A0A087XNJ8_POEFO Loading...

Filamin A interacting protein 1 like

AlphaFold DB , UniProt , Accession A0A087XNJ8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,167 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
1M32Very low35.1Very low239 Ų239157.8 Ų157.8100%1.17781%0.809SS**  0155.90-93.1161.351.500109.8
2R32.4Very low34.8Very low232 Ų232151.9 Ų151.988%0.87580%0.801SS**  trans1.4111.1166-65.9-179.1174.1-166.3-2.8120
3S35Very low34.8Very low107 Ų107154.2 Ų154.275%0.74880%0.8SS**  67.5150.6111.1-47.80000123.2
4R39.9Very low34.6Very low237 Ų237154.3 Ų154.389%0.89480%0.801SS**  trans87.3139.1162.4-62.9-176.9175-177.1-3117
5S38.2Very low34.2Very low94 Ų94155.5 Ų155.566%0.65780%0.798SS**  cis-172.8163.1-16.4-113.80000112.3
6N34.6Very low34Very low152 Ų152155.1 Ų155.181%0.81380%0.797SS**  trans74.3145.9154.7-66.613.3000118.7
7S36.3Very low33.8Very low96 Ų96150.8 Ų150.867%0.67179%0.79SS**  cis-166.5175.1-16.7-164.30000111.3
8L36.5Very low33.5Very low139 Ų139151.3 Ų151.373%0.72879%0.788SS**  trans75.6144.9167.2-52.5175.2000116.8
9E34.5Very low33.3Very low170 Ų170150.3 Ų150.379%0.79478%0.779SS**  cis-179.9169.6-30.8-117.2170.1-152.200106.8
10D35.1Very low33.1Very low140 Ų140150.3 Ų150.375%0.74978%0.775SS**  -157.8-161-61.2-177.519.7000106.1
11V31.4Very low32.9Very low130 Ų130149.5 Ų149.579%0.78877%0.772SS**  trans81.7122.7170.7-172.50000113.7
12A32.2Very low32.8Very low87 Ų87145.7 Ų145.772%0.71975%0.753SS**  cis-164.8177.5-3.200000110
13K34.4Very low32.8Very low182 Ų182141.2 Ų141.279%0.79175%0.746SS**  cis175.2155.2-34.7-161.2166.2-167.2165.10106.5
14L31.5Very low32.7Very low155 Ų155141.7 Ų141.781%0.81275%0.745SS**  trans77.3148.8178.7-49.6165.7000114.7
15K29.6Very low32.2Very low173 Ų173140.1 Ų140.175%0.75274%0.739SS**  cis-154.8137.57.9-141.8173.8-176-179.10114
16L30.2Very low32.1Very low148 Ų148143 Ų14378%0.77574%0.74SS**  trans45.8131.7147.5-85.3164.7000124.3
17A30.1Very low32Very low83 Ų83142.3 Ų142.369%0.68673%0.732SS**  trans71.8156.9134.300000121.3
18Q29.6Very low31.8Very low160 Ų160142.2 Ų142.275%0.74873%0.731SS**  cis-172.6152.5-25.2179172.7-16.900110.4
19Q29.1Very low31.8Very low132 Ų132139.9 Ų139.962%0.61773%0.732SS**  trans69.9124.5161.3-12688.7-4.500123.3
20Q29.6Very low31.6Very low150 Ų150141.2 Ų141.270%0.70174%0.738SS**  trans51.7121.3130.2-78.2170.2-2700125.7
21N29.3Very low31.5Very low134 Ų134145.4 Ų145.472%0.71774%0.744SS**  71.5135.5123.1-80.87.5000125.5
22M29.1Very low31.4Very low158 Ų158146 Ų14678%0.77874%0.743SS**  trans74.284.9139.9-63.7-63.2-178.400122.2
23D31.6Very low31.2Very low138 Ų138150.2 Ų150.274%0.73875%0.747SS**  63.8140.6105.7-144.5-0.4000123.9
24T32.9Very low31.1Very low118 Ų118150 Ų15072%0.72475%0.749SS**  trans69.4152.9170.481.90000117.1
25R31.3Very low32.2Very low203 Ų203148.8 Ų148.877%0.76675%0.75SS**  cis-169.1140.118.4-152.5-178.6-178.6-168.24113.5
26K35.2Very low32.1Very low155 Ų155144 Ų14467%0.67475%0.749SS**  trans64.4165153.5-79.2172.1154.4-141.60118.5
27Q31.9Very low32.1Very low137 Ų137146.6 Ų146.664%0.6475%0.749SS**  cis-155.5166-2.3-132.1173.5-94.100114.3
28S32.8Very low32.1Very low94 Ų94146.9 Ų146.966%0.65775%0.751SS**  trans3.1157.9147.853.40000122.5
29A36.2Very low32.2Very low91 Ų91144.9 Ų144.975%0.75274%0.742SS**  cis-160.2-161.4-9.300000108.4
30E29.5Very low32.4Very low197 Ų197144.8 Ų144.892%0.92174%0.741SS**  -161.7-162.550.3-76.9-172.7125.200113
31R33.3Very low32.6Very low228 Ų228147 Ų14786%0.8674%0.743SS**  trans-119.8171.4-174.5-71.7-178.8169.8-162.3-1.1112.6
32D30.1Very low32.8Very low144 Ų144145.5 Ų145.577%0.7774%0.743SS**  164.6158122.2-81.1-9.9000110.7
33E28.5Very low33Very low175 Ų175149 Ų14982%0.81875%0.748SS**  cis-147.4-171.8-13.9-128.8-163151.300111
34H32Very low33Very low177 Ų177152.6 Ų152.682%0.81975%0.751SS**  trans-114.6-159.4177.2-81.3-30.5000109.7
35P54Low32.8Very low130 Ų130158.5 Ų158.584%0.84476%0.76SS**  cis-136.5-173.9-6.443.1-24.5000116.1
36G28.4Very low32.7Very low71 Ų71156.5 Ų156.573%0.73276%0.76SS**  trans161.748.7170.900000114.7
37R29.8Very low33.6Very low204 Ų204154.4 Ų154.477%0.7776%0.761SS**  52.696.3105.5-160.4178.9-171.3-173.30.6113.2E39R37-E39 IonicContact CZ-OE1 3.19Å; R37-E39 IonicContact NE-OE1 3.13Å; R37-E39 PolarHBondContact NE-OE1 2.95Å; R37-E39 VanDerWaalsContact NE-OE1 3.16Å; R37-E39 IonicContact NH2-OE1 2.68Å; R37-E39 PolarHBondContact NH2-OE1 3.16Å
38A30.9Very low35Very low89 Ų89153.7 Ų153.774%0.73677%0.769SS**  69.8164.96600000112.3
39E31.4Very low34.8Very low117 Ų117153.4 Ų153.455%0.54777%0.772SS.*  cis-129.1-165.812.8-56.9170.7-135.200108.8R37R37-E39 IonicContact CZ-OE1 3.19Å; R37-E39 IonicContact NE-OE1 3.13Å; R37-E39 PolarHBondContact NE-OE1 2.95Å; R37-E39 VanDerWaalsContact NE-OE1 3.16Å; R37-E39 IonicContact NH2-OE1 2.68Å; R37-E39 PolarHBondContact NH2-OE1 3.16Å
40H33Very low34.5Very low131 Ų131156.6 Ų156.661%0.60678%0.777SS**  cis-162-17713.6-146.557.4000104.2
41R32.3Very low34.6Very low195 Ų195153.6 Ų153.674%0.73677%0.772SS**  cis-162.6111.25-177.4174.1-108.6-172.27.5111.4
42S33.4Very low34.5Very low103 Ų103146.1 Ų146.172%0.7277%0.766SS**  trans67.7154.4147.1-700000121.2
43R33.6Very low34.5Very low232 Ų232145.3 Ų145.388%0.87577%0.766SS**  cis-159.4166.54.4-115.2159-169.8-162.53.3108.1
44R32.4Very low34.6Very low214 Ų214144 Ų14481%0.80877%0.77SS**  cis174.6121.5-37.1-178.3-166.9-154.1-79.2-1107.6
45R28.7Very low34.5Very low242 Ų242144.6 Ų144.691%0.91377%0.773SS**  trans-157.4147.3150.8-151.7169.2-170.3165.24.8111.8
46E28.2Very low33.3Very low161 Ų161149 Ų14975%0.75277%0.773SS**  trans-142.6169.4175.1-104.6-161.614100110
47P54.9Low33.4Very low110 Ų110151.6 Ų151.671%0.71477%0.77SS**  trans-96.6-140.6-167.644-40000111
48P60.6Low33.5Very low122 Ų122148.4 Ų148.479%0.79277%0.768SS**  cis-135.8177.3-20.739.2-21.5000116.2
49A29.2Very low33.5Very low89 Ų89150.7 Ų150.774%0.73677%0.768SS**  trans-159.3134.8148.800000108.2
50N30.8Very low33.5Very low157 Ų157151.6 Ų151.684%0.8478%0.781SS**  54123.865.8-82-1.3000112
51T31.6Very low33.5Very low134 Ų134149.1 Ų149.182%0.82278%0.783SS**  cis-152.4-172.733.748.80000111.9
52G29.5Very low33.6Very low71 Ų71148.8 Ų148.873%0.73279%0.788SS**  trans-145.8138.7160.600000112.3
53T31.9Very low33.6Very low127 Ų127151.2 Ų151.278%0.77979%0.792SS**  trans-161.2134.6170.719.60000109.7
54V29.3Very low33.5Very low149 Ų149146.3 Ų146.390%0.90379%0.794SS**  trans-136.4102.1158.2178.20000106.9
55E30.1Very low33.6Very low188 Ų188141 Ų14188%0.87980%0.796SS**  trans-95.9179.4167.9-83.3-158.8119.100111.4
56R30.1Very low33.6Very low224 Ų224132.9 Ų132.985%0.84579%0.787SS**  trans-93.4163.7-158.7-112.3-179.2177.4123.8-4.6114.4
57N30Very low33.9Very low125 Ų125132.5 Ų132.567%0.66880%0.796SS**  trans75.4108.6148.5-63.8-3.1000120.4
58N32.3Very low33Very low137 Ų137132.2 Ų132.273%0.73380%0.803SS**  48.7126.8108.4-64.77.6000121.9
59N29.5Very low31.5Very low136 Ų136130.3 Ų130.373%0.72781%0.806SS**  trans101.2113.2133.5-69.3-3.7000122
60V32Very low32Very low136 Ų136137.2 Ų137.282%0.82481%0.813SS**  62.3112.4123.3178.20000116.5
61A33.3Very low32.5Very low79 Ų79135.6 Ų135.665%0.65381%0.811SS**  -178154.152.300000113.2
62K34.2Very low32.4Very low189 Ų189136.5 Ų136.582%0.82281%0.811SS**  165.3122.6110.9-90.6174.9-176.8175.70114.3
63N34Very low32.4Very low153 Ų153136.5 Ų136.582%0.81881%0.81SS**  trans36116.1141.2-5410.1000121.3
64S31.6Very low32.3Very low130 Ų130135.6 Ų135.691%0.90981%0.809SS**  -160.1166.8118.440.50000109.5
65A34.2Very low32.4Very low103 Ų103134.1 Ų134.185%0.85181%0.806SS**  trans-115.6142-153.600000115.8
66G29.1Very low32.4Very low71 Ų71129.7 Ų129.773%0.73280%0.801SS**  trans74.5108135.200000119.8
67T33.1Very low32.6Very low152 Ų152123.1 Ų123.193%0.93380%0.795SS**  -166.3138.7122.8-740000107.7
68A36.1Very low32.9Very low104 Ų104129 Ų12986%0.8681%0.808SS**  trans-121.9131.6-173.900000112.5
69G30.6Very low32.9Very low83 Ų83127.1 Ų127.186%0.85681%0.811SS**  trans-139.9129.6172.400000111.5
70R38.3Very low33.4Very low233 Ų233124.3 Ų124.388%0.87981%0.814SS**  trans-116.3151.7167.8-94.3177.6162.3-171.8-5.2106.5
71P41.8Very low33.7Very low123 Ų123129.6 Ų129.680%0.79982%0.819SS**  cis-122.917549.58.917.2000113.2
72N29.8Very low34.2Very low154 Ų154137.9 Ų137.982%0.82483%0.834SS**  cis85101.520.7-159.861.2000115.6
73G29.1Very low34.6Very low70 Ų70136 Ų13672%0.72283%0.827SS**  trans177.478.1-179.400000117.7
74S29.8Very low35Very low109 Ų109137.8 Ų137.876%0.76283%0.828SS**  trans0.9144.8154.754.60000123.5
75S30.6Very low35.5Very low118 Ų118134.8 Ų134.883%0.82582%0.818SS**  trans74.2145.7144.473.20000119.7
76A31.7Very low36.4Very low95 Ų95138.9 Ų138.979%0.78581%0.811SS**  cis-163.8162.6-15.900000113.1
77A33.9Very low37.5Very low86 Ų86143 Ų14371%0.71182%0.816SS**  trans67117.6150.400000121.9
78R36.8Very low39.2Very low248 Ų248140.8 Ų140.894%0.93680%0.798SS**  trans71.4139.1143-70.7177.1173.8175.3-2.2117.9
79A31.6Very low41Very low98 Ų98138.4 Ų138.481%0.8178%0.776SS**  cis-159.7165.2-7.100000112.8
80G40.8Very low43.5Very low76 Ų76143.4 Ų143.478%0.78477%0.769SS**  101.354.7126.600000119.6
81R37.6Very low45.5Very low248 Ų248137.2 Ų137.294%0.93675%0.753SS**  trans-118.1121.4150-73.7-170.1-178.4-111.4-1.5110.7E83R81-E83 PolarHBondContact O-N 3Å
82R44.4Very low47.5Very low253 Ų253135.4 Ų135.496%0.95574%0.736SS**  trans-77.295.6161.6-72.5-178.4176.1-179.1-1.8107.4
83E41.7Very low50.1Low148 Ų148132.2 Ų132.269%0.69272%0.719SS**PPolyproline II helixtrans-62.2150.8156.1-94.2-158.7108.300109.1R81 R86R81-E83 PolarHBondContact O-N 3Å; E83-R86 IonicContact OE1-NH2 2.72Å; E83-R86 PolarHBondContact OE1-NH2 3.1Å; E83-R86 IonicContact OE2-NH2 2.72Å
84K41.9Very low52.7Low191 Ų191132.1 Ų132.183%0.8370%0.704SS**PPolyproline II helixtrans-66.4137173-66176.1179.4177.70108.3R86K84-R86 PolarHBondContact O-N 2.98Å; K84-R86 VanDerWaalsContact O-N 3.1Å
85G42.2Very low55.3Low67 Ų67133.7 Ų133.769%0.69170%0.698SS**PPolyproline II helixtrans-53.9118.9170.500000109.5D87G85-D87 PolarHBondContact O-N 3.13Å
86R54.1Low58Low189 Ų189131.8 Ų131.871%0.71368%0.678SS**  trans-84.5101157.8-58.7176-146.8-148.72.5103.4E83 K84 L88E83-R86 IonicContact OE1-NH2 2.72Å; E83-R86 PolarHBondContact OE1-NH2 3.1Å; E83-R86 IonicContact OE2-NH2 2.72Å; K84-R86 PolarHBondContact O-N 2.98Å; K84-R86 VanDerWaalsContact O-N 3.1Å; R86-L88 VanDerWaalsContact C-N 3.28Å; R86-L88 PolarHBondContact O-N 3.21Å
87D52.6Low60.6Low158 Ų158132.1 Ų132.185%0.84567%0.666SS**  trans-64.796.3176.1-63.8-38.7000107.3G85 S89G85-D87 PolarHBondContact O-N 3.13Å; D87-S89 PolarHBondContact O-N 3.34Å
88L68Low63Low105 Ų105131 Ų13155%0.5565%0.653SS.*  trans-55.6133.8177.2-66.4175.3000107.8R86 D92R86-L88 VanDerWaalsContact C-N 3.28Å; R86-L88 PolarHBondContact O-N 3.21Å; L88-D92 HydrophobicContact CB-CB 4.29Å
89S74.6Confident65.4Low55 Ų55124.1 Ų124.139%0.38563%0.634SS.*  trans-62.7156.6176.8780000109.3D87 D91 D92 L93D87-S89 PolarHBondContact O-N 3.34Å; S89-D91 PolarHBondContact O-N 2.87Å; S89-D91 PolarHBondContact OG-N 3.28Å; S89-D92 WeakPolarHBondContact CB-OD2 3.45Å; S89-D92 PolarHBondContact N-OD2 3.44Å; S89-D92 PolarHBondContact O-N 3.4Å; S89-D92 VanDerWaalsContact O-N 3.13Å; S89-D92 PolarHBondContact OG-N 3.21Å; S89-D92 VanDerWaalsContact OG-N 3.13Å; S89-D92 PolarHBondContact OG-OD2 3.11Å; S89-L93 PolarHBondContact O-N 3.47Å
90R81.6Confident68.1Low188 Ų188123.6 Ų123.671%0.70962%0.617SS**Hα-helixtrans-51.1-35.1176.1-178.7-173.1166.1-76.8-1.9111.6V94R90-V94 VanDerWaalsContact O-CG2 3.3Å; R90-V94 WeakPolarHBondContact O-CG2 3.47Å; R90-V94 PolarHBondContact O-N 3.45Å
91D82Confident70.4Confident103 Ų103126 Ų12655%0.55161%0.608SS**Hα-helixtrans-86.7-28.4-174-54.4-25.7000111.6S89 F95S89-D91 PolarHBondContact O-N 2.87Å; S89-D91 PolarHBondContact OG-N 3.28Å; D91-F95 VanDerWaalsContact O-CB 3.27Å; D91-F95 WeakPolarHBondContact O-CB 3.31Å; D91-F95 PolarHBondContact O-N 3.05Å
92D83.4Confident72.9Confident84 Ų84116.1 Ų116.145%0.44958%0.583SS.*Hα-helixtrans-62.9-42.2164.9-61.3-56.7000111.2L88 S89 F95 L96L88-D92 HydrophobicContact CB-CB 4.29Å; S89-D92 WeakPolarHBondContact CB-OD2 3.45Å; S89-D92 PolarHBondContact N-OD2 3.44Å; S89-D92 PolarHBondContact O-N 3.4Å; S89-D92 VanDerWaalsContact O-N 3.13Å; S89-D92 PolarHBondContact OG-N 3.21Å; S89-D92 VanDerWaalsContact OG-N 3.13Å; S89-D92 PolarHBondContact OG-OD2 3.11Å; D92-F95 PolarHBondContact O-N 3Å; D92-L96 WeakPolarHBondContact O-CB 3.47Å; D92-L96 PolarHBondContact O-N 3.17Å
93L83.6Confident74.9Confident88 Ų88108.5 Ų108.546%0.46156%0.558SS.*Hα-helixtrans-67.1-42.3178.4-179.260.9000111.4S89 L96 L97S89-L93 PolarHBondContact O-N 3.47Å; L93-L96 PolarHBondContact O-N 3.16Å; L93-L97 HydrophobicContact CD1-CD1 4.31Å; L93-L97 HydrophobicContact CD1-CG 4.42Å; L93-L97 HydrophobicContact CG-CD1 4.1Å; L93-L97 WeakPolarHBondContact O-CB 3.45Å; L93-L97 VanDerWaalsContact O-CG 3.23Å; L93-L97 WeakPolarHBondContact O-CG 3.43Å; L93-L97 PolarHBondContact O-N 3.29Å
94V83.6Confident77.2Confident68 Ų68106.5 Ų106.541%0.41255%0.552SS.*Hα-helixtrans-63.6-44.2173.5167.80000111R90 L96 L97 S98R90-V94 VanDerWaalsContact O-CG2 3.3Å; R90-V94 WeakPolarHBondContact O-CG2 3.47Å; R90-V94 PolarHBondContact O-N 3.45Å; V94-L96 PolarHBondContact O-N 3.16Å; V94-L97 PolarHBondContact O-N 3.1Å; V94-S98 PolarHBondContact O-N 3.11Å; V94-S98 PolarHBondContact O-OG 3.46Å
95F85.1Confident79.4Confident142 Ų142103.3 Ų103.362%0.62354%0.54SS*.Hα-helixtrans-60.3-44.5176.5177.5-105.4000112.2D91 D92 S98 L99D91-F95 VanDerWaalsContact O-CB 3.27Å; D91-F95 WeakPolarHBondContact O-CB 3.31Å; D91-F95 PolarHBondContact O-N 3.05Å; D92-F95 PolarHBondContact O-N 3Å; F95-S98 PolarHBondContact O-N 3.24Å; F95-L99 WeakPolarHBondContact O-CB 3.46Å; F95-L99 PolarHBondContact O-N 2.89Å
96L86.6Confident81.3Confident78 Ų78102.5 Ų102.541%0.40853%0.526SS..Hα-helixtrans-67-37.1177.5-173.361.6000112.3D92 L93 V94 L99 L100D92-L96 WeakPolarHBondContact O-CB 3.47Å; D92-L96 PolarHBondContact O-N 3.17Å; L93-L96 PolarHBondContact O-N 3.16Å; V94-L96 PolarHBondContact O-N 3.16Å; L96-L99 PolarHBondContact O-N 3.32Å; L96-L100 HydrophobicContact CG-CD1 4.29Å; L96-L100 VanDerWaalsContact O-CG 3.31Å; L96-L100 WeakPolarHBondContact O-CG 3.25Å; L96-L100 PolarHBondContact O-N 3.49Å
97L85.9Confident82.9Confident101 Ų101100.2 Ų100.253%0.52952%0.518SS..Hα-helixtrans-64.7-45.8174-75.8167.4000111.6L93 V94 L99 L100 E101L93-L97 HydrophobicContact CD1-CD1 4.31Å; L93-L97 HydrophobicContact CD1-CG 4.42Å; L93-L97 HydrophobicContact CG-CD1 4.1Å; L93-L97 WeakPolarHBondContact O-CB 3.45Å; L93-L97 VanDerWaalsContact O-CG 3.23Å; L93-L97 WeakPolarHBondContact O-CG 3.43Å; L93-L97 PolarHBondContact O-N 3.29Å; V94-L97 PolarHBondContact O-N 3.1Å; L97-L99 VanDerWaalsContact C-N 3.27Å; L97-L99 PolarHBondContact O-N 3.29Å; L97-L100 PolarHBondContact O-N 3.26Å; L97-E101 WeakPolarHBondContact O-CB 3.33Å; L97-E101 PolarHBondContact O-N 2.99Å
98S86.1Confident84.4Confident63 Ų6397.3 Ų97.344%0.44150%0.502SS..Hα-helixtrans-64.5-30.2174.8-64.90000113V94 F95 G102V94-S98 PolarHBondContact O-N 3.11Å; V94-S98 PolarHBondContact O-OG 3.46Å; F95-S98 PolarHBondContact O-N 3.24Å; S98-G102 PolarHBondContact O-N 3.29Å
99L86.7Confident85.1Confident104 Ų10498.2 Ų98.255%0.54550%0.503SS..Hα-helixtrans-69.4-41.1174-159.774.4000111.7F95 L96 L97 E103F95-L99 WeakPolarHBondContact O-CB 3.46Å; F95-L99 PolarHBondContact O-N 2.89Å; L96-L99 PolarHBondContact O-N 3.32Å; L97-L99 VanDerWaalsContact C-N 3.27Å; L97-L99 PolarHBondContact O-N 3.29Å; L99-E103 PolarHBondContact O-N 3.02Å
100L87.6Confident85.4Confident86 Ų8699.6 Ų99.645%0.4551%0.509SS..Hα-helixtrans-70.7-35.2176.2-71167.1000112.7L96 L97 E103 L104L96-L100 HydrophobicContact CG-CD1 4.29Å; L96-L100 VanDerWaalsContact O-CG 3.31Å; L96-L100 WeakPolarHBondContact O-CG 3.25Å; L96-L100 PolarHBondContact O-N 3.49Å; L97-L100 PolarHBondContact O-N 3.26Å; L100-E103 PolarHBondContact O-N 3.39Å; L100-L104 WeakPolarHBondContact O-CB 3.46Å; L100-L104 PolarHBondContact O-N 3.38Å
101E89.4Confident85.2Confident128 Ų12894.2 Ų94.260%0.59849%0.494SS*.Hα-helixtrans-61.7-48.3171.9-176.9173.4-153.500110.8L97 E103 L104 Q105L97-E101 WeakPolarHBondContact O-CB 3.33Å; L97-E101 PolarHBondContact O-N 2.99Å; E101-E103 PolarHBondContact O-N 3.42Å; E101-L104 PolarHBondContact O-N 3.43Å; E101-Q105 PolarHBondContact O-N 3.38Å
102G89.1Confident85.2Confident39 Ų3993.5 Ų93.540%0.40249%0.494SS..Hα-helixtrans-62.8-38.2174.200000113.7S98 A106S98-G102 PolarHBondContact O-N 3.29Å; G102-A106 WeakPolarHBondContact O-CB 3.44Å; G102-A106 PolarHBondContact O-N 2.85Å
103E88.3Confident84.8Confident93 Ų9393.6 Ų93.644%0.43550%0.497SS..Hα-helixtrans-68.4-38.3176-163.2-173.4159.400112.2L99 L100 E101 R107L99-E103 PolarHBondContact O-N 3.02Å; L100-E103 PolarHBondContact O-N 3.39Å; E101-E103 PolarHBondContact O-N 3.42Å; E103-R107 WeakPolarHBondContact O-CB 3.44Å; E103-R107 WeakPolarHBondContact O-CD 3.2Å; E103-R107 WeakPolarHBondContact O-CG 3.48Å; E103-R107 PolarHBondContact O-N 3.21Å; E103-R107 VanDerWaalsContact O-N 3.08Å; E103-R107 IonicContact OE1-CZ 2.66Å; E103-R107 VanDerWaalsContact OE1-CZ 3.23Å; E103-R107 IonicContact OE1-NE 3.25Å; E103-R107 PolarHBondContact OE1-NE 3.05Å; E103-R107 VanDerWaalsContact OE1-NE 3.12Å; E103-R107 IonicContact OE1-NH2 3.49Å; E103-R107 PolarHBondContact OE1-NH2 2.79Å
104L88.4Confident84.2Confident107 Ų10794.1 Ų94.156%0.5650%0.5SS*.Hα-helixtrans-63.4-48.7173.2-85.5163.6000111.5L100 E101 A106 R107 D108L100-L104 WeakPolarHBondContact O-CB 3.46Å; L100-L104 PolarHBondContact O-N 3.38Å; E101-L104 PolarHBondContact O-N 3.43Å; L104-A106 VanDerWaalsContact C-N 3.35Å; L104-A106 PolarHBondContact O-N 3.43Å; L104-R107 WeakPolarHBondContact O-CB 3.4Å; L104-R107 PolarHBondContact O-N 3.11Å; L104-R107 VanDerWaalsContact O-N 3.1Å; L104-D108 PolarHBondContact O-N 3.26Å
105Q88.3Confident83.5Confident124 Ų12498.2 Ų98.258%0.57951%0.512SS*.Hα-helixtrans-61.5-42179.8-173.1172.2-13.800112E101 R107 D108 E109E101-Q105 PolarHBondContact O-N 3.38Å; Q105-R107 VanDerWaalsContact C-N 3.31Å; Q105-R107 PolarHBondContact O-N 2.91Å; Q105-D108 PolarHBondContact O-N 3.4Å; Q105-E109 PolarHBondContact O-N 3.5Å
106A83.3Confident82.7Confident49 Ų4995.8 Ų95.841%0.40552%0.518SS..Hα-helixtrans-64-34.517500000112.8G102 L104 V110G102-A106 WeakPolarHBondContact O-CB 3.44Å; G102-A106 PolarHBondContact O-N 2.85Å; L104-A106 VanDerWaalsContact C-N 3.35Å; L104-A106 PolarHBondContact O-N 3.43Å; A106-V110 WeakPolarHBondContact O-CB 3.16Å; A106-V110 VanDerWaalsContact O-CG2 3.31Å; A106-V110 WeakPolarHBondContact O-CG2 3.23Å; A106-V110 PolarHBondContact O-N 3.42Å
107R86.3Confident81.7Confident142 Ų14299.1 Ų99.154%0.53653%0.531SS..Hα-helixtrans-68.5-40.5174-72.9164.5176.2-1382.9111.7E103 L104 Q105 V110 I111E103-R107 WeakPolarHBondContact O-CB 3.44Å; E103-R107 WeakPolarHBondContact O-CD 3.2Å; E103-R107 WeakPolarHBondContact O-CG 3.48Å; E103-R107 PolarHBondContact O-N 3.21Å; E103-R107 VanDerWaalsContact O-N 3.08Å; E103-R107 IonicContact OE1-CZ 2.66Å; E103-R107 VanDerWaalsContact OE1-CZ 3.23Å; E103-R107 IonicContact OE1-NE 3.25Å; E103-R107 PolarHBondContact OE1-NE 3.05Å; E103-R107 VanDerWaalsContact OE1-NE 3.12Å; E103-R107 IonicContact OE1-NH2 3.49Å; E103-R107 PolarHBondContact OE1-NH2 2.79Å; L104-R107 WeakPolarHBondContact O-CB 3.4Å; L104-R107 PolarHBondContact O-N 3.11Å; L104-R107 VanDerWaalsContact O-N 3.1Å; Q105-R107 VanDerWaalsContact C-N 3.31Å; Q105-R107 PolarHBondContact O-N 2.91Å; R107-V110 PolarHBondContact O-N 2.98Å; R107-I111 WeakPolarHBondContact O-CB 3.48Å; R107-I111 WeakPolarHBondContact O-CD1 3.49Å; R107-I111 VanDerWaalsContact O-CG1 3.23Å; R107-I111 WeakPolarHBondContact O-CG1 3.37Å; R107-I111 PolarHBondContact O-N 3.48Å
108D85.3Confident80.2Confident97 Ų97102 Ų10252%0.51954%0.54SS..Hα-helixtrans-70.7-34.5177.4-80.2-27.8000112.8L104 Q105 I111 T112L104-D108 PolarHBondContact O-N 3.26Å; Q105-D108 PolarHBondContact O-N 3.4Å; D108-I111 PolarHBondContact O-N 2.67Å; D108-T112 VanDerWaalsContact O-CB 3.32Å; D108-T112 WeakPolarHBondContact O-CB 3.31Å; D108-T112 PolarHBondContact O-N 3.35Å; D108-T112 PolarHBondContact O-OG1 2.88Å
109E82.9Confident78.9Confident123 Ų123104.6 Ų104.658%0.57555%0.547SS*.Hα-helixtrans-61.9-48.5168.2-76.7-171.9153.800111.3Q105 I111 T112 V113Q105-E109 PolarHBondContact O-N 3.5Å; E109-I111 VanDerWaalsContact C-N 3.33Å; E109-I111 PolarHBondContact O-N 3.47Å; E109-T112 CarbonylContact O-C 3.59Å; E109-T112 WeakPolarHBondContact O-CA 3.37Å; E109-T112 WeakPolarHBondContact O-CB 3.48Å; E109-T112 PolarHBondContact O-N 3.44Å; E109-V113 WeakPolarHBondContact O-CG2 3.27Å; E109-V113 PolarHBondContact O-N 2.9Å
110V79.7Confident77.3Confident84 Ų84104.6 Ų104.651%0.50955%0.548SS..Hα-helixtrans-62.3-38.6176.8168.50000112A106 R107 T112 V113 L114A106-V110 WeakPolarHBondContact O-CB 3.16Å; A106-V110 VanDerWaalsContact O-CG2 3.31Å; A106-V110 WeakPolarHBondContact O-CG2 3.23Å; A106-V110 PolarHBondContact O-N 3.42Å; R107-V110 PolarHBondContact O-N 2.98Å; V110-T112 VanDerWaalsContact C-N 3.3Å; V110-T112 PolarHBondContact O-N 3.49Å; V110-V113 PolarHBondContact O-N 2.92Å; V110-L114 HydrophobicContact CG1-CD1 3.76Å; V110-L114 HydrophobicContact CG1-CG 4.31Å; V110-L114 VanDerWaalsContact O-CB 3.29Å; V110-L114 WeakPolarHBondContact O-CB 3.43Å; V110-L114 VanDerWaalsContact O-CG 3.25Å; V110-L114 WeakPolarHBondContact O-CG 3.4Å; V110-L114 PolarHBondContact O-N 2.89Å
111I78.9Confident75.8Confident75 Ų75106.8 Ų106.839%0.38556%0.56SS.*Hα-helixtrans-66.1-34.1173.5-72.9164.8000111.3R107 D108 E109 K115R107-I111 WeakPolarHBondContact O-CB 3.48Å; R107-I111 WeakPolarHBondContact O-CD1 3.49Å; R107-I111 VanDerWaalsContact O-CG1 3.23Å; R107-I111 WeakPolarHBondContact O-CG1 3.37Å; R107-I111 PolarHBondContact O-N 3.48Å; D108-I111 PolarHBondContact O-N 2.67Å; E109-I111 VanDerWaalsContact C-N 3.33Å; E109-I111 PolarHBondContact O-N 3.47Å; I111-K115 HydrophobicContact CG2-CD 4.1Å; I111-K115 WeakPolarHBondContact O-CB 3.5Å; I111-K115 WeakPolarHBondContact O-CD 3.31Å; I111-K115 WeakPolarHBondContact O-CG 3.37Å; I111-K115 PolarHBondContact O-N 3.37Å
112T80.8Confident74.4Confident89 Ų89103.4 Ų103.455%0.54655%0.553SS.*Hα-helixtrans-71.8-43.4177.2-590000111.2D108 E109 V110 K115 A116D108-T112 VanDerWaalsContact O-CB 3.32Å; D108-T112 WeakPolarHBondContact O-CB 3.31Å; D108-T112 PolarHBondContact O-N 3.35Å; D108-T112 PolarHBondContact O-OG1 2.88Å; E109-T112 CarbonylContact O-C 3.59Å; E109-T112 WeakPolarHBondContact O-CA 3.37Å; E109-T112 WeakPolarHBondContact O-CB 3.48Å; E109-T112 PolarHBondContact O-N 3.44Å; V110-T112 VanDerWaalsContact C-N 3.3Å; V110-T112 PolarHBondContact O-N 3.49Å; T112-K115 PolarHBondContact O-N 3.2Å; T112-A116 PolarHBondContact O-N 3.26Å
113V76.1Confident73.1Confident86 Ų86107.5 Ų107.552%0.52157%0.565SS.*Hα-helixtrans-61.2-49.6172.11740000110.6E109 V110 K115 A116 E117E109-V113 WeakPolarHBondContact O-CG2 3.27Å; E109-V113 PolarHBondContact O-N 2.9Å; V110-V113 PolarHBondContact O-N 2.92Å; V113-K115 PolarHBondContact O-N 2.93Å; V113-A116 CarbonylContact O-C 3.59Å; V113-A116 PolarHBondContact O-N 3.45Å; V113-E117 VanDerWaalsContact O-CB 3.31Å; V113-E117 WeakPolarHBondContact O-CB 3.37Å; V113-E117 PolarHBondContact O-N 3.37Å
114L71.1Confident71.6Confident99 Ų99107.8 Ų107.852%0.51857%0.57SS.*Hα-helixtrans-67.8-13.7178.3-70.1172.9000114.3V110V110-L114 HydrophobicContact CG1-CD1 3.76Å; V110-L114 HydrophobicContact CG1-CG 4.31Å; V110-L114 VanDerWaalsContact O-CB 3.29Å; V110-L114 WeakPolarHBondContact O-CB 3.43Å; V110-L114 VanDerWaalsContact O-CG 3.25Å; V110-L114 WeakPolarHBondContact O-CG 3.4Å; V110-L114 PolarHBondContact O-N 2.89Å
115K68.8Low70.3Confident153 Ų153108.9 Ų108.967%0.66557%0.572SS**Hα-helixtrans-84.6-39.8167.2-79.7168.8-179.3171.80111.6I111 T112 V113I111-K115 HydrophobicContact CG2-CD 4.1Å; I111-K115 WeakPolarHBondContact O-CB 3.5Å; I111-K115 WeakPolarHBondContact O-CD 3.31Å; I111-K115 WeakPolarHBondContact O-CG 3.37Å; I111-K115 PolarHBondContact O-N 3.37Å; T112-K115 PolarHBondContact O-N 3.2Å; V113-K115 PolarHBondContact O-N 2.93Å
116A68.1Low69Low91 Ų91107.3 Ų107.375%0.75258%0.58SS**Hα-helixtrans-71.5-33.7177.200000113T112 V113 K118T112-A116 PolarHBondContact O-N 3.26Å; V113-A116 CarbonylContact O-C 3.59Å; V113-A116 PolarHBondContact O-N 3.45Å; A116-K118 VanDerWaalsContact C-N 3.25Å; A116-K118 PolarHBondContact O-N 3.37Å
117E64.1Low67.7Low148 Ų148113 Ų11369%0.69260%0.595SS**THydrogen-bonded Turntrans-81.2-3.1179.6-162.2169.1-135.400112.6V113 I119V113-E117 VanDerWaalsContact O-CB 3.31Å; V113-E117 WeakPolarHBondContact O-CB 3.37Å; V113-E117 PolarHBondContact O-N 3.37Å; E117-I119 PolarHBondContact O-N 2.81Å
118K56.3Low66.4Low161 Ų161115.7 Ų115.770%0.761%0.607SS**SBendtrans-85.784.5-175-136.5-179.7-175-174.50113.1A116A116-K118 VanDerWaalsContact C-N 3.25Å; A116-K118 PolarHBondContact O-N 3.37Å
119I57Low65Low118 Ų118113.5 Ų113.561%0.60561%0.607SS**  trans77.294.6161.1-51.5164.4000113.9E117 L121E117-I119 PolarHBondContact O-N 2.81Å; I119-L121 HydrophobicContact CG2-CD1 4.45Å; I119-L121 PolarHBondContact O-N 3.43Å
120D54.8Low63.2Low105 Ų105115.6 Ų115.656%0.56162%0.615SS**  trans-62.5112.1148.9172.915.6000108.9A122 L123D120-A122 VanDerWaalsContact C-N 3.31Å; D120-A122 PolarHBondContact O-N 2.88Å; D120-A122 WeakPolarHBondContact OD1-CB 3.42Å; D120-A122 PolarHBondContact OD1-N 3.43Å; D120-L123 HydrophobicContact CB-CB 4.46Å
121L55.7Low61.6Low132 Ų132117.6 Ų117.669%0.69163%0.627SS**Hα-helixtrans-70.1-28.9-176.1-160.665.8000112I119 L124 E125I119-L121 HydrophobicContact CG2-CD1 4.45Å; I119-L121 PolarHBondContact O-N 3.43Å; L121-L124 PolarHBondContact O-N 3.06Å; L121-E125 PolarHBondContact O-N 2.96Å; L121-E125 VanDerWaalsContact O-N 3.17Å
122A59.5Low60.2Low56 Ų56118 Ų11846%0.46363%0.633SS.*Hα-helixtrans-70.1-35.4-178.300000112.2D120 L124 E125 A126D120-A122 VanDerWaalsContact C-N 3.31Å; D120-A122 PolarHBondContact O-N 2.88Å; D120-A122 WeakPolarHBondContact OD1-CB 3.42Å; D120-A122 PolarHBondContact OD1-N 3.43Å; A122-L124 VanDerWaalsContact C-N 3.27Å; A122-L124 PolarHBondContact O-N 3.15Å; A122-E125 PolarHBondContact O-N 3.41Å; A122-A126 WeakPolarHBondContact O-CB 3.47Å; A122-A126 PolarHBondContact O-N 2.91Å
