239-L243 PolarHBondContact O-N 3.19Å; M239-L243 HydrophobicContact SD-CD1 4.16Å; L243-Y247 WeakPolarHBondContact O-CB 3.3Å; L243-Y247 PolarHBondContact O-N 3.25Å
244K94.6Very high94.1Very high99 Ų9999.9 Ų99.943%0.4347%0.474SS..Hα-helixtrans-69.3-43.8173.3177.3170.6171.6171.80112.1H240 F241 K242 D246 Y247 E248H240-K244 WeakPolarHBondContact O-CB 3.25Å; H240-K244 PolarHBondContact O-N 2.93Å; F241-K244 PolarHBondContact O-N 2.87Å; K242-K244 VanDerWaalsContact C-N 3.25Å; K242-K244 PolarHBondContact O-N 3.3Å; K244-D246 VanDerWaalsContact C-N 3.29Å; K244-D246 PolarHBondContact O-N 3.14Å; K244-Y247 PolarHBondContact O-N 3.42Å; K244-E248 WeakPolarHBondContact CE-OE1 3.31Å; K244-E248 IonicContact NZ-OE1 2.62Å; K244-E248 PolarHBondContact NZ-OE1 3.45Å; K244-E248 WeakPolarHBondContact O-CG 3.45Å; K244-E248 PolarHBondContact O-N 3.47Å
245E93.9Very high93.9Very high84 Ų84101.1 Ų101.139%0.39348%0.477SS..Hα-helixtrans-60.9-39177-158.6-166.7104.100111.4F241 K242 E248 K249F241-E245 PolarHBondContact O-N 2.88Å; K242-E245 WeakPolarHBondContact O-CB 3.43Å; K242-E245 PolarHBondContact O-N 2.87Å; K242-E245 VanDerWaalsContact O-N 3.08Å; E245-E248 PolarHBondContact O-N 3.28Å; E245-K249 WeakPolarHBondContact O-CE 3.45Å; E245-K249 VanDerWaalsContact O-CG 3.32Å; E245-K249 WeakPolarHBondContact O-CG 3.34Å; E245-K249 PolarHBondContact O-N 2.92Å; E245-K249 VanDerWaalsContact O-N 3.09Å; E245-K249 VanDerWaalsContact OE1-CE 3.25Å; E245-K249 WeakPolarHBondContact OE1-CE 3.38Å; E245-K249 IonicContact OE1-NZ 3.97Å; E245-K249 PolarHBondContact OE1-NZ 3Å
246D92.1Very high93.8Very high74 Ų74102.8 Ų102.840%0.39648%0.477SS..Hα-helixtrans-74.7-34.6177.1-66.3-28.4000112.5K242 K244 K249 I250K242-D246 PolarHBondContact O-N 3.33Å; K244-D246 VanDerWaalsContact C-N 3.29Å; K244-D246 PolarHBondContact O-N 3.14Å; D246-K249 PolarHBondContact O-N 2.7Å; D246-K249 IonicContact OD1-NZ 2.62Å; D246-K249 PolarHBondContact OD1-NZ 3.09Å; D246-I250 VanDerWaalsContact O-CG1 3.31Å; D246-I250 WeakPolarHBondContact O-CG1 3.32Å; D246-I250 PolarHBondContact O-N 2.83Å
247Y92.4Very high93.7Very high136 Ų136104 Ų10453%0.53348%0.483SS..Hα-helixtrans-61.8-42.6168.9177.9-96.2000112L243 K244 K249 I250 Q251L243-Y247 WeakPolarHBondContact O-CB 3.3Å; L243-Y247 PolarHBondContact O-N 3.25Å; K244-Y247 PolarHBondContact O-N 3.42Å; Y247-K249 VanDerWaalsContact C-N 3.33Å; Y247-K249 PolarHBondContact O-N 3.23Å; Y247-I250 PolarHBondContact O-N 3.48Å; Y247-Q251 WeakPolarHBondContact O-CB 3.22Å; Y247-Q251 PolarHBondContact O-N 2.77Å
248E94.6Very high93.6Very high97 Ų97107.6 Ų107.645%0.45350%0.495SS..Hα-helixtrans-64.1-35.5175.9-73.1174.8176.200111.8K244 E245 H252K244-E248 WeakPolarHBondContact CE-OE1 3.31Å; K244-E248 IonicContact NZ-OE1 2.62Å; K244-E248 PolarHBondContact NZ-OE1 3.45Å; K244-E248 WeakPolarHBondContact O-CG 3.45Å; K244-E248 PolarHBondContact O-N 3.47Å; E245-E248 PolarHBondContact O-N 3.28Å; E248-H252 PolarHBondContact O-N 2.97Å; E248-H252 VanDerWaalsContact O-N 3.09Å
249K95Very high93.5Very high94 Ų94109.1 Ų109.141%0.40950%0.5SS..Hα-helixtrans-65.8-45.9171.1-67.7163.5-152.7161.40112.4E245 D246 Y247 Q251 H252 L253E245-K249 WeakPolarHBondContact O-CE 3.45Å; E245-K249 VanDerWaalsContact O-CG 3.32Å; E245-K249 WeakPolarHBondContact O-CG 3.34Å; E245-K249 PolarHBondContact O-N 2.92Å; E245-K249 VanDerWaalsContact O-N 3.09Å; E245-K249 VanDerWaalsContact OE1-CE 3.25Å; E245-K249 WeakPolarHBondContact OE1-CE 3.38Å; E245-K249 IonicContact OE1-NZ 3.97Å; E245-K249 PolarHBondContact OE1-NZ 3Å; D246-K249 PolarHBondContact O-N 2.7Å; D246-K249 IonicContact OD1-NZ 2.62Å; D246-K249 PolarHBondContact OD1-NZ 3.09Å; Y247-K249 VanDerWaalsContact C-N 3.33Å; Y247-K249 PolarHBondContact O-N 3.23Å; K249-Q251 VanDerWaalsContact C-N 3.32Å; K249-Q251 PolarHBondContact O-N 3.04Å; K249-H252 WeakPolarHBondContact O-CB 3.29Å; K249-H252 PolarHBondContact O-N 3.5Å; K249-L253 WeakPolarHBondContact O-CG 3.38Å; K249-L253 PolarHBondContact O-N 2.85Å
250I93.6Very high93.6Very high93 Ų93108 Ų10848%0.47749%0.493SS..Hα-helixtrans-60.7-44.8177.4-70.1164.3000109.9D246 Y247 H252 L253 E254D246-I250 VanDerWaalsContact O-CG1 3.31Å; D246-I250 WeakPolarHBondContact O-CG1 3.32Å; D246-I250 PolarHBondContact O-N 2.83Å; Y247-I250 PolarHBondContact O-N 3.48Å; I250-H252 VanDerWaalsContact C-N 3.29Å; I250-H252 PolarHBondContact O-N 3.15Å; I250-L253 PolarHBondContact O-N 3.45Å; I250-L253 VanDerWaalsContact O-N 3.15Å; I250-E254 HydrophobicContact CG2-CG 4.38Å; I250-E254 WeakPolarHBondContact O-CG 3.43Å; I250-E254 PolarHBondContact O-N 2.85Å
251Q93.1Very high93.6Very high79 Ų79108 Ų10837%0.36950%0.495SS..Hα-helixtrans-63-32.9177.7-173.2174.458.200112.8Y247 K249 Q255Y247-Q251 WeakPolarHBondContact O-CB 3.22Å; Y247-Q251 PolarHBondContact O-N 2.77Å; K249-Q251 VanDerWaalsContact C-N 3.32Å; K249-Q251 PolarHBondContact O-N 3.04Å; Q251-Q255 VanDerWaalsContact O-CG 3.3Å; Q251-Q255 WeakPolarHBondContact O-CG 3.14Å; Q251-Q255 PolarHBondContact O-N 3.05Å; Q251-Q255 VanDerWaalsContact O-N 3.15Å
252H92.9Very high93.6Very high107 Ų107106.4 Ų106.450%0.49549%0.492SS..Hα-helixtrans-65.8-48.2171.5-167.9-79.3000111.5E248 K249 I250 E254 Q255 E256E248-H252 PolarHBondContact O-N 2.97Å; E248-H252 VanDerWaalsContact O-N 3.09Å; K249-H252 WeakPolarHBondContact O-CB 3.29Å; K249-H252 PolarHBondContact O-N 3.5Å; I250-H252 VanDerWaalsContact C-N 3.29Å; I250-H252 PolarHBondContact O-N 3.15Å; H252-E254 VanDerWaalsContact C-N 3.34Å; H252-E254 PolarHBondContact O-N 3.09Å; H252-Q255 WeakPolarHBondContact O-CB 3.33Å; H252-Q255 PolarHBondContact O-N 3.43Å; H252-Q255 VanDerWaalsContact O-N 3.09Å; H252-E256 IonicContact CE1-OE1 2.64Å; H252-E256 PolarHBondContact CE1-OE1 2.84Å; H252-E256 IonicContact CE1-OE2 2.69Å; H252-E256 PolarHBondContact CE1-OE2 3.48Å; H252-E256 VanDerWaalsContact CE1-OE2 3.3Å; H252-E256 IonicContact ND1-OE1 2.72Å; H252-E256 IonicContact ND1-OE2 2.69Å; H252-E256 PolarHBondContact ND1-OE2 3.22Å; H252-E256 PolarHBondContact O-N 3.34Å
253L93.9Very high93.5Very high85 Ų85104.3 Ų104.345%0.44549%0.486SS..Hα-helixtrans-61.7-40.1177.7-68.6168.9000112K249 I250 Q255 E256 Y257K249-L253 WeakPolarHBondContact O-CG 3.38Å; K249-L253 PolarHBondContact O-N 2.85Å; I250-L253 PolarHBondContact O-N 3.45Å; I250-L253 VanDerWaalsContact O-N 3.15Å; L253-Q255 VanDerWaalsContact C-N 3.32Å; L253-Q255 PolarHBondContact O-N 3.09Å; L253-E256 PolarHBondContact O-N 3.15Å; L253-Y257 HydrophobicContact CB-CD2 4.48Å; L253-Y257 HydrophobicContact CB-CE2 4.38Å; L253-Y257 WeakPolarHBondContact O-CB 3.46Å; L253-Y257 WeakPolarHBondContact O-CD2 3.48Å; L253-Y257 PolarHBondContact O-N 3.48Å
254E91.9Very high93.5Very high120 Ų120103.9 Ų103.956%0.56148%0.479SS*.Hα-helixtrans-60-40.1172.6-75.1-177.4165.300112.2I250 H252 K258I250-E254 HydrophobicContact CG2-CG 4.38Å; I250-E254 WeakPolarHBondContact O-CG 3.43Å; I250-E254 PolarHBondContact O-N 2.85Å; H252-E254 VanDerWaalsContact C-N 3.34Å; H252-E254 PolarHBondContact O-N 3.09Å; E254-K258 WeakPolarHBondContact O-CB 3.34Å; E254-K258 PolarHBondContact O-N 3.28Å
255Q93.6Very high93.5Very high122 Ų122104.9 Ų104.957%0.5749%0.486SS*.Hα-helixtrans-68.7-38.6175.9-72.5175.339.200112.1Q251 H252 L253 K259Q251-Q255 VanDerWaalsContact O-CG 3.3Å; Q251-Q255 WeakPolarHBondContact O-CG 3.14Å; Q251-Q255 PolarHBondContact O-N 3.05Å; Q251-Q255 VanDerWaalsContact O-N 3.15Å; H252-Q255 WeakPolarHBondContact O-CB 3.33Å; H252-Q255 PolarHBondContact O-N 3.43Å; H252-Q255 VanDerWaalsContact O-N 3.09Å; L253-Q255 VanDerWaalsContact C-N 3.32Å; L253-Q255 PolarHBondContact O-N 3.09Å; Q255-K259 WeakPolarHBondContact O-CB 3.46Å; Q255-K259 PolarHBondContact O-N 2.83Å
256E93.5Very high93.4Very high102 Ų102106 Ų10648%0.47749%0.489SS..Hα-helixtrans-66-48.3175.1-72.1179.4120.600111.8H252 L253 K258 K259 E260H252-E256 IonicContact CE1-OE1 2.64Å; H252-E256 PolarHBondContact CE1-OE1 2.84Å; H252-E256 IonicContact CE1-OE2 2.69Å; H252-E256 PolarHBondContact CE1-OE2 3.48Å; H252-E256 VanDerWaalsContact CE1-OE2 3.3Å; H252-E256 IonicContact ND1-OE1 2.72Å; H252-E256 IonicContact ND1-OE2 2.69Å; H252-E256 PolarHBondContact ND1-OE2 3.22Å; H252-E256 PolarHBondContact O-N 3.34Å; L253-E256 PolarHBondContact O-N 3.15Å; E256-K258 PolarHBondContact O-N 2.92Å; E256-K259 WeakPolarHBondContact O-CB 3.47Å; E256-K259 PolarHBondContact O-N 3.06Å; E256-E260 PolarHBondContact O-N 2.88Å
257Y92.9Very high93.5Very high148 Ų148107.7 Ų107.758%0.5850%0.495SS*.Hα-helixtrans-63.1-40174.6-73.1-54000112.2L253 K259 E260 I261L253-Y257 HydrophobicContact CB-CD2 4.48Å; L253-Y257 HydrophobicContact CB-CE2 4.38Å; L253-Y257 WeakPolarHBondContact O-CB 3.46Å; L253-Y257 WeakPolarHBondContact O-CD2 3.48Å; L253-Y257 PolarHBondContact O-N 3.48Å; Y257-K259 VanDerWaalsContact C-N 3.29Å; Y257-K259 PolarHBondContact O-N 3.29Å; Y257-E260 PolarHBondContact O-N 2.99Å; Y257-I261 WeakPolarHBondContact O-CB 3.26Å; Y257-I261 VanDerWaalsContact O-CG1 3.25Å; Y257-I261 WeakPolarHBondContact O-CG1 3.38Å; Y257-I261 PolarHBondContact O-N 3.36Å
258K94.6Very high93.5Very high158 Ų158105.8 Ų105.869%0.68750%0.497SS*.Hα-helixtrans-64.2-34.6175.2-175.4171.4-176.51730112.2E254 E256 N262E254-K258 WeakPolarHBondContact O-CB 3.34Å; E254-K258 PolarHBondContact O-N 3.28Å; E256-K258 PolarHBondContact O-N 2.92Å; K258-N262 VanDerWaalsContact O-CB 3.31Å; K258-N262 WeakPolarHBondContact O-CB 3.29Å; K258-N262 PolarHBondContact O-N 2.82Å; K258-N262 VanDerWaalsContact O-N 3.14Å
259K93.1Very high93.4Very high140 Ų140103.9 Ų103.961%0.60949%0.494SS*.Hα-helixtrans-68-46.4171.8-176.6-171.4171.3-167.30111.2Q255 E256 Y257 N262 D263Q255-K259 WeakPolarHBondContact O-CB 3.46Å; Q255-K259 PolarHBondContact O-N 2.83Å; E256-K259 WeakPolarHBondContact O-CB 3.47Å; E256-K259 PolarHBondContact O-N 3.06Å; Y257-K259 VanDerWaalsContact C-N 3.29Å; Y257-K259 PolarHBondContact O-N 3.29Å; K259-N262 PolarHBondContact O-N 2.99Å; K259-D263 PolarHBondContact O-N 3.45Å
260E94Very high93.4Very high95 Ų95104.2 Ų104.244%0.44450%0.5SS..Hα-helixtrans-60.3-47.4176.5-177.5171.2-164.800111.1E256 Y257 N262 D263 K264E256-E260 PolarHBondContact O-N 2.88Å; Y257-E260 PolarHBondContact O-N 2.99Å; E260-N262 VanDerWaalsContact C-N 3.31Å; E260-N262 PolarHBondContact O-N 2.91Å; E260-D263 CarbonylContact O-C 3.6Å; E260-D263 PolarHBondContact O-N 2.71Å; E260-K264 HydrophobicContact CG-CG 4.14Å; E260-K264 WeakPolarHBondContact O-CG 3.35Å; E260-K264 PolarHBondContact O-N 2.86Å; E260-K264 WeakPolarHBondContact OE1-CE 3.47Å; E260-K264 IonicContact OE1-NZ 2.84Å; E260-K264 PolarHBondContact OE1-NZ 3.32Å
261I92.4Very high93.4Very high111 Ų111104.5 Ų104.557%0.56950%0.502SS*.Hα-helixtrans-54.3-47.4176.5-71.2164.5000110.8Y257 D263 K264 E265Y257-I261 WeakPolarHBondContact O-CB 3.26Å; Y257-I261 VanDerWaalsContact O-CG1 3.25Å; Y257-I261 WeakPolarHBondContact O-CG1 3.38Å; Y257-I261 PolarHBondContact O-N 3.36Å; I261-D263 PolarHBondContact O-N 2.68Å; I261-K264 PolarHBondContact O-N 3.09Å; I261-E265 VanDerWaalsContact O-CB 3.28Å; I261-E265 WeakPolarHBondContact O-CB 3.47Å; I261-E265 PolarHBondContact O-N 2.9Å
262N94.6Very high93.4Very high75 Ų75105.9 Ų105.940%0.40151%0.511SS..Hα-helixtrans-63.4-38.2177.3-172.2-18.7000112K258 K259 E260 E265 K266K258-N262 VanDerWaalsContact O-CB 3.31Å; K258-N262 WeakPolarHBondContact O-CB 3.29Å; K258-N262 PolarHBondContact O-N 2.82Å; K258-N262 VanDerWaalsContact O-N 3.14Å; K259-N262 PolarHBondContact O-N 2.99Å; E260-N262 VanDerWaalsContact C-N 3.31Å; E260-N262 PolarHBondContact O-N 2.91Å; N262-E265 PolarHBondContact O-N 3.08Å; N262-K266 VanDerWaalsContact O-CG 3.3Å; N262-K266 WeakPolarHBondContact O-CG 3.4Å; N262-K266 PolarHBondContact O-N 2.93Å; N262-K266 WeakPolarHBondContact OD1-CE 3.5Å; N262-K266 PolarHBondContact OD1-NZ 3.45Å; N262-K266 VanDerWaalsContact OD1-NZ 3.15Å
263D93.9Very high93.4Very high61 Ų61105.2 Ų105.233%0.32651%0.511SS..Hα-helixtrans-72.7-30.1175.5-69.8-22.5000112.9K259 E260 I261 K266 Q267K259-D263 PolarHBondContact O-N 3.45Å; E260-D263 CarbonylContact O-C 3.6Å; E260-D263 PolarHBondContact O-N 2.71Å; I261-D263 PolarHBondContact O-N 2.68Å; D263-K266 IonicContact OD1-NZ 3.34Å; D263-K266 PolarHBondContact OD1-NZ 3.32Å; D263-Q267 WeakPolarHBondContact O-CG 3.49Å; D263-Q267 PolarHBondContact O-N 3.43Å
264K93.6Very high93.4Very high101 Ų101105.7 Ų105.744%0.43951%0.511SS..Hα-helixtrans-71.4-39.6168-60.8-65.4177.1178.20111.7E260 I261 K266 Q267 V268E260-K264 HydrophobicContact CG-CG 4.14Å; E260-K264 WeakPolarHBondContact O-CG 3.35Å; E260-K264 PolarHBondContact O-N 2.86Å; E260-K264 WeakPolarHBondContact OE1-CE 3.47Å; E260-K264 IonicContact OE1-NZ 2.84Å; E260-K264 PolarHBondContact OE1-NZ 3.32Å; I261-K264 PolarHBondContact O-N 3.09Å; K264-K266 VanDerWaalsContact C-N 3.32Å; K264-K266 PolarHBondContact O-N 3.3Å; K264-Q267 CarbonylContact O-C 3.56Å; K264-Q267 WeakPolarHBondContact O-CA 3.29Å; K264-Q267 WeakPolarHBondContact O-CB 3.23Å; K264-Q267 PolarHBondContact O-N 3.28Å; K264-V268 WeakPolarHBondContact O-CG2 3.45Å; K264-V268 PolarHBondContact O-N 3.47Å
265E93.2Very high93.2Very high121 Ų121104.4 Ų104.457%0.56551%0.506SS*.Hα-helixtrans-63.7-37.2177.6-174.2172.4-153.500111.3I261 N262 V268 S269I261-E265 VanDerWaalsContact O-CB 3.28Å; I261-E265 WeakPolarHBondContact O-CB 3.47Å; I261-E265 PolarHBondContact O-N 2.9Å; N262-E265 PolarHBondContact O-N 3.08Å; E265-V268 PolarHBondContact O-N 2.93Å; E265-S269 WeakPolarHBondContact O-CB 3.32Å; E265-S269 PolarHBondContact O-N 3.49Å; E265-S269 PolarHBondContact O-OG 2.72Å
266K93.1Very high93.1Very high106 Ų106101.4 Ų101.446%0.46150%0.497SS..Hα-helixtrans-62.5-42.3167.5-70.1165.5-159146.30112.7N262 D263 K264 S269 L270N262-K266 VanDerWaalsContact O-CG 3.3Å; N262-K266 WeakPolarHBondContact O-CG 3.4Å; N262-K266 PolarHBondContact O-N 2.93Å; N262-K266 WeakPolarHBondContact OD1-CE 3.5Å; N262-K266 PolarHBondContact OD1-NZ 3.45Å; N262-K266 VanDerWaalsContact OD1-NZ 3.15Å; D263-K266 IonicContact OD1-NZ 3.34Å; D263-K266 PolarHBondContact OD1-NZ 3.32Å; K264-K266 VanDerWaalsContact C-N 3.32Å; K264-K266 PolarHBondContact O-N 3.3Å; K266-S269 PolarHBondContact O-N 3.27Å; K266-L270 WeakPolarHBondContact O-CB 3.44Å; K266-L270 PolarHBondContact O-N 3.03Å
267Q94.1Very high93.1Very high110 Ų110100.8 Ų100.851%0.51449%0.494SS..Hα-helixtrans-64.4-43176.4-71.9171.616.800111.5D263 K264 L270 L271D263-Q267 WeakPolarHBondContact O-CG 3.49Å; D263-Q267 PolarHBondContact O-N 3.43Å; K264-Q267 CarbonylContact O-C 3.56Å; K264-Q267 WeakPolarHBondContact O-CA 3.29Å; K264-Q267 WeakPolarHBondContact O-CB 3.23Å; K264-Q267 PolarHBondContact O-N 3.28Å; Q267-L270 PolarHBondContact O-N 2.95Å; Q267-L271 WeakPolarHBondContact O-CG 3.4Å; Q267-L271 PolarHBondContact O-N 2.92Å
268V91.8Very high93Very high96 Ų96100.7 Ų100.758%0.58250%0.496SS*.Hα-helixtrans-62.4-43.5173.6171.60000110.7K264 E265 L270 L271 L272K264-V268 WeakPolarHBondContact O-CG2 3.45Å; K264-V268 PolarHBondContact O-N 3.47Å; E265-V268 PolarHBondContact O-N 2.93Å; V268-L270 PolarHBondContact O-N 3.27Å; V268-L271 PolarHBondContact O-N 3.34Å; V268-L272 WeakPolarHBondContact O-CB 3.39Å; V268-L272 PolarHBondContact O-N 3.17Å
269S93.5Very high92.9Very high57 Ų5797.5 Ų97.540%0.39948%0.484SS..Hα-helixtrans-61.2-42.1176.1-59.20000112.2E265 K266 L272 I273E265-S269 WeakPolarHBondContact O-CB 3.32Å; E265-S269 PolarHBondContact O-N 3.49Å; E265-S269 PolarHBondContact O-OG 2.72Å; K266-S269 PolarHBondContact O-N 3.27Å; S269-L272 PolarHBondContact O-N 3.07Å; S269-I273 VanDerWaalsContact O-CG1 3.32Å; S269-I273 WeakPolarHBondContact O-CG1 3.4Å; S269-I273 PolarHBondContact O-N 2.9Å
270L94.6Very high92.9Very high102 Ų10294.6 Ų94.653%0.53448%0.475SS..Hα-helixtrans-65.6-41.8176.3-177.465.6000111.8K266 Q267 V268 I273 Q274K266-L270 WeakPolarHBondContact O-CB 3.44Å; K266-L270 PolarHBondContact O-N 3.03Å; Q267-L270 PolarHBondContact O-N 2.95Å; V268-L270 PolarHBondContact O-N 3.27Å; L270-I273 PolarHBondContact O-N 2.93Å; L270-Q274 WeakPolarHBondContact O-CG 3.42Å; L270-Q274 PolarHBondContact O-N 3.44Å
271L92.7Very high92.8Very high98 Ų9895 Ų9551%0.51348%0.475SS..Hα-helixtrans-65.4-38.2174.1-71.4170.1000111.6Q267 V268 Q274 I275Q267-L271 WeakPolarHBondContact O-CG 3.4Å; Q267-L271 PolarHBondContact O-N 2.92Å; V268-L271 PolarHBondContact O-N 3.34Å; L271-Q274 PolarHBondContact O-N 3.16Å; L271-I275 VanDerWaalsContact O-CG1 3.29Å; L271-I275 WeakPolarHBondContact O-CG1 3.1Å; L271-I275 PolarHBondContact O-N 3.01Å
272L93.4Very high92.6Very high108 Ų10895.4 Ų95.457%0.56548%0.476SS*.Hα-helixtrans-63.9-44.2175.5-165.873.6000111.2V268 S269 Q274 I275 T276V268-L272 WeakPolarHBondContact O-CB 3.39Å; V268-L272 PolarHBondContact O-N 3.17Å; S269-L272 PolarHBondContact O-N 3.07Å; L272-Q274 VanDerWaalsContact C-N 3.35Å; L272-Q274 PolarHBondContact O-N 3.26Å; L272-I275 WeakPolarHBondContact O-CB 3.43Å; L272-I275 PolarHBondContact O-N 3.01Å; L272-T276 WeakPolarHBondContact O-CG2 3.31Å; L272-T276 PolarHBondContact O-N 3.29Å; L272-T276 PolarHBondContact O-OG1 2.86Å
273I93.1Very high92.5Very high94 Ų9497.1 Ų97.148%0.48248%0.48SS..Hα-helixtrans-57.8-48172.2-69163000110.2S269 L270 I275 T276 E277S269-I273 VanDerWaalsContact O-CG1 3.32Å; S269-I273 WeakPolarHBondContact O-CG1 3.4Å; S269-I273 PolarHBondContact O-N 2.9Å; L270-I273 PolarHBondContact O-N 2.93Å; I273-I275 VanDerWaalsContact C-N 3.3Å; I273-I275 PolarHBondContact O-N 3.21Å; I273-T276 WeakPolarHBondContact CA-OG1 3.37Å; I273-T276 PolarHBondContact O-N 3.37Å; I273-T276 VanDerWaalsContact O-N 3.17Å; I273-T276 PolarHBondContact O-OG1 3.36Å; I273-E277 PolarHBondContact O-N 2.94Å
274Q92.9Very high92.2Very high95 Ų9598.8 Ų98.844%0.44449%0.489SS..Hα-helixtrans-60.6-36.5176.6-72.5178.611.100112.9L270 L271 L272 K278L270-Q274 WeakPolarHBondContact O-CG 3.42Å; L270-Q274 PolarHBondContact O-N 3.44Å; L271-Q274 PolarHBondContact O-N 3.16Å; L272-Q274 VanDerWaalsContact C-N 3.35Å; L272-Q274 PolarHBondContact O-N 3.26Å; Q274-K278 WeakPolarHBondContact O-CB 3.46Å; Q274-K278 WeakPolarHBondContact O-CG 3.45Å; Q274-K278 PolarHBondContact O-N 2.86Å
275I89.4Confident92.1Very high92 Ų9299.6 Ų99.647%0.47250%0.498SS..Hα-helixtrans-64.4-50.3173.3-71.3162.6000110L271 L272 I273 E277 K278 E279L271-I275 VanDerWaalsContact O-CG1 3.29Å; L271-I275 WeakPolarHBondContact O-CG1 3.1Å; L271-I275 PolarHBondContact O-N 3.01Å; L272-I275 WeakPolarHBondContact O-CB 3.43Å; L272-I275 PolarHBondContact O-N 3.01Å; I273-I275 VanDerWaalsContact C-N 3.3Å; I273-I275 PolarHBondContact O-N 3.21Å; I275-E277 VanDerWaalsContact C-N 3.31Å; I275-E277 PolarHBondContact O-N 3.25Å; I275-K278 CarbonylContact O-C 3.54Å; I275-K278 WeakPolarHBondContact O-CA 3.47Å; I275-K278 PolarHBondContact O-N 3.04Å; I275-E279 HydrophobicContact CG2-CG 4.37Å; I275-E279 WeakPolarHBondContact O-CG 3.3Å; I275-E279 PolarHBondContact O-N 2.89Å
276T91.4Very high92Very high60 Ų6097.7 Ų97.737%0.36849%0.494SS..Hα-helixtrans-61.4-35.9178.160.80000113L272 I273 N280L272-T276 WeakPolarHBondContact O-CG2 3.31Å; L272-T276 PolarHBondContact O-N 3.29Å; L272-T276 PolarHBondContact O-OG1 2.86Å; I273-T276 WeakPolarHBondContact CA-OG1 3.37Å; I273-T276 PolarHBondContact O-N 3.37Å; I273-T276 VanDerWaalsContact O-N 3.17Å; I273-T276 PolarHBondContact O-OG1 3.36Å; T276-N280 WeakPolarHBondContact O-CB 3.36Å; T276-N280 PolarHBondContact O-N 3.41Å; T276-N280 PolarHBondContact O-ND2 3.33Å; T276-N280 PolarHBondContact O-OD1 3.49Å
277E92.2Very high91.8Very high89 Ų8999.7 Ų99.742%0.41650%0.503SS..Hα-helixtrans-61.9-43.7170.4-85.2-167-135.400112.3I273 I275 N280 K281I273-E277 PolarHBondContact O-N 2.94Å; I275-E277 VanDerWaalsContact C-N 3.31Å; I275-E277 PolarHBondContact O-N 3.25Å; E277-N280 PolarHBondContact O-N 3.41Å; E277-K281 WeakPolarHBondContact O-CB 3.5Å; E277-K281 VanDerWaalsContact O-CD 3.3Å; E277-K281 WeakPolarHBondContact O-CD 3.3Å; E277-K281 VanDerWaalsContact O-CG 3.24Å; E277-K281 WeakPolarHBondContact O-CG 3.28Å; E277-K281 PolarHBondContact O-N 3.43Å; E277-K281 IonicContact OE2-NZ 3.64Å; E277-K281 PolarHBondContact OE2-NZ 3Å
278K91.5Very high91.7Very high146 Ų14699.1 Ų99.164%0.63550%0.503SS*.Hα-helixtrans-70.2-38.2-179.9-70.7-75.6-178.9173.70111.4Q274 I275 M282Q274-K278 WeakPolarHBondContact O-CB 3.46Å; Q274-K278 WeakPolarHBondContact O-CG 3.45Å; Q274-K278 PolarHBondContact O-N 2.86Å; I275-K278 CarbonylContact O-C 3.54Å; I275-K278 WeakPolarHBondContact O-CA 3.47Å; I275-K278 PolarHBondContact O-N 3.04Å; K278-M282 VanDerWaalsContact O-CB 3.27Å; K278-M282 WeakPolarHBondContact O-CB 3.43Å; K278-M282 PolarHBondContact O-N 3.32Å
279E92.1Very high91.5Very high91 Ų9199.9 Ų99.943%0.42550%0.503SS..Hα-helixtrans-62.6-42.7170.5-74.1-169.116300112I275 M282 K283I275-E279 HydrophobicContact CG2-CG 4.37Å; I275-E279 WeakPolarHBondContact O-CG 3.3Å; I275-E279 PolarHBondContact O-N 2.89Å; E279-M282 CarbonylContact O-C 3.49Å; E279-M282 WeakPolarHBondContact O-CA 3.44Å; E279-M282 WeakPolarHBondContact O-CB 3.48Å; E279-M282 PolarHBondContact O-N 3.2Å; E279-M282 VanDerWaalsContact O-N 3.16Å; E279-K283 VanDerWaalsContact O-CG 3.27Å; E279-K283 WeakPolarHBondContact O-CG 3.45Å; E279-K283 PolarHBondContact O-N 3.09Å; E279-K283 IonicContact OE2-NZ 2.58Å; E279-K283 PolarHBondContact OE2-NZ 3.41Å
280N92.4Very high91.4Very high79 Ų79100.9 Ų100.942%0.42250%0.502SS..Hα-helixtrans-66.8-45.3178.9-68.4-13.9000110.6T276 E277 M282 K283 D284T276-N280 WeakPolarHBondContact O-CB 3.36Å; T276-N280 PolarHBondContact O-N 3.41Å; T276-N280 PolarHBondContact O-ND2 3.33Å; T276-N280 PolarHBondContact O-OD1 3.49Å; E277-N280 PolarHBondContact O-N 3.41Å; N280-M282 PolarHBondContact O-N 2.62Å; N280-K283 WeakPolarHBondContact O-CB 3.45Å; N280-K283 PolarHBondContact O-N 2.87Å; N280-K283 PolarHBondContact OD1-NZ 2.98Å; N280-D284 PolarHBondContact O-N 3.23Å
281K92.6Very high91.1Very high102 Ų10299.9 Ų99.944%0.44349%0.494SS..Hα-helixtrans-59.3-29.8171-69.4158.6-171.4168.10112.5E277 L285E277-K281 WeakPolarHBondContact O-CB 3.5Å; E277-K281 VanDerWaalsContact O-CD 3.3Å; E277-K281 WeakPolarHBondContact O-CD 3.3Å; E277-K281 VanDerWaalsContact O-CG 3.24Å; E277-K281 WeakPolarHBondContact O-CG 3.28Å; E277-K281 PolarHBondContact O-N 3.43Å; E277-K281 IonicContact OE2-NZ 3.64Å; E277-K281 PolarHBondContact OE2-NZ 3Å; K281-L285 WeakPolarHBondContact O-CB 3.45Å; K281-L285 WeakPolarHBondContact O-CD1 3.48Å; K281-L285 VanDerWaalsContact O-CG 3.25Å; K281-L285 WeakPolarHBondContact O-CG 3.49Å; K281-L285 PolarHBondContact O-N 3.32Å; K281-L285 VanDerWaalsContact O-N 3.1Å
282M89.3Confident90.7Very high121 Ų12197.9 Ų97.960%0.59649%0.489SS*.Hα-helixtrans-73.8-42.2173.5-167.5-174.4-53.700111.8K278 E279 N280 D284 L285 T286K278-M282 VanDerWaalsContact O-CB 3.27Å; K278-M282 WeakPolarHBondContact O-CB 3.43Å; K278-M282 PolarHBondContact O-N 3.32Å; E279-M282 CarbonylContact O-C 3.49Å; E279-M282 WeakPolarHBondContact O-CA 3.44Å; E279-M282 WeakPolarHBondContact O-CB 3.48Å; E279-M282 PolarHBondContact O-N 3.2Å; E279-M282 VanDerWaalsContact O-N 3.16Å; N280-M282 PolarHBondContact O-N 2.62Å; M282-D284 VanDerWaalsContact C-N 3.35Å; M282-L285 PolarHBondContact O-N 3.5Å; M282-T286 WeakPolarHBondContact O-CB 3.43Å; M282-T286 PolarHBondContact O-N 3.45Å; M282-T286 PolarHBondContact O-OG1 2.99Å
283K90.9Very high90.5Very high110 Ų11099.3 Ų99.348%0.47849%0.487SS..Hα-helixtrans-60.9-42.9172.9-66.8159.5-156.8158.90110.9E279 N280 T286 F287E279-K283 VanDerWaalsContact O-CG 3.27Å; E279-K283 WeakPolarHBondContact O-CG 3.45Å; E279-K283 PolarHBondContact O-N 3.09Å; E279-K283 IonicContact OE2-NZ 2.58Å; E279-K283 PolarHBondContact OE2-NZ 3.41Å; N280-K283 WeakPolarHBondContact O-CB 3.45Å; N280-K283 PolarHBondContact O-N 2.87Å; N280-K283 PolarHBondContact OD1-NZ 2.98Å; K283-T286 PolarHBondContact O-N 2.86Å; K283-F287 WeakPolarHBondContact O-CB 3.49Å; K283-F287 PolarHBondContact O-N 2.9Å
284D89.3Confident90.4Very high96 Ų9698.7 Ų98.751%0.51348%0.484SS..Hα-helixtrans-60.9-45.6175.4-59.3-29.5000111.2N280 M282 F287 L288N280-D284 PolarHBondContact O-N 3.23Å; M282-D284 VanDerWaalsContact C-N 3.35Å; D284-F287 PolarHBondContact O-N 2.95Å; D284-L288 WeakPolarHBondContact O-CG 3.49Å; D284-L288 PolarHBondContact O-N 2.69Å
285L90.4Very high90.2Very high119 Ų11998.8 Ų98.862%0.62348%0.483SS*.Hα-helixtrans-65.1-36.8174.2-75.4169.5000112.6K281 M282 L289K281-L285 WeakPolarHBondContact O-CB 3.45Å; K281-L285 WeakPolarHBondContact O-CD1 3.48Å; K281-L285 VanDerWaalsContact O-CG 3.25Å; K281-L285 WeakPolarHBondContact O-CG 3.49Å; K281-L285 PolarHBondContact O-N 3.32Å; K281-L285 VanDerWaalsContact O-N 3.1Å; M282-L285 PolarHBondContact O-N 3.5Å; L285-L289 WeakPolarHBondContact O-CB 3.45Å; L285-L289 PolarHBondContact O-N 2.98Å
286T91.1Very high90.1Very high80 Ų8098.5 Ų98.549%0.49149%0.486SS..Hα-helixtrans-67.5-39.5174.5-58.40000111.5M282 K283 L289 E290M282-T286 WeakPolarHBondContact O-CB 3.43Å; M282-T286 PolarHBondContact O-N 3.45Å; M282-T286 PolarHBondContact O-OG1 2.99Å; K283-T286 PolarHBondContact O-N 2.86Å; T286-L289 WeakPolarHBondContact O-CB 3.44Å; T286-L289 PolarHBondContact O-N 3.01Å; T286-E290 PolarHBondContact O-N 3.23Å
287F90.1Very high90Very high149 Ų14998.8 Ų98.865%0.65449%0.485SS*.Hα-helixtrans-64.6-45.1174.3-179.7-95000111.5K283 D284 L289 E290 E291K283-F287 WeakPolarHBondContact O-CB 3.49Å; K283-F287 PolarHBondContact O-N 2.9Å; D284-F287 PolarHBondContact O-N 2.95Å; F287-L289 VanDerWaalsContact C-N 3.29Å; F287-L289 PolarHBondContact O-N 3.38Å; F287-E290 PolarHBondContact O-N 2.74Å; F287-E291 WeakPolarHBondContact O-CB 3.25Å; F287-E291 PolarHBondContact O-N 3.27Å
288L90.6Very high89.8Confident97 Ų9799.4 Ų99.451%0.50849%0.488SS..Hα-helixtrans-62.9-35173.6-72.3168.4000112.4D284 S292D284-L288 WeakPolarHBondContact O-CG 3.49Å; D284-L288 PolarHBondContact O-N 2.69Å; L288-S292 WeakPolarHBondContact O-CB 3.38Å; L288-S292 PolarHBondContact O-N 3.39Å
289L87.6Confident89.4Confident113 Ų11397.6 Ų97.659%0.59248%0.484SS*.Hα-helixtrans-65.4-48.1174.4-169.176.7000110.9L285 T286 F287 S292 R293L285-L289 WeakPolarHBondContact O-CB 3.45Å; L285-L289 PolarHBondContact O-N 2.98Å; T286-L289 WeakPolarHBondContact O-CB 3.44Å; T286-L289 PolarHBondContact O-N 3.01Å; F287-L289 VanDerWaalsContact C-N 3.29Å; F287-L289 PolarHBondContact O-N 3.38Å; L289-S292 WeakPolarHBondContact O-CB 3.21Å; L289-S292 PolarHBondContact O-N 3Å; L289-S292 PolarHBondContact O-OG 2.65Å; L289-R293 WeakPolarHBondContact O-CB 3.34Å; L289-R293 PolarHBondContact O-N 3.1Å
290E91.1Very high89.2Confident78 Ų7897.9 Ų97.936%0.36449%0.486SS..Hα-helixtrans-69.2-37.2-180-15466.8-171.300111.5T286 F287 S292 R293 D294T286-E290 PolarHBondContact O-N 3.23Å; F287-E290 PolarHBondContact O-N 2.74Å; E290-S292 VanDerWaalsContact C-N 3.29Å; E290-S292 PolarHBondContact O-N 3.11Å; E290-R293 CarbonylContact O-C 3.53Å; E290-R293 WeakPolarHBondContact O-CA 3.4Å; E290-R293 VanDerWaalsContact O-CB 3.3Å; E290-R293 WeakPolarHBondContact O-CB 3.26Å; E290-R293 PolarHBondContact O-N 2.6Å; E290-R293 VanDerWaalsContact O-N 3.08Å; E290-R293 VanDerWaalsContact OE1-CD 3.27Å; E290-R293 WeakPolarHBondContact OE1-CD 3.41Å; E290-R293 IonicContact OE1-CZ 3.52Å; E290-R293 IonicContact OE1-NE 2.75Å; E290-R293 IonicContact OE1-NH1 2.67Å; E290-R293 PolarHBondContact OE1-NH1 3.23Å; E290-R293 WeakPolarHBondContact OE2-CD 3.44Å; E290-R293 IonicContact OE2-NH1 3.89Å; E290-R293 PolarHBondContact OE2-NH1 3.47Å; E290-D294 PolarHBondContact O-N 3.33Å
291E88.7Confident88.8Confident80 Ų80100.4 Ų100.437%0.37450%0.495SS..Hα-helixtrans-63.3-35.3171.7-161-139-179.100111.7F287 K295F287-E291 WeakPolarHBondContact O-CB 3.25Å; F287-E291 PolarHBondContact O-N 3.27Å; E291-K295 VanDerWaalsContact CD-CE 3.45Å; E291-K295 WeakPolarHBondContact O-CD 3.3Å; E291-K295 VanDerWaalsContact O-CG 3.23Å; E291-K295 WeakPolarHBondContact O-CG 3.37Å; E291-K295 PolarHBondContact O-N 2.87Å; E291-K295 VanDerWaalsContact O-N 3.13Å; E291-K295 WeakPolarHBondContact OE1-CE 3.48Å; E291-K295 IonicContact OE1-NZ 3.35Å; E291-K295 PolarHBondContact OE1-NZ 3.39Å; E291-K295 IonicContact OE2-NZ 2.76Å; E291-K295 PolarHBondContact OE2-NZ 3.45Å
292S84.9Confident88.4Confident57 Ų57101 Ų10140%0.39950%0.498SS..Hα-helixtrans-69.5-35.4171.783.10000112.3L288 L289 E290 K295 V296L288-S292 WeakPolarHBondContact O-CB 3.38Å; L288-S292 PolarHBondContact O-N 3.39Å; L289-S292 WeakPolarHBondContact O-CB 3.21Å; L289-S292 PolarHBondContact O-N 3Å; L289-S292 PolarHBondContact O-OG 2.65Å; E290-S292 VanDerWaalsContact C-N 3.29Å; E290-S292 PolarHBondContact O-N 3.11Å; S292-K295 PolarHBondContact O-N 2.97Å; S292-V296 WeakPolarHBondContact O-CG2 3.45Å; S292-V296 PolarHBondContact O-N 2.87Å
293R89.9Confident88.1Confident138 Ų13899.3 Ų99.352%0.52149%0.494SS..Hα-helixtrans-67-43.6176.3-169.2-167.8-170.31752.9111L289 E290 K295 V296 N297L289-R293 WeakPolarHBondContact O-CB 3.34Å; L289-R293 PolarHBondContact O-N 3.1Å; E290-R293 CarbonylContact O-C 3.53Å; E290-R293 WeakPolarHBondContact O-CA 3.4Å; E290-R293 VanDerWaalsContact O-CB 3.3Å; E290-R293 WeakPolarHBondContact O-CB 3.26Å; E290-R293 PolarHBondContact O-N 2.6Å; E290-R293 VanDerWaalsContact O-N 3.08Å; E290-R293 VanDerWaalsContact OE1-CD 3.27Å; E290-R293 WeakPolarHBondContact OE1-CD 3.41Å; E290-R293 IonicContact OE1-CZ 3.52Å; E290-R293 IonicContact OE1-NE 2.75Å; E290-R293 IonicContact OE1-NH1 2.67Å; E290-R293 PolarHBondContact OE1-NH1 3.23Å; E290-R293 WeakPolarHBondContact OE2-CD 3.44Å; E290-R293 IonicContact OE2-NH1 3.89Å; E290-R293 PolarHBondContact OE2-NH1 3.47Å; R293-K295 VanDerWaalsContact C-N 3.33Å; R293-K295 PolarHBondContact O-N 3.38Å; R293-V296 CarbonylContact O-C 3.5Å; R293-V296 WeakPolarHBondContact O-CA 3.49Å; R293-V296 WeakPolarHBondContact O-CB 3.34Å; R293-V296 PolarHBondContact O-N 2.86Å; R293-V296 VanDerWaalsContact O-N 3.1Å; R293-N297 PolarHBondContact O-N 2.8Å; R293-N297 PolarHBondContact O-ND2 2.83Å; R293-N297 PolarHBondContact O-OD1 2.73Å
294D89.9Confident87.9Confident81 Ų8199.2 Ų99.243%0.43349%0.494SS..Hα-helixtrans-64.7-37.1174.8-79.3-22.4000112.3E290 V296 N297 Q298E290-D294 PolarHBondContact O-N 3.33Å; D294-V296 VanDerWaalsContact C-N 3.33Å; D294-V296 PolarHBondContact O-N 2.94Å; D294-N297 PolarHBondContact O-N 3.36Å; D294-N297 PolarHBondContact OD1-ND2 2.84Å; D294-Q298 WeakPolarHBondContact O-CB 3.38Å; D294-Q298 VanDerWaalsContact O-CG 3.29Å; D294-Q298 WeakPolarHBondContact O-CG 3.45Å; D294-Q298 PolarHBondContact O-N 2.71Å
295K89.8Confident87.6Confident97 Ų9799.9 Ų99.942%0.42250%0.497SS..Hα-helixtrans-62.4-39.6170.5-71.2162.7-172.3171.90111.7E291 S292 R293 L299E291-K295 VanDerWaalsContact CD-CE 3.45Å; E291-K295 WeakPolarHBondContact O-CD 3.3Å; E291-K295 VanDerWaalsContact O-CG 3.23Å; E291-K295 WeakPolarHBondContact O-CG 3.37Å; E291-K295 PolarHBondContact O-N 2.87Å; E291-K295 VanDerWaalsContact O-N 3.13Å; E291-K295 WeakPolarHBondContact OE1-CE 3.48Å; E291-K295 IonicContact OE1-NZ 3.35Å; E291-K295 PolarHBondContact OE1-NZ 3.39Å; E291-K295 IonicContact OE2-NZ 2.76Å; E291-K295 PolarHBondContact OE2-NZ 3.45Å; S292-K295 PolarHBondContact O-N 2.97Å; R293-K295 VanDerWaalsContact C-N 3.33Å; R293-K295 PolarHBondContact O-N 3.38Å; K295-L299 VanDerWaalsContact O-CG 3.26Å; K295-L299 WeakPolarHBondContact O-CG 3.38Å; K295-L299 PolarHBondContact O-N 3.19Å; K295-L299 VanDerWaalsContact O-N 3.1Å
296V86.6Confident87.1Confident86 Ų86100.4 Ų100.452%0.52150%0.496SS..Hα-helixtrans-66.1-46.1173.1169.20000111.4S292 R293 D294 Q298 L299 E300S292-V296 WeakPolarHBondContact O-CG2 3.45Å; S292-V296 PolarHBondContact O-N 2.87Å; R293-V296 CarbonylContact O-C 3.5Å; R293-V296 WeakPolarHBondContact O-CA 3.49Å; R293-V296 WeakPolarHBondContact O-CB 3.34Å; R293-V296 PolarHBondContact O-N 2.86Å; R293-V296 VanDerWaalsContact O-N 3.1Å; D294-V296 VanDerWaalsContact C-N 3.33Å; D294-V296 PolarHBondContact O-N 2.94Å; V296-Q298 VanDerWaalsContact C-N 3.35Å; V296-Q298 PolarHBondContact O-N 3.23Å; V296-L299 WeakPolarHBondContact O-CB 3.46Å; V296-L299 PolarHBondContact O-N 3.06Å; V296-L299 VanDerWaalsContact O-N 3.09Å; V296-E300 PolarHBondContact O-N 2.89Å
297N88.8Confident86.5Confident66 Ų66100 Ų10035%0.35350%0.496SS..Hα-helixtrans-56-48.3176.5-64.1-25.9000110.8R293 D294 L299 E300 E301R293-N297 PolarHBondContact O-N 2.8Å; R293-N297 PolarHBondContact O-ND2 2.83Å; R293-N297 PolarHBondContact O-OD1 2.73Å; D294-N297 PolarHBondContact O-N 3.36Å; D294-N297 PolarHBondContact OD1-ND2 2.84Å; N297-L299 VanDerWaalsContact C-N 3.32Å; N297-L299 PolarHBondContact O-N 3.2Å; N297-E300 PolarHBondContact O-N 2.89Å; N297-E301 PolarHBondContact O-N 2.99Å