123L61.4Low58.9Low125 Ų125119.6 Ų119.665%0.65465%0.645SS**Hα-helixtrans-67.4-27.6178.5-159.874.9000113D120D120-L123 HydrophobicContact CB-CB 4.46Å
124L57.1Low57.6Low100 Ų100123.6 Ų123.652%0.52466%0.658SS.*Hα-helixtrans-83-39.4176.9-168.562.8000111.6L121 A122 A126 K127 Y128L121-L124 PolarHBondContact O-N 3.06Å; A122-L124 VanDerWaalsContact C-N 3.27Å; A122-L124 PolarHBondContact O-N 3.15Å; L124-A126 VanDerWaalsContact C-N 3.34Å; L124-A126 PolarHBondContact O-N 2.9Å; L124-K127 PolarHBondContact O-N 3.44Å; L124-Y128 HydrophobicContact CD1-CD2 4.24Å; L124-Y128 PolarHBondContact O-N 3.16Å
125E61.2Low57Low130 Ų130126.4 Ų126.461%0.60767%0.666SS**Hα-helixtrans-56.4-47.5171.3-176.8173.7-166.700111.3L121 A122 K127 Y128 G129L121-E125 PolarHBondContact O-N 2.96Å; L121-E125 VanDerWaalsContact O-N 3.17Å; A122-E125 PolarHBondContact O-N 3.41Å; E125-K127 PolarHBondContact O-N 2.67Å; E125-K127 VanDerWaalsContact O-N 3.09Å; E125-Y128 PolarHBondContact O-N 3.25Å; E125-G129 PolarHBondContact O-N 2.75Å
126A60.2Low56.5Low90 Ų90124.1 Ų124.174%0.74466%0.664SS**Hα-helixtrans-62.1-14.9178.500000114.9A122 L124A122-A126 WeakPolarHBondContact O-CB 3.47Å; A122-A126 PolarHBondContact O-N 2.91Å; L124-A126 VanDerWaalsContact C-N 3.34Å; L124-A126 PolarHBondContact O-N 2.9Å
127K55.8Low55.8Low169 Ų169126.5 Ų126.574%0.73566%0.664SS**Hα-helixtrans-104.5-19.2-179.7-105.2-179.8177.61750115.3L124 E125L124-K127 PolarHBondContact O-N 3.44Å; E125-K127 PolarHBondContact O-N 2.67Å; E125-K127 VanDerWaalsContact O-N 3.09Å
128Y60.9Low55.5Low199 Ų199125.9 Ų125.978%0.7866%0.661SS**Hα-helixtrans-133-11-173.7-75.6-72.5000116.8L124 E125L124-Y128 HydrophobicContact CD1-CD2 4.24Å; L124-Y128 PolarHBondContact O-N 3.16Å; E125-Y128 PolarHBondContact O-N 3.25Å
129G54.6Low55.7Low51 Ų51120 Ų12053%0.52664%0.643SS.*  trans66.9118.3159.200000117.8E125 V131E125-G129 PolarHBondContact O-N 2.75Å; G129-V131 PolarHBondContact O-N 2.74Å; G129-V131 VanDerWaalsContact O-N 3.13Å
130F44.9Very low55.6Low167 Ų167120.2 Ų120.273%0.73264%0.644SS**  trans-72.2105.9-178.3-158-72.1000113.1T132F130-T132 HydrophobicContact CD1-CG2 3.93Å; F130-T132 HydrophobicContact CE1-CG2 3.84Å; F130-T132 PolarHBondContact O-N 2.84Å; F130-T132 VanDerWaalsContact O-N 3.1Å
131V47.1Very low55.7Low126 Ų126122.2 Ų122.276%0.76465%0.65SS**  trans-7794.1172.9-178.60000110.3G129G129-V131 PolarHBondContact O-N 2.74Å; G129-V131 VanDerWaalsContact O-N 3.13Å
132T49Very low55.8Low83 Ų83123.9 Ų123.951%0.50965%0.647SS.*  trans-79123.7173.611.30000110.8F130 Q134F130-T132 HydrophobicContact CD1-CG2 3.93Å; F130-T132 HydrophobicContact CE1-CG2 3.84Å; F130-T132 PolarHBondContact O-N 2.84Å; F130-T132 VanDerWaalsContact O-N 3.1Å; T132-Q134 PolarHBondContact O-N 2.75Å
133P54Low55.6Low122 Ų122125.9 Ų125.979%0.79265%0.65SS**THydrogen-bonded Turntrans-80.354.2-171.934.2-38000113.6
134Q48.3Very low55.2Low170 Ų170124 Ų12479%0.79465%0.653SS**THydrogen-bonded Turntrans-142.5-4.2178.4-147158.37.700115.7T132T132-Q134 PolarHBondContact O-N 2.75Å
135K58.6Low55Low158 Ų158126.2 Ų126.269%0.68766%0.664SS**SBendtrans-102-11.2176.4-71.8-178.2177.11760115.2Q138 A139K135-Q138 PolarHBondContact O-N 2.84Å; K135-A139 PolarHBondContact O-N 3.3Å
136V57.3Low54.5Low105 Ų105128.7 Ų128.764%0.63668%0.675SS**Hα-helixtrans-66.8-41.4-177.3-176.10000112.2Q138 A139 L140V136-Q138 VanDerWaalsContact C-N 3.29Å; V136-Q138 PolarHBondContact O-N 2.83Å; V136-A139 WeakPolarHBondContact O-CB 3.41Å; V136-A139 PolarHBondContact O-N 3.35Å; V136-A139 VanDerWaalsContact O-N 3.16Å; V136-L140 PolarHBondContact O-N 2.98Å
137L53.8Low53.8Low141 Ų141127.9 Ų127.974%0.73868%0.675SS**Hα-helixtrans-61.5-35.3176.8-87.2159.9000112.8Q141L137-Q141 PolarHBondContact O-N 3.26Å
138Q58.6Low53Low135 Ų135129.7 Ų129.763%0.63168%0.684SS**Hα-helixtrans-77-22.9177.2-71-177.7-19.400113.4K135 V136K135-Q138 PolarHBondContact O-N 2.84Å; V136-Q138 VanDerWaalsContact C-N 3.29Å; V136-Q138 PolarHBondContact O-N 2.83Å
139A59.4Low52.1Low39 Ų39124.9 Ų124.932%0.32268%0.679SS.*Hα-helixtrans-69.7-53.4170.700000110.4K135 V136 Q141 R142K135-A139 PolarHBondContact O-N 3.3Å; V136-A139 WeakPolarHBondContact O-CB 3.41Å; V136-A139 PolarHBondContact O-N 3.35Å; V136-A139 VanDerWaalsContact O-N 3.16Å; A139-Q141 PolarHBondContact O-N 3.14Å; A139-Q141 VanDerWaalsContact O-N 3.17Å; A139-R142 PolarHBondContact O-N 3.08Å
140L55.1Low51.2Low122 Ų122129 Ų12964%0.63969%0.689SS**Hα-helixtrans-59.6-29.9-177.4-164.169.1000113V136 R142 D143 A144V136-L140 PolarHBondContact O-N 2.98Å; L140-R142 VanDerWaalsContact C-N 3.3Å; L140-R142 PolarHBondContact O-N 3.44Å; L140-D143 PolarHBondContact O-N 2.9Å; L140-A144 PolarHBondContact O-N 3.25Å
141Q57.1Low51.4Low146 Ų146126 Ų12668%0.68268%0.684SS**Hα-helixtrans-72.3-16177.6-125.7176.3-4.300114.7L137 A139L137-Q141 PolarHBondContact O-N 3.26Å; A139-Q141 PolarHBondContact O-N 3.14Å; A139-Q141 VanDerWaalsContact O-N 3.17Å
142R58.2Low51.2Low168 Ų168129.9 Ų129.963%0.63469%0.691SS**Hα-helixtrans-84.1-43.2170.7-58179.7-51.1145.922.8111.2A139 L140 A144 I145A139-R142 PolarHBondContact O-N 3.08Å; L140-R142 VanDerWaalsContact C-N 3.3Å; L140-R142 PolarHBondContact O-N 3.44Å; R142-A144 PolarHBondContact O-N 3.34Å; R142-I145 PolarHBondContact O-N 3.17Å
143D54.7Low51.4Low97 Ų97135 Ų13552%0.51971%0.709SS.*Hα-helixtrans-68.3-22.4-170.3-53.6-15.4000111.2L140 I145L140-D143 PolarHBondContact O-N 2.9Å; D143-I145 PolarHBondContact O-N 3.39Å
144A53.4Low51.3Low86 Ų86136 Ų13671%0.71170%0.703SS**THydrogen-bonded Turntrans-62.5-1217000000115.6L140 R142L140-A144 PolarHBondContact O-N 3.25Å; R142-A144 PolarHBondContact O-N 3.34Å
145I53.6Low51.8Low147 Ų147132.8 Ų132.875%0.75469%0.691SS**THydrogen-bonded Turntrans-105-3.8-173.1-47.7-177.7000112.2R142 D143R142-I145 PolarHBondContact O-N 3.17Å; D143-I145 PolarHBondContact O-N 3.39Å
146Q49.5Very low52Low181 Ų181131.6 Ų131.685%0.84669%0.691SS**  trans-11935.7-172.7-151.6153.432.400115.1K148Q146-K148 PolarHBondContact O-N 3.35Å
147G45.7Very low52.5Low73 Ų73135 Ų13575%0.75369%0.694SS**  trans-72.2122.3167.100000112.5
148K39.5Very low53.5Low208 Ų208135.1 Ų135.190%0.90469%0.691SS**  trans-135.8141.8153.9-76.8-163173.7-171.60109.5Q146Q146-K148 PolarHBondContact O-N 3.35Å
149S40.9Very low54.3Low98 Ų98133.6 Ų133.669%0.68568%0.682SS**  trans-75.2164.6176.660.10000110
150D37.3Very low55.3Low138 Ų138135.3 Ų135.374%0.73869%0.69SS**  -142.1133.360.8-81.6-19.8000116.5
151V48.2Very low56.5Low104 Ų104134.3 Ų134.363%0.6368%0.683SS**  49.8114.2121.6-174.50000118.8
152F42.3Very low57.8Low206 Ų206129.2 Ų129.290%0.90467%0.666SS**  -159.8161.1110.4-97.3-66.9000110.2
153Q53.9Low59.1Low192 Ų192127.4 Ų127.490%0.89766%0.664SS**  trans-92.5135.6-176.2-66.2173.8-80.800112.1
154E52.4Low60.6Low142 Ų142127 Ų12766%0.66466%0.662SS**  trans-147.8159.2163.3-99.1172.2104.200108.5I156 K159E154-I156 PolarHBondContact O-N 3.43Å; E154-K159 VanDerWaalsContact CD-CE 3.43Å; E154-K159 WeakPolarHBondContact OE1-CE 3.16Å; E154-K159 IonicContact OE1-NZ 2.92Å; E154-K159 PolarHBondContact OE1-NZ 2.68Å; E154-K159 IonicContact OE2-NZ 2.64Å; E154-K159 PolarHBondContact OE2-NZ 2.9Å
155D57.3Low62.3Low102 Ų102127.7 Ų127.755%0.54565%0.654SS.*  trans-66.5131.6-178.1-163-35.6000111.2Y157 E158D155-Y157 PolarHBondContact O-N 3.04Å; D155-Y157 PolarHBondContact OD1-N 3.31Å; D155-Y157 VanDerWaalsContact OD1-N 3.13Å; D155-E158 HydrophobicContact CB-CB 4.35Å
156I64Low64Low134 Ų134127.3 Ų127.369%0.68765%0.646SS**THydrogen-bonded Turntrans-65.9-26.4-173.2-59.2174.7000111.3E154 P160E154-I156 PolarHBondContact O-N 3.43Å; I156-P160 WeakPolarHBondContact O-CD 3.46Å
157Y66.9Low66.1Low177 Ų177123.8 Ų123.869%0.69463%0.633SS**THydrogen-bonded Turntrans-101.3-20.1-173-63.5-79.7000115D155 M161D155-Y157 PolarHBondContact O-N 3.04Å; D155-Y157 PolarHBondContact OD1-N 3.31Å; D155-Y157 VanDerWaalsContact OD1-N 3.13Å; Y157-M161 WeakPolarHBondContact O-CB 3.47Å; Y157-M161 WeakPolarHBondContact O-CG 3.38Å; Y157-M161 PolarHBondContact O-N 3.27Å
158E75.6Confident68.2Low143 Ų143122.4 Ų122.467%0.66861%0.61SS**Hα-helixtrans-70.4-44.6-173.4-170.8169.5-161.600112.4D155 M161 A162D155-E158 HydrophobicContact CB-CB 4.35Å; E158-M161 PolarHBondContact O-N 2.84Å; E158-A162 WeakPolarHBondContact O-CB 3.44Å; E158-A162 PolarHBondContact O-N 3.29Å
159K75.6Confident70.7Confident103 Ų103116.8 Ų116.845%0.44859%0.587SS.*Hα-helixtrans-65.1-48.9179.2-65.7178.4-178.1176.10113.2E154 M161 A162 E163E154-K159 VanDerWaalsContact CD-CE 3.43Å; E154-K159 WeakPolarHBondContact OE1-CE 3.16Å; E154-K159 IonicContact OE1-NZ 2.92Å; E154-K159 PolarHBondContact OE1-NZ 2.68Å; E154-K159 IonicContact OE2-NZ 2.64Å; E154-K159 PolarHBondContact OE2-NZ 2.9Å; K159-M161 VanDerWaalsContact C-N 3.33Å; K159-M161 PolarHBondContact O-N 3.41Å; K159-A162 PolarHBondContact O-N 3.1Å; K159-E163 WeakPolarHBondContact O-CG 3.49Å; K159-E163 PolarHBondContact O-N 3.43Å
160P79Confident73.2Confident75 Ų75119.1 Ų119.149%0.48759%0.585SS.*Hα-helixtrans-60.5-38.4176.9-25.335.7000113.6I156 E163 L164I156-P160 WeakPolarHBondContact O-CD 3.46Å; P160-E163 PolarHBondContact O-N 2.78Å; P160-L164 WeakPolarHBondContact O-CB 3.43Å; P160-L164 PolarHBondContact O-N 3.25Å
161M81.9Confident75.7Confident101 Ų101117.4 Ų117.450%0.49857%0.572SS.*Hα-helixtrans-66.9-45.9175.9-74.3-58.8-57.600111.7Y157 E158 K159 E163 L164 D165Y157-M161 WeakPolarHBondContact O-CB 3.47Å; Y157-M161 WeakPolarHBondContact O-CG 3.38Å; Y157-M161 PolarHBondContact O-N 3.27Å; E158-M161 PolarHBondContact O-N 2.84Å; K159-M161 VanDerWaalsContact C-N 3.33Å; K159-M161 PolarHBondContact O-N 3.41Å; M161-E163 PolarHBondContact O-N 2.8Å; M161-L164 PolarHBondContact O-N 2.99Å; M161-L164 VanDerWaalsContact O-N 3.12Å; M161-L164 HydrophobicContact SD-CD2 4.43Å; M161-D165 PolarHBondContact O-N 2.86Å
162A83.5Confident77.9Confident38 Ų38119.4 Ų119.431%0.31457%0.568SS.*Hα-helixtrans-65.4-23176.700000113.4E158 K159 K166E158-A162 WeakPolarHBondContact O-CB 3.44Å; E158-A162 PolarHBondContact O-N 3.29Å; K159-A162 PolarHBondContact O-N 3.1Å; A162-K166 WeakPolarHBondContact O-CD 3.26Å; A162-K166 WeakPolarHBondContact O-CE 3.42Å; A162-K166 WeakPolarHBondContact O-CG 3.33Å; A162-K166 PolarHBondContact O-N 2.8Å
163E84.8Confident80.3Confident130 Ų130112.2 Ų112.261%0.60754%0.537SS*.Hα-helixtrans-80.6-37.4170.1-74.5-178.7-172.800112.6K159 P160 M161 K166 L167K159-E163 WeakPolarHBondContact O-CG 3.49Å; K159-E163 PolarHBondContact O-N 3.43Å; P160-E163 PolarHBondContact O-N 2.78Å; M161-E163 PolarHBondContact O-N 2.8Å; E163-K166 PolarHBondContact O-N 2.94Å; E163-L167 PolarHBondContact O-N 3.43Å
164L86.2Confident82.1Confident88 Ų88106.5 Ų106.546%0.46152%0.516SS..Hα-helixtrans-64-43.5174.3-176.860.4000111.9P160 M161 K166 L167 V168P160-L164 WeakPolarHBondContact O-CB 3.43Å; P160-L164 PolarHBondContact O-N 3.25Å; M161-L164 PolarHBondContact O-N 2.99Å; M161-L164 VanDerWaalsContact O-N 3.12Å; M161-L164 HydrophobicContact SD-CD2 4.43Å; L164-K166 PolarHBondContact O-N 3.44Å; L164-L167 WeakPolarHBondContact O-CB 3.48Å; L164-L167 PolarHBondContact O-N 2.88Å; L164-L167 VanDerWaalsContact O-N 3.11Å; L164-V168 WeakPolarHBondContact O-CG2 3.23Å; L164-V168 PolarHBondContact O-N 2.9Å
165D89Confident84Confident101 Ų101104.4 Ų104.454%0.5451%0.506SS..Hα-helixtrans-64.3-39.5175.6-79-34000112M161 L167 V168 E169M161-D165 PolarHBondContact O-N 2.86Å; D165-L167 VanDerWaalsContact C-N 3.28Å; D165-L167 PolarHBondContact O-N 3.35Å; D165-V168 PolarHBondContact O-N 2.72Å; D165-E169 WeakPolarHBondContact O-CB 3.23Å; D165-E169 PolarHBondContact O-N 2.73Å
166K90.6Very high85.8Confident139 Ų139105.4 Ų105.460%0.60450%0.502SS*.Hα-helixtrans-62-35.9171.6-72.2164.1-161.5153.80111.8A162 E163 L164 K170A162-K166 WeakPolarHBondContact O-CD 3.26Å; A162-K166 WeakPolarHBondContact O-CE 3.42Å; A162-K166 WeakPolarHBondContact O-CG 3.33Å; A162-K166 PolarHBondContact O-N 2.8Å; E163-K166 PolarHBondContact O-N 2.94Å; L164-K166 PolarHBondContact O-N 3.44Å; K166-K170 WeakPolarHBondContact O-CB 3.46Å; K166-K170 PolarHBondContact O-N 3.44Å
167L92.5Very high87.3Confident108 Ų108105.5 Ų105.557%0.56549%0.494SS*.Hα-helixtrans-70-43.9175.9-178.362000111.7E163 L164 D165 K170 Q171E163-L167 PolarHBondContact O-N 3.43Å; L164-L167 WeakPolarHBondContact O-CB 3.48Å; L164-L167 PolarHBondContact O-N 2.88Å; L164-L167 VanDerWaalsContact O-N 3.11Å; D165-L167 VanDerWaalsContact C-N 3.28Å; D165-L167 PolarHBondContact O-N 3.35Å; L167-K170 PolarHBondContact O-N 2.82Å; L167-Q171 WeakPolarHBondContact O-CB 3.43Å; L167-Q171 PolarHBondContact O-N 3.25Å
168V91.6Very high88.6Confident44 Ų44102.7 Ų102.727%0.26749%0.488SS..Hα-helixtrans-63.5-44176.8169.80000111.2L164 D165 Q171 R172L164-V168 WeakPolarHBondContact O-CG2 3.23Å; L164-V168 PolarHBondContact O-N 2.9Å; D165-V168 PolarHBondContact O-N 2.72Å; V168-Q171 WeakPolarHBondContact O-CB 3.35Å; V168-Q171 PolarHBondContact O-N 2.72Å; V168-R172 WeakPolarHBondContact O-CG 3.26Å; V168-R172 PolarHBondContact O-N 2.82Å
169E91.9Very high89.5Confident89 Ų89101.5 Ų101.542%0.41649%0.486SS..Hα-helixtrans-71-35.3178.2-159.955.5-135.800111.7D165 Q171 R172 E173D165-E169 WeakPolarHBondContact O-CB 3.23Å; D165-E169 PolarHBondContact O-N 2.73Å; E169-Q171 VanDerWaalsContact C-N 3.29Å; E169-Q171 PolarHBondContact O-N 2.76Å; E169-R172 PolarHBondContact O-N 3.37Å; E169-R172 WeakPolarHBondContact OE2-CD 3.34Å; E169-R172 IonicContact OE2-CZ 2.58Å; E169-R172 IonicContact OE2-NE 2.65Å; E169-R172 IonicContact OE2-NH1 3.67Å; E169-R172 PolarHBondContact OE2-NH1 2.85Å; E169-E173 WeakPolarHBondContact O-CB 3.38Å; E169-E173 PolarHBondContact O-N 3.11Å
170K92.3Very high90.4Very high148 Ų148102.8 Ų102.864%0.64349%0.494SS*.Hα-helixtrans-63.8-33.2169.5-173.1175.1-178.3-1800112.4K166 L167 T174K166-K170 WeakPolarHBondContact O-CB 3.46Å; K166-K170 PolarHBondContact O-N 3.44Å; L167-K170 PolarHBondContact O-N 2.82Å; K170-T174 WeakPolarHBondContact O-CG2 3.36Å; K170-T174 PolarHBondContact O-N 2.96Å; K170-T174 PolarHBondContact O-OG1 3.36Å
171Q90.2Very high91.2Very high101 Ų101105.8 Ų105.847%0.47250%0.501SS..Hα-helixtrans-71.4-40.9173.9-172.8-179.116.300111.8L167 V168 E169 E173 T174 H175L167-Q171 WeakPolarHBondContact O-CB 3.43Å; L167-Q171 PolarHBondContact O-N 3.25Å; V168-Q171 WeakPolarHBondContact O-CB 3.35Å; V168-Q171 PolarHBondContact O-N 2.72Å; E169-Q171 VanDerWaalsContact C-N 3.29Å; E169-Q171 PolarHBondContact O-N 2.76Å; Q171-E173 VanDerWaalsContact C-N 3.31Å; Q171-E173 PolarHBondContact O-N 2.87Å; Q171-T174 PolarHBondContact O-N 3.35Å; Q171-T174 PolarHBondContact O-OG1 3.08Å; Q171-T174 VanDerWaalsContact O-OG1 3.11Å; Q171-H175 PolarHBondContact NE2-CE1 3.5Å; Q171-H175 VanDerWaalsContact O-CB 3.31Å; Q171-H175 WeakPolarHBondContact O-CB 3.28Å; Q171-H175 PolarHBondContact O-CD2 2.88Å; Q171-H175 PolarHBondContact O-N 2.68Å
172R93.8Very high91.8Very high146 Ų146106.4 Ų106.455%0.55151%0.506SS*.Hα-helixtrans-59.9-43.2171.4-71.3164.8177164.63111V168 E169 R176V168-R172 WeakPolarHBondContact O-CG 3.26Å; V168-R172 PolarHBondContact O-N 2.82Å; E169-R172 PolarHBondContact O-N 3.37Å; E169-R172 WeakPolarHBondContact OE2-CD 3.34Å; E169-R172 IonicContact OE2-CZ 2.58Å; E169-R172 IonicContact OE2-NE 2.65Å; E169-R172 IonicContact OE2-NH1 3.67Å; E169-R172 PolarHBondContact OE2-NH1 2.85Å; R172-R176 WeakPolarHBondContact O-CB 3.26Å; R172-R176 PolarHBondContact O-N 2.89Å
173E94.2Very high92.4Very high55 Ų55108.6 Ų108.626%0.25751%0.512SS..Hα-helixtrans-61.1-48.3176.3-174.561.9-147.500112.5E169 Q171 R176 R177E169-E173 WeakPolarHBondContact O-CB 3.38Å; E169-E173 PolarHBondContact O-N 3.11Å; Q171-E173 VanDerWaalsContact C-N 3.31Å; Q171-E173 PolarHBondContact O-N 2.87Å; E173-R176 PolarHBondContact O-N 3.35Å; E173-R176 IonicContact OE1-NH1 2.66Å; E173-R176 PolarHBondContact OE1-NH1 3.24Å; E173-R176 IonicContact OE2-CZ 3.66Å; E173-R176 IonicContact OE2-NH1 3.93Å; E173-R176 PolarHBondContact OE2-NH1 2.8Å; E173-R176 IonicContact OE2-NH2 2.67Å; E173-R176 PolarHBondContact OE2-NH2 2.96Å; E173-R177 WeakPolarHBondContact O-CG 3.4Å; E173-R177 PolarHBondContact O-N 2.9Å; E173-R177 VanDerWaalsContact O-N 3.08Å; E173-R177 IonicContact OE1-CZ 3.65Å; E173-R177 IonicContact OE1-NE 3.81Å; E173-R177 PolarHBondContact OE1-NE 3.21Å; E173-R177 IonicContact OE1-NH2 2.71Å; E173-R177 PolarHBondContact OE1-NH2 3.24Å
174T91.8Very high92.9Very high73 Ų73108.1 Ų108.145%0.44851%0.511SS..Hα-helixtrans-68.7-39.6178.154.40000112.3K170 Q171 R176 R177 M178K170-T174 WeakPolarHBondContact O-CG2 3.36Å; K170-T174 PolarHBondContact O-N 2.96Å; K170-T174 PolarHBondContact O-OG1 3.36Å; Q171-T174 PolarHBondContact O-N 3.35Å; Q171-T174 PolarHBondContact O-OG1 3.08Å; Q171-T174 VanDerWaalsContact O-OG1 3.11Å; T174-R176 VanDerWaalsContact C-N 3.33Å; T174-R176 PolarHBondContact O-N 3.49Å; T174-R177 PolarHBondContact O-N 2.79Å; T174-M178 VanDerWaalsContact O-CB 3.25Å; T174-M178 WeakPolarHBondContact O-CB 3.39Å; T174-M178 PolarHBondContact O-N 3.46Å
175H91.9Very high93.3Very high97 Ų97108.5 Ų108.545%0.44952%0.517SS..Hα-helixtrans-60.4-41.2173.9-71.7-179.6000111.8Q171 M178 L179Q171-H175 PolarHBondContact NE2-CE1 3.5Å; Q171-H175 VanDerWaalsContact O-CB 3.31Å; Q171-H175 WeakPolarHBondContact O-CB 3.28Å; Q171-H175 PolarHBondContact O-CD2 2.88Å; Q171-H175 PolarHBondContact O-N 2.68Å; H175-M178 PolarHBondContact O-N 3.49Å; H175-L179 WeakPolarHBondContact O-CB 3.47Å; H175-L179 PolarHBondContact O-N 3.37Å
176R95Very high93.6Very high123 Ų123107.8 Ų107.846%0.46451%0.51SS..Hα-helixtrans-64.3-48.2177.7-154.1-168.8-36.2100.12.4111.8R172 E173 T174 M178 L179 E180R172-R176 WeakPolarHBondContact O-CB 3.26Å; R172-R176 PolarHBondContact O-N 2.89Å; E173-R176 PolarHBondContact O-N 3.35Å; E173-R176 IonicContact OE1-NH1 2.66Å; E173-R176 PolarHBondContact OE1-NH1 3.24Å; E173-R176 IonicContact OE2-CZ 3.66Å; E173-R176 IonicContact OE2-NH1 3.93Å; E173-R176 PolarHBondContact OE2-NH1 2.8Å; E173-R176 IonicContact OE2-NH2 2.67Å; E173-R176 PolarHBondContact OE2-NH2 2.96Å; T174-R176 VanDerWaalsContact C-N 3.33Å; T174-R176 PolarHBondContact O-N 3.49Å; R176-M178 VanDerWaalsContact C-N 3.33Å; R176-M178 PolarHBondContact O-N 3.38Å; R176-L179 PolarHBondContact O-N 2.89Å; R176-E180 WeakPolarHBondContact O-CB 3.5Å; R176-E180 PolarHBondContact O-N 2.93Å
177R94Very high93.8Very high137 Ų137105.4 Ų105.452%0.51750%0.501SS..Hα-helixtrans-62.8-37.9176.8-68.1177-167.1-169.82.9112.4E173 T174 E180 Q181E173-R177 WeakPolarHBondContact O-CG 3.4Å; E173-R177 PolarHBondContact O-N 2.9Å; E173-R177 VanDerWaalsContact O-N 3.08Å; E173-R177 IonicContact OE1-CZ 3.65Å; E173-R177 IonicContact OE1-NE 3.81Å; E173-R177 PolarHBondContact OE1-NE 3.21Å; E173-R177 IonicContact OE1-NH2 2.71Å; E173-R177 PolarHBondContact OE1-NH2 3.24Å; T174-R177 PolarHBondContact O-N 2.79Å; R177-E180 PolarHBondContact O-N 3.23Å; R177-Q181 WeakPolarHBondContact O-CB 3.34Å; R177-Q181 VanDerWaalsContact O-CG 3.31Å; R177-Q181 WeakPolarHBondContact O-CG 3.43Å; R177-Q181 PolarHBondContact O-N 2.92Å
178M94.4Very high93.9Very high118 Ų118102.9 Ų102.958%0.58150%0.496SS*.Hα-helixtrans-65-41.4176.1-178.6175.26600111.6T174 H175 R176 L182T174-M178 VanDerWaalsContact O-CB 3.25Å; T174-M178 WeakPolarHBondContact O-CB 3.39Å; T174-M178 PolarHBondContact O-N 3.46Å; H175-M178 PolarHBondContact O-N 3.49Å; R176-M178 VanDerWaalsContact C-N 3.33Å; R176-M178 PolarHBondContact O-N 3.38Å; M178-L182 VanDerWaalsContact O-CB 3.3Å; M178-L182 WeakPolarHBondContact O-CB 3.25Å; M178-L182 PolarHBondContact O-N 3.44Å
179L95.6Very high94.1Very high118 Ų118106 Ų10662%0.61851%0.507SS*.Hα-helixtrans-66.6-40.6175.6-177.361.6000112H175 R176 L182 L183H175-L179 WeakPolarHBondContact O-CB 3.47Å; H175-L179 PolarHBondContact O-N 3.37Å; R176-L179 PolarHBondContact O-N 2.89Å; L179-L182 PolarHBondContact O-N 2.82Å; L179-L183 WeakPolarHBondContact O-CB 3.48Å; L179-L183 PolarHBondContact O-N 2.84Å
180E94.7Very high94.3Very high130 Ų130106.2 Ų106.261%0.60751%0.507SS*.Hα-helixtrans-64.1-44.8175.6-174.9174.4-158.800112R176 R177 L183 M184R176-E180 WeakPolarHBondContact O-CB 3.5Å; R176-E180 PolarHBondContact O-N 2.93Å; R177-E180 PolarHBondContact O-N 3.23Å; E180-L183 PolarHBondContact O-N 2.7Å; E180-M184 WeakPolarHBondContact O-CG 3.47Å; E180-M184 PolarHBondContact O-N 3.11Å
181Q94.4Very high94.4Very high137 Ų137104.9 Ų104.964%0.6450%0.503SS*.Hα-helixtrans-62.6-42.4173-74.9178.3-1.400112.1R177 L183 M184 V185R177-Q181 WeakPolarHBondContact O-CB 3.34Å; R177-Q181 VanDerWaalsContact O-CG 3.31Å; R177-Q181 WeakPolarHBondContact O-CG 3.43Å; R177-Q181 PolarHBondContact O-N 2.92Å; Q181-L183 VanDerWaalsContact C-N 3.34Å; Q181-L183 PolarHBondContact O-N 2.76Å; Q181-M184 PolarHBondContact O-N 3.11Å; Q181-V185 WeakPolarHBondContact O-CG2 3.33Å; Q181-V185 PolarHBondContact O-N 2.8Å
182L95.1Very high94.7Very high114 Ų114102.2 Ų102.260%0.59750%0.498SS*.Hα-helixtrans-61.9-42.2176.7-177.962.4000111.4M178 L179 V185 E186M178-L182 VanDerWaalsContact O-CB 3.3Å; M178-L182 WeakPolarHBondContact O-CB 3.25Å; M178-L182 PolarHBondContact O-N 3.44Å; L179-L182 PolarHBondContact O-N 2.82Å; L182-V185 PolarHBondContact O-N 2.9Å; L182-E186 WeakPolarHBondContact O-CB 3.32Å; L182-E186 PolarHBondContact O-N 3.17Å
183L96Very high94.8Very high84 Ų8499.5 Ų99.544%0.4449%0.494SS..Hα-helixtrans-64-42.5175.7-179.662.4000111.9L179 E180 Q181 E186 Q187L179-L183 WeakPolarHBondContact O-CB 3.48Å; L179-L183 PolarHBondContact O-N 2.84Å; E180-L183 PolarHBondContact O-N 2.7Å; Q181-L183 VanDerWaalsContact C-N 3.34Å; Q181-L183 PolarHBondContact O-N 2.76Å; L183-E186 PolarHBondContact O-N 3.34Å; L183-Q187 HydrophobicContact CD1-CG 4.42Å; L183-Q187 WeakPolarHBondContact O-CB 3.36Å; L183-Q187 WeakPolarHBondContact O-CG 3.42Å; L183-Q187 PolarHBondContact O-N 2.86Å
184M95.7Very high94.9Very high121 Ų121105.5 Ų105.560%0.59652%0.516SS*.Hα-helixtrans-63.8-40.2175.6-72.9-61.8-68.300112.2E180 Q181 A188E180-M184 WeakPolarHBondContact O-CG 3.47Å; E180-M184 PolarHBondContact O-N 3.11Å; Q181-M184 PolarHBondContact O-N 3.11Å; M184-A188 WeakPolarHBondContact O-CB 3.31Å; M184-A188 PolarHBondContact O-N 2.9Å
185V95.4Very high95.1Very high96 Ų96108.6 Ų108.658%0.58252%0.523SS*.Hα-helixtrans-66.1-41173.8170.20000111.3Q181 L182 A188 H189Q181-V185 WeakPolarHBondContact O-CG2 3.33Å; Q181-V185 PolarHBondContact O-N 2.8Å; L182-V185 PolarHBondContact O-N 2.9Å; V185-A188 PolarHBondContact O-N 3.41Å; V185-H189 VanDerWaalsContact O-CB 3.27Å; V185-H189 WeakPolarHBondContact O-CB 3.48Å; V185-H189 PolarHBondContact O-N 3.24Å
186E94.1Very high95.3Very high86 Ų86108.8 Ų108.840%0.40253%0.527SS..Hα-helixtrans-64.2-42.8177-161.3-149.5-172.700111.6L182 L183 H189 K190L182-E186 WeakPolarHBondContact O-CB 3.32Å; L182-E186 PolarHBondContact O-N 3.17Å; L183-E186 PolarHBondContact O-N 3.34Å; E186-H189 PolarHBondContact O-N 2.86Å; E186-K190 VanDerWaalsContact CD-CE 3.45Å; E186-K190 WeakPolarHBondContact O-CB 3.23Å; E186-K190 VanDerWaalsContact O-CG 3.3Å; E186-K190 WeakPolarHBondContact O-CG 3.44Å; E186-K190 PolarHBondContact O-N 2.99Å; E186-K190 WeakPolarHBondContact OE1-CE 3.43Å; E186-K190 IonicContact OE1-NZ 2.64Å; E186-K190 PolarHBondContact OE1-NZ 3.13Å; E186-K190 IonicContact OE2-NZ 2.65Å; E186-K190 PolarHBondContact OE2-NZ 2.64Å
187Q95.1Very high95.3Very high89 Ų89106.5 Ų106.542%0.41652%0.521SS..Hα-helixtrans-64.8-44.9175.1-71.9-17925.100111.9L183 H189 K190 Q191L183-Q187 HydrophobicContact CD1-CG 4.42Å; L183-Q187 WeakPolarHBondContact O-CB 3.36Å; L183-Q187 WeakPolarHBondContact O-CG 3.42Å; L183-Q187 PolarHBondContact O-N 2.86Å; Q187-H189 VanDerWaalsContact C-N 3.33Å; Q187-H189 PolarHBondContact O-N 3.24Å; Q187-K190 PolarHBondContact O-N 2.72Å; Q187-Q191 WeakPolarHBondContact O-CG 3.31Å; Q187-Q191 PolarHBondContact O-N 3.21Å
188A94.8Very high95.3Very high55 Ų55103.4 Ų103.446%0.45552%0.515SS..Hα-helixtrans-62.6-39.6175.500000112M184 V185 Q191 A192M184-A188 WeakPolarHBondContact O-CB 3.31Å; M184-A188 PolarHBondContact O-N 2.9Å; V185-A188 PolarHBondContact O-N 3.41Å; A188-Q191 PolarHBondContact O-N 3.35Å; A188-A192 PolarHBondContact O-N 2.85Å
189H95Very high95.4Very high109 Ų109103.7 Ų103.751%0.50552%0.515SS..Hα-helixtrans-65.7-43.6175.7-175.258.3000112V185 E186 Q187 Q191 A192 L193V185-H189 VanDerWaalsContact O-CB 3.27Å; V185-H189 WeakPolarHBondContact O-CB 3.48Å; V185-H189 PolarHBondContact O-N 3.24Å; E186-H189 PolarHBondContact O-N 2.86Å; Q187-H189 VanDerWaalsContact C-N 3.33Å; Q187-H189 PolarHBondContact O-N 3.24Å; H189-Q191 VanDerWaalsContact C-N 3.33Å; H189-Q191 PolarHBondContact O-N 3.44Å; H189-A192 PolarHBondContact O-N 3.48Å; H189-A192 VanDerWaalsContact O-N 3.16Å; H189-L193 WeakPolarHBondContact O-CG 3.38Å; H189-L193 PolarHBondContact O-N 3.39Å
190K96.1Very high95.4Very high94 Ų94104 Ų10441%0.40951%0.511SS..Hα-helixtrans-57.5-44.2172.4-73.9166.8-177.3168.30111.5E186 Q187 A192 L193 Y194E186-K190 VanDerWaalsContact CD-CE 3.45Å; E186-K190 WeakPolarHBondContact O-CB 3.23Å; E186-K190 VanDerWaalsContact O-CG 3.3Å; E186-K190 WeakPolarHBondContact O-CG 3.44Å; E186-K190 PolarHBondContact O-N 2.99Å; E186-K190 WeakPolarHBondContact OE1-CE 3.43Å; E186-K190 IonicContact OE1-NZ 2.64Å; E186-K190 PolarHBondContact OE1-NZ 3.13Å; E186-K190 IonicContact OE2-NZ 2.65Å; E186-K190 PolarHBondContact OE2-NZ 2.64Å; Q187-K190 PolarHBondContact O-N 2.72Å; K190-A192 PolarHBondContact O-N 2.92Å; K190-L193 PolarHBondContact O-N 2.74Å; K190-Y194 WeakPolarHBondContact O-CD2 3.4Å; K190-Y194 PolarHBondContact O-N 3.41Å
191Q95.6Very high95.4Very high120 Ų120104 Ų10456%0.56151%0.506SS*.Hα-helixtrans-63.8-38.4175.3-70.1179.119.900113Q187 A188 H189 Y194 K195Q187-Q191 WeakPolarHBondContact O-CG 3.31Å; Q187-Q191 PolarHBondContact O-N 3.21Å; A188-Q191 PolarHBondContact O-N 3.35Å; H189-Q191 VanDerWaalsContact C-N 3.33Å; H189-Q191 PolarHBondContact O-N 3.44Å; Q191-Y194 PolarHBondContact O-N 3.34Å; Q191-K195 WeakPolarHBondContact O-CG 3.48Å; Q191-K195 PolarHBondContact O-N 3.36Å; Q191-K195 VanDerWaalsContact O-N 3.16Å
192A96Very high95.5Very high45 Ų45101.7 Ų101.737%0.37250%0.498SS..Hα-helixtrans-65.7-43175.100000111.9A188 H189 K190 Y194 K195 L196A188-A192 PolarHBondContact O-N 2.85Å; H189-A192 PolarHBondContact O-N 3.48Å; H189-A192 VanDerWaalsContact O-N 3.16Å; K190-A192 PolarHBondContact O-N 2.92Å; A192-Y194 PolarHBondContact O-N 3.02Å; A192-K195 PolarHBondContact O-N 3.18Å; A192-L196 WeakPolarHBondContact O-CG 3.25Å; A192-L196 PolarHBondContact O-N 2.93Å
193L96Very high95.5Very high89 Ų89101.9 Ų101.947%0.46650%0.495SS..Hα-helixtrans-61.6-41.1174.8-70.7175.6000112.2H189 K190 K195 L196 E197H189-L193 WeakPolarHBondContact O-CG 3.38Å; H189-L193 PolarHBondContact O-N 3.39Å; K190-L193 PolarHBondContact O-N 2.74Å; L193-K195 PolarHBondContact O-N 3.09Å; L193-L196 PolarHBondContact O-N 3.01Å; L193-E197 WeakPolarHBondContact O-CB 3.36Å; L193-E197 PolarHBondContact O-N 3.01Å
194Y96.3Very high95.5Very high180 Ų18099.5 Ų99.571%0.70649%0.492SS*.Hα-helixtrans-62.1-40.4175.1-76.4-56.3000112.7K190 Q191 A192 D198K190-Y194 WeakPolarHBondContact O-CD2 3.4Å; K190-Y194 PolarHBondContact O-N 3.41Å; Q191-Y194 PolarHBondContact O-N 3.34Å; A192-Y194 PolarHBondContact O-N 3.02Å; Y194-D198 WeakPolarHBondContact O-CB 3.48Å; Y194-D198 PolarHBondContact O-N 3.45Å
195K96.2Very high95.4Very high138 Ų13897.1 Ų97.160%0.648%0.479SS*.Hα-helixtrans-65.3-46.6175.4-71.4176.3-179.4-179.70111.9Q191 A192 L193 E197 D198 E199Q191-K195 WeakPolarHBondContact O-CG 3.48Å; Q191-K195 PolarHBondContact O-N 3.36Å; Q191-K195 VanDerWaalsContact O-N 3.16Å; A192-K195 PolarHBondContact O-N 3.18Å; L193-K195 PolarHBondContact O-N 3.09Å; K195-E197 VanDerWaalsContact C-N 3.35Å; K195-E197 PolarHBondContact O-N 2.8Å; K195-D198 PolarHBondContact O-N 3.37Å; K195-D198 VanDerWaalsContact O-N 3.16Å; K195-E199 WeakPolarHBondContact O-CB 3.22Å; K195-E199 WeakPolarHBondContact O-CG 3.49Å; K195-E199 PolarHBondContact O-N 3.32Å
196L95.3Very high95.5Very high102 Ų10299 Ų9953%0.53448%0.48SS..Hα-helixtrans-62.8-39.3178.1-71.9169.5000112.4A192 L193 D198 K200A192-L196 WeakPolarHBondContact O-CG 3.25Å; A192-L196 PolarHBondContact O-N 2.93Å; L193-L196 PolarHBondContact O-N 3.01Å; L196-D198 VanDerWaalsContact C-N 3.32Å; L196-K200 WeakPolarHBondContact O-CB 3.48Å; L196-K200 PolarHBondContact O-N 3.23Å
197E94.9Very high95.5Very high74 Ų7498.5 Ų98.535%0.34648%0.478SS..Hα-helixtrans-70.2-30.1176.2-17159.9-144.400111.8L193 K195 K200 R201L193-E197 WeakPolarHBondContact O-CB 3.36Å; L193-E197 PolarHBondContact O-N 3.01Å; K195-E197 VanDerWaalsContact C-N 3.35Å; K195-E197 PolarHBondContact O-N 2.8Å; E197-K200 IonicContact OE1-NZ 3.48Å; E197-K200 PolarHBondContact OE1-NZ 3.5Å; E197-K200 IonicContact OE2-NZ 2.62Å; E197-K200 PolarHBondContact OE2-NZ 3.06Å; E197-R201 WeakPolarHBondContact O-CG 3.25Å; E197-R201 PolarHBondContact O-N 2.91Å
198D95Very high95.6Very high72 Ų72100 Ų10039%0.38548%0.48SS..Hα-helixtrans-75.2-45.6173.5-155.665.8000112.8Y194 K195 L196 K200 R201 N202Y194-D198 WeakPolarHBondContact O-CB 3.48Å; Y194-D198 PolarHBondContact O-N 3.45Å; K195-D198 PolarHBondContact O-N 3.37Å; K195-D198 VanDerWaalsContact O-N 3.16Å; L196-D198 VanDerWaalsContact C-N 3.32Å; D198-K200 PolarHBondContact O-N 3.01Å; D198-R201 WeakPolarHBondContact O-CB 3.36Å; D198-R201 PolarHBondContact O-N 2.85Å; D198-R201 IonicContact OD1-NH1 3.17Å; D198-R201 PolarHBondContact OD1-NH1 2.92Å; D198-N202 WeakPolarHBondContact O-CB 3.41Å; D198-N202 VanDerWaalsContact O-CG 3.3Å; D198-N202 PolarHBondContact O-N 2.9Å; D198-N202 PolarHBondContact O-ND2 3.47Å; D198-N202 PolarHBondContact OD2-ND2 2.79Å
199E95.4Very high95.7Very high124 Ų124101.7 Ų101.758%0.57948%0.477SS*.Hα-helixtrans-54.1-39.5169.8-74173.3-174.100111.4K195 N202 H203K195-E199 WeakPolarHBondContact O-CB 3.22Å; K195-E199 WeakPolarHBondContact O-CG 3.49Å; K195-E199 PolarHBondContact O-N 3.32Å; E199-N202 PolarHBondContact O-N 2.88Å; E199-H203 VanDerWaalsContact O-CB 3.31Å; E199-H203 WeakPolarHBondContact O-CB 3.47Å; E199-H203 PolarHBondContact O-N 2.88Å
200K95.4Very high95.7Very high125 Ų12598.7 Ų98.754%0.54347%0.468SS..Hα-helixtrans-64.7-39.5173.4170.4167.5162.3-98.30113.3L196 E197 D198 G204L196-K200 WeakPolarHBondContact O-CB 3.48Å; L196-K200 PolarHBondContact O-N 3.23Å; E197-K200 IonicContact OE1-NZ 3.48Å; E197-K200 PolarHBondContact OE1-NZ 3.5Å; E197-K200 IonicContact OE2-NZ 2.62Å; E197-K200 PolarHBondContact OE2-NZ 3.06Å; D198-K200 PolarHBondContact O-N 3.01Å; K200-G204 PolarHBondContact O-N 3.2Å
201R96.1Very high95.7Very high129 Ų12998 Ų9849%0.48747%0.469SS..Hα-helixtrans-65.1-48.7170.5-71.6-175.4-153.794.99.9111.5E197 D198 H203 G204 E205E197-R201 WeakPolarHBondContact O-CG 3.25Å; E197-R201 PolarHBondContact O-N 2.91Å; D198-R201 WeakPolarHBondContact O-CB 3.36Å; D198-R201 PolarHBondContact O-N 2.85Å; D198-R201 IonicContact OD1-NH1 3.17Å; D198-R201 PolarHBondContact OD1-NH1 2.92Å; R201-H203 VanDerWaalsContact C-N 3.29Å; R201-H203 PolarHBondContact O-N 3.48Å; R201-G204 CarbonylContact O-C 3.6Å; R201-G204 WeakPolarHBondContact O-CA 3.44Å; R201-G204 PolarHBondContact O-N 3.47Å; R201-G204 VanDerWaalsContact O-N 3.08Å; R201-E205 WeakPolarHBondContact O-CG 3.38Å; R201-E205 PolarHBondContact O-N 2.96Å
202N95.4Very high95.7Very high89 Ų8997.5 Ų97.548%0.47647%0.467SS..Hα-helixtrans-61.8-37.1-178.9-68.2-43.4000111.8D198 E199 E205 F206D198-N202 WeakPolarHBondContact O-CB 3.41Å; D198-N202 VanDerWaalsContact O-CG 3.3Å; D198-N202 PolarHBondContact O-N 2.9Å; D198-N202 PolarHBondContact O-ND2 3.47Å; D198-N202 PolarHBondContact OD2-ND2 2.79Å; E199-N202 PolarHBondContact O-N 2.88Å; N202-E205 WeakPolarHBondContact O-CB 3.25Å; N202-F206 WeakPolarHBondContact O-CB 3.48Å; N202-F206 PolarHBondContact O-N 2.83Å
203H96Very high95.8Very high118 Ų118102 Ų10255%0.54648%0.479SS..Hα-helixtrans-68.6-42.1171.4-176.260.4000112.2E199 R201 E205 F206 M207E199-H203 VanDerWaalsContact O-CB 3.31Å; E199-H203 WeakPolarHBondContact O-CB 3.47Å; E199-H203 PolarHBondContact O-N 2.88Å; R201-H203 VanDerWaalsContact C-N 3.29Å; R201-H203 PolarHBondContact O-N 3.48Å; H203-E205 VanDerWaalsContact C-N 3.32Å; H203-E205 PolarHBondContact O-N 3.5Å; H203-F206 PolarHBondContact O-N 3.46Å; H203-M207 WeakPolarHBondContact O-CB 3.44Å; H203-M207 WeakPolarHBondContact O-CG 3.39Å; H203-M207 PolarHBondContact O-N 2.78Å
204G95.4Very high95.8Very high35 Ų35101.2 Ų101.236%0.36148%0.477SS..Hα-helixtrans-62.5-35.4174.200000113.7K200 R201 R208K200-G204 PolarHBondContact O-N 3.2Å; R201-G204 CarbonylContact O-C 3.6Å; R201-G204 WeakPolarHBondContact O-CA 3.44Å; R201-G204 PolarHBondContact O-N 3.47Å; R201-G204 VanDerWaalsContact O-N 3.08Å; G204-R208 WeakPolarHBondContact O-CB 3.46Å; G204-R208 PolarHBondContact O-N 3.32Å; G204-R208 VanDerWaalsContact O-N 3.09Å
205E94.8Very high95.8Very high70 Ų7097.3 Ų97.333%0.32747%0.468SS..Hα-helixtrans-64.7-44.8169.9-73.9-97.5125.100112.3R201 N202 H203 R208 K209R201-E205 WeakPolarHBondContact O-CG 3.38Å; R201-E205 PolarHBondContact O-N 2.96Å; N202-E205 WeakPolarHBondContact O-CB 3.25Å; H203-E205 VanDerWaalsContact C-N 3.32Å; H203-E205 PolarHBondContact O-N 3.5Å; E205-R208 PolarHBondContact O-N 2.99Å; E205-R208 IonicContact OE1-CZ 2.71Å; E205-R208 IonicContact OE1-NH1 2.68Å; E205-R208 PolarHBondContact OE1-NH1 3.44Å; E205-R208 IonicContact OE1-NH2 2.81Å; E205-R208 PolarHBondContact OE1-NH2 3.06Å; E205-K209 WeakPolarHBondContact O-CD 3.47Å; E205-K209 WeakPolarHBondContact O-CG 3.26Å; E205-K209 PolarHBondContact O-N 2.9Å; E205-K209 VanDerWaalsContact O-N 3.07Å; E205-K209 IonicContact OE2-NZ 2.73Å; E205-K209 PolarHBondContact OE2-NZ 3.32Å
206F96.5Very high95.9Very high136 Ų13695.2 Ų95.260%0.59646%0.463SS*.Hα-helixtrans-65.5-44178.3179.1-90.7000111.6N202 H203 K209 S210N202-F206 WeakPolarHBondContact O-CB 3.48Å; N202-F206 PolarHBondContact O-N 2.83Å; H203-F206 PolarHBondContact O-N 3.46Å; F206-K209 PolarHBondContact O-N 2.85Å; F206-S210 WeakPolarHBondContact O-CB 3.44Å; F206-S210 PolarHBondContact O-N 3.34Å
207M94.9Very high95.9Very high76 Ų7696.5 Ų96.537%0.37447%0.47SS..Hα-helixtrans-59.1-48.4174.7-73.9-55.1-54.600111H203 K209 S210 D211H203-M207 WeakPolarHBondContact O-CB 3.44Å; H203-M207 WeakPolarHBondContact O-CG 3.39Å; H203-M207 PolarHBondContact O-N 2.78Å; M207-K209 VanDerWaalsContact C-N 3.33Å; M207-K209 PolarHBondContact O-N 3.38Å; M207-S210 CarbonylContact O-C 3.6Å; M207-S210 WeakPolarHBondContact O-CA 3.43Å; M207-S210 WeakPolarHBondContact O-CB 3.42Å; M207-S210 PolarHBondContact O-N 3.18Å; M207-D211 PolarHBondContact O-N 2.97Å
208R96.2Very high95.9Very high120 Ų12097.2 Ų97.245%0.45347%0.473SS..Hα-helixtrans-55.3-45.9176.3-162.3-163.2-48.9131.39.9112.4G204 E205 D211 E212G204-R208 WeakPolarHBondContact O-CB 3.46Å; G204-R208 PolarHBondContact O-N 3.32Å; G204-R208 VanDerWaalsContact O-N 3.09Å; E205-R208 PolarHBondContact O-N 2.99Å; E205-R208 IonicContact OE1-CZ 2.71Å; E205-R208 IonicContact OE1-NH1 2.68Å; E205-R208 PolarHBondContact OE1-NH1 3.44Å; E205-R208 IonicContact OE1-NH2 2.81Å; E205-R208 PolarHBondContact OE1-NH2 3.06Å; R208-D211 PolarHBondContact O-N 2.89Å; R208-E212 WeakPolarHBondContact CG-OE1 3.35Å; R208-E212 VanDerWaalsContact O-CG 3.26Å; R208-E212 WeakPolarHBondContact O-CG 3.34Å; R208-E212 PolarHBondContact O-N 2.66Å
209K96.5Very high96Very high90 Ų90100 Ų10039%0.39148%0.484SS..Hα-helixtrans-66-36.5176.2-69.9161.7-167.9158.10112E205 F206 M207 E212 F213E205-K209 WeakPolarHBondContact O-CD 3.47Å; E205-K209 WeakPolarHBondContact O-CG 3.26Å; E205-K209 PolarHBondContact O-N 2.9Å; E205-K209 VanDerWaalsContact O-N 3.07Å; E205-K209 IonicContact OE2-NZ 2.73Å; E205-K209 PolarHBondContact OE2-NZ 3.32Å; F206-K209 PolarHBondContact O-N 2.85Å; M207-K209 VanDerWaalsContact C-N 3.33Å; M207-K209 PolarHBondContact O-N 3.38Å; K209-E212 PolarHBondContact O-N 3.35Å; K209-F213 WeakPolarHBondContact O-CD2 3.39Å; K209-F213 PolarHBondContact O-N 2.88Å
210S94.8Very high96Very high46 Ų4698.8 Ų98.832%0.32248%0.478SS..Hα-helixtrans-65.9-38.1173.8-171.20000112.1F206 M207 T214F206-S210 WeakPolarHBondContact O-CB 3.44Å; F206-S210 PolarHBondContact O-N 3.34Å; M207-S210 CarbonylContact O-C 3.6Å; M207-S210 WeakPolarHBondContact O-CA 3.43Å; M207-S210 WeakPolarHBondContact O-CB 3.42Å; M207-S210 PolarHBondContact O-N 3.18Å; S210-T214 WeakPolarHBondContact O-CB 3.33Å; S210-T214 PolarHBondContact O-N 3.04Å; S210-T214 PolarHBondContact O-OG1 3.5Å
211D96.4Very high96.1Very high81 Ų81100.4 Ų100.443%0.43348%0.481SS..Hα-helixtrans-69.1-42.8175.4-61.7-27.9000110.4M207 R208 F213 T214 N215M207-D211 PolarHBondContact O-N 2.97Å; R208-D211 PolarHBondContact O-N 2.89Å; D211-F213 PolarHBondContact O-N 3.37Å; D211-T214 PolarHBondContact O-N 3.02Å; D211-T214 VanDerWaalsContact O-N 3.14Å; D211-N215 WeakPolarHBondContact O-CB 3.46Å; D211-N215 PolarHBondContact O-N 2.86Å; D211-N215 PolarHBondContact O-ND2 2.86Å
212E96.9Very high96.1Very high108 Ų108100.2 Ų100.251%0.50549%0.486SS..Hα-helixtrans-55.6-48.3172.1-72.4159.5-15800112R208 K209 T214 N215 L216R208-E212 WeakPolarHBondContact CG-OE1 3.35Å; R208-E212 VanDerWaalsContact O-CG 3.26Å; R208-E212 WeakPolarHBondContact O-CG 3.34Å; R208-E212 PolarHBondContact O-N 2.66Å; K209-E212 PolarHBondContact O-N 3.35Å; E212-T214 PolarHBondContact O-N 3.03Å; E212-N215 PolarHBondContact O-N 2.71Å; E212-L216 PolarHBondContact O-N 2.81Å; E212-L216 VanDerWaalsContact O-N 3.12Å
213F96.4Very high96.2Very high141 Ų141103.8 Ų103.862%0.61849%0.493SS*.Hα-helixtrans-65.6-35.1174.5-73.2-57000113.1K209 D211 L217K209-F213 WeakPolarHBondContact O-CD2 3.39Å; K209-F213 PolarHBondContact O-N 2.88Å; D211-F213 PolarHBondContact O-N 3.37Å; F213-L217 WeakPolarHBondContact O-CG 3.32Å; F213-L217 PolarHBondContact O-N 3.05Å; F213-L217 VanDerWaalsContact O-N 3.12Å
214T96.9Very high96.3Very high72 Ų72102.9 Ų102.944%0.44249%0.491SS..Hα-helixtrans-67.5-42.4178.1-59.20000110.9S210 D211 E212 L217 E218S210-T214 WeakPolarHBondContact O-CB 3.33Å; S210-T214 PolarHBondContact O-N 3.04Å; S210-T214 PolarHBondContact O-OG1 3.5Å; D211-T214 PolarHBondContact O-N 3.02Å; D211-T214 VanDerWaalsContact O-N 3.14Å; E212-T214 PolarHBondContact O-N 3.03Å; T214-L217 PolarHBondContact O-N 3.4Å; T214-E218 PolarHBondContact O-N 2.91Å
215N96.2Very high96.4Very high97 Ų97107.1 Ų107.152%0.51950%0.5SS..Hα-helixtrans-61.4-45.8175.6-66.4-26000111.4D211 E212 L217 E218 E219D211-N215 WeakPolarHBondContact O-CB 3.46Å; D211-N215 PolarHBondContact O-N 2.86Å; D211-N215 PolarHBondContact O-ND2 2.86Å; E212-N215 PolarHBondContact O-N 2.71Å; N215-L217 VanDerWaalsContact C-N 3.29Å; N215-L217 PolarHBondContact O-N 3.27Å; N215-E218 WeakPolarHBondContact O-CB 3.49Å; N215-E218 PolarHBondContact O-N 3.34Å; N215-E218 VanDerWaalsContact O-N 3.08Å; N215-E219 WeakPolarHBondContact O-CG 3.43Å; N215-E219 PolarHBondContact O-N 2.99Å
216L97.8Very high96.5Very high94 Ų94108.7 Ų108.749%0.49251%0.51SS..Hα-helixtrans-61.9-35.5177.4-176.963.1000112.8E212 E220E212-L216 PolarHBondContact O-N 2.81Å; E212-L216 VanDerWaalsContact O-N 3.12Å; L216-E220 PolarHBondContact O-N 3.36Å
217L95.7Very high96.5Very high129 Ų129107.3 Ų107.368%0.67551%0.508SS*.Hα-helixtrans-72.4-30.8174.1-71.6170.8000112.8F213 T214 N215 R221F213-L217 WeakPolarHBondContact O-CG 3.32Å; F213-L217 PolarHBondContact O-N 3.05Å; F213-L217 VanDerWaalsContact O-N 3.12Å; T214-L217 PolarHBondContact O-N 3.4Å; N215-L217 VanDerWaalsContact C-N 3.29Å; N215-L217 PolarHBondContact O-N 3.27Å; L217-R221 WeakPolarHBondContact O-CB 3.48Å; L217-R221 PolarHBondContact O-N 3.1Å; L217-R221 VanDerWaalsContact O-N 3.1Å
218E96.1Very high96.6Very high89 Ų89107.6 Ų107.642%0.41651%0.511SS..Hα-helixtrans-69.6-43.8171.3-161.484.3-95.400110.4T214 N215 R221 E222T214-E218 PolarHBondContact O-N 2.91Å; N215-E218 WeakPolarHBondContact O-CB 3.49Å; N215-E218 PolarHBondContact O-N 3.34Å; N215-E218 VanDerWaalsContact O-N 3.08Å; E218-R221 CarbonylContact O-C 3.57Å; E218-R221 WeakPolarHBondContact O-CB 3.43Å; E218-R221 PolarHBondContact O-N 3.06Å; E218-R221 IonicContact OE1-CZ 3.01Å; E218-R221 IonicContact OE1-NE 2.66Å; E218-R221 IonicContact OE1-NH1 2.83Å; E218-R221 PolarHBondContact OE1-NH1 3.44Å; E218-E222 WeakPolarHBondContact O-CG 3.48Å; E218-E222 PolarHBondContact O-N 3.12Å
219E96.9Very high96.7Very high130 Ų130104.6 Ų104.661%0.60750%0.503SS*.Hα-helixtrans-59.4-50.4175.8-74.6179.5-173.900112.4N215 R221 E222 R223N215-E219 WeakPolarHBondContact O-CG 3.43Å; N215-E219 PolarHBondContact O-N 2.99Å; E219-R221 VanDerWaalsContact C-N 3.27Å; E219-R221 PolarHBondContact O-N 3.48Å; E219-E222 PolarHBondContact O-N 2.93Å; E219-R223 WeakPolarHBondContact O-CB 3.3Å; E219-R223 PolarHBondContact O-N 3.14Å
220E95.6Very high96.7Very high99 Ų99105.7 Ų105.746%0.46351%0.51SS..Hα-helixtrans-67-29176.5-82.1-65.113200112.3L216 R223 L224L216-E220 PolarHBondContact O-N 3.36Å; E220-R223 WeakPolarHBondContact OE1-CD 3.48Å; E220-R223 IonicContact OE1-NE 3.18Å; E220-R223 IonicContact OE1-NH1 2.67Å; E220-R223 WeakPolarHBondContact OE2-CD 3.5Å; E220-L224 WeakPolarHBondContact O-CB 3.44Å; E220-L224 PolarHBondContact O-N 2.78Å
221R95.9Very high96.7Very high160 Ų160108.7 Ų108.760%0.60452%0.519SS*.Hα-helixtrans-67.3-41.8171172.2-178.1174.3-99.8-10.8111.9L217 E218 E219 K225L217-R221 WeakPolarHBondContact O-CB 3.48Å; L217-R221 PolarHBondContact O-N 3.1Å; L217-R221 VanDerWaalsContact O-N 3.1Å; E218-R221 CarbonylContact O-C 3.57Å; E218-R221 WeakPolarHBondContact O-CB 3.43Å; E218-R221 PolarHBondContact O-N 3.06Å; E218-R221 IonicContact OE1-CZ 3.01Å; E218-R221 IonicContact OE1-NE 2.66Å; E218-R221 IonicContact OE1-NH1 2.83Å; E218-R221 PolarHBondContact OE1-NH1 3.44Å; E219-R221 VanDerWaalsContact C-N 3.27Å; E219-R221 PolarHBondContact O-N 3.48Å; R221-K225 VanDerWaalsContact O-CB 3.3Å; R221-K225 WeakPolarHBondContact O-CB 3.39Å; R221-K225 PolarHBondContact O-N 3.05Å
222E96.6Very high96.7Very high125 Ų125109.7 Ų109.758%0.58452%0.519SS*.Hα-helixtrans-70.2-40.1175.9-67.6-149.9139.900111.9E218 E219 K225 L226E218-E222 WeakPolarHBondContact O-CG 3.48Å; E218-E222 PolarHBondContact O-N 3.12Å; E219-E222 PolarHBondContact O-N 2.93Å; E222-K225 WeakPolarHBondContact O-CB 3.46Å; E222-K225 PolarHBondContact O-N 3.31Å; E222-L226 WeakPolarHBondContact O-CB 3.49Å; E222-L226 PolarHBondContact O-N 3.22Å
223R97.9Very high96.7Very high164 Ų164108.2 Ų108.262%0.61952%0.518SS*.Hα-helixtrans-56.7-50.8171-177.8-161.4179.8109.98111.7E219 E220 K225 L226 L227E219-R223 WeakPolarHBondContact O-CB 3.3Å; E219-R223 PolarHBondContact O-N 3.14Å; E220-R223 WeakPolarHBondContact OE1-CD 3.48Å; E220-R223 IonicContact OE1-NE 3.18Å; E220-R223 IonicContact OE1-NH1 2.67Å; E220-R223 WeakPolarHBondContact OE2-CD 3.5Å; R223-K225 VanDerWaalsContact C-N 3.34Å; R223-L226 PolarHBondContact O-N 2.75Å; R223-L227 PolarHBondContact O-N 3.08Å
224L97.4Very high96.7Very high99 Ų99107.4 Ų107.452%0.51851%0.511SS..Hα-helixtrans-65.6-38.2179.7-179.459.8000111.4E220 L227 I228E220-L224 WeakPolarHBondContact O-CB 3.44Å; E220-L224 PolarHBondContact O-N 2.78Å; L224-L227 PolarHBondContact O-N 3.31Å; L224-I228 HydrophobicContact CD1-CD1 4.21Å; L224-I228 HydrophobicContact CD1-CG1 4.39Å; L224-I228 HydrophobicContact CG-CD1 3.96Å; L224-I228 WeakPolarHBondContact O-CB 3.32Å; L224-I228 VanDerWaalsContact O-CG1 3.27Å; L224-I228 WeakPolarHBondContact O-CG1 3.34Å; L224-I228 PolarHBondContact O-N 3.43Å
225K97.5Very high96.6Very high123 Ų123107 Ų10754%0.53550%0.504SS..Hα-helixtrans-59.9-47.6172.4-178.3-164.5167.8-1590111.2R221 E222 R223 L227 I228 D229R221-K225 VanDerWaalsContact O-CB 3.3Å; R221-K225 WeakPolarHBondContact O-CB 3.39Å; R221-K225 PolarHBondContact O-N 3.05Å; E222-K225 WeakPolarHBondContact O-CB 3.46Å; E222-K225 PolarHBondContact O-N 3.31Å; R223-K225 VanDerWaalsContact C-N 3.34Å; K225-L227 VanDerWaalsContact C-N 3.32Å; K225-L227 PolarHBondContact O-N 3.34Å; K225-I228 PolarHBondContact O-N 3.46Å; K225-D229 WeakPolarHBondContact O-CB 3.39Å; K225-D229 VanDerWaalsContact O-CG 3.32Å; K225-D229 PolarHBondContact O-N 3.33Å
226L97.6Very high96.6Very high104 Ų104107.7 Ų107.755%0.54550%0.504SS..Hα-helixtrans-60.8-40.8177.7-179.563000111.7E222 R223 D229 Q230E222-L226 WeakPolarHBondContact O-CB 3.49Å; E222-L226 PolarHBondContact O-N 3.22Å; R223-L226 PolarHBondContact O-N 2.75Å; L226-D229 PolarHBondContact O-N 3.46Å; L226-Q230 VanDerWaalsContact O-CG 3.31Å; L226-Q230 WeakPolarHBondContact O-CG 3.36Å; L226-Q230 PolarHBondContact O-N 3.38Å
227L97.1Very high96.6Very high107 Ų107110.3 Ų110.356%0.5651%0.508SS*.Hα-helixtrans-65.9-41.1176.2-169.169.2000112R223 L224 K225 Q230 E231R223-L227 PolarHBondContact O-N 3.08Å; L224-L227 PolarHBondContact O-N 3.31Å; K225-L227 VanDerWaalsContact C-N 3.32Å; K225-L227 PolarHBondContact O-N 3.34Å; L227-Q230 PolarHBondContact O-N 3.23Å; L227-E231 PolarHBondContact O-N 3.15Å
228I96.8Very high96.6Very high82 Ų82108.3 Ų108.342%0.42149%0.493SS..Hα-helixtrans-62.8-41.6173.6-74.6166.9000111.1L224 K225 E231 K232L224-I228 HydrophobicContact CD1-CD1 4.21Å; L224-I228 HydrophobicContact CD1-CG1 4.39Å; L224-I228 HydrophobicContact CG-CD1 3.96Å; L224-I228 WeakPolarHBondContact O-CB 3.32Å; L224-I228 VanDerWaalsContact O-CG1 3.27Å; L224-I228 WeakPolarHBondContact O-CG1 3.34Å; L224-I228 PolarHBondContact O-N 3.43Å; K225-I228 PolarHBondContact O-N 3.46Å; I228-E231 PolarHBondContact O-N 3.02Å; I228-K232 WeakPolarHBondContact O-CG 3.38Å; I228-K232 PolarHBondContact O-N 3.41Å
229D96.8Very high96.5Very high57 Ų57107.2 Ų107.231%0.30549%0.49SS..Hα-helixtrans-71.6-31.4179.3-68.3-22.8000111.7K225 L226 K232 V233K225-D229 WeakPolarHBondContact O-CB 3.39Å; K225-D229 VanDerWaalsContact O-CG 3.32Å; K225-D229 PolarHBondContact O-N 3.33Å; L226-D229 PolarHBondContact O-N 3.46Å; D229-K232 IonicContact OD1-NZ 2.66Å; D229-K232 PolarHBondContact OD1-NZ 2.83Å; D229-V233 WeakPolarHBondContact O-CG2 3.26Å; D229-V233 PolarHBondContact O-N 2.61Å
230Q97.1Very high96.5Very high112 Ų112106 Ų10652%0.52349%0.485SS..Hα-helixtrans-66.2-45.2168.3-74.2174.411.300112.5L226 L227 K232 V233 Y234L226-Q230 VanDerWaalsContact O-CG 3.31Å; L226-Q230 WeakPolarHBondContact O-CG 3.36Å; L226-Q230 PolarHBondContact O-N 3.38Å; L227-Q230 PolarHBondContact O-N 3.23Å; Q230-K232 PolarHBondContact O-N 2.89Å; Q230-V233 PolarHBondContact O-N 2.65Å; Q230-Y234 PolarHBondContact O-N 3.34Å
231E94.9Very high96.6Very high109 Ų109106.2 Ų106.251%0.50949%0.486SS..Hα-helixtrans-64.5-38.3178.3-17659.4-155.100111.6L227 I228 Y234 Q235L227-E231 PolarHBondContact O-N 3.15Å; I228-E231 PolarHBondContact O-N 3.02Å; E231-Y234 PolarHBondContact O-N 2.71Å; E231-Q235 WeakPolarHBondContact O-CB 3.45Å; E231-Q235 PolarHBondContact O-N 2.88Å
232K97.4Very high96.5Very high103 Ų103101.4 Ų101.445%0.44847%0.472SS..Hα-helixtrans-56.8-51.6170.4-72.9170.4-165158.90111.6I228 D229 Q230 Y234 Q235 E236I228-K232 WeakPolarHBondContact O-CG 3.38Å; I228-K232 PolarHBondContact O-N 3.41Å; D229-K232 IonicContact OD1-NZ 2.66Å; D229-K232 PolarHBondContact OD1-NZ 2.83Å; Q230-K232 PolarHBondContact O-N 2.89Å; K232-Y234 VanDerWaalsContact C-N 3.26Å; K232-Y234 PolarHBondContact O-N 3.48Å; K232-Q235 PolarHBondContact O-N 2.8Å; K232-E236 WeakPolarHBondContact O-CB 3.18Å; K232-E236 WeakPolarHBondContact O-CG 3.42Å; K232-E236 PolarHBondContact O-N 3.18Å
233V96.6Very high96.5Very high77 Ų7799.6 Ų99.647%0.46747%0.467SS..Hα-helixtrans-63.4-32.9-179.5169.80000111.9D229 Q230 R237D229-V233 WeakPolarHBondContact O-CG2 3.26Å; D229-V233 PolarHBondContact O-N 2.61Å; Q230-V233 PolarHBondContact O-N 2.65Å; V233-R237 WeakPolarHBondContact O-CB 3.5Å; V233-R237 PolarHBondContact O-N 3.46Å; V233-R237 VanDerWaalsContact O-N 3.14Å
234Y95.8Very high96.5Very high123 Ų12398 Ų9848%0.48246%0.464SS..Hα-helixtrans-68.8-48172.6174.2-114.1000112.3Q230 E231 K232 R237 K238Q230-Y234 PolarHBondContact O-N 3.34Å; E231-Y234 PolarHBondContact O-N 2.71Å; K232-Y234 VanDerWaalsContact C-N 3.26Å; K232-Y234 PolarHBondContact O-N 3.48Å; Y234-R237 WeakPolarHBondContact O-CB 3.3Å; Y234-R237 PolarHBondContact O-N 2.93Å; Y234-K238 WeakPolarHBondContact O-CB 3.45Å; Y234-K238 PolarHBondContact O-N 2.81Å
235Q95Very high96.5Very high63 Ų6398 Ų9829%0.29446%0.46SS..Hα-helixtrans-66.8-40.3179.5-178.655.236.700111.8E231 K232 R237 K238 D239E231-Q235 WeakPolarHBondContact O-CB 3.45Å; E231-Q235 PolarHBondContact O-N 2.88Å; K232-Q235 PolarHBondContact O-N 2.8Å; Q235-R237 PolarHBondContact O-N 3.43Å; Q235-K238 PolarHBondContact O-N 2.82Å; Q235-D239 PolarHBondContact NE2-OD1 3.23Å; Q235-D239 PolarHBondContact NE2-OD2 3.39Å; Q235-D239 WeakPolarHBondContact O-CB 3.32Å; Q235-D239 PolarHBondContact O-N 3.4Å
236E95.9Very high96.5Very high112 Ų11295.8 Ų95.852%0.52345%0.453SS..Hα-helixtrans-59.6-43.2171.5-76.5175.2-159.700112K232 D239 Q240K232-E236 WeakPolarHBondContact O-CB 3.18Å; K232-E236 WeakPolarHBondContact O-CG 3.42Å; K232-E236 PolarHBondContact O-N 3.18Å; E236-D239 PolarHBondContact O-N 3.18Å; E236-Q240 WeakPolarHBondContact O-CB 3.41Å; E236-Q240 VanDerWaalsContact O-CG 3.25Å; E236-Q240 WeakPolarHBondContact O-CG 3.34Å; E236-Q240 PolarHBondContact O-N 2.81Å
237R97Very high96.5Very high150 Ų15095.9 Ų95.957%0.56645%0.451SS*.Hα-helixtrans-62.8-43.2175.9-175.6-172.6-57.6148.86.4111.6V233 Y234 Q235 Q240 E241V233-R237 WeakPolarHBondContact O-CB 3.5Å; V233-R237 PolarHBondContact O-N 3.46Å; V233-R237 VanDerWaalsContact O-N 3.14Å; Y234-R237 WeakPolarHBondContact O-CB 3.3Å; Y234-R237 PolarHBondContact O-N 2.93Å; Q235-R237 PolarHBondContact O-N 3.43Å; R237-Q240 PolarHBondContact O-N 3.29Å; R237-E241 PolarHBondContact O-N 2.95Å
238K96.2Very high96.5Very high86 Ų8693.1 Ų93.137%0.37444%0.441SS..Hα-helixtrans-65.4-39177.3176.3179.3159.9-150.60111.7Y234 Q235 E241 N242Y234-K238 WeakPolarHBondContact O-CB 3.45Å; Y234-K238 PolarHBondContact O-N 2.81Å; Q235-K238 PolarHBondContact O-N 2.82Å; K238-E241 WeakPolarHBondContact O-CB 3.43Å; K238-E241 PolarHBondContact O-N 3.46Å; K238-N242 WeakPolarHBondContact O-CB 3.38Å; K238-N242 PolarHBondContact O-N 3.4Å; K238-N242 PolarHBondContact O-ND2 3.4Å
239D94.6Very high96.5Very high66 Ų6694.2 Ų94.235%0.35345%0.447SS..Hα-helixtrans-73.4-33.1176.1-70-22.6000112.3Q235 E236 E241 N242 N243Q235-D239 PolarHBondContact NE2-OD1 3.23Å; Q235-D239 PolarHBondContact NE2-OD2 3.39Å; Q235-D239 WeakPolarHBondContact O-CB 3.32Å; Q235-D239 PolarHBondContact O-N 3.4Å; E236-D239 PolarHBondContact O-N 3.18Å; D239-E241 VanDerWaalsContact C-N 3.35Å; D239-N242 PolarHBondContact O-N 2.87Å; D239-N243 VanDerWaalsContact O-CB 3.3Å; D239-N243 WeakPolarHBondContact O-CB 3.41Å; D239-N243 PolarHBondContact O-N 2.78Å; D239-N243 PolarHBondContact O-ND2 3.25Å
240Q97.2Very high96.5Very high105 Ų10597.3 Ų97.349%0.49146%0.458SS..Hα-helixtrans-62.7-39.5166.6-72.6171.227.600112.1E236 R237 K244E236-Q240 WeakPolarHBondContact O-CB 3.41Å; E236-Q240 VanDerWaalsContact O-CG 3.25Å; E236-Q240 WeakPolarHBondContact O-CG 3.34Å; E236-Q240 PolarHBondContact O-N 2.81Å; R237-Q240 PolarHBondContact O-N 3.29Å; Q240-K244 VanDerWaalsContact O-CG 3.27Å; Q240-K244 WeakPolarHBondContact O-CG 3.25Å; Q240-K244 PolarHBondContact O-N 3.09Å
241E96.5Very high96.5Very high103 Ų10396.9 Ų96.948%0.48146%0.456SS..Hα-helixtrans-67.6-41.5175.5-162-165.8142.300111.7R237 K238 D239 K244 K245R237-E241 PolarHBondContact O-N 2.95Å; K238-E241 WeakPolarHBondContact O-CB 3.43Å; K238-E241 PolarHBondContact O-N 3.46Å; D239-E241 VanDerWaalsContact C-N 3.35Å; E241-K244 PolarHBondContact O-N 3.05Å; E241-K245 WeakPolarHBondContact O-CG 3.48Å; E241-K245 PolarHBondContact O-N 3.25Å; E241-K245 WeakPolarHBondContact OE1-CE 3.33Å; E241-K245 IonicContact OE1-NZ 2.67Å; E241-K245 PolarHBondContact OE1-NZ 3.44Å
242N94.8Very high96.6Very high60 Ų6097.2 Ų97.232%0.32146%0.457SS..Hα-helixtrans-63.2-43.4173.7-69.1-29.9000111.6K238 D239 K244 K245 I246K238-N242 WeakPolarHBondContact O-CB 3.38Å; K238-N242 PolarHBondContact O-N 3.4Å; K238-N242 PolarHBondContact O-ND2 3.4Å; D239-N242 PolarHBondContact O-N 2.87Å; N242-K244 PolarHBondContact O-N 3.38Å; N242-K245 PolarHBondContact O-N 2.8Å; N242-I246 WeakPolarHBondContact O-CB 3.38Å; N242-I246 VanDerWaalsContact O-CG1 3.26Å; N242-I246 WeakPolarHBondContact O-CG1 3.27Å; N242-I246 PolarHBondContact O-N 2.7Å
243N96.9Very high96.6Very high87 Ų8796.3 Ų96.347%0.46546%0.457SS..Hα-helixtrans-61.8-43.6176.5-75.2-25000111.5D239 K245 I246 E247D239-N243 VanDerWaalsContact O-CB 3.3Å; D239-N243 WeakPolarHBondContact O-CB 3.41Å; D239-N243 PolarHBondContact O-N 2.78Å; D239-N243 PolarHBondContact O-ND2 3.25Å; N243-K245 VanDerWaalsContact C-N 3.34Å; N243-K245 PolarHBondContact O-N 2.87Å; N243-I246 CarbonylContact O-C 3.58Å; N243-I246 WeakPolarHBondContact O-CB 3.3Å; N243-I246 PolarHBondContact O-N 3.31Å; N243-I246 VanDerWaalsContact O-N 3.12Å; N243-E247 WeakPolarHBondContact O-CB 3.4Å; N243-E247 VanDerWaalsContact O-CG 3.3Å; N243-E247 WeakPolarHBondContact O-CG 3.37Å; N243-E247 PolarHBondContact O-N 3.44Å