298Q88.1Confident86.2Confident102 Ų10298.6 Ų98.648%0.47749%0.492SS..Hα-helixtrans-63.6-32.9176.7-72.7177.73100113.4D294 V296 K302D294-Q298 WeakPolarHBondContact O-CB 3.38Å; D294-Q298 VanDerWaalsContact O-CG 3.29Å; D294-Q298 WeakPolarHBondContact O-CG 3.45Å; D294-Q298 PolarHBondContact O-N 2.71Å; V296-Q298 VanDerWaalsContact C-N 3.35Å; V296-Q298 PolarHBondContact O-N 3.23Å; Q298-K302 WeakPolarHBondContact O-CB 3.38Å; Q298-K302 WeakPolarHBondContact O-CD 3.45Å; Q298-K302 WeakPolarHBondContact O-CG 3.4Å; Q298-K302 PolarHBondContact O-N 2.88Å
299L83.9Confident85.8Confident108 Ų10898.4 Ų98.457%0.56549%0.491SS*.Hα-helixtrans-72.4-38.4174-73.8169000111.3K295 V296 N297 K302 T303K295-L299 VanDerWaalsContact O-CG 3.26Å; K295-L299 WeakPolarHBondContact O-CG 3.38Å; K295-L299 PolarHBondContact O-N 3.19Å; K295-L299 VanDerWaalsContact O-N 3.1Å; V296-L299 WeakPolarHBondContact O-CB 3.46Å; V296-L299 PolarHBondContact O-N 3.06Å; V296-L299 VanDerWaalsContact O-N 3.09Å; N297-L299 VanDerWaalsContact C-N 3.32Å; N297-L299 PolarHBondContact O-N 3.2Å; L299-K302 PolarHBondContact O-N 3.43Å; L299-T303 WeakPolarHBondContact O-CB 3.38Å; L299-T303 PolarHBondContact O-N 3.33Å; L299-T303 PolarHBondContact O-OG1 2.91Å
300E87Confident85.4Confident96 Ų9698.4 Ų98.445%0.44949%0.491SS..Hα-helixtrans-65.5-42.4175.2-158.5-169.4129.800111.3V296 N297 T303 K304V296-E300 PolarHBondContact O-N 2.89Å; N297-E300 PolarHBondContact O-N 2.89Å; E300-T303 WeakPolarHBondContact O-CB 3.36Å; E300-T303 PolarHBondContact O-N 2.92Å; E300-K304 WeakPolarHBondContact O-CG 3.29Å; E300-K304 PolarHBondContact O-N 2.65Å; E300-K304 WeakPolarHBondContact OE1-CE 3.33Å; E300-K304 IonicContact OE1-NZ 3.98Å; E300-K304 PolarHBondContact OE1-NZ 2.94Å
301E84.5Confident85Confident133 Ų133100.1 Ų100.162%0.62150%0.497SS*.Hα-helixtrans-64.1-42.7172.9-73.5-167.4155.100112.8N297 T303 K304 L305N297-E301 PolarHBondContact O-N 2.99Å; E301-T303 VanDerWaalsContact C-N 3.27Å; E301-T303 PolarHBondContact O-N 3.21Å; E301-K304 PolarHBondContact O-N 3.49Å; E301-L305 WeakPolarHBondContact O-CB 3.44Å; E301-L305 PolarHBondContact O-N 2.73Å
302K85.1Confident84.6Confident115 Ų115100.7 Ų100.750%0.550%0.5SS..Hα-helixtrans-61-37.9173-76.2164.9-174161.90111.7Q298 L299 Q306Q298-K302 WeakPolarHBondContact O-CB 3.38Å; Q298-K302 WeakPolarHBondContact O-CD 3.45Å; Q298-K302 WeakPolarHBondContact O-CG 3.4Å; Q298-K302 PolarHBondContact O-N 2.88Å; L299-K302 PolarHBondContact O-N 3.43Å; K302-Q306 WeakPolarHBondContact O-CB 3.36Å; K302-Q306 VanDerWaalsContact O-CG 3.3Å; K302-Q306 WeakPolarHBondContact O-CG 3.45Å; K302-Q306 PolarHBondContact O-N 2.95Å
303T82.6Confident84.3Confident85 Ų85101.3 Ų101.352%0.52150%0.504SS..Hα-helixtrans-67.1-43.1175.6-56.10000111.4L299 E300 E301 Q306 S307L299-T303 WeakPolarHBondContact O-CB 3.38Å; L299-T303 PolarHBondContact O-N 3.33Å; L299-T303 PolarHBondContact O-OG1 2.91Å; E300-T303 WeakPolarHBondContact O-CB 3.36Å; E300-T303 PolarHBondContact O-N 2.92Å; E301-T303 VanDerWaalsContact C-N 3.27Å; E301-T303 PolarHBondContact O-N 3.21Å; T303-Q306 PolarHBondContact O-N 3.49Å; T303-S307 WeakPolarHBondContact O-CB 3.34Å; T303-S307 PolarHBondContact O-N 2.9Å
304K85.8Confident83.9Confident108 Ų10898.7 Ų98.747%0.4750%0.5SS..Hα-helixtrans-58.9-51.5173.1-72.5164.6-174.5163.80111E300 E301 Q306 S307 E308E300-K304 WeakPolarHBondContact O-CG 3.29Å; E300-K304 PolarHBondContact O-N 2.65Å; E300-K304 WeakPolarHBondContact OE1-CE 3.33Å; E300-K304 IonicContact OE1-NZ 3.98Å; E300-K304 PolarHBondContact OE1-NZ 2.94Å; E301-K304 PolarHBondContact O-N 3.49Å; K304-Q306 VanDerWaalsContact C-N 3.32Å; K304-Q306 PolarHBondContact O-N 2.89Å; K304-S307 PolarHBondContact O-N 3.5Å; K304-S307 PolarHBondContact O-OG 2.96Å; K304-E308 PolarHBondContact O-N 3.49Å
305L84.2Confident83.5Confident110 Ų11099.7 Ų99.758%0.57650%0.502SS*.Hα-helixtrans-60.9-38.2178.8-167.473.5000112.2E301 N309E301-L305 WeakPolarHBondContact O-CB 3.44Å; E301-L305 PolarHBondContact O-N 2.73Å; L305-N309 WeakPolarHBondContact O-CB 3.21Å; L305-N309 PolarHBondContact O-N 2.92Å; L305-N309 PolarHBondContact O-ND2 3.25Å
306Q79.1Confident83.1Confident130 Ų130100.5 Ų100.561%0.60751%0.505SS*.Hα-helixtrans-66.1-41.9172.5-78179.1-14.200112.1K302 T303 K304 E308 N309 L310K302-Q306 WeakPolarHBondContact O-CB 3.36Å; K302-Q306 VanDerWaalsContact O-CG 3.3Å; K302-Q306 WeakPolarHBondContact O-CG 3.45Å; K302-Q306 PolarHBondContact O-N 2.95Å; T303-Q306 PolarHBondContact O-N 3.49Å; K304-Q306 VanDerWaalsContact C-N 3.32Å; K304-Q306 PolarHBondContact O-N 2.89Å; Q306-E308 VanDerWaalsContact C-N 3.33Å; Q306-E308 PolarHBondContact O-N 3.22Å; Q306-N309 PolarHBondContact O-N 3.36Å; Q306-L310 WeakPolarHBondContact O-CB 3.34Å; Q306-L310 PolarHBondContact O-N 3.35Å
307S78.8Confident82.7Confident70 Ų70102.4 Ų102.449%0.4951%0.508SS..Hα-helixtrans-64.9-35.3177.1770000112.7T303 K304 L310 K311T303-S307 WeakPolarHBondContact O-CB 3.34Å; T303-S307 PolarHBondContact O-N 2.9Å; K304-S307 PolarHBondContact O-N 3.5Å; K304-S307 PolarHBondContact O-OG 2.96Å; S307-L310 WeakPolarHBondContact O-CB 3.33Å; S307-L310 PolarHBondContact O-N 2.77Å; S307-K311 WeakPolarHBondContact O-CB 3.49Å; S307-K311 PolarHBondContact O-N 3.33Å
308E84.2Confident82.1Confident121 Ų121105.3 Ų105.357%0.56552%0.52SS*.Hα-helixtrans-76.1-37.3178.1-170143.4-125.600112K304 Q306 K311 Q312K304-E308 PolarHBondContact O-N 3.49Å; Q306-E308 VanDerWaalsContact C-N 3.33Å; Q306-E308 PolarHBondContact O-N 3.22Å; E308-K311 PolarHBondContact O-N 3.32Å; E308-Q312 WeakPolarHBondContact O-CB 3.36Å; E308-Q312 PolarHBondContact O-N 3.34Å
309N81.3Confident81.6Confident93 Ų93106 Ų10650%0.49752%0.523SS..Hα-helixtrans-62.9-40168.6-80-59.6000112.2L305 Q306 Q312 S313L305-N309 WeakPolarHBondContact O-CB 3.21Å; L305-N309 PolarHBondContact O-N 2.92Å; L305-N309 PolarHBondContact O-ND2 3.25Å; Q306-N309 PolarHBondContact O-N 3.36Å; N309-Q312 PolarHBondContact O-N 3.05Å; N309-S313 WeakPolarHBondContact O-CB 3.44Å; N309-S313 PolarHBondContact O-N 3.39Å
310L78.8Confident81.3Confident112 Ų112106.2 Ų106.259%0.58652%0.524SS*.Hα-helixtrans-60.5-48.3172.7-89.1160.9000111.3Q306 S307 Q312 S313 I314Q306-L310 WeakPolarHBondContact O-CB 3.34Å; Q306-L310 PolarHBondContact O-N 3.35Å; S307-L310 WeakPolarHBondContact O-CB 3.33Å; S307-L310 PolarHBondContact O-N 2.77Å; L310-Q312 PolarHBondContact O-N 3.2Å; L310-S313 WeakPolarHBondContact O-CB 3.12Å; L310-S313 PolarHBondContact O-N 3.38Å; L310-S313 VanDerWaalsContact O-N 3.17Å; L310-I314 WeakPolarHBondContact O-CG1 3.3Å; L310-I314 PolarHBondContact O-N 3.23Å
311K84.1Confident80.7Confident115 Ų115105.5 Ų105.550%0.553%0.526SS..Hα-helixtrans-56.6-48.8175-177.8-170.3169.4-159.40111.7S307 E308 S313 I314 E315S307-K311 WeakPolarHBondContact O-CB 3.49Å; S307-K311 PolarHBondContact O-N 3.33Å; E308-K311 PolarHBondContact O-N 3.32Å; K311-S313 VanDerWaalsContact C-N 3.27Å; K311-S313 PolarHBondContact O-N 3.35Å; K311-I314 WeakPolarHBondContact O-CB 3.33Å; K311-I314 PolarHBondContact O-N 2.99Å; K311-I314 VanDerWaalsContact O-N 3.12Å; K311-E315 WeakPolarHBondContact CE-OE1 3.49Å; K311-E315 IonicContact NZ-OE1 3.37Å; K311-E315 WeakPolarHBondContact O-CG 3.45Å; K311-E315 PolarHBondContact O-N 3.23Å
312Q80.4Confident80.5Confident92 Ų92105.9 Ų105.943%0.4353%0.526SS..Hα-helixtrans-66.4-28.7179.1-159.1-168.492.500112.4E308 N309 L310 K316E308-Q312 WeakPolarHBondContact O-CB 3.36Å; E308-Q312 PolarHBondContact O-N 3.34Å; N309-Q312 PolarHBondContact O-N 3.05Å; L310-Q312 PolarHBondContact O-N 3.2Å; Q312-K316 WeakPolarHBondContact O-CD 3.36Å; Q312-K316 VanDerWaalsContact O-CG 3.28Å; Q312-K316 WeakPolarHBondContact O-CG 3.45Å; Q312-K316 PolarHBondContact O-N 2.92Å; Q312-K316 VanDerWaalsContact O-N 3.13Å
313S77.5Confident80Confident69 Ų69104.5 Ų104.548%0.48352%0.521SS..Hα-helixtrans-71.1-37.7171.5-166.50000112.3N309 L310 K311 K316 Q317N309-S313 WeakPolarHBondContact O-CB 3.44Å; N309-S313 PolarHBondContact O-N 3.39Å; L310-S313 WeakPolarHBondContact O-CB 3.12Å; L310-S313 PolarHBondContact O-N 3.38Å; L310-S313 VanDerWaalsContact O-N 3.17Å; K311-S313 VanDerWaalsContact C-N 3.27Å; K311-S313 PolarHBondContact O-N 3.35Å; S313-K316 PolarHBondContact O-N 3.4Å; S313-Q317 PolarHBondContact O-N 3.25Å
314I80.9Confident79.8Confident83 Ų83106 Ų10643%0.42653%0.525SS..Hα-helixtrans-66.6-41.5174.7-69.6161.9000110.4L310 K311 K316 Q317 H318L310-I314 WeakPolarHBondContact O-CG1 3.3Å; L310-I314 PolarHBondContact O-N 3.23Å; K311-I314 WeakPolarHBondContact O-CB 3.33Å; K311-I314 PolarHBondContact O-N 2.99Å; K311-I314 VanDerWaalsContact O-N 3.12Å; I314-K316 PolarHBondContact O-N 3.39Å; I314-Q317 WeakPolarHBondContact O-CB 3.3Å; I314-Q317 PolarHBondContact O-N 2.93Å; I314-H318 PolarHBondContact O-CD2 3.43Å; I314-H318 PolarHBondContact O-N 2.68Å
315E81.9Confident79.5Confident103 Ų103104.7 Ų104.748%0.48152%0.521SS..Hα-helixtrans-60.7-42.5173.8-72.3168.3175.100111.9K311 H318 H319K311-E315 WeakPolarHBondContact CE-OE1 3.49Å; K311-E315 IonicContact NZ-OE1 3.37Å; K311-E315 WeakPolarHBondContact O-CG 3.45Å; K311-E315 PolarHBondContact O-N 3.23Å; E315-H318 PolarHBondContact O-N 2.89Å; E315-H319 PolarHBondContact O-N 3.47Å
316K82.3Confident79.1Confident114 Ų114103.6 Ų103.650%0.49652%0.516SS..Hα-helixtrans-63.8-39.2172.7-71.5165-169.9166.10112.5Q312 S313 I314 H319 L320Q312-K316 WeakPolarHBondContact O-CD 3.36Å; Q312-K316 VanDerWaalsContact O-CG 3.28Å; Q312-K316 WeakPolarHBondContact O-CG 3.45Å; Q312-K316 PolarHBondContact O-N 2.92Å; Q312-K316 VanDerWaalsContact O-N 3.13Å; S313-K316 PolarHBondContact O-N 3.4Å; I314-K316 PolarHBondContact O-N 3.39Å; K316-H319 WeakPolarHBondContact O-CB 3.48Å; K316-H319 PolarHBondContact O-N 3.37Å; K316-L320 WeakPolarHBondContact O-CG 3.48Å; K316-L320 PolarHBondContact O-N 3.37Å
317Q77.1Confident79Confident125 Ų125103.1 Ų103.158%0.58452%0.516SS*.Hα-helixtrans-63.5-40.5174.9-175178.4-5.500111.6S313 I314 T321S313-Q317 PolarHBondContact O-N 3.25Å; I314-Q317 WeakPolarHBondContact O-CB 3.3Å; I314-Q317 PolarHBondContact O-N 2.93Å; Q317-T321 WeakPolarHBondContact O-CB 3.38Å; Q317-T321 PolarHBondContact O-N 3.38Å; Q317-T321 PolarHBondContact O-OG1 2.88Å
318H75.8Confident79Confident128 Ų128105 Ų10559%0.59352%0.515SS*.Hα-helixtrans-65.4-37.3173.9-76.9-63.2000112.8I314 E315 T321 K322I314-H318 PolarHBondContact O-CD2 3.43Å; I314-H318 PolarHBondContact O-N 2.68Å; E315-H318 PolarHBondContact O-N 2.89Å; H318-T321 PolarHBondContact O-N 3.05Å; H318-K322 PolarHBondContact O-N 2.89Å
319H77.6Confident78.5Confident115 Ų115102.1 Ų102.153%0.53251%0.506SS..Hα-helixtrans-59.4-53.8173.7-166.1-76.4000111.5E315 K316 T321 K322 E323E315-H319 PolarHBondContact O-N 3.47Å; K316-H319 WeakPolarHBondContact O-CB 3.48Å; K316-H319 PolarHBondContact O-N 3.37Å; H319-T321 VanDerWaalsContact C-N 3.29Å; H319-T321 PolarHBondContact O-N 2.76Å; H319-K322 WeakPolarHBondContact O-CB 3.45Å; H319-K322 PolarHBondContact O-N 3.23Å; H319-E323 IonicContact CE1-OE1 2.72Å; H319-E323 PolarHBondContact CE1-OE1 3.49Å; H319-E323 IonicContact CE1-OE2 2.66Å; H319-E323 PolarHBondContact CE1-OE2 3.13Å; H319-E323 IonicContact CG-OE2 3.93Å; H319-E323 IonicContact ND1-OE1 3.49Å; H319-E323 IonicContact ND1-OE2 3.66Å; H319-E323 PolarHBondContact ND1-OE2 3.49Å; H319-E323 PolarHBondContact O-N 3.3Å
320L78.1Confident78.1Confident114 Ų114100.7 Ų100.760%0.59750%0.503SS*.Hα-helixtrans-60.9-36.7178.7-69.4167.6000112.5K316 K322 L324K316-L320 WeakPolarHBondContact O-CG 3.48Å; K316-L320 PolarHBondContact O-N 3.37Å; L320-K322 VanDerWaalsContact C-N 3.33Å; L320-L324 VanDerWaalsContact O-CB 3.32Å; L320-L324 WeakPolarHBondContact O-CB 3.25Å; L320-L324 PolarHBondContact O-N 3.45Å
321T74.4Confident77.9Confident81 Ų81100.5 Ų100.550%0.49750%0.502SS..Hα-helixtrans-65.4-37.8175.6-54.40000111.4Q317 H318 H319 E325Q317-T321 WeakPolarHBondContact O-CB 3.38Å; Q317-T321 PolarHBondContact O-N 3.38Å; Q317-T321 PolarHBondContact O-OG1 2.88Å; H318-T321 PolarHBondContact O-N 3.05Å; H319-T321 VanDerWaalsContact C-N 3.29Å; H319-T321 PolarHBondContact O-N 2.76Å; T321-E325 PolarHBondContact O-N 3.2Å
322K80.1Confident77.5Confident141 Ų141101.4 Ų101.461%0.61351%0.508SS*.Hα-helixtrans-68.5-47.9176.1-173.2-168.4171-1660111.6H318 H319 L320 L324 E325 D326H318-K322 PolarHBondContact O-N 2.89Å; H319-K322 WeakPolarHBondContact O-CB 3.45Å; H319-K322 PolarHBondContact O-N 3.23Å; L320-K322 VanDerWaalsContact C-N 3.33Å; K322-L324 VanDerWaalsContact C-N 3.28Å; K322-L324 PolarHBondContact O-N 3.3Å; K322-E325 PolarHBondContact O-N 2.81Å; K322-E325 VanDerWaalsContact O-N 3.08Å; K322-D326 PolarHBondContact O-N 3.17Å
323E76.1Confident77.1Confident86 Ų86104.4 Ų104.440%0.40252%0.516SS..Hα-helixtrans-58.6-40.4177.6-70.4172.9119.700111.8H319 E325 D326 I327H319-E323 IonicContact CE1-OE1 2.72Å; H319-E323 PolarHBondContact CE1-OE1 3.49Å; H319-E323 IonicContact CE1-OE2 2.66Å; H319-E323 PolarHBondContact CE1-OE2 3.13Å; H319-E323 IonicContact CG-OE2 3.93Å; H319-E323 IonicContact ND1-OE1 3.49Å; H319-E323 IonicContact ND1-OE2 3.66Å; H319-E323 PolarHBondContact ND1-OE2 3.49Å; H319-E323 PolarHBondContact O-N 3.3Å; E323-E325 VanDerWaalsContact C-N 3.33Å; E323-E325 PolarHBondContact O-N 3.3Å; E323-D326 PolarHBondContact O-N 2.92Å; E323-I327 WeakPolarHBondContact O-CB 3.33Å; E323-I327 VanDerWaalsContact O-CG1 3.26Å; E323-I327 WeakPolarHBondContact O-CG1 3.35Å; E323-I327 PolarHBondContact O-N 3.46Å
324L76.6Confident76.7Confident115 Ų115103.8 Ų103.860%0.60251%0.511SS*.Hα-helixtrans-64.4-36.5176-173.2145.4000112.3L320 K322 K328L320-L324 VanDerWaalsContact O-CB 3.32Å; L320-L324 WeakPolarHBondContact O-CB 3.25Å; L320-L324 PolarHBondContact O-N 3.45Å; K322-L324 VanDerWaalsContact C-N 3.28Å; K322-L324 PolarHBondContact O-N 3.3Å; L324-K328 WeakPolarHBondContact O-CB 3.38Å; L324-K328 PolarHBondContact O-N 2.82Å
325E79.8Confident76.3Confident81 Ų81103.4 Ų103.438%0.37951%0.513SS..Hα-helixtrans-72.4-40175-166.860-144.300112.2T321 K322 E323 I327 K328 V329T321-E325 PolarHBondContact O-N 3.2Å; K322-E325 PolarHBondContact O-N 2.81Å; K322-E325 VanDerWaalsContact O-N 3.08Å; E323-E325 VanDerWaalsContact C-N 3.33Å; E323-E325 PolarHBondContact O-N 3.3Å; E325-I327 VanDerWaalsContact C-N 3.35Å; E325-I327 PolarHBondContact O-N 2.83Å; E325-K328 WeakPolarHBondContact O-CB 3.34Å; E325-K328 PolarHBondContact O-N 2.88Å; E325-K328 IonicContact OE1-NZ 2.63Å; E325-K328 PolarHBondContact OE1-NZ 2.96Å; E325-K328 IonicContact OE2-NZ 2.67Å; E325-K328 PolarHBondContact OE2-NZ 3.02Å; E325-V329 WeakPolarHBondContact O-CG2 3.35Å; E325-V329 PolarHBondContact O-N 3.41Å
326D76.4Confident75.7Confident88 Ų88102 Ų10247%0.47151%0.514SS..Hα-helixtrans-63.8-38175.1-78-36.7000111.8K322 E323 S330K322-D326 PolarHBondContact O-N 3.17Å; E323-D326 PolarHBondContact O-N 2.92Å; D326-S330 WeakPolarHBondContact O-CB 3.46Å; D326-S330 PolarHBondContact O-N 3.34Å; D326-S330 PolarHBondContact O-OG 3.12Å
327I77.5Confident74.9Confident119 Ų119100.7 Ų100.761%0.6152%0.516SS*.Hα-helixtrans-65.6-44.5171.4-70166000110.9E323 E325 S330 L331E323-I327 WeakPolarHBondContact O-CB 3.33Å; E323-I327 VanDerWaalsContact O-CG1 3.26Å; E323-I327 WeakPolarHBondContact O-CG1 3.35Å; E323-I327 PolarHBondContact O-N 3.46Å; E325-I327 VanDerWaalsContact C-N 3.35Å; E325-I327 PolarHBondContact O-N 2.83Å; I327-S330 WeakPolarHBondContact O-CB 3.39Å; I327-S330 PolarHBondContact O-N 3.17Å; I327-S330 VanDerWaalsContact O-N 3.14Å; I327-L331 PolarHBondContact O-N 3.27Å
328K77.6Confident74.4Confident109 Ų109100.8 Ų100.847%0.47452%0.516SS..Hα-helixtrans-62.3-41.8178.2167.8165.4160.6-89.40112.4L324 E325 S330 L331 Q332L324-K328 WeakPolarHBondContact O-CB 3.38Å; L324-K328 PolarHBondContact O-N 2.82Å; E325-K328 WeakPolarHBondContact O-CB 3.34Å; E325-K328 PolarHBondContact O-N 2.88Å; E325-K328 IonicContact OE1-NZ 2.63Å; E325-K328 PolarHBondContact OE1-NZ 2.96Å; E325-K328 IonicContact OE2-NZ 2.67Å; E325-K328 PolarHBondContact OE2-NZ 3.02Å; K328-S330 VanDerWaalsContact C-N 3.32Å; K328-L331 PolarHBondContact O-N 2.85Å; K328-Q332 WeakPolarHBondContact O-CB 2.73Å; K328-Q332 PolarHBondContact O-N 3.17Å
329V74.2Confident74.2Confident62 Ų62101.3 Ų101.338%0.37652%0.517SS..Hα-helixtrans-64.7-36.8172.6169.10000111.5E325 R333E325-V329 WeakPolarHBondContact O-CG2 3.35Å; E325-V329 PolarHBondContact O-N 3.41Å; V329-R333 PolarHBondContact O-N 2.97Å; V329-R333 VanDerWaalsContact O-N 3.13Å
330S72.9Confident73.7Confident63 Ų6398.3 Ų98.344%0.44151%0.512SS..Hα-helixtrans-68.9-40.8177.1-59.60000112.3D326 I327 K328 R333 S334D326-S330 WeakPolarHBondContact O-CB 3.46Å; D326-S330 PolarHBondContact O-N 3.34Å; D326-S330 PolarHBondContact O-OG 3.12Å; I327-S330 WeakPolarHBondContact O-CB 3.39Å; I327-S330 PolarHBondContact O-N 3.17Å; I327-S330 VanDerWaalsContact O-N 3.14Å; K328-S330 VanDerWaalsContact C-N 3.32Å; S330-R333 WeakPolarHBondContact O-CB 3.2Å; S330-R333 PolarHBondContact O-N 3.11Å; S330-S334 PolarHBondContact O-N 2.92Å
331L73.9Confident73.3Confident108 Ų10898.6 Ų98.657%0.56551%0.513SS*.Hα-helixtrans-65.6-41174.1-176.664.3000112.2I327 K328 R333 S334 V335I327-L331 PolarHBondContact O-N 3.27Å; K328-L331 PolarHBondContact O-N 2.85Å; L331-R333 PolarHBondContact O-N 3.11Å; L331-S334 PolarHBondContact O-N 2.95Å; L331-S334 PolarHBondContact O-OG 3.46Å; L331-V335 WeakPolarHBondContact O-CG2 3.34Å; L331-V335 PolarHBondContact O-N 3.49Å
332Q76.1Confident73.2Confident133 Ų133100.6 Ų100.662%0.62152%0.517SS*.Hα-helixtrans-58.6-37.2173.5-170.669.621.400111.5K328 S336K328-Q332 WeakPolarHBondContact O-CB 2.73Å; K328-Q332 PolarHBondContact O-N 3.17Å; Q332-S336 PolarHBondContact O-N 2.91Å; Q332-S336 PolarHBondContact O-OG 2.97Å
333R73.5Confident72.7Confident156 Ų15699.4 Ų99.459%0.58951%0.514SS*.Hα-helixtrans-70.2-42.7177.5-164179.5-63.81332.7112V329 S330 L331 S336 T337V329-R333 PolarHBondContact O-N 2.97Å; V329-R333 VanDerWaalsContact O-N 3.13Å; S330-R333 WeakPolarHBondContact O-CB 3.2Å; S330-R333 PolarHBondContact O-N 3.11Å; L331-R333 PolarHBondContact O-N 3.11Å; R333-S336 WeakPolarHBondContact O-CB 2.95Å; R333-S336 PolarHBondContact O-N 3.48Å; R333-T337 PolarHBondContact O-N 3.41Å; R333-T337 VanDerWaalsContact O-N 3.13Å; R333-T337 PolarHBondContact O-OG1 3.29Å
334S68.6Low72.2Confident55 Ų55100.1 Ų100.139%0.38552%0.52SS..Hα-helixtrans-68.4-38.4178.462.90000113S330 L331 S336 T337 Q338S330-S334 PolarHBondContact O-N 2.92Å; L331-S334 PolarHBondContact O-N 2.95Å; L331-S334 PolarHBondContact O-OG 3.46Å; S334-S336 VanDerWaalsContact C-N 3.26Å; S334-S336 PolarHBondContact O-N 2.96Å; S334-T337 WeakPolarHBondContact CA-OG1 3.33Å; S334-T337 PolarHBondContact O-N 3.34Å; S334-T337 PolarHBondContact O-OG1 3.4Å; S334-Q338 WeakPolarHBondContact O-CB 3.47Å; S334-Q338 PolarHBondContact O-N 2.78Å
335V71.3Confident71.8Confident76 Ų76100.2 Ų100.246%0.46152%0.521SS..Hα-helixtrans-61-37.3172.7170.50000111.1L331 Q338 K339L331-V335 WeakPolarHBondContact O-CG2 3.34Å; L331-V335 PolarHBondContact O-N 3.49Å; V335-Q338 PolarHBondContact O-N 3.17Å; V335-K339 PolarHBondContact O-N 2.89Å
336S69Low71.2Confident73 Ų73103.1 Ų103.151%0.5153%0.534SS..Hα-helixtrans-65.9-40.5176-560000112.3Q332 R333 S334Q332-S336 PolarHBondContact O-N 2.91Å; Q332-S336 PolarHBondContact O-OG 2.97Å; R333-S336 WeakPolarHBondContact O-CB 2.95Å; R333-S336 PolarHBondContact O-N 3.48Å; S334-S336 VanDerWaalsContact C-N 3.26Å; S334-S336 PolarHBondContact O-N 2.96Å
337T67.5Low70.8Confident87 Ų87104.1 Ų104.153%0.53454%0.539SS..Hα-helixtrans-71.8-33.2175.547.90000113.4R333 S334 K339 A340 L341R333-T337 PolarHBondContact O-N 3.41Å; R333-T337 VanDerWaalsContact O-N 3.13Å; R333-T337 PolarHBondContact O-OG1 3.29Å; S334-T337 WeakPolarHBondContact CA-OG1 3.33Å; S334-T337 PolarHBondContact O-N 3.34Å; S334-T337 PolarHBondContact O-OG1 3.4Å; T337-K339 VanDerWaalsContact C-N 3.31Å; T337-K339 PolarHBondContact O-N 2.88Å; T337-A340 PolarHBondContact O-N 3.41Å; T337-L341 PolarHBondContact O-N 2.94Å
338Q65.8Low69.9Low127 Ų127101.1 Ų101.159%0.59353%0.531SS*.Hα-helixtrans-63.4-39.3176.7-175.7174.5-2.700111.3S334 V335 A340 L341 E342S334-Q338 WeakPolarHBondContact O-CB 3.47Å; S334-Q338 PolarHBondContact O-N 2.78Å; V335-Q338 PolarHBondContact O-N 3.17Å; Q338-A340 PolarHBondContact O-N 3.43Å; Q338-L341 PolarHBondContact O-N 2.83Å; Q338-E342 PolarHBondContact O-N 3.04Å
339K70.6Confident69.3Low139 Ų13999.7 Ų99.760%0.60453%0.532SS*.Hα-helixtrans-65.6-36.7-179.8-164.9176.6178.7-173.90113.4V335 T337 E342 E343V335-K339 PolarHBondContact O-N 2.89Å; T337-K339 VanDerWaalsContact C-N 3.31Å; T337-K339 PolarHBondContact O-N 2.88Å; K339-E342 PolarHBondContact O-N 3.11Å; K339-E343 PolarHBondContact O-N 3.37Å
340A67.7Low68.9Low51 Ų51104.8 Ų104.842%0.42155%0.549SS..Hα-helixtrans-64.7-43176.800000112.3T337 Q338 E342 E343 D344T337-A340 PolarHBondContact O-N 3.41Å; Q338-A340 PolarHBondContact O-N 3.43Å; A340-E342 PolarHBondContact O-N 3.18Å; A340-E343 PolarHBondContact O-N 2.97Å; A340-D344 PolarHBondContact O-N 2.86Å; A340-D344 VanDerWaalsContact O-N 3.14Å
341L69.4Low68.1Low121 Ų121105.8 Ų105.863%0.63455%0.552SS**Hα-helixtrans-64.1-28.3178.5-73.5166.6000113.2T337 Q338 L345T337-L341 PolarHBondContact O-N 2.94Å; Q338-L341 PolarHBondContact O-N 2.83Å; L341-L345 WeakPolarHBondContact O-CB 3.19Å; L341-L345 PolarHBondContact O-N 2.86Å
342E72.1Confident67.5Low123 Ų123106.1 Ų106.158%0.57555%0.554SS**Hα-helixtrans-77.6-30.6177-164.7166.3174.700112.3Q338 K339 A340 Q346Q338-E342 PolarHBondContact O-N 3.04Å; K339-E342 PolarHBondContact O-N 3.11Å; A340-E342 PolarHBondContact O-N 3.18Å; E342-Q346 PolarHBondContact O-N 3.23Å
343E69.3Low66.3Low115 Ų115104 Ų10454%0.53755%0.553SS.*Hα-helixtrans-68.6-43.1172.3-69.7173.3-168.800111.2K339 A340 L345 Q346 I347K339-E343 PolarHBondContact O-N 3.37Å; A340-E343 PolarHBondContact O-N 2.97Å; E343-L345 VanDerWaalsContact C-N 3.33Å; E343-L345 PolarHBondContact O-N 2.69Å; E343-Q346 PolarHBondContact O-N 3.04Å; E343-I347 WeakPolarHBondContact O-CG1 3.34Å; E343-I347 PolarHBondContact O-N 3.17Å
344D65.9Low65.3Low102 Ų102104 Ų10455%0.54556%0.559SS.*Hα-helixtrans-60.9-37.9174-76.9-31.4000112.9A340 I347 A348A340-D344 PolarHBondContact O-N 2.86Å; A340-D344 VanDerWaalsContact O-N 3.14Å; D344-I347 WeakPolarHBondContact O-CB 3.39Å; D344-I347 PolarHBondContact O-N 3.26Å; D344-A348 PolarHBondContact O-N 2.66Å
345L68.5Low64.6Low116 Ų116107.2 Ų107.261%0.60757%0.571SS**Hα-helixtrans-70-33.7-177.9-148.7158.2000111.8L341 E343 I347 T349L341-L345 WeakPolarHBondContact O-CB 3.19Å; L341-L345 PolarHBondContact O-N 2.86Å; E343-L345 VanDerWaalsContact C-N 3.33Å; E343-L345 PolarHBondContact O-N 2.69Å; L345-I347 VanDerWaalsContact C-N 3.34Å; L345-T349 WeakPolarHBondContact O-CB 3.28Å; L345-T349 PolarHBondContact O-N 2.94Å; L345-T349 VanDerWaalsContact O-N 3.16Å; L345-T349 PolarHBondContact O-OG1 3.31Å
346Q66.6Low63.7Low142 Ų142107.7 Ų107.766%0.66458%0.575SS**Hα-helixtrans-65.6-35.6170.1-70.9-166.39.500112.7E342 E343 K350E342-Q346 PolarHBondContact O-N 3.23Å; E343-Q346 PolarHBondContact O-N 3.04Å; Q346-K350 PolarHBondContact O-N 2.98Å
347I68.5Low62.7Low110 Ų110111.9 Ų111.956%0.56459%0.586SS**Hα-helixtrans-66-50.1177.3-65.3167.8000110.1E343 D344 L345 T349 K350 T351E343-I347 WeakPolarHBondContact O-CG1 3.34Å; E343-I347 PolarHBondContact O-N 3.17Å; D344-I347 WeakPolarHBondContact O-CB 3.39Å; D344-I347 PolarHBondContact O-N 3.26Å; L345-I347 VanDerWaalsContact C-N 3.34Å; I347-T349 VanDerWaalsContact C-N 3.32Å; I347-T349 PolarHBondContact O-N 3Å; I347-K350 WeakPolarHBondContact O-CB 3.41Å; I347-K350 PolarHBondContact O-N 3.5Å; I347-K350 VanDerWaalsContact O-N 3.14Å; I347-T351 PolarHBondContact O-OG1 2.77Å
348A59.3Low61.8Low55 Ų55115.4 Ų115.446%0.45560%0.597SS.*Hα-helixtrans-58.7-41.3179.300000113D344 K350 T351D344-A348 PolarHBondContact O-N 2.66Å; A348-K350 PolarHBondContact O-N 3.14Å; A348-T351 PolarHBondContact O-N 3.3Å
349T65.4Low61.1Low80 Ų80116.7 Ų116.749%0.49160%0.6SS.*Hα-helixtrans-62-32.1179.1-56.30000112.4L345 I347L345-T349 WeakPolarHBondContact O-CB 3.28Å; L345-T349 PolarHBondContact O-N 2.94Å; L345-T349 VanDerWaalsContact O-N 3.16Å; L345-T349 PolarHBondContact O-OG1 3.31Å; I347-T349 VanDerWaalsContact C-N 3.32Å; I347-T349 PolarHBondContact O-N 3Å
350K65.6Low60Low169 Ų169117.6 Ų117.674%0.73561%0.607SS**Hα-helixtrans-75-31-176.2-152.7169.4-171.9173.60113.3Q346 I347 A348Q346-K350 PolarHBondContact O-N 2.98Å; I347-K350 WeakPolarHBondContact O-CB 3.41Å; I347-K350 PolarHBondContact O-N 3.5Å; I347-K350 VanDerWaalsContact O-N 3.14Å; A348-K350 PolarHBondContact O-N 3.14Å
351T56.6Low58.9Low83 Ų83121.2 Ų121.251%0.50962%0.624SS.*Hα-helixtrans-74.9-31.6-179.8-440000112.6I347 A348 C353 Q354I347-T351 PolarHBondContact O-OG1 2.77Å; A348-T351 PolarHBondContact O-N 3.3Å; T351-C353 VanDerWaalsContact C-N 3.29Å; T351-C353 PolarHBondContact O-N 3.23Å; T351-Q354 PolarHBondContact O-N 2.85Å
352I60.9Low57.6Low116 Ų116123.1 Ų123.160%0.59563%0.629SS**Hα-helixtrans-64.6-35-178.1-67.8170000111.5Q354 L355I352-Q354 PolarHBondContact O-N 3.47Å; I352-Q354 VanDerWaalsContact O-N 3.12Å; I352-L355 PolarHBondContact O-N 2.96Å
353C50.6Low56Low89 Ų89124.5 Ų124.560%0.60164%0.637SS**THydrogen-bonded Turntrans-69-8.1-175.9-61.10000114.8T351T351-C353 VanDerWaalsContact C-N 3.29Å; T351-C353 PolarHBondContact O-N 3.23Å
354Q52.1Low54.9Low154 Ų154127.4 Ų127.472%0.7265%0.651SS**THydrogen-bonded Turntrans-99-10.9-179.7-66.4-172.7-43.800114.1T351 I352T351-Q354 PolarHBondContact O-N 2.85Å; I352-Q354 PolarHBondContact O-N 3.47Å; I352-Q354 VanDerWaalsContact O-N 3.12Å
355L53.8Low53.6Low123 Ų123131.4 Ų131.464%0.64467%0.667SS**SBendtrans-103.8-4.4-177.3-72.8167.6000113.6I352I352-L355 PolarHBondContact O-N 2.96Å
356T53.1Low52Low87 Ų87131.3 Ų131.353%0.53468%0.675SS.*SBendtrans-78.4-38.3179.9-44.20000112.2E358T356-E358 VanDerWaalsContact C-N 3.28Å; T356-E358 PolarHBondContact O-N 2.93Å
357E46.8Very low50.4Low160 Ų160130.7 Ų130.775%0.74868%0.677SS**THydrogen-bonded Turntrans-66.9-24.5-173.9-59.7-174.7143.300113.7
358E48.8Very low48.5Very low161 Ų161135.3 Ų135.375%0.75269%0.693SS**THydrogen-bonded Turntrans-86.8-10.3-172.4-158.5171.7-136.100113.9T356T356-E358 VanDerWaalsContact C-N 3.28Å; T356-E358 PolarHBondContact O-N 2.93Å
359K52.4Low47Very low154 Ų154137.5 Ų137.567%0.6771%0.711SS**SBendtrans-102.7-13.3-174.7-103.3-69.7170.5-166.30115.8
360E47.1Very low45.5Very low159 Ų159144.3 Ų144.374%0.74373%0.728SS**G310 helixtrans-87-15.5-167.5-158.9151.9-147.600113.7
361T45.1Very low43.6Very low126 Ų126140.8 Ų140.877%0.77373%0.73SS**G310 helixtrans-86.8-3.5-173.651.80000115.9
362Q40.9Very low42.2Very low161 Ų161141 Ų14175%0.75274%0.74SS**G310 helixtrans-110.36.3-173.5-147-174.217.100115
363M39Very low40.7Very low152 Ų152143.8 Ų143.875%0.74975%0.75SS**SBendtrans-101.5-10.7-172.8-158.1167.4-67.600115E365M363-E365 PolarHBondContact O-N 3.37Å
364E46.7Very low40Very low177 Ų177144.2 Ų144.283%0.82775%0.754SS**G310 helixtrans-71.3-25.1-172-159.463.1-152.400114.1
365E37Very low39Very low186 Ų186146 Ų14687%0.86976%0.76SS**G310 helixtrans-81.2-22.2-160.2-164.1166.4-145.900115.3M363M363-E365 PolarHBondContact O-N 3.37Å
366S35.8Very low38Very low113 Ų113144.5 Ų144.579%0.7976%0.756SS**G310 helixtrans-90.2-12.3-166.1-152.10000115.6K368S366-K368 PolarHBondContact O-N 3.12Å
367N33.2Very low37.9Very low130 Ų130144.7 Ų144.770%0.69576%0.757SS**THydrogen-bonded Turntrans-83.87.9-165.4-97.1-50.5000116.6
368K29Very low37.5Very low206 Ų206142.6 Ų142.690%0.89676%0.755SS**THydrogen-bonded Turntrans-133.926.8-167.1-141171.7-174.8173.80118.2S366S366-K368 PolarHBondContact O-N 3.12Å
369A27.3Very low36.8Very low101 Ų101141.7 Ų141.784%0.83575%0.751SS**  trans-124.570.8170.200000112.1
370R34.1Very low35.9Very low223 Ų223142.5 Ų142.584%0.84275%0.754SS**  trans-130.457.7-172.6-179.6163.743.7121.1-6.6112.6
371A25.4Very low35.2Very low96 Ų96142.6 Ų142.679%0.79376%0.755SS**  trans-164.5154.7169.800000111.2
372A27.3Very low34.7Very low86 Ų86141.7 Ų141.771%0.71175%0.749SS**  trans64.3123.1172.200000116.5
373H30.1Very low34.7Very low175 Ų175138.4 Ų138.481%0.8174%0.74SS**  cis-141.3157.3-9.8-74.3-83.6000107.9
374S35.2Very low35.2Very low99 Ų99136.2 Ų136.269%0.69274%0.735SS**  cis79.638.416.3-161.80000117.8
375F30.6Very low34.9Very low191 Ų191134.2 Ų134.284%0.83874%0.74SS**  trans-168.5109.2162.1-163.5-96.1000106.7
376V33Very low34.3Very low92 Ų92129.5 Ų129.556%0.55873%0.727SS**  cis-134124.514.9176.30000106.2E379V376-E379 HydrophobicContact CG1-CB 4.44Å
377V51Low34.2Very low90 Ų90131.6 Ų131.655%0.54573%0.728SS.*  cis7287.325.6-167.90000113.7
378T38.4Very low34.5Very low116 Ų116133.9 Ų133.971%0.71274%0.735SS**SBendtrans70.823.1149.264.50000121.3
379E33.6Very low34.7Very low143 Ų143132.7 Ų132.767%0.66873%0.733SS**SBendtrans-91.3-19.6179.4-155.3160.4-138.100116.1V376V376-E379 HydrophobicContact CG1-CB 4.44Å
380F33.1Very low35.1Very low170 Ų170134.9 Ų134.975%0.74673%0.729SS**SBendtrans-131.636.7-178-71.7-69.9000115.8T382F380-T382 VanDerWaalsContact C-N 3.31Å
381E34Very low35.5Very low162 Ų162131.8 Ų131.876%0.75773%0.729SS**SBendtrans-95.717.3167.7-155159.9-149.500112.2V384E381-V384 WeakPolarHBondContact O-CG2 3.47Å
382T33.5Very low35.9Very low106 Ų106137 Ų13765%0.6573%0.728SS**SBendtrans-112.7-0.2-172.446.30000114.7F380F380-T382 VanDerWaalsContact C-N 3.31Å
383T42.2Very low36.2Very low92 Ų92138.9 Ų138.956%0.56473%0.731SS**  trans-146.658.6-178.760.50000111.5
384V48.2Very low36.4Very low106 Ų106135.8 Ų135.864%0.64272%0.717SS**  4694.354.7-173.70000111.6E381E381-V384 WeakPolarHBondContact O-CG2 3.47Å
385C40.8Very low36.2Very low136 Ų136139.9 Ų139.992%0.91973%0.725SS**SBendtrans66.538.2158.5-57.60000119
386S23.9Very low36.2Very low86 Ų86137.6 Ų137.660%0.60172%0.717SS**  trans-141.5124.1157.668.30000112.4
387L35.3Very low36.2Very low157 Ų157142.6 Ų142.682%0.82273%0.726SS**  trans63.997164.2-49178.7000113.7
388E38.3Very low35.7Very low178 Ų178145.6 Ų145.683%0.83274%0.738SS**  cis56.2118.832-147.7169.8-140.200111.1
389E33.2Very low35.4Very low181 Ų181146.6 Ų146.685%0.84674%0.735SS**  trans64.989.4-171.2-54.5-161.2116.300117.8
390L35.9Very low35.8Very low147 Ų147147.7 Ų147.777%0.7774%0.737SS**  trans169.899.6131.5-91.7166000107
391L43.5Very low36.1Very low159 Ų159145.8 Ų145.883%0.83274%0.735SS**  cis55.352.727.9-161.273.5000114
392R33.3Very low36.5Very low204 Ų204144.1 Ų144.177%0.7773%0.727SS**  trans-176.5150.8135-103.9173.1-70.6170.8-2.9109.2
393T33.8Very low36.6Very low126 Ų126145 Ų14577%0.77373%0.728SS**SBendtrans72.7128-165.570.40000114.2
394E33.5Very low36.2Very low110 Ų110148.1 Ų148.151%0.51474%0.736SS.*  cis-146.2138.1-20.3-95.7-51.986.100105.3Q396E394-Q396 VanDerWaalsContact C-N 3.26Å; E394-Q396 HydrophobicContact CB-CB 4.33Å; E394-Q396 HydrophobicContact CG-CB 4.33Å; E394-Q396 WeakPolarHBondContact OE2-CB 3.44Å; E394-Q396 WeakPolarHBondContact OE2-CG 3.28Å; E394-Q396 PolarHBondContact OE2-N 3.17Å; E394-Q396 PolarHBondContact OE2-NE2 3.49Å
395Q32.1Very low36.3Very low185 Ų185151.4 Ų151.486%0.86475%0.749SS**  cis70.51.314.7-148.4151.517.300117
396Q29.7Very low36Very low143 Ų143153.1 Ų153.167%0.66874%0.741SS**  trans-140.8139153.4-88.3-178.646.900105.6E394E394-Q396 VanDerWaalsContact C-N 3.26Å; E394-Q396 HydrophobicContact CB-CB 4.33Å; E394-Q396 HydrophobicContact CG-CB 4.33Å; E394-Q396 WeakPolarHBondContact OE2-CB 3.44Å; E394-Q396 WeakPolarHBondContact OE2-CG 3.28Å; E394-Q396 PolarHBondContact OE2-N 3.17Å; E394-Q396 PolarHBondContact OE2-NE2 3.49Å
397R33.6Very low36.8Very low198 Ų198157 Ų15775%0.74775%0.753SS**  cis-162.6126.69.1-169.5-179.469.8-148.9-1.4105.2E399R397-E399 HydrophobicContact CG-CB 3.89Å
398L39.2Very low36.7Very low152 Ų152154 Ų15480%0.79674%0.738SS**  cis46.567.621.8-137.1165000114.1E402L398-E402 VanDerWaalsContact CD2-OE1 3.26Å; L398-E402 WeakPolarHBondContact CD2-OE1 3.49Å
399E32.8Very low36.6Very low138 Ų138151.3 Ų151.365%0.64573%0.733SS**  trans-162116.5142.5-154.3-179.8177.400108.9R397R397-E399 HydrophobicContact CG-CB 3.89Å
400K41.6Very low37.4Very low166 Ų166149 Ų14972%0.72272%0.724SS**SBendtrans77.4135.1178.2-51.6177.8-177175.60116.9E402K400-E402 WeakPolarHBondContact CA-OE2 3.46Å; K400-E402 PolarHBondContact N-OE2 2.96Å
401N40Very low37.6Very low129 Ų129150.7 Ų150.769%0.6973%0.728SS**  cis-148113.7-13.1-123.3109.5000107.9
402E42.4Very low38Very low127 Ų127150.2 Ų150.259%0.59373%0.725SS**  cis1082.19.5-146.6151.2-132.500114.9L398 K400L398-E402 VanDerWaalsContact CD2-OE1 3.26Å; L398-E402 WeakPolarHBondContact CD2-OE1 3.49Å; K400-E402 WeakPolarHBondContact CA-OE2 3.46Å; K400-E402 PolarHBondContact N-OE2 2.96Å
403D34.7Very low38.1Very low126 Ų126146.9 Ų146.967%0.67472%0.719SS**  trans-143129171.6-107-39.2000107.9
404Q34.8Very low38.1Very low156 Ų156149.2 Ų149.273%0.72972%0.718SS**  cis-138123.9-3.7-76.3-177.9-3.900112.1
405L49.8Very low38.3Very low176 Ų176151.4 Ų151.492%0.92173%0.726SS**  trans-113.362.4169.7-168120.9000109.7
406K35.6Very low38.7Very low171 Ų171147.9 Ų147.974%0.74372%0.722SS**  trans-14822.4-174.8-135.8170.2-174.2173.50117.2L408K406-L408 WeakPolarHBondContact O-CB 3.22Å