244K98Very high96.6Very high131 Ų13196.7 Ų96.757%0.5746%0.459SS*.Hα-helixtrans-60-40.1174.1-73.2166.5-176174.10112.8Q240 E241 N242 E247 S248Q240-K244 VanDerWaalsContact O-CG 3.27Å; Q240-K244 WeakPolarHBondContact O-CG 3.25Å; Q240-K244 PolarHBondContact O-N 3.09Å; E241-K244 PolarHBondContact O-N 3.05Å; N242-K244 PolarHBondContact O-N 3.38Å; K244-E247 PolarHBondContact O-N 2.68Å; K244-S248 PolarHBondContact O-N 2.88Å; K244-S248 PolarHBondContact O-OG 2.87Å
245K97.4Very high96.7Very high97 Ų9796.2 Ų96.242%0.42246%0.46SS..Hα-helixtrans-67-37.9173.7-69166.5-174167.50112.1E241 N242 N243 E247 S248 L249E241-K245 WeakPolarHBondContact O-CG 3.48Å; E241-K245 PolarHBondContact O-N 3.25Å; E241-K245 WeakPolarHBondContact OE1-CE 3.33Å; E241-K245 IonicContact OE1-NZ 2.67Å; E241-K245 PolarHBondContact OE1-NZ 3.44Å; N242-K245 PolarHBondContact O-N 2.8Å; N243-K245 VanDerWaalsContact C-N 3.34Å; N243-K245 PolarHBondContact O-N 2.87Å; K245-E247 VanDerWaalsContact C-N 3.32Å; K245-S248 PolarHBondContact O-OG 3.18Å; K245-S248 VanDerWaalsContact O-OG 3.08Å; K245-L249 VanDerWaalsContact O-CB 3.31Å; K245-L249 WeakPolarHBondContact O-CB 3.5Å; K245-L249 WeakPolarHBondContact O-CD1 3.41Å; K245-L249 WeakPolarHBondContact O-CG 3.39Å; K245-L249 PolarHBondContact O-N 3.32Å
246I96Very high96.8Very high77 Ų7798.1 Ų98.140%0.39547%0.471SS..Hα-helixtrans-67.9-35174.9-71.1163.9000110.6N242 N243 K250N242-I246 WeakPolarHBondContact O-CB 3.38Å; N242-I246 VanDerWaalsContact O-CG1 3.26Å; N242-I246 WeakPolarHBondContact O-CG1 3.27Å; N242-I246 PolarHBondContact O-N 2.7Å; N243-I246 CarbonylContact O-C 3.58Å; N243-I246 WeakPolarHBondContact O-CB 3.3Å; N243-I246 PolarHBondContact O-N 3.31Å; N243-I246 VanDerWaalsContact O-N 3.12Å; I246-K250 HydrophobicContact CG2-CD 4.13Å; I246-K250 VanDerWaalsContact CG2-CE 3.48Å; I246-K250 WeakPolarHBondContact O-CB 3.07Å; I246-K250 WeakPolarHBondContact O-CD 3.43Å; I246-K250 WeakPolarHBondContact O-CG 3.45Å; I246-K250 PolarHBondContact O-N 3.41Å
247E97.6Very high96.8Very high106 Ų10698.7 Ų98.750%0.49547%0.472SS..Hα-helixtrans-68.9-47.9174.5-74.7160.3-179.400111.6N243 K244 K245 L249 K250 E251N243-E247 WeakPolarHBondContact O-CB 3.4Å; N243-E247 VanDerWaalsContact O-CG 3.3Å; N243-E247 WeakPolarHBondContact O-CG 3.37Å; N243-E247 PolarHBondContact O-N 3.44Å; K244-E247 PolarHBondContact O-N 2.68Å; K245-E247 VanDerWaalsContact C-N 3.32Å; E247-L249 VanDerWaalsContact C-N 3.34Å; E247-L249 PolarHBondContact O-N 2.85Å; E247-K250 WeakPolarHBondContact O-CB 3.12Å; E247-K250 PolarHBondContact O-N 3.49Å; E247-K250 VanDerWaalsContact O-N 3.13Å; E247-E251 PolarHBondContact O-N 2.89Å
248S97.3Very high96.7Very high50 Ų5094.9 Ų94.935%0.3547%0.469SS..Hα-helixtrans-62.2-40.6175.568.60000112.1K244 K245 K250 E251 E252K244-S248 PolarHBondContact O-N 2.88Å; K244-S248 PolarHBondContact O-OG 2.87Å; K245-S248 PolarHBondContact O-OG 3.18Å; K245-S248 VanDerWaalsContact O-OG 3.08Å; S248-K250 PolarHBondContact O-N 3.2Å; S248-E251 WeakPolarHBondContact O-CB 3.46Å; S248-E251 PolarHBondContact O-N 3.07Å; S248-E252 WeakPolarHBondContact O-CG 3.41Å; S248-E252 PolarHBondContact O-N 2.87Å
249L97.3Very high96.8Very high104 Ų10496.8 Ų96.855%0.54548%0.477SS..Hα-helixtrans-67.3-32.3174.1-72.1170.1000112.9K245 E247 L253K245-L249 VanDerWaalsContact O-CB 3.31Å; K245-L249 WeakPolarHBondContact O-CB 3.5Å; K245-L249 WeakPolarHBondContact O-CD1 3.41Å; K245-L249 WeakPolarHBondContact O-CG 3.39Å; K245-L249 PolarHBondContact O-N 3.32Å; E247-L249 VanDerWaalsContact C-N 3.34Å; E247-L249 PolarHBondContact O-N 2.85Å; L249-L253 VanDerWaalsContact O-CB 3.27Å; L249-L253 WeakPolarHBondContact O-CB 3.44Å; L249-L253 PolarHBondContact O-N 3.44Å
250K96.9Very high96.9Very high123 Ų12397.4 Ų97.454%0.53548%0.483SS..Hα-helixtrans-66.5-40.9170.8-78.5162.8-177168.60111.2I246 E247 S248 L253 T254I246-K250 HydrophobicContact CG2-CD 4.13Å; I246-K250 VanDerWaalsContact CG2-CE 3.48Å; I246-K250 WeakPolarHBondContact O-CB 3.07Å; I246-K250 WeakPolarHBondContact O-CD 3.43Å; I246-K250 WeakPolarHBondContact O-CG 3.45Å; I246-K250 PolarHBondContact O-N 3.41Å; E247-K250 WeakPolarHBondContact O-CB 3.12Å; E247-K250 PolarHBondContact O-N 3.49Å; E247-K250 VanDerWaalsContact O-N 3.13Å; S248-K250 PolarHBondContact O-N 3.2Å; K250-L253 PolarHBondContact O-N 3.17Å; K250-T254 WeakPolarHBondContact O-CG2 3.46Å; K250-T254 PolarHBondContact O-N 2.86Å; K250-T254 PolarHBondContact O-OG1 3.43Å
251E97.2Very high96.9Very high103 Ų10397.3 Ų97.348%0.48149%0.486SS..Hα-helixtrans-66.2-41.6174.4-72.9-172.3-158.500112.6E247 S248 L253 T254 K255E247-E251 PolarHBondContact O-N 2.89Å; S248-E251 WeakPolarHBondContact O-CB 3.46Å; S248-E251 PolarHBondContact O-N 3.07Å; E251-L253 VanDerWaalsContact C-N 3.27Å; E251-L253 PolarHBondContact O-N 3.49Å; E251-T254 WeakPolarHBondContact CA-OG1 3.5Å; E251-T254 PolarHBondContact O-N 3.39Å; E251-T254 PolarHBondContact O-OG1 3.22Å; E251-K255 WeakPolarHBondContact O-CB 3.42Å; E251-K255 VanDerWaalsContact O-CD 3.3Å; E251-K255 WeakPolarHBondContact O-CD 3.27Å; E251-K255 WeakPolarHBondContact O-CG 3.5Å; E251-K255 PolarHBondContact O-N 2.95Å; E251-K255 IonicContact OE2-NZ 3.69Å; E251-K255 PolarHBondContact OE2-NZ 2.92Å
252E97.3Very high97Very high115 Ų11598.1 Ų98.154%0.53749%0.491SS..Hα-helixtrans-62.5-38.1174-75172.4-16600110.9S248 K255 L256S248-E252 WeakPolarHBondContact O-CG 3.41Å; S248-E252 PolarHBondContact O-N 2.87Å; E252-K255 PolarHBondContact O-N 3.33Å; E252-L256 VanDerWaalsContact O-CB 3.25Å; E252-L256 WeakPolarHBondContact O-CB 3.46Å; E252-L256 PolarHBondContact O-N 2.84Å
253L97.3Very high97.1Very high85 Ų8597.3 Ų97.345%0.44549%0.488SS..Hα-helixtrans-67.7-35.3173.4-17861.5000113.1L249 K250 E251 K257L249-L253 VanDerWaalsContact O-CB 3.27Å; L249-L253 WeakPolarHBondContact O-CB 3.44Å; L249-L253 PolarHBondContact O-N 3.44Å; K250-L253 PolarHBondContact O-N 3.17Å; E251-L253 VanDerWaalsContact C-N 3.27Å; E251-L253 PolarHBondContact O-N 3.49Å; L253-K257 HydrophobicContact CD1-CD 4.48Å; L253-K257 HydrophobicContact CG-CD 4.28Å; L253-K257 WeakPolarHBondContact O-CB 3.33Å; L253-K257 WeakPolarHBondContact O-CD 3.45Å; L253-K257 WeakPolarHBondContact O-CG 3.43Å; L253-K257 PolarHBondContact O-N 3.17Å
254T96.4Very high97.1Very high85 Ų8596.5 Ų96.552%0.52149%0.486SS..Hα-helixtrans-74.2-39.2173.954.80000111.9K250 E251 K257 S258K250-T254 WeakPolarHBondContact O-CG2 3.46Å; K250-T254 PolarHBondContact O-N 2.86Å; K250-T254 PolarHBondContact O-OG1 3.43Å; E251-T254 WeakPolarHBondContact CA-OG1 3.5Å; E251-T254 PolarHBondContact O-N 3.39Å; E251-T254 PolarHBondContact O-OG1 3.22Å; T254-K257 PolarHBondContact O-N 2.9Å; T254-S258 WeakPolarHBondContact O-CB 3.33Å; T254-S258 PolarHBondContact O-N 2.75Å; T254-S258 PolarHBondContact O-OG 3.4Å
255K97.9Very high97Very high112 Ų11294.3 Ų94.349%0.48748%0.481SS..Hα-helixtrans-57.5-50.5171.2-70.2158.8-163.3163.80110.2E251 E252 K257 S258 F259E251-K255 WeakPolarHBondContact O-CB 3.42Å; E251-K255 VanDerWaalsContact O-CD 3.3Å; E251-K255 WeakPolarHBondContact O-CD 3.27Å; E251-K255 WeakPolarHBondContact O-CG 3.5Å; E251-K255 PolarHBondContact O-N 2.95Å; E251-K255 IonicContact OE2-NZ 3.69Å; E251-K255 PolarHBondContact OE2-NZ 2.92Å; E252-K255 PolarHBondContact O-N 3.33Å; K255-K257 PolarHBondContact O-N 3.35Å; K255-S258 PolarHBondContact O-N 3.15Å; K255-S258 PolarHBondContact O-OG 3.24Å; K255-F259 PolarHBondContact O-N 2.93Å
256L96.9Very high97Very high103 Ų10395.2 Ų95.254%0.53949%0.486SS..Hα-helixtrans-61.2-43.7176.4-177.560.5000112.3E252 S258 F259 T260E252-L256 VanDerWaalsContact O-CB 3.25Å; E252-L256 WeakPolarHBondContact O-CB 3.46Å; E252-L256 PolarHBondContact O-N 2.84Å; L256-S258 VanDerWaalsContact C-N 3.32Å; L256-S258 PolarHBondContact O-N 2.92Å; L256-F259 PolarHBondContact O-N 2.85Å; L256-T260 PolarHBondContact O-N 3.49Å; L256-T260 PolarHBondContact O-OG1 2.82Å; L256-T260 VanDerWaalsContact O-OG1 3.11Å
257K96.9Very high96.9Very high125 Ų12597.1 Ų97.154%0.54349%0.493SS..Hα-helixtrans-60.6-39.8174.1-78168179.7175.90112.6L253 T254 K255 T260 L261L253-K257 HydrophobicContact CD1-CD 4.48Å; L253-K257 HydrophobicContact CG-CD 4.28Å; L253-K257 WeakPolarHBondContact O-CB 3.33Å; L253-K257 WeakPolarHBondContact O-CD 3.45Å; L253-K257 WeakPolarHBondContact O-CG 3.43Å; L253-K257 PolarHBondContact O-N 3.17Å; T254-K257 PolarHBondContact O-N 2.9Å; K255-K257 PolarHBondContact O-N 3.35Å; K257-T260 PolarHBondContact O-N 2.79Å; K257-L261 WeakPolarHBondContact O-CB 3.33Å; K257-L261 PolarHBondContact O-N 3.16Å
258S95Very high96.9Very high70 Ų7098.6 Ų98.649%0.4950%0.5SS..Hα-helixtrans-68.7-35.3177.373.50000112.3T254 K255 L256 L261 M262T254-S258 WeakPolarHBondContact O-CB 3.33Å; T254-S258 PolarHBondContact O-N 2.75Å; T254-S258 PolarHBondContact O-OG 3.4Å; K255-S258 PolarHBondContact O-N 3.15Å; K255-S258 PolarHBondContact O-OG 3.24Å; L256-S258 VanDerWaalsContact C-N 3.32Å; L256-S258 PolarHBondContact O-N 2.92Å; S258-L261 PolarHBondContact O-N 2.88Å; S258-M262 WeakPolarHBondContact O-CB 3.29Å; S258-M262 PolarHBondContact O-N 3.32Å
259F97.9Very high96.8Very high126 Ų126101.8 Ų101.855%0.55351%0.509SS*.Hα-helixtrans-67-46.1171.6-178.9-101.9000111.8K255 L256 L261 M262 V263K255-F259 PolarHBondContact O-N 2.93Å; L256-F259 PolarHBondContact O-N 2.85Å; F259-L261 VanDerWaalsContact C-N 3.29Å; F259-L261 PolarHBondContact O-N 2.76Å; F259-M262 PolarHBondContact O-N 2.87Å; F259-V263 HydrophobicContact CD1-CG2 4.3Å; F259-V263 HydrophobicContact CE1-CG2 3.87Å; F259-V263 HydrophobicContact CE2-CG2 4.15Å; F259-V263 HydrophobicContact CZ-CG2 3.79Å; F259-V263 WeakPolarHBondContact O-CG2 3.41Å; F259-V263 PolarHBondContact O-N 2.86Å
260T96.8Very high96.8Very high78 Ų78101.2 Ų101.248%0.47951%0.507SS..Hα-helixtrans-59.9-40.1175-58.20000111.7L256 K257 V263 V264L256-T260 PolarHBondContact O-N 3.49Å; L256-T260 PolarHBondContact O-OG1 2.82Å; L256-T260 VanDerWaalsContact O-OG1 3.11Å; K257-T260 PolarHBondContact O-N 2.79Å; T260-V263 PolarHBondContact O-N 3.27Å; T260-V264 WeakPolarHBondContact O-CG2 3.41Å; T260-V264 PolarHBondContact O-N 3.14Å
261L97.5Very high96.8Very high104 Ų10499 Ų9955%0.54550%0.503SS..Hα-helixtrans-64-48.5175.4-176.960.6000111.3K257 S258 F259 V263 V264 D265K257-L261 WeakPolarHBondContact O-CB 3.33Å; K257-L261 PolarHBondContact O-N 3.16Å; S258-L261 PolarHBondContact O-N 2.88Å; F259-L261 VanDerWaalsContact C-N 3.29Å; F259-L261 PolarHBondContact O-N 2.76Å; L261-V263 VanDerWaalsContact C-N 3.28Å; L261-V263 PolarHBondContact O-N 3.48Å; L261-V264 CarbonylContact O-C 3.56Å; L261-V264 WeakPolarHBondContact O-CA 3.26Å; L261-V264 WeakPolarHBondContact O-CB 3.46Å; L261-V264 PolarHBondContact O-N 3.04Å; L261-D265 VanDerWaalsContact O-CG 3.28Å; L261-D265 PolarHBondContact O-N 3.46Å
262M97.4Very high96.7Very high120 Ų12098.2 Ų98.259%0.59150%0.5SS*.Hα-helixtrans-57.2-39.2176-175.1-174.5-61.900112.7S258 F259 D265 E266S258-M262 WeakPolarHBondContact O-CB 3.29Å; S258-M262 PolarHBondContact O-N 3.32Å; F259-M262 PolarHBondContact O-N 2.87Å; M262-D265 PolarHBondContact O-N 3.4Å; M262-E266 WeakPolarHBondContact O-CB 3.39Å; M262-E266 PolarHBondContact O-N 2.9Å
263V96.3Very high96.7Very high42 Ų4296.9 Ų96.926%0.25549%0.493SS..Hα-helixtrans-70-34.4175.3170.80000111.9F259 T260 L261 Q267F259-V263 HydrophobicContact CD1-CG2 4.3Å; F259-V263 HydrophobicContact CE1-CG2 3.87Å; F259-V263 HydrophobicContact CE2-CG2 4.15Å; F259-V263 HydrophobicContact CZ-CG2 3.79Å; F259-V263 WeakPolarHBondContact O-CG2 3.41Å; F259-V263 PolarHBondContact O-N 2.86Å; T260-V263 PolarHBondContact O-N 3.27Å; L261-V263 VanDerWaalsContact C-N 3.28Å; L261-V263 PolarHBondContact O-N 3.48Å; V263-Q267 WeakPolarHBondContact O-CB 3.4Å; V263-Q267 VanDerWaalsContact O-CG 3.24Å; V263-Q267 WeakPolarHBondContact O-CG 3.41Å; V263-Q267 PolarHBondContact O-N 3.44Å
264V97.9Very high96.7Very high70 Ų7098.5 Ų98.542%0.42450%0.502SS..Hα-helixtrans-68.2-43.1172.5167.30000110.9T260 L261 E266 Q267 Q268T260-V264 WeakPolarHBondContact O-CG2 3.41Å; T260-V264 PolarHBondContact O-N 3.14Å; L261-V264 CarbonylContact O-C 3.56Å; L261-V264 WeakPolarHBondContact O-CA 3.26Å; L261-V264 WeakPolarHBondContact O-CB 3.46Å; L261-V264 PolarHBondContact O-N 3.04Å; V264-E266 PolarHBondContact O-N 3.32Å; V264-Q267 PolarHBondContact O-N 3.37Å; V264-Q268 WeakPolarHBondContact O-CB 3.46Å; V264-Q268 PolarHBondContact O-N 2.88Å
265D96.3Very high96.7Very high86 Ų8698.2 Ų98.246%0.4650%0.497SS..Hα-helixtrans-62.1-42.4176-64.1-27.5000111L261 M262 Q268 H269L261-D265 VanDerWaalsContact O-CG 3.28Å; L261-D265 PolarHBondContact O-N 3.46Å; M262-D265 PolarHBondContact O-N 3.4Å; D265-Q268 PolarHBondContact O-N 3.07Å; D265-H269 VanDerWaalsContact O-CB 3.31Å; D265-H269 WeakPolarHBondContact O-CB 3.4Å; D265-H269 PolarHBondContact O-N 3.05Å
266E96.5Very high96.6Very high115 Ų11597.1 Ų97.154%0.53749%0.494SS..Hα-helixtrans-65.4-44.3174.6-175.6173.2-153.200111.9M262 V264 Q268 H269 L270M262-E266 WeakPolarHBondContact O-CB 3.39Å; M262-E266 PolarHBondContact O-N 2.9Å; V264-E266 PolarHBondContact O-N 3.32Å; E266-Q268 VanDerWaalsContact C-N 3.33Å; E266-Q268 PolarHBondContact O-N 2.87Å; E266-H269 PolarHBondContact O-N 2.86Å; E266-L270 HydrophobicContact CG-CD1 4.03Å; E266-L270 HydrophobicContact CG-CG 4.43Å; E266-L270 WeakPolarHBondContact O-CB 3.23Å; E266-L270 VanDerWaalsContact O-CG 3.29Å; E266-L270 WeakPolarHBondContact O-CG 3.41Å; E266-L270 PolarHBondContact O-N 2.97Å
267Q95.1Very high96.5Very high118 Ų11899.2 Ų99.255%0.55150%0.499SS*.Hα-helixtrans-62.6-39.3175-77.1178.317.700112.1V263 V264 T271V263-Q267 WeakPolarHBondContact O-CB 3.4Å; V263-Q267 VanDerWaalsContact O-CG 3.24Å; V263-Q267 WeakPolarHBondContact O-CG 3.41Å; V263-Q267 PolarHBondContact O-N 3.44Å; V264-Q267 PolarHBondContact O-N 3.37Å; Q267-T271 VanDerWaalsContact O-CB 3.29Å; Q267-T271 WeakPolarHBondContact O-CB 3.16Å; Q267-T271 PolarHBondContact O-N 3.39Å; Q267-T271 PolarHBondContact O-OG1 2.96Å
268Q96.3Very high96.5Very high137 Ų13796.5 Ų96.564%0.6450%0.495SS*.Hα-helixtrans-65.9-43.8175.4-177.9171.6-23.600111.2V264 D265 E266 T271 E272V264-Q268 WeakPolarHBondContact O-CB 3.46Å; V264-Q268 PolarHBondContact O-N 2.88Å; D265-Q268 PolarHBondContact O-N 3.07Å; E266-Q268 VanDerWaalsContact C-N 3.33Å; E266-Q268 PolarHBondContact O-N 2.87Å; Q268-T271 PolarHBondContact O-N 2.91Å; Q268-E272 WeakPolarHBondContact O-CB 3.29Å; Q268-E272 PolarHBondContact O-N 3.45Å
269H95.5Very high96.6Very high116 Ų11697 Ų9754%0.53750%0.495SS..Hα-helixtrans-63.7-40.6176174.7-127.3000112.9D265 E266 E272 Q273D265-H269 VanDerWaalsContact O-CB 3.31Å; D265-H269 WeakPolarHBondContact O-CB 3.4Å; D265-H269 PolarHBondContact O-N 3.05Å; E266-H269 PolarHBondContact O-N 2.86Å; H269-E272 PolarHBondContact O-N 3.48Å; H269-Q273 PolarHBondContact CE1-NE2 3Å; H269-Q273 PolarHBondContact NE2-NE2 3.42Å; H269-Q273 WeakPolarHBondContact O-CG 3.41Å; H269-Q273 PolarHBondContact O-N 3.45Å
270L96.7Very high96.6Very high93 Ų9397 Ų9749%0.48750%0.495SS..Hα-helixtrans-68.1-38.7174.1-71.2171.5000111.9E266 Q273 L274E266-L270 HydrophobicContact CG-CD1 4.03Å; E266-L270 HydrophobicContact CG-CG 4.43Å; E266-L270 WeakPolarHBondContact O-CB 3.23Å; E266-L270 VanDerWaalsContact O-CG 3.29Å; E266-L270 WeakPolarHBondContact O-CG 3.41Å; E266-L270 PolarHBondContact O-N 2.97Å; L270-Q273 PolarHBondContact O-N 3.35Å; L270-L274 WeakPolarHBondContact O-CB 3.35Å; L270-L274 PolarHBondContact O-N 2.9Å
271T97Very high96.6Very high75 Ų7597.8 Ų97.846%0.4650%0.499SS..Hα-helixtrans-63.8-41.5174.5-59.10000110.9Q267 Q268 L274 N275Q267-T271 VanDerWaalsContact O-CB 3.29Å; Q267-T271 WeakPolarHBondContact O-CB 3.16Å; Q267-T271 PolarHBondContact O-N 3.39Å; Q267-T271 PolarHBondContact O-OG1 2.96Å; Q268-T271 PolarHBondContact O-N 2.91Å; T271-L274 CarbonylContact O-C 3.57Å; T271-L274 WeakPolarHBondContact O-CB 3.48Å; T271-L274 PolarHBondContact O-N 2.86Å; T271-N275 PolarHBondContact O-N 3.25Å; T271-N275 PolarHBondContact O-ND2 3.45Å
272E96.5Very high96.5Very high88 Ų8898.8 Ų98.841%0.41150%0.501SS..Hα-helixtrans-68.2-40.5177.7179.848.4-149.900112.2Q268 H269 L274 N275 Q276Q268-E272 WeakPolarHBondContact O-CB 3.29Å; Q268-E272 PolarHBondContact O-N 3.45Å; H269-E272 PolarHBondContact O-N 3.48Å; E272-L274 VanDerWaalsContact C-N 3.3Å; E272-L274 PolarHBondContact O-N 2.91Å; E272-N275 WeakPolarHBondContact O-CB 3.37Å; E272-N275 PolarHBondContact O-N 3.02Å; E272-N275 PolarHBondContact OE2-ND2 2.88Å; E272-Q276 WeakPolarHBondContact O-CG 3.42Å; E272-Q276 PolarHBondContact O-N 3.39Å; E272-Q276 WeakPolarHBondContact OE1-CG 3.17Å; E272-Q276 PolarHBondContact OE1-NE2 3.27Å
273Q97.1Very high96.4Very high86 Ų8697.6 Ų97.640%0.40250%0.497SS..Hα-helixtrans-60-39.4169.2-76.7-176.170.900112.4H269 L270 Q276 K277H269-Q273 PolarHBondContact CE1-NE2 3Å; H269-Q273 PolarHBondContact NE2-NE2 3.42Å; H269-Q273 WeakPolarHBondContact O-CG 3.41Å; H269-Q273 PolarHBondContact O-N 3.45Å; L270-Q273 PolarHBondContact O-N 3.35Å; Q273-Q276 PolarHBondContact O-N 2.89Å; Q273-K277 WeakPolarHBondContact O-CB 3.35Å; Q273-K277 WeakPolarHBondContact O-CG 3.18Å; Q273-K277 PolarHBondContact O-N 2.81Å
274L96.9Very high96.4Very high120 Ų120101.8 Ų101.863%0.62852%0.518SS*.Hα-helixtrans-66.6-40.2176.2-176.961.7000111.7L270 T271 E272 K277 S278L270-L274 WeakPolarHBondContact O-CB 3.35Å; L270-L274 PolarHBondContact O-N 2.9Å; T271-L274 CarbonylContact O-C 3.57Å; T271-L274 WeakPolarHBondContact O-CB 3.48Å; T271-L274 PolarHBondContact O-N 2.86Å; E272-L274 VanDerWaalsContact C-N 3.3Å; E272-L274 PolarHBondContact O-N 2.91Å; L274-K277 PolarHBondContact O-N 2.87Å; L274-S278 WeakPolarHBondContact O-CB 3.36Å; L274-S278 PolarHBondContact O-N 2.84Å
275N95.7Very high96.4Very high79 Ų79107.7 Ų107.742%0.42253%0.532SS..Hα-helixtrans-59.7-48.8173.2-68.6-23.5000110.9T271 E272 K277 S278 V279T271-N275 PolarHBondContact O-N 3.25Å; T271-N275 PolarHBondContact O-ND2 3.45Å; E272-N275 WeakPolarHBondContact O-CB 3.37Å; E272-N275 PolarHBondContact O-N 3.02Å; E272-N275 PolarHBondContact OE2-ND2 2.88Å; N275-K277 VanDerWaalsContact C-N 3.31Å; N275-K277 PolarHBondContact O-N 3.06Å; N275-S278 WeakPolarHBondContact O-CB 3.49Å; N275-S278 PolarHBondContact O-N 3.03Å; N275-S278 VanDerWaalsContact O-N 3.09Å; N275-V279 WeakPolarHBondContact O-CG2 3.41Å; N275-V279 PolarHBondContact O-N 3.11Å
276Q96.4Very high96.3Very high89 Ų89107.5 Ų107.542%0.41653%0.534SS..Hα-helixtrans-63.1-34.7177.7-68.8174.823.700112.9E272 Q273 K280E272-Q276 WeakPolarHBondContact O-CG 3.42Å; E272-Q276 PolarHBondContact O-N 3.39Å; E272-Q276 WeakPolarHBondContact OE1-CG 3.17Å; E272-Q276 PolarHBondContact OE1-NE2 3.27Å; Q273-Q276 PolarHBondContact O-N 2.89Å; Q276-K280 WeakPolarHBondContact O-CB 3.49Å; Q276-K280 WeakPolarHBondContact O-CD 3.24Å; Q276-K280 VanDerWaalsContact O-CG 3.23Å; Q276-K280 WeakPolarHBondContact O-CG 3.42Å; Q276-K280 PolarHBondContact O-N 3.01Å
277K95.6Very high96.4Very high147 Ų147103.8 Ų103.864%0.63953%0.526SS*.Hα-helixtrans-67-43.5171-69-87.9-175.1168.90111Q273 L274 N275 K280 V281Q273-K277 WeakPolarHBondContact O-CB 3.35Å; Q273-K277 WeakPolarHBondContact O-CG 3.18Å; Q273-K277 PolarHBondContact O-N 2.81Å; L274-K277 PolarHBondContact O-N 2.87Å; N275-K277 VanDerWaalsContact C-N 3.31Å; N275-K277 PolarHBondContact O-N 3.06Å; K277-K280 PolarHBondContact O-N 3.18Å; K277-V281 WeakPolarHBondContact O-CG2 3.39Å; K277-V281 PolarHBondContact O-N 3.13Å
278S96.8Very high96.4Very high68 Ų68104.6 Ų104.648%0.47653%0.529SS..Hα-helixtrans-62.7-47.9179.8-1690000111.9L274 N275 K280 V281 Q282L274-S278 WeakPolarHBondContact O-CB 3.36Å; L274-S278 PolarHBondContact O-N 2.84Å; N275-S278 WeakPolarHBondContact O-CB 3.49Å; N275-S278 PolarHBondContact O-N 3.03Å; N275-S278 VanDerWaalsContact O-N 3.09Å; S278-K280 PolarHBondContact O-N 2.86Å; S278-V281 PolarHBondContact O-N 3.41Å; S278-Q282 WeakPolarHBondContact O-CB 3.35Å; S278-Q282 PolarHBondContact O-N 2.98Å
279V96.6Very high96.3Very high79 Ų79100.9 Ų100.948%0.47952%0.518SS..Hα-helixtrans-58.4-48.4174.8172.60000110.7N275 V281 Q282 D283N275-V279 WeakPolarHBondContact O-CG2 3.41Å; N275-V279 PolarHBondContact O-N 3.11Å; V279-V281 VanDerWaalsContact C-N 3.3Å; V279-V281 PolarHBondContact O-N 2.68Å; V279-Q282 CarbonylContact O-C 3.6Å; V279-Q282 WeakPolarHBondContact O-CA 3.49Å; V279-Q282 WeakPolarHBondContact O-CB 3.41Å; V279-Q282 PolarHBondContact O-N 3.19Å; V279-D283 PolarHBondContact O-N 3.41Å
280K97.4Very high96.4Very high127 Ų127100.8 Ų100.855%0.55252%0.518SS*.Hα-helixtrans-60.5-36.7176.8-72.4167.5-174.1169.30113Q276 K277 S278 L284Q276-K280 WeakPolarHBondContact O-CB 3.49Å; Q276-K280 WeakPolarHBondContact O-CD 3.24Å; Q276-K280 VanDerWaalsContact O-CG 3.23Å; Q276-K280 WeakPolarHBondContact O-CG 3.42Å; Q276-K280 PolarHBondContact O-N 3.01Å; K277-K280 PolarHBondContact O-N 3.18Å; S278-K280 PolarHBondContact O-N 2.86Å; K280-L284 WeakPolarHBondContact O-CB 3.41Å; K280-L284 WeakPolarHBondContact O-CD1 3.34Å; K280-L284 WeakPolarHBondContact O-CG 3.49Å; K280-L284 PolarHBondContact O-N 3.35Å
281V96.8Very high96.2Very high95 Ų9599.1 Ų99.158%0.57652%0.517SS*.Hα-helixtrans-69.5-36.2173.4168.20000111.5K277 S278 V279 R285K277-V281 WeakPolarHBondContact O-CG2 3.39Å; K277-V281 PolarHBondContact O-N 3.13Å; S278-V281 PolarHBondContact O-N 3.41Å; V279-V281 VanDerWaalsContact C-N 3.3Å; V279-V281 PolarHBondContact O-N 2.68Å; V281-R285 VanDerWaalsContact O-CB 3.24Å; V281-R285 WeakPolarHBondContact O-CB 3.35Å; V281-R285 PolarHBondContact O-N 3.03Å
282Q95.7Very high96.2Very high124 Ų124100.4 Ų100.458%0.57952%0.518SS*.Hα-helixtrans-68-42.6175.9-175.1169.5-10.900111.9S278 V279 R285 T286S278-Q282 WeakPolarHBondContact O-CB 3.35Å; S278-Q282 PolarHBondContact O-N 2.98Å; V279-Q282 CarbonylContact O-C 3.6Å; V279-Q282 WeakPolarHBondContact O-CA 3.49Å; V279-Q282 WeakPolarHBondContact O-CB 3.41Å; V279-Q282 PolarHBondContact O-N 3.19Å; Q282-R285 WeakPolarHBondContact O-CB 3.41Å; Q282-R285 PolarHBondContact O-N 2.79Å; Q282-T286 PolarHBondContact O-N 3.32Å; Q282-T286 PolarHBondContact O-OG1 3.07Å
283D96.2Very high96.1Very high96 Ų96100.8 Ų100.851%0.51352%0.523SS..Hα-helixtrans-65.9-41.3175.8-65.4-29.1000111.9V279 R285 T286 G287V279-D283 PolarHBondContact O-N 3.41Å; D283-R285 VanDerWaalsContact C-N 3.29Å; D283-R285 PolarHBondContact O-N 3.2Å; D283-T286 WeakPolarHBondContact CA-OG1 3.36Å; D283-T286 PolarHBondContact O-N 3.49Å; D283-T286 PolarHBondContact O-OG1 2.86Å; D283-G287 PolarHBondContact O-N 2.92Å
284L96.4Very high96.1Very high130 Ų130101 Ų10168%0.68152%0.522SS*.Hα-helixtrans-64.4-34.6172.1-73.5170.1000111.8K280 F288K280-L284 WeakPolarHBondContact O-CB 3.41Å; K280-L284 WeakPolarHBondContact O-CD1 3.34Å; K280-L284 WeakPolarHBondContact O-CG 3.49Å; K280-L284 PolarHBondContact O-N 3.35Å; L284-F288 VanDerWaalsContact O-CB 3.23Å; L284-F288 WeakPolarHBondContact O-CB 3.46Å; L284-F288 PolarHBondContact O-N 3.19Å
285R96.4Very high96Very high194 Ų194100.2 Ų100.273%0.73252%0.518SS*.Hα-helixtrans-72.2-39.3177.3-175.6178.4179.4-174.90.2112.7V281 Q282 D283 S289V281-R285 VanDerWaalsContact O-CB 3.24Å; V281-R285 WeakPolarHBondContact O-CB 3.35Å; V281-R285 PolarHBondContact O-N 3.03Å; Q282-R285 WeakPolarHBondContact O-CB 3.41Å; Q282-R285 PolarHBondContact O-N 2.79Å; D283-R285 VanDerWaalsContact C-N 3.29Å; D283-R285 PolarHBondContact O-N 3.2Å; R285-S289 PolarHBondContact O-N 3.49Å
286T95.5Very high96Very high82 Ų8299.6 Ų99.650%0.50352%0.52SS..Hα-helixtrans-70.1-40.3174.553.70000111.1Q282 D283 S289 Q290Q282-T286 PolarHBondContact O-N 3.32Å; Q282-T286 PolarHBondContact O-OG1 3.07Å; D283-T286 WeakPolarHBondContact CA-OG1 3.36Å; D283-T286 PolarHBondContact O-N 3.49Å; D283-T286 PolarHBondContact O-OG1 2.86Å; T286-S289 PolarHBondContact O-N 2.95Å; T286-Q290 WeakPolarHBondContact O-CB 3.41Å; T286-Q290 PolarHBondContact O-N 2.88Å
287G97.4Very high96Very high36 Ų3698 Ų9837%0.37152%0.518SS..Hα-helixtrans-60.3-44.1171.600000112.9D283 Q290 A291D283-G287 PolarHBondContact O-N 2.92Å; G287-Q290 PolarHBondContact O-N 3.37Å; G287-A291 WeakPolarHBondContact O-CB 3.42Å; G287-A291 PolarHBondContact O-N 2.65Å
288F94.9Very high95.9Very high136 Ų13693.3 Ų93.360%0.59651%0.507SS*.Hα-helixtrans-62.7-44.7174.5179.6-93.2000112.1L284 A291 Q292L284-F288 VanDerWaalsContact O-CB 3.23Å; L284-F288 WeakPolarHBondContact O-CB 3.46Å; L284-F288 PolarHBondContact O-N 3.19Å; F288-A291 PolarHBondContact O-N 2.86Å; F288-Q292 VanDerWaalsContact CE1-OE1 3.24Å; F288-Q292 WeakPolarHBondContact O-CB 3.31Å; F288-Q292 PolarHBondContact O-N 3.38Å
289S95.8Very high95.8Very high59 Ų5994.1 Ų94.141%0.41351%0.507SS..Hα-helixtrans-58.1-50.7174.9-164.40000110.9R285 T286 A291 Q292 D293R285-S289 PolarHBondContact O-N 3.49Å; T286-S289 PolarHBondContact O-N 2.95Å; S289-A291 VanDerWaalsContact C-N 3.28Å; S289-A291 PolarHBondContact O-N 2.79Å; S289-Q292 CarbonylContact O-C 3.6Å; S289-Q292 PolarHBondContact O-N 3.11Å; S289-D293 PolarHBondContact O-N 3.3Å; S289-D293 VanDerWaalsContact O-OD2 3.06Å
290Q96Very high95.8Very high114 Ų11492.6 Ų92.653%0.53350%0.502SS..Hα-helixtrans-61.7-35.6179.3-168.6-173.454.800112.4T286 G287 K294T286-Q290 WeakPolarHBondContact O-CB 3.41Å; T286-Q290 PolarHBondContact O-N 2.88Å; G287-Q290 PolarHBondContact O-N 3.37Å; Q290-K294 HydrophobicContact CG-CD 4.5Å; Q290-K294 WeakPolarHBondContact O-CB 3.45Å; Q290-K294 VanDerWaalsContact O-CG 3.29Å; Q290-K294 WeakPolarHBondContact O-CG 3.49Å; Q290-K294 PolarHBondContact O-N 3.19Å
291A93.9Very high95.7Very high57 Ų5794.3 Ų94.347%0.47151%0.505SS..Hα-helixtrans-66.9-39.4173.600000111.8G287 F288 S289 K294 L295G287-A291 WeakPolarHBondContact O-CB 3.42Å; G287-A291 PolarHBondContact O-N 2.65Å; F288-A291 PolarHBondContact O-N 2.86Å; S289-A291 VanDerWaalsContact C-N 3.28Å; S289-A291 PolarHBondContact O-N 2.79Å; A291-K294 PolarHBondContact O-N 3.13Å; A291-L295 WeakPolarHBondContact O-CB 3.3Å; A291-L295 PolarHBondContact O-N 2.72Å