407I39.3Very low38.9Very low167 Ų167143.3 Ų143.386%0.85671%0.705SS**SBendtrans-13051.6160.5-47.1178.1000107
408L33.8Very low39.5Very low96 Ų96140.7 Ų140.750%0.50370%0.701SS.*  67.298.265-165.886.9000112.2K406 M410K406-L408 WeakPolarHBondContact O-CB 3.22Å; L408-M410 HydrophobicContact CD2-CG 4.11Å; L408-M410 HydrophobicContact CD2-SD 4.17Å; L408-M410 PolarHBondContact O-N 3.21Å
409T35.2Very low39.7Very low121 Ų121140.4 Ų140.474%0.74270%0.7SS**SBend37.720.1114.6-23.10000120.2
410M50.6Low40Very low132 Ų132141.3 Ų141.365%0.6570%0.704SS**  trans-132.38.2-180-76.5-164.770.700114.1L408L408-M410 HydrophobicContact CD2-CG 4.11Å; L408-M410 HydrophobicContact CD2-SD 4.17Å; L408-M410 PolarHBondContact O-N 3.21Å
411E40.8Very low39.9Very low183 Ų183141.7 Ų141.786%0.85571%0.709SS**SBendtrans-89.17.2159.9-151.3156.7-130.600112.6Q413E411-Q413 PolarHBondContact O-N 2.72Å
412L51.7Low39.4Very low148 Ų148141.4 Ų141.478%0.77571%0.705SS**THydrogen-bonded Turntrans-55.6-14.2165.9-174.366.1000113.6
413Q36.2Very low39.2Very low135 Ų135140.4 Ų140.463%0.63171%0.707SS**THydrogen-bonded Turntrans-143.427.9-143.6-135.3166.9-9.800115.6E411E411-Q413 PolarHBondContact O-N 2.72Å
414K33.2Very low39.4Very low175 Ų175142.3 Ų142.376%0.76171%0.71SS**SBendtrans-1375.5-178.4-143.7-172.5175.6-177.20118.1
415K38.1Very low39.4Very low156 Ų156141.1 Ų141.168%0.67871%0.707SS**SBendtrans-130.520.1168.1-102.1-68.7155.5-163.30114.8S417K415-S417 PolarHBondContact NZ-O 3.08Å; K415-S417 PolarHBondContact O-N 3.37Å
416S40.3Very low38.4Very low111 Ų111138.1 Ų138.178%0.77670%0.697SS**SBendtrans-73.433.3159.159.20000112
417S32.3Very low38.7Very low46 Ų46137.2 Ų137.232%0.32270%0.7SS.*  trans-156.4126.1-172.766.50000111.7K415K415-S417 PolarHBondContact NZ-O 3.08Å; K415-S417 PolarHBondContact O-N 3.37Å
418E48Very low38.7Very low143 Ų143135 Ų13567%0.66869%0.69SS**  trans80.7129.3155.1-56.5134.7-141.900118
419L41.7Very low39.4Very low146 Ų146138.6 Ų138.676%0.76470%0.702SS**  cis-174161.2-14.9-134.760.7000104
420E39Very low39.6Very low157 Ų157141.8 Ų141.873%0.73471%0.708SS**  cis-157.7179.43.9-157.6160.1170.600108.6
421E39.4Very low39.2Very low175 Ų175142.2 Ų142.282%0.81872%0.718SS**  trans70.2149.4169.6-54.5-150.5128.100120.4
422M31.1Very low39.6Very low122 Ų122140.8 Ų140.860%0.60171%0.711SS**  -162.7136.1-64.1-96-116.8-8000108.1
423T37.1Very low39.1Very low106 Ų106140.8 Ų140.865%0.6571%0.711SS**  68.9125.169.7-38.80000115.5
424K39.8Very low39.8Very low166 Ų166141.6 Ų141.672%0.72272%0.715SS**  153145128.3-83.8168.5-175.7176.30113
425L34.3Very low40.6Very low131 Ų131141.4 Ų141.469%0.68672%0.717SS**  cis-168.8153.1-17.6-15973.5000112.4
426T29.6Very low41Very low114 Ų114140.6 Ų140.670%0.69972%0.719SS**  trans60.4130.9148.436.40000125.3
427N40.1Very low41.4Very low152 Ų152143.6 Ų143.681%0.81372%0.718SS**  trans-178.8152.7140.2-99.4-40.2000109.2
428N41.3Very low42.3Very low120 Ų120150.4 Ų150.464%0.64274%0.742SS**  cis-170.4171.1-24.9-149.9-31.2000111.5
429K47.4Very low42.7Very low172 Ų172147.9 Ų147.975%0.74874%0.736SS**  trans72109.8158.7-62.1176.7-179.6-1750121
430E38.7Very low43Very low188 Ų188148.5 Ų148.588%0.87974%0.739SS**SBendtrans-153.1-24.4142.4-163.6151.5-167.300115.7
431V42.7Very low43.7Very low141 Ų141143.9 Ų143.986%0.85573%0.734SS**SBendtrans-122.146.2-166.3-154.70000115.6
432E48.6Very low44.6Very low153 Ų153142.3 Ų142.372%0.71573%0.726SS**  trans-101.21.3173.6-69.6-178143.900113.9E434E432-E434 PolarHBondContact O-N 3.38Å
433L42.9Very low45.9Very low147 Ų147144.5 Ų144.577%0.7773%0.733SS**THydrogen-bonded Turntrans-80.7-9.8-160.5-113.2170.8000117
434E50.3Low47Very low152 Ų152147.5 Ų147.571%0.7174%0.739SS**THydrogen-bonded Turntrans-92.7-22.4-173.8-161.260-144.700114E432 L436E432-E434 PolarHBondContact O-N 3.38Å; E434-L436 PolarHBondContact O-N 2.87Å
435E50.2Low48Very low172 Ų172144 Ų14480%0.80473%0.732SS**G310 helixtrans-75.2-25.4-176.5-67.6-162115.300113.9K437 K438E435-K437 PolarHBondContact O-N 2.9Å; E435-K438 PolarHBondContact O-N 3.34Å
436L46.4Very low49.5Very low138 Ų138143 Ų14372%0.72373%0.727SS**G310 helixtrans-63.3-12.4-176.2-101.2167.4000114.6E434 K438E434-L436 PolarHBondContact O-N 2.87Å; L436-K438 VanDerWaalsContact C-N 3.32Å; L436-K438 PolarHBondContact O-N 3.01Å
437K48.6Very low51.2Low175 Ų175144 Ų14476%0.76173%0.727SS**G310 helixtrans-78.6-11.8-178.9-144.4171.7-169.5170.50114.1E435E435-K437 PolarHBondContact O-N 2.9Å
438K51.7Low52.7Low188 Ų188144.5 Ų144.582%0.81772%0.719SS**SBendtrans-89.3-27.7-173.4-166.3178.7177.3-171.70114.4E435 L436 L440E435-K438 PolarHBondContact O-N 3.34Å; L436-K438 VanDerWaalsContact C-N 3.32Å; L436-K438 PolarHBondContact O-N 3.01Å; K438-L440 VanDerWaalsContact C-N 3.29Å; K438-L440 PolarHBondContact O-N 2.95Å
439V55.6Low54.1Low91 Ų91143.8 Ų143.855%0.55271%0.712SS**G310 helixtrans-74.3-13.7-166.4-175.80000113.8G441V439-G441 VanDerWaalsContact C-N 3.26Å; V439-G441 PolarHBondContact O-N 2.7Å
440L47.9Very low55.3Low159 Ų159141.3 Ų141.383%0.83271%0.707SS**G310 helixtrans-69.6-18.3-173.5-157.668.8000114.4K438K438-L440 VanDerWaalsContact C-N 3.29Å; K438-L440 PolarHBondContact O-N 2.95Å
441G54.1Low57Low60 Ų60139.8 Ų139.862%0.61970%0.697SS**G310 helixtrans-78.2-16.9-176.400000115.8V439 K443V439-G441 VanDerWaalsContact C-N 3.26Å; V439-G441 PolarHBondContact O-N 2.7Å; G441-K443 VanDerWaalsContact C-N 3.26Å; G441-K443 PolarHBondContact O-N 3.06Å
442E58.2Low58.5Low141 Ų141137 Ų13766%0.65967%0.674SS**G310 helixtrans-84.43.8-170.4-63.4177.9163.500113.8T445E442-T445 PolarHBondContact O-OG1 2.97Å
443K58.5Low59.8Low168 Ų168136.1 Ų136.173%0.7367%0.669SS**G310 helixtrans-90-16.8-171.6-159.5167.8-176.2175.50114.9G441G441-K443 VanDerWaalsContact C-N 3.26Å; G441-K443 PolarHBondContact O-N 3.06Å
444E60.3Low61.5Low170 Ų170135.8 Ų135.879%0.79466%0.663SS**THydrogen-bonded Turntrans-82.4-25.2-178.6-65.4-170.612900113.4
445T60.4Low62.9Low92 Ų92133.6 Ų133.656%0.56465%0.651SS**Hα-helixtrans-68.9-46.9179.847.10000112.6E442 L447 Y448 E449E442-T445 PolarHBondContact O-OG1 2.97Å; T445-L447 PolarHBondContact O-N 3.42Å; T445-L447 VanDerWaalsContact O-N 3.12Å; T445-Y448 WeakPolarHBondContact O-CB 3.47Å; T445-Y448 PolarHBondContact O-N 3.23Å; T445-E449 PolarHBondContact O-N 3.2Å
446L65.8Low64.3Low110 Ų110129.4 Ų129.458%0.57663%0.634SS**Hα-helixtrans-58.3-27.1179.9-67.5170.6000113.3Y448 N450L446-Y448 VanDerWaalsContact C-N 3.33Å; L446-N450 PolarHBondContact O-N 3.42Å
447L64.8Low65.9Low135 Ų135125.6 Ų125.671%0.70762%0.622SS**Hα-helixtrans-73.1-26.2179.6-134.4169.7000112.1T445T445-L447 PolarHBondContact O-N 3.42Å; T445-L447 VanDerWaalsContact O-N 3.12Å
448Y72Confident67.5Low162 Ų162124.1 Ų124.164%0.63562%0.618SS**Hα-helixtrans-76.5-41.2174.1-177.9-99.5000112T445 L446 K451 Q452T445-Y448 WeakPolarHBondContact O-CB 3.47Å; T445-Y448 PolarHBondContact O-N 3.23Å; L446-Y448 VanDerWaalsContact C-N 3.33Å; Y448-K451 PolarHBondContact O-N 2.92Å; Y448-Q452 PolarHBondContact OH-NE2 2.91Å
449E70.9Confident68.9Low106 Ų106120.2 Ų120.250%0.49560%0.602SS.*Hα-helixtrans-65.1-44.3-179-63.7-178.4149.900112T445 K451 Q452 F453T445-E449 PolarHBondContact O-N 3.2Å; E449-K451 PolarHBondContact O-N 3.11Å; E449-K451 VanDerWaalsContact O-N 3.15Å; E449-Q452 WeakPolarHBondContact O-CB 3.43Å; E449-Q452 PolarHBondContact O-N 3.03Å; E449-F453 WeakPolarHBondContact O-CD2 3.4Å; E449-F453 PolarHBondContact O-N 3.27Å
450N72.2Confident70Confident120 Ų120121.2 Ų121.264%0.64260%0.604SS**Hα-helixtrans-58.3-32.3-179.9-155.938.3000112.5L446 Q452 F453 E454L446-N450 PolarHBondContact O-N 3.42Å; N450-Q452 VanDerWaalsContact C-N 3.31Å; N450-Q452 PolarHBondContact O-N 3.34Å; N450-F453 PolarHBondContact O-N 3.43Å; N450-E454 PolarHBondContact O-N 3.25Å
451K74.9Confident71.7Confident155 Ų155119.9 Ų119.967%0.67459%0.591SS**Hα-helixtrans-73.4-18.5177.7-166.2169.7-176.61750113.8Y448 E449Y448-K451 PolarHBondContact O-N 2.92Å; E449-K451 PolarHBondContact O-N 3.11Å; E449-K451 VanDerWaalsContact O-N 3.15Å
452Q73.2Confident73Confident82 Ų82118.6 Ų118.638%0.38358%0.578SS.*Hα-helixtrans-80.3-38.3172.5-57.1-62.1-2200111.2Y448 E449 N450 E454 K455 I456Y448-Q452 PolarHBondContact OH-NE2 2.91Å; E449-Q452 WeakPolarHBondContact O-CB 3.43Å; E449-Q452 PolarHBondContact O-N 3.03Å; N450-Q452 VanDerWaalsContact C-N 3.31Å; N450-Q452 PolarHBondContact O-N 3.34Å; Q452-E454 PolarHBondContact O-N 2.85Å; Q452-K455 PolarHBondContact O-N 3.04Å; Q452-I456 WeakPolarHBondContact O-CG1 3.31Å; Q452-I456 PolarHBondContact O-N 2.71Å; Q452-I456 VanDerWaalsContact O-N 3.13Å
453F77.4Confident74.1Confident136 Ų136115.2 Ų115.260%0.59657%0.567SS**Hα-helixtrans-63.1-38.9177.7-71.9-68.4000112.9E449 N450 K455 I456 A457E449-F453 WeakPolarHBondContact O-CD2 3.4Å; E449-F453 PolarHBondContact O-N 3.27Å; N450-F453 PolarHBondContact O-N 3.43Å; F453-K455 VanDerWaalsContact C-N 3.34Å; F453-K455 PolarHBondContact O-N 3.14Å; F453-I456 PolarHBondContact O-N 2.88Å; F453-A457 PolarHBondContact O-N 3.38Å
454E77.3Confident75.2Confident139 Ų139112.7 Ų112.765%0.6556%0.558SS**Hα-helixtrans-61.6-42177.2-165.2161.3-136.400111.7N450 Q452 I456 A457 E458N450-E454 PolarHBondContact O-N 3.25Å; Q452-E454 PolarHBondContact O-N 2.85Å; E454-I456 PolarHBondContact O-N 3.08Å; E454-A457 WeakPolarHBondContact O-CB 3.28Å; E454-A457 PolarHBondContact O-N 3.1Å; E454-E458 PolarHBondContact O-N 3.37Å; E454-E458 VanDerWaalsContact O-N 3.15Å
455K79.5Confident76.4Confident106 Ų106110.9 Ų110.946%0.46155%0.549SS..Hα-helixtrans-64.4-38.3175.1-173.3174.3-179.3-65.90113Q452 F453 A457 E458 E459Q452-K455 PolarHBondContact O-N 3.04Å; F453-K455 VanDerWaalsContact C-N 3.34Å; F453-K455 PolarHBondContact O-N 3.14Å; K455-A457 VanDerWaalsContact C-N 3.33Å; K455-E458 PolarHBondContact O-N 2.88Å; K455-E459 IonicContact NZ-OE1 3.37Å; K455-E459 PolarHBondContact NZ-OE1 3.31Å; K455-E459 WeakPolarHBondContact O-CG 3.43Å; K455-E459 PolarHBondContact O-N 3.15Å; K455-E459 VanDerWaalsContact O-N 3.1Å
456I80.8Confident77.5Confident85 Ų85113.2 Ų113.244%0.43655%0.554SS.*Hα-helixtrans-66.5-35.9175.4-67.1165000111Q452 F453 E454 E459 L460Q452-I456 WeakPolarHBondContact O-CG1 3.31Å; Q452-I456 PolarHBondContact O-N 2.71Å; Q452-I456 VanDerWaalsContact O-N 3.13Å; F453-I456 PolarHBondContact O-N 2.88Å; E454-I456 PolarHBondContact O-N 3.08Å; I456-E459 PolarHBondContact O-N 3.05Å; I456-L460 HydrophobicContact CG2-CD1 4.16Å; I456-L460 WeakPolarHBondContact O-CB 3.5Å; I456-L460 WeakPolarHBondContact O-CG 3.48Å; I456-L460 PolarHBondContact O-N 3.33Å
457A79.7Confident78.4Confident57 Ų57113.3 Ų113.347%0.47155%0.554SS.*Hα-helixtrans-67.4-37.4176.500000112.7F453 E454 K455 K461F453-A457 PolarHBondContact O-N 3.38Å; E454-A457 WeakPolarHBondContact O-CB 3.28Å; E454-A457 PolarHBondContact O-N 3.1Å; K455-A457 VanDerWaalsContact C-N 3.33Å; A457-K461 WeakPolarHBondContact O-CB 3.26Å; A457-K461 PolarHBondContact O-N 2.88Å; A457-K461 VanDerWaalsContact O-N 3.1Å
458E81.6Confident79.6Confident145 Ų145110.9 Ų110.968%0.67854%0.542SS*.Hα-helixtrans-67.5-40.6173.5-67.3-172.5134.700112.3E454 K455 K461 G462E454-E458 PolarHBondContact O-N 3.37Å; E454-E458 VanDerWaalsContact O-N 3.15Å; K455-E458 PolarHBondContact O-N 2.88Å; E458-K461 PolarHBondContact O-N 2.92Å; E458-G462 PolarHBondContact O-N 2.77Å; E458-G462 VanDerWaalsContact O-N 3.11Å
459E81.3Confident80.3Confident106 Ų106105.1 Ų105.150%0.49553%0.531SS..Hα-helixtrans-63.8-43.6175.2-74.4171.2-170.200112K455 I456 K461 G462 T463K455-E459 IonicContact NZ-OE1 3.37Å; K455-E459 PolarHBondContact NZ-OE1 3.31Å; K455-E459 WeakPolarHBondContact O-CG 3.43Å; K455-E459 PolarHBondContact O-N 3.15Å; K455-E459 VanDerWaalsContact O-N 3.1Å; I456-E459 PolarHBondContact O-N 3.05Å; E459-K461 PolarHBondContact O-N 2.72Å; E459-G462 PolarHBondContact O-N 3.23Å; E459-T463 PolarHBondContact O-N 2.69Å
460L79.5Confident81.2Confident111 Ų111105.6 Ų105.658%0.58154%0.537SS*.Hα-helixtrans-58.1-46173.6-81.4166.4000112.1I456 G462 T463 E464I456-L460 HydrophobicContact CG2-CD1 4.16Å; I456-L460 WeakPolarHBondContact O-CB 3.5Å; I456-L460 WeakPolarHBondContact O-CG 3.48Å; I456-L460 PolarHBondContact O-N 3.33Å; L460-G462 VanDerWaalsContact C-N 3.25Å; L460-G462 PolarHBondContact O-N 3.49Å; L460-T463 PolarHBondContact O-N 3.37Å; L460-T463 VanDerWaalsContact O-N 3.07Å; L460-T463 PolarHBondContact O-OG1 2.92Å; L460-E464 PolarHBondContact O-N 3.44Å
461K82.3Confident82Confident132 Ų132104.9 Ų104.957%0.57453%0.532SS*.Hα-helixtrans-62.1-32178.3-172178179.9-178.40112.7A457 E458 E459 Q465A457-K461 WeakPolarHBondContact O-CB 3.26Å; A457-K461 PolarHBondContact O-N 2.88Å; A457-K461 VanDerWaalsContact O-N 3.1Å; E458-K461 PolarHBondContact O-N 2.92Å; E459-K461 PolarHBondContact O-N 2.72Å; K461-Q465 WeakPolarHBondContact O-CG 3.4Å; K461-Q465 PolarHBondContact O-N 2.93Å
462G82Confident82.6Confident33 Ų33102.5 Ų102.534%0.3452%0.523SS..Hα-helixtrans-61.7-50.7169.400000112.1E458 E459 L460 E464 Q465 E466E458-G462 PolarHBondContact O-N 2.77Å; E458-G462 VanDerWaalsContact O-N 3.11Å; E459-G462 PolarHBondContact O-N 3.23Å; L460-G462 VanDerWaalsContact C-N 3.25Å; L460-G462 PolarHBondContact O-N 3.49Å; G462-E464 VanDerWaalsContact C-N 3.29Å; G462-E464 PolarHBondContact O-N 3Å; G462-Q465 PolarHBondContact O-N 3.22Å; G462-Q465 VanDerWaalsContact O-N 3.13Å; G462-E466 PolarHBondContact O-N 3.33Å; G462-E466 VanDerWaalsContact O-N 3.13Å
463T81Confident83.3Confident70 Ų70100.8 Ų100.843%0.42952%0.523SS..Hα-helixtrans-63.8-31.6-179.964.30000113.6E459 L460 E466 L467E459-T463 PolarHBondContact O-N 2.69Å; L460-T463 PolarHBondContact O-N 3.37Å; L460-T463 VanDerWaalsContact O-N 3.07Å; L460-T463 PolarHBondContact O-OG1 2.92Å; T463-E466 PolarHBondContact O-N 3.49Å; T463-L467 WeakPolarHBondContact O-CB 3.3Å; T463-L467 WeakPolarHBondContact O-CG 3.37Å; T463-L467 PolarHBondContact O-N 3.22Å
464E82.5Confident83.7Confident115 Ų115102.1 Ų102.154%0.53752%0.524SS..Hα-helixtrans-61.9-43.4173.3-176.3179.7-155.800111.5L460 G462 L467 I468L460-E464 PolarHBondContact O-N 3.44Å; G462-E464 VanDerWaalsContact C-N 3.29Å; G462-E464 PolarHBondContact O-N 3Å; E464-L467 PolarHBondContact O-N 2.82Å; E464-I468 HydrophobicContact CG-CD1 4.2Å; E464-I468 WeakPolarHBondContact O-CG1 3.38Å; E464-I468 PolarHBondContact O-N 2.86Å
465Q84.5Confident84.2Confident131 Ų131101 Ų10161%0.61252%0.519SS*.Hα-helixtrans-71.1-34.9179.6-66.8-173.5-48.300112.6K461 G462 I468 G469K461-Q465 WeakPolarHBondContact O-CG 3.4Å; K461-Q465 PolarHBondContact O-N 2.93Å; G462-Q465 PolarHBondContact O-N 3.22Å; G462-Q465 VanDerWaalsContact O-N 3.13Å; Q465-I468 PolarHBondContact O-N 3.41Å; Q465-G469 PolarHBondContact O-N 3.37Å; Q465-G469 VanDerWaalsContact O-N 3.1Å
466E83.3Confident84.7Confident141 Ų141102.6 Ų102.666%0.65953%0.526SS*.Hα-helixtrans-64.7-42.8171.1-68.4-170.7150.500111.9G462 T463 I468 G469 L470G462-E466 PolarHBondContact O-N 3.33Å; G462-E466 VanDerWaalsContact O-N 3.13Å; T463-E466 PolarHBondContact O-N 3.49Å; E466-I468 PolarHBondContact O-N 2.91Å; E466-G469 PolarHBondContact O-N 2.81Å; E466-L470 WeakPolarHBondContact O-CG 3.26Å; E466-L470 PolarHBondContact O-N 2.81Å
467L86Confident85.1Confident112 Ų112102.9 Ų102.959%0.58653%0.526SS*.Hα-helixtrans-61.2-42.3175.8-82.2165.2000112.4T463 E464 G469 L470 L471T463-L467 WeakPolarHBondContact O-CB 3.3Å; T463-L467 WeakPolarHBondContact O-CG 3.37Å; T463-L467 PolarHBondContact O-N 3.22Å; E464-L467 PolarHBondContact O-N 2.82Å; L467-G469 VanDerWaalsContact C-N 3.34Å; L467-G469 PolarHBondContact O-N 3.06Å; L467-L470 PolarHBondContact O-N 3.29Å; L467-L471 WeakPolarHBondContact O-CB 3.43Å; L467-L471 PolarHBondContact O-N 2.97Å
468I88.7Confident85.6Confident85 Ų85104.8 Ų104.844%0.43653%0.531SS..Hα-helixtrans-61.7-42.3174.9-69.1163.9000111E464 Q465 E466 L471 Q472E464-I468 HydrophobicContact CG-CD1 4.2Å; E464-I468 WeakPolarHBondContact O-CG1 3.38Å; E464-I468 PolarHBondContact O-N 2.86Å; Q465-I468 PolarHBondContact O-N 3.41Å; E466-I468 PolarHBondContact O-N 2.91Å; I468-L471 PolarHBondContact O-N 2.89Å; I468-Q472 WeakPolarHBondContact O-CG 3.47Å; I468-Q472 PolarHBondContact O-N 3.09Å
469G87.4Confident85.9Confident41 Ų41102.7 Ų102.742%0.42352%0.521SS..Hα-helixtrans-62.3-41.6176.100000113.2Q465 E466 L467 A473Q465-G469 PolarHBondContact O-N 3.37Å; Q465-G469 VanDerWaalsContact O-N 3.1Å; E466-G469 PolarHBondContact O-N 2.81Å; L467-G469 VanDerWaalsContact C-N 3.34Å; L467-G469 PolarHBondContact O-N 3.06Å; G469-A473 PolarHBondContact O-N 3.45Å; G469-A473 VanDerWaalsContact O-N 3.1Å
470L89.8Confident86.4Confident116 Ų116102 Ų10261%0.60752%0.521SS*.Hα-helixtrans-66.6-37.9175-71.2171.2000112.5E466 L467 A473 R474E466-L470 WeakPolarHBondContact O-CG 3.26Å; E466-L470 PolarHBondContact O-N 2.81Å; L467-L470 PolarHBondContact O-N 3.29Å; L470-A473 WeakPolarHBondContact O-CB 3.15Å; L470-A473 PolarHBondContact O-N 3.09Å; L470-R474 PolarHBondContact O-N 3.3Å
471L88.4Confident87Confident105 Ų105101.3 Ų101.355%0.5552%0.517SS..Hα-helixtrans-65.6-47.9178.5-153.3165.1000110.5L467 I468 A473 R474 E475L467-L471 WeakPolarHBondContact O-CB 3.43Å; L467-L471 PolarHBondContact O-N 2.97Å; I468-L471 PolarHBondContact O-N 2.89Å; L471-A473 PolarHBondContact O-N 2.96Å; L471-R474 PolarHBondContact O-N 3.2Å; L471-R474 VanDerWaalsContact O-N 3.09Å; L471-E475 HydrophobicContact CD2-CG 3.95Å; L471-E475 WeakPolarHBondContact CD2-OE1 3.49Å; L471-E475 WeakPolarHBondContact O-CG 3.48Å; L471-E475 PolarHBondContact O-N 3.3Å
472Q87.8Confident87.4Confident104 Ų104100.2 Ų100.249%0.48651%0.514SS..Hα-helixtrans-64.1-25.3175.1-69.9-178.70.800113.9I468 K476I468-Q472 WeakPolarHBondContact O-CG 3.47Å; I468-Q472 PolarHBondContact O-N 3.09Å; Q472-K476 WeakPolarHBondContact O-CG 3.34Å
473A87.8Confident87.9Confident46 Ų46102.9 Ų102.938%0.3852%0.519SS..Hα-helixtrans-71.7-45.1170.800000111.2G469 L470 L471 E475 K476 E477G469-A473 PolarHBondContact O-N 3.45Å; G469-A473 VanDerWaalsContact O-N 3.1Å; L470-A473 WeakPolarHBondContact O-CB 3.15Å; L470-A473 PolarHBondContact O-N 3.09Å; L471-A473 PolarHBondContact O-N 2.96Å; A473-E475 PolarHBondContact O-N 3.3Å; A473-K476 PolarHBondContact O-N 2.88Å; A473-E477 PolarHBondContact O-N 2.81Å; A473-E477 VanDerWaalsContact O-N 3.14Å
474R86.6Confident88.3Confident165 Ų165104.9 Ų104.962%0.62352%0.524SS*.Hα-helixtrans-64.4-37176-69.4-53.5-162.5-173.20.4113.1L470 L471 K476 E477 V478L470-R474 PolarHBondContact O-N 3.3Å; L471-R474 PolarHBondContact O-N 3.2Å; L471-R474 VanDerWaalsContact O-N 3.09Å; R474-K476 VanDerWaalsContact C-N 3.28Å; R474-K476 PolarHBondContact O-N 3.07Å; R474-E477 WeakPolarHBondContact CD-OE2 3.45Å; R474-E477 IonicContact CZ-OE2 3.34Å; R474-E477 IonicContact NE-OE2 3.8Å; R474-E477 IonicContact NH1-OE1 3.83Å; R474-E477 IonicContact NH1-OE2 3.55Å; R474-E477 PolarHBondContact NH1-OE2 3.03Å; R474-E477 PolarHBondContact O-N 3.39Å; R474-V478 WeakPolarHBondContact O-CB 3.38Å; R474-V478 VanDerWaalsContact O-CG2 3.31Å; R474-V478 WeakPolarHBondContact O-CG2 3.32Å; R474-V478 PolarHBondContact O-N 3.19Å
475E88.2Confident88.7Confident115 Ų115104.6 Ų104.654%0.53753%0.526SS..Hα-helixtrans-58.6-39.7175-74.2173.7153.500112.1L471 A473 H479L471-E475 HydrophobicContact CD2-CG 3.95Å; L471-E475 WeakPolarHBondContact CD2-OE1 3.49Å; L471-E475 WeakPolarHBondContact O-CG 3.48Å; L471-E475 PolarHBondContact O-N 3.3Å; A473-E475 PolarHBondContact O-N 3.3Å; E475-H479 PolarHBondContact O-N 3.49Å; E475-H479 VanDerWaalsContact O-N 3.07Å
476K89.2Confident89Confident140 Ų140102.3 Ų102.361%0.60952%0.521SS*.Hα-helixtrans-69.1-45.7176.1-69.8170.2-176.1169.70112.2Q472 A473 R474 V478 H479 D480Q472-K476 WeakPolarHBondContact O-CG 3.34Å; A473-K476 PolarHBondContact O-N 2.88Å; R474-K476 VanDerWaalsContact C-N 3.28Å; R474-K476 PolarHBondContact O-N 3.07Å; K476-V478 VanDerWaalsContact C-N 3.29Å; K476-V478 PolarHBondContact O-N 3.31Å; K476-H479 PolarHBondContact O-N 3.04Å; K476-H479 VanDerWaalsContact O-N 3.15Å; K476-D480 PolarHBondContact O-N 3.38Å
477E89.5Confident89.3Confident91 Ų9198.2 Ų98.243%0.42551%0.511SS..Hα-helixtrans-59.1-39.8175.3-69.5178160.900112.2A473 R474 L481A473-E477 PolarHBondContact O-N 2.81Å; A473-E477 VanDerWaalsContact O-N 3.14Å; R474-E477 WeakPolarHBondContact CD-OE2 3.45Å; R474-E477 IonicContact CZ-OE2 3.34Å; R474-E477 IonicContact NE-OE2 3.8Å; R474-E477 IonicContact NH1-OE1 3.83Å; R474-E477 IonicContact NH1-OE2 3.55Å; R474-E477 PolarHBondContact NH1-OE2 3.03Å; R474-E477 PolarHBondContact O-N 3.39Å; E477-L481 WeakPolarHBondContact O-CB 3.41Å; E477-L481 VanDerWaalsContact O-CG 3.25Å; E477-L481 WeakPolarHBondContact O-CG 3.49Å; E477-L481 PolarHBondContact O-N 3.49Å
478V89.3Confident89.5Confident96 Ų9697.6 Ų97.658%0.58251%0.507SS*.Hα-helixtrans-63.9-42.4175.2168.40000111.1R474 K476 L481 E482R474-V478 WeakPolarHBondContact O-CB 3.38Å; R474-V478 VanDerWaalsContact O-CG2 3.31Å; R474-V478 WeakPolarHBondContact O-CG2 3.32Å; R474-V478 PolarHBondContact O-N 3.19Å; K476-V478 VanDerWaalsContact C-N 3.29Å; K476-V478 PolarHBondContact O-N 3.31Å; V478-L481 PolarHBondContact O-N 3.1Å; V478-E482 WeakPolarHBondContact O-CB 3.5Å; V478-E482 PolarHBondContact O-N 3.28Å
479H89.9Confident89.6Confident102 Ų10296.4 Ų96.447%0.47250%0.504SS..Hα-helixtrans-69.5-38.8178-168.453.3000112.9E475 K476 L481 E482 I483E475-H479 PolarHBondContact O-N 3.49Å; E475-H479 VanDerWaalsContact O-N 3.07Å; K476-H479 PolarHBondContact O-N 3.04Å; K476-H479 VanDerWaalsContact O-N 3.15Å; H479-L481 VanDerWaalsContact C-N 3.27Å; H479-L481 PolarHBondContact O-N 3.25Å; H479-E482 IonicContact CE1-OE2 3.12Å; H479-E482 IonicContact ND1-OE2 3.76Å; H479-E482 PolarHBondContact ND1-OE2 3Å; H479-E482 WeakPolarHBondContact O-CB 3.46Å; H479-E482 PolarHBondContact O-N 2.89Å; H479-E482 VanDerWaalsContact O-N 3.16Å; H479-I483 WeakPolarHBondContact O-CG1 3.46Å; H479-I483 PolarHBondContact O-N 2.93Å
480D89.9Confident89.7Confident92 Ų9298.6 Ų98.649%0.49251%0.509SS..Hα-helixtrans-64.3-32.2173.6-74.4-26.8000112K476 Q484K476-D480 PolarHBondContact O-N 3.38Å; D480-Q484 WeakPolarHBondContact O-CG 3.42Å; D480-Q484 PolarHBondContact O-N 3.27Å; D480-Q484 PolarHBondContact O-NE2 3.19Å
481L92.5Very high89.6Confident96 Ų9695.6 Ų95.650%0.50350%0.498SS..Hα-helixtrans-74-34.6171.7-72.8169.2000112.5E477 V478 H479 Q484 L485E477-L481 WeakPolarHBondContact O-CB 3.41Å; E477-L481 VanDerWaalsContact O-CG 3.25Å; E477-L481 WeakPolarHBondContact O-CG 3.49Å; E477-L481 PolarHBondContact O-N 3.49Å; V478-L481 PolarHBondContact O-N 3.1Å; H479-L481 VanDerWaalsContact C-N 3.27Å; H479-L481 PolarHBondContact O-N 3.25Å; L481-Q484 PolarHBondContact O-N 3.35Å; L481-L485 WeakPolarHBondContact O-CB 3.5Å; L481-L485 WeakPolarHBondContact O-CG 3.44Å; L481-L485 PolarHBondContact O-N 2.98Å
482E91.3Very high89.7Confident109 Ų10996.8 Ų96.851%0.50950%0.501SS..Hα-helixtrans-65.4-39.6174.1-174.5177.9-133.600111.8V478 H479 L485 T486V478-E482 WeakPolarHBondContact O-CB 3.5Å; V478-E482 PolarHBondContact O-N 3.28Å; H479-E482 IonicContact CE1-OE2 3.12Å; H479-E482 IonicContact ND1-OE2 3.76Å; H479-E482 PolarHBondContact ND1-OE2 3Å; H479-E482 WeakPolarHBondContact O-CB 3.46Å; H479-E482 PolarHBondContact O-N 2.89Å; H479-E482 VanDerWaalsContact O-N 3.16Å; E482-L485 PolarHBondContact O-N 2.92Å; E482-T486 WeakPolarHBondContact O-CG2 3.19Å; E482-T486 PolarHBondContact O-N 3.1Å; E482-T486 PolarHBondContact O-OG1 2.99Å
483I91.9Very high89.8Confident88 Ų8897.9 Ų97.945%0.45151%0.506SS..Hα-helixtrans-63.5-41.8171.4-67.4166000110.9H479 T486 A487H479-I483 WeakPolarHBondContact O-CG1 3.46Å; H479-I483 PolarHBondContact O-N 2.93Å; I483-T486 WeakPolarHBondContact CA-OG1 3.36Å; I483-T486 PolarHBondContact O-OG1 2.73Å; I483-A487 WeakPolarHBondContact O-CB 3.37Å; I483-A487 PolarHBondContact O-N 3.03Å
484Q90.5Very high90Very high113 Ų113102.4 Ų102.453%0.52851%0.514SS..Hα-helixtrans-66.2-41.9175.1-75.1170.571.800112.5D480 L481 T486 A487 I488D480-Q484 WeakPolarHBondContact O-CG 3.42Å; D480-Q484 PolarHBondContact O-N 3.27Å; D480-Q484 PolarHBondContact O-NE2 3.19Å; L481-Q484 PolarHBondContact O-N 3.35Å; Q484-T486 PolarHBondContact O-N 3.1Å; Q484-A487 PolarHBondContact O-N 2.98Å; Q484-I488 VanDerWaalsContact O-CG1 3.28Å; Q484-I488 WeakPolarHBondContact O-CG1 3.24Å; Q484-I488 PolarHBondContact O-N 3.44Å
485L90.3Very high90.2Very high109 Ų109101.3 Ų101.357%0.57151%0.511SS*.Hα-helixtrans-63.9-39.6177-79.9166.2000112.4L481 E482 I488 T489L481-L485 WeakPolarHBondContact O-CB 3.5Å; L481-L485 WeakPolarHBondContact O-CG 3.44Å; L481-L485 PolarHBondContact O-N 2.98Å; E482-L485 PolarHBondContact O-N 2.92Å; L485-I488 PolarHBondContact O-N 2.78Å; L485-T489 WeakPolarHBondContact O-CB 3.46Å; L485-T489 PolarHBondContact O-N 3.49Å; L485-T489 PolarHBondContact O-OG1 3.48Å
486T90.1Very high90.4Very high82 Ų8298.5 Ų98.550%0.50350%0.504SS..Hα-helixtrans-70.7-36.2175.848.60000112.4E482 I483 Q484 T489 T490E482-T486 WeakPolarHBondContact O-CG2 3.19Å; E482-T486 PolarHBondContact O-N 3.1Å; E482-T486 PolarHBondContact O-OG1 2.99Å; I483-T486 WeakPolarHBondContact CA-OG1 3.36Å; I483-T486 PolarHBondContact O-OG1 2.73Å; Q484-T486 PolarHBondContact O-N 3.1Å; T486-T489 PolarHBondContact O-N 3.3Å; T486-T490 WeakPolarHBondContact O-CG2 3.25Å; T486-T490 PolarHBondContact O-N 3.02Å; T486-T490 PolarHBondContact O-OG1 3.45Å
487A90.1Very high90.5Very high55 Ų5598.1 Ų98.146%0.45550%0.503SS..Hα-helixtrans-62.8-44.5170.700000112.4I483 Q484 T490 S491I483-A487 WeakPolarHBondContact O-CB 3.37Å; I483-A487 PolarHBondContact O-N 3.03Å; Q484-A487 PolarHBondContact O-N 2.98Å; A487-T490 PolarHBondContact O-N 3.16Å; A487-T490 PolarHBondContact O-OG1 3.42Å; A487-S491 PolarHBondContact O-N 3.22Å; A487-S491 VanDerWaalsContact O-N 3.11Å
488I90.3Very high90.7Very high99 Ų9997.7 Ų97.751%0.50850%0.5SS..Hα-helixtrans-61-50.4174.2-69.9164.4000110Q484 L485 T490 S491 E492Q484-I488 VanDerWaalsContact O-CG1 3.28Å; Q484-I488 WeakPolarHBondContact O-CG1 3.24Å; Q484-I488 PolarHBondContact O-N 3.44Å; L485-I488 PolarHBondContact O-N 2.78Å; I488-T490 VanDerWaalsContact C-N 3.32Å; I488-T490 PolarHBondContact O-N 3.08Å; I488-S491 PolarHBondContact O-N 3.43Å; I488-S491 VanDerWaalsContact O-N 3.09Å; I488-S491 PolarHBondContact O-OG 3.36Å; I488-E492 PolarHBondContact O-N 2.85Å
489T90.4Very high90.6Very high61 Ų6197.7 Ų97.737%0.37450%0.501SS..Hα-helixtrans-57.4-41.7-179.2-58.20000112.3L485 T486 E492 Q493L485-T489 WeakPolarHBondContact O-CB 3.46Å; L485-T489 PolarHBondContact O-N 3.49Å; L485-T489 PolarHBondContact O-OG1 3.48Å; T486-T489 PolarHBondContact O-N 3.3Å; T489-E492 PolarHBondContact O-N 2.74Å; T489-Q493 VanDerWaalsContact O-CG 3.3Å; T489-Q493 WeakPolarHBondContact O-CG 3.49Å; T489-Q493 PolarHBondContact O-N 3.32Å
490T89.8Confident90.7Very high87 Ų8798.5 Ų98.553%0.53450%0.503SS..Hα-helixtrans-69.9-36.3177.548.40000112.5T486 A487 I488 Q493 Y494T486-T490 WeakPolarHBondContact O-CG2 3.25Å; T486-T490 PolarHBondContact O-N 3.02Å; T486-T490 PolarHBondContact O-OG1 3.45Å; A487-T490 PolarHBondContact O-N 3.16Å; A487-T490 PolarHBondContact O-OG1 3.42Å; I488-T490 VanDerWaalsContact C-N 3.32Å; I488-T490 PolarHBondContact O-N 3.08Å; T490-Q493 PolarHBondContact O-N 3.29Å; T490-Y494 PolarHBondContact O-N 3.1Å
491S87.8Confident90.7Very high53 Ų5398.1 Ų98.137%0.37150%0.5SS..Hα-helixtrans-69-37172.874.30000113A487 I488 Y494 Y495A487-S491 PolarHBondContact O-N 3.22Å; A487-S491 VanDerWaalsContact O-N 3.11Å; I488-S491 PolarHBondContact O-N 3.43Å; I488-S491 VanDerWaalsContact O-N 3.09Å; I488-S491 PolarHBondContact O-OG 3.36Å; S491-Y494 WeakPolarHBondContact O-CB 3.31Å; S491-Y494 PolarHBondContact O-N 3.46Å; S491-Y495 WeakPolarHBondContact O-CD2 3.34Å; S491-Y495 PolarHBondContact O-N 2.92Å
492E90.3Very high90.7Very high130 Ų13098.2 Ų98.261%0.60750%0.501SS*.Hα-helixtrans-66.3-39174.5-173.4176.6-159.200111.3I488 T489 Y494 Y495 S496I488-E492 PolarHBondContact O-N 2.85Å; T489-E492 PolarHBondContact O-N 2.74Å; E492-Y494 VanDerWaalsContact C-N 3.34Å; E492-Y494 PolarHBondContact O-N 2.92Å; E492-Y495 PolarHBondContact O-N 3.47Å; E492-S496 WeakPolarHBondContact O-CB 3.4Å; E492-S496 PolarHBondContact O-N 3.13Å
493Q90.3Very high90.7Very high127 Ų12799.5 Ų99.559%0.59351%0.505SS*.Hα-helixtrans-63.3-38171.7-74176.917.100112.4T489 T490 K497T489-Q493 VanDerWaalsContact O-CG 3.3Å; T489-Q493 WeakPolarHBondContact O-CG 3.49Å; T489-Q493 PolarHBondContact O-N 3.32Å; T490-Q493 PolarHBondContact O-N 3.29Å; Q493-K497 PolarHBondContact O-N 3.19Å
494Y92.5Very high90.7Very high141 Ų14199.4 Ų99.455%0.55351%0.509SS*.Hα-helixtrans-60.7-55173.3173.1-85.5000111.3T490 S491 E492 S496 K497 E498T490-Y494 PolarHBondContact O-N 3.1Å; S491-Y494 WeakPolarHBondContact O-CB 3.31Å; S491-Y494 PolarHBondContact O-N 3.46Å; E492-Y494 VanDerWaalsContact C-N 3.34Å; E492-Y494 PolarHBondContact O-N 2.92Å; Y494-S496 VanDerWaalsContact C-N 3.31Å; Y494-S496 PolarHBondContact O-N 2.99Å; Y494-K497 WeakPolarHBondContact O-CA 3.43Å; Y494-K497 WeakPolarHBondContact O-CB 3.46Å; Y494-K497 PolarHBondContact O-N 3.11Å; Y494-E498 WeakPolarHBondContact CE1-OE2 3.48Å; Y494-E498 PolarHBondContact O-N 2.89Å
495Y89.7Confident90.8Very high141 Ų14199.8 Ų99.855%0.55351%0.511SS*.Hα-helixtrans-64.3-35.2179-65.8-58.4000112.3S491 E492 K497 E498 V499S491-Y495 WeakPolarHBondContact O-CD2 3.34Å; S491-Y495 PolarHBondContact O-N 2.92Å; E492-Y495 PolarHBondContact O-N 3.47Å; Y495-K497 PolarHBondContact O-N 2.82Å; Y495-E498 PolarHBondContact O-N 3.25Å; Y495-V499 WeakPolarHBondContact O-CB 3.5Å; Y495-V499 VanDerWaalsContact O-CG2 3.3Å; Y495-V499 WeakPolarHBondContact O-CG2 3.28Å; Y495-V499 PolarHBondContact O-N 3.37Å
496S92.4Very high90.8Very high56 Ų5699.5 Ų99.539%0.39251%0.509SS..Hα-helixtrans-63.3-25.8173.2-171.70000112.8E492 Y494 K500E492-S496 WeakPolarHBondContact O-CB 3.4Å; E492-S496 PolarHBondContact O-N 3.13Å; Y494-S496 VanDerWaalsContact C-N 3.31Å; Y494-S496 PolarHBondContact O-N 2.99Å; S496-K500 VanDerWaalsContact O-CG 3.29Å; S496-K500 WeakPolarHBondContact O-CG 3.48Å; S496-K500 PolarHBondContact O-NZ 3.04Å; S496-K500 PolarHBondContact OG-NZ 3.24Å
497K92.7Very high90.8Very high133 Ų13399.8 Ų99.858%0.57851%0.505SS*.Hα-helixtrans-80-49.9171.9-169.6-171.4172.3-1690111Q493 Y494 Y495 V499 K500 D501Q493-K497 PolarHBondContact O-N 3.19Å; Y494-K497 WeakPolarHBondContact O-CA 3.43Å; Y494-K497 WeakPolarHBondContact O-CB 3.46Å; Y494-K497 PolarHBondContact O-N 3.11Å; Y495-K497 PolarHBondContact O-N 2.82Å; K497-V499 VanDerWaalsContact C-N 3.27Å; K497-V499 PolarHBondContact O-N 2.95Å; K497-K500 WeakPolarHBondContact O-CA 3.33Å; K497-K500 WeakPolarHBondContact O-CB 3.39Å; K497-K500 PolarHBondContact O-N 2.97Å; K497-D501 WeakPolarHBondContact CE-OD2 3.19Å; K497-D501 PolarHBondContact O-N 2.91Å
498E91.8Very high90.9Very high81 Ų81102.2 Ų102.238%0.37951%0.51SS..Hα-helixtrans-54.7-41.8178.1-172.9169.4-14800112.1Y494 Y495 K500 D501 L502Y494-E498 WeakPolarHBondContact CE1-OE2 3.48Å; Y494-E498 PolarHBondContact O-N 2.89Å; Y495-E498 PolarHBondContact O-N 3.25Å; E498-K500 PolarHBondContact O-N 2.89Å; E498-D501 PolarHBondContact O-N 3.17Å; E498-L502 HydrophobicContact CG-CD1 4.18Å; E498-L502 WeakPolarHBondContact O-CB 3.4Å; E498-L502 WeakPolarHBondContact O-CG 3.24Å; E498-L502 PolarHBondContact O-N 2.86Å
499V88.1Confident90.8Very high97 Ų97102.1 Ų102.159%0.58851%0.507SS*.Hα-helixtrans-66.2-31174.3170.10000113.2Y495 K497 K503Y495-V499 WeakPolarHBondContact O-CB 3.5Å; Y495-V499 VanDerWaalsContact O-CG2 3.3Å; Y495-V499 WeakPolarHBondContact O-CG2 3.28Å; Y495-V499 PolarHBondContact O-N 3.37Å; K497-V499 VanDerWaalsContact C-N 3.27Å; K497-V499 PolarHBondContact O-N 2.95Å; V499-K503 VanDerWaalsContact O-CB 3.22Å; V499-K503 WeakPolarHBondContact O-CB 3.32Å; V499-K503 PolarHBondContact O-N 2.88Å; V499-K503 VanDerWaalsContact O-N 3.16Å
500K91.2Very high90.8Very high119 Ų119104 Ų10452%0.51751%0.51SS..Hα-helixtrans-72.1-45.3172.9-72.9176.5-165.586.90110.9S496 K497 E498 K503 T504S496-K500 VanDerWaalsContact O-CG 3.29Å; S496-K500 WeakPolarHBondContact O-CG 3.48Å; S496-K500 PolarHBondContact O-NZ 3.04Å; S496-K500 PolarHBondContact OG-NZ 3.24Å; K497-K500 WeakPolarHBondContact O-CA 3.33Å; K497-K500 WeakPolarHBondContact O-CB 3.39Å; K497-K500 PolarHBondContact O-N 2.97Å; E498-K500 PolarHBondContact O-N 2.89Å; K500-K503 WeakPolarHBondContact O-CB 3.41Å; K500-K503 PolarHBondContact O-N 3.25Å; K500-K503 VanDerWaalsContact O-N 3.17Å; K500-T504 PolarHBondContact O-N 2.81Å
501D90.7Very high90.9Very high83 Ų83104.8 Ų104.844%0.44451%0.511SS..Hα-helixtrans-63.2-50.1-177.8-63.5-15.9000109.7K497 E498 K503 T504 E505K497-D501 WeakPolarHBondContact CE-OD2 3.19Å; K497-D501 PolarHBondContact O-N 2.91Å; E498-D501 PolarHBondContact O-N 3.17Å; D501-K503 VanDerWaalsContact C-N 3.28Å; D501-K503 PolarHBondContact O-N 3.47Å; D501-T504 PolarHBondContact O-N 2.98Å; D501-T504 PolarHBondContact O-OG1 3.1Å; D501-E505 PolarHBondContact O-N 3.2Å