292Q96.4Very high95.5Very high102 Ų10294.2 Ų94.248%0.47750%0.501SS..Hα-helixtrans-71.6-34.2176.5-172.1159.93.700112.6F288 S289 L295 S296F288-Q292 VanDerWaalsContact CE1-OE1 3.24Å; F288-Q292 WeakPolarHBondContact O-CB 3.31Å; F288-Q292 PolarHBondContact O-N 3.38Å; S289-Q292 CarbonylContact O-C 3.6Å; S289-Q292 PolarHBondContact O-N 3.11Å; Q292-L295 PolarHBondContact O-N 2.88Å; Q292-S296 WeakPolarHBondContact O-CB 3.48Å; Q292-S296 PolarHBondContact O-N 2.89Å; Q292-S296 PolarHBondContact O-OG 2.91Å
293D95.1Very high95.5Very high97 Ų9794.1 Ų94.152%0.51950%0.5SS..Hα-helixtrans-66.3-42.1172-61.2-38.2000111S289 S296 S297S289-D293 PolarHBondContact O-N 3.3Å; S289-D293 VanDerWaalsContact O-OD2 3.06Å; D293-S296 PolarHBondContact O-N 3.28Å; D293-S297 WeakPolarHBondContact O-CB 3.44Å; D293-S297 PolarHBondContact O-N 3.5Å; D293-S297 PolarHBondContact O-OG 2.91Å
294K96.8Very high95.4Very high89 Ų8994.6 Ų94.639%0.38750%0.499SS..Hα-helixtrans-63.3-41172.4-78.5176171.7-179.60112.1Q290 A291 S297 A298 G1103Q290-K294 HydrophobicContact CG-CD 4.5Å; Q290-K294 WeakPolarHBondContact O-CB 3.45Å; Q290-K294 VanDerWaalsContact O-CG 3.29Å; Q290-K294 WeakPolarHBondContact O-CG 3.49Å; Q290-K294 PolarHBondContact O-N 3.19Å; A291-K294 PolarHBondContact O-N 3.13Å; K294-S297 WeakPolarHBondContact CA-OG 3.32Å; K294-S297 PolarHBondContact O-OG 3.43Å; K294-A298 VanDerWaalsContact O-CB 3.29Å; K294-A298 WeakPolarHBondContact O-CB 3.45Å; K294-A298 PolarHBondContact O-N 3.07Å; K294-G1103 PolarHBondContact NZ-O 2.64Å
295L94.6Very high95.2Very high104 Ų10493 Ų9355%0.54549%0.489SS..Hα-helixtrans-67-41.6175.4-179.261.7000112A291 Q292 A298 N299A291-L295 WeakPolarHBondContact O-CB 3.3Å; A291-L295 PolarHBondContact O-N 2.72Å; Q292-L295 PolarHBondContact O-N 2.88Å; L295-A298 PolarHBondContact O-N 2.9Å; L295-N299 PolarHBondContact O-N 3.16Å
296S95.5Very high95.1Very high66 Ų6688.9 Ų88.946%0.46248%0.478SS..Hα-helixtrans-66.1-42179.8-56.90000111.7Q292 D293 N299 A300Q292-S296 WeakPolarHBondContact O-CB 3.48Å; Q292-S296 PolarHBondContact O-N 2.89Å; Q292-S296 PolarHBondContact O-OG 2.91Å; D293-S296 PolarHBondContact O-N 3.28Å; S296-N299 PolarHBondContact O-N 2.86Å; S296-A300 PolarHBondContact O-N 3.21Å
297S95.9Very high95.1Very high55 Ų5590.6 Ų90.639%0.38548%0.48SS..Hα-helixtrans-71.7-29.2174.252.30000113.4D293 K294 R301D293-S297 WeakPolarHBondContact O-CB 3.44Å; D293-S297 PolarHBondContact O-N 3.5Å; D293-S297 PolarHBondContact O-OG 2.91Å; K294-S297 WeakPolarHBondContact CA-OG 3.32Å; K294-S297 PolarHBondContact O-OG 3.43Å; S297-R301 WeakPolarHBondContact O-CG 3.44Å; S297-R301 PolarHBondContact O-N 3.14Å
298A94.2Very high95.1Very high49 Ų4992.4 Ų92.441%0.40548%0.477SS..Hα-helixtrans-67.5-43.9168.900000111.9K294 L295 A300 R301 L302K294-A298 VanDerWaalsContact O-CB 3.29Å; K294-A298 WeakPolarHBondContact O-CB 3.45Å; K294-A298 PolarHBondContact O-N 3.07Å; L295-A298 PolarHBondContact O-N 2.9Å; A298-A300 PolarHBondContact O-N 3.41Å; A298-R301 PolarHBondContact O-N 3.02Å; A298-L302 PolarHBondContact O-N 2.9Å
299N94.4Very high95Very high86 Ų8689.4 Ų89.446%0.4647%0.47SS..Hα-helixtrans-64-38.4175.4-816.6000112.5L295 S296 L302 Q303L295-N299 PolarHBondContact O-N 3.16Å; S296-N299 PolarHBondContact O-N 2.86Å; N299-L302 WeakPolarHBondContact O-CB 3.45Å; N299-L302 PolarHBondContact O-N 3.01Å; N299-Q303 PolarHBondContact O-N 3.26Å
300A95.6Very high94.9Very high46 Ų4694.1 Ų94.138%0.3848%0.484SS..Hα-helixtrans-61-45.2174.400000111.6S296 A298 Q303 E304S296-A300 PolarHBondContact O-N 3.21Å; A298-A300 PolarHBondContact O-N 3.41Å; A300-Q303 PolarHBondContact O-N 3.12Å; A300-E304 PolarHBondContact O-N 2.9Å
301R95.5Very high94.9Very high164 Ų16495.3 Ų95.362%0.61948%0.483SS*.Hα-helixtrans-64-39.3173.7-69.7174.7-171169.95.3112.3S297 A298 Q303 E304 E305S297-R301 WeakPolarHBondContact O-CG 3.44Å; S297-R301 PolarHBondContact O-N 3.14Å; A298-R301 PolarHBondContact O-N 3.02Å; R301-Q303 VanDerWaalsContact C-N 3.32Å; R301-Q303 PolarHBondContact O-N 3.21Å; R301-E304 WeakPolarHBondContact O-CB 3.45Å; R301-E304 PolarHBondContact O-N 3.4Å; R301-E305 WeakPolarHBondContact O-CG 3.44Å; R301-E305 PolarHBondContact O-N 2.78Å
302L93.6Very high95Very high93 Ų9397.7 Ų97.749%0.48749%0.487SS..Hα-helixtrans-58.8-45.4175.2-177.264.5000110.7A298 N299 E304 E305 E306A298-L302 PolarHBondContact O-N 2.9Å; N299-L302 WeakPolarHBondContact O-CB 3.45Å; N299-L302 PolarHBondContact O-N 3.01Å; L302-E304 PolarHBondContact O-N 3.49Å; L302-E305 PolarHBondContact O-N 2.81Å; L302-E306 HydrophobicContact CG-CG 4.44Å; L302-E306 WeakPolarHBondContact O-CB 3.42Å; L302-E306 VanDerWaalsContact O-CG 3.3Å; L302-E306 WeakPolarHBondContact O-CG 3.49Å; L302-E306 PolarHBondContact O-N 2.89Å
303Q95.2Very high94.8Very high121 Ų12197.9 Ų97.957%0.56549%0.488SS*.Hα-helixtrans-65.2-34.9175.3-71.8-174.6-2200113.2N299 A300 R301 Q307N299-Q303 PolarHBondContact O-N 3.26Å; A300-Q303 PolarHBondContact O-N 3.12Å; R301-Q303 VanDerWaalsContact C-N 3.32Å; R301-Q303 PolarHBondContact O-N 3.21Å; Q303-Q307 WeakPolarHBondContact O-CB 3.48Å; Q303-Q307 VanDerWaalsContact O-CG 3.31Å; Q303-Q307 WeakPolarHBondContact O-CG 3.4Å; Q303-Q307 PolarHBondContact O-N 3.28Å
304E95.1Very high94.8Very high106 Ų10695.9 Ų95.950%0.49549%0.485SS..Hα-helixtrans-64.6-40.9171.5-74.4180-158.200112.4A300 R301 L302 K308A300-E304 PolarHBondContact O-N 2.9Å; R301-E304 WeakPolarHBondContact O-CB 3.45Å; R301-E304 PolarHBondContact O-N 3.4Å; L302-E304 PolarHBondContact O-N 3.49Å; E304-K308 VanDerWaalsContact O-CG 3.24Å; E304-K308 WeakPolarHBondContact O-CG 3.24Å; E304-K308 PolarHBondContact O-N 2.63Å
305E92.3Very high94.7Very high98 Ų9897.7 Ų97.746%0.45850%0.495SS..Hα-helixtrans-71-41.5175.5-63.1-48.7136.400112.1R301 L302 Q307 K308 V309R301-E305 WeakPolarHBondContact O-CG 3.44Å; R301-E305 PolarHBondContact O-N 2.78Å; L302-E305 PolarHBondContact O-N 2.81Å; E305-Q307 VanDerWaalsContact C-N 3.29Å; E305-Q307 PolarHBondContact O-N 3.01Å; E305-K308 CarbonylContact O-C 3.59Å; E305-K308 WeakPolarHBondContact O-CA 3.26Å; E305-K308 WeakPolarHBondContact O-CB 3.45Å; E305-K308 PolarHBondContact O-N 3.36Å; E305-K308 IonicContact OE1-NZ 2.68Å; E305-K308 PolarHBondContact OE1-NZ 3.39Å; E305-K308 VanDerWaalsContact OE2-CD 3.26Å; E305-K308 WeakPolarHBondContact OE2-CD 3.48Å; E305-K308 IonicContact OE2-NZ 2.65Å; E305-V309 WeakPolarHBondContact O-CG2 3.46Å; E305-V309 PolarHBondContact O-N 3.21Å
306E94.3Very high94.7Very high107 Ų10798.1 Ų98.150%0.550%0.497SS..Hα-helixtrans-55-45.1171.6-75.6171.6167.100110.7L302 K308 V309 F310L302-E306 HydrophobicContact CG-CG 4.44Å; L302-E306 WeakPolarHBondContact O-CB 3.42Å; L302-E306 VanDerWaalsContact O-CG 3.3Å; L302-E306 WeakPolarHBondContact O-CG 3.49Å; L302-E306 PolarHBondContact O-N 2.89Å; E306-K308 PolarHBondContact O-N 3.25Å; E306-V309 PolarHBondContact O-N 3Å; E306-F310 WeakPolarHBondContact O-CB 3.26Å; E306-F310 PolarHBondContact O-N 3.43Å
307Q95.6Very high94.7Very high117 Ų117100.9 Ų100.955%0.54751%0.506SS..Hα-helixtrans-69.1-28.5174.6-72.8-175.725.200113.9Q303 E305 R311Q303-Q307 WeakPolarHBondContact O-CB 3.48Å; Q303-Q307 VanDerWaalsContact O-CG 3.31Å; Q303-Q307 WeakPolarHBondContact O-CG 3.4Å; Q303-Q307 PolarHBondContact O-N 3.28Å; E305-Q307 VanDerWaalsContact C-N 3.29Å; E305-Q307 PolarHBondContact O-N 3.01Å; Q307-R311 WeakPolarHBondContact O-CG 3.22Å; Q307-R311 PolarHBondContact O-N 3.24Å; Q307-R311 PolarHBondContact O-NH1 3Å
308K96.1Very high94.6Very high74 Ų74102.9 Ų102.932%0.32251%0.509SS..Hα-helixtrans-70.1-45.4172.3-72.6161.4-163.8169.10110.4E304 E305 E306 R311 L312E304-K308 VanDerWaalsContact O-CG 3.24Å; E304-K308 WeakPolarHBondContact O-CG 3.24Å; E304-K308 PolarHBondContact O-N 2.63Å; E305-K308 CarbonylContact O-C 3.59Å; E305-K308 WeakPolarHBondContact O-CA 3.26Å; E305-K308 WeakPolarHBondContact O-CB 3.45Å; E305-K308 PolarHBondContact O-N 3.36Å; E305-K308 IonicContact OE1-NZ 2.68Å; E305-K308 PolarHBondContact OE1-NZ 3.39Å; E305-K308 VanDerWaalsContact OE2-CD 3.26Å; E305-K308 WeakPolarHBondContact OE2-CD 3.48Å; E305-K308 IonicContact OE2-NZ 2.65Å; E306-K308 PolarHBondContact O-N 3.25Å; K308-R311 VanDerWaalsContact CG-NH2 3.28Å; K308-R311 PolarHBondContact O-N 2.9Å; K308-L312 WeakPolarHBondContact O-CG 3.32Å; K308-L312 PolarHBondContact O-N 3.09Å
309V93.8Very high94.6Very high74 Ų74105.2 Ų105.245%0.44851%0.512SS..Hα-helixtrans-57.9-50174.1172.30000110.2E305 E306 R311 L312 E313E305-V309 WeakPolarHBondContact O-CG2 3.46Å; E305-V309 PolarHBondContact O-N 3.21Å; E306-V309 PolarHBondContact O-N 3Å; V309-R311 PolarHBondContact O-N 3.15Å; V309-L312 CarbonylContact O-C 3.58Å; V309-L312 PolarHBondContact O-N 2.76Å; V309-E313 HydrophobicContact CG1-CG 4.09Å; V309-E313 WeakPolarHBondContact O-CB 3.47Å; V309-E313 WeakPolarHBondContact O-CG 3.49Å; V309-E313 PolarHBondContact O-N 2.9Å
310F94.1Very high94.5Very high158 Ų158103.5 Ų103.569%0.69351%0.51SS*.Hα-helixtrans-59.6-33.1179.8-143.8-77.9000113.1E306 A314E306-F310 WeakPolarHBondContact O-CB 3.26Å; E306-F310 PolarHBondContact O-N 3.43Å; F310-A314 WeakPolarHBondContact O-CB 3.19Å; F310-A314 PolarHBondContact O-N 2.95Å
311R95.9Very high94.4Very high139 Ų139104.4 Ų104.453%0.52551%0.514SS..Hα-helixtrans-71.9-43.3172.6-75.7-174.1-63.9-90.20.6112.4Q307 K308 V309 A314 E315Q307-R311 WeakPolarHBondContact O-CG 3.22Å; Q307-R311 PolarHBondContact O-N 3.24Å; Q307-R311 PolarHBondContact O-NH1 3Å; K308-R311 VanDerWaalsContact CG-NH2 3.28Å; K308-R311 PolarHBondContact O-N 2.9Å; V309-R311 PolarHBondContact O-N 3.15Å; R311-A314 PolarHBondContact O-N 3.34Å; R311-E315 WeakPolarHBondContact O-CB 3.4Å; R311-E315 PolarHBondContact O-N 2.95Å
312L94.4Very high94.4Very high107 Ų107103.3 Ų103.356%0.5651%0.509SS*.Hα-helixtrans-67.5-35.6178.1-70.1169.2000112.1K308 V309 E315 L316K308-L312 WeakPolarHBondContact O-CG 3.32Å; K308-L312 PolarHBondContact O-N 3.09Å; V309-L312 CarbonylContact O-C 3.58Å; V309-L312 PolarHBondContact O-N 2.76Å; L312-E315 PolarHBondContact O-N 3.12Å; L312-L316 WeakPolarHBondContact O-CB 3.49Å; L312-L316 PolarHBondContact O-N 2.99Å
313E93.1Very high94.3Very high105 Ų105105.4 Ų105.449%0.49152%0.516SS..Hα-helixtrans-64.3-43.6172.1-72.8178.2157.200111.2V309 L316 L317V309-E313 HydrophobicContact CG1-CG 4.09Å; V309-E313 WeakPolarHBondContact O-CB 3.47Å; V309-E313 WeakPolarHBondContact O-CG 3.49Å; V309-E313 PolarHBondContact O-N 2.9Å; E313-L316 PolarHBondContact O-N 3.45Å; E313-L317 WeakPolarHBondContact O-CB 3.29Å; E313-L317 VanDerWaalsContact O-CG 3.24Å; E313-L317 WeakPolarHBondContact O-CG 3.31Å; E313-L317 PolarHBondContact O-N 2.9Å
314A94.8Very high94.2Very high55 Ų55104.7 Ų104.746%0.45551%0.513SS..Hα-helixtrans-64.6-43.7174.800000112.5F310 R311 L317 E318F310-A314 WeakPolarHBondContact O-CB 3.19Å; F310-A314 PolarHBondContact O-N 2.95Å; R311-A314 PolarHBondContact O-N 3.34Å; A314-L317 PolarHBondContact O-N 2.87Å; A314-E318 PolarHBondContact O-N 3.03Å
315E94.9Very high94.2Very high128 Ų128105.9 Ų105.960%0.59852%0.518SS*.Hα-helixtrans-65.3-38.9177.1-175170.4-160.300111.9R311 L312 E318 Q319R311-E315 WeakPolarHBondContact O-CB 3.4Å; R311-E315 PolarHBondContact O-N 2.95Å; L312-E315 PolarHBondContact O-N 3.12Å; E315-E318 PolarHBondContact O-N 2.95Å; E315-Q319 WeakPolarHBondContact O-CB 3.48Å; E315-Q319 PolarHBondContact O-N 3.42Å
316L93.6Very high94.2Very high113 Ų113106.1 Ų106.159%0.59252%0.523SS*.Hα-helixtrans-71.9-34.7176.6-170.6147.8000112.1L312 E313 Q319 A320L312-L316 WeakPolarHBondContact O-CB 3.49Å; L312-L316 PolarHBondContact O-N 2.99Å; E313-L316 PolarHBondContact O-N 3.45Å; L316-Q319 PolarHBondContact O-N 3.5Å; L316-A320 VanDerWaalsContact O-CB 3.29Å; L316-A320 WeakPolarHBondContact O-CB 3.29Å; L316-A320 PolarHBondContact O-N 3.36Å
317L95.4Very high94Very high123 Ų123107.1 Ų107.164%0.64453%0.527SS*.Hα-helixtrans-66.1-39.4170.1-76.2169.4000111.9E313 A314 A320 S321E313-L317 WeakPolarHBondContact O-CB 3.29Å; E313-L317 VanDerWaalsContact O-CG 3.24Å; E313-L317 WeakPolarHBondContact O-CG 3.31Å; E313-L317 PolarHBondContact O-N 2.9Å; A314-L317 PolarHBondContact O-N 2.87Å; L317-A320 PolarHBondContact O-N 3.48Å; L317-S321 PolarHBondContact O-N 3.42Å; L317-S321 PolarHBondContact O-OG 3.06Å
318E94.7Very high93.9Very high97 Ų97107 Ų10745%0.45353%0.527SS..Hα-helixtrans-68.7-39.2173.7-158.5-167.1156.600111.6A314 E315 A320 S321 R322A314-E318 PolarHBondContact O-N 3.03Å; E315-E318 PolarHBondContact O-N 2.95Å; E318-A320 VanDerWaalsContact C-N 3.33Å; E318-A320 PolarHBondContact O-N 2.8Å; E318-S321 PolarHBondContact O-N 2.83Å; E318-S321 PolarHBondContact O-OG 2.85Å; E318-R322 VanDerWaalsContact CD-NH2 3.35Å; E318-R322 WeakPolarHBondContact O-CB 3.34Å; E318-R322 VanDerWaalsContact O-CG 3.23Å; E318-R322 WeakPolarHBondContact O-CG 3.44Å; E318-R322 PolarHBondContact O-N 3.4Å; E318-R322 IonicContact OE1-CZ 2.79Å; E318-R322 IonicContact OE1-NE 3.81Å; E318-R322 PolarHBondContact OE1-NE 2.85Å; E318-R322 IonicContact OE1-NH2 2.97Å; E318-R322 PolarHBondContact OE1-NH2 3.26Å; E318-R322 IonicContact OE2-NH2 3.71Å
319Q93.8Very high93.8Very high98 Ų98105.5 Ų105.546%0.45853%0.528SS..Hα-helixtrans-64.5-39.4174.4-167.5179.618.100111.4E315 L316 H323E315-Q319 WeakPolarHBondContact O-CB 3.48Å; E315-Q319 PolarHBondContact O-N 3.42Å; L316-Q319 PolarHBondContact O-N 3.5Å; Q319-H323 VanDerWaalsContact CG-NE2 3.33Å; Q319-H323 WeakPolarHBondContact CG-NE2 3.48Å; Q319-H323 PolarHBondContact NE2-NE2 3.41Å; Q319-H323 WeakPolarHBondContact O-CB 3.38Å; Q319-H323 PolarHBondContact O-CD2 2.95Å; Q319-H323 PolarHBondContact O-N 2.86Å
320A93.1Very high93.6Very high50 Ų50107.3 Ų107.341%0.41353%0.533SS..Hα-helixtrans-65.6-40.1175.200000112.4L316 L317 E318 H324L316-A320 VanDerWaalsContact O-CB 3.29Å; L316-A320 WeakPolarHBondContact O-CB 3.29Å; L316-A320 PolarHBondContact O-N 3.36Å; L317-A320 PolarHBondContact O-N 3.48Å; E318-A320 VanDerWaalsContact C-N 3.33Å; E318-A320 PolarHBondContact O-N 2.8Å; A320-H324 WeakPolarHBondContact O-CB 3.12Å; A320-H324 PolarHBondContact O-N 2.87Å
321S93.8Very high93.5Very high66 Ų66103.4 Ų103.446%0.46252%0.522SS..Hα-helixtrans-70.7-38.6177700000112.3L317 E318 H324 Q325L317-S321 PolarHBondContact O-N 3.42Å; L317-S321 PolarHBondContact O-OG 3.06Å; E318-S321 PolarHBondContact O-N 2.83Å; E318-S321 PolarHBondContact O-OG 2.85Å; S321-H324 PolarHBondContact O-N 3.5Å; S321-Q325 WeakPolarHBondContact O-CB 3.29Å; S321-Q325 PolarHBondContact O-N 2.99Å
322R94.9Very high93.3Very high140 Ų14099.4 Ų99.453%0.52852%0.519SS..Hα-helixtrans-59.7-49.7170.4-71172-175.2-168.87.4111.5E318 H324 Q325 D326E318-R322 VanDerWaalsContact CD-NH2 3.35Å; E318-R322 WeakPolarHBondContact O-CB 3.34Å; E318-R322 VanDerWaalsContact O-CG 3.23Å; E318-R322 WeakPolarHBondContact O-CG 3.44Å; E318-R322 PolarHBondContact O-N 3.4Å; E318-R322 IonicContact OE1-CZ 2.79Å; E318-R322 IonicContact OE1-NE 3.81Å; E318-R322 PolarHBondContact OE1-NE 2.85Å; E318-R322 IonicContact OE1-NH2 2.97Å; E318-R322 PolarHBondContact OE1-NH2 3.26Å; E318-R322 IonicContact OE2-NH2 3.71Å; R322-H324 VanDerWaalsContact C-N 3.29Å; R322-H324 PolarHBondContact O-N 3.3Å; R322-Q325 PolarHBondContact O-N 3.46Å; R322-Q325 VanDerWaalsContact O-N 3.17Å; R322-D326 WeakPolarHBondContact O-CB 3.47Å; R322-D326 PolarHBondContact O-N 3.3Å
323H91.9Very high93.3Very high137 Ų137100.1 Ų100.163%0.63452%0.517SS*.Hα-helixtrans-60.2-37.7176.3-77.8-47.7000112.6Q319 Q327Q319-H323 VanDerWaalsContact CG-NE2 3.33Å; Q319-H323 WeakPolarHBondContact CG-NE2 3.48Å; Q319-H323 PolarHBondContact NE2-NE2 3.41Å; Q319-H323 WeakPolarHBondContact O-CB 3.38Å; Q319-H323 PolarHBondContact O-CD2 2.95Å; Q319-H323 PolarHBondContact O-N 2.86Å; H323-Q327 WeakPolarHBondContact O-CB 3.35Å; H323-Q327 PolarHBondContact O-N 3.15Å
324H93.6Very high93.1Very high106 Ų106100.6 Ų100.649%0.49152%0.523SS..Hα-helixtrans-66.1-44.8174.9-172.441.5000111.5A320 S321 R322 D326 Q327 E328A320-H324 WeakPolarHBondContact O-CB 3.12Å; A320-H324 PolarHBondContact O-N 2.87Å; S321-H324 PolarHBondContact O-N 3.5Å; R322-H324 VanDerWaalsContact C-N 3.29Å; R322-H324 PolarHBondContact O-N 3.3Å; H324-D326 PolarHBondContact O-N 3.47Å; H324-Q327 WeakPolarHBondContact O-CB 3.38Å; H324-Q327 PolarHBondContact O-N 3.19Å; H324-Q327 VanDerWaalsContact O-N 3.17Å; H324-E328 WeakPolarHBondContact O-CG 3.36Å; H324-E328 PolarHBondContact O-N 3.27Å
325Q94Very high92.9Very high132 Ų132101.8 Ų101.862%0.61752%0.524SS*.Hα-helixtrans-64.3-38.5176.7-170174.927.600112.3S321 R322 E328 A329S321-Q325 WeakPolarHBondContact O-CB 3.29Å; S321-Q325 PolarHBondContact O-N 2.99Å; R322-Q325 PolarHBondContact O-N 3.46Å; R322-Q325 VanDerWaalsContact O-N 3.17Å; Q325-E328 PolarHBondContact O-N 2.95Å; Q325-A329 VanDerWaalsContact O-CB 3.27Å; Q325-A329 WeakPolarHBondContact O-CB 3.29Å; Q325-A329 PolarHBondContact O-N 3.49Å
326D92.6Very high92.8Very high102 Ų10298.4 Ų98.455%0.54552%0.515SS..Hα-helixtrans-66-38.1172.2-81.8-34.1000111.6R322 H324 A329 M330R322-D326 WeakPolarHBondContact O-CB 3.47Å; R322-D326 PolarHBondContact O-N 3.3Å; H324-D326 PolarHBondContact O-N 3.47Å; D326-A329 PolarHBondContact O-N 3.23Å; D326-M330 VanDerWaalsContact O-CB 3.3Å; D326-M330 WeakPolarHBondContact O-CB 3.47Å; D326-M330 VanDerWaalsContact O-CG 3.27Å; D326-M330 WeakPolarHBondContact O-CG 3.31Å; D326-M330 PolarHBondContact O-N 2.96Å
327Q91.1Very high92.6Very high128 Ų12899.1 Ų99.160%0.59852%0.515SS*.Hα-helixtrans-66.3-42.3174.1-173.5-178.28.800111.9H323 H324 M330 T331H323-Q327 WeakPolarHBondContact O-CB 3.35Å; H323-Q327 PolarHBondContact O-N 3.15Å; H324-Q327 WeakPolarHBondContact O-CB 3.38Å; H324-Q327 PolarHBondContact O-N 3.19Å; H324-Q327 VanDerWaalsContact O-N 3.17Å; Q327-M330 PolarHBondContact O-N 3.19Å; Q327-T331 WeakPolarHBondContact O-CB 3.49Å; Q327-T331 PolarHBondContact O-N 2.89Å; Q327-T331 PolarHBondContact O-OG1 3.14Å
328E92.6Very high92.4Very high116 Ų11697 Ų9754%0.54250%0.504SS..Hα-helixtrans-61.5-47172.3-72.8-170.1135.700110.9H324 Q325 M330 T331 A332H324-E328 WeakPolarHBondContact O-CG 3.36Å; H324-E328 PolarHBondContact O-N 3.27Å; Q325-E328 PolarHBondContact O-N 2.95Å; E328-M330 PolarHBondContact O-N 2.88Å; E328-T331 PolarHBondContact O-N 3.01Å; E328-A332 WeakPolarHBondContact O-CB 3.29Å; E328-A332 PolarHBondContact O-N 2.82Å
329A94Very high92.2Very high41 Ų4194.5 Ų94.534%0.33950%0.501SS..Hα-helixtrans-63.9-38.8178.300000112.5Q325 D326 K333Q325-A329 VanDerWaalsContact O-CB 3.27Å; Q325-A329 WeakPolarHBondContact O-CB 3.29Å; Q325-A329 PolarHBondContact O-N 3.49Å; D326-A329 PolarHBondContact O-N 3.23Å; A329-K333 WeakPolarHBondContact O-CB 3.38Å; A329-K333 VanDerWaalsContact O-CG 3.25Å; A329-K333 WeakPolarHBondContact O-CG 3.38Å; A329-K333 PolarHBondContact O-N 2.64Å
330M90.3Very high92.1Very high112 Ų11295.6 Ų95.655%0.55251%0.506SS*.Hα-helixtrans-67.2-38.5172.5-77.1-63.2-67.600112D326 Q327 E328 K333 L334D326-M330 VanDerWaalsContact O-CB 3.3Å; D326-M330 WeakPolarHBondContact O-CB 3.47Å; D326-M330 VanDerWaalsContact O-CG 3.27Å; D326-M330 WeakPolarHBondContact O-CG 3.31Å; D326-M330 PolarHBondContact O-N 2.96Å; Q327-M330 PolarHBondContact O-N 3.19Å; E328-M330 PolarHBondContact O-N 2.88Å; M330-K333 PolarHBondContact O-N 3.47Å; M330-K333 HydrophobicContact SD-CD 4.04Å; M330-L334 WeakPolarHBondContact O-CB 3.32Å; M330-L334 PolarHBondContact O-N 3.21Å
331T90.4Very high91.9Very high76 Ų7696.7 Ų96.747%0.46651%0.505SS..Hα-helixtrans-67.9-39.7176-55.60000111.3Q327 E328 L334 T335Q327-T331 WeakPolarHBondContact O-CB 3.49Å; Q327-T331 PolarHBondContact O-N 2.89Å; Q327-T331 PolarHBondContact O-OG1 3.14Å; E328-T331 PolarHBondContact O-N 3.01Å; T331-L334 PolarHBondContact O-N 2.98Å; T331-T335 WeakPolarHBondContact O-CG2 3.49Å; T331-T335 PolarHBondContact O-N 3.4Å; T331-T335 PolarHBondContact O-OG1 3.11Å
332A91.7Very high91.6Very high56 Ų5699.4 Ų99.446%0.46351%0.505SS..Hα-helixtrans-63.3-46173.200000111.7E328 T335 S336E328-A332 WeakPolarHBondContact O-CB 3.29Å; E328-A332 PolarHBondContact O-N 2.82Å; A332-T335 PolarHBondContact O-OG1 3.26Å; A332-S336 WeakPolarHBondContact O-CB 3.33Å; A332-S336 PolarHBondContact O-N 2.93Å
333K94.5Very high91.4Very high121 Ų12197 Ų9753%0.52650%0.499SS..Hα-helixtrans-56-52.5171.4-74.1166.7-174.9170.80111A329 M330 T335 S336 E337A329-K333 WeakPolarHBondContact O-CB 3.38Å; A329-K333 VanDerWaalsContact O-CG 3.25Å; A329-K333 WeakPolarHBondContact O-CG 3.38Å; A329-K333 PolarHBondContact O-N 2.64Å; M330-K333 PolarHBondContact O-N 3.47Å; M330-K333 HydrophobicContact SD-CD 4.04Å; K333-T335 PolarHBondContact O-N 2.89Å; K333-S336 WeakPolarHBondContact O-CA 3.48Å; K333-S336 WeakPolarHBondContact O-CB 3.44Å; K333-S336 PolarHBondContact O-N 2.98Å; K333-S336 PolarHBondContact O-OG 3.09Å; K333-E337 PolarHBondContact O-N 2.82Å
334L89.6Confident91.3Very high115 Ų11595.1 Ų95.160%0.60249%0.494SS*.Hα-helixtrans-59.3-45.9-177.2-157.7109.6000111.7M330 T331 S336 E337 D338M330-L334 WeakPolarHBondContact O-CB 3.32Å; M330-L334 PolarHBondContact O-N 3.21Å; T331-L334 PolarHBondContact O-N 2.98Å; L334-S336 VanDerWaalsContact C-N 3.28Å; L334-S336 PolarHBondContact O-N 3.46Å; L334-E337 PolarHBondContact O-N 3.5Å; L334-D338 VanDerWaalsContact O-CB 3.25Å; L334-D338 WeakPolarHBondContact O-CB 3.45Å; L334-D338 PolarHBondContact O-N 3.5Å
335T91.1Very high91.1Very high80 Ų8098.2 Ų98.249%0.49150%0.501SS..Hα-helixtrans-65.6-29.4176.454.10000113.2T331 A332 K333 A339T331-T335 WeakPolarHBondContact O-CG2 3.49Å; T331-T335 PolarHBondContact O-N 3.4Å; T331-T335 PolarHBondContact O-OG1 3.11Å; A332-T335 PolarHBondContact O-OG1 3.26Å; K333-T335 PolarHBondContact O-N 2.89Å; T335-A339 WeakPolarHBondContact O-CB 3.49Å; T335-A339 PolarHBondContact O-N 3.01Å
336S91.3Very high90.8Very high57 Ų5798 Ų9840%0.39950%0.5SS..Hα-helixtrans-74.5-40.9174.5820000112.8A332 K333 L334 D338 A339 Q340A332-S336 WeakPolarHBondContact O-CB 3.33Å; A332-S336 PolarHBondContact O-N 2.93Å; K333-S336 WeakPolarHBondContact O-CA 3.48Å; K333-S336 WeakPolarHBondContact O-CB 3.44Å; K333-S336 PolarHBondContact O-N 2.98Å; K333-S336 PolarHBondContact O-OG 3.09Å; L334-S336 VanDerWaalsContact C-N 3.28Å; L334-S336 PolarHBondContact O-N 3.46Å; S336-D338 VanDerWaalsContact C-N 3.34Å; S336-A339 WeakPolarHBondContact O-CB 3.49Å; S336-A339 PolarHBondContact O-N 3.5Å; S336-Q340 WeakPolarHBondContact O-CG 3.46Å; S336-Q340 PolarHBondContact O-N 3.39Å
337E91.2Very high90.7Very high128 Ų12898.2 Ų98.260%0.59850%0.496SS*.Hα-helixtrans-65.1-39.9171.3-72.9-169.1169.700110.9K333 L334 A339 Q340 N341K333-E337 PolarHBondContact O-N 2.82Å; L334-E337 PolarHBondContact O-N 3.5Å; E337-A339 VanDerWaalsContact C-N 3.29Å; E337-A339 PolarHBondContact O-N 3.44Å; E337-Q340 CarbonylContact O-C 3.59Å; E337-Q340 WeakPolarHBondContact O-CA 3.36Å; E337-Q340 WeakPolarHBondContact O-CB 3.36Å; E337-Q340 PolarHBondContact O-N 2.87Å; E337-Q340 VanDerWaalsContact O-N 3.09Å; E337-N341 WeakPolarHBondContact O-CB 3.46Å; E337-N341 PolarHBondContact O-N 2.7Å
338D89.5Confident90.6Very high78 Ų7897.7 Ų97.742%0.41750%0.497SS..Hα-helixtrans-66.2-33.5177.6-155.648.1000111.2L334 S336 N341 R342L334-D338 VanDerWaalsContact O-CB 3.25Å; L334-D338 WeakPolarHBondContact O-CB 3.45Å; L334-D338 PolarHBondContact O-N 3.5Å; S336-D338 VanDerWaalsContact C-N 3.34Å; D338-N341 PolarHBondContact O-N 2.85Å; D338-R342 WeakPolarHBondContact O-CB 3.28Å; D338-R342 VanDerWaalsContact O-CG 3.22Å; D338-R342 WeakPolarHBondContact O-CG 3.43Å; D338-R342 PolarHBondContact O-N 3.42Å; D338-R342 PolarHBondContact O-NE 3.3Å; D338-R342 IonicContact OD2-CZ 2.76Å; D338-R342 IonicContact OD2-NE 3.63Å; D338-R342 PolarHBondContact OD2-NE 3.27Å; D338-R342 IonicContact OD2-NH2 3.75Å; D338-R342 PolarHBondContact OD2-NH2 3.41Å
339A90.4Very high90.3Very high45 Ų4596.1 Ų96.137%0.37250%0.498SS..Hα-helixtrans-66.2-41.1168.800000112.7T335 S336 E337 N341 R342 H343T335-A339 WeakPolarHBondContact O-CB 3.49Å; T335-A339 PolarHBondContact O-N 3.01Å; S336-A339 WeakPolarHBondContact O-CB 3.49Å; S336-A339 PolarHBondContact O-N 3.5Å; E337-A339 VanDerWaalsContact C-N 3.29Å; E337-A339 PolarHBondContact O-N 3.44Å; A339-N341 VanDerWaalsContact C-N 3.35Å; A339-R342 PolarHBondContact O-N 3.3Å; A339-H343 PolarHBondContact O-N 2.88Å
340Q91.9Very high89.9Confident122 Ų12296.6 Ų96.657%0.5750%0.502SS*.Hα-helixtrans-63.9-39.1171.8-66.8177.537.400111.8S336 E337 H343 L344S336-Q340 WeakPolarHBondContact O-CG 3.46Å; S336-Q340 PolarHBondContact O-N 3.39Å; E337-Q340 CarbonylContact O-C 3.59Å; E337-Q340 WeakPolarHBondContact O-CA 3.36Å; E337-Q340 WeakPolarHBondContact O-CB 3.36Å; E337-Q340 PolarHBondContact O-N 2.87Å; E337-Q340 VanDerWaalsContact O-N 3.09Å; Q340-H343 CarbonylContact O-C 3.57Å; Q340-H343 WeakPolarHBondContact O-CB 3.35Å; Q340-H343 PolarHBondContact O-N 2.98Å; Q340-L344 WeakPolarHBondContact O-CG 3.31Å; Q340-L344 PolarHBondContact O-N 2.99Å
341N88.6Confident89.8Confident72 Ų7295.6 Ų95.639%0.38550%0.499SS..Hα-helixtrans-65.7-42.3178.7-153.4-60.2000110.8E337 D338 A339 H343 L344 R345E337-N341 WeakPolarHBondContact O-CB 3.46Å; E337-N341 PolarHBondContact O-N 2.7Å; D338-N341 PolarHBondContact O-N 2.85Å; A339-N341 VanDerWaalsContact C-N 3.35Å; N341-H343 PolarHBondContact O-N 3.03Å; N341-L344 PolarHBondContact O-N 2.89Å; N341-R345 WeakPolarHBondContact O-CB 3.22Å; N341-R345 VanDerWaalsContact O-CG 3.25Å; N341-R345 WeakPolarHBondContact O-CG 3.37Å; N341-R345 PolarHBondContact O-N 3.45Å; N341-R345 PolarHBondContact OD1-NE 3.47Å; N341-R345 PolarHBondContact OD1-NH2 2.83Å
342R89.4Confident89.6Confident124 Ų12495 Ų9547%0.46850%0.497SS..Hα-helixtrans-59.4-43.5169.7-70.4171.9-131.4139.2-4.3111.9D338 A339 R345 Q346D338-R342 WeakPolarHBondContact O-CB 3.28Å; D338-R342 VanDerWaalsContact O-CG 3.22Å; D338-R342 WeakPolarHBondContact O-CG 3.43Å; D338-R342 PolarHBondContact O-N 3.42Å; D338-R342 PolarHBondContact O-NE 3.3Å; D338-R342 IonicContact OD2-CZ 2.76Å; D338-R342 IonicContact OD2-NE 3.63Å; D338-R342 PolarHBondContact OD2-NE 3.27Å; D338-R342 IonicContact OD2-NH2 3.75Å; D338-R342 PolarHBondContact OD2-NH2 3.41Å; A339-R342 PolarHBondContact O-N 3.3Å; R342-R345 PolarHBondContact O-N 2.97Å; R342-Q346 WeakPolarHBondContact O-CG 3.23Å; R342-Q346 PolarHBondContact O-N 2.91Å
343H89.8Confident89.2Confident89 Ų8999 Ų9941%0.41250%0.501SS..Hα-helixtrans-66.6-37.9176.7-177.355.3000113.1A339 Q340 N341 Q346 K347A339-H343 PolarHBondContact O-N 2.88Å; Q340-H343 CarbonylContact O-C 3.57Å; Q340-H343 WeakPolarHBondContact O-CB 3.35Å; Q340-H343 PolarHBondContact O-N 2.98Å; N341-H343 PolarHBondContact O-N 3.03Å; H343-Q346 PolarHBondContact O-N 2.96Å; H343-K347 VanDerWaalsContact NE2-CE 3.25Å; H343-K347 WeakPolarHBondContact NE2-CE 3.34Å; H343-K347 PolarHBondContact NE2-NZ 2.78Å; H343-K347 PolarHBondContact O-N 2.82Å
344L89.1Confident88.8Confident98 Ų9898.1 Ų98.151%0.51350%0.498SS..Hα-helixtrans-66.4-40.3173.1-72.8171.2000111.6Q340 N341 Q346 K347 L348Q340-L344 WeakPolarHBondContact O-CG 3.31Å; Q340-L344 PolarHBondContact O-N 2.99Å; N341-L344 PolarHBondContact O-N 2.89Å; L344-Q346 PolarHBondContact O-N 3.28Å; L344-K347 PolarHBondContact O-N 3.22Å; L344-L348 WeakPolarHBondContact O-CB 3.23Å; L344-L348 WeakPolarHBondContact O-CG 3.49Å; L344-L348 PolarHBondContact O-N 3.44Å
345R89.1Confident88.4Confident170 Ų17098.3 Ų98.364%0.64250%0.5SS*.Hα-helixtrans-62.8-39.4173-71.1166.8-173-115.94112.3N341 R342 L348 S349N341-R345 WeakPolarHBondContact O-CB 3.22Å; N341-R345 VanDerWaalsContact O-CG 3.25Å; N341-R345 WeakPolarHBondContact O-CG 3.37Å; N341-R345 PolarHBondContact O-N 3.45Å; N341-R345 PolarHBondContact OD1-NE 3.47Å; N341-R345 PolarHBondContact OD1-NH2 2.83Å; R342-R345 PolarHBondContact O-N 2.97Å; R345-L348 PolarHBondContact O-N 2.85Å; R345-S349 WeakPolarHBondContact O-CB 3.46Å; R345-S349 PolarHBondContact O-N 2.91Å
346Q88.9Confident87.9Confident129 Ų12999.3 Ų99.360%0.60350%0.502SS*.Hα-helixtrans-62.5-44.7172.2-72.4167.4-12.700111.7R342 H343 L344 S349 A350R342-Q346 WeakPolarHBondContact O-CG 3.23Å; R342-Q346 PolarHBondContact O-N 2.91Å; H343-Q346 PolarHBondContact O-N 2.96Å; L344-Q346 PolarHBondContact O-N 3.28Å; Q346-S349 PolarHBondContact O-N 3.41Å; Q346-A350 PolarHBondContact O-N 3.3Å
347K90.5Very high87.4Confident106 Ų106100.8 Ų100.846%0.46150%0.503SS..Hα-helixtrans-61.9-43.8174.5-80.7171.1162.8164.40112.7H343 L344 A350 L351H343-K347 VanDerWaalsContact NE2-CE 3.25Å; H343-K347 WeakPolarHBondContact NE2-CE 3.34Å; H343-K347 PolarHBondContact NE2-NZ 2.78Å; H343-K347 PolarHBondContact O-N 2.82Å; L344-K347 PolarHBondContact O-N 3.22Å; K347-A350 PolarHBondContact O-N 2.98Å; K347-L351 WeakPolarHBondContact O-CB 3.5Å; K347-L351 WeakPolarHBondContact O-CG 3.5Å; K347-L351 PolarHBondContact O-N 3.48Å
348L87.8Confident86.7Confident116 Ų11699.9 Ų99.961%0.60750%0.501SS*.Hα-helixtrans-63.6-39.5176.4-73.6168.7000111.8L344 R345 L351 S352L344-L348 WeakPolarHBondContact O-CB 3.23Å; L344-L348 WeakPolarHBondContact O-CG 3.49Å; L344-L348 PolarHBondContact O-N 3.44Å; R345-L348 PolarHBondContact O-N 2.85Å; L348-L351 PolarHBondContact O-N 3.29Å; L348-S352 WeakPolarHBondContact O-CB 3.45Å; L348-S352 PolarHBondContact O-N 3.46Å
349S86.4Confident86.1Confident83 Ų8397.4 Ų97.458%0.5849%0.494SS*.Hα-helixtrans-63.3-43.2173.5179.60000112.1R345 Q346 S352 R353R345-S349 WeakPolarHBondContact O-CB 3.46Å; R345-S349 PolarHBondContact O-N 2.91Å; Q346-S349 PolarHBondContact O-N 3.41Å; S349-S352 PolarHBondContact O-N 3.5Å; S349-R353 PolarHBondContact O-N 2.87Å; S349-R353 VanDerWaalsContact O-N 3.1Å
350A86.3Confident85.4Confident51 Ų51101.5 Ų101.542%0.42151%0.506SS..Hα-helixtrans-64.2-42.4175.400000112.7Q346 K347 R353 Q354Q346-A350 PolarHBondContact O-N 3.3Å; K347-A350 PolarHBondContact O-N 2.98Å; A350-R353 PolarHBondContact O-N 3.37Å; A350-Q354 PolarHBondContact O-N 2.88Å; A350-Q354 VanDerWaalsContact O-N 3.14Å
351L88.2Confident84.6Confident92 Ų9299.6 Ų99.648%0.48250%0.502SS..Hα-helixtrans-67.5-37.2176.3-74.6166.5000112.5K347 L348 R353 Q354 L355K347-L351 WeakPolarHBondContact O-CB 3.5Å; K347-L351 WeakPolarHBondContact O-CG 3.5Å; K347-L351 PolarHBondContact O-N 3.48Å; L348-L351 PolarHBondContact O-N 3.29Å; L351-R353 VanDerWaalsContact C-N 3.33Å; L351-Q354 PolarHBondContact O-N 2.9Å; L351-L355 PolarHBondContact O-N 2.87Å
352S86.2Confident83.9Confident62 Ų6299.6 Ų99.643%0.43450%0.502SS..Hα-helixtrans-59.2-47.1172.5-168.20000110.4L348 S349 Q354 L355 D356L348-S352 WeakPolarHBondContact O-CB 3.45Å; L348-S352 PolarHBondContact O-N 3.46Å; S349-S352 PolarHBondContact O-N 3.5Å; S352-Q354 PolarHBondContact O-N 3.25Å; S352-L355 CarbonylContact O-C 3.58Å; S352-L355 WeakPolarHBondContact O-CA 3.45Å; S352-L355 WeakPolarHBondContact O-CB 3.48Å; S352-L355 PolarHBondContact O-N 2.94Å; S352-D356 PolarHBondContact O-N 2.83Å; S352-D356 VanDerWaalsContact O-OD2 3.07Å
353R84Confident83.3Confident141 Ų14199.7 Ų99.753%0.53251%0.506SS..Hα-helixtrans-60.8-33.7178.4-151.9-171.169.967.623.2112.4S349 A350 L351 E357S349-R353 PolarHBondContact O-N 2.87Å; S349-R353 VanDerWaalsContact O-N 3.1Å; A350-R353 PolarHBondContact O-N 3.37Å; L351-R353 VanDerWaalsContact C-N 3.33Å; R353-E357 IonicContact CZ-OE1 3.62Å; R353-E357 IonicContact NH1-OE1 3.41Å; R353-E357 PolarHBondContact NH1-OE1 3.29Å; R353-E357 VanDerWaalsContact NH2-CD 3.34Å; R353-E357 IonicContact NH2-OE1 2.94Å; R353-E357 PolarHBondContact NH2-OE1 2.93Å; R353-E357 IonicContact NH2-OE2 3.99Å; R353-E357 PolarHBondContact NH2-OE2 3.48Å; R353-E357 VanDerWaalsContact O-CG 3.31Å; R353-E357 WeakPolarHBondContact O-CG 3.44Å; R353-E357 PolarHBondContact O-N 2.87Å; R353-E357 VanDerWaalsContact O-N 3.16Å
354Q85.9Confident82.4Confident102 Ų10299.4 Ų99.448%0.47751%0.511SS..Hα-helixtrans-74-32.9172.7-71.1-178.8-40.700113.1A350 L351 S352 D356 L358A350-Q354 PolarHBondContact O-N 2.88Å; A350-Q354 VanDerWaalsContact O-N 3.14Å; L351-Q354 PolarHBondContact O-N 2.9Å; S352-Q354 PolarHBondContact O-N 3.25Å; Q354-D356 VanDerWaalsContact C-N 3.35Å; Q354-L358 WeakPolarHBondContact O-CB 3.31Å; Q354-L358 WeakPolarHBondContact O-CG 3.39Å; Q354-L358 PolarHBondContact O-N 2.89Å
355L80Confident81.6Confident120 Ų120100.3 Ų100.363%0.62852%0.515SS*.Hα-helixtrans-67.9-34.5172-89.9165.9000112L351 S352 L358 G359L351-L355 PolarHBondContact O-N 2.87Å; S352-L355 CarbonylContact O-C 3.58Å; S352-L355 WeakPolarHBondContact O-CA 3.45Å; S352-L355 WeakPolarHBondContact O-CB 3.48Å; S352-L355 PolarHBondContact O-N 2.94Å; L355-L358 PolarHBondContact O-N 3.26Å; L355-G359 PolarHBondContact O-N 3.45Å
356D81.1Confident80.8Confident101 Ų10198.9 Ų98.954%0.5451%0.51SS..Hα-helixtrans-66.7-47.4173-64.2-47.8000110.8S352 Q354 L358 G359 E360S352-D356 PolarHBondContact O-N 2.83Å; S352-D356 VanDerWaalsContact O-OD2 3.07Å; Q354-D356 VanDerWaalsContact C-N 3.35Å; D356-L358 VanDerWaalsContact C-N 3.33Å; D356-L358 PolarHBondContact O-N 3.03Å; D356-G359 CarbonylContact O-C 3.59Å; D356-G359 WeakPolarHBondContact O-CA 3.26Å; D356-G359 PolarHBondContact O-N 3.19Å; D356-E360 PolarHBondContact O-N 2.94Å
357E82.1Confident79.9Confident88 Ų88100 Ų10041%0.41151%0.509SS..Hα-helixtrans-56.1-43.8172.6-72.5168.3162.400111.9R353 E360 T361R353-E357 IonicContact CZ-OE1 3.62Å; R353-E357 IonicContact NH1-OE1 3.41Å; R353-E357 PolarHBondContact NH1-OE1 3.29Å; R353-E357 VanDerWaalsContact NH2-CD 3.34Å; R353-E357 IonicContact NH2-OE1 2.94Å; R353-E357 PolarHBondContact NH2-OE1 2.93Å; R353-E357 IonicContact NH2-OE2 3.99Å; R353-E357 PolarHBondContact NH2-OE2 3.48Å; R353-E357 VanDerWaalsContact O-CG 3.31Å; R353-E357 WeakPolarHBondContact O-CG 3.44Å; R353-E357 PolarHBondContact O-N 2.87Å; R353-E357 VanDerWaalsContact O-N 3.16Å; E357-E360 PolarHBondContact O-N 3.02Å; E357-T361 PolarHBondContact O-N 3.35Å
358L75.2Confident78.9Confident108 Ų10897.2 Ų97.257%0.56551%0.506SS*.Hα-helixtrans-67.1-36.5173.3-77.7166.7000112.5Q354 L355 D356 E360 T361 N362Q354-L358 WeakPolarHBondContact O-CB 3.31Å; Q354-L358 WeakPolarHBondContact O-CG 3.39Å; Q354-L358 PolarHBondContact O-N 2.89Å; L355-L358 PolarHBondContact O-N 3.26Å; D356-L358 VanDerWaalsContact C-N 3.33Å; D356-L358 PolarHBondContact O-N 3.03Å; L358-E360 VanDerWaalsContact C-N 3.27Å; L358-E360 PolarHBondContact O-N 2.92Å; L358-T361 PolarHBondContact O-N 2.96Å; L358-T361 PolarHBondContact O-OG1 3.43Å; L358-N362 WeakPolarHBondContact O-CB 3.38Å; L358-N362 PolarHBondContact O-N 3.49Å
359G77.9Confident78.3Confident27 Ų2797.2 Ų97.228%0.27850%0.503SS..Hα-helixtrans-63.9-30.5175.600000113.1L355 D356 K363L355-G359 PolarHBondContact O-N 3.45Å; D356-G359 CarbonylContact O-C 3.59Å; D356-G359 WeakPolarHBondContact O-CA 3.26Å; D356-G359 PolarHBondContact O-N 3.19Å; G359-K363 WeakPolarHBondContact O-CD 3.2Å; G359-K363 WeakPolarHBondContact O-CE 3.16Å; G359-K363 VanDerWaalsContact O-CG 3.31Å; G359-K363 WeakPolarHBondContact O-CG 3.43Å
360E74.7Confident77.6Confident131 Ų13199.5 Ų99.561%0.61250%0.504SS*.Hα-helixtrans-73.3-43.6172.3-67.4-170155.200112.3D356 E357 L358 N362 K363D356-E360 PolarHBondContact O-N 2.94Å; E357-E360 PolarHBondContact O-N 3.02Å; L358-E360 VanDerWaalsContact C-N 3.27Å; L358-E360 PolarHBondContact O-N 2.92Å; E360-N362 PolarHBondContact O-N 2.82Å; E360-K363 WeakPolarHBondContact O-CB 3.47Å; E360-K363 PolarHBondContact O-N 3.16Å
361T75.1Confident76.7Confident81 Ų81104 Ų10450%0.49752%0.517SS..Hα-helixtrans-65.6-34.2174.260.50000113.2E357 L358 K363 T364 L365E357-T361 PolarHBondContact O-N 3.35Å; L358-T361 PolarHBondContact O-N 2.96Å; L358-T361 PolarHBondContact O-OG1 3.43Å; T361-K363 PolarHBondContact O-N 3.38Å; T361-T364 PolarHBondContact O-N 3.25Å; T361-T364 PolarHBondContact O-OG1 2.98Å; T361-L365 PolarHBondContact O-N 2.69Å
362N73.9Confident75.6Confident72 Ų72104.2 Ų104.239%0.38552%0.518SS..Hα-helixtrans-64.1-29.8176-163.3-80.5000112.5L358 E360 T364 L365 R366L358-N362 WeakPolarHBondContact O-CB 3.38Å; L358-N362 PolarHBondContact O-N 3.49Å; E360-N362 PolarHBondContact O-N 2.82Å; N362-T364 VanDerWaalsContact C-N 3.27Å; N362-T364 PolarHBondContact O-N 3.03Å; N362-L365 PolarHBondContact O-N 2.89Å; N362-R366 PolarHBondContact O-N 3.41Å; N362-R366 PolarHBondContact OD1-NE 3.37Å; N362-R366 PolarHBondContact OD1-NH2 3.33Å; N362-R366 VanDerWaalsContact OD1-NH2 3.11Å
363K76.6Confident74.8Confident127 Ų127105.3 Ų105.355%0.55252%0.516SS*.Hα-helixtrans-73.1-11.6173.3-65.3163.4-166.9163.70113.7G359 E360 T361 R367G359-K363 WeakPolarHBondContact O-CD 3.2Å; G359-K363 WeakPolarHBondContact O-CE 3.16Å; G359-K363 VanDerWaalsContact O-CG 3.31Å; G359-K363 WeakPolarHBondContact O-CG 3.43Å; E360-K363 WeakPolarHBondContact O-CB 3.47Å; E360-K363 PolarHBondContact O-N 3.16Å; T361-K363 PolarHBondContact O-N 3.38Å; K363-R367 PolarHBondContact O-NE 3.3Å; K363-R367 PolarHBondContact O-NH2 2.95Å
364T70.6Confident73.8Confident83 Ų83105.7 Ų105.751%0.50952%0.524SS..Hα-helixtrans-91.1-40169.168.80000110.7T361 N362 R366 R367T361-T364 PolarHBondContact O-N 3.25Å; T361-T364 PolarHBondContact O-OG1 2.98Å; N362-T364 VanDerWaalsContact C-N 3.27Å; N362-T364 PolarHBondContact O-N 3.03Å; T364-R366 PolarHBondContact O-N 3.43Å; T364-R367 PolarHBondContact O-N 3.05Å
365L72.2Confident72.5Confident116 Ų116105.9 Ų105.961%0.60753%0.528SS*.Hα-helixtrans-58.4-47-179.8-166.574.3000113.2T361 N362 R367 A368 E369T361-L365 PolarHBondContact O-N 2.69Å; N362-L365 PolarHBondContact O-N 2.89Å; L365-R367 PolarHBondContact O-N 3.15Å; L365-A368 PolarHBondContact O-N 3.13Å; L365-E369 PolarHBondContact O-N 3.42Å
366R73.3Confident71.7Confident141 Ų141106.1 Ų106.153%0.53252%0.52SS..Hα-helixtrans-59.5-29.8-176.3-107.2-177.5-79.4171.7-9.6114.6N362 T364 A368 E369 E370N362-R366 PolarHBondContact O-N 3.41Å; N362-R366 PolarHBondContact OD1-NE 3.37Å; N362-R366 PolarHBondContact OD1-NH2 3.33Å; N362-R366 VanDerWaalsContact OD1-NH2 3.11Å; T364-R366 PolarHBondContact O-N 3.43Å; R366-A368 VanDerWaalsContact C-N 3.31Å; R366-A368 PolarHBondContact O-N 2.87Å; R366-E369 WeakPolarHBondContact O-CB 3.49Å; R366-E369 PolarHBondContact O-N 3.42Å; R366-E369 VanDerWaalsContact O-N 3.16Å; R366-E370 WeakPolarHBondContact O-CG 3.49Å; R366-E370 PolarHBondContact O-N 2.92Å; R366-E370 VanDerWaalsContact O-N 3.16Å
367R71.1Confident70.6Confident151 Ų151106.5 Ų106.557%0.5752%0.522SS*.Hα-helixtrans-68.5-29176-79.3175-80.6153.4-8.6113K363 T364 L365K363-R367 PolarHBondContact O-NE 3.3Å; K363-R367 PolarHBondContact O-NH2 2.95Å; T364-R367 PolarHBondContact O-N 3.05Å; L365-R367 PolarHBondContact O-N 3.15Å
368A69.4Low69.5Low49 Ų49108.6 Ų108.641%0.40553%0.53SS..Hα-helixtrans-80.6-20.6172.500000112.7L365 R366 L372L365-A368 PolarHBondContact O-N 3.13Å; R366-A368 VanDerWaalsContact C-N 3.31Å; R366-A368 PolarHBondContact O-N 2.87Å; A368-L372 WeakPolarHBondContact O-CG 3.35Å; A368-L372 PolarHBondContact O-N 3.41Å
369E73.6Confident68.7Low116 Ų116110.1 Ų110.154%0.54254%0.537SS..Hα-helixtrans-76.1-38176.1-172.3169.7-153.100111.8L365 R366 L372 Q373L365-E369 PolarHBondContact O-N 3.42Å; R366-E369 WeakPolarHBondContact O-CB 3.49Å; R366-E369 PolarHBondContact O-N 3.42Å; R366-E369 VanDerWaalsContact O-N 3.16Å; E369-L372 PolarHBondContact O-N 3.32Å; E369-Q373 PolarHBondContact O-N 2.93Å
370E73.3Confident67.6Low131 Ų131113.3 Ų113.361%0.61256%0.555SS**Hα-helixtrans-58.3-46.2173.7-71.7163.3-179.300111.6R366 L372 Q373R366-E370 WeakPolarHBondContact O-CG 3.49Å; R366-E370 PolarHBondContact O-N 2.92Å; R366-E370 VanDerWaalsContact O-N 3.16Å; E370-L372 VanDerWaalsContact C-N 3.29Å; E370-L372 PolarHBondContact O-N 2.86Å; E370-Q373 PolarHBondContact O-N 3.18Å
371E67.1Low66.2Low146 Ų146117.3 Ų117.368%0.68257%0.565SS**Hα-helixtrans-62.5-30.8176.3-67.1177.3175.100113.4
372L64.9Low64.9Low95 Ų95117 Ų11750%0.49758%0.577SS.*Hα-helixtrans-80.9-15.5178.9-73.5173.1000113.7A368 E369 E370 L375A368-L372 WeakPolarHBondContact O-CG 3.35Å; A368-L372 PolarHBondContact O-N 3.41Å; E369-L372 PolarHBondContact O-N 3.32Å; E370-L372 VanDerWaalsContact C-N 3.29Å; E370-L372 PolarHBondContact O-N 2.86Å; L372-L375 HydrophobicContact CD2-CD1 4.44Å
373Q68.2Low63.5Low86 Ų86122.4 Ų122.440%0.40260%0.6SS.*Hα-helixtrans-79-37.5179.9-172.255.828.700112.3E369 E370 L375 R376E369-Q373 PolarHBondContact O-N 2.93Å; E370-Q373 PolarHBondContact O-N 3.18Å; Q373-L375 PolarHBondContact O-N 3.31Å; Q373-L375 VanDerWaalsContact O-N 3.1Å; Q373-R376 PolarHBondContact O-N 3.12Å
374E62.8Low61.9Low148 Ų148121.9 Ų121.969%0.69261%0.611SS**THydrogen-bonded Turntrans-63.1-17.9177.8-165.7-178.6-151.200113.5
375L59.9Low60.9Low107 Ų107121 Ų12156%0.5662%0.62SS**THydrogen-bonded Turntrans-81.6-27.3173.8-75.6166000113.5L372 Q373L372-L375 HydrophobicContact CD2-CD1 4.44Å; Q373-L375 PolarHBondContact O-N 3.31Å; Q373-L375 VanDerWaalsContact O-N 3.1Å
376R62.2Low60Low124 Ų124123.4 Ų123.447%0.46863%0.633SS.*G310 helixtrans-75.2-37.3-175.7-85.6-176.5-80.3-90.31113.3Q373 K378 I379Q373-R376 PolarHBondContact O-N 3.12Å; R376-K378 PolarHBondContact O-N 2.93Å; R376-I379 PolarHBondContact O-N 3.45Å; R376-I379 VanDerWaalsContact O-N 3.13Å
377D59.5Low58.9Low109 Ų109122.7 Ų122.758%0.58365%0.649SS**G310 helixtrans-67.8-5.6-173.6-64.3-9.3000114.3
378K58.8Low57.7Low132 Ų132121.2 Ų121.257%0.57466%0.663SS**G310 helixtrans-84.5-14175.3-74164-177.6135.20114R376 R381R376-K378 PolarHBondContact O-N 2.93Å; K378-R381 PolarHBondContact O-NH2 3.26Å; K378-R381 VanDerWaalsContact O-NH2 3.16Å
379I58Low56.8Low140 Ų140125.3 Ų125.372%0.71868%0.677SS**SBendtrans-95.9-19.6-166.9-61.8176.1000113.6R376 R381R376-I379 PolarHBondContact O-N 3.45Å; R376-I379 VanDerWaalsContact O-N 3.13Å; I379-R381 PolarHBondContact O-N 2.96Å
380S54.5Low55.8Low95 Ų95127.7 Ų127.766%0.66469%0.69SS**  trans-79.868-162.1570000116.7
381R45.7Very low55.3Low214 Ų214125.8 Ų125.881%0.80869%0.691SS**  trans-140.959.7-177.8-66.3-174.4-94.3-109-4.4116.7K378 I379K378-R381 PolarHBondContact O-NH2 3.26Å; K378-R381 VanDerWaalsContact O-NH2 3.16Å; I379-R381 PolarHBondContact O-N 2.96Å
382G46.8Very low55.6Low74 Ų74125.9 Ų125.976%0.76369%0.691SS**  trans147.4-177.3169.200000114.1
383E46.1Very low55.8Low186 Ų186128.2 Ų128.287%0.86970%0.704SS**  cis-179.4169.1-34.3-89.2-155-110.500107.3
384C42.9Very low55.9Low116 Ų116131.6 Ų131.678%0.78472%0.72SS**  cis-167.5174.2-23.9-89.90000107.2
385G49.7Very low56.5Low66 Ų66129.6 Ų129.668%0.6871%0.71SS**  cis-165.6-145.512.300000113.8
386N52.1Low57.5Low165 Ų165129.6 Ų129.688%0.88271%0.71SS**  trans-135.7161.7-152.7-49.7-38.9000120.9
387S50.3Low58Low126 Ų126131 Ų13188%0.88172%0.722SS**  145143.7129.463.90000120
388S45.1Very low59Low121 Ų121131.9 Ų131.985%0.84672%0.721SS**  trans174.8165149.5-168.70000112.8
389L50.4Low60.2Low134 Ų134131.8 Ų131.870%0.70272%0.717SS**  trans-149.9-23.2-179.5-170.563.6000118.3S391L389-S391 VanDerWaalsContact C-N 3.34Å; L389-S391 PolarHBondContact O-N 3.4Å; L389-S391 VanDerWaalsContact O-N 3.11Å
390M53Low61.5Low167 Ų167128.4 Ų128.482%0.82370%0.702SS**THydrogen-bonded Turntrans-70.5-10.2-160.4-77.6-68-6500118
391S62.3Low62.9Low90 Ų90129.8 Ų129.863%0.62970%0.701SS**THydrogen-bonded Turntrans-77.8-21.6-166.8450000116.1L389 L393L389-S391 VanDerWaalsContact C-N 3.34Å; L389-S391 PolarHBondContact O-N 3.4Å; L389-S391 VanDerWaalsContact O-N 3.11Å; S391-L393 PolarHBondContact O-N 3.4Å
392E74.8Confident64.6Low148 Ų148123.3 Ų123.369%0.69268%0.681SS**Hα-helixtrans-75.2-23.7-166.9-61.2-176.6172.800114.1
393L68.7Low66.4Low145 Ų145124.9 Ų124.976%0.75967%0.669SS**Hα-helixtrans-75.9-37.6-174.5-156.783.2000112.9S391S391-L393 PolarHBondContact O-N 3.4Å
394E70.4Confident67.9Low157 Ų157121.2 Ų121.273%0.73465%0.652SS**Hα-helixtrans-72-32.8-177.5-62.5-175.3154.800111.7L396E394-L396 VanDerWaalsContact C-N 3.28Å; E394-L396 PolarHBondContact O-N 2.85Å
395E76.3Confident69.9Low105 Ų105117.8 Ų117.849%0.49164%0.636SS.*Hα-helixtrans-66.8-29.7-179.7-146.5-159.7135.400112.5K398 R399E395-K398 PolarHBondContact O-N 3.22Å; E395-R399 PolarHBondContact O-N 3.47Å; E395-R399 IonicContact OE1-CZ 3.41Å; E395-R399 IonicContact OE1-NE 3.37Å; E395-R399 PolarHBondContact OE1-NE 3.17Å; E395-R399 IonicContact OE1-NH2 2.67Å; E395-R399 PolarHBondContact OE1-NH2 3.29Å; E395-R399 IonicContact OE2-NH2 3.47Å; E395-R399 PolarHBondContact OE2-NH2 2.81Å
396L79.4Confident71.7Confident107 Ų107120.1 Ų120.156%0.5663%0.628SS**Hα-helixtrans-71.4-38.8-177.1-170.462.7000112.6E394 K398 R399E394-L396 VanDerWaalsContact C-N 3.28Å; E394-L396 PolarHBondContact O-N 2.85Å; L396-K398 VanDerWaalsContact C-N 3.31Å; L396-K398 PolarHBondContact O-N 3.09Å; L396-R399 PolarHBondContact O-N 3.31Å
397Q73.8Confident73.3Confident154 Ų154116.6 Ų116.672%0.7261%0.609SS**Hα-helixtrans-63.5-38.8176.5-71.9-170.1-10.400111.8R399 V400Q397-R399 VanDerWaalsContact C-N 3.31Å; Q397-R399 PolarHBondContact O-N 3.01Å; Q397-V400 PolarHBondContact O-N 2.7Å
398K80.6Confident75.2Confident128 Ų128115.6 Ų115.656%0.55759%0.59SS**Hα-helixtrans-59.6-41.6178.2-167.8-172.2179.9-1200112.1E395 L396 V400 E402E395-K398 PolarHBondContact O-N 3.22Å; L396-K398 VanDerWaalsContact C-N 3.31Å; L396-K398 PolarHBondContact O-N 3.09Å; K398-V400 VanDerWaalsContact C-N 3.29Å; K398-V400 PolarHBondContact O-N 2.82Å; K398-E402 WeakPolarHBondContact CE-OE1 3.4Å; K398-E402 IonicContact NZ-OE1 3.82Å; K398-E402 PolarHBondContact NZ-OE1 3.37Å; K398-E402 WeakPolarHBondContact O-CG 3.34Å; K398-E402 PolarHBondContact O-N 2.95Å
399R84.4Confident77.3Confident130 Ų130115 Ų11549%0.49157%0.574SS.*Hα-helixtrans-65.1-29-178.9-66.1-180-164.8159.22.9113.3E395 L396 Q397 E402 M403E395-R399 PolarHBondContact O-N 3.47Å; E395-R399 IonicContact OE1-CZ 3.41Å; E395-R399 IonicContact OE1-NE 3.37Å; E395-R399 PolarHBondContact OE1-NE 3.17Å; E395-R399 IonicContact OE1-NH2 2.67Å; E395-R399 PolarHBondContact OE1-NH2 3.29Å; E395-R399 IonicContact OE2-NH2 3.47Å; E395-R399 PolarHBondContact OE2-NH2 2.81Å; L396-R399 PolarHBondContact O-N 3.31Å; Q397-R399 VanDerWaalsContact C-N 3.31Å; Q397-R399 PolarHBondContact O-N 3.01Å; R399-E402 CarbonylContact O-C 3.6Å; R399-E402 PolarHBondContact O-N 2.83Å; R399-M403 WeakPolarHBondContact O-CG 3.43Å; R399-M403 PolarHBondContact O-N 3.3Å; R399-M403 VanDerWaalsContact O-N 3.08Å
400V83.9Confident79.2Confident68 Ų68113.1 Ų113.141%0.41257%0.565SS.*Hα-helixtrans-69.3-49.5179.6179.20000111.3Q397 K398 E402 M403 E404Q397-V400 PolarHBondContact O-N 2.7Å; K398-V400 VanDerWaalsContact C-N 3.29Å; K398-V400 PolarHBondContact O-N 2.82Å; V400-E402 PolarHBondContact O-N 3.39Å; V400-M403 WeakPolarHBondContact O-CA 3.48Å; V400-M403 WeakPolarHBondContact O-CB 3.39Å; V400-M403 PolarHBondContact O-N 2.83Å; V400-E404 PolarHBondContact O-N 3Å
401L83.4Confident81Confident124 Ų124109 Ų10965%0.64955%0.545SS*.Hα-helixtrans-59.5-35.7173.5-77.1159.1000112M403 G405L401-M403 VanDerWaalsContact C-N 3.28Å; L401-M403 PolarHBondContact O-N 3.4Å; L401-G405 PolarHBondContact O-N 2.89Å
402E83.3Confident82.4Confident79 Ų79110.7 Ų110.737%0.36954%0.537SS..Hα-helixtrans-71.8-13.3172.8-74-173.5-154.200114.2K398 R399 V400 K406K398-E402 WeakPolarHBondContact CE-OE1 3.4Å; K398-E402 IonicContact NZ-OE1 3.82Å; K398-E402 PolarHBondContact NZ-OE1 3.37Å; K398-E402 WeakPolarHBondContact O-CG 3.34Å; K398-E402 PolarHBondContact O-N 2.95Å; R399-E402 CarbonylContact O-C 3.6Å; R399-E402 PolarHBondContact O-N 2.83Å; V400-E402 PolarHBondContact O-N 3.39Å; E402-K406 VanDerWaalsContact O-CD 3.28Å; E402-K406 WeakPolarHBondContact O-CD 3.24Å; E402-K406 WeakPolarHBondContact O-CE 3.3Å; E402-K406 VanDerWaalsContact O-CG 3.26Å; E402-K406 WeakPolarHBondContact O-CG 3.49Å; E402-K406 PolarHBondContact O-NZ 2.96Å; E402-K406 IonicContact OE2-NZ 3.14Å
403M83.1Confident83.2Confident106 Ų106108.3 Ų108.352%0.52253%0.528SS..Hα-helixtrans-88-47.2169.5-71.5-171.1-52.800110.9R399 V400 L401 G405 K406 D407R399-M403 WeakPolarHBondContact O-CG 3.43Å; R399-M403 PolarHBondContact O-N 3.3Å; R399-M403 VanDerWaalsContact O-N 3.08Å; V400-M403 WeakPolarHBondContact O-CA 3.48Å; V400-M403 WeakPolarHBondContact O-CB 3.39Å; V400-M403 PolarHBondContact O-N 2.83Å; L401-M403 VanDerWaalsContact C-N 3.28Å; L401-M403 PolarHBondContact O-N 3.4Å; M403-G405 VanDerWaalsContact C-N 3.25Å; M403-G405 PolarHBondContact O-N 2.92Å; M403-K406 CarbonylContact O-C 3.59Å; M403-K406 WeakPolarHBondContact O-CA 3.42Å; M403-K406 WeakPolarHBondContact O-CB 3.46Å; M403-K406 PolarHBondContact O-N 2.94Å; M403-D407 PolarHBondContact O-N 3.08Å
404E78.7Confident84.3Confident110 Ų110105.9 Ų105.951%0.51451%0.512SS..Hα-helixtrans-54.1-42178.6-66.7173.715700111.9V400 K406 D407 E408V400-E404 PolarHBondContact O-N 3Å; E404-K406 VanDerWaalsContact C-N 3.3Å; E404-K406 PolarHBondContact O-N 2.99Å; E404-D407 PolarHBondContact O-N 3.01Å; E404-E408 PolarHBondContact O-N 3.37Å; E404-E408 VanDerWaalsContact O-N 3.11Å
405G83.3Confident85.4Confident44 Ų44101.8 Ų101.845%0.45450%0.495SS..Hα-helixtrans-66.7-24.8175.100000115.2L401 M403 E409L401-G405 PolarHBondContact O-N 2.89Å; M403-G405 VanDerWaalsContact C-N 3.25Å; M403-G405 PolarHBondContact O-N 2.92Å; G405-E409 PolarHBondContact O-N 2.85Å
406K88.6Confident86.2Confident114 Ų114102.8 Ų102.850%0.49650%0.5SS..Hα-helixtrans-86.5-34.9176.2-68.1177.5-171.6107.60111.8E402 M403 E404 E408 E409 L410E402-K406 VanDerWaalsContact O-CD 3.28Å; E402-K406 WeakPolarHBondContact O-CD 3.24Å; E402-K406 WeakPolarHBondContact O-CE 3.3Å; E402-K406 VanDerWaalsContact O-CG 3.26Å; E402-K406 WeakPolarHBondContact O-CG 3.49Å; E402-K406 PolarHBondContact O-NZ 2.96Å; E402-K406 IonicContact OE2-NZ 3.14Å; M403-K406 CarbonylContact O-C 3.59Å; M403-K406 WeakPolarHBondContact O-CA 3.42Å; M403-K406 WeakPolarHBondContact O-CB 3.46Å; M403-K406 PolarHBondContact O-N 2.94Å; E404-K406 VanDerWaalsContact C-N 3.3Å; E404-K406 PolarHBondContact O-N 2.99Å; K406-E408 VanDerWaalsContact C-N 3.31Å; K406-E409 CarbonylContact O-C 3.57Å; K406-E409 WeakPolarHBondContact O-CA 3.46Å; K406-E409 WeakPolarHBondContact O-CB 3.45Å; K406-E409 PolarHBondContact O-N 3.24Å; K406-E409 VanDerWaalsContact O-N 3.08Å; K406-L410 WeakPolarHBondContact O-CB 3.26Å; K406-L410 PolarHBondContact O-N 3.39Å
407D86.4Confident86.8Confident91 Ų91101.5 Ų101.549%0.48750%0.499SS..Hα-helixtrans-64.7-39.6173.5-67.6-29.4000110.5M403 E404 E409 L410 I411M403-D407 PolarHBondContact O-N 3.08Å; E404-D407 PolarHBondContact O-N 3.01Å; D407-E409 VanDerWaalsContact C-N 3.3Å; D407-E409 PolarHBondContact O-N 3.07Å; D407-L410 WeakPolarHBondContact O-CB 3.49Å; D407-L410 PolarHBondContact O-N 3.43Å; D407-I411 VanDerWaalsContact O-CG1 3.31Å; D407-I411 WeakPolarHBondContact O-CG1 3.31Å; D407-I411 PolarHBondContact O-N 3.23Å
408E89.3Confident87.8Confident105 Ų10598.8 Ų98.849%0.49148%0.482SS..Hα-helixtrans-60.6-34.2168.7-85-70.1162.600113.3E404 K406 R412E404-E408 PolarHBondContact O-N 3.37Å; E404-E408 VanDerWaalsContact O-N 3.11Å; K406-E408 VanDerWaalsContact C-N 3.31Å; E408-R412 VanDerWaalsContact C-NH1 3.3Å; E408-R412 WeakPolarHBondContact O-CG 3.33Å; E408-R412 VanDerWaalsContact O-CZ 3.27Å; E408-R412 PolarHBondContact O-N 3.42Å; E408-R412 VanDerWaalsContact O-N 3.17Å; E408-R412 PolarHBondContact O-NH1 2.99Å; E408-R412 IonicContact OE2-NH1 3.28Å
409E89.6Confident88.5Confident108 Ų10896.6 Ų96.651%0.50548%0.476SS..Hα-helixtrans-72.5-39172.5-169.5169.2-155.200112.4G405 K406 D407 R412 M413G405-E409 PolarHBondContact O-N 2.85Å; K406-E409 CarbonylContact O-C 3.57Å; K406-E409 WeakPolarHBondContact O-CA 3.46Å; K406-E409 WeakPolarHBondContact O-CB 3.45Å; K406-E409 PolarHBondContact O-N 3.24Å; K406-E409 VanDerWaalsContact O-N 3.08Å; D407-E409 VanDerWaalsContact C-N 3.3Å; D407-E409 PolarHBondContact O-N 3.07Å; E409-R412 VanDerWaalsContact CA-NH2 3.31Å; E409-R412 PolarHBondContact O-N 2.89Å; E409-M413 HydrophobicContact CG-CE 4.44Å; E409-M413 WeakPolarHBondContact O-CG 3.43Å; E409-M413 PolarHBondContact O-N 3.47Å
410L91.1Very high89Confident96 Ų9695.7 Ų95.750%0.50348%0.481SS..Hα-helixtrans-61.8-43.6174.6-170.1155.8000111K406 D407 M413 E414K406-L410 WeakPolarHBondContact O-CB 3.26Å; K406-L410 PolarHBondContact O-N 3.39Å; D407-L410 WeakPolarHBondContact O-CB 3.49Å; D407-L410 PolarHBondContact O-N 3.43Å; L410-M413 PolarHBondContact O-N 2.82Å; L410-E414 WeakPolarHBondContact O-CB 3.38Å; L410-E414 PolarHBondContact O-N 3.31Å
411I90.1Very high89.4Confident81 Ų8197.4 Ų97.442%0.41549%0.488SS..Hα-helixtrans-59.6-47.5173.4-68.8163.4000110.4D407 M413 E414 D415D407-I411 VanDerWaalsContact O-CG1 3.31Å; D407-I411 WeakPolarHBondContact O-CG1 3.31Å; D407-I411 PolarHBondContact O-N 3.23Å; I411-M413 VanDerWaalsContact C-N 3.3Å; I411-M413 PolarHBondContact O-N 3.21Å; I411-E414 PolarHBondContact O-N 2.88Å; I411-E414 VanDerWaalsContact O-N 3.11Å; I411-D415 PolarHBondContact O-N 3.46Å; I411-D415 VanDerWaalsContact O-OD1 3.09Å