502L92.3Very high91.1Very high98 Ų98106.9 Ų106.951%0.51351%0.513SS..Hα-helixtrans-57.6-35.4172.4-72.6170.6000113.4E498 E505 L506E498-L502 HydrophobicContact CG-CD1 4.18Å; E498-L502 WeakPolarHBondContact O-CB 3.4Å; E498-L502 WeakPolarHBondContact O-CG 3.24Å; E498-L502 PolarHBondContact O-N 2.86Å; L502-E505 PolarHBondContact O-N 3Å; L502-L506 WeakPolarHBondContact O-CB 3.38Å; L502-L506 PolarHBondContact O-N 3.11Å
503K92Very high91Very high136 Ų136105.4 Ų105.459%0.59151%0.509SS*.Hα-helixtrans-67.4-36.8175.4-177.6176.61791800111.9V499 K500 D501 E507V499-K503 VanDerWaalsContact O-CB 3.22Å; V499-K503 WeakPolarHBondContact O-CB 3.32Å; V499-K503 PolarHBondContact O-N 2.88Å; V499-K503 VanDerWaalsContact O-N 3.16Å; K500-K503 WeakPolarHBondContact O-CB 3.41Å; K500-K503 PolarHBondContact O-N 3.25Å; K500-K503 VanDerWaalsContact O-N 3.17Å; D501-K503 VanDerWaalsContact C-N 3.28Å; D501-K503 PolarHBondContact O-N 3.47Å; K503-E507 PolarHBondContact O-N 3.29Å
504T91.1Very high91Very high86 Ų86103.7 Ų103.753%0.52851%0.508SS..Hα-helixtrans-68.9-38.3174.462.80000112.1K500 D501 L506 E507 N508K500-T504 PolarHBondContact O-N 2.81Å; D501-T504 PolarHBondContact O-N 2.98Å; D501-T504 PolarHBondContact O-OG1 3.1Å; T504-L506 PolarHBondContact O-N 3.44Å; T504-E507 PolarHBondContact O-N 2.87Å; T504-N508 VanDerWaalsContact O-CG 3.26Å; T504-N508 PolarHBondContact O-N 3.29Å; T504-N508 PolarHBondContact O-ND2 3.41Å
505E92Very high91Very high122 Ų122102 Ų10257%0.5751%0.505SS*.Hα-helixtrans-64.9-38.8175.8-167.8163.3-138.400112D501 L502 N508 E509D501-E505 PolarHBondContact O-N 3.2Å; L502-E505 PolarHBondContact O-N 3Å; E505-N508 PolarHBondContact O-N 3.45Å; E505-E509 PolarHBondContact O-N 2.93Å
506L91.1Very high91.1Very high102 Ų102100.1 Ų100.153%0.53450%0.504SS..Hα-helixtrans-63-39.9173.8-179.662.2000113.3L502 T504 K510L502-L506 WeakPolarHBondContact O-CB 3.38Å; L502-L506 PolarHBondContact O-N 3.11Å; T504-L506 PolarHBondContact O-N 3.44Å; L506-K510 WeakPolarHBondContact O-CG 3.37Å; L506-K510 PolarHBondContact O-N 3.24Å; L506-K510 VanDerWaalsContact O-N 3.11Å
507E90.8Very high91.1Very high89 Ų89100.7 Ų100.742%0.41651%0.505SS..Hα-helixtrans-70.9-34.1174.4-61.1-51.8144.400112.2K503 T504 K510 L511K503-E507 PolarHBondContact O-N 3.29Å; T504-E507 PolarHBondContact O-N 2.87Å; E507-K510 WeakPolarHBondContact O-CB 3.41Å; E507-K510 PolarHBondContact O-N 3.27Å; E507-K510 IonicContact OE1-NZ 3.78Å; E507-K510 PolarHBondContact OE1-NZ 2.8Å; E507-K510 WeakPolarHBondContact OE2-CD 3.31Å; E507-K510 IonicContact OE2-NZ 2.6Å; E507-K510 PolarHBondContact OE2-NZ 2.92Å; E507-L511 PolarHBondContact O-N 3.47Å
508N91Very high91Very high105 Ų10597.5 Ų97.556%0.56150%0.5SS*.Hα-helixtrans-63.7-46.6174.3-70.5-24.5000112T504 E505 K510 L511 K512T504-N508 VanDerWaalsContact O-CG 3.26Å; T504-N508 PolarHBondContact O-N 3.29Å; T504-N508 PolarHBondContact O-ND2 3.41Å; E505-N508 PolarHBondContact O-N 3.45Å; N508-K510 VanDerWaalsContact C-N 3.34Å; N508-K510 PolarHBondContact O-N 3.07Å; N508-L511 WeakPolarHBondContact O-CB 3.33Å; N508-L511 PolarHBondContact O-N 3.49Å; N508-K512 WeakPolarHBondContact O-CB 3.5Å; N508-K512 PolarHBondContact O-N 3.44Å
509E88.9Confident91Very high98 Ų9899.2 Ų99.246%0.45851%0.507SS..Hα-helixtrans-69.1-29.6177-72.5-60.412700112.7E505 K512 N513E505-E509 PolarHBondContact O-N 2.93Å; E509-K512 VanDerWaalsContact CD-NZ 3.26Å; E509-K512 VanDerWaalsContact OE1-CD 3.23Å; E509-K512 WeakPolarHBondContact OE1-CD 3.36Å; E509-K512 WeakPolarHBondContact OE1-CE 3.48Å; E509-K512 IonicContact OE1-NZ 3.64Å; E509-K512 PolarHBondContact OE1-NZ 3.49Å; E509-K512 VanDerWaalsContact OE2-CD 3.29Å; E509-K512 WeakPolarHBondContact OE2-CD 3.29Å; E509-K512 IonicContact OE2-NZ 3.21Å; E509-K512 PolarHBondContact OE2-NZ 3.08Å; E509-K512 VanDerWaalsContact OE2-NZ 3.1Å; E509-N513 VanDerWaalsContact O-CB 3.28Å; E509-N513 WeakPolarHBondContact O-CB 3.24Å; E509-N513 PolarHBondContact O-N 3.06Å
510K90.6Very high91Very high99 Ų9998.4 Ų98.443%0.4351%0.505SS..Hα-helixtrans-61.5-47.3167.9-77.7165.6174.6178.30111.7L506 E507 N508 K512 N513 T514L506-K510 WeakPolarHBondContact O-CG 3.37Å; L506-K510 PolarHBondContact O-N 3.24Å; L506-K510 VanDerWaalsContact O-N 3.11Å; E507-K510 WeakPolarHBondContact O-CB 3.41Å; E507-K510 PolarHBondContact O-N 3.27Å; E507-K510 IonicContact OE1-NZ 3.78Å; E507-K510 PolarHBondContact OE1-NZ 2.8Å; E507-K510 WeakPolarHBondContact OE2-CD 3.31Å; E507-K510 IonicContact OE2-NZ 2.6Å; E507-K510 PolarHBondContact OE2-NZ 2.92Å; N508-K510 VanDerWaalsContact C-N 3.34Å; N508-K510 PolarHBondContact O-N 3.07Å; K510-K512 PolarHBondContact O-N 3.24Å; K510-N513 WeakPolarHBondContact O-CB 3.4Å; K510-N513 PolarHBondContact O-N 3.33Å; K510-T514 PolarHBondContact O-N 2.84Å
511L91.1Very high91Very high105 Ų10597.8 Ų97.855%0.5551%0.508SS..Hα-helixtrans-58.4-50.1178.9-162.696.3000110.4E507 N508 N513 T514 E515E507-L511 PolarHBondContact O-N 3.47Å; N508-L511 WeakPolarHBondContact O-CB 3.33Å; N508-L511 PolarHBondContact O-N 3.49Å; L511-N513 VanDerWaalsContact C-N 3.3Å; L511-N513 PolarHBondContact O-N 3.01Å; L511-T514 CarbonylContact O-C 3.55Å; L511-T514 WeakPolarHBondContact O-CA 3.23Å; L511-T514 PolarHBondContact O-N 3.19Å; L511-T514 PolarHBondContact O-OG1 3.02Å; L511-E515 PolarHBondContact O-N 2.84Å
512K92Very high91.2Very high96 Ų96100.6 Ų100.642%0.41752%0.516SS..Hα-helixtrans-59.1-36.1176.5-164.2-169.4-169.6-173.20113N508 E509 K510 E515 L516N508-K512 WeakPolarHBondContact O-CB 3.5Å; N508-K512 PolarHBondContact O-N 3.44Å; E509-K512 VanDerWaalsContact CD-NZ 3.26Å; E509-K512 VanDerWaalsContact OE1-CD 3.23Å; E509-K512 WeakPolarHBondContact OE1-CD 3.36Å; E509-K512 WeakPolarHBondContact OE1-CE 3.48Å; E509-K512 IonicContact OE1-NZ 3.64Å; E509-K512 PolarHBondContact OE1-NZ 3.49Å; E509-K512 VanDerWaalsContact OE2-CD 3.29Å; E509-K512 WeakPolarHBondContact OE2-CD 3.29Å; E509-K512 IonicContact OE2-NZ 3.21Å; E509-K512 PolarHBondContact OE2-NZ 3.08Å; E509-K512 VanDerWaalsContact OE2-NZ 3.1Å; K510-K512 PolarHBondContact O-N 3.24Å; K512-E515 PolarHBondContact O-N 2.67Å; K512-L516 WeakPolarHBondContact O-CB 3.38Å; K512-L516 WeakPolarHBondContact O-CG 3.45Å; K512-L516 PolarHBondContact O-N 3.04Å
513N89.1Confident91Very high99 Ų99100.2 Ų100.253%0.52951%0.514SS..Hα-helixtrans-69.4-35.6172.9-169.222.8000112.1E509 K510 L511 T517E509-N513 VanDerWaalsContact O-CB 3.28Å; E509-N513 WeakPolarHBondContact O-CB 3.24Å; E509-N513 PolarHBondContact O-N 3.06Å; K510-N513 WeakPolarHBondContact O-CB 3.4Å; K510-N513 PolarHBondContact O-N 3.33Å; L511-N513 VanDerWaalsContact C-N 3.3Å; L511-N513 PolarHBondContact O-N 3.01Å; N513-T517 WeakPolarHBondContact O-CB 3.47Å; N513-T517 PolarHBondContact O-N 3.21Å; N513-T517 PolarHBondContact O-OG1 3.33Å
514T90.8Very high91Very high91 Ų9196.4 Ų96.456%0.55850%0.504SS*.Hα-helixtrans-69-36.6171.659.90000112.6K510 L511 T517 S518K510-T514 PolarHBondContact O-N 2.84Å; L511-T514 CarbonylContact O-C 3.55Å; L511-T514 WeakPolarHBondContact O-CA 3.23Å; L511-T514 PolarHBondContact O-N 3.19Å; L511-T514 PolarHBondContact O-OG1 3.02Å; T514-T517 PolarHBondContact O-N 3.02Å; T514-S518 PolarHBondContact O-N 3.34Å
515E92.2Very high91Very high105 Ų10596.9 Ų96.949%0.49150%0.503SS..Hα-helixtrans-61.6-50.3171.2-69.7-178.9157.300111.3L511 K512 T517 S518 H519L511-E515 PolarHBondContact O-N 2.84Å; K512-E515 PolarHBondContact O-N 2.67Å; E515-T517 VanDerWaalsContact C-N 3.3Å; E515-T517 PolarHBondContact O-N 2.87Å; E515-S518 WeakPolarHBondContact O-CA 3.37Å; E515-S518 WeakPolarHBondContact O-CB 3.2Å; E515-S518 PolarHBondContact O-N 2.75Å; E515-S518 PolarHBondContact O-OG 3.45Å; E515-H519 PolarHBondContact O-CD2 3.08Å; E515-H519 PolarHBondContact O-N 3.15Å
516L91.3Very high91Very high103 Ų10395.5 Ų95.554%0.53950%0.497SS..Hα-helixtrans-58.1-41.2175.1-76.9167.9000112.1K512 S518 H519 C520K512-L516 WeakPolarHBondContact O-CB 3.38Å; K512-L516 WeakPolarHBondContact O-CG 3.45Å; K512-L516 PolarHBondContact O-N 3.04Å; L516-S518 VanDerWaalsContact C-N 3.33Å; L516-S518 PolarHBondContact O-N 2.85Å; L516-H519 PolarHBondContact O-N 3Å; L516-C520 PolarHBondContact O-N 2.82Å; L516-C520 PolarHBondContact O-SG 3.24Å; L516-C520 VanDerWaalsContact O-SG 3.37Å
517T92.2Very high90.8Very high67 Ų6795.3 Ų95.341%0.41150%0.496SS..Hα-helixtrans-61.6-41.5174.1-59.70000111.2N513 T514 E515 C520 N521N513-T517 WeakPolarHBondContact O-CB 3.47Å; N513-T517 PolarHBondContact O-N 3.21Å; N513-T517 PolarHBondContact O-OG1 3.33Å; T514-T517 PolarHBondContact O-N 3.02Å; E515-T517 VanDerWaalsContact C-N 3.3Å; E515-T517 PolarHBondContact O-N 2.87Å; T517-C520 PolarHBondContact O-N 3.31Å; T517-N521 WeakPolarHBondContact O-CB 3.46Å; T517-N521 VanDerWaalsContact O-CG 3.26Å; T517-N521 PolarHBondContact O-N 2.87Å; T517-N521 PolarHBondContact O-ND2 3.45Å
518S91.3Very high90.8Very high67 Ų6797.4 Ų97.447%0.46950%0.504SS..Hα-helixtrans-64.3-39.2175.583.10000112.3T514 E515 L516 N521 K522T514-S518 PolarHBondContact O-N 3.34Å; E515-S518 WeakPolarHBondContact O-CA 3.37Å; E515-S518 WeakPolarHBondContact O-CB 3.2Å; E515-S518 PolarHBondContact O-N 2.75Å; E515-S518 PolarHBondContact O-OG 3.45Å; L516-S518 VanDerWaalsContact C-N 3.33Å; L516-S518 PolarHBondContact O-N 2.85Å; S518-N521 PolarHBondContact O-N 3.46Å; S518-K522 WeakPolarHBondContact O-CB 3.46Å; S518-K522 PolarHBondContact O-N 3.19Å
519H91.3Very high90.8Very high116 Ų11698 Ų9854%0.53750%0.503SS..Hα-helixtrans-65.7-44.1175-86-74.2000112.3E515 L516 N521 K522 L523E515-H519 PolarHBondContact O-CD2 3.08Å; E515-H519 PolarHBondContact O-N 3.15Å; L516-H519 PolarHBondContact O-N 3Å; H519-N521 VanDerWaalsContact C-N 3.34Å; H519-N521 PolarHBondContact O-N 3.01Å; H519-K522 PolarHBondContact O-N 2.82Å; H519-L523 WeakPolarHBondContact O-CB 3.24Å; H519-L523 WeakPolarHBondContact O-CG 3.46Å; H519-L523 PolarHBondContact O-N 2.76Å
520C88Confident90.9Very high80 Ų8097.3 Ų97.354%0.54150%0.502SS..Hα-helixtrans-61.1-41.7174.3-72.40000112L516 T517 L523 S524L516-C520 PolarHBondContact O-N 2.82Å; L516-C520 PolarHBondContact O-SG 3.24Å; L516-C520 VanDerWaalsContact O-SG 3.37Å; T517-C520 PolarHBondContact O-N 3.31Å; C520-L523 PolarHBondContact O-N 2.87Å; C520-S524 WeakPolarHBondContact O-CB 3.46Å; C520-S524 PolarHBondContact O-N 3.48Å
521N91.9Very high90.6Very high107 Ų10797.2 Ų97.257%0.57251%0.51SS*.Hα-helixtrans-65.1-41.2175.9-72.5-22000111.9T517 S518 H519 S524 L525T517-N521 WeakPolarHBondContact O-CB 3.46Å; T517-N521 VanDerWaalsContact O-CG 3.26Å; T517-N521 PolarHBondContact O-N 2.87Å; T517-N521 PolarHBondContact O-ND2 3.45Å; S518-N521 PolarHBondContact O-N 3.46Å; H519-N521 VanDerWaalsContact C-N 3.34Å; H519-N521 PolarHBondContact O-N 3.01Å; N521-S524 PolarHBondContact O-N 2.85Å; N521-L525 PolarHBondContact O-N 3.1Å; N521-L525 VanDerWaalsContact O-N 3.14Å
522K93.4Very high90.6Very high142 Ų14297.1 Ų97.162%0.61751%0.507SS*.Hα-helixtrans-63.1-48.5175.1-175.3175.2178.5178.40111.7S518 H519 S524 L525 E526S518-K522 WeakPolarHBondContact O-CB 3.46Å; S518-K522 PolarHBondContact O-N 3.19Å; H519-K522 PolarHBondContact O-N 2.82Å; K522-S524 PolarHBondContact O-N 3.48Å; K522-L525 WeakPolarHBondContact O-CB 3.24Å; K522-L525 PolarHBondContact O-N 3.33Å; K522-E526 PolarHBondContact O-N 3.21Å
523L89.6Confident90.6Very high90 Ų9097.8 Ų97.847%0.47151%0.511SS..Hα-helixtrans-61.2-32.6175.8-71.3167.9000112H519 C520 L525 N527H519-L523 WeakPolarHBondContact O-CB 3.24Å; H519-L523 WeakPolarHBondContact O-CG 3.46Å; H519-L523 PolarHBondContact O-N 2.76Å; C520-L523 PolarHBondContact O-N 2.87Å; L523-L525 VanDerWaalsContact C-N 3.31Å; L523-L525 PolarHBondContact O-N 3.39Å; L523-N527 WeakPolarHBondContact O-CB 3.34Å; L523-N527 PolarHBondContact O-N 3Å; L523-N527 PolarHBondContact O-ND2 3.25Å
524S90.8Very high90.4Very high56 Ų5697.1 Ų97.139%0.39251%0.511SS..Hα-helixtrans-69.5-26.2173.8-174.60000113.3C520 N521 K522 K528C520-S524 WeakPolarHBondContact O-CB 3.46Å; C520-S524 PolarHBondContact O-N 3.48Å; N521-S524 PolarHBondContact O-N 2.85Å; K522-S524 PolarHBondContact O-N 3.48Å; S524-K528 WeakPolarHBondContact O-CD 3.43Å; S524-K528 VanDerWaalsContact O-CG 3.3Å; S524-K528 WeakPolarHBondContact O-CG 3.49Å
525L92.1Very high90.5Very high96 Ų9695.4 Ų95.450%0.50350%0.503SS..Hα-helixtrans-80.8-47.1174.8-170.1130.5000111N521 K522 L523 N527 K528 E529N521-L525 PolarHBondContact O-N 3.1Å; N521-L525 VanDerWaalsContact O-N 3.14Å; K522-L525 WeakPolarHBondContact O-CB 3.24Å; K522-L525 PolarHBondContact O-N 3.33Å; L523-L525 VanDerWaalsContact C-N 3.31Å; L523-L525 PolarHBondContact O-N 3.39Å; L525-N527 VanDerWaalsContact C-N 3.31Å; L525-N527 PolarHBondContact O-N 2.91Å; L525-K528 WeakPolarHBondContact O-CA 3.42Å; L525-K528 WeakPolarHBondContact O-CB 3.5Å; L525-K528 PolarHBondContact O-N 2.68Å; L525-E529 WeakPolarHBondContact CD2-OE1 3.43Å; L525-E529 PolarHBondContact O-N 3.41Å
526E90.6Very high90.5Very high93 Ų9394.2 Ų94.244%0.43550%0.5SS..Hα-helixtrans-57.2-40.5174.8-171.5170.7-172.300111.9K522 K528 E529 L530K522-E526 PolarHBondContact O-N 3.21Å; E526-K528 VanDerWaalsContact C-N 3.33Å; E526-K528 PolarHBondContact O-N 3.22Å; E526-E529 PolarHBondContact O-N 2.89Å; E526-L530 WeakPolarHBondContact O-CB 3.45Å; E526-L530 WeakPolarHBondContact O-CG 3.41Å; E526-L530 PolarHBondContact O-N 2.96Å
527N88.3Confident90.5Very high98 Ų9894.3 Ų94.352%0.52450%0.499SS..Hα-helixtrans-64.8-31.3172.1-85-75.9000113.6L523 L525 T531L523-N527 WeakPolarHBondContact O-CB 3.34Å; L523-N527 PolarHBondContact O-N 3Å; L523-N527 PolarHBondContact O-ND2 3.25Å; L525-N527 VanDerWaalsContact C-N 3.31Å; L525-N527 PolarHBondContact O-N 2.91Å; N527-T531 WeakPolarHBondContact O-CG2 3.44Å; N527-T531 PolarHBondContact O-N 3.46Å; N527-T531 PolarHBondContact O-OG1 3.29Å
528K90.9Very high90.4Very high132 Ų13295.2 Ų95.257%0.57451%0.505SS*.Hα-helixtrans-72.4-43.2176.7-73.1164-173.1165.30110.9S524 L525 E526 T531 Q532S524-K528 WeakPolarHBondContact O-CD 3.43Å; S524-K528 VanDerWaalsContact O-CG 3.3Å; S524-K528 WeakPolarHBondContact O-CG 3.49Å; L525-K528 WeakPolarHBondContact O-CA 3.42Å; L525-K528 WeakPolarHBondContact O-CB 3.5Å; L525-K528 PolarHBondContact O-N 2.68Å; E526-K528 VanDerWaalsContact C-N 3.33Å; E526-K528 PolarHBondContact O-N 3.22Å; K528-T531 WeakPolarHBondContact CA-OG1 3.34Å; K528-T531 PolarHBondContact O-N 2.86Å; K528-T531 PolarHBondContact O-OG1 2.98Å; K528-Q532 PolarHBondContact O-N 3.34Å
529E90.7Very high90.4Very high117 Ų11796.5 Ų96.555%0.54751%0.506SS..Hα-helixtrans-58.7-47.6174.6-68.6169.9157.600110.4L525 E526 T531 Q532 E533L525-E529 WeakPolarHBondContact CD2-OE1 3.43Å; L525-E529 PolarHBondContact O-N 3.41Å; E526-E529 PolarHBondContact O-N 2.89Å; E529-T531 PolarHBondContact O-N 2.9Å; E529-Q532 WeakPolarHBondContact O-CB 3.4Å; E529-Q532 PolarHBondContact O-N 2.91Å; E529-Q532 VanDerWaalsContact O-N 3.08Å; E529-E533 WeakPolarHBondContact O-CB 3.47Å; E529-E533 PolarHBondContact O-N 3.27Å
530L89.9Confident90.4Very high84 Ų8496.7 Ų96.744%0.4451%0.507SS..Hα-helixtrans-60.2-38.5174-72.4168.9000113.4E526 Q532 T534E526-L530 WeakPolarHBondContact O-CB 3.45Å; E526-L530 WeakPolarHBondContact O-CG 3.41Å; E526-L530 PolarHBondContact O-N 2.96Å; L530-Q532 VanDerWaalsContact C-N 3.35Å; L530-T534 VanDerWaalsContact O-CB 3.3Å; L530-T534 WeakPolarHBondContact O-CB 3.49Å; L530-T534 PolarHBondContact O-N 3.39Å; L530-T534 PolarHBondContact O-OG1 3.46Å
531T85.9Confident90.5Very high97 Ų9797.7 Ų97.760%0.59551%0.506SS*.Hα-helixtrans-69.3-31.417450.70000113.3N527 K528 E529 S535N527-T531 WeakPolarHBondContact O-CG2 3.44Å; N527-T531 PolarHBondContact O-N 3.46Å; N527-T531 PolarHBondContact O-OG1 3.29Å; K528-T531 WeakPolarHBondContact CA-OG1 3.34Å; K528-T531 PolarHBondContact O-N 2.86Å; K528-T531 PolarHBondContact O-OG1 2.98Å; E529-T531 PolarHBondContact O-N 2.9Å; T531-S535 PolarHBondContact O-N 2.72Å; T531-S535 VanDerWaalsContact O-N 3.15Å
532Q90.6Very high90.5Very high103 Ų10399.1 Ų99.148%0.48151%0.507SS..Hα-helixtrans-69.9-51.9175.3-177.355.452.600110.2K528 E529 L530 T534 S535 D536K528-Q532 PolarHBondContact O-N 3.34Å; E529-Q532 WeakPolarHBondContact O-CB 3.4Å; E529-Q532 PolarHBondContact O-N 2.91Å; E529-Q532 VanDerWaalsContact O-N 3.08Å; L530-Q532 VanDerWaalsContact C-N 3.35Å; Q532-T534 VanDerWaalsContact C-N 3.29Å; Q532-T534 PolarHBondContact O-N 2.86Å; Q532-S535 PolarHBondContact NE2-OG 3.49Å; Q532-S535 CarbonylContact O-C 3.57Å; Q532-S535 WeakPolarHBondContact O-CA 3.5Å; Q532-S535 WeakPolarHBondContact O-CB 3.23Å; Q532-S535 PolarHBondContact O-N 3.07Å; Q532-S535 PolarHBondContact O-OG 3.39Å; Q532-D536 PolarHBondContact NE2-OD1 3.31Å; Q532-D536 PolarHBondContact NE2-OD2 3.41Å; Q532-D536 PolarHBondContact O-N 2.97Å
533E91.1Very high90.5Very high110 Ų11096.3 Ų96.351%0.51450%0.499SS..Hα-helixtrans-55-42.8175.1-175.6-177.5-164.500111.9E529 S535 D536 M537E529-E533 WeakPolarHBondContact O-CB 3.47Å; E529-E533 PolarHBondContact O-N 3.27Å; E533-S535 VanDerWaalsContact C-N 3.28Å; E533-S535 PolarHBondContact O-N 3.02Å; E533-D536 PolarHBondContact O-N 2.74Å; E533-M537 VanDerWaalsContact O-CB 3.25Å; E533-M537 WeakPolarHBondContact O-CB 3.38Å; E533-M537 PolarHBondContact O-N 3.18Å
534T86.5Confident90.5Very high86 Ų8696.5 Ų96.553%0.52850%0.498SS..Hα-helixtrans-60.7-37.1173.9-59.20000111.9L530 Q532 T538L530-T534 VanDerWaalsContact O-CB 3.3Å; L530-T534 WeakPolarHBondContact O-CB 3.49Å; L530-T534 PolarHBondContact O-N 3.39Å; L530-T534 PolarHBondContact O-OG1 3.46Å; Q532-T534 VanDerWaalsContact C-N 3.29Å; Q532-T534 PolarHBondContact O-N 2.86Å; T534-T538 WeakPolarHBondContact O-CB 3.47Å; T534-T538 PolarHBondContact O-N 2.98Å; T534-T538 PolarHBondContact O-OG1 2.64Å
535S92.3Very high90.4Very high54 Ų5498.6 Ų98.638%0.37850%0.501SS..Hα-helixtrans-73.2-38.4178.582.20000112.6T531 Q532 E533 T538 L539T531-S535 PolarHBondContact O-N 2.72Å; T531-S535 VanDerWaalsContact O-N 3.15Å; Q532-S535 PolarHBondContact NE2-OG 3.49Å; Q532-S535 CarbonylContact O-C 3.57Å; Q532-S535 WeakPolarHBondContact O-CA 3.5Å; Q532-S535 WeakPolarHBondContact O-CB 3.23Å; Q532-S535 PolarHBondContact O-N 3.07Å; Q532-S535 PolarHBondContact O-OG 3.39Å; E533-S535 VanDerWaalsContact C-N 3.28Å; E533-S535 PolarHBondContact O-N 3.02Å; S535-T538 WeakPolarHBondContact O-CB 3.42Å; S535-T538 PolarHBondContact O-N 3.17Å; S535-L539 PolarHBondContact O-N 3.11Å
536D92.2Very high90.4Very high80 Ų8099.3 Ų99.343%0.42850%0.502SS..Hα-helixtrans-70.5-42.9178-64.2-41.9000110.9Q532 E533 T538 L539 E540Q532-D536 PolarHBondContact NE2-OD1 3.31Å; Q532-D536 PolarHBondContact NE2-OD2 3.41Å; Q532-D536 PolarHBondContact O-N 2.97Å; E533-D536 PolarHBondContact O-N 2.74Å; D536-T538 VanDerWaalsContact C-N 3.28Å; D536-T538 PolarHBondContact O-N 2.92Å; D536-L539 WeakPolarHBondContact O-CB 3.42Å; D536-L539 PolarHBondContact O-N 3.49Å; D536-L539 VanDerWaalsContact O-N 3.09Å; D536-E540 PolarHBondContact O-N 3.32Å
537M91.2Very high90.4Very high105 Ų10599.5 Ų99.552%0.51751%0.506SS..Hα-helixtrans-61.3-36.1171.5-168.7-175.5-58.600111.9E533 E540 L541E533-M537 VanDerWaalsContact O-CB 3.25Å; E533-M537 WeakPolarHBondContact O-CB 3.38Å; E533-M537 PolarHBondContact O-N 3.18Å; M537-E540 PolarHBondContact O-N 2.93Å; M537-L541 HydrophobicContact CG-CD1 4.5Å; M537-L541 WeakPolarHBondContact O-CB 3.38Å; M537-L541 VanDerWaalsContact O-CG 3.28Å; M537-L541 WeakPolarHBondContact O-CG 3.28Å; M537-L541 PolarHBondContact O-N 3.07Å
538T89.6Confident90.6Very high87 Ų8799.6 Ų99.653%0.53451%0.505SS..Hα-helixtrans-67.3-36.1173.8-61.40000112T534 S535 D536 K542T534-T538 WeakPolarHBondContact O-CB 3.47Å; T534-T538 PolarHBondContact O-N 2.98Å; T534-T538 PolarHBondContact O-OG1 2.64Å; S535-T538 WeakPolarHBondContact O-CB 3.42Å; S535-T538 PolarHBondContact O-N 3.17Å; D536-T538 VanDerWaalsContact C-N 3.28Å; D536-T538 PolarHBondContact O-N 2.92Å; T538-K542 WeakPolarHBondContact O-CB 3.36Å; T538-K542 PolarHBondContact O-N 3.38Å
539L92.7Very high90.7Very high94 Ų9497 Ų9749%0.49250%0.497SS..Hα-helixtrans-68-43.4174.3-179.263.7000111.4S535 D536 K542 N543S535-L539 PolarHBondContact O-N 3.11Å; D536-L539 WeakPolarHBondContact O-CB 3.42Å; D536-L539 PolarHBondContact O-N 3.49Å; D536-L539 VanDerWaalsContact O-N 3.09Å; L539-K542 WeakPolarHBondContact O-CB 3.41Å; L539-K542 PolarHBondContact O-N 3.43Å; L539-N543 VanDerWaalsContact O-CG 3.32Å; L539-N543 PolarHBondContact O-N 2.88Å; L539-N543 PolarHBondContact O-OD1 3.41Å
540E90.9Very high90.9Very high119 Ų11994.5 Ų94.556%0.55649%0.488SS*.Hα-helixtrans-67.1-42.7179.3-172.4165.9-168.400112.3D536 M537 K542 N543 Q544D536-E540 PolarHBondContact O-N 3.32Å; M537-E540 PolarHBondContact O-N 2.93Å; E540-K542 PolarHBondContact O-N 3.33Å; E540-N543 PolarHBondContact O-N 3.31Å; E540-N543 VanDerWaalsContact O-N 3.1Å; E540-Q544 WeakPolarHBondContact O-CG 3.4Å; E540-Q544 PolarHBondContact O-N 2.91Å
541L90.1Very high90.9Very high102 Ų10295.4 Ų95.453%0.53449%0.493SS..Hα-helixtrans-57-36.2171.1-75.8170.2000112.2M537 Q545M537-L541 HydrophobicContact CG-CD1 4.5Å; M537-L541 WeakPolarHBondContact O-CB 3.38Å; M537-L541 VanDerWaalsContact O-CG 3.28Å; M537-L541 WeakPolarHBondContact O-CG 3.28Å; M537-L541 PolarHBondContact O-N 3.07Å; L541-Q545 VanDerWaalsContact O-CB 3.3Å; L541-Q545 WeakPolarHBondContact O-CB 3.46Å; L541-Q545 PolarHBondContact O-N 3.37Å
542K91.8Very high91.1Very high137 Ų13796.2 Ų96.260%0.59649%0.488SS*.Hα-helixtrans-69.1-40.3176-172.7-172.6173.8-165.60112T538 L539 E540 Q545 E546T538-K542 WeakPolarHBondContact O-CB 3.36Å; T538-K542 PolarHBondContact O-N 3.38Å; L539-K542 WeakPolarHBondContact O-CB 3.41Å; L539-K542 PolarHBondContact O-N 3.43Å; E540-K542 PolarHBondContact O-N 3.33Å; K542-Q545 PolarHBondContact O-N 3.26Å; K542-E546 PolarHBondContact O-N 2.84Å
543N92.2Very high91.2Very high82 Ų8295.9 Ų95.944%0.43949%0.486SS..Hα-helixtrans-63.8-49175.6-64.1-16.8000110.8L539 E540 Q545 E546 D547L539-N543 VanDerWaalsContact O-CG 3.32Å; L539-N543 PolarHBondContact O-N 2.88Å; L539-N543 PolarHBondContact O-OD1 3.41Å; E540-N543 PolarHBondContact O-N 3.31Å; E540-N543 VanDerWaalsContact O-N 3.1Å; N543-Q545 VanDerWaalsContact C-N 3.26Å; N543-Q545 PolarHBondContact O-N 3.33Å; N543-E546 WeakPolarHBondContact O-CA 3.5Å; N543-E546 PolarHBondContact O-N 3.42Å; N543-D547 PolarHBondContact O-N 3.31Å
544Q90Very high91.1Very high95 Ų9595.6 Ų95.644%0.44448%0.484SS..Hα-helixtrans-57.5-38.8175-67.517712.700111.9E540 E546 D547 I548E540-Q544 WeakPolarHBondContact O-CG 3.4Å; E540-Q544 PolarHBondContact O-N 2.91Å; Q544-E546 VanDerWaalsContact C-N 3.34Å; Q544-E546 PolarHBondContact O-N 2.91Å; Q544-D547 PolarHBondContact O-N 2.88Å; Q544-I548 WeakPolarHBondContact O-CD1 3.24Å; Q544-I548 VanDerWaalsContact O-CG1 3.26Å; Q544-I548 WeakPolarHBondContact O-CG1 3.46Å; Q544-I548 PolarHBondContact O-N 3.46Å
545Q89.4Confident91.1Very high99 Ų9996.6 Ų96.646%0.46348%0.483SS..Hα-helixtrans-66.7-32.3174.9-178.559.596.200112.7L541 K542 N543 N549L541-Q545 VanDerWaalsContact O-CB 3.3Å; L541-Q545 WeakPolarHBondContact O-CB 3.46Å; L541-Q545 PolarHBondContact O-N 3.37Å; K542-Q545 PolarHBondContact O-N 3.26Å; N543-Q545 VanDerWaalsContact C-N 3.26Å; N543-Q545 PolarHBondContact O-N 3.33Å; Q545-N549 PolarHBondContact NE2-ND2 3.33Å; Q545-N549 PolarHBondContact O-N 2.91Å; Q545-N549 PolarHBondContact O-ND2 2.92Å
546E91.1Very high91Very high112 Ų11298.4 Ų98.452%0.52349%0.485SS..Hα-helixtrans-72.3-40.2173.1-174.6148.3-165.500112K542 N543 Q544 N549 N550K542-E546 PolarHBondContact O-N 2.84Å; N543-E546 WeakPolarHBondContact O-CA 3.5Å; N543-E546 PolarHBondContact O-N 3.42Å; Q544-E546 VanDerWaalsContact C-N 3.34Å; Q544-E546 PolarHBondContact O-N 2.91Å; E546-N549 CarbonylContact O-C 3.56Å; E546-N549 WeakPolarHBondContact O-CB 3.47Å; E546-N549 PolarHBondContact O-N 2.87Å; E546-N549 VanDerWaalsContact O-N 3.13Å; E546-N550 PolarHBondContact O-N 3.01Å; E546-N550 PolarHBondContact O-ND2 3.48Å
547D92Very high91Very high96 Ų96102 Ų10251%0.51349%0.493SS..Hα-helixtrans-62.6-42.5173.5-74.3-31.7000112.5N543 Q544 N549 N550 N551N543-D547 PolarHBondContact O-N 3.31Å; Q544-D547 PolarHBondContact O-N 2.88Å; D547-N549 VanDerWaalsContact C-N 3.28Å; D547-N549 PolarHBondContact O-N 2.97Å; D547-N550 PolarHBondContact O-N 3.2Å; D547-N550 VanDerWaalsContact O-N 3.11Å; D547-N551 WeakPolarHBondContact O-CB 3.23Å; D547-N551 PolarHBondContact O-N 2.96Å; D547-N551 PolarHBondContact O-ND2 3.11Å
548I91.9Very high90.7Very high100 Ų100101.2 Ų101.251%0.51349%0.489SS..Hα-helixtrans-57.1-43171.7-71.9164.5000110.8Q544 N550 K552Q544-I548 WeakPolarHBondContact O-CD1 3.24Å; Q544-I548 VanDerWaalsContact O-CG1 3.26Å; Q544-I548 WeakPolarHBondContact O-CG1 3.46Å; Q544-I548 PolarHBondContact O-N 3.46Å; I548-N550 VanDerWaalsContact C-N 3.33Å; I548-N550 PolarHBondContact O-N 3.48Å; I548-K552 WeakPolarHBondContact O-CB 3.45Å; I548-K552 PolarHBondContact O-N 3.48Å
549N93.2Very high90.7Very high77 Ų77101.9 Ų101.941%0.41249%0.489SS..Hα-helixtrans-67.9-31177.1-77.2-46.4000112.8Q545 E546 D547 K553Q545-N549 PolarHBondContact NE2-ND2 3.33Å; Q545-N549 PolarHBondContact O-N 2.91Å; Q545-N549 PolarHBondContact O-ND2 2.92Å; E546-N549 CarbonylContact O-C 3.56Å; E546-N549 WeakPolarHBondContact O-CB 3.47Å; E546-N549 PolarHBondContact O-N 2.87Å; E546-N549 VanDerWaalsContact O-N 3.13Å; D547-N549 VanDerWaalsContact C-N 3.28Å; D547-N549 PolarHBondContact O-N 2.97Å; N549-K553 WeakPolarHBondContact O-CD 3.41Å; N549-K553 WeakPolarHBondContact O-CE 3.41Å; N549-K553 VanDerWaalsContact O-CG 3.24Å; N549-K553 WeakPolarHBondContact O-CG 3.44Å; N549-K553 PolarHBondContact O-N 2.93Å
550N93.9Very high90.6Very high65 Ų65103.2 Ų103.235%0.34849%0.491SS..Hα-helixtrans-77.8-41.2177.1-69.9-31.1000112.1E546 D547 I548 K552 K553 Q554E546-N550 PolarHBondContact O-N 3.01Å; E546-N550 PolarHBondContact O-ND2 3.48Å; D547-N550 PolarHBondContact O-N 3.2Å; D547-N550 VanDerWaalsContact O-N 3.11Å; I548-N550 VanDerWaalsContact C-N 3.33Å; I548-N550 PolarHBondContact O-N 3.48Å; N550-K552 VanDerWaalsContact C-N 3.34Å; N550-K552 PolarHBondContact O-N 2.88Å; N550-K553 WeakPolarHBondContact O-CB 3.41Å; N550-K553 PolarHBondContact O-N 2.93Å; N550-K553 PolarHBondContact OD1-NZ 3Å; N550-Q554 PolarHBondContact O-N 3.27Å; N550-Q554 VanDerWaalsContact O-N 3.11Å
551N90.9Very high90.5Very high103 Ų103103.3 Ų103.355%0.55149%0.491SS*.Hα-helixtrans-59.2-43.7171.6-74.5-35.8000111.4D547 K553 Q554 E555D547-N551 WeakPolarHBondContact O-CB 3.23Å; D547-N551 PolarHBondContact O-N 2.96Å; D547-N551 PolarHBondContact O-ND2 3.11Å; N551-K553 PolarHBondContact O-N 3.34Å; N551-Q554 CarbonylContact O-C 3.54Å; N551-Q554 WeakPolarHBondContact O-CA 3.46Å; N551-Q554 WeakPolarHBondContact O-CB 3.33Å; N551-Q554 PolarHBondContact O-N 2.95Å; N551-E555 PolarHBondContact O-N 3.2Å
552K90.8Very high90.4Very high114 Ų114103 Ų10350%0.49649%0.489SS..Hα-helixtrans-61.3-41.3175.3-173.7174.3178.6178.10113I548 N550 Q554 E555 E556I548-K552 WeakPolarHBondContact O-CB 3.45Å; I548-K552 PolarHBondContact O-N 3.48Å; N550-K552 VanDerWaalsContact C-N 3.34Å; N550-K552 PolarHBondContact O-N 2.88Å; K552-Q554 PolarHBondContact O-N 3.36Å; K552-E555 WeakPolarHBondContact O-CB 3.32Å; K552-E555 PolarHBondContact O-N 2.93Å; K552-E556 WeakPolarHBondContact O-CG 3.46Å; K552-E556 PolarHBondContact O-N 3.26Å
553K90.8Very high90.2Very high97 Ų97102 Ų10242%0.42249%0.486SS..Hα-helixtrans-63-25.8172.7-67162.9-157161.60112.6N549 N550 N551 R557N549-K553 WeakPolarHBondContact O-CD 3.41Å; N549-K553 WeakPolarHBondContact O-CE 3.41Å; N549-K553 VanDerWaalsContact O-CG 3.24Å; N549-K553 WeakPolarHBondContact O-CG 3.44Å; N549-K553 PolarHBondContact O-N 2.93Å; N550-K553 WeakPolarHBondContact O-CB 3.41Å; N550-K553 PolarHBondContact O-N 2.93Å; N550-K553 PolarHBondContact OD1-NZ 3Å; N551-K553 PolarHBondContact O-N 3.34Å; K553-R557 VanDerWaalsContact O-CG 3.32Å; K553-R557 WeakPolarHBondContact O-CG 3.39Å; K553-R557 PolarHBondContact O-NE 3Å
554Q89.2Confident90.1Very high103 Ų103102.8 Ų102.848%0.48149%0.491SS..Hα-helixtrans-81.3-40.7175.2179.5166.5-35.600111.6N550 N551 K552 E556 R557 M558N550-Q554 PolarHBondContact O-N 3.27Å; N550-Q554 VanDerWaalsContact O-N 3.11Å; N551-Q554 CarbonylContact O-C 3.54Å; N551-Q554 WeakPolarHBondContact O-CA 3.46Å; N551-Q554 WeakPolarHBondContact O-CB 3.33Å; N551-Q554 PolarHBondContact O-N 2.95Å; K552-Q554 PolarHBondContact O-N 3.36Å; Q554-E556 VanDerWaalsContact C-N 3.35Å; Q554-E556 PolarHBondContact O-N 2.95Å; Q554-R557 WeakPolarHBondContact O-CB 3.42Å; Q554-R557 PolarHBondContact O-N 3.44Å; Q554-R557 VanDerWaalsContact O-N 3.08Å; Q554-M558 HydrophobicContact CG-CE 4.38Å; Q554-M558 WeakPolarHBondContact O-CG 3.29Å; Q554-M558 PolarHBondContact O-N 3.36Å
555E87.2Confident90.1Very high107 Ų107103.7 Ų103.750%0.550%0.498SS..Hα-helixtrans-55.3-47.7170.8-172.4-179.8-16700111.4N551 K552 R557 M558 L559N551-E555 PolarHBondContact O-N 3.2Å; K552-E555 WeakPolarHBondContact O-CB 3.32Å; K552-E555 PolarHBondContact O-N 2.93Å; E555-R557 PolarHBondContact O-N 3.43Å; E555-M558 PolarHBondContact O-N 2.96Å; E555-M558 VanDerWaalsContact O-N 3.1Å; E555-L559 HydrophobicContact CG-CD1 4.2Å; E555-L559 WeakPolarHBondContact O-CG 3.36Å; E555-L559 PolarHBondContact O-N 3.39Å
556E89.3Confident89.9Confident93 Ų93104.4 Ų104.444%0.43550%0.501SS..Hα-helixtrans-60.8-26.3175.4-73.5178.2-162.300114.1K552 Q554 K560K552-E556 WeakPolarHBondContact O-CG 3.46Å; K552-E556 PolarHBondContact O-N 3.26Å; Q554-E556 VanDerWaalsContact C-N 3.35Å; Q554-E556 PolarHBondContact O-N 2.95Å; E556-K560 WeakPolarHBondContact O-CD 3.38Å; E556-K560 WeakPolarHBondContact O-CG 3.28Å; E556-K560 PolarHBondContact O-N 2.97Å
557R92.2Very high89.8Confident154 Ų154104.5 Ų104.558%0.58150%0.502SS*.Hα-helixtrans-77.4-42.7172.7-65.9166.9-158.71623.8111.3K553 Q554 E555 K560 Q561K553-R557 VanDerWaalsContact O-CG 3.32Å; K553-R557 WeakPolarHBondContact O-CG 3.39Å; K553-R557 PolarHBondContact O-NE 3Å; Q554-R557 WeakPolarHBondContact O-CB 3.42Å; Q554-R557 PolarHBondContact O-N 3.44Å; Q554-R557 VanDerWaalsContact O-N 3.08Å; E555-R557 PolarHBondContact O-N 3.43Å; R557-K560 PolarHBondContact O-N 2.97Å; R557-Q561 WeakPolarHBondContact O-CG 3.38Å; R557-Q561 PolarHBondContact O-N 3.48Å
558M85.9Confident89.6Confident90 Ų90103 Ų10344%0.44350%0.496SS..Hα-helixtrans-65.6-39.6178.3-66.5-173.4-60.300111.1Q554 E555 K560 Q561 I562Q554-M558 HydrophobicContact CG-CE 4.38Å; Q554-M558 WeakPolarHBondContact O-CG 3.29Å; Q554-M558 PolarHBondContact O-N 3.36Å; E555-M558 PolarHBondContact O-N 2.96Å; E555-M558 VanDerWaalsContact O-N 3.1Å; M558-K560 PolarHBondContact O-N 3.36Å; M558-Q561 WeakPolarHBondContact O-CB 3.17Å; M558-Q561 PolarHBondContact O-N 2.62Å; M558-Q561 VanDerWaalsContact O-N 3.15Å; M558-I562 VanDerWaalsContact O-CG1 3.31Å; M558-I562 WeakPolarHBondContact O-CG1 3.3Å; M558-I562 PolarHBondContact O-N 2.98Å
559L90Very high89.4Confident100 Ų100102.6 Ų102.652%0.52449%0.492SS..Hα-helixtrans-59.1-44.1173.7-73.4169.7000112E555 Q561 I562 E563E555-L559 HydrophobicContact CG-CD1 4.2Å; E555-L559 WeakPolarHBondContact O-CG 3.36Å; E555-L559 PolarHBondContact O-N 3.39Å; L559-Q561 VanDerWaalsContact C-N 3.33Å; L559-Q561 PolarHBondContact O-N 2.68Å; L559-I562 PolarHBondContact O-N 3.09Å; L559-E563 WeakPolarHBondContact O-CB 3.25Å; L559-E563 PolarHBondContact O-N 3.4Å
560K90.4Very high89.2Confident122 Ų122102.3 Ų102.353%0.5349%0.493SS..Hα-helixtrans-66.3-31.9174.7-72.9169.2-178.5166.10113.2E556 R557 M558 N564E556-K560 WeakPolarHBondContact O-CD 3.38Å; E556-K560 WeakPolarHBondContact O-CG 3.28Å; E556-K560 PolarHBondContact O-N 2.97Å; R557-K560 PolarHBondContact O-N 2.97Å; M558-K560 PolarHBondContact O-N 3.36Å; K560-N564 WeakPolarHBondContact O-CB 3.32Å; K560-N564 PolarHBondContact O-N 3.01Å; K560-N564 VanDerWaalsContact O-N 3.07Å; K560-N564 PolarHBondContact O-ND2 2.72Å; K560-N564 PolarHBondContact O-OD1 3.46Å
561Q88.8Confident88.9Confident122 Ų122104.3 Ų104.357%0.5750%0.501SS*.Hα-helixtrans-69.2-39.2172-73.3175.4-24.300111.8R557 M558 L559 L565R557-Q561 WeakPolarHBondContact O-CG 3.38Å; R557-Q561 PolarHBondContact O-N 3.48Å; M558-Q561 WeakPolarHBondContact O-CB 3.17Å; M558-Q561 PolarHBondContact O-N 2.62Å; M558-Q561 VanDerWaalsContact O-N 3.15Å; L559-Q561 VanDerWaalsContact C-N 3.33Å; L559-Q561 PolarHBondContact O-N 2.68Å; Q561-L565 WeakPolarHBondContact O-CB 3.33Å; Q561-L565 VanDerWaalsContact O-CG 3.24Å; Q561-L565 WeakPolarHBondContact O-CG 3.48Å; Q561-L565 PolarHBondContact O-N 3.02Å
562I86.9Confident88.9Confident95 Ų95104.1 Ų104.149%0.48750%0.499SS..Hα-helixtrans-65.5-44.4174.9-68.3162.5000110.6M558 L559 L565 Q566M558-I562 VanDerWaalsContact O-CG1 3.31Å; M558-I562 WeakPolarHBondContact O-CG1 3.3Å; M558-I562 PolarHBondContact O-N 2.98Å; L559-I562 PolarHBondContact O-N 3.09Å; I562-L565 PolarHBondContact O-N 3Å; I562-Q566 VanDerWaalsContact O-CB 3.28Å; I562-Q566 WeakPolarHBondContact O-CB 3.5Å; I562-Q566 PolarHBondContact O-N 3.35Å
563E89.1Confident88.7Confident116 Ų116105.9 Ų105.954%0.54250%0.502SS..Hα-helixtrans-56.6-52.4175.5-174.2170.1-138.900111.3L559 L565 Q566 E567L559-E563 WeakPolarHBondContact O-CB 3.25Å; L559-E563 PolarHBondContact O-N 3.4Å; E563-L565 VanDerWaalsContact C-N 3.35Å; E563-L565 PolarHBondContact O-N 2.86Å; E563-Q566 WeakPolarHBondContact O-CB 3.42Å; E563-Q566 PolarHBondContact O-N 3.01Å; E563-Q566 VanDerWaalsContact O-N 3.17Å; E563-E567 PolarHBondContact O-N 3.47Å
564N89.3Confident88.6Confident98 Ų98106.7 Ų106.752%0.52451%0.511SS..Hα-helixtrans-58.6-42.3175-67.8-13.6000112.8K560 Q566 E567 T568K560-N564 WeakPolarHBondContact O-CB 3.32Å; K560-N564 PolarHBondContact O-N 3.01Å; K560-N564 VanDerWaalsContact O-N 3.07Å; K560-N564 PolarHBondContact O-ND2 2.72Å; K560-N564 PolarHBondContact O-OD1 3.46Å; N564-Q566 VanDerWaalsContact C-N 3.35Å; N564-E567 PolarHBondContact O-N 3.49Å; N564-T568 PolarHBondContact O-N 3.16Å; N564-T568 VanDerWaalsContact O-N 3.11Å
565L89.8Confident88.7Confident114 Ų114107.5 Ų107.560%0.59752%0.515SS*.Hα-helixtrans-65.5-39.9177.4-76.3168.7000111.3Q561 I562 E563 T568 E569Q561-L565 WeakPolarHBondContact O-CB 3.33Å; Q561-L565 VanDerWaalsContact O-CG 3.24Å; Q561-L565 WeakPolarHBondContact O-CG 3.48Å; Q561-L565 PolarHBondContact O-N 3.02Å; I562-L565 PolarHBondContact O-N 3Å; E563-L565 VanDerWaalsContact C-N 3.35Å; E563-L565 PolarHBondContact O-N 2.86Å; L565-T568 PolarHBondContact O-N 3.39Å; L565-T568 PolarHBondContact O-OG1 3.29Å; L565-E569 PolarHBondContact O-N 3.3Å
566Q85.1Confident88.7Confident115 Ų115108 Ų10854%0.53752%0.521SS..Hα-helixtrans-66.3-36.6177.6-167.9172.5-5.400111.4I562 E563 N564 E569 T570I562-Q566 VanDerWaalsContact O-CB 3.28Å; I562-Q566 WeakPolarHBondContact O-CB 3.5Å; I562-Q566 PolarHBondContact O-N 3.35Å; E563-Q566 WeakPolarHBondContact O-CB 3.42Å; E563-Q566 PolarHBondContact O-N 3.01Å; E563-Q566 VanDerWaalsContact O-N 3.17Å; N564-Q566 VanDerWaalsContact C-N 3.35Å; Q566-E569 WeakPolarHBondContact O-CB 3.48Å; Q566-E569 PolarHBondContact O-N 3.03Å; Q566-T570 WeakPolarHBondContact O-CG2 3.46Å; Q566-T570 PolarHBondContact O-N 3.14Å
567E89.9Confident88.8Confident114 Ų114107.7 Ų107.753%0.53352%0.519SS..Hα-helixtrans-59.3-49.5168.1-70.6-165.4156.100111.5E563 N564 E569 T570 Q571E563-E567 PolarHBondContact O-N 3.47Å; N564-E567 PolarHBondContact O-N 3.49Å; E567-E569 VanDerWaalsContact C-N 3.27Å; E567-E569 PolarHBondContact O-N 3.45Å; E567-T570 PolarHBondContact O-N 3.45Å; E567-T570 VanDerWaalsContact O-N 3.07Å; E567-T570 PolarHBondContact O-OG1 2.89Å; E567-Q571 WeakPolarHBondContact O-CG 3.47Å; E567-Q571 PolarHBondContact O-N 3.4Å
568T86.6Confident88.8Confident64 Ų64108.6 Ų108.639%0.39352%0.524SS..Hα-helixtrans-62.6-32.3177.263.20000113N564 L565 Q571 L572N564-T568 PolarHBondContact O-N 3.16Å; N564-T568 VanDerWaalsContact O-N 3.11Å; L565-T568 PolarHBondContact O-N 3.39Å; L565-T568 PolarHBondContact O-OG1 3.29Å; T568-Q571 PolarHBondContact O-N 3.41Å; T568-L572 WeakPolarHBondContact O-CG 3.39Å; T568-L572 PolarHBondContact O-N 2.84Å
569E89.2Confident89.1Confident91 Ų91107.6 Ų107.643%0.42552%0.523SS..Hα-helixtrans-64.2-42.2172.8-161.9-160.4152.700111.2L565 Q566 E567 L572 R573L565-E569 PolarHBondContact O-N 3.3Å; Q566-E569 WeakPolarHBondContact O-CB 3.48Å; Q566-E569 PolarHBondContact O-N 3.03Å; E567-E569 VanDerWaalsContact C-N 3.27Å; E567-E569 PolarHBondContact O-N 3.45Å; E569-L572 PolarHBondContact O-N 3.18Å; E569-R573 WeakPolarHBondContact O-CB 3.4Å; E569-R573 WeakPolarHBondContact O-CG 3.28Å; E569-R573 PolarHBondContact O-N 3.5Å; E569-R573 IonicContact OE1-CZ 2.65Å; E569-R573 IonicContact OE1-NE 2.62Å; E569-R573 PolarHBondContact OE1-NE 3.12Å; E569-R573 IonicContact OE1-NH2 3.42Å; E569-R573 PolarHBondContact OE1-NH2 3.42Å
570T87.3Confident89Confident72 Ų72109.8 Ų109.844%0.44252%0.524SS..Hα-helixtrans-66.1-36.7175.564.30000112.6Q566 E567 R573 N574Q566-T570 WeakPolarHBondContact O-CG2 3.46Å; Q566-T570 PolarHBondContact O-N 3.14Å; E567-T570 PolarHBondContact O-N 3.45Å; E567-T570 VanDerWaalsContact O-N 3.07Å; E567-T570 PolarHBondContact O-OG1 2.89Å; T570-R573 PolarHBondContact O-N 2.92Å; T570-N574 PolarHBondContact O-N 2.89Å; T570-N574 PolarHBondContact O-ND2 3.4Å; T570-N574 VanDerWaalsContact O-ND2 3.16Å
571Q88.7Confident89Confident107 Ų107108.2 Ų108.250%0.552%0.519SS..Hα-helixtrans-62.2-51.6175-67.5169.612.900110.9E567 T568 R573 N574 E575E567-Q571 WeakPolarHBondContact O-CG 3.47Å; E567-Q571 PolarHBondContact O-N 3.4Å; T568-Q571 PolarHBondContact O-N 3.41Å; Q571-R573 VanDerWaalsContact C-N 3.31Å; Q571-R573 PolarHBondContact O-N 3.39Å; Q571-N574 WeakPolarHBondContact O-CB 3.42Å; Q571-N574 PolarHBondContact O-N 2.88Å; Q571-N574 VanDerWaalsContact O-N 3.09Å; Q571-E575 PolarHBondContact O-N 3.36Å
572L90.6Very high89.1Confident99 Ų99106.8 Ų106.852%0.51851%0.512SS..Hα-helixtrans-62.5-34.6176.9-69.7170.6000112.9T568 E569 E575 L576T568-L572 WeakPolarHBondContact O-CG 3.39Å; T568-L572 PolarHBondContact O-N 2.84Å; E569-L572 PolarHBondContact O-N 3.18Å; L572-E575 PolarHBondContact O-N 2.92Å; L572-L576 WeakPolarHBondContact O-CB 3.49Å; L572-L576 VanDerWaalsContact O-CG 3.28Å; L572-L576 WeakPolarHBondContact O-CG 3.4Å; L572-L576 PolarHBondContact O-N 2.85Å
573R87Confident89.1Confident150 Ų150107.6 Ų107.657%0.56652%0.517SS*.Hα-helixtrans-64.1-41172.6-77.2169.2176.1-84.11.8112.1E569 T570 Q571 L576 E577E569-R573 WeakPolarHBondContact O-CB 3.4Å; E569-R573 WeakPolarHBondContact O-CG 3.28Å; E569-R573 PolarHBondContact O-N 3.5Å; E569-R573 IonicContact OE1-CZ 2.65Å; E569-R573 IonicContact OE1-NE 2.62Å; E569-R573 PolarHBondContact OE1-NE 3.12Å; E569-R573 IonicContact OE1-NH2 3.42Å; E569-R573 PolarHBondContact OE1-NH2 3.42Å; T570-R573 PolarHBondContact O-N 2.92Å; Q571-R573 VanDerWaalsContact C-N 3.31Å; Q571-R573 PolarHBondContact O-N 3.39Å; R573-L576 PolarHBondContact O-N 2.88Å; R573-E577 PolarHBondContact O-N 2.8Å
574N89.4Confident89Confident114 Ų114106.2 Ų106.261%0.6151%0.509SS*.Hα-helixtrans-67.5-40.3177.2-66.7-26.3000111.6T570 Q571 E577 Y578T570-N574 PolarHBondContact O-N 2.89Å; T570-N574 PolarHBondContact O-ND2 3.4Å; T570-N574 VanDerWaalsContact O-ND2 3.16Å; Q571-N574 WeakPolarHBondContact O-CB 3.42Å; Q571-N574 PolarHBondContact O-N 2.88Å; Q571-N574 VanDerWaalsContact O-N 3.09Å; N574-E577 PolarHBondContact O-N 2.81Å; N574-Y578 PolarHBondContact O-N 2.77Å
575E91.1Very high89Confident121 Ų121108 Ų10857%0.56551%0.514SS*.Hα-helixtrans-62.5-43.8173.2-70.5179-176.100112.1Q571 L572 E577 Y578 V579Q571-E575 PolarHBondContact O-N 3.36Å; L572-E575 PolarHBondContact O-N 2.92Å; E575-E577 VanDerWaalsContact C-N 3.33Å; E575-E577 PolarHBondContact O-N 2.91Å; E575-Y578 WeakPolarHBondContact O-CB 3.35Å; E575-Y578 PolarHBondContact O-N 2.94Å; E575-V579 WeakPolarHBondContact O-CG2 3.49Å; E575-V579 PolarHBondContact O-N 3.42Å
576L86.6Confident88.9Confident118 Ų118107.2 Ų107.262%0.61851%0.506SS*.Hα-helixtrans-63.8-35.3176-76170.4000112.9L572 R573 R580L572-L576 WeakPolarHBondContact O-CB 3.49Å; L572-L576 VanDerWaalsContact O-CG 3.28Å; L572-L576 WeakPolarHBondContact O-CG 3.4Å; L572-L576 PolarHBondContact O-N 2.85Å; R573-L576 PolarHBondContact O-N 2.88Å; L576-R580 WeakPolarHBondContact O-CB 3.21Å; L576-R580 PolarHBondContact O-N 2.84Å
577E91.4Very high88.9Confident86 Ų86110.2 Ų110.240%0.40251%0.512SS..Hα-helixtrans-72.9-37.3175.8-154.765.2-140.500111.6R573 N574 E575 R580 E581R573-E577 PolarHBondContact O-N 2.8Å; N574-E577 PolarHBondContact O-N 2.81Å; E575-E577 VanDerWaalsContact C-N 3.33Å; E575-E577 PolarHBondContact O-N 2.91Å; E577-R580 WeakPolarHBondContact O-CB 3.04Å; E577-R580 PolarHBondContact O-N 3.12Å; E577-R580 WeakPolarHBondContact OE1-CD 3.29Å; E577-R580 IonicContact OE1-CZ 3.21Å; E577-R580 IonicContact OE1-NE 2.81Å; E577-R580 IonicContact OE1-NH1 2.71Å; E577-R580 PolarHBondContact OE1-NH1 3.14Å; E577-R580 IonicContact OE2-CZ 3.82Å; E577-R580 IonicContact OE2-NH1 3.48Å; E577-R580 PolarHBondContact OE2-NH1 3.36Å; E577-R580 IonicContact OE2-NH2 3.3Å; E577-E581 PolarHBondContact O-N 3.13Å
578Y92.6Very high88.8Confident172 Ų172108.5 Ų108.568%0.67551%0.507SS*.Hα-helixtrans-59.6-49.5171.5179.4-93.3000111.6N574 E575 R580 E581 E582N574-Y578 PolarHBondContact O-N 2.77Å; E575-Y578 WeakPolarHBondContact O-CB 3.35Å; E575-Y578 PolarHBondContact O-N 2.94Å; Y578-R580 VanDerWaalsContact C-N 3.29Å; Y578-R580 PolarHBondContact O-N 3.35Å; Y578-E581 PolarHBondContact O-N 2.99Å; Y578-E582 PolarHBondContact O-N 3.28Å
579V91.3Very high89Confident70 Ų70109 Ų10942%0.42450%0.504SS..Hα-helixtrans-63.2-34.8176172.60000111.5E575 E582 L583E575-V579 WeakPolarHBondContact O-CG2 3.49Å; E575-V579 PolarHBondContact O-N 3.42Å; V579-E582 PolarHBondContact O-N 3.1Å; V579-L583 HydrophobicContact CG1-CD1 4.1Å; V579-L583 HydrophobicContact CG1-CG 4.44Å; V579-L583 WeakPolarHBondContact O-CB 3.34Å; V579-L583 VanDerWaalsContact O-CG 3.28Å; V579-L583 WeakPolarHBondContact O-CG 3.23Å; V579-L583 PolarHBondContact O-N 2.92Å
580R88.9Confident89Confident145 Ų145109.1 Ų109.155%0.54751%0.511SS..Hα-helixtrans-63.1-43.3173.8-176.3-174.6-65.9150.84.5111.8L576 E577 Y578 L583 K584L576-R580 WeakPolarHBondContact O-CB 3.21Å; L576-R580 PolarHBondContact O-N 2.84Å; E577-R580 WeakPolarHBondContact O-CB 3.04Å; E577-R580 PolarHBondContact O-N 3.12Å; E577-R580 WeakPolarHBondContact OE1-CD 3.29Å; E577-R580 IonicContact OE1-CZ 3.21Å; E577-R580 IonicContact OE1-NE 2.81Å; E577-R580 IonicContact OE1-NH1 2.71Å; E577-R580 PolarHBondContact OE1-NH1 3.14Å; E577-R580 IonicContact OE2-CZ 3.82Å; E577-R580 IonicContact OE2-NH1 3.48Å; E577-R580 PolarHBondContact OE2-NH1 3.36Å; E577-R580 IonicContact OE2-NH2 3.3Å; Y578-R580 VanDerWaalsContact C-N 3.29Å; Y578-R580 PolarHBondContact O-N 3.35Å; R580-L583 PolarHBondContact O-N 2.84Å; R580-K584 WeakPolarHBondContact O-CB 3.37Å; R580-K584 PolarHBondContact O-N 2.9Å
581E89.3Confident89.2Confident89 Ų89111.3 Ų111.342%0.41652%0.515SS..Hα-helixtrans-70.5-35.3177.7-79.3-62.9156.900112.6E577 Y578 K584 Q585E577-E581 PolarHBondContact O-N 3.13Å; Y578-E581 PolarHBondContact O-N 2.99Å; E581-K584 WeakPolarHBondContact O-CB 3.34Å; E581-K584 PolarHBondContact O-N 3.37Å; E581-K584 IonicContact OE1-NZ 3.48Å; E581-K584 PolarHBondContact OE1-NZ 3.34Å; E581-K584 IonicContact OE2-NZ 2.62Å; E581-K584 PolarHBondContact OE2-NZ 3.25Å; E581-Q585 PolarHBondContact O-N 2.95Å
582E90.2Very high89Confident92 Ų92109.4 Ų109.443%0.4351%0.512SS..Hα-helixtrans-61.4-46.5169.9-169.8-174.5-175.900111.3Y578 V579 K584 Q585 K586Y578-E582 PolarHBondContact O-N 3.28Å; V579-E582 PolarHBondContact O-N 3.1Å; E582-K584 VanDerWaalsContact C-N 3.26Å; E582-K584 PolarHBondContact O-N 2.84Å; E582-Q585 PolarHBondContact O-N 3.2Å; E582-K586 WeakPolarHBondContact O-CB 3.33Å; E582-K586 WeakPolarHBondContact O-CG 3.38Å; E582-K586 PolarHBondContact O-N 3.23Å
583L88.1Confident88.9Confident112 Ų112110.4 Ų110.459%0.58651%0.513SS*.Hα-helixtrans-63.3-31.4176.1-72.9172.7000112.7V579 R580 R587V579-L583 HydrophobicContact CG1-CD1 4.1Å; V579-L583 HydrophobicContact CG1-CG 4.44Å; V579-L583 WeakPolarHBondContact O-CB 3.34Å; V579-L583 VanDerWaalsContact O-CG 3.28Å; V579-L583 WeakPolarHBondContact O-CG 3.23Å; V579-L583 PolarHBondContact O-N 2.92Å; R580-L583 PolarHBondContact O-N 2.84Å; L583-R587 WeakPolarHBondContact O-CB 3.46Å; L583-R587 PolarHBondContact O-N 2.94Å
584K87.4Confident88.9Confident88 Ų88108.1 Ų108.138%0.38351%0.511SS..Hα-helixtrans-70.1-46.3173.2173.2161.5152.2-970111R580 E581 E582 K586 R587 D588R580-K584 WeakPolarHBondContact O-CB 3.37Å; R580-K584 PolarHBondContact O-N 2.9Å; E581-K584 WeakPolarHBondContact O-CB 3.34Å; E581-K584 PolarHBondContact O-N 3.37Å; E581-K584 IonicContact OE1-NZ 3.48Å; E581-K584 PolarHBondContact OE1-NZ 3.34Å; E581-K584 IonicContact OE2-NZ 2.62Å; E581-K584 PolarHBondContact OE2-NZ 3.25Å; E582-K584 VanDerWaalsContact C-N 3.26Å; E582-K584 PolarHBondContact O-N 2.84Å; K584-K586 VanDerWaalsContact C-N 3.3Å; K584-K586 PolarHBondContact O-N 3.46Å; K584-R587 WeakPolarHBondContact O-CB 3.36Å; K584-R587 PolarHBondContact O-N 3.44Å; K584-D588 PolarHBondContact O-N 2.85Å
585Q88.7Confident88.9Confident136 Ų136106.3 Ų106.364%0.63650%0.502SS*.Hα-helixtrans-58.7-41.1172.3-168.5-177.222.100111.8E581 E582 D588 E589E581-Q585 PolarHBondContact O-N 2.95Å; E582-Q585 PolarHBondContact O-N 3.2Å; Q585-D588 PolarHBondContact O-N 2.94Å; Q585-E589 WeakPolarHBondContact O-CB 3.16Å; Q585-E589 PolarHBondContact O-N 2.81Å
586K88.2Confident88.7Confident97 Ų97107 Ų10742%0.42250%0.503SS..Hα-helixtrans-68-37.4176.2-70.9-72.4157.2-162.80112.9E582 K584 E589 V590E582-K586 WeakPolarHBondContact O-CB 3.33Å; E582-K586 WeakPolarHBondContact O-CG 3.38Å; E582-K586 PolarHBondContact O-N 3.23Å; K584-K586 VanDerWaalsContact C-N 3.3Å; K584-K586 PolarHBondContact O-N 3.46Å; K586-E589 IonicContact NZ-OE2 2.98Å; K586-E589 PolarHBondContact NZ-OE2 3.46Å; K586-E589 PolarHBondContact O-N 3.29Å; K586-V590 WeakPolarHBondContact O-CB 2.79Å; K586-V590 WeakPolarHBondContact O-CG2 3.44Å; K586-V590 PolarHBondContact O-N 2.74Å
587R84.8Confident88.4Confident178 Ų178104 Ų10467%0.67249%0.491SS*.Hα-helixtrans-59-47.5171.3179.5-168.6-62168.50.3110.9L583 K584 V590 K591L583-R587 WeakPolarHBondContact O-CB 3.46Å; L583-R587 PolarHBondContact O-N 2.94Å; K584-R587 WeakPolarHBondContact O-CB 3.36Å; K584-R587 PolarHBondContact O-N 3.44Å; R587-V590 PolarHBondContact O-N 3.3Å; R587-K591 WeakPolarHBondContact O-CB 3.34Å; R587-K591 PolarHBondContact O-N 2.81Å
588D86.8Confident88.3Confident78 Ų78105.1 Ų105.142%0.41750%0.497SS..Hα-helixtrans-70.8-34-178.2-65.8-27000111.8K584 Q585 K591 C592K584-D588 PolarHBondContact O-N 2.85Å; Q585-D588 PolarHBondContact O-N 2.94Å; D588-K591 PolarHBondContact O-N 3.2Å; D588-C592 WeakPolarHBondContact O-CB 3.32Å; D588-C592 PolarHBondContact O-N 3.18Å; D588-C592 PolarHBondContact O-SG 2.6Å
589E91.9Very high88.1Confident73 Ų73102.7 Ų102.734%0.34149%0.492SS..Hα-helixtrans-60.9-44.1169.1-165.5-160.7143.500112Q585 K586 C592 K593Q585-E589 WeakPolarHBondContact O-CB 3.16Å; Q585-E589 PolarHBondContact O-N 2.81Å; K586-E589 IonicContact NZ-OE2 2.98Å; K586-E589 PolarHBondContact NZ-OE2 3.46Å; K586-E589 PolarHBondContact O-N 3.29Å; E589-C592 PolarHBondContact O-N 2.87Å; E589-K593 WeakPolarHBondContact O-CG 3.41Å; E589-K593 PolarHBondContact O-N 2.89Å; E589-K593 VanDerWaalsContact OE1-CE 3.29Å; E589-K593 WeakPolarHBondContact OE1-CE 3.39Å; E589-K593 IonicContact OE1-NZ 3.17Å; E589-K593 PolarHBondContact OE1-NZ 2.77Å
590V89.1Confident88Confident94 Ų94104.2 Ų104.257%0.5750%0.497SS*.Hα-helixtrans-66.6-40.5175.5168.10000111.1K586 R587 K593 L594K586-V590 WeakPolarHBondContact O-CB 2.79Å; K586-V590 WeakPolarHBondContact O-CG2 3.44Å; K586-V590 PolarHBondContact O-N 2.74Å; R587-V590 PolarHBondContact O-N 3.3Å; V590-K593 WeakPolarHBondContact O-CB 3.45Å; V590-K593 PolarHBondContact O-N 3.18Å; V590-K593 VanDerWaalsContact O-N 3.11Å; V590-L594 PolarHBondContact O-N 3.21Å
591K90.4Very high87.7Confident119 Ų119100.6 Ų100.652%0.51749%0.493SS..Hα-helixtrans-59.8-47.7174.6-170.7-172.2170.9-169.20111.2R587 D588 K593 L594 D595R587-K591 WeakPolarHBondContact O-CB 3.34Å; R587-K591 PolarHBondContact O-N 2.81Å; D588-K591 PolarHBondContact O-N 3.2Å; K591-K593 PolarHBondContact O-N 3.45Å; K591-K593 VanDerWaalsContact O-N 3.12Å; K591-L594 WeakPolarHBondContact O-CA 3.41Å; K591-L594 WeakPolarHBondContact O-CB 3.25Å; K591-L594 PolarHBondContact O-N 3.1Å; K591-D595 PolarHBondContact O-N 2.83Å
592C85.4Confident87.6Confident66 Ų6698.5 Ų98.545%0.44649%0.485SS..Hα-helixtrans-60.5-24.4176.1-68.30000113.6D588 E589 K596D588-C592 WeakPolarHBondContact O-CB 3.32Å; D588-C592 PolarHBondContact O-N 3.18Å; D588-C592 PolarHBondContact O-SG 2.6Å; E589-C592 PolarHBondContact O-N 2.87Å; C592-K596 VanDerWaalsContact O-CD 3.27Å; C592-K596 WeakPolarHBondContact O-CD 3.22Å; C592-K596 VanDerWaalsContact O-CG 3.23Å; C592-K596 WeakPolarHBondContact O-CG 3.45Å
593K88.2Confident87.5Confident120 Ų12097.7 Ų97.752%0.52248%0.483SS..Hα-helixtrans-82.2-33.8172.8-69.3170.4-173.11740112.2E589 V590 K591 S597E589-K593 WeakPolarHBondContact O-CG 3.41Å; E589-K593 PolarHBondContact O-N 2.89Å; E589-K593 VanDerWaalsContact OE1-CE 3.29Å; E589-K593 WeakPolarHBondContact OE1-CE 3.39Å; E589-K593 IonicContact OE1-NZ 3.17Å; E589-K593 PolarHBondContact OE1-NZ 2.77Å; V590-K593 WeakPolarHBondContact O-CB 3.45Å; V590-K593 PolarHBondContact O-N 3.18Å; V590-K593 VanDerWaalsContact O-N 3.11Å; K591-K593 PolarHBondContact O-N 3.45Å; K591-K593 VanDerWaalsContact O-N 3.12Å; K593-S597 PolarHBondContact O-N 2.84Å; K593-S597 VanDerWaalsContact O-N 3.09Å
594L87Confident87.4Confident103 Ų10397.3 Ų97.354%0.53948%0.482SS..Hα-helixtrans-69.2-48.8174.2-177.562.2000111.6V590 K591 K596 S597 E598V590-L594 PolarHBondContact O-N 3.21Å; K591-L594 WeakPolarHBondContact O-CA 3.41Å; K591-L594 WeakPolarHBondContact O-CB 3.25Å; K591-L594 PolarHBondContact O-N 3.1Å; L594-K596 PolarHBondContact O-N 3.06Å; L594-S597 PolarHBondContact O-N 3.46Å; L594-S597 PolarHBondContact O-OG 3.27Å; L594-E598 PolarHBondContact O-N 2.83Å
595D88.2Confident87.4Confident76 Ų76100.6 Ų100.641%0.40649%0.492SS..Hα-helixtrans-56.4-40.1178.9-58.9-17.8000110.6K591 E599K591-D595 PolarHBondContact O-N 2.83Å; D595-E599 PolarHBondContact O-N 2.87Å
596K87.3Confident87.4Confident135 Ų13599.8 Ų99.859%0.58749%0.486SS*.Hα-helixtrans-69.9-34.4174.1-72.3174-173.6176.80113.9C592 L594 N600C592-K596 VanDerWaalsContact O-CD 3.27Å; C592-K596 WeakPolarHBondContact O-CD 3.22Å; C592-K596 VanDerWaalsContact O-CG 3.23Å; C592-K596 WeakPolarHBondContact O-CG 3.45Å; L594-K596 PolarHBondContact O-N 3.06Å; K596-N600 PolarHBondContact O-N 2.73Å; K596-N600 VanDerWaalsContact O-N 3.14Å; K596-N600 PolarHBondContact O-ND2 3.22Å
597S81.3Confident87.2Confident54 Ų54100 Ų10038%0.37849%0.488SS..Hα-helixtrans-76.4-32.517771.70000111.4K593 L594 N600 C601K593-S597 PolarHBondContact O-N 2.84Å; K593-S597 VanDerWaalsContact O-N 3.09Å; L594-S597 PolarHBondContact O-N 3.46Å; L594-S597 PolarHBondContact O-OG 3.27Å; S597-N600 PolarHBondContact O-N 3.07Å; S597-C601 WeakPolarHBondContact O-CB 3.5Å; S597-C601 PolarHBondContact O-N 3.16Å; S597-C601 PolarHBondContact O-SG 3.25Å
598E89.3Confident87.2Confident110 Ų11096 Ų9651%0.51448%0.483SS..Hα-helixtrans-65.1-44.8169.7176.9162.7-16100111.9L594 N600 C601 N602L594-E598 PolarHBondContact O-N 2.83Å; E598-N600 VanDerWaalsContact C-N 3.32Å; E598-N600 PolarHBondContact O-N 2.89Å; E598-C601 CarbonylContact O-C 3.56Å; E598-C601 WeakPolarHBondContact O-CB 3.31Å; E598-C601 PolarHBondContact O-N 2.89Å; E598-C601 VanDerWaalsContact O-N 3.13Å; E598-N602 WeakPolarHBondContact CG-ND2 3.43Å; E598-N602 WeakPolarHBondContact O-CB 3.5Å; E598-N602 PolarHBondContact O-N 2.89Å; E598-N602 PolarHBondContact O-ND2 3.29Å
599E88.3Confident87.1Confident122 Ų12296.9 Ų96.957%0.5749%0.485SS*.Hα-helixtrans-58.6-44.1173.8-175.2173.9-155.700111.7D595 C601 N602 N603D595-E599 PolarHBondContact O-N 2.87Å; E599-C601 PolarHBondContact O-N 3.03Å; E599-N602 PolarHBondContact O-N 2.73Å; E599-N603 PolarHBondContact O-N 2.82Å; E599-N603 PolarHBondContact O-ND2 2.94Å
600N88.1Confident86.9Confident101 Ų10198.2 Ų98.254%0.5450%0.495SS..Hα-helixtrans-61.3-42.3173.3-78.7-55.9000112.4K596 S597 E598 N602 N603 L604K596-N600 PolarHBondContact O-N 2.73Å; K596-N600 VanDerWaalsContact O-N 3.14Å; K596-N600 PolarHBondContact O-ND2 3.22Å; S597-N600 PolarHBondContact O-N 3.07Å; E598-N600 VanDerWaalsContact C-N 3.32Å; E598-N600 PolarHBondContact O-N 2.89Å; N600-N602 VanDerWaalsContact C-N 3.33Å; N600-N602 PolarHBondContact O-N 3.15Å; N600-N603 PolarHBondContact O-N 3.43Å; N600-L604 WeakPolarHBondContact O-CG 3.48Å; N600-L604 PolarHBondContact O-N 3.07Å
601C82.6Confident86.8Confident69 Ų6999.3 Ų99.347%0.46649%0.492SS..Hα-helixtrans-63.7-37.3174.8-70.80000112.4S597 E598 E599 L604 R605S597-C601 WeakPolarHBondContact O-CB 3.5Å; S597-C601 PolarHBondContact O-N 3.16Å; S597-C601 PolarHBondContact O-SG 3.25Å; E598-C601 CarbonylContact O-C 3.56Å; E598-C601 WeakPolarHBondContact O-CB 3.31Å; E598-C601 PolarHBondContact O-N 2.89Å; E598-C601 VanDerWaalsContact O-N 3.13Å; E599-C601 PolarHBondContact O-N 3.03Å; C601-L604 PolarHBondContact O-N 3.01Å; C601-R605 WeakPolarHBondContact O-CB 3.43Å; C601-R605 PolarHBondContact O-N 3.01Å
602N87.3Confident86.6Confident46 Ų4697.4 Ų97.425%0.24649%0.487CS..Hα-helixtrans-70.3-34.8176.1-74.7-40.4000112E598 E599 N600 R605 K606E598-N602 WeakPolarHBondContact CG-ND2 3.43Å; E598-N602 WeakPolarHBondContact O-CB 3.5Å; E598-N602 PolarHBondContact O-N 2.89Å; E598-N602 PolarHBondContact O-ND2 3.29Å; E599-N602 PolarHBondContact O-N 2.73Å; N600-N602 VanDerWaalsContact C-N 3.33Å; N600-N602 PolarHBondContact O-N 3.15Å; N602-R605 WeakPolarHBondContact O-CB 3.45Å; N602-R605 PolarHBondContact O-N 3.46Å; N602-R605 VanDerWaalsContact OD1-CZ 3.26Å; N602-R605 PolarHBondContact OD1-NH1 3.44Å; N602-R605 VanDerWaalsContact OD1-NH1 3.1Å; N602-R605 PolarHBondContact OD1-NH2 2.86Å; N602-K606 WeakPolarHBondContact O-CG 3.45Å; N602-K606 PolarHBondContact O-N 2.82Å
603N88.8Confident86.7Confident74 Ų7498.4 Ų98.440%0.39648%0.484SS..Hα-helixtrans-70.3-38.9172.6-71.3-30.9000112.3E599 N600 K606 Q607E599-N603 PolarHBondContact O-N 2.82Å; E599-N603 PolarHBondContact O-ND2 2.94Å; N600-N603 PolarHBondContact O-N 3.43Å; N603-K606 PolarHBondContact O-N 3.2Å; N603-Q607 PolarHBondContact O-N 3.47Å
604L87.3Confident86.5Confident105 Ų10599.3 Ų99.355%0.5549%0.485SS..Hα-helixtrans-63.5-40.3169.7-71.9171.1000111.8N600 C601 Q607 V608N600-L604 WeakPolarHBondContact O-CG 3.48Å; N600-L604 PolarHBondContact O-N 3.07Å; C601-L604 PolarHBondContact O-N 3.01Å; L604-Q607 WeakPolarHBondContact O-CB 3.39Å; L604-Q607 PolarHBondContact O-N 3.42Å; L604-Q607 VanDerWaalsContact O-N 3.14Å; L604-V608 WeakPolarHBondContact O-CG2 3.46Å; L604-V608 PolarHBondContact O-N 3.16Å
605R87.3Confident86.2Confident157 Ų15798.3 Ų98.359%0.59248%0.48SS*.Hα-helixtrans-59.1-48.2175.2-168.3-176.2-60158.56.9111.4C601 N602 Q607 V608 E609C601-R605 WeakPolarHBondContact O-CB 3.43Å; C601-R605 PolarHBondContact O-N 3.01Å; N602-R605 WeakPolarHBondContact O-CB 3.45Å; N602-R605 PolarHBondContact O-N 3.46Å; N602-R605 VanDerWaalsContact OD1-CZ 3.26Å; N602-R605 PolarHBondContact OD1-NH1 3.44Å; N602-R605 VanDerWaalsContact OD1-NH1 3.1Å; N602-R605 PolarHBondContact OD1-NH2 2.86Å; R605-Q607 VanDerWaalsContact C-N 3.3Å; R605-Q607 PolarHBondContact O-N 3.2Å; R605-V608 PolarHBondContact O-N 2.97Å; R605-E609 WeakPolarHBondContact O-CB 3.47Å; R605-E609 PolarHBondContact O-N 3.4Å
606K87Confident86Confident118 Ų11899.1 Ų99.151%0.51348%0.481SS..Hα-helixtrans-58.1-39.4173-69.8169-173.5168.10112.3N602 N603 E609 N610N602-K606 WeakPolarHBondContact O-CG 3.45Å; N602-K606 PolarHBondContact O-N 2.82Å; N603-K606 PolarHBondContact O-N 3.2Å; K606-E609 PolarHBondContact O-N 2.84Å; K606-N610 WeakPolarHBondContact O-CB 3.37Å; K606-N610 VanDerWaalsContact O-CG 3.28Å; K606-N610 PolarHBondContact O-N 3.47Å
607Q84.7Confident85.8Confident101 Ų10198.1 Ų98.147%0.47248%0.478SS..Hα-helixtrans-67.1-40.8177.1-163-163.190.600112.1N603 L604 R605 K611N603-Q607 PolarHBondContact O-N 3.47Å; L604-Q607 WeakPolarHBondContact O-CB 3.39Å; L604-Q607 PolarHBondContact O-N 3.42Å; L604-Q607 VanDerWaalsContact O-N 3.14Å; R605-Q607 VanDerWaalsContact C-N 3.3Å; R605-Q607 PolarHBondContact O-N 3.2Å; Q607-K611 WeakPolarHBondContact O-CG 3.5Å; Q607-K611 PolarHBondContact O-N 2.82Å
608V84.1Confident85.6Confident94 Ų9498.5 Ų98.557%0.5748%0.476SS*.Hα-helixtrans-64.4-43.8174170.80000110.7L604 R605 N610 K611 N612L604-V608 WeakPolarHBondContact O-CG2 3.46Å; L604-V608 PolarHBondContact O-N 3.16Å; R605-V608 PolarHBondContact O-N 2.97Å; V608-N610 PolarHBondContact O-N 3.45Å; V608-K611 CarbonylContact O-C 3.57Å; V608-K611 WeakPolarHBondContact O-CB 3.45Å; V608-K611 PolarHBondContact O-N 3.01Å; V608-N612 PolarHBondContact O-N 3.38Å
609E84.8Confident85.1Confident97 Ų9798.1 Ų98.145%0.45347%0.474SS..Hα-helixtrans-62.4-41.7178.7-164.1-168.6147.300112.2R605 K606 N612 K613R605-E609 WeakPolarHBondContact O-CB 3.47Å; R605-E609 PolarHBondContact O-N 3.4Å; K606-E609 PolarHBondContact O-N 2.84Å; E609-N612 WeakPolarHBondContact O-CB 3.33Å; E609-N612 PolarHBondContact O-N 3.3Å; E609-K613 WeakPolarHBondContact O-CG 3.39Å; E609-K613 PolarHBondContact O-N 3.49Å; E609-K613 WeakPolarHBondContact OE1-CE 3.45Å; E609-K613 IonicContact OE1-NZ 2.63Å; E609-K613 PolarHBondContact OE1-NZ 2.9Å
610N87.8Confident84.8Confident101 Ų10198.6 Ų98.654%0.5448%0.476SS..Hα-helixtrans-67.2-37.5174.1-71-11.7000112.3K606 V608 N612 K613 Y614K606-N610 WeakPolarHBondContact O-CB 3.37Å; K606-N610 VanDerWaalsContact O-CG 3.28Å; K606-N610 PolarHBondContact O-N 3.47Å; V608-N610 PolarHBondContact O-N 3.45Å; N610-N612 VanDerWaalsContact C-N 3.3Å; N610-N612 PolarHBondContact O-N 3.47Å; N610-K613 PolarHBondContact O-N 2.88Å; N610-Y614 PolarHBondContact O-N 3.14Å
611K87.8Confident84.3Confident118 Ų11899 Ų9951%0.51348%0.475SS..Hα-helixtrans-64.5-34.5170.5-75.6168.2172.7172.10111.9Q607 V608 Y614 I615Q607-K611 WeakPolarHBondContact O-CG 3.5Å; Q607-K611 PolarHBondContact O-N 2.82Å; V608-K611 CarbonylContact O-C 3.57Å; V608-K611 WeakPolarHBondContact O-CB 3.45Å; V608-K611 PolarHBondContact O-N 3.01Å; K611-Y614 PolarHBondContact O-N 3.44Å; K611-I615 VanDerWaalsContact O-CG1 3.31Å; K611-I615 WeakPolarHBondContact O-CG1 3.47Å; K611-I615 PolarHBondContact O-N 3.18Å
612N87.1Confident84Confident78 Ų78100.1 Ų100.142%0.41748%0.476SS..Hα-helixtrans-68-42.7177.2-151.381.6000111.6V608 E609 N610 Y614 I615 E616V608-N612 PolarHBondContact O-N 3.38Å; E609-N612 WeakPolarHBondContact O-CB 3.33Å; E609-N612 PolarHBondContact O-N 3.3Å; N610-N612 VanDerWaalsContact C-N 3.3Å; N610-N612 PolarHBondContact O-N 3.47Å; N612-Y614 VanDerWaalsContact C-N 3.33Å; N612-Y614 PolarHBondContact O-N 3.23Å; N612-I615 CarbonylContact O-C 3.58Å; N612-I615 WeakPolarHBondContact O-CA 3.45Å; N612-I615 WeakPolarHBondContact O-CB 3.49Å; N612-I615 PolarHBondContact O-N 3.13Å; N612-I615 VanDerWaalsContact O-N 3.07Å; N612-E616 PolarHBondContact ND2-OE1 3.22Å; N612-E616 WeakPolarHBondContact O-CG 3.5Å; N612-E616 PolarHBondContact O-N 3.01Å
613K86.9Confident83.7Confident87 Ų87103.9 Ų103.938%0.37849%0.49SS..Hα-helixtrans-57-45173-70164-171.2161.60111.6E609 N610 I615 E616 E617E609-K613 WeakPolarHBondContact O-CG 3.39Å; E609-K613 PolarHBondContact O-N 3.49Å; E609-K613 WeakPolarHBondContact OE1-CE 3.45Å; E609-K613 IonicContact OE1-NZ 2.63Å; E609-K613 PolarHBondContact OE1-NZ 2.9Å; N610-K613 PolarHBondContact O-N 2.88Å; K613-I615 VanDerWaalsContact C-N 3.34Å; K613-I615 PolarHBondContact O-N 3.41Å; K613-E616 WeakPolarHBondContact O-CB 3.47Å; K613-E616 PolarHBondContact O-N 2.96Å; K613-E616 VanDerWaalsContact O-N 3.15Å; K613-E617 WeakPolarHBondContact O-CG 3.38Å; K613-E617 PolarHBondContact O-N 2.97Å
614Y84.2Confident83.2Confident140 Ų140103 Ų10355%0.54949%0.493SS..Hα-helixtrans-63.7-35.6174.4-173.7-113.4000113.3N610 K611 N612 L618N610-Y614 PolarHBondContact O-N 3.14Å; K611-Y614 PolarHBondContact O-N 3.44Å; N612-Y614 VanDerWaalsContact C-N 3.33Å; N612-Y614 PolarHBondContact O-N 3.23Å; Y614-L618 HydrophobicContact CD1-CD1 3.96Å; Y614-L618 HydrophobicContact CE1-CD1 3.61Å; Y614-L618 HydrophobicContact CE1-CG 4.35Å; Y614-L618 WeakPolarHBondContact O-CB 3.23Å; Y614-L618 WeakPolarHBondContact O-CG 3.46Å; Y614-L618 PolarHBondContact O-N 2.94Å
615I81.1Confident82.6Confident82 Ų82102.4 Ų102.442%0.42149%0.49SS..Hα-helixtrans-68.1-37.9172.5-70.2163.7000111.2K611 N612 K613 L618 Q619K611-I615 VanDerWaalsContact O-CG1 3.31Å; K611-I615 WeakPolarHBondContact O-CG1 3.47Å; K611-I615 PolarHBondContact O-N 3.18Å; N612-I615 CarbonylContact O-C 3.58Å; N612-I615 WeakPolarHBondContact O-CA 3.45Å; N612-I615 WeakPolarHBondContact O-CB 3.49Å; N612-I615 PolarHBondContact O-N 3.13Å; N612-I615 VanDerWaalsContact O-N 3.07Å; K613-I615 VanDerWaalsContact C-N 3.34Å; K613-I615 PolarHBondContact O-N 3.41Å; I615-L618 PolarHBondContact O-N 2.84Å; I615-Q619 WeakPolarHBondContact O-CB 3.27Å; I615-Q619 VanDerWaalsContact O-CG 3.31Å; I615-Q619 WeakPolarHBondContact O-CG 3.42Å; I615-Q619 PolarHBondContact O-N 3.29Å
616E83.3Confident81.8Confident92 Ų92102.7 Ų102.743%0.4350%0.496SS..Hα-helixtrans-66-40.6175-72.6169.8-136.500111.9N612 K613 Q619 Q620N612-E616 PolarHBondContact ND2-OE1 3.22Å; N612-E616 WeakPolarHBondContact O-CG 3.5Å; N612-E616 PolarHBondContact O-N 3.01Å; K613-E616 WeakPolarHBondContact O-CB 3.47Å; K613-E616 PolarHBondContact O-N 2.96Å; K613-E616 VanDerWaalsContact O-N 3.15Å; E616-Q619 WeakPolarHBondContact O-CB 3.39Å; E616-Q619 PolarHBondContact O-N 3.09Å; E616-Q620 WeakPolarHBondContact O-CG 3.33Å; E616-Q620 PolarHBondContact O-N 3.11Å
617E82.5Confident81.3Confident114 Ų114104.4 Ų104.453%0.53350%0.503SS..Hα-helixtrans-58.6-51.7171.2-72.6164.5-175.300110.9K613 Q619 Q620 E621K613-E617 WeakPolarHBondContact O-CG 3.38Å; K613-E617 PolarHBondContact O-N 2.97Å; E617-Q619 VanDerWaalsContact C-N 3.26Å; E617-Q619 PolarHBondContact O-N 2.98Å; E617-Q620 WeakPolarHBondContact O-CA 3.29Å; E617-Q620 WeakPolarHBondContact O-CB 3.37Å; E617-Q620 PolarHBondContact O-N 3.22Å; E617-E621 PolarHBondContact O-N 3.45Å
618L78.3Confident80.8Confident62 Ų62105.1 Ų105.133%0.32551%0.505SS..Hα-helixtrans-61.1-31.6175-72.4172.4000112.9Y614 I615 N622Y614-L618 HydrophobicContact CD1-CD1 3.96Å; Y614-L618 HydrophobicContact CE1-CD1 3.61Å; Y614-L618 HydrophobicContact CE1-CG 4.35Å; Y614-L618 WeakPolarHBondContact O-CB 3.23Å; Y614-L618 WeakPolarHBondContact O-CG 3.46Å; Y614-L618 PolarHBondContact O-N 2.94Å; I615-L618 PolarHBondContact O-N 2.84Å; L618-N622 WeakPolarHBondContact O-CB 3.34Å; L618-N622 PolarHBondContact O-N 2.89Å; L618-N622 PolarHBondContact O-ND2 2.71Å
619Q77.2Confident80.2Confident103 Ų103102.2 Ų102.248%0.48149%0.494SS..Hα-helixtrans-71.8-34.8172.4-77.7-1763100112.6I615 E616 E617 K623I615-Q619 WeakPolarHBondContact O-CB 3.27Å; I615-Q619 VanDerWaalsContact O-CG 3.31Å; I615-Q619 WeakPolarHBondContact O-CG 3.42Å; I615-Q619 PolarHBondContact O-N 3.29Å; E616-Q619 WeakPolarHBondContact O-CB 3.39Å; E616-Q619 PolarHBondContact O-N 3.09Å; E617-Q619 VanDerWaalsContact C-N 3.26Å; E617-Q619 PolarHBondContact O-N 2.98Å; Q619-K623 WeakPolarHBondContact O-CD 3.46Å; Q619-K623 VanDerWaalsContact O-CG 3.25Å; Q619-K623 WeakPolarHBondContact O-CG 3.49Å; Q619-K623 PolarHBondContact O-N 2.8Å
620Q81.9Confident79.5Confident131 Ų131101.3 Ų101.361%0.61250%0.495SS*.Hα-helixtrans-69.4-41.1173-71.3-173.452.800111.2E616 E617 K623 A624E616-Q620 WeakPolarHBondContact O-CG 3.33Å; E616-Q620 PolarHBondContact O-N 3.11Å; E617-Q620 WeakPolarHBondContact O-CA 3.29Å; E617-Q620 WeakPolarHBondContact O-CB 3.37Å; E617-Q620 PolarHBondContact O-N 3.22Å; Q620-K623 CarbonylContact O-C 3.55Å; Q620-K623 WeakPolarHBondContact O-CB 3.27Å; Q620-K623 PolarHBondContact O-N 3.47Å; Q620-K623 VanDerWaalsContact O-N 3.16Å; Q620-A624 PolarHBondContact O-N 2.95Å
621E78.8Confident78.7Confident109 Ų10999 Ų9951%0.50949%0.49SS..Hα-helixtrans-61.3-45.6172.3-172.6176-157.800111.2E617 K623 A624 L625E617-E621 PolarHBondContact O-N 3.45Å; E621-K623 VanDerWaalsContact C-N 3.28Å; E621-K623 PolarHBondContact O-N 2.69Å; E621-A624 CarbonylContact O-C 3.56Å; E621-A624 WeakPolarHBondContact O-CA 3.26Å; E621-A624 WeakPolarHBondContact O-CB 3.3Å; E621-A624 PolarHBondContact O-N 3.47Å; E621-L625 HydrophobicContact CG-CD1 4.23Å; E621-L625 HydrophobicContact CG-CG 4.42Å; E621-L625 WeakPolarHBondContact O-CG 3.41Å; E621-L625 PolarHBondContact O-N 2.87Å
622N75.2Confident77.9Confident93 Ų9397.6 Ų97.650%0.49749%0.485SS..Hα-helixtrans-61.1-33.6173.8-89.7-88.7000113L618 K626L618-N622 WeakPolarHBondContact O-CB 3.34Å; L618-N622 PolarHBondContact O-N 2.89Å; L618-N622 PolarHBondContact O-ND2 2.71Å; N622-K626 WeakPolarHBondContact O-CB 3.47Å; N622-K626 WeakPolarHBondContact O-CG 3.39Å; N622-K626 PolarHBondContact O-N 3.11Å
623K81.6Confident77.1Confident125 Ų12597.5 Ų97.554%0.54349%0.49SS..Hα-helixtrans-68.7-36171.3-72.9162.6-174.5166.80111.6Q619 Q620 E621 K627Q619-K623 WeakPolarHBondContact O-CD 3.46Å; Q619-K623 VanDerWaalsContact O-CG 3.25Å; Q619-K623 WeakPolarHBondContact O-CG 3.49Å; Q619-K623 PolarHBondContact O-N 2.8Å; Q620-K623 CarbonylContact O-C 3.55Å; Q620-K623 WeakPolarHBondContact O-CB 3.27Å; Q620-K623 PolarHBondContact O-N 3.47Å; Q620-K623 VanDerWaalsContact O-N 3.16Å; E621-K623 VanDerWaalsContact C-N 3.28Å; E621-K623 PolarHBondContact O-N 2.69Å; K623-K627 WeakPolarHBondContact O-CG 3.49Å; K623-K627 PolarHBondContact O-N 2.92Å