412R92Very high90Very high124 Ų12496.2 Ų96.247%0.46848%0.477SS..Hα-helixtrans-60.6-36.8176.4-72.4-174.6-58.6-86.43.6113E408 E409 Q416E408-R412 VanDerWaalsContact C-NH1 3.3Å; E408-R412 WeakPolarHBondContact O-CG 3.33Å; E408-R412 VanDerWaalsContact O-CZ 3.27Å; E408-R412 PolarHBondContact O-N 3.42Å; E408-R412 VanDerWaalsContact O-N 3.17Å; E408-R412 PolarHBondContact O-NH1 2.99Å; E408-R412 IonicContact OE2-NH1 3.28Å; E409-R412 VanDerWaalsContact CA-NH2 3.31Å; E409-R412 PolarHBondContact O-N 2.89Å; R412-Q416 WeakPolarHBondContact O-CG 3.29Å; R412-Q416 PolarHBondContact O-N 2.87Å
413M91.9Very high90.6Very high99 Ų9999.1 Ų99.149%0.48849%0.489SS..Hα-helixtrans-70.2-38.2173.2-72.1-170.5-67.600112.2E409 L410 I411 Q416 C417E409-M413 HydrophobicContact CG-CE 4.44Å; E409-M413 WeakPolarHBondContact O-CG 3.43Å; E409-M413 PolarHBondContact O-N 3.47Å; L410-M413 PolarHBondContact O-N 2.82Å; I411-M413 VanDerWaalsContact C-N 3.3Å; I411-M413 PolarHBondContact O-N 3.21Å; M413-Q416 PolarHBondContact O-N 3Å; M413-C417 PolarHBondContact O-N 2.87Å; M413-C417 PolarHBondContact O-SG 3.45Å
414E91.7Very high91.1Very high94 Ų9499.1 Ų99.144%0.43949%0.49SS..Hα-helixtrans-64-45.3176-155.3-148.1121.200110.6L410 I411 Q416 C417 R418L410-E414 WeakPolarHBondContact O-CB 3.38Å; L410-E414 PolarHBondContact O-N 3.31Å; I411-E414 PolarHBondContact O-N 2.88Å; I411-E414 VanDerWaalsContact O-N 3.11Å; E414-Q416 VanDerWaalsContact C-N 3.33Å; E414-Q416 PolarHBondContact O-N 3.46Å; E414-C417 CarbonylContact O-C 3.58Å; E414-C417 WeakPolarHBondContact O-CA 3.29Å; E414-C417 WeakPolarHBondContact O-CB 3.42Å; E414-C417 PolarHBondContact O-N 2.82Å; E414-R418 WeakPolarHBondContact O-CG 3.37Å; E414-R418 PolarHBondContact O-N 3.4Å; E414-R418 WeakPolarHBondContact OE1-CD 3.4Å; E414-R418 IonicContact OE1-CZ 2.73Å; E414-R418 IonicContact OE1-NE 3.16Å; E414-R418 IonicContact OE1-NH1 3.16Å; E414-R418 PolarHBondContact OE1-NH1 2.94Å; E414-R418 IonicContact OE2-NH1 3.42Å
415D92.8Very high91.8Very high70 Ų7098.6 Ų98.637%0.37449%0.488SS..Hα-helixtrans-54.4-46.2173.1-86.258.7000112.1I411 R418 D419I411-D415 PolarHBondContact O-N 3.46Å; I411-D415 VanDerWaalsContact O-OD1 3.09Å; D415-R418 PolarHBondContact O-N 3.48Å; D415-R418 IonicContact OD1-CZ 3.93Å; D415-R418 VanDerWaalsContact OD1-CZ 3.28Å; D415-R418 IonicContact OD1-NH1 2.7Å; D415-R418 PolarHBondContact OD1-NH1 3.4Å; D415-R418 VanDerWaalsContact OD1-NH1 3.13Å; D415-R418 IonicContact OD1-NH2 3.13Å; D415-R418 PolarHBondContact OD1-NH2 2.88Å; D415-R418 IonicContact OD2-NH2 2.72Å; D415-R418 PolarHBondContact OD2-NH2 3.47Å; D415-D419 PolarHBondContact O-N 3.2Å
416Q93.8Very high92.3Very high127 Ų127103.1 Ų103.159%0.59350%0.495SS*.Hα-helixtrans-62.9-41.2174-71.2174.216.300112.3R412 M413 E414 D419 L420R412-Q416 WeakPolarHBondContact O-CG 3.29Å; R412-Q416 PolarHBondContact O-N 2.87Å; M413-Q416 PolarHBondContact O-N 3Å; E414-Q416 VanDerWaalsContact C-N 3.33Å; E414-Q416 PolarHBondContact O-N 3.46Å; Q416-D419 PolarHBondContact O-N 2.95Å; Q416-L420 WeakPolarHBondContact O-CB 3.42Å; Q416-L420 WeakPolarHBondContact O-CG 3.43Å; Q416-L420 PolarHBondContact O-N 3.31Å
417C90.9Very high92.5Very high79 Ų79103.2 Ų103.253%0.53450%0.497SS..Hα-helixtrans-64.4-41.1175.1-68.80000112M413 E414 D419 L420 N421M413-C417 PolarHBondContact O-N 2.87Å; M413-C417 PolarHBondContact O-SG 3.45Å; E414-C417 CarbonylContact O-C 3.58Å; E414-C417 WeakPolarHBondContact O-CA 3.29Å; E414-C417 WeakPolarHBondContact O-CB 3.42Å; E414-C417 PolarHBondContact O-N 2.82Å; C417-D419 VanDerWaalsContact C-N 3.33Å; C417-D419 PolarHBondContact O-N 3.41Å; C417-L420 PolarHBondContact O-N 3.2Å; C417-N421 WeakPolarHBondContact O-CB 3.31Å; C417-N421 PolarHBondContact O-N 2.94Å
418R95.6Very high92.9Very high98 Ų98101.9 Ų101.937%0.3749%0.492SS..Hα-helixtrans-63.6-38.1175.2-65.6-165.7-48.6-91.1-1.1111E414 D415 N421 K422E414-R418 WeakPolarHBondContact O-CG 3.37Å; E414-R418 PolarHBondContact O-N 3.4Å; E414-R418 WeakPolarHBondContact OE1-CD 3.4Å; E414-R418 IonicContact OE1-CZ 2.73Å; E414-R418 IonicContact OE1-NE 3.16Å; E414-R418 IonicContact OE1-NH1 3.16Å; E414-R418 PolarHBondContact OE1-NH1 2.94Å; E414-R418 IonicContact OE2-NH1 3.42Å; D415-R418 PolarHBondContact O-N 3.48Å; D415-R418 IonicContact OD1-CZ 3.93Å; D415-R418 VanDerWaalsContact OD1-CZ 3.28Å; D415-R418 IonicContact OD1-NH1 2.7Å; D415-R418 PolarHBondContact OD1-NH1 3.4Å; D415-R418 VanDerWaalsContact OD1-NH1 3.13Å; D415-R418 IonicContact OD1-NH2 3.13Å; D415-R418 PolarHBondContact OD1-NH2 2.88Å; D415-R418 IonicContact OD2-NH2 2.72Å; D415-R418 PolarHBondContact OD2-NH2 3.47Å; R418-N421 PolarHBondContact O-N 3.31Å; R418-K422 VanDerWaalsContact O-CG 3.26Å; R418-K422 WeakPolarHBondContact O-CG 3.31Å; R418-K422 PolarHBondContact O-N 2.98Å
419D94.4Very high93.2Very high81 Ų81102.1 Ų102.143%0.43349%0.492SS..Hα-helixtrans-75.5-35.2176.8-94.118.7000114.1D415 Q416 C417 N421 K422 K423D415-D419 PolarHBondContact O-N 3.2Å; Q416-D419 PolarHBondContact O-N 2.95Å; C417-D419 VanDerWaalsContact C-N 3.33Å; C417-D419 PolarHBondContact O-N 3.41Å; D419-N421 VanDerWaalsContact C-N 3.34Å; D419-K422 PolarHBondContact O-N 3.44Å; D419-K422 WeakPolarHBondContact OD1-CD 3.3Å; D419-K422 WeakPolarHBondContact OD1-CE 3.4Å; D419-K422 IonicContact OD1-NZ 2.64Å; D419-K422 PolarHBondContact OD1-NZ 2.97Å; D419-K423 WeakPolarHBondContact O-CG 3.45Å; D419-K423 PolarHBondContact O-N 3.01Å
420L94.6Very high93.5Very high111 Ų111102.6 Ų102.658%0.58149%0.494SS*.Hα-helixtrans-62.4-42168.4-74.9170.9000111Q416 C417 K423 L424Q416-L420 WeakPolarHBondContact O-CB 3.42Å; Q416-L420 WeakPolarHBondContact O-CG 3.43Å; Q416-L420 PolarHBondContact O-N 3.31Å; C417-L420 PolarHBondContact O-N 3.2Å; L420-K423 WeakPolarHBondContact O-CB 3.32Å; L420-K423 PolarHBondContact O-N 2.74Å; L420-K423 VanDerWaalsContact O-N 3.15Å; L420-L424 PolarHBondContact O-N 2.62Å
421N93Very high93.6Very high104 Ų104101.3 Ų101.356%0.55649%0.493SS*.Hα-helixtrans-64.1-42175.8-165.639.3000111.8C417 R418 D419 K423 L424 E425C417-N421 WeakPolarHBondContact O-CB 3.31Å; C417-N421 PolarHBondContact O-N 2.94Å; R418-N421 PolarHBondContact O-N 3.31Å; D419-N421 VanDerWaalsContact C-N 3.34Å; N421-K423 VanDerWaalsContact C-N 3.27Å; N421-K423 PolarHBondContact O-N 2.68Å; N421-L424 PolarHBondContact O-N 2.93Å; N421-E425 WeakPolarHBondContact O-CB 3.34Å; N421-E425 PolarHBondContact O-N 2.81Å
422K95.4Very high93.9Very high99 Ų99106.7 Ų106.743%0.4351%0.509SS..Hα-helixtrans-61.1-32.2172.1-69.8167-152164.10113.1R418 D419 K426R418-K422 VanDerWaalsContact O-CG 3.26Å; R418-K422 WeakPolarHBondContact O-CG 3.31Å; R418-K422 PolarHBondContact O-N 2.98Å; D419-K422 PolarHBondContact O-N 3.44Å; D419-K422 WeakPolarHBondContact OD1-CD 3.3Å; D419-K422 WeakPolarHBondContact OD1-CE 3.4Å; D419-K422 IonicContact OD1-NZ 2.64Å; D419-K422 PolarHBondContact OD1-NZ 2.97Å; K422-K426 WeakPolarHBondContact O-CD 3.48Å; K422-K426 VanDerWaalsContact O-CG 3.3Å; K422-K426 WeakPolarHBondContact O-CG 3.32Å; K422-K426 PolarHBondContact O-N 2.89Å
423K95.9Very high94.1Very high140 Ų140104.6 Ų104.661%0.60951%0.512SS*.Hα-helixtrans-71.3-46.7173.6-72.5170.7-176.2175.60110.6D419 L420 N421 E425 K426 E427D419-K423 WeakPolarHBondContact O-CG 3.45Å; D419-K423 PolarHBondContact O-N 3.01Å; L420-K423 WeakPolarHBondContact O-CB 3.32Å; L420-K423 PolarHBondContact O-N 2.74Å; L420-K423 VanDerWaalsContact O-N 3.15Å; N421-K423 VanDerWaalsContact C-N 3.27Å; N421-K423 PolarHBondContact O-N 2.68Å; K423-E425 VanDerWaalsContact C-N 3.31Å; K423-E425 PolarHBondContact O-N 3.24Å; K423-K426 WeakPolarHBondContact O-CB 3.32Å; K423-K426 PolarHBondContact O-N 2.93Å; K423-K426 VanDerWaalsContact O-N 3.08Å; K423-E427 WeakPolarHBondContact O-CB 3.39Å; K423-E427 PolarHBondContact O-N 3.33Å
424L94.3Very high94.3Very high106 Ų106104.7 Ų104.756%0.55551%0.514SS*.Hα-helixtrans-61-37176-175.861.7000112.4L420 N421 K426 E427 T428L420-L424 PolarHBondContact O-N 2.62Å; N421-L424 PolarHBondContact O-N 2.93Å; L424-K426 VanDerWaalsContact C-N 3.31Å; L424-K426 PolarHBondContact O-N 3.31Å; L424-E427 PolarHBondContact O-N 3.28Å; L424-T428 HydrophobicContact CD1-CG2 4.36Å; L424-T428 WeakPolarHBondContact O-CB 3.39Å; L424-T428 WeakPolarHBondContact O-CG2 3.47Å; L424-T428 PolarHBondContact O-N 2.67Å; L424-T428 PolarHBondContact O-OG1 3.29Å
425E93.6Very high94.5Very high100 Ų100105 Ų10547%0.46751%0.514SS..Hα-helixtrans-68.4-29175.3-154.4-154.416000112.6N421 K423 T428 K429N421-E425 WeakPolarHBondContact O-CB 3.34Å; N421-E425 PolarHBondContact O-N 2.81Å; K423-E425 VanDerWaalsContact C-N 3.31Å; K423-E425 PolarHBondContact O-N 3.24Å; E425-T428 WeakPolarHBondContact CA-OG1 3.46Å; E425-T428 PolarHBondContact O-OG1 3.44Å; E425-K429 VanDerWaalsContact CD-NZ 3.28Å; E425-K429 VanDerWaalsContact O-CD 3.26Å; E425-K429 WeakPolarHBondContact O-CD 3.28Å; E425-K429 WeakPolarHBondContact O-CG 3.4Å; E425-K429 PolarHBondContact O-N 3.06Å; E425-K429 VanDerWaalsContact OE1-CE 3.32Å; E425-K429 WeakPolarHBondContact OE1-CE 3.35Å; E425-K429 IonicContact OE1-NZ 3.37Å; E425-K429 PolarHBondContact OE1-NZ 3.47Å; E425-K429 IonicContact OE2-NZ 3.9Å
426K94.4Very high94.7Very high139 Ų139104.6 Ų104.660%0.60452%0.52SS*.Hα-helixtrans-77.4-44.2172.4-72.2169.2-177178.90111.4K422 K423 L424 K429 Q430K422-K426 WeakPolarHBondContact O-CD 3.48Å; K422-K426 VanDerWaalsContact O-CG 3.3Å; K422-K426 WeakPolarHBondContact O-CG 3.32Å; K422-K426 PolarHBondContact O-N 2.89Å; K423-K426 WeakPolarHBondContact O-CB 3.32Å; K423-K426 PolarHBondContact O-N 2.93Å; K423-K426 VanDerWaalsContact O-N 3.08Å; L424-K426 VanDerWaalsContact C-N 3.31Å; L424-K426 PolarHBondContact O-N 3.31Å; K426-K429 PolarHBondContact O-N 2.92Å; K426-Q430 WeakPolarHBondContact O-CG 3.48Å; K426-Q430 PolarHBondContact O-N 3.26Å
427E92.8Very high94.8Very high116 Ų116104.3 Ų104.354%0.54252%0.518SS..Hα-helixtrans-61.8-45.3178.5-168.460-142.800111K423 L424 K429 Q430 S431K423-E427 WeakPolarHBondContact O-CB 3.39Å; K423-E427 PolarHBondContact O-N 3.33Å; L424-E427 PolarHBondContact O-N 3.28Å; E427-K429 PolarHBondContact O-N 2.79Å; E427-Q430 PolarHBondContact O-N 3.45Å; E427-S431 WeakPolarHBondContact O-CB 3.24Å; E427-S431 PolarHBondContact O-N 3.01Å
428T93.9Very high95.1Very high62 Ų62104.1 Ų104.138%0.3852%0.515SS..Hα-helixtrans-62.2-41.1174.348.10000111.9L424 E425 Q430 S431 W432L424-T428 HydrophobicContact CD1-CG2 4.36Å; L424-T428 WeakPolarHBondContact O-CB 3.39Å; L424-T428 WeakPolarHBondContact O-CG2 3.47Å; L424-T428 PolarHBondContact O-N 2.67Å; L424-T428 PolarHBondContact O-OG1 3.29Å; E425-T428 WeakPolarHBondContact CA-OG1 3.46Å; E425-T428 PolarHBondContact O-OG1 3.44Å; T428-Q430 PolarHBondContact O-N 2.96Å; T428-S431 CarbonylContact O-C 3.59Å; T428-S431 WeakPolarHBondContact O-CB 3.34Å; T428-S431 PolarHBondContact O-N 2.82Å; T428-W432 PolarHBondContact O-N 2.91Å
429K95.3Very high95.1Very high111 Ų111102.1 Ų102.148%0.48351%0.511SS..Hα-helixtrans-62.9-39.2173.7-73.9168.5-168.3171.10112.6E425 K426 E427 W432 C433E425-K429 VanDerWaalsContact CD-NZ 3.28Å; E425-K429 VanDerWaalsContact O-CD 3.26Å; E425-K429 WeakPolarHBondContact O-CD 3.28Å; E425-K429 WeakPolarHBondContact O-CG 3.4Å; E425-K429 PolarHBondContact O-N 3.06Å; E425-K429 VanDerWaalsContact OE1-CE 3.32Å; E425-K429 WeakPolarHBondContact OE1-CE 3.35Å; E425-K429 IonicContact OE1-NZ 3.37Å; E425-K429 PolarHBondContact OE1-NZ 3.47Å; E425-K429 IonicContact OE2-NZ 3.9Å; K426-K429 PolarHBondContact O-N 2.92Å; E427-K429 PolarHBondContact O-N 2.79Å; K429-W432 PolarHBondContact O-N 3.49Å; K429-C433 PolarHBondContact O-N 3.46Å; K429-C433 PolarHBondContact O-SG 2.91Å; K429-C433 VanDerWaalsContact O-SG 3.39Å
430Q95.6Very high95.3Very high117 Ų117105.1 Ų105.155%0.54752%0.523SS..Hα-helixtrans-66.1-41.3173.2-71.6-178.3-0.700111.5K426 E427 T428 W432 C433 L434K426-Q430 WeakPolarHBondContact O-CG 3.48Å; K426-Q430 PolarHBondContact O-N 3.26Å; E427-Q430 PolarHBondContact O-N 3.45Å; T428-Q430 PolarHBondContact O-N 2.96Å; Q430-W432 VanDerWaalsContact C-N 3.31Å; Q430-W432 PolarHBondContact O-N 2.82Å; Q430-C433 PolarHBondContact O-N 2.7Å; Q430-L434 WeakPolarHBondContact O-CG 3.29Å; Q430-L434 PolarHBondContact O-N 2.97Å
431S93.8Very high95.4Very high70 Ų70104.5 Ų104.549%0.4952%0.52SS..Hα-helixtrans-61-36.5172.7-175.10000112.5E427 T428 K435E427-S431 WeakPolarHBondContact O-CB 3.24Å; E427-S431 PolarHBondContact O-N 3.01Å; T428-S431 CarbonylContact O-C 3.59Å; T428-S431 WeakPolarHBondContact O-CB 3.34Å; T428-S431 PolarHBondContact O-N 2.82Å; S431-K435 WeakPolarHBondContact O-CB 3.48Å; S431-K435 PolarHBondContact O-N 3.31Å
432W96.4Very high95.5Very high194 Ų194103.2 Ų103.274%0.73551%0.513SS*.Hα-helixtrans-66.6-40.5172.8-83107.7000112.4T428 K429 Q430 K435 A436T428-W432 PolarHBondContact O-N 2.91Å; K429-W432 PolarHBondContact O-N 3.49Å; Q430-W432 VanDerWaalsContact C-N 3.31Å; Q430-W432 PolarHBondContact O-N 2.82Å; W432-K435 PolarHBondContact O-N 3.27Å; W432-A436 PolarHBondContact O-N 2.87Å
433C95.2Very high95.6Very high80 Ų80104.6 Ų104.654%0.54152%0.52SS..Hα-helixtrans-64.4-50.2174.1-66.70000111.7K429 Q430 K435 A436 E437K429-C433 PolarHBondContact O-N 3.46Å; K429-C433 PolarHBondContact O-SG 2.91Å; K429-C433 VanDerWaalsContact O-SG 3.39Å; Q430-C433 PolarHBondContact O-N 2.7Å; C433-K435 PolarHBondContact O-N 3.3Å; C433-A436 WeakPolarHBondContact O-CB 3.39Å; C433-A436 PolarHBondContact O-N 3.38Å; C433-A436 VanDerWaalsContact O-N 3.07Å; C433-E437 PolarHBondContact O-N 3.15Å
434L96.3Very high95.7Very high100 Ų100106.2 Ų106.252%0.52452%0.523SS..Hα-helixtrans-60-36.1176.1-70.6170.7000111.7Q430 E437 V438Q430-L434 WeakPolarHBondContact O-CG 3.29Å; Q430-L434 PolarHBondContact O-N 2.97Å; L434-E437 PolarHBondContact O-N 2.86Å; L434-V438 WeakPolarHBondContact O-CB 3.47Å; L434-V438 VanDerWaalsContact O-CG2 3.29Å; L434-V438 WeakPolarHBondContact O-CG2 3.46Å; L434-V438 PolarHBondContact O-N 3.07Å
435K97.3Very high95.9Very high102 Ų102104.6 Ų104.644%0.44351%0.514SS..Hα-helixtrans-63-42.6174.1179.255178.7145.70111.7S431 W432 C433 V438 D439S431-K435 WeakPolarHBondContact O-CB 3.48Å; S431-K435 PolarHBondContact O-N 3.31Å; W432-K435 PolarHBondContact O-N 3.27Å; C433-K435 PolarHBondContact O-N 3.3Å; K435-V438 PolarHBondContact O-N 3.38Å; K435-D439 WeakPolarHBondContact CE-OD2 3.48Å; K435-D439 IonicContact NZ-OD1 3.35Å; K435-D439 PolarHBondContact NZ-OD1 2.83Å; K435-D439 IonicContact NZ-OD2 3.91Å; K435-D439 PolarHBondContact NZ-OD2 3.37Å; K435-D439 WeakPolarHBondContact O-CB 3.39Å; K435-D439 VanDerWaalsContact O-CG 3.25Å; K435-D439 PolarHBondContact O-N 3.06Å
436A95.8Very high96Very high60 Ų60102.3 Ų102.350%0.49651%0.507SS..Hα-helixtrans-66.1-39.2175.200000112.7W432 C433 D439 Q440W432-A436 PolarHBondContact O-N 2.87Å; C433-A436 WeakPolarHBondContact O-CB 3.39Å; C433-A436 PolarHBondContact O-N 3.38Å; C433-A436 VanDerWaalsContact O-N 3.07Å; A436-D439 PolarHBondContact O-N 3.24Å; A436-Q440 WeakPolarHBondContact O-CB 3.48Å; A436-Q440 PolarHBondContact O-N 3.25Å
437E96.9Very high96.1Very high121 Ų121100.1 Ų100.157%0.56550%0.501SS*.Hα-helixtrans-65.9-42.7174.7-71.2-180-173.500112.3C433 L434 Q440 L441C433-E437 PolarHBondContact O-N 3.15Å; L434-E437 PolarHBondContact O-N 2.86Å; E437-Q440 PolarHBondContact O-N 2.73Å; E437-L441 WeakPolarHBondContact O-CB 3.44Å; E437-L441 PolarHBondContact O-N 2.95Å
438V96.3Very high96.3Very high76 Ų7699.4 Ų99.446%0.46150%0.501SS..Hα-helixtrans-61.9-43.2173.2165.90000110.9L434 K435 L441 N442L434-V438 WeakPolarHBondContact O-CB 3.47Å; L434-V438 VanDerWaalsContact O-CG2 3.29Å; L434-V438 WeakPolarHBondContact O-CG2 3.46Å; L434-V438 PolarHBondContact O-N 3.07Å; K435-V438 PolarHBondContact O-N 3.38Å; V438-L441 PolarHBondContact O-N 3.47Å; V438-N442 WeakPolarHBondContact O-CB 3.26Å; V438-N442 PolarHBondContact O-N 2.96Å; V438-N442 PolarHBondContact O-ND2 2.99Å; V438-N442 VanDerWaalsContact O-ND2 3.16Å
439D96.3Very high96.4Very high55 Ų55101.6 Ų101.629%0.29451%0.507SS..Hα-helixtrans-68.9-34.2178-70.5-21.9000111.9K435 A436 N442 H443K435-D439 WeakPolarHBondContact CE-OD2 3.48Å; K435-D439 IonicContact NZ-OD1 3.35Å; K435-D439 PolarHBondContact NZ-OD1 2.83Å; K435-D439 IonicContact NZ-OD2 3.91Å; K435-D439 PolarHBondContact NZ-OD2 3.37Å; K435-D439 WeakPolarHBondContact O-CB 3.39Å; K435-D439 VanDerWaalsContact O-CG 3.25Å; K435-D439 PolarHBondContact O-N 3.06Å; A436-D439 PolarHBondContact O-N 3.24Å; D439-N442 PolarHBondContact O-N 3.28Å; D439-H443 PolarHBondContact O-N 3.4Å; D439-H443 PolarHBondContact O-ND1 2.88Å
440Q97.7Very high96.5Very high144 Ų144100 Ų10067%0.67350%0.5SS*.Hα-helixtrans-66-40.3170.6-171.8-178.917.400112.1A436 E437 H443 R444A436-Q440 WeakPolarHBondContact O-CB 3.48Å; A436-Q440 PolarHBondContact O-N 3.25Å; E437-Q440 PolarHBondContact O-N 2.73Å; Q440-H443 PolarHBondContact O-N 2.65Å; Q440-R444 PolarHBondContact O-N 2.94Å
441L97.2Very high96.5Very high99 Ų9999.9 Ų99.952%0.51850%0.502SS..Hα-helixtrans-64.6-41.7175.3-177.261.5000111.2E437 V438 R444 I445E437-L441 WeakPolarHBondContact O-CB 3.44Å; E437-L441 PolarHBondContact O-N 2.95Å; V438-L441 PolarHBondContact O-N 3.47Å; L441-R444 CarbonylContact O-C 3.58Å; L441-R444 WeakPolarHBondContact O-CB 3.34Å; L441-R444 PolarHBondContact O-N 3.26Å; L441-I445 HydrophobicContact CG-CD1 4.19Å; L441-I445 WeakPolarHBondContact O-CG1 3.19Å; L441-I445 PolarHBondContact O-N 2.72Å
442N96Very high96.6Very high77 Ų77103 Ų10341%0.41251%0.509SS..Hα-helixtrans-60.6-44.7174.8-70.8-29.4000111.7V438 D439 R444 I445 T446V438-N442 WeakPolarHBondContact O-CB 3.26Å; V438-N442 PolarHBondContact O-N 2.96Å; V438-N442 PolarHBondContact O-ND2 2.99Å; V438-N442 VanDerWaalsContact O-ND2 3.16Å; D439-N442 PolarHBondContact O-N 3.28Å; N442-R444 VanDerWaalsContact C-N 3.33Å; N442-R444 PolarHBondContact O-N 3.34Å; N442-I445 PolarHBondContact O-N 3.47Å; N442-T446 PolarHBondContact O-N 3.17Å
443H97.6Very high96.6Very high127 Ų12798.6 Ų98.659%0.58850%0.5SS*.Hα-helixtrans-56.9-47.6173.1-77.879.6000111.2D439 Q440 I445 T446 D447D439-H443 PolarHBondContact O-N 3.4Å; D439-H443 PolarHBondContact O-ND1 2.88Å; Q440-H443 PolarHBondContact O-N 2.65Å; H443-I445 VanDerWaalsContact C-N 3.3Å; H443-I445 PolarHBondContact O-N 3.5Å; H443-T446 PolarHBondContact O-N 3.38Å; H443-T446 VanDerWaalsContact O-N 3.11Å; H443-T446 PolarHBondContact O-OG1 2.97Å; H443-D447 PolarHBondContact O-N 2.86Å
444R97.9Very high96.6Very high175 Ų17597.1 Ų97.166%0.6649%0.494SS*.Hα-helixtrans-62.2-33.2177.9-173.1175.5-178.3172.41.2113.2Q440 L441 N442 L448Q440-R444 PolarHBondContact O-N 2.94Å; L441-R444 CarbonylContact O-C 3.58Å; L441-R444 WeakPolarHBondContact O-CB 3.34Å; L441-R444 PolarHBondContact O-N 3.26Å; N442-R444 VanDerWaalsContact C-N 3.33Å; N442-R444 PolarHBondContact O-N 3.34Å; R444-L448 WeakPolarHBondContact O-CG 3.5Å; R444-L448 PolarHBondContact O-N 2.87Å; R444-L448 VanDerWaalsContact O-N 3.12Å
445I97.1Very high96.5Very high72 Ų7299 Ų9937%0.36950%0.498SS..Hα-helixtrans-64.3-50.4171.6-70.4163.9000109.5L441 N442 H443 D447 L448 E449L441-I445 HydrophobicContact CG-CD1 4.19Å; L441-I445 WeakPolarHBondContact O-CG1 3.19Å; L441-I445 PolarHBondContact O-N 2.72Å; N442-I445 PolarHBondContact O-N 3.47Å; H443-I445 VanDerWaalsContact C-N 3.3Å; H443-I445 PolarHBondContact O-N 3.5Å; I445-D447 PolarHBondContact O-N 3.48Å; I445-L448 WeakPolarHBondContact O-CA 3.28Å; I445-L448 WeakPolarHBondContact O-CB 3.44Å; I445-L448 PolarHBondContact O-N 2.94Å; I445-E449 HydrophobicContact CG2-CG 4.37Å; I445-E449 WeakPolarHBondContact O-CG 3.49Å; I445-E449 PolarHBondContact O-N 3Å
446T96.3Very high96.5Very high51 Ų5196.8 Ų96.831%0.31350%0.495SS..Hα-helixtrans-62.1-30.1178.771.60000113.7N442 H443 E449 K450N442-T446 PolarHBondContact O-N 3.17Å; H443-T446 PolarHBondContact O-N 3.38Å; H443-T446 VanDerWaalsContact O-N 3.11Å; H443-T446 PolarHBondContact O-OG1 2.97Å; T446-E449 WeakPolarHBondContact CA-OE2 3.35Å; T446-K450 WeakPolarHBondContact O-CD 3.14Å; T446-K450 WeakPolarHBondContact O-CE 3.33Å; T446-K450 WeakPolarHBondContact O-CG 3.37Å; T446-K450 PolarHBondContact O-N 2.91Å; T446-K450 PolarHBondContact OG1-NZ 3.44Å; T446-K450 VanDerWaalsContact OG1-NZ 3.13Å
447D96.1Very high96.6Very high93 Ų9397.9 Ų97.950%0.49749%0.489SS..Hα-helixtrans-75-28.9175.1-70.3-22.7000112.8H443 I445 K450 L451H443-D447 PolarHBondContact O-N 2.86Å; I445-D447 PolarHBondContact O-N 3.48Å; D447-K450 IonicContact OD1-NZ 3.7Å; D447-K450 PolarHBondContact OD1-NZ 3.44Å; D447-L451 WeakPolarHBondContact O-CB 3.48Å; D447-L451 PolarHBondContact O-N 2.76Å
448L97.1Very high96.5Very high101 Ų10195.3 Ų95.353%0.52948%0.484SS..Hα-helixtrans-72.7-39.9169.7-71.6168.7000111.6R444 I445 L451 E452R444-L448 WeakPolarHBondContact O-CG 3.5Å; R444-L448 PolarHBondContact O-N 2.87Å; R444-L448 VanDerWaalsContact O-N 3.12Å; I445-L448 WeakPolarHBondContact O-CA 3.28Å; I445-L448 WeakPolarHBondContact O-CB 3.44Å; I445-L448 PolarHBondContact O-N 2.94Å; L448-L451 CarbonylContact O-C 3.56Å; L448-L451 WeakPolarHBondContact O-CB 3.33Å; L448-L451 PolarHBondContact O-N 3.01Å; L448-L451 VanDerWaalsContact O-N 3.14Å; L448-E452 PolarHBondContact O-N 3.01Å
449E95.9Very high96.6Very high109 Ų10997.8 Ų97.851%0.50949%0.489SS..Hα-helixtrans-60.1-48.1174.3-69.1169.1161.500111.1I445 T446 L451 E452 D453I445-E449 HydrophobicContact CG2-CG 4.37Å; I445-E449 WeakPolarHBondContact O-CG 3.49Å; I445-E449 PolarHBondContact O-N 3Å; T446-E449 WeakPolarHBondContact CA-OE2 3.35Å; E449-L451 PolarHBondContact O-N 2.94Å; E449-E452 PolarHBondContact O-N 3.1Å; E449-E452 VanDerWaalsContact O-N 3.16Å; E449-D453 PolarHBondContact O-N 2.97Å
450K97.3Very high96.6Very high77 Ų77101 Ų10134%0.33550%0.502SS..Hα-helixtrans-57.4-35.5173.4-69.6161.5-145.1155.70112.4T446 D447 A454T446-K450 WeakPolarHBondContact O-CD 3.14Å; T446-K450 WeakPolarHBondContact O-CE 3.33Å; T446-K450 WeakPolarHBondContact O-CG 3.37Å; T446-K450 PolarHBondContact O-N 2.91Å; T446-K450 PolarHBondContact OG1-NZ 3.44Å; T446-K450 VanDerWaalsContact OG1-NZ 3.13Å; D447-K450 IonicContact OD1-NZ 3.7Å; D447-K450 PolarHBondContact OD1-NZ 3.44Å; K450-A454 WeakPolarHBondContact O-CB 3.4Å; K450-A454 PolarHBondContact O-N 3.44Å
451L96.4Very high96.5Very high114 Ų11497.9 Ų97.960%0.59749%0.488SS*.Hα-helixtrans-75.4-35.5178.3-174.362.2000112.2D447 L448 E449 A454 F455D447-L451 WeakPolarHBondContact O-CB 3.48Å; D447-L451 PolarHBondContact O-N 2.76Å; L448-L451 CarbonylContact O-C 3.56Å; L448-L451 WeakPolarHBondContact O-CB 3.33Å; L448-L451 PolarHBondContact O-N 3.01Å; L448-L451 VanDerWaalsContact O-N 3.14Å; E449-L451 PolarHBondContact O-N 2.94Å; L451-A454 PolarHBondContact O-N 2.98Å; L451-F455 VanDerWaalsContact O-CB 3.32Å; L451-F455 WeakPolarHBondContact O-CB 3.36Å; L451-F455 PolarHBondContact O-N 3.46Å
452E95.3Very high96.5Very high135 Ų13597 Ų9763%0.63149%0.489SS*.Hα-helixtrans-67.9-38.1172.3-178.1163-161.200111.8L448 E449 F455 S456L448-E452 PolarHBondContact O-N 3.01Å; E449-E452 PolarHBondContact O-N 3.1Å; E449-E452 VanDerWaalsContact O-N 3.16Å; E452-F455 PolarHBondContact O-N 3.45Å; E452-S456 VanDerWaalsContact O-CB 3.26Å; E452-S456 WeakPolarHBondContact O-CB 3.37Å; E452-S456 PolarHBondContact O-N 2.83Å; E452-S456 PolarHBondContact O-OG 2.99Å
453D96Very high96.5Very high102 Ų10297.7 Ų97.755%0.54549%0.491SS..Hα-helixtrans-60.9-47.1170.1-104-6.7000111.4E449 F455 S456 K457E449-D453 PolarHBondContact O-N 2.97Å; D453-F455 PolarHBondContact O-N 3.42Å; D453-S456 PolarHBondContact O-N 3.45Å; D453-K457 VanDerWaalsContact O-CG 3.31Å; D453-K457 WeakPolarHBondContact O-CG 3.44Å; D453-K457 PolarHBondContact O-N 3.37Å
454A95.1Very high96.4Very high50 Ų5092.7 Ų92.741%0.41347%0.471SS..Hα-helixtrans-63-41.2176.600000112.1K450 L451 K457 S458K450-A454 WeakPolarHBondContact O-CB 3.4Å; K450-A454 PolarHBondContact O-N 3.44Å; L451-A454 PolarHBondContact O-N 2.98Å; A454-K457 PolarHBondContact O-N 2.87Å; A454-S458 WeakPolarHBondContact O-CB 3.19Å; A454-S458 PolarHBondContact O-N 3.08Å
455F95.9Very high96.3Very high140 Ų14090.2 Ų90.261%0.61447%0.47SS*.Hα-helixtrans-65.9-38.4175-175-103.2000111.8L451 E452 D453 S458 K459L451-F455 VanDerWaalsContact O-CB 3.32Å; L451-F455 WeakPolarHBondContact O-CB 3.36Å; L451-F455 PolarHBondContact O-N 3.46Å; E452-F455 PolarHBondContact O-N 3.45Å; D453-F455 PolarHBondContact O-N 3.42Å; F455-S458 PolarHBondContact O-N 2.94Å; F455-K459 WeakPolarHBondContact O-CB 3.38Å; F455-K459 PolarHBondContact O-N 2.91Å
456S96.8Very high96.3Very high55 Ų5593.4 Ų93.439%0.38548%0.481SS..Hα-helixtrans-67.4-41.2176.7-65.80000112.2E452 D453 Q460E452-S456 VanDerWaalsContact O-CB 3.26Å; E452-S456 WeakPolarHBondContact O-CB 3.37Å; E452-S456 PolarHBondContact O-N 2.83Å; E452-S456 PolarHBondContact O-OG 2.99Å; D453-S456 PolarHBondContact O-N 3.45Å; S456-Q460 WeakPolarHBondContact O-CB 3.22Å; S456-Q460 PolarHBondContact O-N 2.98Å
457K96.9Very high96.3Very high83 Ų8393.7 Ų93.736%0.36149%0.485SS..Hα-helixtrans-58.9-52.8169.8-69.9170-170.8178.60111.1D453 A454 K459 Q460 E461 Q1081 S1082D453-K457 VanDerWaalsContact O-CG 3.31Å; D453-K457 WeakPolarHBondContact O-CG 3.44Å; D453-K457 PolarHBondContact O-N 3.37Å; A454-K457 PolarHBondContact O-N 2.87Å; K457-K459 VanDerWaalsContact C-N 3.33Å; K457-K459 PolarHBondContact O-N 3.28Å; K457-Q460 WeakPolarHBondContact O-CB 3.38Å; K457-Q460 PolarHBondContact O-N 2.9Å; K457-E461 WeakPolarHBondContact O-CG 3.46Å; K457-E461 PolarHBondContact O-N 2.68Å; K457-Q1081 PolarHBondContact NZ-O 3.28Å; K457-S1082 PolarHBondContact NZ-O 3.44Å
458S95.7Very high96.3Very high66 Ų6691.5 Ų91.546%0.46247%0.474SS..Hα-helixtrans-61.9-37.2-179.9-174.30000113.1A454 F455 E461 C462A454-S458 WeakPolarHBondContact O-CB 3.19Å; A454-S458 PolarHBondContact O-N 3.08Å; F455-S458 PolarHBondContact O-N 2.94Å; S458-E461 PolarHBondContact O-N 2.86Å; S458-C462 VanDerWaalsContact O-CB 3.29Å; S458-C462 WeakPolarHBondContact O-CB 3.44Å; S458-C462 PolarHBondContact O-N 3.46Å
459K97.6Very high96.3Very high129 Ų12990.2 Ų90.256%0.56147%0.467SS*.Hα-helixtrans-62.4-41.6172.2179.9-178.5176-173.50111.7F455 K457 C462 I463F455-K459 WeakPolarHBondContact O-CB 3.38Å; F455-K459 PolarHBondContact O-N 2.91Å; K457-K459 VanDerWaalsContact C-N 3.33Å; K457-K459 PolarHBondContact O-N 3.28Å; K459-C462 PolarHBondContact O-N 2.73Å; K459-I463 HydrophobicContact CG-CD1 4.33Å; K459-I463 WeakPolarHBondContact O-CD1 3.31Å; K459-I463 VanDerWaalsContact O-CG1 3.29Å; K459-I463 WeakPolarHBondContact O-CG1 3.16Å; K459-I463 PolarHBondContact O-N 2.97Å