624A78.1Confident76.5Confident56 Ų56100.4 Ų100.446%0.46350%0.503SS..Hα-helixtrans-69.4-43.3174.200000112.2Q620 E621 K627 K628Q620-A624 PolarHBondContact O-N 2.95Å; E621-A624 CarbonylContact O-C 3.56Å; E621-A624 WeakPolarHBondContact O-CA 3.26Å; E621-A624 WeakPolarHBondContact O-CB 3.3Å; E621-A624 PolarHBondContact O-N 3.47Å; A624-K627 WeakPolarHBondContact O-CB 3.47Å; A624-K627 PolarHBondContact O-N 3.27Å; A624-K627 VanDerWaalsContact O-N 3.14Å; A624-K628 PolarHBondContact O-N 3.45Å
625L74.8Confident75.9Confident93 Ų9399.5 Ų99.549%0.48750%0.504SS..Hα-helixtrans-63.1-39.8174-69.5173.4000111.7E621 K628 G629E621-L625 HydrophobicContact CG-CD1 4.23Å; E621-L625 HydrophobicContact CG-CG 4.42Å; E621-L625 WeakPolarHBondContact O-CG 3.41Å; E621-L625 PolarHBondContact O-N 2.87Å; L625-K628 PolarHBondContact O-N 3.44Å; L625-G629 PolarHBondContact O-N 2.9Å
626K71.3Confident75.3Confident162 Ų162101.3 Ų101.370%0.70451%0.514SS*.Hα-helixtrans-61-42.7169.9-80.4-174.4176-175.80112.3N622 G629 T630N622-K626 WeakPolarHBondContact O-CB 3.47Å; N622-K626 WeakPolarHBondContact O-CG 3.39Å; N622-K626 PolarHBondContact O-N 3.11Å; K626-G629 PolarHBondContact O-N 3.35Å; K626-T630 WeakPolarHBondContact O-CG2 3.45Å; K626-T630 PolarHBondContact O-N 2.97Å
627K76.9Confident74.8Confident155 Ų155100.9 Ų100.967%0.67451%0.514SS*.Hα-helixtrans-60.8-44173.7-73.6173.6179.7-1790111.6K623 A624 T630 A631K623-K627 WeakPolarHBondContact O-CG 3.49Å; K623-K627 PolarHBondContact O-N 2.92Å; A624-K627 WeakPolarHBondContact O-CB 3.47Å; A624-K627 PolarHBondContact O-N 3.27Å; A624-K627 VanDerWaalsContact O-N 3.14Å; K627-T630 PolarHBondContact O-N 2.87Å; K627-T630 PolarHBondContact O-OG1 3.16Å; K627-A631 PolarHBondContact O-N 3.36Å
628K74Confident74.3Confident116 Ų11699.7 Ų99.750%0.50452%0.515SS..Hα-helixtrans-59.8-47.5175.5-170.7170.3-178.2-75.10111.5A624 L625 T630 A631 E632A624-K628 PolarHBondContact O-N 3.45Å; L625-K628 PolarHBondContact O-N 3.44Å; K628-T630 VanDerWaalsContact C-N 3.32Å; K628-T630 PolarHBondContact O-N 3.41Å; K628-A631 CarbonylContact O-C 3.57Å; K628-A631 WeakPolarHBondContact O-CA 3.18Å; K628-A631 WeakPolarHBondContact O-CB 3.43Å; K628-A631 PolarHBondContact O-N 2.93Å; K628-E632 IonicContact NZ-OE1 2.74Å; K628-E632 PolarHBondContact NZ-OE1 3.02Å; K628-E632 WeakPolarHBondContact O-CG 3.44Å; K628-E632 PolarHBondContact O-N 3.42Å
629G70.2Confident74Confident32 Ų32103.6 Ų103.633%0.3353%0.526SS..Hα-helixtrans-58.9-36.517300000113.6L625 K626 A631 S633L625-G629 PolarHBondContact O-N 2.9Å; K626-G629 PolarHBondContact O-N 3.35Å; G629-A631 VanDerWaalsContact C-N 3.31Å; G629-A631 PolarHBondContact O-N 2.86Å; G629-S633 WeakPolarHBondContact O-CB 3.48Å; G629-S633 PolarHBondContact O-N 3.47Å
630T70.3Confident73.8Confident79 Ų79104 Ų10449%0.48553%0.528SS..Hα-helixtrans-72.8-19.8172.262.80000114.1K626 K627 K628 K634K626-T630 WeakPolarHBondContact O-CG2 3.45Å; K626-T630 PolarHBondContact O-N 2.97Å; K627-T630 PolarHBondContact O-N 2.87Å; K627-T630 PolarHBondContact O-OG1 3.16Å; K628-T630 VanDerWaalsContact C-N 3.32Å; K628-T630 PolarHBondContact O-N 3.41Å; T630-K634 WeakPolarHBondContact O-CD 3.39Å; T630-K634 VanDerWaalsContact O-CG 3.22Å; T630-K634 WeakPolarHBondContact O-CG 3.35Å; T630-K634 PolarHBondContact O-N 3.28Å
631A72Confident73.4Confident53 Ų53102.6 Ų102.644%0.43852%0.524SS..Hα-helixtrans-83.2-39.5172.200000111.3K627 K628 G629 K634 Q635K627-A631 PolarHBondContact O-N 3.36Å; K628-A631 CarbonylContact O-C 3.57Å; K628-A631 WeakPolarHBondContact O-CA 3.18Å; K628-A631 WeakPolarHBondContact O-CB 3.43Å; K628-A631 PolarHBondContact O-N 2.93Å; G629-A631 VanDerWaalsContact C-N 3.31Å; G629-A631 PolarHBondContact O-N 2.86Å; A631-K634 WeakPolarHBondContact O-CB 3.43Å; A631-K634 PolarHBondContact O-N 3.46Å; A631-Q635 PolarHBondContact O-N 3.46Å
632E71.4Confident73.4Confident88 Ų88103.8 Ų103.841%0.41153%0.527SS..Hα-helixtrans-66.6-38.8173.3-70.9164.2167.200111.2K628 K634 Q635 L636K628-E632 IonicContact NZ-OE1 2.74Å; K628-E632 PolarHBondContact NZ-OE1 3.02Å; K628-E632 WeakPolarHBondContact O-CG 3.44Å; K628-E632 PolarHBondContact O-N 3.42Å; E632-K634 VanDerWaalsContact C-N 3.31Å; E632-K634 PolarHBondContact O-N 2.96Å; E632-Q635 CarbonylContact O-C 3.58Å; E632-Q635 WeakPolarHBondContact O-CB 3.39Å; E632-Q635 PolarHBondContact O-N 3.49Å; E632-L636 PolarHBondContact O-N 3.01Å
633S68.4Low73.3Confident75 Ų75103 Ų10352%0.52453%0.526SS..Hα-helixtrans-61.2-36.1169.3172.30000112.7G629 L636 N637G629-S633 WeakPolarHBondContact O-CB 3.48Å; G629-S633 PolarHBondContact O-N 3.47Å; S633-L636 WeakPolarHBondContact O-CB 3.44Å; S633-L636 PolarHBondContact O-N 2.84Å; S633-N637 PolarHBondContact O-N 2.92Å
634K74.9Confident73.1Confident148 Ų148100.7 Ų100.764%0.64352%0.519SS*.Hα-helixtrans-70.5-35.3172.8-74.5167.6-174.9179.30112.4T630 A631 E632 N637 V638T630-K634 WeakPolarHBondContact O-CD 3.39Å; T630-K634 VanDerWaalsContact O-CG 3.22Å; T630-K634 WeakPolarHBondContact O-CG 3.35Å; T630-K634 PolarHBondContact O-N 3.28Å; A631-K634 WeakPolarHBondContact O-CB 3.43Å; A631-K634 PolarHBondContact O-N 3.46Å; E632-K634 VanDerWaalsContact C-N 3.31Å; E632-K634 PolarHBondContact O-N 2.96Å; K634-N637 PolarHBondContact O-N 3.43Å; K634-V638 WeakPolarHBondContact O-CG2 3.48Å; K634-V638 PolarHBondContact O-N 3.47Å
635Q72Confident73.1Confident121 Ų121103.8 Ų103.857%0.56552%0.522SS*.Hα-helixtrans-65.5-41.5169.6-73.9-171.9-13.300111.5A631 E632 N637 V638 Y639A631-Q635 PolarHBondContact O-N 3.46Å; E632-Q635 CarbonylContact O-C 3.58Å; E632-Q635 WeakPolarHBondContact O-CB 3.39Å; E632-Q635 PolarHBondContact O-N 3.49Å; Q635-N637 VanDerWaalsContact C-N 3.35Å; Q635-N637 PolarHBondContact O-N 3.18Å; Q635-V638 CarbonylContact O-C 3.58Å; Q635-V638 WeakPolarHBondContact O-CA 3.5Å; Q635-V638 WeakPolarHBondContact O-CB 3.46Å; Q635-V638 PolarHBondContact O-N 2.85Å; Q635-V638 VanDerWaalsContact O-N 3.11Å; Q635-Y639 HydrophobicContact CB-CE2 4.37Å; Q635-Y639 WeakPolarHBondContact O-CD2 3.44Å; Q635-Y639 PolarHBondContact O-N 2.93Å
636L69.2Low73.2Confident120 Ų120104.5 Ų104.563%0.62853%0.526SS*.Hα-helixtrans-57.2-46.4174-108.3166.1000111.4E632 S633 V638 Y639 E640E632-L636 PolarHBondContact O-N 3.01Å; S633-L636 WeakPolarHBondContact O-CB 3.44Å; S633-L636 PolarHBondContact O-N 2.84Å; L636-V638 VanDerWaalsContact C-N 3.34Å; L636-V638 PolarHBondContact O-N 3.11Å; L636-Y639 CarbonylContact O-C 3.59Å; L636-Y639 WeakPolarHBondContact O-CA 3.31Å; L636-Y639 WeakPolarHBondContact O-CB 3.43Å; L636-Y639 PolarHBondContact O-N 3.17Å; L636-Y639 VanDerWaalsContact O-N 3.09Å; L636-E640 WeakPolarHBondContact O-CB 3.47Å; L636-E640 PolarHBondContact O-N 3.04Å
637N71.1Confident73.2Confident83 Ų83102.2 Ų102.244%0.44452%0.518SS..Hα-helixtrans-62.2-38.2174.3-169.8-37.9000112S633 K634 Q635 Y639 E640 I641S633-N637 PolarHBondContact O-N 2.92Å; K634-N637 PolarHBondContact O-N 3.43Å; Q635-N637 VanDerWaalsContact C-N 3.35Å; Q635-N637 PolarHBondContact O-N 3.18Å; N637-Y639 VanDerWaalsContact C-N 3.34Å; N637-Y639 PolarHBondContact O-N 3.36Å; N637-E640 WeakPolarHBondContact O-CB 3.44Å; N637-E640 PolarHBondContact O-N 3.37Å; N637-I641 WeakPolarHBondContact O-CB 3.39Å; N637-I641 VanDerWaalsContact O-CG1 3.3Å; N637-I641 WeakPolarHBondContact O-CG1 3.29Å; N637-I641 PolarHBondContact O-N 2.83Å; N637-I641 VanDerWaalsContact OD1-CD1 3.26Å; N637-I641 WeakPolarHBondContact OD1-CD1 3.36Å
638V72.8Confident73.3Confident90 Ų90101 Ų10155%0.54552%0.518SS..Hα-helixtrans-64.9-35.2172.1168.60000112.4K634 Q635 L636 K642K634-V638 WeakPolarHBondContact O-CG2 3.48Å; K634-V638 PolarHBondContact O-N 3.47Å; Q635-V638 CarbonylContact O-C 3.58Å; Q635-V638 WeakPolarHBondContact O-CA 3.5Å; Q635-V638 WeakPolarHBondContact O-CB 3.46Å; Q635-V638 PolarHBondContact O-N 2.85Å; Q635-V638 VanDerWaalsContact O-N 3.11Å; L636-V638 VanDerWaalsContact C-N 3.34Å; L636-V638 PolarHBondContact O-N 3.11Å; V638-K642 PolarHBondContact O-N 3.33Å
639Y71.9Confident73.4Confident144 Ų14499.9 Ų99.957%0.56552%0.515SS*.Hα-helixtrans-71.7-38172.2-72.9-63.5000112.2Q635 L636 N637 K642 V643Q635-Y639 HydrophobicContact CB-CE2 4.37Å; Q635-Y639 WeakPolarHBondContact O-CD2 3.44Å; Q635-Y639 PolarHBondContact O-N 2.93Å; L636-Y639 CarbonylContact O-C 3.59Å; L636-Y639 WeakPolarHBondContact O-CA 3.31Å; L636-Y639 WeakPolarHBondContact O-CB 3.43Å; L636-Y639 PolarHBondContact O-N 3.17Å; L636-Y639 VanDerWaalsContact O-N 3.09Å; N637-Y639 VanDerWaalsContact C-N 3.34Å; N637-Y639 PolarHBondContact O-N 3.36Å; Y639-K642 CarbonylContact O-C 3.53Å; Y639-K642 WeakPolarHBondContact O-CA 3.36Å; Y639-K642 VanDerWaalsContact O-CB 3.23Å; Y639-K642 WeakPolarHBondContact O-CB 3.4Å; Y639-K642 PolarHBondContact O-N 3.18Å; Y639-V643 WeakPolarHBondContact O-CG2 3.35Å; Y639-V643 PolarHBondContact O-N 3.38Å
640E72.5Confident73.7Confident111 Ų111103.2 Ų103.252%0.51952%0.524SS..Hα-helixtrans-62.5-46.6175-172176.9-175.200111.1L636 N637 K642 V643 N644L636-E640 WeakPolarHBondContact O-CB 3.47Å; L636-E640 PolarHBondContact O-N 3.04Å; N637-E640 WeakPolarHBondContact O-CB 3.44Å; N637-E640 PolarHBondContact O-N 3.37Å; E640-K642 PolarHBondContact O-N 2.95Å; E640-V643 PolarHBondContact O-N 2.83Å; E640-V643 VanDerWaalsContact O-N 3.13Å; E640-N644 WeakPolarHBondContact O-CB 3.37Å; E640-N644 PolarHBondContact O-N 2.85Å; E640-N644 PolarHBondContact O-ND2 3.14Å; E640-N644 PolarHBondContact O-OD1 2.94Å
641I74.6Confident74Confident102 Ų102104.2 Ų104.252%0.52352%0.523SS..Hα-helixtrans-58.3-35.2170.1-69.6166000111.4N637 K645N637-I641 WeakPolarHBondContact O-CB 3.39Å; N637-I641 VanDerWaalsContact O-CG1 3.3Å; N637-I641 WeakPolarHBondContact O-CG1 3.29Å; N637-I641 PolarHBondContact O-N 2.83Å; N637-I641 VanDerWaalsContact OD1-CD1 3.26Å; N637-I641 WeakPolarHBondContact OD1-CD1 3.36Å; I641-K645 WeakPolarHBondContact O-CB 3.35Å; I641-K645 PolarHBondContact O-N 2.85Å
642K77.9Confident74Confident133 Ų133104 Ų10458%0.57852%0.519SS*.Hα-helixtrans-70.8-39.7175.3-120.7176.3-179.3179.70112.7V638 Y639 E640 K645 L646V638-K642 PolarHBondContact O-N 3.33Å; Y639-K642 CarbonylContact O-C 3.53Å; Y639-K642 WeakPolarHBondContact O-CA 3.36Å; Y639-K642 VanDerWaalsContact O-CB 3.23Å; Y639-K642 WeakPolarHBondContact O-CB 3.4Å; Y639-K642 PolarHBondContact O-N 3.18Å; E640-K642 PolarHBondContact O-N 2.95Å; K642-K645 PolarHBondContact O-N 2.77Å; K642-L646 WeakPolarHBondContact O-CG 3.42Å; K642-L646 PolarHBondContact O-N 3.3Å
643V74.3Confident74.2Confident76 Ų76101.5 Ų101.546%0.46151%0.513SS..Hα-helixtrans-64.4-51.2173.7169.60000109.6Y639 E640 K645 L646 E647Y639-V643 WeakPolarHBondContact O-CG2 3.35Å; Y639-V643 PolarHBondContact O-N 3.38Å; E640-V643 PolarHBondContact O-N 2.83Å; E640-V643 VanDerWaalsContact O-N 3.13Å; V643-K645 PolarHBondContact O-N 2.99Å; V643-L646 CarbonylContact O-C 3.53Å; V643-L646 WeakPolarHBondContact O-CA 3.44Å; V643-L646 PolarHBondContact O-N 2.91Å; V643-E647 HydrophobicContact CG1-CG 4.33Å; V643-E647 PolarHBondContact O-N 3.26Å
644N75.6Confident74.4Confident77 Ų77103 Ų10341%0.41251%0.51SS..Hα-helixtrans-58.9-33.9178.2-61.4-8000112E640 L648E640-N644 WeakPolarHBondContact O-CB 3.37Å; E640-N644 PolarHBondContact O-N 2.85Å; E640-N644 PolarHBondContact O-ND2 3.14Å; E640-N644 PolarHBondContact O-OD1 2.94Å; N644-L648 WeakPolarHBondContact O-CB 3.47Å; N644-L648 PolarHBondContact O-N 3.29Å
645K78.9Confident74.3Confident122 Ų122101.8 Ų101.853%0.5351%0.507SS..Hα-helixtrans-68-44.4171.1176.9171.6171.21750112.3I641 K642 V643 E647 L648 E649I641-K645 WeakPolarHBondContact O-CB 3.35Å; I641-K645 PolarHBondContact O-N 2.85Å; K642-K645 PolarHBondContact O-N 2.77Å; V643-K645 PolarHBondContact O-N 2.99Å; K645-E647 VanDerWaalsContact C-N 3.31Å; K645-L648 WeakPolarHBondContact O-CB 3.5Å; K645-L648 PolarHBondContact O-N 2.87Å; K645-E649 WeakPolarHBondContact CE-OE1 3.43Å; K645-E649 IonicContact NZ-OE1 2.6Å; K645-E649 PolarHBondContact NZ-OE1 3.19Å; K645-E649 WeakPolarHBondContact O-CG 3.5Å; K645-E649 PolarHBondContact O-N 2.99Å
646L77.1Confident74.3Confident107 Ų107101.9 Ų101.956%0.5651%0.506SS*.Hα-helixtrans-67.2-31.9176.8-72.7168.4000112.2K642 V643 E649 L650K642-L646 WeakPolarHBondContact O-CG 3.42Å; K642-L646 PolarHBondContact O-N 3.3Å; V643-L646 CarbonylContact O-C 3.53Å; V643-L646 WeakPolarHBondContact O-CA 3.44Å; V643-L646 PolarHBondContact O-N 2.91Å; L646-E649 PolarHBondContact O-N 3Å; L646-L650 VanDerWaalsContact O-CB 3.22Å; L646-L650 WeakPolarHBondContact O-CB 3.44Å; L646-L650 PolarHBondContact O-N 3.43Å
647E71.6Confident74.3Confident115 Ų115102.8 Ų102.854%0.53751%0.505SS..Hα-helixtrans-67.6-41.2170.5-71.9-171.1142.700111.6V643 K645 L650 E651V643-E647 HydrophobicContact CG1-CG 4.33Å; V643-E647 PolarHBondContact O-N 3.26Å; K645-E647 VanDerWaalsContact C-N 3.31Å; E647-L650 PolarHBondContact O-N 2.85Å; E647-E651 WeakPolarHBondContact O-CB 2.75Å; E647-E651 PolarHBondContact O-N 3.5Å
648L78.6Confident74.5Confident129 Ų129100.1 Ų100.168%0.67550%0.497SS*.Hα-helixtrans-63-40.1171.4-94.2162.1000112.7N644 K645 E651 S652N644-L648 WeakPolarHBondContact O-CB 3.47Å; N644-L648 PolarHBondContact O-N 3.29Å; K645-L648 WeakPolarHBondContact O-CB 3.5Å; K645-L648 PolarHBondContact O-N 2.87Å; L648-E651 PolarHBondContact O-N 3.45Å; L648-S652 WeakPolarHBondContact O-CB 3.36Å; L648-S652 PolarHBondContact O-N 3.03Å
649E76.8Confident74.4Confident93 Ų93100.5 Ų100.544%0.43549%0.492SS..Hα-helixtrans-66.7-42.3174.9-73.9175.6176.400111K645 L646 S652 A653K645-E649 WeakPolarHBondContact CE-OE1 3.43Å; K645-E649 IonicContact NZ-OE1 2.6Å; K645-E649 PolarHBondContact NZ-OE1 3.19Å; K645-E649 WeakPolarHBondContact O-CG 3.5Å; K645-E649 PolarHBondContact O-N 2.99Å; L646-E649 PolarHBondContact O-N 3Å; E649-S652 PolarHBondContact O-N 3.21Å; E649-S652 PolarHBondContact O-OG 2.89Å; E649-A653 PolarHBondContact O-N 3.14Å
650L76.6Confident74.5Confident101 Ų10197.4 Ų97.453%0.52949%0.485SS..Hα-helixtrans-61.3-44.6172.9-178.772.2000112.1L646 E647 A653 K654L646-L650 VanDerWaalsContact O-CB 3.22Å; L646-L650 WeakPolarHBondContact O-CB 3.44Å; L646-L650 PolarHBondContact O-N 3.43Å; E647-L650 PolarHBondContact O-N 2.85Å; L650-A653 CarbonylContact O-C 3.6Å; L650-A653 WeakPolarHBondContact O-CB 3.34Å; L650-A653 PolarHBondContact O-N 3.05Å; L650-A653 VanDerWaalsContact O-N 3.15Å; L650-K654 WeakPolarHBondContact O-CG 3.38Å; L650-K654 PolarHBondContact O-N 2.61Å
651E75.7Confident74.6Confident100 Ų10095.8 Ų95.847%0.46748%0.483SS..Hα-helixtrans-69.3-36.2179.3-152.663.9-145.900111E647 L648 A653 K654 Q655E647-E651 WeakPolarHBondContact O-CB 2.75Å; E647-E651 PolarHBondContact O-N 3.5Å; L648-E651 PolarHBondContact O-N 3.45Å; E651-A653 VanDerWaalsContact C-N 3.25Å; E651-A653 PolarHBondContact O-N 2.9Å; E651-K654 PolarHBondContact O-N 3.45Å; E651-K654 IonicContact OE1-NZ 3.36Å; E651-K654 WeakPolarHBondContact OE2-CD 3.35Å; E651-K654 WeakPolarHBondContact OE2-CE 3.43Å; E651-K654 IonicContact OE2-NZ 2.8Å; E651-K654 PolarHBondContact OE2-NZ 3.16Å; E651-Q655 WeakPolarHBondContact O-CB 3.49Å; E651-Q655 PolarHBondContact O-N 3.45Å
652S72.3Confident74.6Confident50 Ų5096.1 Ų96.135%0.3549%0.486SS..Hα-helixtrans-64.5-30.7170.885.20000112.7L648 E649 K656L648-S652 WeakPolarHBondContact O-CB 3.36Å; L648-S652 PolarHBondContact O-N 3.03Å; E649-S652 PolarHBondContact O-N 3.21Å; E649-S652 PolarHBondContact O-OG 2.89Å; S652-K656 WeakPolarHBondContact O-CD 3.39Å; S652-K656 VanDerWaalsContact O-CG 3.32Å; S652-K656 WeakPolarHBondContact O-CG 3.34Å; S652-K656 PolarHBondContact O-N 3.26Å; S652-K656 VanDerWaalsContact O-N 3.13Å
653A75.3Confident74.4Confident35 Ų3593.9 Ų93.929%0.28948%0.483SS..Hα-helixtrans-74.6-42.3173.100000111.2E649 L650 E651 Q655 K656 F657E649-A653 PolarHBondContact O-N 3.14Å; L650-A653 CarbonylContact O-C 3.6Å; L650-A653 WeakPolarHBondContact O-CB 3.34Å; L650-A653 PolarHBondContact O-N 3.05Å; L650-A653 VanDerWaalsContact O-N 3.15Å; E651-A653 VanDerWaalsContact C-N 3.25Å; E651-A653 PolarHBondContact O-N 2.9Å; A653-Q655 VanDerWaalsContact C-N 3.33Å; A653-Q655 PolarHBondContact O-N 3.02Å; A653-K656 PolarHBondContact O-N 2.78Å; A653-F657 WeakPolarHBondContact O-CD2 3.23Å; A653-F657 PolarHBondContact O-N 2.77Å
654K71.8Confident74.2Confident106 Ų10697.1 Ų97.146%0.46149%0.488SS..Hα-helixtrans-59.4-42.3171.4-69.9-177.4-157.51570111.6L650 E651 F657 G658L650-K654 WeakPolarHBondContact O-CG 3.38Å; L650-K654 PolarHBondContact O-N 2.61Å; E651-K654 PolarHBondContact O-N 3.45Å; E651-K654 IonicContact OE1-NZ 3.36Å; E651-K654 WeakPolarHBondContact OE2-CD 3.35Å; E651-K654 WeakPolarHBondContact OE2-CE 3.43Å; E651-K654 IonicContact OE2-NZ 2.8Å; E651-K654 PolarHBondContact OE2-NZ 3.16Å; K654-F657 CarbonylContact O-C 3.59Å; K654-F657 PolarHBondContact O-N 2.91Å; K654-G658 PolarHBondContact O-N 3.49Å
655Q74.5Confident73.9Confident122 Ų12298.9 Ų98.957%0.5749%0.494SS*.Hα-helixtrans-61.5-45.7176.2-175.4-178.1-26.600110.7E651 A653 F657 G658 E659E651-Q655 WeakPolarHBondContact O-CB 3.49Å; E651-Q655 PolarHBondContact O-N 3.45Å; A653-Q655 VanDerWaalsContact C-N 3.33Å; A653-Q655 PolarHBondContact O-N 3.02Å; Q655-F657 VanDerWaalsContact C-N 3.34Å; Q655-F657 PolarHBondContact O-N 3.39Å; Q655-G658 CarbonylContact O-C 3.53Å; Q655-G658 WeakPolarHBondContact O-CA 3.43Å; Q655-G658 PolarHBondContact O-N 2.9Å; Q655-G658 VanDerWaalsContact O-N 3.1Å; Q655-E659 WeakPolarHBondContact CG-OE1 3.39Å; Q655-E659 PolarHBondContact NE2-OE1 3.47Å; Q655-E659 WeakPolarHBondContact O-CG 3.43Å; Q655-E659 PolarHBondContact O-N 2.99Å
656K71.4Confident73.7Confident124 Ų12499.4 Ų99.454%0.53950%0.496SS..Hα-helixtrans-62.4-38.6174.1-73.6166.4-176.6167.80112.8S652 A653 G658 I660S652-K656 WeakPolarHBondContact O-CD 3.39Å; S652-K656 VanDerWaalsContact O-CG 3.32Å; S652-K656 WeakPolarHBondContact O-CG 3.34Å; S652-K656 PolarHBondContact O-N 3.26Å; S652-K656 VanDerWaalsContact O-N 3.13Å; A653-K656 PolarHBondContact O-N 2.78Å; K656-G658 VanDerWaalsContact C-N 3.33Å; K656-I660 WeakPolarHBondContact O-CB 3.5Å; K656-I660 WeakPolarHBondContact O-CD1 3.49Å; K656-I660 WeakPolarHBondContact O-CG1 3.09Å; K656-I660 PolarHBondContact O-N 3.01Å
657F69.3Low73.4Confident139 Ų13999 Ų9961%0.6149%0.491SS*.Hα-helixtrans-67.1-34.9172.4-75.5-59.3000112A653 K654 Q655 I660 T661A653-F657 WeakPolarHBondContact O-CD2 3.23Å; A653-F657 PolarHBondContact O-N 2.77Å; K654-F657 CarbonylContact O-C 3.59Å; K654-F657 PolarHBondContact O-N 2.91Å; Q655-F657 VanDerWaalsContact C-N 3.34Å; Q655-F657 PolarHBondContact O-N 3.39Å; F657-I660 PolarHBondContact O-N 2.81Å; F657-T661 VanDerWaalsContact O-CB 3.32Å; F657-T661 WeakPolarHBondContact O-CB 3.17Å; F657-T661 PolarHBondContact O-N 3.25Å; F657-T661 PolarHBondContact O-OG1 3.37Å
658G74.3Confident73.4Confident27 Ų2798.2 Ų98.228%0.27849%0.49SS..Hα-helixtrans-62.7-51.6171.200000111.8K654 Q655 K656 I660 T661 D662K654-G658 PolarHBondContact O-N 3.49Å; Q655-G658 CarbonylContact O-C 3.53Å; Q655-G658 WeakPolarHBondContact O-CA 3.43Å; Q655-G658 PolarHBondContact O-N 2.9Å; Q655-G658 VanDerWaalsContact O-N 3.1Å; K656-G658 VanDerWaalsContact C-N 3.33Å; G658-I660 VanDerWaalsContact C-N 3.31Å; G658-I660 PolarHBondContact O-N 3.46Å; G658-T661 CarbonylContact O-C 3.59Å; G658-T661 PolarHBondContact O-N 3.27Å; G658-T661 VanDerWaalsContact O-N 3.11Å; G658-D662 WeakPolarHBondContact O-CB 3.32Å; G658-D662 PolarHBondContact O-N 3.01Å
659E72.3Confident73.2Confident97 Ų9796.1 Ų96.145%0.45348%0.477SS..Hα-helixtrans-58.6-41175.5-70.6165.6-174.400111.7Q655 T663Q655-E659 WeakPolarHBondContact CG-OE1 3.39Å; Q655-E659 PolarHBondContact NE2-OE1 3.47Å; Q655-E659 WeakPolarHBondContact O-CG 3.43Å; Q655-E659 PolarHBondContact O-N 2.99Å; E659-T663 WeakPolarHBondContact O-CG2 3.43Å; E659-T663 PolarHBondContact O-N 2.93Å; E659-T663 PolarHBondContact O-OG1 3.2Å
660I74.3Confident73Confident80 Ų8095.9 Ų95.941%0.4148%0.478SS..Hα-helixtrans-65.1-46.4173.2-72.1165.6000110.9K656 F657 G658 D662 T663 Y664K656-I660 WeakPolarHBondContact O-CB 3.5Å; K656-I660 WeakPolarHBondContact O-CD1 3.49Å; K656-I660 WeakPolarHBondContact O-CG1 3.09Å; K656-I660 PolarHBondContact O-N 3.01Å; F657-I660 PolarHBondContact O-N 2.81Å; G658-I660 VanDerWaalsContact C-N 3.31Å; G658-I660 PolarHBondContact O-N 3.46Å; I660-D662 PolarHBondContact O-N 2.77Å; I660-T663 WeakPolarHBondContact CA-OG1 3.5Å; I660-T663 PolarHBondContact O-N 3.13Å; I660-T663 PolarHBondContact O-OG1 3.18Å; I660-Y664 HydrophobicContact CG2-CD2 3.75Å; I660-Y664 HydrophobicContact CG2-CE2 3.5Å; I660-Y664 VanDerWaalsContact CG2-CE2 3.5Å; I660-Y664 VanDerWaalsContact O-CD2 3.28Å; I660-Y664 WeakPolarHBondContact O-CD2 3.41Å; I660-Y664 PolarHBondContact O-N 3.27Å
661T73.2Confident72.8Confident76 Ų7696.6 Ų96.647%0.46648%0.477SS..Hα-helixtrans-59.6-46.3175.7-65.60000110.8F657 G658 T663 Y664 Q665F657-T661 VanDerWaalsContact O-CB 3.32Å; F657-T661 WeakPolarHBondContact O-CB 3.17Å; F657-T661 PolarHBondContact O-N 3.25Å; F657-T661 PolarHBondContact O-OG1 3.37Å; G658-T661 CarbonylContact O-C 3.59Å; G658-T661 PolarHBondContact O-N 3.27Å; G658-T661 VanDerWaalsContact O-N 3.11Å; T661-T663 VanDerWaalsContact C-N 3.34Å; T661-T663 PolarHBondContact O-N 2.8Å; T661-Y664 CarbonylContact O-C 3.59Å; T661-Y664 PolarHBondContact O-N 3.07Å; T661-Y664 VanDerWaalsContact O-N 3.16Å; T661-Q665 VanDerWaalsContact O-CB 3.29Å; T661-Q665 WeakPolarHBondContact O-CB 3.46Å; T661-Q665 PolarHBondContact O-N 2.77Å
662D74.5Confident72.4Confident110 Ų11096.3 Ų96.359%0.58847%0.474SS*.Hα-helixtrans-64.1-35.9177.8-73.6-23.2000111.9G658 I660 Q665 K666G658-D662 WeakPolarHBondContact O-CB 3.32Å; G658-D662 PolarHBondContact O-N 3.01Å; I660-D662 PolarHBondContact O-N 2.77Å; D662-Q665 PolarHBondContact O-N 3.09Å; D662-K666 WeakPolarHBondContact O-CB 3.49Å; D662-K666 PolarHBondContact O-N 2.85Å
663T73.8Confident72.3Confident86 Ų8697.6 Ų97.653%0.52848%0.477SS..Hα-helixtrans-67.4-37.5171.854.40000113E659 I660 T661 E667E659-T663 WeakPolarHBondContact O-CG2 3.43Å; E659-T663 PolarHBondContact O-N 2.93Å; E659-T663 PolarHBondContact O-OG1 3.2Å; I660-T663 WeakPolarHBondContact CA-OG1 3.5Å; I660-T663 PolarHBondContact O-N 3.13Å; I660-T663 PolarHBondContact O-OG1 3.18Å; T661-T663 VanDerWaalsContact C-N 3.34Å; T661-T663 PolarHBondContact O-N 2.8Å; T663-E667 PolarHBondContact O-N 3.23Å
664Y69.6Low72Confident144 Ų14498.9 Ų98.957%0.56548%0.484SS*.Hα-helixtrans-72.5-36.8172.6-72.8-55000112.6I660 T661 K666 E667 I668I660-Y664 HydrophobicContact CG2-CD2 3.75Å; I660-Y664 HydrophobicContact CG2-CE2 3.5Å; I660-Y664 VanDerWaalsContact CG2-CE2 3.5Å; I660-Y664 VanDerWaalsContact O-CD2 3.28Å; I660-Y664 WeakPolarHBondContact O-CD2 3.41Å; I660-Y664 PolarHBondContact O-N 3.27Å; T661-Y664 CarbonylContact O-C 3.59Å; T661-Y664 PolarHBondContact O-N 3.07Å; T661-Y664 VanDerWaalsContact O-N 3.16Å; Y664-K666 VanDerWaalsContact C-N 3.27Å; Y664-K666 PolarHBondContact O-N 2.81Å; Y664-E667 PolarHBondContact O-N 2.91Å; Y664-I668 WeakPolarHBondContact O-CB 3.32Å; Y664-I668 WeakPolarHBondContact O-CD1 3.41Å; Y664-I668 VanDerWaalsContact O-CG1 3.23Å; Y664-I668 WeakPolarHBondContact O-CG1 3.09Å; Y664-I668 PolarHBondContact O-N 2.79Å
665Q69.6Low71.9Confident114 Ų114100.3 Ų100.353%0.53349%0.492SS..Hα-helixtrans-61.8-40.5174.3-155.679.211.800109.9T661 D662 I668 E669T661-Q665 VanDerWaalsContact O-CB 3.29Å; T661-Q665 WeakPolarHBondContact O-CB 3.46Å; T661-Q665 PolarHBondContact O-N 2.77Å; D662-Q665 PolarHBondContact O-N 3.09Å; Q665-I668 PolarHBondContact O-N 3.44Å; Q665-E669 WeakPolarHBondContact O-CB 3.22Å; Q665-E669 PolarHBondContact O-N 2.74Å
666K75.2Confident71.5Confident133 Ų133100.5 Ų100.558%0.57849%0.493SS*.Hα-helixtrans-71.7-41.1174.6-172.7175178.8-176.40112.6D662 Y664 I668 E669 D670D662-K666 WeakPolarHBondContact O-CB 3.49Å; D662-K666 PolarHBondContact O-N 2.85Å; Y664-K666 VanDerWaalsContact C-N 3.27Å; Y664-K666 PolarHBondContact O-N 2.81Å; K666-I668 PolarHBondContact O-N 2.62Å; K666-E669 PolarHBondContact O-N 3.11Å; K666-D670 VanDerWaalsContact O-CB 3.28Å; K666-D670 WeakPolarHBondContact O-CB 2.99Å; K666-D670 VanDerWaalsContact O-CG 3.31Å; K666-D670 PolarHBondContact O-N 2.89Å
667E72.1Confident71.2Confident98 Ų9899 Ų9946%0.45849%0.49SS..Hα-helixtrans-59-38170-89.9-155.3177.900111.9T663 Y664 K671T663-E667 PolarHBondContact O-N 3.23Å; Y664-E667 PolarHBondContact O-N 2.91Å; E667-K671 WeakPolarHBondContact O-CB 3.48Å; E667-K671 VanDerWaalsContact O-CD 3.3Å; E667-K671 WeakPolarHBondContact O-CD 3.43Å; E667-K671 WeakPolarHBondContact O-CG 3.22Å; E667-K671 PolarHBondContact O-N 3.1Å; E667-K671 IonicContact OE2-NZ 2.88Å; E667-K671 PolarHBondContact OE2-NZ 3.44Å
668I70.9Confident71.2Confident98 Ų9897.4 Ų97.450%0.50349%0.488SS..Hα-helixtrans-67-45176.4-73.5164.3000110.2Y664 Q665 K666 K671 K672Y664-I668 WeakPolarHBondContact O-CB 3.32Å; Y664-I668 WeakPolarHBondContact O-CD1 3.41Å; Y664-I668 VanDerWaalsContact O-CG1 3.23Å; Y664-I668 WeakPolarHBondContact O-CG1 3.09Å; Y664-I668 PolarHBondContact O-N 2.79Å; Q665-I668 PolarHBondContact O-N 3.44Å; K666-I668 PolarHBondContact O-N 2.62Å; I668-K671 PolarHBondContact O-N 2.76Å; I668-K672 WeakPolarHBondContact O-CB 3.28Å; I668-K672 PolarHBondContact O-N 2.85Å
669E74.3Confident70.8Confident86 Ų86101.1 Ų101.140%0.40250%0.501SS..Hα-helixtrans-71.1-38.8180-156.968.1-161.700111.8Q665 K666 K672 I673Q665-E669 WeakPolarHBondContact O-CB 3.22Å; Q665-E669 PolarHBondContact O-N 2.74Å; K666-E669 PolarHBondContact O-N 3.11Å; E669-K672 PolarHBondContact O-N 3.37Å; E669-K672 IonicContact OE1-NZ 2.69Å; E669-K672 PolarHBondContact OE1-NZ 3.49Å; E669-K672 IonicContact OE2-NZ 2.71Å; E669-K672 PolarHBondContact OE2-NZ 3.24Å; E669-I673 HydrophobicContact CG-CD1 4.47Å; E669-I673 WeakPolarHBondContact O-CB 3.45Å; E669-I673 WeakPolarHBondContact O-CD1 3.29Å; E669-I673 VanDerWaalsContact O-CG1 3.22Å; E669-I673 WeakPolarHBondContact O-CG1 3.17Å; E669-I673 PolarHBondContact O-N 3.27Å
670D71.5Confident70.6Confident88 Ų88101.3 Ų101.347%0.47150%0.502SS..Hα-helixtrans-66.1-40.2173.2-72.5-24.8000111.1K666 I673 S674K666-D670 VanDerWaalsContact O-CB 3.28Å; K666-D670 WeakPolarHBondContact O-CB 2.99Å; K666-D670 VanDerWaalsContact O-CG 3.31Å; K666-D670 PolarHBondContact O-N 2.89Å; D670-I673 PolarHBondContact O-N 3.13Å; D670-S674 PolarHBondContact O-N 3.47Å
671K72.2Confident70.3Confident116 Ų116103.6 Ų103.650%0.50451%0.511SS..Hα-helixtrans-64.7-43.5172-77.4165-169.3158.90111.5E667 I668 I673 S674 E675E667-K671 WeakPolarHBondContact O-CB 3.48Å; E667-K671 VanDerWaalsContact O-CD 3.3Å; E667-K671 WeakPolarHBondContact O-CD 3.43Å; E667-K671 WeakPolarHBondContact O-CG 3.22Å; E667-K671 PolarHBondContact O-N 3.1Å; E667-K671 IonicContact OE2-NZ 2.88Å; E667-K671 PolarHBondContact OE2-NZ 3.44Å; I668-K671 PolarHBondContact O-N 2.76Å; K671-I673 VanDerWaalsContact C-N 3.35Å; K671-S674 CarbonylContact O-C 3.55Å; K671-S674 WeakPolarHBondContact O-CA 3.43Å; K671-S674 WeakPolarHBondContact O-CB 3.28Å; K671-S674 PolarHBondContact O-N 2.79Å; K671-S674 VanDerWaalsContact O-N 3.09Å; K671-S674 PolarHBondContact O-OG 2.65Å; K671-E675 WeakPolarHBondContact O-CB 3.32Å; K671-E675 PolarHBondContact O-N 3.26Å
672K68.1Low69.9Low93 Ų93104 Ų10440%0.40451%0.513SS..Hα-helixtrans-64-36.7176.2174.7-178.8161.3-138.10112.2I668 E669 E675 E676I668-K672 WeakPolarHBondContact O-CB 3.28Å; I668-K672 PolarHBondContact O-N 2.85Å; E669-K672 PolarHBondContact O-N 3.37Å; E669-K672 IonicContact OE1-NZ 2.69Å; E669-K672 PolarHBondContact OE1-NZ 3.49Å; E669-K672 IonicContact OE2-NZ 2.71Å; E669-K672 PolarHBondContact OE2-NZ 3.24Å; K672-E675 PolarHBondContact O-N 2.82Å; K672-E676 VanDerWaalsContact O-CB 3.24Å; K672-E676 WeakPolarHBondContact O-CB 3.18Å; K672-E676 PolarHBondContact O-N 3.38Å
673I71.2Confident69.3Low78 Ų78102.9 Ų102.940%0.450%0.504SS..Hα-helixtrans-66.4-39.7170.3-71.2162.5000110.3E669 D670 K671 E675 E676 N677E669-I673 HydrophobicContact CG-CD1 4.47Å; E669-I673 WeakPolarHBondContact O-CB 3.45Å; E669-I673 WeakPolarHBondContact O-CD1 3.29Å; E669-I673 VanDerWaalsContact O-CG1 3.22Å; E669-I673 WeakPolarHBondContact O-CG1 3.17Å; E669-I673 PolarHBondContact O-N 3.27Å; D670-I673 PolarHBondContact O-N 3.13Å; K671-I673 VanDerWaalsContact C-N 3.35Å; I673-E675 VanDerWaalsContact C-N 3.35Å; I673-E676 PolarHBondContact O-N 3.15Å; I673-N677 PolarHBondContact O-N 2.77Å; I673-N677 PolarHBondContact O-ND2 2.64Å
674S67.8Low69.1Low62 Ų62104 Ų10443%0.43450%0.501SS..Hα-helixtrans-66.6-36173.979.30000112.8D670 K671 L678D670-S674 PolarHBondContact O-N 3.47Å; K671-S674 CarbonylContact O-C 3.55Å; K671-S674 WeakPolarHBondContact O-CA 3.43Å; K671-S674 WeakPolarHBondContact O-CB 3.28Å; K671-S674 PolarHBondContact O-N 2.79Å; K671-S674 VanDerWaalsContact O-N 3.09Å; K671-S674 PolarHBondContact O-OG 2.65Å; S674-L678 WeakPolarHBondContact O-CB 3.32Å; S674-L678 WeakPolarHBondContact O-CG 3.49Å; S674-L678 PolarHBondContact O-N 2.77Å
675E69.1Low68.8Low136 Ų13699.8 Ų99.864%0.63650%0.497SS*.Hα-helixtrans-68.5-39.3173.9-174.2174-16200111.1K671 K672 I673 L678 L679K671-E675 WeakPolarHBondContact O-CB 3.32Å; K671-E675 PolarHBondContact O-N 3.26Å; K672-E675 PolarHBondContact O-N 2.82Å; I673-E675 VanDerWaalsContact C-N 3.35Å; E675-L678 CarbonylContact O-C 3.54Å; E675-L678 PolarHBondContact O-N 2.63Å; E675-L679 VanDerWaalsContact O-CB 3.29Å; E675-L679 WeakPolarHBondContact O-CB 3.37Å; E675-L679 PolarHBondContact O-N 2.76Å
676E66.3Low68.6Low125 Ų12598.9 Ų98.958%0.58449%0.491SS*.Hα-helixtrans-71.3-33.7176.5-169.9163.7-151.100112.2K672 I673 L679 E680K672-E676 VanDerWaalsContact O-CB 3.24Å; K672-E676 WeakPolarHBondContact O-CB 3.18Å; K672-E676 PolarHBondContact O-N 3.38Å; I673-E676 PolarHBondContact O-N 3.15Å; E676-L679 CarbonylContact O-C 3.57Å; E676-L679 WeakPolarHBondContact O-CB 3.38Å; E676-L679 PolarHBondContact O-N 2.98Å; E676-E680 PolarHBondContact O-N 3.34Å
677N66.5Low68.4Low92 Ų9296.5 Ų96.549%0.49249%0.487SS..Hα-helixtrans-66.6-43.8169.2-81.5-82.1000111.8I673 L679 E680 E681I673-N677 PolarHBondContact O-N 2.77Å; I673-N677 PolarHBondContact O-ND2 2.64Å; N677-L679 VanDerWaalsContact C-N 3.28Å; N677-L679 PolarHBondContact O-N 3.35Å; N677-E680 PolarHBondContact O-N 2.84Å; N677-E681 PolarHBondContact O-N 3.32Å
678L67.9Low68.3Low106 Ų10697.4 Ų97.456%0.55549%0.494SS*.Hα-helixtrans-64.4-34.2172.5-74.5169.2000111.5S674 E675 E681 V682S674-L678 WeakPolarHBondContact O-CB 3.32Å; S674-L678 WeakPolarHBondContact O-CG 3.49Å; S674-L678 PolarHBondContact O-N 2.77Å; E675-L678 CarbonylContact O-C 3.54Å; E675-L678 PolarHBondContact O-N 2.63Å; L678-E681 PolarHBondContact O-N 3.36Å; L678-V682 WeakPolarHBondContact O-CB 3.47Å; L678-V682 VanDerWaalsContact O-CG2 3.28Å; L678-V682 WeakPolarHBondContact O-CG2 3.48Å; L678-V682 PolarHBondContact O-N 2.82Å
679L67.1Low68.2Low105 Ų10595.1 Ų95.155%0.5549%0.49SS..Hα-helixtrans-67.4-36.5172.8-157.978.9000110.8E675 E676 N677 V682 E683E675-L679 VanDerWaalsContact O-CB 3.29Å; E675-L679 WeakPolarHBondContact O-CB 3.37Å; E675-L679 PolarHBondContact O-N 2.76Å; E676-L679 CarbonylContact O-C 3.57Å; E676-L679 WeakPolarHBondContact O-CB 3.38Å; E676-L679 PolarHBondContact O-N 2.98Å; N677-L679 VanDerWaalsContact C-N 3.28Å; N677-L679 PolarHBondContact O-N 3.35Å; L679-V682 CarbonylContact O-C 3.55Å; L679-V682 PolarHBondContact O-N 3.46Å; L679-E683 VanDerWaalsContact O-CB 3.26Å; L679-E683 WeakPolarHBondContact O-CB 3.1Å; L679-E683 PolarHBondContact O-N 3.46Å
680E67Low67.9Low101 Ų10194.9 Ų94.947%0.47249%0.492SS..Hα-helixtrans-69.1-37174.7-152.2-161.3143.700111.8E676 N677 E683 K684E676-E680 PolarHBondContact O-N 3.34Å; N677-E680 PolarHBondContact O-N 2.84Å; E680-E683 PolarHBondContact O-N 2.9Å; E680-K684 WeakPolarHBondContact O-CB 3.3Å; E680-K684 VanDerWaalsContact O-CD 3.32Å; E680-K684 WeakPolarHBondContact O-CD 3.23Å; E680-K684 WeakPolarHBondContact O-CG 3.48Å; E680-K684 PolarHBondContact O-N 3.25Å; E680-K684 WeakPolarHBondContact OE1-CE 3.5Å; E680-K684 IonicContact OE1-NZ 2.7Å; E680-K684 PolarHBondContact OE1-NZ 2.85Å; E680-K684 IonicContact OE2-NZ 3.16Å
681E68.1Low67.9Low129 Ų12996.5 Ų96.560%0.60350%0.496SS*.Hα-helixtrans-65.1-42.6169.4-72.1-162139.100112.2N677 L678 K684 A685N677-E681 PolarHBondContact O-N 3.32Å; L678-E681 PolarHBondContact O-N 3.36Å; E681-K684 PolarHBondContact O-N 2.8Å; E681-A685 WeakPolarHBondContact O-CB 3.4Å; E681-A685 PolarHBondContact O-N 3.27Å
682V64.9Low67.6Low85 Ų8593.6 Ų93.652%0.51549%0.494SS..Hα-helixtrans-63.9-40.9174.5165.50000111.2L678 L679 A685 K686L678-V682 WeakPolarHBondContact O-CB 3.47Å; L678-V682 VanDerWaalsContact O-CG2 3.28Å; L678-V682 WeakPolarHBondContact O-CG2 3.48Å; L678-V682 PolarHBondContact O-N 2.82Å; L679-V682 CarbonylContact O-C 3.55Å; L679-V682 PolarHBondContact O-N 3.46Å; V682-A685 PolarHBondContact O-N 3.49Å; V682-K686 WeakPolarHBondContact O-CB 3.24Å; V682-K686 PolarHBondContact O-N 3.4Å
683E63.3Low67.8Low86 Ų8691.9 Ų91.940%0.40249%0.491SS..Hα-helixtrans-71.4-34.1179.6-152.969.8-162.200110.9L679 E680 K686 V687L679-E683 VanDerWaalsContact O-CB 3.26Å; L679-E683 WeakPolarHBondContact O-CB 3.1Å; L679-E683 PolarHBondContact O-N 3.46Å; E680-E683 PolarHBondContact O-N 2.9Å; E683-K686 PolarHBondContact O-N 2.72Å; E683-K686 WeakPolarHBondContact OE1-CE 3.17Å; E683-K686 IonicContact OE1-NZ 2.7Å; E683-K686 PolarHBondContact OE1-NZ 3.16Å; E683-K686 WeakPolarHBondContact OE2-CD 3.11Å; E683-K686 IonicContact OE2-NZ 2.65Å; E683-K686 PolarHBondContact OE2-NZ 3Å; E683-V687 WeakPolarHBondContact O-CG2 3.38Å; E683-V687 PolarHBondContact O-N 2.94Å
684K67.9Low67.8Low108 Ų10894.9 Ų94.947%0.4750%0.501SS..Hα-helixtrans-63.7-47.9167.9-73.5160.8-171157.90111.8E680 E681 K686 V687 I688E680-K684 WeakPolarHBondContact O-CB 3.3Å; E680-K684 VanDerWaalsContact O-CD 3.32Å; E680-K684 WeakPolarHBondContact O-CD 3.23Å; E680-K684 WeakPolarHBondContact O-CG 3.48Å; E680-K684 PolarHBondContact O-N 3.25Å; E680-K684 WeakPolarHBondContact OE1-CE 3.5Å; E680-K684 IonicContact OE1-NZ 2.7Å; E680-K684 PolarHBondContact OE1-NZ 2.85Å; E680-K684 IonicContact OE2-NZ 3.16Å; E681-K684 PolarHBondContact O-N 2.8Å; K684-K686 VanDerWaalsContact C-N 3.25Å; K684-K686 PolarHBondContact O-N 3.44Å; K684-V687 PolarHBondContact O-N 2.79Å; K684-I688 WeakPolarHBondContact O-CG1 3.34Å; K684-I688 PolarHBondContact O-N 2.93Å
685A64.6Low67.9Low57 Ų5797.2 Ų97.247%0.47151%0.508SS..Hα-helixtrans-62.6-33.8176.200000112.2E681 V682 I688 A689E681-A685 WeakPolarHBondContact O-CB 3.4Å; E681-A685 PolarHBondContact O-N 3.27Å; V682-A685 PolarHBondContact O-N 3.49Å; A685-I688 PolarHBondContact O-N 3.5Å; A685-A689 WeakPolarHBondContact O-CB 3.34Å; A685-A689 PolarHBondContact O-N 2.96Å
686K63.8Low67.8Low95 Ų9595.2 Ų95.241%0.41350%0.499SS..Hα-helixtrans-74.9-35.2176.6178.9-179167.6-154.40112.6V682 E683 K684 A689 D690V682-K686 WeakPolarHBondContact O-CB 3.24Å; V682-K686 PolarHBondContact O-N 3.4Å; E683-K686 PolarHBondContact O-N 2.72Å; E683-K686 WeakPolarHBondContact OE1-CE 3.17Å; E683-K686 IonicContact OE1-NZ 2.7Å; E683-K686 PolarHBondContact OE1-NZ 3.16Å; E683-K686 WeakPolarHBondContact OE2-CD 3.11Å; E683-K686 IonicContact OE2-NZ 2.65Å; E683-K686 PolarHBondContact OE2-NZ 3Å; K684-K686 VanDerWaalsContact C-N 3.25Å; K684-K686 PolarHBondContact O-N 3.44Å; K686-A689 CarbonylContact O-C 3.49Å; K686-A689 PolarHBondContact O-N 3.42Å; K686-D690 WeakPolarHBondContact O-CB 3.38Å; K686-D690 PolarHBondContact O-N 3.17Å
687V71.5Confident68Low82 Ų8295.2 Ų95.250%0.49750%0.497SS..Hα-helixtrans-63.7-44.5168166.80000110.6E683 K684 A689 D690 E691E683-V687 WeakPolarHBondContact O-CG2 3.38Å; E683-V687 PolarHBondContact O-N 2.94Å; K684-V687 PolarHBondContact O-N 2.79Å; V687-A689 VanDerWaalsContact C-N 3.32Å; V687-A689 PolarHBondContact O-N 3.47Å; V687-D690 PolarHBondContact O-N 2.82Å; V687-E691 PolarHBondContact O-N 3.01Å
688I70.2Confident68.1Low118 Ų11895.3 Ų95.361%0.60549%0.494SS*.Hα-helixtrans-60.9-41.9173.7-66.9165.4000110.7K684 A685 E691 A692K684-I688 WeakPolarHBondContact O-CG1 3.34Å; K684-I688 PolarHBondContact O-N 2.93Å; A685-I688 PolarHBondContact O-N 3.5Å; I688-E691 PolarHBondContact O-N 3.38Å; I688-A692 WeakPolarHBondContact O-CB 3.45Å; I688-A692 PolarHBondContact O-N 2.78Å
689A68.1Low68.3Low50 Ų5093.9 Ų93.941%0.41349%0.486SS..Hα-helixtrans-66.5-38.7175.600000112.6A685 K686 V687 A692 V693A685-A689 WeakPolarHBondContact O-CB 3.34Å; A685-A689 PolarHBondContact O-N 2.96Å; K686-A689 CarbonylContact O-C 3.49Å; K686-A689 PolarHBondContact O-N 3.42Å; V687-A689 VanDerWaalsContact C-N 3.32Å; V687-A689 PolarHBondContact O-N 3.47Å; A689-A692 PolarHBondContact O-N 2.78Å; A689-V693 VanDerWaalsContact O-CB 3.24Å; A689-V693 WeakPolarHBondContact O-CB 3.26Å; A689-V693 WeakPolarHBondContact O-CG2 3.04Å; A689-V693 PolarHBondContact O-N 3.36Å
690D68.6Low68.4Low81 Ų8191.9 Ų91.943%0.43348%0.477SS..Hα-helixtrans-74.1-27.7177.1-93.5-34.3000112.6K686 V687 K694K686-D690 WeakPolarHBondContact O-CB 3.38Å; K686-D690 PolarHBondContact O-N 3.17Å; V687-D690 PolarHBondContact O-N 2.82Å; D690-K694 WeakPolarHBondContact O-CB 3.29Å; D690-K694 WeakPolarHBondContact O-CD 3.32Å; D690-K694 WeakPolarHBondContact O-CG 3.43Å; D690-K694 PolarHBondContact O-N 3.34Å
691E71.6Confident68.7Low121 Ų12193.3 Ų93.357%0.56548%0.481SS*.Hα-helixtrans-70.6-43.3166.6-72.2-157.9133.400111.7V687 I688 V693 K694 L695V687-E691 PolarHBondContact O-N 3.01Å; I688-E691 PolarHBondContact O-N 3.38Å; E691-V693 VanDerWaalsContact C-N 3.31Å; E691-V693 PolarHBondContact O-N 2.9Å; E691-K694 PolarHBondContact O-N 3.38Å; E691-L695 PolarHBondContact O-N 2.94Å
692A65.6Low68.6Low55 Ų5594.1 Ų94.146%0.45548%0.479SS..Hα-helixtrans-60.8-39.9172.200000111.8I688 A689 L695 Q696I688-A692 WeakPolarHBondContact O-CB 3.45Å; I688-A692 PolarHBondContact O-N 2.78Å; A689-A692 PolarHBondContact O-N 2.78Å; A692-L695 PolarHBondContact O-N 2.8Å; A692-Q696 VanDerWaalsContact O-CB 3.31Å; A692-Q696 WeakPolarHBondContact O-CB 3.47Å; A692-Q696 PolarHBondContact O-N 3.44Å
693V72.1Confident68.4Low57 Ų5792.9 Ų92.935%0.34547%0.473SS..Hα-helixtrans-73.4-29.3176.3164.70000112.1A689 E691 K697A689-V693 VanDerWaalsContact O-CB 3.24Å; A689-V693 WeakPolarHBondContact O-CB 3.26Å; A689-V693 WeakPolarHBondContact O-CG2 3.04Å; A689-V693 PolarHBondContact O-N 3.36Å; E691-V693 VanDerWaalsContact C-N 3.31Å; E691-V693 PolarHBondContact O-N 2.9Å; V693-K697 HydrophobicContact CG1-CD 3.82Å; V693-K697 VanDerWaalsContact CG1-CE 3.41Å; V693-K697 HydrophobicContact CG1-CG 4.44Å; V693-K697 VanDerWaalsContact O-CB 3.25Å; V693-K697 WeakPolarHBondContact O-CB 3.18Å; V693-K697 WeakPolarHBondContact O-CD 3.39Å; V693-K697 WeakPolarHBondContact O-CG 3.28Å; V693-K697 PolarHBondContact O-N 2.98Å
694K71.4Confident68.3Low142 Ų14295.2 Ų95.262%0.61748%0.484SS*.Hα-helixtrans-68.1-46.2168.2-80.6165.4-174.9166.20111.2D690 E691 Q696 K697 E698D690-K694 WeakPolarHBondContact O-CB 3.29Å; D690-K694 WeakPolarHBondContact O-CD 3.32Å; D690-K694 WeakPolarHBondContact O-CG 3.43Å; D690-K694 PolarHBondContact O-N 3.34Å; E691-K694 PolarHBondContact O-N 3.38Å; K694-Q696 VanDerWaalsContact C-N 3.35Å; K694-Q696 PolarHBondContact O-N 3.09Å; K694-K697 PolarHBondContact O-N 2.67Å; K694-E698 WeakPolarHBondContact O-CB 3.4Å; K694-E698 PolarHBondContact O-N 2.82Å
695L70.3Confident68.4Low111 Ų11196.1 Ų96.158%0.58149%0.489SS*.Hα-helixtrans-58.7-46.1173.6-86163.4000111.2E691 A692 E698 I699E691-L695 PolarHBondContact O-N 2.94Å; A692-L695 PolarHBondContact O-N 2.8Å; L695-E698 PolarHBondContact O-N 3.47Å; L695-I699 VanDerWaalsContact O-CG1 3.29Å; L695-I699 WeakPolarHBondContact O-CG1 3.37Å; L695-I699 PolarHBondContact O-N 2.6Å
696Q68.1Low69Low94 Ų9499.3 Ų99.344%0.43949%0.493SS..Hα-helixtrans-60.7-46.6174.8-175.658.340.300111.5A692 K694 E698 I699 D700A692-Q696 VanDerWaalsContact O-CB 3.31Å; A692-Q696 WeakPolarHBondContact O-CB 3.47Å; A692-Q696 PolarHBondContact O-N 3.44Å; K694-Q696 VanDerWaalsContact C-N 3.35Å; K694-Q696 PolarHBondContact O-N 3.09Å; Q696-E698 VanDerWaalsContact C-N 3.28Å; Q696-E698 PolarHBondContact O-N 2.91Å; Q696-I699 CarbonylContact O-C 2.89Å; Q696-I699 PolarHBondContact O-N 2.85Å; Q696-D700 PolarHBondContact NE2-OD1 3.3Å; Q696-D700 VanDerWaalsContact NE2-OD1 3.14Å; Q696-D700 PolarHBondContact NE2-OD2 2.83Å; Q696-D700 WeakPolarHBondContact O-CB 3.22Å; Q696-D700 PolarHBondContact O-N 3.49Å
697K69.8Low69.3Low125 Ų12599.7 Ų99.754%0.54350%0.498SS..Hα-helixtrans-65.6-27.5176.5-75.1165.4-178.2164.20113.2V693 K694 K701V693-K697 HydrophobicContact CG1-CD 3.82Å; V693-K697 VanDerWaalsContact CG1-CE 3.41Å; V693-K697 HydrophobicContact CG1-CG 4.44Å; V693-K697 VanDerWaalsContact O-CB 3.25Å; V693-K697 WeakPolarHBondContact O-CB 3.18Å; V693-K697 WeakPolarHBondContact O-CD 3.39Å; V693-K697 WeakPolarHBondContact O-CG 3.28Å; V693-K697 PolarHBondContact O-N 2.98Å; K694-K697 PolarHBondContact O-N 2.67Å; K697-K701 VanDerWaalsContact O-CB 3.25Å; K697-K701 WeakPolarHBondContact O-CB 3.33Å; K697-K701 WeakPolarHBondContact O-CG 3.29Å; K697-K701 PolarHBondContact O-N 3.37Å
698E68.2Low69.2Low93 Ų9398.3 Ų98.344%0.43550%0.496SS..Hα-helixtrans-83-25.1175.6-165.357.7-151.700112.5K694 L695 Q696 R702K694-E698 WeakPolarHBondContact O-CB 3.4Å; K694-E698 PolarHBondContact O-N 2.82Å; L695-E698 PolarHBondContact O-N 3.47Å; Q696-E698 VanDerWaalsContact C-N 3.28Å; Q696-E698 PolarHBondContact O-N 2.91Å; E698-R702 PolarHBondContact O-N 3.4Å; E698-R702 PolarHBondContact O-NE 2.77Å; E698-R702 PolarHBondContact O-NH2 2.74Å
699I72.8Confident69.2Low76 Ų7697.1 Ų97.139%0.3949%0.487SS..Hα-helixtrans-72.3-51.1165.8-69.8162.9000109.1L695 Q696 K701 R702 C703L695-I699 VanDerWaalsContact O-CG1 3.29Å; L695-I699 WeakPolarHBondContact O-CG1 3.37Å; L695-I699 PolarHBondContact O-N 2.6Å; Q696-I699 CarbonylContact O-C 2.89Å; Q696-I699 PolarHBondContact O-N 2.85Å; I699-K701 PolarHBondContact O-N 3.33Å; I699-R702 CarbonylContact O-C 3.05Å; I699-R702 WeakPolarHBondContact O-CA 3.32Å; I699-R702 WeakPolarHBondContact O-CB 3.31Å; I699-R702 PolarHBondContact O-N 3.42Å; I699-C703 PolarHBondContact O-N 2.7Å; I699-C703 PolarHBondContact O-SG 3.01Å; I699-C703 VanDerWaalsContact O-SG 3.36Å
700D68.1Low69.2Low64 Ų6499.9 Ų99.934%0.34249%0.493SS..Hα-helixtrans-65-34.4-179.5-73.5-31.8000112.7Q696 C703 Q704Q696-D700 PolarHBondContact NE2-OD1 3.3Å; Q696-D700 VanDerWaalsContact NE2-OD1 3.14Å; Q696-D700 PolarHBondContact NE2-OD2 2.83Å; Q696-D700 WeakPolarHBondContact O-CB 3.22Å; Q696-D700 PolarHBondContact O-N 3.49Å; D700-C703 PolarHBondContact O-N 2.74Å; D700-Q704 VanDerWaalsContact O-CB 3.26Å; D700-Q704 WeakPolarHBondContact O-CB 3.44Å; D700-Q704 VanDerWaalsContact O-CG 3.26Å; D700-Q704 WeakPolarHBondContact O-CG 3.43Å; D700-Q704 PolarHBondContact O-N 3.36Å
701K73.3Confident69.2Low131 Ų13199.4 Ų99.457%0.5749%0.493SS*.Hα-helixtrans-62.3-40.9168.4-84.7175.9179.3179.10112.2K697 I699 H705K697-K701 VanDerWaalsContact O-CB 3.25Å; K697-K701 WeakPolarHBondContact O-CB 3.33Å; K697-K701 WeakPolarHBondContact O-CG 3.29Å; K697-K701 PolarHBondContact O-N 3.37Å; I699-K701 PolarHBondContact O-N 3.33Å; K701-H705 WeakPolarHBondContact O-CB 3.21Å; K701-H705 PolarHBondContact O-N 2.86Å
702R66.4Low69Low146 Ų14696.6 Ų96.655%0.55149%0.491SS*.Hα-helixtrans-68.3-39.1175.2-81.4176.6-73.4-174.1-1.4111.5E698 I699 H705 K706E698-R702 PolarHBondContact O-N 3.4Å; E698-R702 PolarHBondContact O-NE 2.77Å; E698-R702 PolarHBondContact O-NH2 2.74Å; I699-R702 CarbonylContact O-C 3.05Å; I699-R702 WeakPolarHBondContact O-CA 3.32Å; I699-R702 WeakPolarHBondContact O-CB 3.31Å; I699-R702 PolarHBondContact O-N 3.42Å; R702-H705 PolarHBondContact O-N 3.38Å; R702-K706 WeakPolarHBondContact O-CB 3.25Å; R702-K706 PolarHBondContact O-N 2.84Å
703C60.7Low69.7Low59 Ų5998.7 Ų98.740%0.39949%0.494SS..Hα-helixtrans-63.3-47.5172.4-66.30000111.6I699 D700 H705 K706 I707I699-C703 PolarHBondContact O-N 2.7Å; I699-C703 PolarHBondContact O-SG 3.01Å; I699-C703 VanDerWaalsContact O-SG 3.36Å; D700-C703 PolarHBondContact O-N 2.74Å; C703-H705 VanDerWaalsContact C-N 3.35Å; C703-H705 PolarHBondContact O-N 3.43Å; C703-K706 PolarHBondContact O-N 2.84Å; C703-I707 WeakPolarHBondContact O-CB 3.4Å; C703-I707 WeakPolarHBondContact O-CD1 3.24Å; C703-I707 WeakPolarHBondContact O-CG1 3.18Å; C703-I707 PolarHBondContact O-N 2.85Å
704Q61.2Low69Low134 Ų134101.9 Ų101.963%0.62651%0.506SS*.Hα-helixtrans-64.2-37176-75.3179.11.900112.3D700 I707 A708D700-Q704 VanDerWaalsContact O-CB 3.26Å; D700-Q704 WeakPolarHBondContact O-CB 3.44Å; D700-Q704 VanDerWaalsContact O-CG 3.26Å; D700-Q704 WeakPolarHBondContact O-CG 3.43Å; D700-Q704 PolarHBondContact O-N 3.36Å; Q704-I707 PolarHBondContact O-N 2.74Å; Q704-A708 VanDerWaalsContact O-CB 3.25Å; Q704-A708 WeakPolarHBondContact O-CB 3.25Å; Q704-A708 PolarHBondContact O-N 2.93Å
705H70.1Confident68.9Low127 Ų127100.2 Ų100.259%0.58850%0.501SS*.Hα-helixtrans-66.7-42.9173.3-165.959.6000111K701 R702 C703 I707 A708 E709K701-H705 WeakPolarHBondContact O-CB 3.21Å; K701-H705 PolarHBondContact O-N 2.86Å; R702-H705 PolarHBondContact O-N 3.38Å; C703-H705 VanDerWaalsContact C-N 3.35Å; C703-H705 PolarHBondContact O-N 3.43Å; H705-I707 VanDerWaalsContact C-N 3.35Å; H705-I707 PolarHBondContact O-N 3.22Å; H705-A708 PolarHBondContact O-N 2.87Å; H705-E709 WeakPolarHBondContact O-CG 3.45Å; H705-E709 PolarHBondContact O-N 3.46Å
706K76.4Confident68.9Low125 Ų125102.1 Ų102.154%0.54350%0.504SS..Hα-helixtrans-62.8-39.9174.4-151.576.2-157.1148.90112.5R702 C703 E709 M710R702-K706 WeakPolarHBondContact O-CB 3.25Å; R702-K706 PolarHBondContact O-N 2.84Å; C703-K706 PolarHBondContact O-N 2.84Å; K706-E709 WeakPolarHBondContact CE-OE2 3.44Å; K706-E709 IonicContact NZ-OE2 3.23Å; K706-E709 PolarHBondContact NZ-OE2 2.76Å; K706-M710 WeakPolarHBondContact O-CB 3.22Å; K706-M710 WeakPolarHBondContact O-CG 3.34Å; K706-M710 PolarHBondContact O-N 3.45Å
707I70.6Confident69.1Low102 Ų102101.8 Ų101.852%0.52350%0.502SS..Hα-helixtrans-68-40174.5-69.9162.8000110.1C703 Q704 H705 M710 V711C703-I707 WeakPolarHBondContact O-CB 3.4Å; C703-I707 WeakPolarHBondContact O-CD1 3.24Å; C703-I707 WeakPolarHBondContact O-CG1 3.18Å; C703-I707 PolarHBondContact O-N 2.85Å; Q704-I707 PolarHBondContact O-N 2.74Å; H705-I707 VanDerWaalsContact C-N 3.35Å; H705-I707 PolarHBondContact O-N 3.22Å; I707-M710 CarbonylContact O-C 3.42Å; I707-M710 PolarHBondContact O-N 2.86Å; I707-V711 HydrophobicContact CG2-CG2 4.17Å; I707-V711 WeakPolarHBondContact O-CB 3.26Å; I707-V711 VanDerWaalsContact O-CG2 3.23Å; I707-V711 WeakPolarHBondContact O-CG2 3.38Å; I707-V711 PolarHBondContact O-N 2.85Å
708A70.1Confident68.8Low54 Ų54101 Ų10145%0.44650%0.499SS..Hα-helixtrans-67.2-39.117600000112.5Q704 H705 V711 A712Q704-A708 VanDerWaalsContact O-CB 3.25Å; Q704-A708 WeakPolarHBondContact O-CB 3.25Å; Q704-A708 PolarHBondContact O-N 2.93Å; H705-A708 PolarHBondContact O-N 2.87Å; A708-V711 PolarHBondContact O-N 3.44Å; A708-A712 VanDerWaalsContact O-CB 3.3Å; A708-A712 WeakPolarHBondContact O-CB 3.2Å; A708-A712 PolarHBondContact O-N 3.33Å
709E69.7Low68.9Low92 Ų92102.6 Ų102.643%0.4351%0.506SS..Hα-helixtrans-59.9-47.8169.2-73.4-176.6137.800111.1H705 K706 A712 L713H705-E709 WeakPolarHBondContact O-CG 3.45Å; H705-E709 PolarHBondContact O-N 3.46Å; K706-E709 WeakPolarHBondContact CE-OE2 3.44Å; K706-E709 IonicContact NZ-OE2 3.23Å; K706-E709 PolarHBondContact NZ-OE2 2.76Å; E709-A712 PolarHBondContact O-N 3.25Å; E709-L713 WeakPolarHBondContact O-CB 3.26Å; E709-L713 PolarHBondContact O-N 3.34Å
710M68.1Low68.7Low108 Ų108104.8 Ų104.853%0.53252%0.515SS..Hα-helixtrans-64.6-40.2177.8-77.7-173.266.400112.4K706 I707 L713 M714K706-M710 WeakPolarHBondContact O-CB 3.22Å; K706-M710 WeakPolarHBondContact O-CG 3.34Å; K706-M710 PolarHBondContact O-N 3.45Å; I707-M710 CarbonylContact O-C 3.42Å; I707-M710 PolarHBondContact O-N 2.86Å; M710-L713 PolarHBondContact O-N 2.85Å; M710-M714 WeakPolarHBondContact O-CB 3.36Å; M710-M714 WeakPolarHBondContact O-CG 3.25Å; M710-M714 PolarHBondContact O-N 2.81Å
711V69.5Low68.2Low72 Ų72108.8 Ų108.844%0.43653%0.526SS..Hα-helixtrans-66.1-48.7176.51670000110I707 A708 L713 M714 E715I707-V711 HydrophobicContact CG2-CG2 4.17Å; I707-V711 WeakPolarHBondContact O-CB 3.26Å; I707-V711 VanDerWaalsContact O-CG2 3.23Å; I707-V711 WeakPolarHBondContact O-CG2 3.38Å; I707-V711 PolarHBondContact O-N 2.85Å; A708-V711 PolarHBondContact O-N 3.44Å; V711-L713 VanDerWaalsContact C-N 3.27Å; V711-L713 PolarHBondContact O-N 2.86Å; V711-M714 PolarHBondContact O-N 2.77Å; V711-E715 WeakPolarHBondContact O-CB 3.37Å; V711-E715 PolarHBondContact O-N 3.2Å
712A67.6Low67.9Low62 Ų62105.4 Ų105.451%0.51252%0.515SS..Hα-helixtrans-60.3-36.1177.200000112.6A708 E709 K716A708-A712 VanDerWaalsContact O-CB 3.3Å; A708-A712 WeakPolarHBondContact O-CB 3.2Å; A708-A712 PolarHBondContact O-N 3.33Å; E709-A712 PolarHBondContact O-N 3.25Å; A712-K716 VanDerWaalsContact O-CB 3.28Å; A712-K716 WeakPolarHBondContact O-CB 3.45Å; A712-K716 PolarHBondContact O-N 3.21Å; A712-K716 VanDerWaalsContact O-N 3.13Å
713L80.1Confident68.1Low99 Ų99104.4 Ų104.452%0.51851%0.514SS..Hα-helixtrans-72.6-45.8174.7-174.964.4000112.3E709 M710 V711 E715 K716 H717E709-L713 WeakPolarHBondContact O-CB 3.26Å; E709-L713 PolarHBondContact O-N 3.34Å; M710-L713 PolarHBondContact O-N 2.85Å; V711-L713 VanDerWaalsContact C-N 3.27Å; V711-L713 PolarHBondContact O-N 2.86Å; L713-E715 VanDerWaalsContact C-N 3.33Å; L713-E715 PolarHBondContact O-N 3.27Å; L713-K716 PolarHBondContact O-N 3.42Å; L713-H717 PolarHBondContact O-CD2 3.49Å; L713-H717 PolarHBondContact O-N 2.86Å
714M56.2Low68.2Low123 Ų123105.8 Ų105.861%0.60652%0.516SS*.Hα-helixtrans-65.2-35.3177.4-78177.861.200111.9M710 V711 H717 K718M710-M714 WeakPolarHBondContact O-CB 3.36Å; M710-M714 WeakPolarHBondContact O-CG 3.25Å; M710-M714 PolarHBondContact O-N 2.81Å; V711-M714 PolarHBondContact O-N 2.77Å; M714-H717 CarbonylContact O-C 3.03Å; M714-H717 PolarHBondContact O-N 2.99Å; M714-K718 WeakPolarHBondContact O-CA 3.23Å; M714-K718 WeakPolarHBondContact O-CB 3.43Å; M714-K718 PolarHBondContact O-N 3.39Å
715E69.2Low68.4Low108 Ų108103.6 Ų103.651%0.50551%0.508SS..Hα-helixtrans-73.8-35.8178.2-169.7157.2-119.500110.9V711 L713 K718 H719V711-E715 WeakPolarHBondContact O-CB 3.37Å; V711-E715 PolarHBondContact O-N 3.2Å; L713-E715 VanDerWaalsContact C-N 3.33Å; L713-E715 PolarHBondContact O-N 3.27Å; E715-K718 PolarHBondContact O-N 2.88Å; E715-H719 PolarHBondContact O-N 3.43Å; E715-H719 PolarHBondContact O-ND1 2.75Å
716K71.1Confident68.1Low150 Ų150104.4 Ų104.465%0.65251%0.512SS*.Hα-helixtrans-64.2-37.3168.8-171.3176.4-175.7179.20112.5A712 L713A712-K716 VanDerWaalsContact O-CB 3.28Å; A712-K716 WeakPolarHBondContact O-CB 3.45Å; A712-K716 PolarHBondContact O-N 3.21Å; A712-K716 VanDerWaalsContact O-N 3.13Å; L713-K716 PolarHBondContact O-N 3.42Å
717H71.1Confident67.2Low87 Ų87103.7 Ų103.740%0.40351%0.511SS..Hα-helixtrans-75.8-35172.4-75-151.6000111.8L713 M714 Q720 Y721L713-H717 PolarHBondContact O-CD2 3.49Å; L713-H717 PolarHBondContact O-N 2.86Å; M714-H717 CarbonylContact O-C 3.03Å; M714-H717 PolarHBondContact O-N 2.99Å; H717-Q720 WeakPolarHBondContact O-CA 3.28Å; H717-Q720 WeakPolarHBondContact O-CB 3.3Å; H717-Q720 PolarHBondContact O-N 2.82Å; H717-Y721 HydrophobicContact CB-CE2 4.35Å; H717-Y721 WeakPolarHBondContact O-CD2 3.09Å; H717-Y721 PolarHBondContact O-N 2.69Å
718K65.4Low66.7Low108 Ų108106.4 Ų106.447%0.4752%0.515SS..Hα-helixtrans-66.2-40.2178.1-166.6-168.5179.1-60.30111M714 E715 Q720 Y721 D722M714-K718 WeakPolarHBondContact O-CA 3.23Å; M714-K718 WeakPolarHBondContact O-CB 3.43Å; M714-K718 PolarHBondContact O-N 3.39Å; E715-K718 PolarHBondContact O-N 2.88Å; K718-Q720 PolarHBondContact O-N 3.36Å; K718-Q720 VanDerWaalsContact O-N 3.17Å; K718-Y721 CarbonylContact O-C 3.58Å; K718-Y721 PolarHBondContact O-N 3.24Å; K718-D722 IonicContact NZ-OD1 2.75Å; K718-D722 PolarHBondContact NZ-OD1 3.21Å; K718-D722 IonicContact NZ-OD2 3.38Å; K718-D722 PolarHBondContact NZ-OD2 3.47Å; K718-D722 WeakPolarHBondContact O-CB 3.33Å; K718-D722 VanDerWaalsContact O-CG 3.24Å; K718-D722 PolarHBondContact O-N 3.14Å
719H68.6Low65.6Low127 Ų127108.8 Ų108.859%0.58852%0.52SS*.Hα-helixtrans-61.7-22171.5-77.881.7000113.3E715 K723E715-H719 PolarHBondContact O-N 3.43Å; E715-H719 PolarHBondContact O-ND1 2.75Å; H719-K723 WeakPolarHBondContact O-CB 3.21Å
720Q69.1Low65Low123 Ų123108.6 Ų108.658%0.57553%0.528SS*.Hα-helixtrans-81.5-39.3169.7-64.2-178.3-29.600111.8H717 K718 I724H717-Q720 WeakPolarHBondContact O-CA 3.28Å; H717-Q720 WeakPolarHBondContact O-CB 3.3Å; H717-Q720 PolarHBondContact O-N 2.82Å; K718-Q720 PolarHBondContact O-N 3.36Å; K718-Q720 VanDerWaalsContact O-N 3.17Å; Q720-I724 WeakPolarHBondContact O-CD1 3.22Å; Q720-I724 VanDerWaalsContact O-CG1 3.3Å; Q720-I724 WeakPolarHBondContact O-CG1 3.45Å; Q720-I724 PolarHBondContact O-N 2.82Å
721Y56.9Low64.4Low147 Ų147108.8 Ų108.858%0.57653%0.528SS*.Hα-helixtrans-69.2-42.4175.1-72.1-60.5000113.4H717 K718 K723 I724 I725H717-Y721 HydrophobicContact CB-CE2 4.35Å; H717-Y721 WeakPolarHBondContact O-CD2 3.09Å; H717-Y721 PolarHBondContact O-N 2.69Å; K718-Y721 CarbonylContact O-C 3.58Å; K718-Y721 PolarHBondContact O-N 3.24Å; Y721-K723 VanDerWaalsContact C-N 3.26Å; Y721-K723 PolarHBondContact O-N 2.87Å; Y721-I724 CarbonylContact O-C 2.84Å; Y721-I724 PolarHBondContact O-N 3.46Å; Y721-I724 VanDerWaalsContact O-N 3.11Å; Y721-I725 WeakPolarHBondContact O-CB 3.19Å; Y721-I725 VanDerWaalsContact O-CG1 3.22Å; Y721-I725 WeakPolarHBondContact O-CG1 3.17Å; Y721-I725 PolarHBondContact O-N 2.74Å
722D67.3Low63.6Low61 Ų61110 Ų11033%0.32653%0.532SS..Hα-helixtrans-59-40.5175.7-67.8-21000110.1K718 I725 E726K718-D722 IonicContact NZ-OD1 2.75Å; K718-D722 PolarHBondContact NZ-OD1 3.21Å; K718-D722 IonicContact NZ-OD2 3.38Å; K718-D722 PolarHBondContact NZ-OD2 3.47Å; K718-D722 WeakPolarHBondContact O-CB 3.33Å; K718-D722 VanDerWaalsContact O-CG 3.24Å; K718-D722 PolarHBondContact O-N 3.14Å; D722-I725 PolarHBondContact O-N 2.79Å; D722-E726 WeakPolarHBondContact O-CB 3.33Å; D722-E726 PolarHBondContact O-N 2.84Å
723K70.9Confident62.7Low125 Ų125108.8 Ų108.854%0.54353%0.525SS..Hα-helixtrans-63.7-43.5172.9-175.2176.8179-178.60112.8H719 Y721 I725 E726 E727H719-K723 WeakPolarHBondContact O-CB 3.21Å; Y721-K723 VanDerWaalsContact C-N 3.26Å; Y721-K723 PolarHBondContact O-N 2.87Å; K723-I725 VanDerWaalsContact C-N 3.28Å; K723-I725 PolarHBondContact O-N 3.47Å; K723-E726 PolarHBondContact O-N 3.44Å; K723-E727 WeakPolarHBondContact O-CG 3.36Å; K723-E727 PolarHBondContact O-N 2.79Å
724I62.3Low61.4Low87 Ų87110.2 Ų110.245%0.44653%0.532SS..Hα-helixtrans-67-31.1175.4-68.7164.1000111.2Q720 Y721 R728Q720-I724 WeakPolarHBondContact O-CD1 3.22Å; Q720-I724 VanDerWaalsContact O-CG1 3.3Å; Q720-I724 WeakPolarHBondContact O-CG1 3.45Å; Q720-I724 PolarHBondContact O-N 2.82Å; Y721-I724 CarbonylContact O-C 2.84Å; Y721-I724 PolarHBondContact O-N 3.46Å; Y721-I724 VanDerWaalsContact O-N 3.11Å; I724-R728 WeakPolarHBondContact O-CB 3.48Å; I724-R728 VanDerWaalsContact O-CG 3.3Å; I724-R728 WeakPolarHBondContact O-CG 3.43Å; I724-R728 PolarHBondContact O-N 3.49Å
725I65.4Low61Low88 Ų88113.2 Ų113.245%0.45154%0.538SS..Hα-helixtrans-74.3-39.9176.8-71164.3000110.5Y721 D722 K723 E727 R728 D729Y721-I725 WeakPolarHBondContact O-CB 3.19Å; Y721-I725 VanDerWaalsContact O-CG1 3.22Å; Y721-I725 WeakPolarHBondContact O-CG1 3.17Å; Y721-I725 PolarHBondContact O-N 2.74Å; D722-I725 PolarHBondContact O-N 2.79Å; K723-I725 VanDerWaalsContact C-N 3.28Å; K723-I725 PolarHBondContact O-N 3.47Å; I725-E727 VanDerWaalsContact C-N 3.31Å; I725-E727 PolarHBondContact O-N 2.94Å; I725-R728 CarbonylContact O-C 3.25Å; I725-R728 WeakPolarHBondContact O-CA 3.39Å; I725-R728 PolarHBondContact O-N 2.87Å; I725-D729 PolarHBondContact O-N 2.97Å
726E65.1Low60Low144 Ų144115.8 Ų115.867%0.67355%0.548SS*.Hα-helixtrans-62.7-37.5173.1-167.4168.5-138.800111.7D722 K723 S730D722-E726 WeakPolarHBondContact O-CB 3.33Å; D722-E726 PolarHBondContact O-N 2.84Å; K723-E726 PolarHBondContact O-N 3.44Å; E726-S730 PolarHBondContact O-N 3.38Å; E726-S730 PolarHBondContact O-OG 2.81Å
727E57.8Low59.3Low111 Ų111112.5 Ų112.552%0.51954%0.544SS..Hα-helixtrans-65.6-37168.3-71.7170.9-173.200112.2K723 I725 S730 E731K723-E727 WeakPolarHBondContact O-CG 3.36Å; K723-E727 PolarHBondContact O-N 2.79Å; I725-E727 VanDerWaalsContact C-N 3.31Å; I725-E727 PolarHBondContact O-N 2.94Å; E727-S730 WeakPolarHBondContact O-CB 3.49Å; E727-E731 PolarHBondContact O-N 3.3Å
728R60.3Low58.2Low159 Ų159116.1 Ų116.160%0.656%0.558SS**Hα-helixtrans-80.6-31.1179.7-78.2-65.3-177.291.4-0.7115.6I724 I725 S730 E731 L732I724-R728 WeakPolarHBondContact O-CB 3.48Å; I724-R728 VanDerWaalsContact O-CG 3.3Å; I724-R728 WeakPolarHBondContact O-CG 3.43Å; I724-R728 PolarHBondContact O-N 3.49Å; I725-R728 CarbonylContact O-C 3.25Å; I725-R728 WeakPolarHBondContact O-CA 3.39Å; I725-R728 PolarHBondContact O-N 2.87Å; R728-S730 PolarHBondContact O-N 3.47Å; R728-E731 WeakPolarHBondContact CD-OE2 3.47Å; R728-E731 IonicContact NE-OE2 3.13Å; R728-E731 PolarHBondContact NE-OE2 2.98Å; R728-E731 PolarHBondContact O-N 3.37Å; R728-L732 WeakPolarHBondContact O-CB 3.3Å; R728-L732 PolarHBondContact O-N 3.45Å
729D45.5Very low57.1Low104 Ų104118 Ų11856%0.55657%0.569SS**Hα-helixtrans-66.8-31.2171-84.5-37.4000110.5I725 L732 G733I725-D729 PolarHBondContact O-N 2.97Å; D729-L732 PolarHBondContact O-N 3.13Å; D729-G733 PolarHBondContact O-N 3.36Å
730S57.5Low56Low87 Ų87117.5 Ų117.561%0.60857%0.567SS**Hα-helixtrans-63.6-38.5170-58.30000112.4E726 E727 R728E726-S730 PolarHBondContact O-N 3.38Å; E726-S730 PolarHBondContact O-OG 2.81Å; E727-S730 WeakPolarHBondContact O-CB 3.49Å; R728-S730 PolarHBondContact O-N 3.47Å
731E56.6Low55Low113 Ų113118.4 Ų118.453%0.52857%0.571SS.*Hα-helixtrans-74-41.8172.5-67.8-167.3132.700112.9E727 R728 G733 L734E727-E731 PolarHBondContact O-N 3.3Å; R728-E731 WeakPolarHBondContact CD-OE2 3.47Å; R728-E731 IonicContact NE-OE2 3.13Å; R728-E731 PolarHBondContact NE-OE2 2.98Å; R728-E731 PolarHBondContact O-N 3.37Å; E731-G733 VanDerWaalsContact C-N 3.26Å; E731-G733 PolarHBondContact O-N 3.48Å; E731-L734 WeakPolarHBondContact O-CB 3.22Å; E731-L734 PolarHBondContact O-N 3.28Å
732L52.3Low54.3Low97 Ų97117.8 Ų117.851%0.50857%0.573SS.*Hα-helixtrans-68.9-26-177.9-149.787.8000112.3R728 D729 L734 Y735 K736R728-L732 WeakPolarHBondContact O-CB 3.3Å; R728-L732 PolarHBondContact O-N 3.45Å; D729-L732 PolarHBondContact O-N 3.13Å; L732-L734 PolarHBondContact O-N 3.23Å; L732-Y735 PolarHBondContact O-N 2.73Å; L732-Y735 VanDerWaalsContact O-N 3.11Å; L732-K736 PolarHBondContact O-N 2.69Å
733G48.9Very low53.3Low36 Ų36118.4 Ų118.437%0.37158%0.582SS.*Hα-helixtrans-58-31169.100000113.7D729 E731 S737D729-G733 PolarHBondContact O-N 3.36Å; E731-G733 VanDerWaalsContact C-N 3.26Å; E731-G733 PolarHBondContact O-N 3.48Å; G733-S737 PolarHBondContact O-OG 2.77Å
734L52.5Low52.2Low129 Ų129113.4 Ų113.468%0.67556%0.563SS**Hα-helixtrans-75.1-35.8173.1-70.1165.7000112E731 L732 S737E731-L734 WeakPolarHBondContact O-CB 3.22Å; E731-L734 PolarHBondContact O-N 3.28Å; L732-L734 PolarHBondContact O-N 3.23Å; L734-S737 PolarHBondContact O-N 2.73Å
735Y46.4Very low51.6Low186 Ų186111.6 Ų111.673%0.72955%0.554SS**Hα-helixtrans-67-41176-96.6-87.2000112.9L732 S737 K738L732-Y735 PolarHBondContact O-N 2.73Å; L732-Y735 VanDerWaalsContact O-N 3.11Å; Y735-S737 PolarHBondContact O-N 3.31Å; Y735-K738 PolarHBondContact O-N 3.37Å
736K48.4Very low50.2Low162 Ų162116 Ų11670%0.70457%0.565SS**THydrogen-bonded Turntrans-54.4-23.6171.8-85.8179.6175.8168.60113.7L732L732-K736 PolarHBondContact O-N 2.69Å
737S56.2Low48.8Very low81 Ų81112.2 Ų112.257%0.56656%0.559SS**THydrogen-bonded Turntrans-89.2-16.3-176.7-57.70000114.7G733 L734 Y735G733-S737 PolarHBondContact O-OG 2.77Å; L734-S737 PolarHBondContact O-N 2.73Å; Y735-S737 PolarHBondContact O-N 3.31Å
738K50Low48.5Very low163 Ų163110.8 Ų110.871%0.70956%0.561SS**THydrogen-bonded Turntrans-98.9-38.4-175.4-99-178.2175.8176.40114.6Y735 Q740 E741 Q742Y735-K738 PolarHBondContact O-N 3.37Å; K738-Q740 VanDerWaalsContact C-N 3.32Å; K738-Q740 PolarHBondContact O-N 3.02Å; K738-E741 PolarHBondContact O-N 2.82Å; K738-E741 VanDerWaalsContact O-N 3.16Å; K738-Q742 PolarHBondContact O-N 2.65Å
739E41.6Very low47.5Very low147 Ų147108.2 Ų108.269%0.68756%0.559SS**Hα-helixtrans-74-26.2-175.5-169.2163.2-15900112.8E741 Q742 S743E739-E741 PolarHBondContact O-N 3.03Å; E739-Q742 PolarHBondContact O-N 2.7Å; E739-S743 WeakPolarHBondContact O-CB 3.39Å; E739-S743 PolarHBondContact O-N 2.92Å; E739-S743 PolarHBondContact O-OG 2.94Å
740Q46Very low47.3Very low117 Ų117106.4 Ų106.455%0.54755%0.547SS..Hα-helixtrans-70.2-10171.7-164.7161.7-21.800113.1K738 S744K738-Q740 VanDerWaalsContact C-N 3.32Å; K738-Q740 PolarHBondContact O-N 3.02Å; Q740-S744 WeakPolarHBondContact O-CB 3.43Å; Q740-S744 PolarHBondContact O-OG 3.07Å
741E47.5Very low46.2Very low142 Ų142109.9 Ų109.966%0.66455%0.551SS**Hα-helixtrans-99.6-26.8167.1-67.4-165.4144.200113.4K738 E739 S744 L745K738-E741 PolarHBondContact O-N 2.82Å; K738-E741 VanDerWaalsContact O-N 3.16Å; E739-E741 PolarHBondContact O-N 3.03Å; E741-S744 WeakPolarHBondContact CA-OG 3.3Å; E741-S744 CarbonylContact O-C 3.6Å; E741-S744 PolarHBondContact O-OG 3.17Å; E741-L745 PolarHBondContact O-N 2.72Å
742Q41.7Very low45.3Very low134 Ų134109.8 Ų109.863%0.62655%0.553SS**Hα-helixtrans-83.4-39.6177.1-86.8-74.6-1000114.3K738 E739 S744 L745K738-Q742 PolarHBondContact O-N 2.65Å; E739-Q742 PolarHBondContact O-N 2.7Å; Q742-S744 VanDerWaalsContact C-N 3.25Å; Q742-L745 WeakPolarHBondContact O-CA 3.38Å; Q742-L745 VanDerWaalsContact O-CB 3.3Å; Q742-L745 WeakPolarHBondContact O-CB 3.48Å; Q742-L745 PolarHBondContact O-N 3.07Å
743S45.8Very low44.6Very low74 Ų74111.2 Ų111.252%0.51756%0.556SS.*G310 helixtrans-72.9-26.2168.860.50000111.2E739 L745 R746E739-S743 WeakPolarHBondContact O-CB 3.39Å; E739-S743 PolarHBondContact O-N 2.92Å; E739-S743 PolarHBondContact O-OG 2.94Å; S743-L745 PolarHBondContact O-N 3.42Å; S743-R746 WeakPolarHBondContact O-CA 3.48Å; S743-R746 WeakPolarHBondContact O-CB 3.38Å; S743-R746 PolarHBondContact O-N 3.46Å
744S48.3Very low44Very low20 Ų20118 Ų11814%0.1457%0.57CS.*G310 helixtrans-82.432.4158.197.50000112.6Q740 E741 Q742 L763 K764 E765Q740-S744 WeakPolarHBondContact O-CB 3.43Å; Q740-S744 PolarHBondContact O-OG 3.07Å; E741-S744 WeakPolarHBondContact CA-OG 3.3Å; E741-S744 CarbonylContact O-C 3.6Å; E741-S744 PolarHBondContact O-OG 3.17Å; Q742-S744 VanDerWaalsContact C-N 3.25Å; S744-L763 CarbonylContact O-C 3.02Å; S744-L763 VanDerWaalsContact O-C 3.25Å; S744-L763 WeakPolarHBondContact O-CA 3.12Å; S744-L763 WeakPolarHBondContact O-CG 3.17Å; S744-K764 VanDerWaalsContact CB-N 3.29Å; S744-K764 PolarHBondContact O-N 3.06Å; S744-K764 VanDerWaalsContact OG-C 3.32Å; S744-E765 PolarHBondContact OG-N 2.76Å
745L50.2Low42.9Very low50 Ų50120.2 Ų120.226%0.26258%0.577SS.*G310 helixtrans-114.930.1144.8-81.3153.7000110.6E741 Q742 S743 L749 T762 L763E741-L745 PolarHBondContact O-N 2.72Å; Q742-L745 WeakPolarHBondContact O-CA 3.38Å; Q742-L745 VanDerWaalsContact O-CB 3.3Å; Q742-L745 WeakPolarHBondContact O-CB 3.48Å; Q742-L745 PolarHBondContact O-N 3.07Å; S743-L745 PolarHBondContact O-N 3.42Å; L745-L749 HydrophobicContact CD2-CB 3.45Å; L745-L749 VanDerWaalsContact CD2-CB 3.45Å; L745-L749 HydrophobicContact CD2-CD1 3.75Å; L745-L749 HydrophobicContact CD2-CD2 4.01Å; L745-L749 HydrophobicContact CD2-CG 3.92Å; L745-T762 CarbonylContact C-O 3.56Å; L745-L763 HydrophobicContact CD2-CB 4.1Å; L745-L763 HydrophobicContact CD2-CD1 3.66Å; L745-L763 HydrophobicContact CD2-CG 4.38Å; L745-L763 HydrophobicContact CG-CD1 4.3Å
746R36.4Very low42.3Very low179 Ų179113.8 Ų113.868%0.67556%0.562SS**SBendtrans-122.48.1165.8-65.9-171.5157.1154.8-6.5118S743 E750 T762 L763S743-R746 WeakPolarHBondContact O-CA 3.48Å; S743-R746 WeakPolarHBondContact O-CB 3.38Å; S743-R746 PolarHBondContact O-N 3.46Å; R746-E750 HydrophobicContact CG-CB 4.22Å; R746-E750 HydrophobicContact CG-CG 4.19Å; R746-E750 IonicContact CZ-OE2 2.85Å; R746-E750 IonicContact NE-OE2 2.69Å; R746-E750 PolarHBondContact NE-OE2 3.11Å; R746-E750 VanDerWaalsContact NE-OE2 3.13Å; R746-E750 IonicContact NH2-OE2 3.63Å; R746-E750 PolarHBondContact NH2-OE2 3.38Å; R746-T762 CarbonylContact C-O 3.58Å; R746-T762 VanDerWaalsContact CA-C 3.48Å; R746-T762 WeakPolarHBondContact CA-O 3.12Å; R746-T762 PolarHBondContact N-O 3.46Å; R746-T762 PolarHBondContact O-OG1 3.26Å; R746-L763 VanDerWaalsContact N-N 3.2Å
747A34.8Very low41.9Very low65 Ų65116.2 Ų116.254%0.53757%0.573SS.*SBendtrans-111.9-17.1166.700000127.3T762 L763A747-T762 VanDerWaalsContact CA-CB 3.41Å; A747-T762 PolarHBondContact N-O 3.18Å; A747-T762 WeakPolarHBondContact O-CB 3.14Å; A747-T762 WeakPolarHBondContact O-CG2 3.42Å; A747-L763 VanDerWaalsContact C-N 3.27Å; A747-L763 CarbonylContact C-O 3.53Å; A747-L763 VanDerWaalsContact CA-N 3.29Å; A747-L763 WeakPolarHBondContact CA-O 3.01Å; A747-L763 WeakPolarHBondContact CB-O 3.33Å
748S50.9Low41.3Very low81 Ų81118.3 Ų118.357%0.56657%0.573SS**SBendtrans-132.2-8.4151.7-41.80000125.1T762 L763S748-T762 PolarHBondContact O-N 2.83Å; S748-L763 VanDerWaalsContact N-C 3.29Å; S748-L763 PolarHBondContact N-O 3.11Å
749L39.5Very low40.5Very low106 Ų106116 Ų11656%0.55557%0.569SS**SBendtrans-97.8-22.9158.9-162.1137.5000127L745 A761 T762 L763L745-L749 HydrophobicContact CD2-CB 3.45Å; L745-L749 VanDerWaalsContact CD2-CB 3.45Å; L745-L749 HydrophobicContact CD2-CD1 3.75Å; L745-L749 HydrophobicContact CD2-CD2 4.01Å; L745-L749 HydrophobicContact CD2-CG 3.92Å; L749-A761 VanDerWaalsContact C-CB 3.4Å; L749-A761 WeakPolarHBondContact O-CA 3.35Å; L749-A761 WeakPolarHBondContact O-CB 2.82Å; L749-A761 PolarHBondContact O-N 3.23Å; L749-T762 CarbonylContact C-O 3.59Å; L749-T762 VanDerWaalsContact CA-C 3.49Å; L749-T762 PolarHBondContact N-O 3.48Å; L749-L763 HydrophobicContact CB-CB 4.14Å
750E42.8Very low40.2Very low66 Ų66112.4 Ų112.431%0.30856%0.557SS.*SBendtrans-118.5113.6170.6169109.8-69.900116.5R746 T760 A761 T762R746-E750 HydrophobicContact CG-CB 4.22Å; R746-E750 HydrophobicContact CG-CG 4.19Å; R746-E750 IonicContact CZ-OE2 2.85Å; R746-E750 IonicContact NE-OE2 2.69Å; R746-E750 PolarHBondContact NE-OE2 3.11Å; R746-E750 VanDerWaalsContact NE-OE2 3.13Å; R746-E750 IonicContact NH2-OE2 3.63Å; R746-E750 PolarHBondContact NH2-OE2 3.38Å; E750-T760 WeakPolarHBondContact OE1-CB 3.41Å; E750-T760 WeakPolarHBondContact OE1-CG2 3.42Å; E750-T760 PolarHBondContact OE1-OG1 2.86Å; E750-A761 CarbonylContact C-O 3.56Å; E750-A761 VanDerWaalsContact CA-C 3.45Å; E750-A761 CarbonylContact O-C 2.95Å; E750-T762 PolarHBondContact N-O 2.99Å; E750-T762 WeakPolarHBondContact O-CA 3Å; E750-T762 PolarHBondContact O-OG1 2.85Å
751K32.9Very low40.3Very low159 Ų159108.4 Ų108.469%0.69154%0.544SS*.  trans163.2-13.3166.7-178.2177.3177.8-1780118.4K753 T760 A761 T762K751-K753 VanDerWaalsContact C-N 3.26Å; K751-K753 PolarHBondContact O-N 3.01Å; K751-T760 VanDerWaalsContact N-CB 3.32Å; K751-A761 VanDerWaalsContact CA-O 3.22Å; K751-A761 WeakPolarHBondContact CA-O 3.5Å; K751-A761 WeakPolarHBondContact CB-O 3.42Å; K751-A761 PolarHBondContact N-O 2.73Å; K751-T762 WeakPolarHBondContact CB-OG1 3.35Å; K751-T762 WeakPolarHBondContact CD-OG1 3.11Å
752L38.2Very low39.9Very low111 Ų111103.2 Ų103.258%0.58152%0.522SS*.  trans-55.543.9-174.7-144156.2000119.5N759 T760 A761L752-N759 CarbonylContact C-O 3.55Å; L752-T760 WeakPolarHBondContact CB-O 3.3Å; L752-A761 HydrophobicContact CD1-CB 4.26Å
753K38.6Very low39.4Very low128 Ų128100 Ų10056%0.55751%0.509SS*.  trans-132.776.9176.4-174.6-175.2-169.9158.40109.4K751 E758 N759K751-K753 VanDerWaalsContact C-N 3.26Å; K751-K753 PolarHBondContact O-N 3.01Å; K753-E758 VanDerWaalsContact CD-O 3.22Å; K753-E758 WeakPolarHBondContact CD-O 3.46Å; K753-E758 WeakPolarHBondContact CE-O 3.4Å; K753-E758 PolarHBondContact NZ-O 2.93Å; K753-N759 VanDerWaalsContact CB-O 3.32Å; K753-N759 WeakPolarHBondContact CB-O 3.17Å; K753-N759 PolarHBondContact N-O 3.37Å
754R34.5Very low38.7Very low179 Ų179103 Ų10368%0.67551%0.512SS*.SBendcis49.790.217.2-81.5-131.1159.2118.92.4115.7A756R754-A756 PolarHBondContact O-N 3.37Å
755E31Very low37.8Very low175 Ų175106.8 Ų106.882%0.81853%0.528SS*.SBendtrans64.79.8138.1-63.2122.5-124.600118.6
756A32.2Very low37.8Very low51 Ų51112.4 Ų112.442%0.42155%0.551SS.*SBendtrans-134.5164.4151.600000110.3R754 E758R754-A756 PolarHBondContact O-N 3.37Å; A756-E758 HydrophobicContact CB-CB 4.06Å; A756-E758 PolarHBondContact O-N 3.44Å
757K40.2Very low38.4Very low213 Ų213112.9 Ų112.993%0.92656%0.557SS**SBendtrans-74.642.3165-68179.3176176.30111.1
758E43.3Very low39.2Very low124 Ų124117.3 Ų117.358%0.57957%0.572SS**SBendtrans-135-106.7-165.8-85.2159.8122.400119.9K753 A756K753-E758 VanDerWaalsContact CD-O 3.22Å; K753-E758 WeakPolarHBondContact CD-O 3.46Å; K753-E758 WeakPolarHBondContact CE-O 3.4Å; K753-E758 PolarHBondContact NZ-O 2.93Å; A756-E758 HydrophobicContact CB-CB 4.06Å; A756-E758 PolarHBondContact O-N 3.44Å
759N34.3Very low38.8Very low116 Ų116122 Ų12262%0.6258%0.582SS**  trans-136.9-164.5-152.5-64.7-60.2000120.8L752 K753L752-N759 CarbonylContact C-O 3.55Å; K753-N759 VanDerWaalsContact CB-O 3.32Å; K753-N759 WeakPolarHBondContact CB-O 3.17Å; K753-N759 PolarHBondContact N-O 3.37Å
760T35.1Very low39.2Very low70 Ų70124.3 Ų124.343%0.42959%0.588SS.*  trans-122-167.4-150.8600000122.7E750 K751 L752E750-T760 WeakPolarHBondContact OE1-CB 3.41Å; E750-T760 WeakPolarHBondContact OE1-CG2 3.42Å; E750-T760 PolarHBondContact OE1-OG1 2.86Å; K751-T760 VanDerWaalsContact N-CB 3.32Å; L752-T760 WeakPolarHBondContact CB-O 3.3Å
761A47.4Very low38.7Very low33 Ų33126.4 Ų126.427%0.27361%0.605SS.*  trans149107.5-14400000120.7L749 E750 K751 L752L749-A761 VanDerWaalsContact C-CB 3.4Å; L749-A761 WeakPolarHBondContact O-CA 3.35Å; L749-A761 WeakPolarHBondContact O-CB 2.82Å; L749-A761 PolarHBondContact O-N 3.23Å; E750-A761 CarbonylContact C-O 3.56Å; E750-A761 VanDerWaalsContact CA-C 3.45Å; E750-A761 CarbonylContact O-C 2.95Å; K751-A761 VanDerWaalsContact CA-O 3.22Å; K751-A761 WeakPolarHBondContact CA-O 3.5Å; K751-A761 WeakPolarHBondContact CB-O 3.42Å; K751-A761 PolarHBondContact N-O 2.73Å; L752-A761 HydrophobicContact CD1-CB 4.26Å
762T39.5Very low39.1Very low34 Ų34125.1 Ų125.121%0.20960%0.602CS.*  trans136.40-152.283.40000126.1L745 R746 A747 S748 L749 E750 K751L745-T762 CarbonylContact C-O 3.56Å; R746-T762 CarbonylContact C-O 3.58Å; R746-T762 VanDerWaalsContact CA-C 3.48Å; R746-T762 WeakPolarHBondContact CA-O 3.12Å; R746-T762 PolarHBondContact N-O 3.46Å; R746-T762 PolarHBondContact O-OG1 3.26Å; A747-T762 VanDerWaalsContact CA-CB 3.41Å; A747-T762 PolarHBondContact N-O 3.18Å; A747-T762 WeakPolarHBondContact O-CB 3.14Å; A747-T762 WeakPolarHBondContact O-CG2 3.42Å; S748-T762 PolarHBondContact O-N 2.83Å; L749-T762 CarbonylContact C-O 3.59Å; L749-T762 VanDerWaalsContact CA-C 3.49Å; L749-T762 PolarHBondContact N-O 3.48Å; E750-T762 PolarHBondContact N-O 2.99Å; E750-T762 WeakPolarHBondContact O-CA 3Å; E750-T762 PolarHBondContact O-OG1 2.85Å; K751-T762 WeakPolarHBondContact CB-OG1 3.35Å; K751-T762 WeakPolarHBondContact CD-OG1 3.11Å
763L31.9Very low39Very low65 Ų65124.3 Ų124.334%0.3460%0.601SS.*  000-171.7145.9000136.7S744 L745 R746 A747 S748 L749S744-L763 CarbonylContact O-C 3.02Å; S744-L763 VanDerWaalsContact O-C 3.25Å; S744-L763 WeakPolarHBondContact O-CA 3.12Å; S744-L763 WeakPolarHBondContact O-CG 3.17Å; L745-L763 HydrophobicContact CD2-CB 4.1Å; L745-L763 HydrophobicContact CD2-CD1 3.66Å; L745-L763 HydrophobicContact CD2-CG 4.38Å; L745-L763 HydrophobicContact CG-CD1 4.3Å; R746-L763 VanDerWaalsContact N-N 3.2Å; A747-L763 VanDerWaalsContact C-N 3.27Å; A747-L763 CarbonylContact C-O 3.53Å; A747-L763 VanDerWaalsContact CA-N 3.29Å; A747-L763 WeakPolarHBondContact CA-O 3.01Å; A747-L763 WeakPolarHBondContact CB-O 3.33Å; S748-L763 VanDerWaalsContact N-C 3.29Å; S748-L763 PolarHBondContact N-O 3.11Å; L749-L763 HydrophobicContact CB-CB 4.14Å
764K29.8Very low38.8Very low137 Ų137126.6 Ų126.660%0.59661%0.612SS**  000-148.4-145.8-167-154.70129.8S744S744-K764 VanDerWaalsContact CB-N 3.29Å; S744-K764 PolarHBondContact O-N 3.06Å; S744-K764 VanDerWaalsContact OG-C 3.32Å
765E31Very low39.3Very low100 Ų100124.6 Ų124.647%0.46761%0.614SS.*  000-104.3-159.6129.200137.5S744S744-E765 PolarHBondContact OG-N 2.76Å
766K49.6Very low39.8Very low169 Ų169122.7 Ų122.774%0.73561%0.609SS**  0168.90-105.9-172-167.1870133.9
767K49.4Very low39.3Very low188 Ų188128.7 Ų128.782%0.81763%0.628SS**  trans-162162.4-139.1-174.6-176.4-164.5168.50121.2
768D51.3Low38.5Very low159 Ų159124.8 Ų124.885%0.8562%0.622SS**  trans-158.1176.5154.9-137.9-28.5000118.8
769K43.5Very low38.2Very low180 Ų180124.1 Ų124.178%0.78363%0.628SS**  trans-127.6-160.2-177.5-85.7-152.2169.2-165.80114.5
770K46Very low37.7Very low154 Ų154127.2 Ų127.267%0.6764%0.639SS**  cis-164.6156.925.5175.2-165.1168.5-177.70108.8
771T33.2Very low37.9Very low110 Ų110130.6 Ų130.668%0.67565%0.653SS**  cis102.3151.723.4-37.90000117.2
772Q41.7Very low37.3Very low132 Ų132137.9 Ų137.962%0.61768%0.675SS**  trans100.2152.9169.4-67.8-164.7-118.600116.5
773T35.1Very low36.8Very low93 Ų93147.1 Ų147.157%0.57171%0.706SS**  cis-171167.4-18.829.20000107.7
774F34.2Very low37.6Very low176 Ų176153 Ų15377%0.77273%0.729SS**  cis-165.5172.8-1.2-115.6-31.3000111.3
775L45.2Very low38.3Very low137 Ų137154 Ų15472%0.71774%0.74SS**  trans43.7137.4155.7-83.199.5000122.8
776L41Very low39.2Very low136 Ų136156.1 Ų156.171%0.71275%0.754SS**  cis-165.5127.3-22.1-158.668.9000112.5
777E21.6Very low39.1Very low177 Ų177153.6 Ų153.683%0.82776%0.758SS**  trans52.3-175.7156.2-71.1-172.1127.700122.7
778T24.7Very low39.1Very low131 Ų131154.6 Ų154.680%0.80476%0.762SS**  trans-123.8-153.4-162.653.90000110.3
779P35.8Very low38.7Very low110 Ų110151.6 Ų151.671%0.71476%0.76SS**  -123.3174.8-61.531.2-13.2000115.1
780E24.3Very low38.5Very low181 Ų181149.6 Ų149.685%0.84676%0.762SS**  trans-129.6155.6161.9-77.2-169.214700109.6
781I39.4Very low39.4Very low140 Ų140147.5 Ų147.572%0.71876%0.764SS**  cis89.6103.431.9-59.7176.7000114.8
782Y35.6Very low40.3Very low187 Ų187147 Ų14773%0.73377%0.765SS**  trans34.6128135-117.2-77.9000119
783W28.8Very low40.6Very low228 Ų228148.7 Ų148.786%0.86477%0.773SS**  -163.9-173.867.5-83.482.1000112.2
784K47.5Very low40.8Very low189 Ų189149.7 Ų149.782%0.82278%0.779SS**  trans-121.4145.3-176.7-65.2179.3174.1179.90114.6
785L45.1Very low41.2Very low157 Ų157148.1 Ų148.182%0.82278%0.784SS**  trans158.1140.2136.6-105.167000115
786D49.3Very low41.2Very low144 Ų144147.2 Ų147.277%0.7779%0.789SS**  trans36.2141.1153.4-57.8-5.8000128.8
787S49Very low40.9Very low116 Ų116150.6 Ų150.681%0.81179%0.792SS**  trans101.6125.4143.9-62.40000126.8
788K49.8Very low41.5Very low210 Ų210147.1 Ų147.191%0.91378%0.78SS**  trans59.9138.6144.2-85.8-177.6176176.90127.8
789A41.1Very low41.6Very low96 Ų96148.7 Ų148.779%0.79378%0.775SS**  trans98.7107.5131.100000129.2
790V40.3Very low41.3Very low138 Ų138149.2 Ų149.284%0.83678%0.777SS**  86.50127.7-134.20000127.3
791P64.9Low41.5Very low109 Ų109145.3 Ų145.371%0.70877%0.769SS**  0-172.3045.7-24.7000124.2
792S51.8Low40.9Very low100 Ų100145.2 Ų145.270%0.69978%0.775SS**  trans108.7143.3139.9-79.80000127.5
793Q47.4Very low40.5Very low168 Ų168142.5 Ų142.579%0.78577%0.773SS**  trans67.9163.5139.3-70.9-16941.600124.7
794T40.4Very low40.3Very low113 Ų113139.8 Ų139.869%0.69377%0.77SS**  cis-166.7161.1-9.519.50000118.5
795V41.8Very low39.4Very low143 Ų143134.7 Ų134.787%0.86777%0.771SS**  trans77.9142.8143.3164.50000126.7
796S45.1Very low38.8Very low119 Ų119135.2 Ų135.283%0.83277%0.773SS**  trans-169163.6165.266.30000116.6
797R34.3Very low38Very low206 Ų206132.5 Ų132.578%0.77777%0.765SS**  trans-174163.7173.2-150-178136.6144.7-1.5119.1
798N34.8Very low37.2Very low105 Ų105136.4 Ų136.456%0.56177%0.767SS**  trans99117.8154.2-66.1-28.5000120.5
799F27.7Very low36.1Very low163 Ų163132.2 Ų132.272%0.71576%0.755SS**  95.5160.390-74.4-0.6000113.6
800T28.5Very low35.6Very low121 Ų121134.8 Ų134.874%0.74275%0.748SS**  cis-174169.8-927.10000107.8
801S28.7Very low35.1Very low99 Ų99137.9 Ų137.969%0.69275%0.745SS**  cis-176.3-164.1-12.552.60000110.1
802V27Very low33.5Very low138 Ų138138.4 Ų138.484%0.83674%0.742SS**  trans79.1146.5160151.20000119.2
803D26.5Very low32.4Very low131 Ų131143.5 Ų143.570%0.70175%0.747SS**  cis-166-139.2-23.9-166.151.4000115
804H25.6Very low31.9Very low171 Ų171142.8 Ų142.879%0.79275%0.748SS**  trans-95.5165.5-161.4-77.257.6000119
805G27.5Very low31.3Very low82 Ų82148.4 Ų148.485%0.84576%0.756SS**  trans163.8105.7155.200000119.5
806I34.2Very low30.9Very low168 Ų168147.2 Ų147.286%0.86275%0.75SS**  trans-91.1141.7-170.3-55.6159.4000115.1
807S31.5Very low30.2Very low86 Ų86147 Ų14760%0.60175%0.748SS**  148.5143.611989.70000118.7
808K32.5Very low29.9Very low198 Ų198141.1 Ų141.186%0.86174%0.744SS**  trans63.7155155-60.6162.5-174.5171.50117
809D26.6Very low29.8Very low123 Ų123145.1 Ų145.166%0.65876%0.756SS**  cis-148.1-161.322.6-166.121.6000112.7
810K30.9Very low29.8Very low150 Ų150143.8 Ų143.865%0.65276%0.757SS**  trans-75.5167.1-167.1-35.8115.5-175.7116.80118.5
811R30.4Very low29.7Very low203 Ų203144.9 Ų144.977%0.76676%0.763SS**  115.7136.1128.1-94.7-169.8-68.9-155.3-2.4120.7
812D30.8Very low29.6Very low119 Ų119148.1 Ų148.164%0.63677%0.772SS**  trans41.4138.6136.1-46.4-17.2000124
813Y28.9Very low29.7Very low208 Ų208146.1 Ų146.182%0.81676%0.764SS**  trans74.5116.3157.2-66.2-66.4000122.3
814L36.7Very low30.2Very low153 Ų153145.5 Ų145.580%0.80177%0.765SS**  trans59.2131.4132.8-74.1164.3000123.5
815W26.5Very low30.6Very low230 Ų230143.3 Ų143.387%0.87177%0.766SS**  trans87.1124.1144.6-140.6-25.4000120.5
816T34.2Very low30.5Very low118 Ų118146.9 Ų146.972%0.72477%0.765SS**  trans72.4153.2157.823.30000117
817S29.8Very low31.2Very low114 Ų114143.1 Ų143.180%0.79775%0.751SS**  cis-149.6179.423.9-157.10000114.9
818A29.1Very low31Very low83 Ų83148.5 Ų148.569%0.68676%0.764SS**  trans-118.2167.1-179.500000113
819K31.8Very low30.6Very low189 Ų189142.5 Ų142.582%0.82275%0.751SS**  trans171.6148.3163.4-97.8149.5-175-178.30108.7
820N27.9Very low30.6Very low136 Ų136147.3 Ų147.373%0.72776%0.762SS**  cis-165.8-179.2-11.3-122.618.8000110.5
821T25.6Very low30.4Very low144 Ų144146.8 Ų146.888%0.88377%0.771SS**  trans81.8158.7168.870.80000118.3
822L26.9Very low30.5Very low167 Ų167142.9 Ų142.987%0.87477%0.77SS**  trans-148.4160.6-148.6-167.966.2000113.1
823S30.3Very low30.5Very low96 Ų96146.7 Ų146.767%0.67178%0.781SS**  trans-47.2171.3177.6-38.40000116.8
824T35.6Very low30.8Very low118 Ų118143.3 Ų143.372%0.72478%0.782SS**  cis-159.8177.717.4-25.20000109.9
825P34.1Very low31.9Very low125 Ų125141.4 Ų141.481%0.81278%0.779SS**  -150.1177.587.937.2-15.9000117.8
826L27Very low32Very low156 Ų156137.5 Ų137.582%0.81778%0.78SS**  trans-102-162.4-173.1-135.267.3000110.3
827P49.2Very low32.3Very low89 Ų89141 Ų14158%0.57879%0.786SS**  cis-146.1-175-15.943.1-24000118.2
828K27.1Very low33.1Very low200 Ų200141.6 Ų141.687%0.8779%0.787SS**  trans70.1159151.5-73.5162.7-171.7175.90120.4
829A24.1Very low33.1Very low72 Ų72144.6 Ų144.660%0.59578%0.784SS**  cis-174.6162.4-29.600000112.9
830Y26.3Very low33.1Very low224 Ų224143 Ų14388%0.87878%0.784SS**  trans65.8142.5169.7-63.2-79000118.7
831T26.9Very low33.1Very low138 Ų138142 Ų14285%0.84778%0.775SS**  -172.2-174.878.9-54.80000111.6
832V31.8Very low33.4Very low122 Ų122141.9 Ų141.974%0.73976%0.764SS**  trans-120.2149.9-164.2-176.50000114
833K31.2Very low33.5Very low199 Ų199142.9 Ų142.987%0.86576%0.757SS**  trans159.7167138.4-88.3163.9-175.4179.20116.7
834T34.4Very low33.4Very low136 Ų136144.2 Ų144.283%0.83475%0.752SS**  trans-126.6-159.9172.248.30000110.4
835P60.8Low33.1Very low114 Ų114143.9 Ų143.974%0.7475%0.746SS**  -126.6173.7-80.940.5-25000115.6
836T27.6Very low33Very low147 Ų147144.6 Ų144.690%0.90274%0.742SS**  trans-149.9161176.1-22.20000116.9
837K40.1Very low33.1Very low193 Ų193143 Ų14384%0.83973%0.734SS**  trans-126.4178.5174.8-55.2177.2-176.5178.90111
838P47.9Very low32.1Very low126 Ų126145.8 Ų145.882%0.81874%0.743SS**  -146.3-173.976.541.6-24.2000114.3
839K29.8Very low33.2Very low146 Ų146141.3 Ų141.364%0.63573%0.734SS**  cis112.564.9-11-162-105.8127.8-150.40121.7Q841K839-Q841 VanDerWaalsContact CE-OE1 3.24Å
840L30.8Very low33.3Very low156 Ų156146.2 Ų146.282%0.81775%0.749SS**  trans-146.2134.5157.6-78.8165.3000109.4
841Q28.5Very low33.3Very low115 Ų115143.9 Ų143.954%0.53775%0.746SS.*  cis78.2138.449-70.7-176.7-97.700113.8K839K839-Q841 VanDerWaalsContact CE-OE1 3.24Å
842Q31.7Very low33.4Very low141 Ų141144.8 Ų144.866%0.65974%0.74SS**  cis-163.5157.71-128.6174-23.300113.6
843R28.5Very low33.4Very low188 Ų188142.6 Ų142.671%0.70973%0.731SS**  trans35156.9130.5-79.1-167139.1171.5-8.4123.2
844E29.3Very low33.3Very low124 Ų124141 Ų14158%0.57972%0.724SS**  cis175.2173.6-24.9-131.4166.8-129.800109.8
845N29.2Very low33.5Very low111 Ų111143.9 Ų143.959%0.59473%0.725SS**  trans84.2120.6154.5-60.8-34.7000121.2
846L30.5Very low32.2Very low139 Ų139147.1 Ų147.173%0.72873%0.727SS**  79.4143.988-61.3174.6000113.6
847N29.9Very low32.8Very low122 Ų122151.8 Ų151.865%0.65273%0.728SS**  cis-163.81335.8-123.8-8.5000115.3
848I29Very low32.6Very low148 Ų148151.4 Ų151.476%0.75973%0.726SS**  trans53.2-172.8148-7.3-177.3000120.8
849P49.8Very low32Very low106 Ų106152.3 Ų152.369%0.68872%0.722SS**  -126.8-175.5-123.646-28000116.8
850I26.2Very low32Very low176 Ų176149.4 Ų149.490%0.90372%0.724SS**  trans-169.8176138.3-104.5161.8000112.4
851E26.6Very low32Very low175 Ų175151.4 Ų151.482%0.81873%0.727SS**  trans-98.3172-158.7-173.3168-160.300116.3
852E27.7Very low32.2Very low157 Ų157153.9 Ų153.973%0.73474%0.739SS**  trans83.5116.2154.3-121.6-157.3-124.900123.9K854E852-K854 IonicContact OE2-NZ 2.64Å
853S31.8Very low32.5Very low76 Ų76155.2 Ų155.253%0.53174%0.743SS.*  117.9140.6118.187.80000122.4
854K30.2Very low32.5Very low166 Ų166151.8 Ų151.872%0.72274%0.738SS**  trans70.5116148.5-63.3158-166.4108.80121.8E852E852-K854 IonicContact OE2-NZ 2.64Å
855K37Very low32.8Very low196 Ų196153 Ų15385%0.85275%0.747SS**  trans163.1153.6131-88.9151.5-169.1168.40111.9
856K34.8Very low33Very low182 Ų182153.8 Ų153.879%0.79175%0.751SS**  cis-177.1130.3-26.8-118.2-171.4-172.5-177.60110.4
857R39.5Very low33Very low244 Ų244152.3 Ų152.392%0.92175%0.753SS**  trans162.5133.1153-95169.2-115.5-148.81107.9
858K35.8Very low33.3Very low185 Ų185153.5 Ų153.580%0.80476%0.759SS**  cis67.3134.543.2-67.6-156.8170.9-159.50112.6
859M35.2Very low33.5Very low146 Ų146151.6 Ų151.672%0.71976%0.759SS**  cis-154.9135.213.4-164.2175.6-7700106.3
860A31.1Very low33.1Very low84 Ų84151.9 Ų151.969%0.69476%0.764SS**  71.9127.457.700000115.7
861F30.7Very low33.5Very low198 Ų198152 Ų15287%0.86876%0.76SS**  trans-157167.2154.1-115.6-76.3000109.5
862E32.8Very low34Very low168 Ų168150.7 Ų150.779%0.78576%0.764SS**  trans-151.2-168.6-144.7-166.4161.3-150.200112.2
863F36.1Very low34.4Very low169 Ų169149.6 Ų149.674%0.74177%0.769SS**  trans91.6140.4176-65.2-75.3000117.3
864D30.1Very low34.6Very low115 Ų115152.8 Ų152.862%0.61578%0.78SS**  cis-147.6168.7-2.8-159.918.3000113.5N866D864-N866 PolarHBondContact OD2-ND2 3.34Å
865I35.2Very low34.8Very low151 Ų151150.8 Ų150.877%0.77478%0.776SS**  trans-136.7129.8170.3-61.2176000110.7
866N33.8Very low34.6Very low127 Ų127148.4 Ų148.468%0.67977%0.772SS**  trans-136.2133162.3-62.4-90.2000106.6D864D864-N866 PolarHBondContact OD2-ND2 3.34Å
867S30.5Very low34.4Very low108 Ų108145.2 Ų145.276%0.75577%0.772SS**  65.6133.258.9-75.70000113.3
868D35Very low33.9Very low146 Ų146141.1 Ų141.178%0.78177%0.766SS**  cis-165.7171.8-7.6-160.7-5.6000109.6
869S34.5Very low33.6Very low109 Ų109138.7 Ų138.776%0.76277%0.766SS**  trans64.6177.7174.777.60000116.1
870S39.8Very low33.7Very low112 Ų112135.3 Ų135.378%0.78376%0.757SS**  cis-154.8-179.14.5-155.50000112.6
871E36Very low33.9Very low177 Ų177138.8 Ų138.883%0.82776%0.759SS**  trans-104.3156.7171.3-61.2175.8128.200112.7
872T37.4Very low33.9Very low148 Ų148137.3 Ų137.391%0.90876%0.755SS**  -173.6154129.513.70000111.6
873T35.5Very low34Very low135 Ų135135.4 Ų135.483%0.82875%0.746SS**  trans-110.5154.1-179.550.20000113
874D35.7Very low33.9Very low142 Ų142134 Ų13476%0.75975%0.751SS**  115.2156128.3-147.912.8000119.4
875L33.7Very low34Very low124 Ų124137.1 Ų137.165%0.64977%0.767SS**  trans81110.3161.5-57.3-174.9000121.3
876L33.4Very low33.9Very low147 Ų147137.8 Ų137.877%0.7776%0.764SS**  70.9101.8129.7-60.1171.3000119.8
877S30.7Very low33.9Very low114 Ų114138.5 Ų138.580%0.79777%0.773SS**  trans-134.9114.8134.4-174.10000108.9
878M29.7Very low34.1Very low159 Ų159140.9 Ų140.978%0.78378%0.777SS**  trans-100.5131.5169.3-80.6-171.865.200109.2
879V29.8Very low33.8Very low133 Ų133145.4 Ų145.481%0.80679%0.785SS**  trans-132.9103.1166.8177.40000107.4
880S35.9Very low33.6Very low76 Ų76150.9 Ų150.953%0.53179%0.788SS.*  trans-70.6163151.8-45.60000108.6
881E35.3Very low33.1Very low156 Ų156151.7 Ų151.773%0.72978%0.784SS**  cis-132.5168.817.2-114.2105.9-12100109.2
882E31.8Very low32.8Very low167 Ų167150.7 Ų150.778%0.7879%0.785SS**  45131.591.1-134.6160.9-175.700113.6
883E33.5Very low32.5Very low129 Ų129151.7 Ų151.760%0.60378%0.784SS**  cis-154.6134.930.3-169.5175.2-159.400111.6K886E883-K886 IonicContact OE1-NZ 2.99Å; E883-K886 PolarHBondContact OE1-NZ 3.33Å
884T34.4Very low32.5Very low140 Ų140150.8 Ų150.886%0.85978%0.781SS**  trans-177.7109.1154.412.10000111.9
885L33.1Very low32.9Very low180 Ų180149.9 Ų149.994%0.94278%0.783SS**  trans169.776.2148.7-96.9168.7000110.3
886K33Very low32.7Very low164 Ų164148.1 Ų148.171%0.71379%0.786SS**  trans-13091.4171.4-76.7173.3-170.7143.80111E883E883-K886 IonicContact OE1-NZ 2.99Å; E883-K886 PolarHBondContact OE1-NZ 3.33Å
887T32.6Very low32.6Very low142 Ų142146.1 Ų146.187%0.87178%0.784SS**  trans-170.8162.2147.411.50000109.8
888L35.2Very low32.6Very low158 Ų158150.2 Ų150.283%0.82779%0.79SS**  trans63.381.3179.9-54.2178.3000115.8
889Y29Very low32.8Very low241 Ų241149.5 Ų149.595%0.94579%0.789SS**  -156.2120.6104-108-74.5000110.1
890R29.4Very low32.7Very low224 Ų224148.9 Ų148.985%0.84579%0.789SS**  trans-109.6140.9174.6-145.2-164.8-155.4-169.98.3108.2
891N29.8Very low32.4Very low129 Ų129151.8 Ų151.869%0.6980%0.803SS**  trans60.5112.8172.3-57.32.5000116.2
892N30.4Very low32.2Very low157 Ų157151.6 Ų151.684%0.8480%0.8SS**  -173.1109.4112.2-89.4-24000110.6
893N30.2Very low32.3Very low168 Ų168150.1 Ų150.190%0.89880%0.802SS**PPolyproline II helixtrans-87.6130.8167.8-71.9-10.8000110
894P36.7Very low32.8Very low117 Ų117149.4 Ų149.476%0.7681%0.809SS**PPolyproline II helixtrans-98.6148.6150.834.8-28.8000110.8
895P44.3Very low32.8Very low123 Ų123152.4 Ų152.480%0.79981%0.81SS**PPolyproline II helixtrans-86.9154.6-175.234.2-36000114.6
896A28.6Very low32.7Very low86 Ų86154.1 Ų154.171%0.71181%0.81SS**  trans28.2102.6149.200000120
897S31Very low32.6Very low105 Ų105150.6 Ų150.673%0.73481%0.812SS**  29.3127.5129.262.40000121.2
898H31.5Very low33.1Very low200 Ų200149.1 Ų149.193%0.92680%0.804SS**  trans-131.2145.3136.8-99.2-86.3000110.7
899L32.4Very low32.8Very low145 Ų145146.5 Ų146.576%0.75980%0.8SS**  trans-110.8137.7-170.1-152.889000110.6
900C29.1Very low32.9Very low119 Ų119140.2 Ų140.280%0.80479%0.79SS**  trans-167.4108.2146.2-108.80000116.2
901V29.6Very low33Very low138 Ų138137 Ų13784%0.83679%0.789SS**  trans67.8150.6134.2-176.90000120.1
902K31.3Very low32.8Very low152 Ų152137.6 Ų137.666%0.66180%0.798SS**  trans-115.2130.5-164.5-63.7174.5178.6174.40113.8
903T32.9Very low33Very low135 Ų135136.2 Ų136.283%0.82880%0.795SS**  trans64178.5140.367.10000118.2
904P43.9Very low33.6Very low115 Ų115134.1 Ų134.175%0.74779%0.791SS**  cis-133.4161.4-2.941-23.7000118.8
905K35.7Very low33.1Very low203 Ų203131.7 Ų131.788%0.88379%0.787SS**  trans13.3122153.2-62.9179.3177.9177.90120.9
906K30.3Very low32.4Very low216 Ų216131.5 Ų131.594%0.93979%0.789SS**  -169.5160.3123.3-106.1167-175.8177.90112
907A31.4Very low32.4Very low90 Ų90133.5 Ų133.574%0.74479%0.792SS**  trans-102.2176.317000000109.4
908P43.2Very low32.8Very low110 Ų110137.1 Ų137.171%0.71480%0.802SS**  cis-141.9-179.910.141.5-21.8000117.4
909S28.8Very low33Very low104 Ų104136.3 Ų136.373%0.72780%0.796SS**  trans64.9145.6144.466.70000123.8
910S29.7Very low33Very low108 Ų108139.5 Ų139.576%0.75580%0.804SS**  trans100.6124.2148.5790000121.1
911L32.5Very low33.2Very low157 Ų157138 Ų13882%0.82281%0.809SS**  trans30.3111.5139.6-66.3161.3000120.3
912T25.9Very low33.8Very low141 Ų141135.3 Ų135.387%0.86580%0.801SS**  179.5147.597.526.70000113.7
913T35.1Very low34.2Very low129 Ų129136.6 Ų136.679%0.79181%0.813SS**  trans-83.7159.8159.66.60000109.5
914P41.4Very low34.6Very low123 Ų123140.6 Ų140.680%0.79981%0.813SS**  -150.4160.655.940.4-19.9000119.4
915G25.7Very low34.8Very low66 Ų66143.5 Ų143.568%0.6881%0.814SS**  trans64.8105.2131.100000120.8
916S31.3Very low35.1Very low120 Ų120141.7 Ų141.784%0.83981%0.811SS**  172127.396.249.30000112.2
917T28.4Very low36Very low128 Ų128142.3 Ų142.379%0.78581%0.807SS**  trans-133.782.8174.38.50000110.3K919T917-K919 PolarHBondContact O-N 3.16Å
918L39Very low36.6Very low180 Ų180144.8 Ų144.894%0.94280%0.804SS**  trans-74.9105.2161.2-151.484.2000107.5
919K34.6Very low36.9Very low184 Ų184143.7 Ų143.780%0.879%0.792SS**  trans-130.2138.5172.2-80.1-164.5173.6-175.50111.6T917 G921T917-K919 PolarHBondContact O-N 3.16Å; K919-G921 PolarHBondContact O-N 3.02Å
920F32.9Very low37.8Very low212 Ų212147.7 Ų147.793%0.9379%0.791SS**  trans-54.5128.8-172.1-76.6-104.5000113.3
921G34.2Very low38.7Very low87 Ų87152.1 Ų152.190%0.89779%0.791SS**  trans-96.3102.7166.600000111.4K919K919-G921 PolarHBondContact O-N 3.02Å
922A42.6Very low39.6Very low82 Ų82146.8 Ų146.868%0.67877%0.77SS**  trans-158.1160.3161.200000109.6R924A922-R924 PolarHBondContact O-N 3.21Å
923I38Very low40.9Very low178 Ų178144.6 Ų144.691%0.91376%0.756SS**SBendtrans6039.8170.4-31.3-178.8000115.8
924R43.1Very low41.8Very low220 Ų220143.2 Ų143.283%0.8374%0.743SS**  trans-149.863.1154.3-162.2-176.8-68.6-165.6-0.3112.6A922A922-R924 PolarHBondContact O-N 3.21Å
925K46.4Very low42.3Very low175 Ų175140.3 Ų140.376%0.76173%0.729SS**  trans-151.949.3178.3-151.4179.7-177.7-178.10115.3
926M43.8Very low43.8Very low165 Ų165144.8 Ų144.881%0.81373%0.73SS**SBendtrans-141.70.6173.6-74-162.277.800115.8
927R47.8Very low45.2Very low229 Ų229145.4 Ų145.486%0.86472%0.721SS**SBendtrans-108-21.9-177.2-131.8179.2-166.9-169.73.8115.2
928E44.4Very low46.5Very low143 Ų143142.9 Ų142.967%0.66870%0.703SS**SBendtrans-92.6-35.7-174.9-72.7157.2-162.100113.1R930 W931E928-R930 PolarHBondContact O-N 3.46Å; E928-W931 PolarHBondContact O-N 3.17Å
929D50Low47.8Very low87 Ų87144.1 Ų144.147%0.46570%0.695SS.*Hα-helixtrans-60.4-23.5-175.4-69.4-59.7000114.5W931 A932 V933D929-W931 VanDerWaalsContact C-N 3.34Å; D929-W931 PolarHBondContact O-N 3.03Å; D929-A932 PolarHBondContact O-N 3.23Å; D929-V933 WeakPolarHBondContact O-CG2 3.22Å; D929-V933 PolarHBondContact O-N 2.77Å
930R47.4Very low49.1Very low187 Ų187142.9 Ų142.971%0.70669%0.689SS**Hα-helixtrans-64.6-36.1179-68.2-174.7-179-107.1-0112.7E928 I934E928-R930 PolarHBondContact O-N 3.46Å; R930-I934 WeakPolarHBondContact O-CG1 3.09Å
931W47.6Very low50.7Low202 Ų202138.6 Ų138.677%0.76567%0.67SS**Hα-helixtrans-75.9-37.8177.8-69.1104.1000112E928 D929 V933 I934 A935E928-W931 PolarHBondContact O-N 3.17Å; D929-W931 VanDerWaalsContact C-N 3.34Å; D929-W931 PolarHBondContact O-N 3.03Å; W931-V933 VanDerWaalsContact C-N 3.33Å; W931-V933 PolarHBondContact O-N 2.88Å; W931-I934 PolarHBondContact O-N 3.24Å; W931-A935 WeakPolarHBondContact O-CB 3.32Å; W931-A935 PolarHBondContact O-N 3.48Å
932A51.8Low52.1Low45 Ų45140.3 Ų140.337%0.37265%0.653SS.*Hα-helixtrans-64.1-34.2178.800000113.2D929 K936D929-A932 PolarHBondContact O-N 3.23Å; A932-K936 WeakPolarHBondContact O-CB 3.09Å; A932-K936 VanDerWaalsContact O-CG 3.31Å; A932-K936 WeakPolarHBondContact O-CG 3.22Å; A932-K936 PolarHBondContact O-N 3.28Å
933V53.8Low53.1Low95 Ų95142 Ų14258%0.57665%0.65SS**Hα-helixtrans-69.7-45176172.50000111.5D929 W931 K936 M937D929-V933 WeakPolarHBondContact O-CG2 3.22Å; D929-V933 PolarHBondContact O-N 2.77Å; W931-V933 VanDerWaalsContact C-N 3.33Å; W931-V933 PolarHBondContact O-N 2.88Å; V933-K936 PolarHBondContact O-N 2.75Å; V933-M937 PolarHBondContact O-N 2.85Å
934I53.2Low54.1Low100 Ų100139.9 Ų139.951%0.51363%0.634SS.*Hα-helixtrans-63-46.8179.2-64.7169.7000110.6R930 W931 K936 M937 D938R930-I934 WeakPolarHBondContact O-CG1 3.09Å; W931-I934 PolarHBondContact O-N 3.24Å; I934-K936 VanDerWaalsContact C-N 3.3Å; I934-K936 PolarHBondContact O-N 3.13Å; I934-M937 PolarHBondContact O-N 3.24Å; I934-M937 VanDerWaalsContact O-N 3.11Å; I934-D938 PolarHBondContact O-N 3.22Å
935A52.1Low54.8Low62 Ų62134.2 Ų134.251%0.51262%0.617SS.*Hα-helixtrans-61.8-34.5178.500000113.3W931 R939W931-A935 WeakPolarHBondContact O-CB 3.32Å; W931-A935 PolarHBondContact O-N 3.48Å; A935-R939 PolarHBondContact O-N 3.16Å
936K57Low55.4Low160 Ų160128.4 Ų128.470%0.69660%0.602SS**Hα-helixtrans-72.1-36173.7-75.8175.6-180178.10112.3A932 V933 I934 K940A932-K936 WeakPolarHBondContact O-CB 3.09Å; A932-K936 VanDerWaalsContact O-CG 3.31Å; A932-K936 WeakPolarHBondContact O-CG 3.22Å; A932-K936 PolarHBondContact O-N 3.28Å; V933-K936 PolarHBondContact O-N 2.75Å; I934-K936 VanDerWaalsContact C-N 3.3Å; I934-K936 PolarHBondContact O-N 3.13Å; K936-K940 WeakPolarHBondContact O-CB 3.12Å; K936-K940 PolarHBondContact O-N 2.86Å
937M60.5Low55.9Low133 Ų133126.9 Ų126.966%0.65559%0.593SS**Hα-helixtrans-70.9-41.6178.8-167.1158.268.800112.2V933 I934 K940 K941V933-M937 PolarHBondContact O-N 2.85Å; I934-M937 PolarHBondContact O-N 3.24Å; I934-M937 VanDerWaalsContact O-N 3.11Å; M937-K940 PolarHBondContact O-N 2.75Å; M937-K941 PolarHBondContact O-N 2.65Å
938D56.3Low56.3Low75 Ų75124.3 Ų124.340%0.40159%0.588SS.*Hα-helixtrans-66.2-41.9178.2-170.458.8000112.4I934 K940 K941 K942I934-D938 PolarHBondContact O-N 3.22Å; D938-K940 VanDerWaalsContact C-N 3.32Å; D938-K940 PolarHBondContact O-N 2.86Å; D938-K941 PolarHBondContact O-N 2.97Å; D938-K942 PolarHBondContact O-N 2.72Å; D938-K942 IonicContact OD1-NZ 3.56Å; D938-K942 WeakPolarHBondContact OD2-CE 3.47Å; D938-K942 IonicContact OD2-NZ 2.66Å; D938-K942 PolarHBondContact OD2-NZ 3.39Å
939R66Low56.6Low205 Ų205124.2 Ų124.277%0.77459%0.591SS**Hα-helixtrans-57.1-43170.7-92.8-175.9168.6164.1-1.8112.3A935 K941 L943A935-R939 PolarHBondContact O-N 3.16Å; R939-K941 VanDerWaalsContact C-N 3.3Å; R939-K941 PolarHBondContact O-N 3.24Å; R939-L943 PolarHBondContact O-N 2.72Å; R939-L943 VanDerWaalsContact O-N 3.12Å
940K62.7Low56.4Low158 Ų158129.2 Ų129.269%0.68761%0.609SS**Hα-helixtrans-72.6-22.1-179.9-156.4171.4-172.5178.20112.9K936 M937 D938K936-K940 WeakPolarHBondContact O-CB 3.12Å; K936-K940 PolarHBondContact O-N 2.86Å; M937-K940 PolarHBondContact O-N 2.75Å; D938-K940 VanDerWaalsContact C-N 3.32Å; D938-K940 PolarHBondContact O-N 2.86Å
941K66.1Low56.2Low123 Ų123129.8 Ų129.854%0.53563%0.633SS.*Hα-helixtrans-77.2-49.6172-167.8-178.9176.9-170.20111.6M937 D938 R939 L943 K944 E945M937-K941 PolarHBondContact O-N 2.65Å; D938-K941 PolarHBondContact O-N 2.97Å; R939-K941 VanDerWaalsContact C-N 3.3Å; R939-K941 PolarHBondContact O-N 3.24Å; K941-L943 VanDerWaalsContact C-N 3.3Å; K941-L943 PolarHBondContact O-N 2.71Å; K941-K944 PolarHBondContact O-N 2.87Å; K941-E945 PolarHBondContact O-N 3.19Å; K941-E945 VanDerWaalsContact O-N 3.11Å
942K63Low56.6Low122 Ų122126.2 Ų126.253%0.5363%0.626SS.*Hα-helixtrans-62.8-33179.3-75.7170.7177.9158.40113.3D938 E945 A946D938-K942 PolarHBondContact O-N 2.72Å; D938-K942 IonicContact OD1-NZ 3.56Å; D938-K942 WeakPolarHBondContact OD2-CE 3.47Å; D938-K942 IonicContact OD2-NZ 2.66Å; D938-K942 PolarHBondContact OD2-NZ 3.39Å; K942-E945 PolarHBondContact O-N 2.77Å; K942-A946 PolarHBondContact O-N 2.99Å
943L64.2Low56.9Low117 Ų117130.4 Ų130.461%0.61364%0.639SS**Hα-helixtrans-60.8-43.3171.1-121.4156.9000111.9R939 K941 E945 A946 E947R939-L943 PolarHBondContact O-N 2.72Å; R939-L943 VanDerWaalsContact O-N 3.12Å; K941-L943 VanDerWaalsContact C-N 3.3Å; K941-L943 PolarHBondContact O-N 2.71Å; L943-E945 VanDerWaalsContact C-N 3.3Å; L943-E945 PolarHBondContact O-N 3.46Å; L943-A946 PolarHBondContact O-N 2.97Å; L943-E947 VanDerWaalsContact O-CB 3.3Å; L943-E947 WeakPolarHBondContact O-CB 3.03Å; L943-E947 PolarHBondContact O-N 2.72Å
944K59.5Low57Low135 Ų135132.4 Ų132.459%0.58764%0.643SS**Hα-helixtrans-73.3-15176.4-74.4-166.1169.7-160.70115K941 K948K941-K944 PolarHBondContact O-N 2.87Å; K944-K948 WeakPolarHBondContact O-CG 3.2Å
945E58.2Low57.3Low100 Ų100134.3 Ų134.347%0.46765%0.651SS.*Hα-helixtrans-87-37.8171.1-75.6167.8164.200110.7K941 K942 L943 K948K941-E945 PolarHBondContact O-N 3.19Å; K941-E945 VanDerWaalsContact O-N 3.11Å; K942-E945 PolarHBondContact O-N 2.77Å; L943-E945 VanDerWaalsContact C-N 3.3Å; L943-E945 PolarHBondContact O-N 3.46Å; E945-K948 PolarHBondContact O-N 2.77Å
946A57.2Low57.6Low53 Ų53138.8 Ų138.844%0.43866%0.659SS.*Hα-helixtrans-64.3-40.7171.100000112.7K942 L943 K948 L949K942-A946 PolarHBondContact O-N 2.99Å; L943-A946 PolarHBondContact O-N 2.97Å; A946-K948 PolarHBondContact O-N 3.29Å; A946-L949 PolarHBondContact O-N 2.87Å
947E54.9Low57.6Low134 Ų134137.4 Ų137.463%0.62666%0.657SS**THydrogen-bonded Turntrans-65.8-13.7176.8-161.5168.6-125.300113.1L943L943-E947 VanDerWaalsContact O-CB 3.3Å; L943-E947 WeakPolarHBondContact O-CB 3.03Å; L943-E947 PolarHBondContact O-N 2.72Å
948K56.5Low57.4Low175 Ų175137.7 Ų137.776%0.76166%0.657SS**THydrogen-bonded Turntrans-95.1-1.2172.6-78-175.5173.2-167.40114.6K944 E945 A946K944-K948 WeakPolarHBondContact O-CG 3.2Å; E945-K948 PolarHBondContact O-N 2.77Å; A946-K948 PolarHBondContact O-N 3.29Å
949L51Low57.5Low140 Ų140142.5 Ų142.573%0.73368%0.677SS**SBendtrans-1014.8177.2-69.5168.2000112.8A946A946-L949 PolarHBondContact O-N 2.87Å
950F45.9Very low56.8Low193 Ų193137.3 Ų137.385%0.84667%0.669SS**  trans-136.857.3177.6-76.7-78000112.2
951V42.5Very low56.3Low198 Ų198135.5 Ų135.5100%1.267%0.667SS**  trans-139.10159.8-177.30000108.1

Retrieved 951 of 951 residues in 1325.2 ms (Link to these results)