460Q96.6Very high96.3Very high122 Ų12289.2 Ų89.257%0.5746%0.462SS*.Hα-helixtrans-69.6-40.2176.4-176.159.92000112.3S456 K457 C462 I463 S464S456-Q460 WeakPolarHBondContact O-CB 3.22Å; S456-Q460 PolarHBondContact O-N 2.98Å; K457-Q460 WeakPolarHBondContact O-CB 3.38Å; K457-Q460 PolarHBondContact O-N 2.9Å; Q460-C462 VanDerWaalsContact C-N 3.34Å; Q460-C462 PolarHBondContact O-N 2.92Å; Q460-I463 PolarHBondContact O-N 2.81Å; Q460-S464 PolarHBondContact O-N 3.18Å
461E96.4Very high96.3Very high79 Ų7989.4 Ų89.437%0.36946%0.463SS..Hα-helixtrans-60.7-42.1172.3-71.7173.2176.800111.1K457 S458 I463 S464 L465 N1084K457-E461 WeakPolarHBondContact O-CG 3.46Å; K457-E461 PolarHBondContact O-N 2.68Å; S458-E461 PolarHBondContact O-N 2.86Å; E461-I463 PolarHBondContact O-N 2.96Å; E461-S464 PolarHBondContact O-N 2.78Å; E461-L465 WeakPolarHBondContact O-CB 3.44Å; E461-L465 PolarHBondContact O-N 2.94Å; E461-N1084 PolarHBondContact OE1-N 3.49Å; E461-N1084 VanDerWaalsContact OE1-N 3.07Å
462C95.9Very high96.1Very high81 Ų8190.3 Ų90.355%0.54746%0.464SS..Hα-helixtrans-63.1-40174.7-1760000112.7S458 K459 Q460 L465 K466S458-C462 VanDerWaalsContact O-CB 3.29Å; S458-C462 WeakPolarHBondContact O-CB 3.44Å; S458-C462 PolarHBondContact O-N 3.46Å; K459-C462 PolarHBondContact O-N 2.73Å; Q460-C462 VanDerWaalsContact C-N 3.34Å; Q460-C462 PolarHBondContact O-N 2.92Å; C462-L465 PolarHBondContact O-N 3.36Å; C462-K466 WeakPolarHBondContact O-CB 3.43Å; C462-K466 PolarHBondContact O-N 2.83Å
463I96.5Very high96.2Very high90 Ų9089.9 Ų89.946%0.46246%0.457SS..Hα-helixtrans-64.3-42.7173.6-70.3162.6000110.9K459 Q460 E461 K466 S467K459-I463 HydrophobicContact CG-CD1 4.33Å; K459-I463 WeakPolarHBondContact O-CD1 3.31Å; K459-I463 VanDerWaalsContact O-CG1 3.29Å; K459-I463 WeakPolarHBondContact O-CG1 3.16Å; K459-I463 PolarHBondContact O-N 2.97Å; Q460-I463 PolarHBondContact O-N 2.81Å; E461-I463 PolarHBondContact O-N 2.96Å; I463-K466 PolarHBondContact O-N 3.18Å; I463-S467 PolarHBondContact O-N 3.22Å
464S95.4Very high96.2Very high23 Ų2388.7 Ų88.716%0.16145%0.453CS..Hα-helixtrans-63.7-47.5175.6-175.10000111.8Q460 E461 K466 S467 N468 S1086Q460-S464 PolarHBondContact O-N 3.18Å; E461-S464 PolarHBondContact O-N 2.78Å; S464-K466 VanDerWaalsContact C-N 3.33Å; S464-K466 PolarHBondContact O-N 3.42Å; S464-S467 WeakPolarHBondContact O-CB 3.48Å; S464-S467 PolarHBondContact O-N 2.83Å; S464-S467 VanDerWaalsContact O-N 3.09Å; S464-N468 VanDerWaalsContact O-CG 3.31Å; S464-N468 PolarHBondContact O-N 2.71Å; S464-N468 PolarHBondContact O-ND2 3.49Å; S464-N468 VanDerWaalsContact O-ND2 3.11Å; S464-N468 PolarHBondContact OG-ND2 2.83Å; S464-S1086 PolarHBondContact OG-O 3.46Å
465L96.8Very high96.3Very high123 Ų12390.3 Ų90.364%0.64446%0.458SS*.Hα-helixtrans-60-42.1177.3-176.462.1000111.5E461 C462 N468 L469E461-L465 WeakPolarHBondContact O-CB 3.44Å; E461-L465 PolarHBondContact O-N 2.94Å; C462-L465 PolarHBondContact O-N 3.36Å; L465-N468 PolarHBondContact O-N 2.96Å; L465-L469 WeakPolarHBondContact O-CB 3.41Å; L465-L469 PolarHBondContact O-N 3.11Å
466K97Very high96.4Very high139 Ų13987.2 Ų87.260%0.60445%0.453SS*.Hα-helixtrans-60.3-45.1172.6-176.2-175.3175.1-172.90111.7C462 I463 S464 N468 L469 E470C462-K466 WeakPolarHBondContact O-CB 3.43Å; C462-K466 PolarHBondContact O-N 2.83Å; I463-K466 PolarHBondContact O-N 3.18Å; S464-K466 VanDerWaalsContact C-N 3.33Å; S464-K466 PolarHBondContact O-N 3.42Å; K466-N468 VanDerWaalsContact C-N 3.32Å; K466-N468 PolarHBondContact O-N 3.32Å; K466-L469 PolarHBondContact O-N 2.86Å; K466-E470 PolarHBondContact O-N 2.98Å
467S96.2Very high96.4Very high57 Ų5791.6 Ų91.640%0.39947%0.465SS..Hα-helixtrans-60-43176.3-176.80000111.6I463 S464 E470 K471I463-S467 PolarHBondContact O-N 3.22Å; S464-S467 WeakPolarHBondContact O-CB 3.48Å; S464-S467 PolarHBondContact O-N 2.83Å; S464-S467 VanDerWaalsContact O-N 3.09Å; S467-E470 WeakPolarHBondContact O-CB 3.38Å; S467-E470 PolarHBondContact O-N 3.25Å; S467-K471 WeakPolarHBondContact O-CG 3.47Å; S467-K471 PolarHBondContact O-N 3.39Å
468N95.8Very high96.4Very high47 Ų4791.1 Ų91.125%0.25147%0.47SS..Hα-helixtrans-69.2-37.8179.4-63.3-35.9000112.3S464 L465 K466 E470 K471 E472S464-N468 VanDerWaalsContact O-CG 3.31Å; S464-N468 PolarHBondContact O-N 2.71Å; S464-N468 PolarHBondContact O-ND2 3.49Å; S464-N468 VanDerWaalsContact O-ND2 3.11Å; S464-N468 PolarHBondContact OG-ND2 2.83Å; L465-N468 PolarHBondContact O-N 2.96Å; K466-N468 VanDerWaalsContact C-N 3.32Å; K466-N468 PolarHBondContact O-N 3.32Å; N468-E470 VanDerWaalsContact C-N 3.33Å; N468-E470 PolarHBondContact O-N 3.43Å; N468-K471 WeakPolarHBondContact O-CB 3.4Å; N468-K471 PolarHBondContact O-N 2.9Å; N468-K471 PolarHBondContact OD1-NZ 2.72Å; N468-E472 WeakPolarHBondContact O-CB 3.01Å; N468-E472 PolarHBondContact O-N 3.42Å
469L96Very high96.5Very high74 Ų7492.8 Ų92.839%0.38747%0.473SS..Hα-helixtrans-64.2-35.2171-179.363.2000112.3L465 K466 E472 R473L465-L469 WeakPolarHBondContact O-CB 3.41Å; L465-L469 PolarHBondContact O-N 3.11Å; K466-L469 PolarHBondContact O-N 2.86Å; L469-E472 PolarHBondContact O-N 3.18Å; L469-R473 WeakPolarHBondContact O-CB 3.46Å; L469-R473 WeakPolarHBondContact O-CD 3.42Å; L469-R473 WeakPolarHBondContact O-CG 3.48Å; L469-R473 PolarHBondContact O-N 2.89Å
470E96.4Very high96.4Very high87 Ų8791 Ų9141%0.40747%0.469SS..Hα-helixtrans-67-42.5174.1-143.575.7-98.100111.2K466 S467 N468 R473 T474K466-E470 PolarHBondContact O-N 2.98Å; S467-E470 WeakPolarHBondContact O-CB 3.38Å; S467-E470 PolarHBondContact O-N 3.25Å; N468-E470 VanDerWaalsContact C-N 3.33Å; N468-E470 PolarHBondContact O-N 3.43Å; E470-R473 PolarHBondContact O-N 3.47Å; E470-R473 IonicContact OE1-NH1 3.42Å; E470-R473 PolarHBondContact OE1-NH1 2.91Å; E470-T474 PolarHBondContact O-N 3.46Å; E470-T474 PolarHBondContact O-OG1 3.19Å
471K96.6Very high96.4Very high82 Ų8288.6 Ų88.636%0.35747%0.466SS..Hα-helixtrans-58.9-49.3171.9-64.3168.3-162.8166.20111S467 N468 R473 T474 V475 S1088S467-K471 WeakPolarHBondContact O-CG 3.47Å; S467-K471 PolarHBondContact O-N 3.39Å; N468-K471 WeakPolarHBondContact O-CB 3.4Å; N468-K471 PolarHBondContact O-N 2.9Å; N468-K471 PolarHBondContact OD1-NZ 2.72Å; K471-R473 VanDerWaalsContact C-N 3.34Å; K471-R473 PolarHBondContact O-N 2.87Å; K471-T474 WeakPolarHBondContact CA-OG1 3.3Å; K471-T474 PolarHBondContact O-N 3.41Å; K471-T474 PolarHBondContact O-OG1 3.48Å; K471-V475 PolarHBondContact O-N 3.35Å; K471-S1088 PolarHBondContact NZ-OG 2.92Å; K471-S1088 VanDerWaalsContact NZ-OG 3.14Å
472E93.1Very high96.5Very high132 Ų13290 Ų9062%0.61747%0.473SS*.Hα-helixtrans-59.6-42.3178.3-171.8-179.8-175.500111.9N468 L469 T474 V475 S476N468-E472 WeakPolarHBondContact O-CB 3.01Å; N468-E472 PolarHBondContact O-N 3.42Å; L469-E472 PolarHBondContact O-N 3.18Å; E472-T474 VanDerWaalsContact C-N 3.34Å; E472-T474 PolarHBondContact O-N 3.42Å; E472-V475 PolarHBondContact O-N 3.09Å; E472-S476 VanDerWaalsContact O-CB 3.31Å; E472-S476 WeakPolarHBondContact O-CB 3.43Å; E472-S476 PolarHBondContact O-N 3.29Å
473R97.3Very high96.5Very high127 Ų12790.1 Ų90.148%0.47947%0.467SS..Hα-helixtrans-61.6-37172.2-75.4166171.9-176.2-1.6113.1L469 E470 K471 K477L469-R473 WeakPolarHBondContact O-CB 3.46Å; L469-R473 WeakPolarHBondContact O-CD 3.42Å; L469-R473 WeakPolarHBondContact O-CG 3.48Å; L469-R473 PolarHBondContact O-N 2.89Å; E470-R473 PolarHBondContact O-N 3.47Å; E470-R473 IonicContact OE1-NH1 3.42Å; E470-R473 PolarHBondContact OE1-NH1 2.91Å; K471-R473 VanDerWaalsContact C-N 3.34Å; K471-R473 PolarHBondContact O-N 2.87Å; R473-K477 VanDerWaalsContact O-CG 3.26Å; R473-K477 WeakPolarHBondContact O-CG 3.44Å; R473-K477 PolarHBondContact O-N 3.39Å; R473-K477 VanDerWaalsContact O-N 3.08Å
474T96.7Very high96.6Very high77 Ų7789.9 Ų89.947%0.47246%0.464SS..Hα-helixtrans-68.5-43.3174.152.70000112.1E470 K471 E472 S476 K477 V478E470-T474 PolarHBondContact O-N 3.46Å; E470-T474 PolarHBondContact O-OG1 3.19Å; K471-T474 WeakPolarHBondContact CA-OG1 3.3Å; K471-T474 PolarHBondContact O-N 3.41Å; K471-T474 PolarHBondContact O-OG1 3.48Å; E472-T474 VanDerWaalsContact C-N 3.34Å; E472-T474 PolarHBondContact O-N 3.42Å; T474-S476 PolarHBondContact O-N 3Å; T474-K477 PolarHBondContact O-N 3.36Å; T474-V478 WeakPolarHBondContact O-CG2 3.49Å; T474-V478 PolarHBondContact O-N 2.88Å
475V97.3Very high96.7Very high84 Ų8491.7 Ų91.751%0.50948%0.481SS..Hα-helixtrans-61.7-44.4174.61730000111.2K471 E472 K477 V478 L479K471-V475 PolarHBondContact O-N 3.35Å; E472-V475 PolarHBondContact O-N 3.09Å; V475-K477 VanDerWaalsContact C-N 3.33Å; V475-K477 PolarHBondContact O-N 3.02Å; V475-V478 PolarHBondContact O-N 2.96Å; V475-V478 VanDerWaalsContact O-N 3.16Å; V475-L479 HydrophobicContact CG1-CD1 3.87Å; V475-L479 HydrophobicContact CG1-CG 4.28Å; V475-L479 WeakPolarHBondContact O-CG 3.18Å; V475-L479 PolarHBondContact O-N 3.49Å
476S97Very high96.7Very high74 Ų7489.6 Ų89.652%0.51747%0.47SS..Hα-helixtrans-59.4-39.9175.8176.60000112.6E472 T474 N480E472-S476 VanDerWaalsContact O-CB 3.31Å; E472-S476 WeakPolarHBondContact O-CB 3.43Å; E472-S476 PolarHBondContact O-N 3.29Å; T474-S476 PolarHBondContact O-N 3Å; S476-N480 WeakPolarHBondContact O-CB 3.34Å; S476-N480 PolarHBondContact O-N 2.99Å
477K97.9Very high96.7Very high147 Ų14787.4 Ų87.464%0.63946%0.46SS*.Hα-helixtrans-64.3-42.8173.4-74.1167.4-177.2176.30112.5R473 T474 V475 N480 S481R473-K477 VanDerWaalsContact O-CG 3.26Å; R473-K477 WeakPolarHBondContact O-CG 3.44Å; R473-K477 PolarHBondContact O-N 3.39Å; R473-K477 VanDerWaalsContact O-N 3.08Å; T474-K477 PolarHBondContact O-N 3.36Å; V475-K477 VanDerWaalsContact C-N 3.33Å; V475-K477 PolarHBondContact O-N 3.02Å; K477-N480 PolarHBondContact O-N 3.45Å; K477-S481 PolarHBondContact O-N 3.48Å
478V97.2Very high96.8Very high74 Ų7488.4 Ų88.445%0.44846%0.464SS..Hα-helixtrans-62.4-52.8177.1172.30000110.2T474 V475 N480 S481 E482T474-V478 WeakPolarHBondContact O-CG2 3.49Å; T474-V478 PolarHBondContact O-N 2.88Å; V475-V478 PolarHBondContact O-N 2.96Å; V475-V478 VanDerWaalsContact O-N 3.16Å; V478-N480 VanDerWaalsContact C-N 3.25Å; V478-N480 PolarHBondContact O-N 2.89Å; V478-S481 WeakPolarHBondContact O-CA 3.25Å; V478-S481 PolarHBondContact O-N 3.03Å; V478-S481 PolarHBondContact O-OG 3Å; V478-E482 HydrophobicContact CG1-CG 4.43Å; V478-E482 PolarHBondContact O-N 3.31Å
479L97Very high96.8Very high101 Ų10192.5 Ų92.553%0.52948%0.476SS..Hα-helixtrans-57.5-36.8177.1-69.1172000112.4V475 L483V475-L479 HydrophobicContact CG1-CD1 3.87Å; V475-L479 HydrophobicContact CG1-CG 4.28Å; V475-L479 WeakPolarHBondContact O-CG 3.18Å; V475-L479 PolarHBondContact O-N 3.49Å; L479-L483 VanDerWaalsContact O-CB 3.31Å; L479-L483 WeakPolarHBondContact O-CB 3.44Å; L479-L483 PolarHBondContact O-N 2.73Å
480N96.1Very high96.9Very high91 Ų9192 Ų9249%0.48748%0.475SS..Hα-helixtrans-67.6-38.5174-169.893.5000112.1S476 K477 V478 L483 E484S476-N480 WeakPolarHBondContact O-CB 3.34Å; S476-N480 PolarHBondContact O-N 2.99Å; K477-N480 PolarHBondContact O-N 3.45Å; V478-N480 VanDerWaalsContact C-N 3.25Å; V478-N480 PolarHBondContact O-N 2.89Å; N480-L483 PolarHBondContact O-N 3.28Å; N480-E484 PolarHBondContact O-N 3.2Å
481S96.6Very high96.9Very high71 Ų7194.2 Ų94.250%0.49748%0.484SS..Hα-helixtrans-68.5-37175.671.90000112.6K477 V478 E484 A485K477-S481 PolarHBondContact O-N 3.48Å; V478-S481 WeakPolarHBondContact O-CA 3.25Å; V478-S481 PolarHBondContact O-N 3.03Å; V478-S481 PolarHBondContact O-OG 3Å; S481-E484 PolarHBondContact O-N 3.41Å; S481-A485 WeakPolarHBondContact O-CB 3.49Å; S481-A485 PolarHBondContact O-N 3.22Å
482E97.5Very high96.9Very high110 Ų11095.9 Ų95.951%0.51449%0.493SS..Hα-helixtrans-64.9-39171.9-69.3175.517800111.4V478 A485 L486V478-E482 HydrophobicContact CG1-CG 4.43Å; V478-E482 PolarHBondContact O-N 3.31Å; E482-A485 PolarHBondContact O-N 3.45Å; E482-L486 VanDerWaalsContact O-CB 3.3Å; E482-L486 WeakPolarHBondContact O-CB 3.44Å; E482-L486 PolarHBondContact O-N 3.46Å
483L96.9Very high96.9Very high83 Ų8394 Ų9444%0.43549%0.487SS..Hα-helixtrans-65.1-41.1175.4-179.962.3000112.4L479 N480 L486 K487L479-L483 VanDerWaalsContact O-CB 3.31Å; L479-L483 WeakPolarHBondContact O-CB 3.44Å; L479-L483 PolarHBondContact O-N 2.73Å; N480-L483 PolarHBondContact O-N 3.28Å; L483-L486 PolarHBondContact O-N 3.3Å; L483-K487 VanDerWaalsContact O-CG 3.3Å; L483-K487 WeakPolarHBondContact O-CG 3.19Å; L483-K487 PolarHBondContact O-N 3.49Å
484E97.4Very high96.9Very high84 Ų8493.5 Ų93.539%0.39349%0.489SS..Hα-helixtrans-68.2-40.7173.5-65.6-49.2136.300112.1N480 S481 L486 K487 V488N480-E484 PolarHBondContact O-N 3.2Å; S481-E484 PolarHBondContact O-N 3.41Å; E484-L486 VanDerWaalsContact C-N 3.3Å; E484-L486 PolarHBondContact O-N 2.8Å; E484-K487 WeakPolarHBondContact O-CB 3.4Å; E484-K487 PolarHBondContact O-N 2.91Å; E484-K487 IonicContact OE1-NZ 3Å; E484-K487 PolarHBondContact OE1-NZ 2.98Å; E484-K487 VanDerWaalsContact OE2-CD 3.26Å; E484-K487 WeakPolarHBondContact OE2-CD 3.34Å; E484-K487 IonicContact OE2-NZ 3.12Å; E484-V488 WeakPolarHBondContact O-CG2 3.27Å; E484-V488 PolarHBondContact O-N 2.79Å
485A97.3Very high96.9Very high62 Ų6293.6 Ų93.651%0.51249%0.49SS..Hα-helixtrans-60.3-40.417300000111.8S481 E482 V488 R489S481-A485 WeakPolarHBondContact O-CB 3.49Å; S481-A485 PolarHBondContact O-N 3.22Å; E482-A485 PolarHBondContact O-N 3.45Å; A485-V488 PolarHBondContact O-N 2.99Å; A485-R489 PolarHBondContact O-N 3.23Å
486L96.8Very high96.7Very high79 Ų7991.4 Ų91.441%0.41448%0.481SS..Hα-helixtrans-65.5-40.4174.9-176.360.6000111.9E482 L483 E484 V488 R489 V490E482-L486 VanDerWaalsContact O-CB 3.3Å; E482-L486 WeakPolarHBondContact O-CB 3.44Å; E482-L486 PolarHBondContact O-N 3.46Å; L483-L486 PolarHBondContact O-N 3.3Å; E484-L486 VanDerWaalsContact C-N 3.3Å; E484-L486 PolarHBondContact O-N 2.8Å; L486-V488 VanDerWaalsContact C-N 3.33Å; L486-V488 PolarHBondContact O-N 2.9Å; L486-R489 VanDerWaalsContact CD1-NH2 3.31Å; L486-R489 PolarHBondContact O-N 3.42Å; L486-V490 WeakPolarHBondContact O-CG2 3.48Å; L486-V490 PolarHBondContact O-N 3.35Å
487K97.7Very high96.6Very high92 Ų9294.2 Ų94.240%0.449%0.486SS..Hα-helixtrans-62.3-37173.5-74.4164.8-1801740112.6L483 E484 K491L483-K487 VanDerWaalsContact O-CG 3.3Å; L483-K487 WeakPolarHBondContact O-CG 3.19Å; L483-K487 PolarHBondContact O-N 3.49Å; E484-K487 WeakPolarHBondContact O-CB 3.4Å; E484-K487 PolarHBondContact O-N 2.91Å; E484-K487 IonicContact OE1-NZ 3Å; E484-K487 PolarHBondContact OE1-NZ 2.98Å; E484-K487 VanDerWaalsContact OE2-CD 3.26Å; E484-K487 WeakPolarHBondContact OE2-CD 3.34Å; E484-K487 IonicContact OE2-NZ 3.12Å; K487-K491 WeakPolarHBondContact O-CG 3.33Å; K487-K491 PolarHBondContact O-N 3.5Å
488V97.4Very high96.5Very high78 Ų7888.7 Ų88.747%0.47347%0.471SS..Hα-helixtrans-64.8-50.41731730000110E484 A485 L486 V490 K491 E492E484-V488 WeakPolarHBondContact O-CG2 3.27Å; E484-V488 PolarHBondContact O-N 2.79Å; A485-V488 PolarHBondContact O-N 2.99Å; L486-V488 VanDerWaalsContact C-N 3.33Å; L486-V488 PolarHBondContact O-N 2.9Å; V488-V490 VanDerWaalsContact C-N 3.28Å; V488-V490 PolarHBondContact O-N 3.08Å; V488-K491 WeakPolarHBondContact O-CB 3.44Å; V488-K491 PolarHBondContact O-N 3.24Å; V488-E492 HydrophobicContact CG1-CG 4.5Å; V488-E492 WeakPolarHBondContact O-CG 3.25Å; V488-E492 PolarHBondContact O-N 3.13Å
489R96.6Very high96.5Very high134 Ų13491.1 Ų91.151%0.50648%0.475SS..Hα-helixtrans-60.4-34.2178.9-165.4179.168.986.70.6113.3A485 L486 E492 L493A485-R489 PolarHBondContact O-N 3.23Å; L486-R489 VanDerWaalsContact CD1-NH2 3.31Å; L486-R489 PolarHBondContact O-N 3.42Å; R489-E492 PolarHBondContact O-N 2.94Å; R489-L493 VanDerWaalsContact O-CG 3.31Å; R489-L493 WeakPolarHBondContact O-CG 3.45Å; R489-L493 PolarHBondContact O-N 3.07Å
490V97.2Very high96.3Very high62 Ų6290.8 Ų90.838%0.37648%0.477SS..Hα-helixtrans-63.7-47.6172.7167.10000110.9L486 V488 E492 L493 E494L486-V490 WeakPolarHBondContact O-CG2 3.48Å; L486-V490 PolarHBondContact O-N 3.35Å; V488-V490 VanDerWaalsContact C-N 3.28Å; V488-V490 PolarHBondContact O-N 3.08Å; V490-E492 VanDerWaalsContact C-N 3.31Å; V490-E492 PolarHBondContact O-N 2.79Å; V490-L493 WeakPolarHBondContact O-CB 3.49Å; V490-L493 PolarHBondContact O-N 3.16Å; V490-L493 VanDerWaalsContact O-N 3.15Å; V490-E494 HydrophobicContact CG1-CG 4.43Å; V490-E494 WeakPolarHBondContact O-CG 3.48Å; V490-E494 PolarHBondContact O-N 2.81Å
491K97.1Very high96.4Very high134 Ų13490.1 Ų90.158%0.58348%0.476SS*.Hα-helixtrans-61.7-38176.1-69170.9-178.1176.10112.6K487 V488 L493 E494 T495K487-K491 WeakPolarHBondContact O-CG 3.33Å; K487-K491 PolarHBondContact O-N 3.5Å; V488-K491 WeakPolarHBondContact O-CB 3.44Å; V488-K491 PolarHBondContact O-N 3.24Å; K491-L493 VanDerWaalsContact C-N 3.34Å; K491-E494 PolarHBondContact O-N 3.23Å; K491-T495 WeakPolarHBondContact O-CG2 3.47Å; K491-T495 PolarHBondContact O-N 2.84Å
492E96Very high96.4Very high118 Ų11894 Ų9455%0.55148%0.484SS*.Hα-helixtrans-60.3-45.7174.3-70.4172.2165.300111.2V488 R489 V490 T495 A496V488-E492 HydrophobicContact CG1-CG 4.5Å; V488-E492 WeakPolarHBondContact O-CG 3.25Å; V488-E492 PolarHBondContact O-N 3.13Å; R489-E492 PolarHBondContact O-N 2.94Å; V490-E492 VanDerWaalsContact C-N 3.31Å; V490-E492 PolarHBondContact O-N 2.79Å; E492-T495 PolarHBondContact O-N 2.81Å; E492-T495 PolarHBondContact O-OG1 2.68Å; E492-A496 PolarHBondContact O-N 2.87Å
493L94.7Very high96.3Very high93 Ų9393 Ų9349%0.48749%0.485SS..Hα-helixtrans-63.3-42.9175-70.7168.9000112.5R489 V490 K491 T495 A496 E497R489-L493 VanDerWaalsContact O-CG 3.31Å; R489-L493 WeakPolarHBondContact O-CG 3.45Å; R489-L493 PolarHBondContact O-N 3.07Å; V490-L493 WeakPolarHBondContact O-CB 3.49Å; V490-L493 PolarHBondContact O-N 3.16Å; V490-L493 VanDerWaalsContact O-N 3.15Å; K491-L493 VanDerWaalsContact C-N 3.34Å; L493-T495 VanDerWaalsContact C-N 3.31Å; L493-T495 PolarHBondContact O-N 3.37Å; L493-A496 CarbonylContact O-C 3.58Å; L493-A496 WeakPolarHBondContact O-CA 3.37Å; L493-A496 WeakPolarHBondContact O-CB 3.33Å; L493-A496 PolarHBondContact O-N 3.33Å; L493-E497 PolarHBondContact O-N 2.86Å
494E96.4Very high96.2Very high115 Ų11593.6 Ų93.654%0.53749%0.486SS..Hα-helixtrans-56.8-42.8173-69.9168.1170.300111.3V490 K491 A496 G498V490-E494 HydrophobicContact CG1-CG 4.43Å; V490-E494 WeakPolarHBondContact O-CG 3.48Å; V490-E494 PolarHBondContact O-N 2.81Å; K491-E494 PolarHBondContact O-N 3.23Å; E494-A496 VanDerWaalsContact C-N 3.3Å; E494-A496 PolarHBondContact O-N 2.81Å; E494-G498 PolarHBondContact O-N 3.34Å
495T96.4Very high96.1Very high79 Ų7993.9 Ų93.949%0.48549%0.487SS..Hα-helixtrans-72.8-20174.874.30000113.7K491 E492 L493 K499K491-T495 WeakPolarHBondContact O-CG2 3.47Å; K491-T495 PolarHBondContact O-N 2.84Å; E492-T495 PolarHBondContact O-N 2.81Å; E492-T495 PolarHBondContact O-OG1 2.68Å; L493-T495 VanDerWaalsContact C-N 3.31Å; L493-T495 PolarHBondContact O-N 3.37Å; T495-K499 WeakPolarHBondContact O-CD 3.35Å; T495-K499 WeakPolarHBondContact O-CE 3.48Å; T495-K499 WeakPolarHBondContact O-CG 3.35Å; T495-K499 PolarHBondContact O-N 3.03Å; T495-K499 PolarHBondContact O-NZ 2.85Å; T495-K499 PolarHBondContact OG1-NZ 3.33Å
496A93.1Very high96.1Very high39 Ų3994.4 Ų94.432%0.32248%0.484SS..Hα-helixtrans-79-47.4174.300000110.6E492 L493 E494 G498 K499 V500E492-A496 PolarHBondContact O-N 2.87Å; L493-A496 CarbonylContact O-C 3.58Å; L493-A496 WeakPolarHBondContact O-CA 3.37Å; L493-A496 WeakPolarHBondContact O-CB 3.33Å; L493-A496 PolarHBondContact O-N 3.33Å; E494-A496 VanDerWaalsContact C-N 3.3Å; E494-A496 PolarHBondContact O-N 2.81Å; A496-G498 VanDerWaalsContact C-N 3.32Å; A496-G498 PolarHBondContact O-N 3.25Å; A496-K499 WeakPolarHBondContact O-CA 3.14Å; A496-K499 WeakPolarHBondContact O-CB 3.47Å; A496-K499 PolarHBondContact O-N 3.1Å; A496-V500 WeakPolarHBondContact O-CG2 3.34Å; A496-V500 PolarHBondContact O-N 3.44Å
497E94.7Very high96.1Very high132 Ų13296.4 Ų96.462%0.61750%0.495SS*.Hα-helixtrans-55.2-47.5171-175.9177.9-171.900110.8L493 K499 V500 V501L493-E497 PolarHBondContact O-N 2.86Å; E497-K499 PolarHBondContact O-N 2.85Å; E497-K499 VanDerWaalsContact O-N 3.08Å; E497-V500 PolarHBondContact O-N 2.83Å; E497-V501 HydrophobicContact CG-CG2 4.38Å; E497-V501 WeakPolarHBondContact O-CG2 3.28Å; E497-V501 PolarHBondContact O-N 3.41Å
498G96.2Very high96.1Very high31 Ų3196.4 Ų96.432%0.3250%0.495SS..Hα-helixtrans-63.5-11.5174.800000115.6E494 A496 K502E494-G498 PolarHBondContact O-N 3.34Å; A496-G498 VanDerWaalsContact C-N 3.32Å; A496-G498 PolarHBondContact O-N 3.25Å; G498-K502 VanDerWaalsContact O-CD 3.28Å; G498-K502 WeakPolarHBondContact O-CD 3.31Å; G498-K502 WeakPolarHBondContact O-CE 3.27Å; G498-K502 WeakPolarHBondContact O-CG 3.27Å
499K96.5Very high96Very high126 Ų12696.5 Ų96.555%0.54849%0.49SS..Hα-helixtrans-91-43.9166.6-66.7156.2-1651480110.7T495 A496 E497 V501 K502 T503T495-K499 WeakPolarHBondContact O-CD 3.35Å; T495-K499 WeakPolarHBondContact O-CE 3.48Å; T495-K499 WeakPolarHBondContact O-CG 3.35Å; T495-K499 PolarHBondContact O-N 3.03Å; T495-K499 PolarHBondContact O-NZ 2.85Å; T495-K499 PolarHBondContact OG1-NZ 3.33Å; A496-K499 WeakPolarHBondContact O-CA 3.14Å; A496-K499 WeakPolarHBondContact O-CB 3.47Å; A496-K499 PolarHBondContact O-N 3.1Å; E497-K499 PolarHBondContact O-N 2.85Å; E497-K499 VanDerWaalsContact O-N 3.08Å; K499-V501 PolarHBondContact O-N 3.37Å; K499-K502 WeakPolarHBondContact O-CB 3.28Å; K499-K502 PolarHBondContact O-N 3.35Å; K499-K502 VanDerWaalsContact O-N 3.1Å; K499-T503 PolarHBondContact O-N 3.06Å; K499-T503 PolarHBondContact O-OG1 2.66Å
500V93.9Very high96Very high93 Ų9394.1 Ų94.156%0.56449%0.487SS*.Hα-helixtrans-57.9-46.8177.5173.80000111.2A496 E497 K502 T503 E504A496-V500 WeakPolarHBondContact O-CG2 3.34Å; A496-V500 PolarHBondContact O-N 3.44Å; E497-V500 PolarHBondContact O-N 2.83Å; V500-K502 VanDerWaalsContact C-N 3.25Å; V500-K502 PolarHBondContact O-N 3.27Å; V500-T503 WeakPolarHBondContact CA-OG1 3.45Å; V500-T503 PolarHBondContact O-N 3.44Å; V500-T503 VanDerWaalsContact O-N 3.09Å; V500-T503 PolarHBondContact O-OG1 2.85Å; V500-E504 WeakPolarHBondContact O-CB 3.38Å; V500-E504 PolarHBondContact O-N 2.84Å
501V97.4Very high96Very high77 Ų7795.2 Ų95.247%0.46749%0.49SS..Hα-helixtrans-58.9-35.9176.3172.80000111.9E497 K499 Q505E497-V501 HydrophobicContact CG-CG2 4.38Å; E497-V501 WeakPolarHBondContact O-CG2 3.28Å; E497-V501 PolarHBondContact O-N 3.41Å; K499-V501 PolarHBondContact O-N 3.37Å; V501-Q505 WeakPolarHBondContact O-CB 3.18Å; V501-Q505 PolarHBondContact O-N 2.93Å
502K97.2Very high95.8Very high154 Ų15492.6 Ų92.667%0.6749%0.486SS*.Hα-helixtrans-69.5-41.4175.1-68.2173.1-174174.10111.8G498 K499 V500 E504 Q505 T506G498-K502 VanDerWaalsContact O-CD 3.28Å; G498-K502 WeakPolarHBondContact O-CD 3.31Å; G498-K502 WeakPolarHBondContact O-CE 3.27Å; G498-K502 WeakPolarHBondContact O-CG 3.27Å; K499-K502 WeakPolarHBondContact O-CB 3.28Å; K499-K502 PolarHBondContact O-N 3.35Å; K499-K502 VanDerWaalsContact O-N 3.1Å; V500-K502 VanDerWaalsContact C-N 3.25Å; V500-K502 PolarHBondContact O-N 3.27Å; K502-E504 VanDerWaalsContact C-N 3.34Å; K502-Q505 PolarHBondContact O-N 2.87Å; K502-T506 PolarHBondContact O-N 2.87Å; K502-T506 PolarHBondContact O-OG1 2.9Å
503T94.6Very high95.9Very high87 Ų8792.5 Ų92.553%0.53448%0.484SS..Hα-helixtrans-68.3-32.7175.5520000112.9K499 V500 T506 L507K499-T503 PolarHBondContact O-N 3.06Å; K499-T503 PolarHBondContact O-OG1 2.66Å; V500-T503 WeakPolarHBondContact CA-OG1 3.45Å; V500-T503 PolarHBondContact O-N 3.44Å; V500-T503 VanDerWaalsContact O-N 3.09Å; V500-T503 PolarHBondContact O-OG1 2.85Å; T503-T506 WeakPolarHBondContact CA-OG1 3.3Å; T503-T506 PolarHBondContact O-OG1 3.36Å; T503-L507 WeakPolarHBondContact O-CB 3.38Å; T503-L507 PolarHBondContact O-N 3.34Å
504E96.1Very high96Very high96 Ų9692.9 Ų92.945%0.44949%0.486SS..Hα-helixtrans-66.5-40.9172.7-162.5-149.2171.800110.8V500 K502 L507 K508V500-E504 WeakPolarHBondContact O-CB 3.38Å; V500-E504 PolarHBondContact O-N 2.84Å; K502-E504 VanDerWaalsContact C-N 3.34Å; E504-L507 PolarHBondContact O-N 3.09Å; E504-K508 VanDerWaalsContact CD-CE 3.44Å; E504-K508 VanDerWaalsContact O-CG 3.31Å; E504-K508 WeakPolarHBondContact O-CG 3.42Å; E504-K508 PolarHBondContact O-N 3.36Å; E504-K508 WeakPolarHBondContact OE1-CE 3.38Å; E504-K508 IonicContact OE1-NZ 3.21Å; E504-K508 PolarHBondContact OE1-NZ 2.95Å; E504-K508 IonicContact OE2-NZ 2.68Å; E504-K508 PolarHBondContact OE2-NZ 2.77Å
505Q95.9Very high96.1Very high91 Ų9193.4 Ų93.443%0.42549%0.486SS..Hα-helixtrans-63.7-45.7175179.156.829.500112.2V501 K502 L507 K508 E509V501-Q505 WeakPolarHBondContact O-CB 3.18Å; V501-Q505 PolarHBondContact O-N 2.93Å; K502-Q505 PolarHBondContact O-N 2.87Å; Q505-L507 VanDerWaalsContact C-N 3.31Å; Q505-L507 PolarHBondContact O-N 3.27Å; Q505-K508 WeakPolarHBondContact O-CB 3.46Å; Q505-K508 PolarHBondContact O-N 2.96Å; Q505-E509 PolarHBondContact NE2-OE1 3.44Å; Q505-E509 WeakPolarHBondContact O-CG 3.15Å; Q505-E509 PolarHBondContact O-N 2.91Å
506T96.1Very high96Very high72 Ų7293.7 Ų93.744%0.44249%0.488SS..Hα-helixtrans-63-38.3174.950.70000111.9K502 T503 K508 E509 D510K502-T506 PolarHBondContact O-N 2.87Å; K502-T506 PolarHBondContact O-OG1 2.9Å; T503-T506 WeakPolarHBondContact CA-OG1 3.3Å; T503-T506 PolarHBondContact O-OG1 3.36Å; T506-K508 PolarHBondContact O-N 3.07Å; T506-E509 WeakPolarHBondContact O-CB 3.42Å; T506-E509 PolarHBondContact O-N 2.94Å; T506-D510 PolarHBondContact O-N 3.24Å
507L96.4Very high96.2Very high121 Ų12196 Ų9663%0.63450%0.495SS*.Hα-helixtrans-67.1-34.6176.2-175.162000112.4T503 E504 Q505 E509 D510 L511T503-L507 WeakPolarHBondContact O-CB 3.38Å; T503-L507 PolarHBondContact O-N 3.34Å; E504-L507 PolarHBondContact O-N 3.09Å; Q505-L507 VanDerWaalsContact C-N 3.31Å; Q505-L507 PolarHBondContact O-N 3.27Å; L507-E509 VanDerWaalsContact C-N 3.35Å; L507-D510 PolarHBondContact O-N 3.04Å; L507-L511 VanDerWaalsContact O-CB 3.25Å; L507-L511 WeakPolarHBondContact O-CB 3.45Å; L507-L511 PolarHBondContact O-N 2.78Å
508K97.2Very high96.2Very high92 Ų9293.3 Ų93.340%0.449%0.487SS..Hα-helixtrans-63.3-40.4170.9-74.4163.7-176.9163.10111.5E504 Q505 T506 L511 T512E504-K508 VanDerWaalsContact CD-CE 3.44Å; E504-K508 VanDerWaalsContact O-CG 3.31Å; E504-K508 WeakPolarHBondContact O-CG 3.42Å; E504-K508 PolarHBondContact O-N 3.36Å; E504-K508 WeakPolarHBondContact OE1-CE 3.38Å; E504-K508 IonicContact OE1-NZ 3.21Å; E504-K508 PolarHBondContact OE1-NZ 2.95Å; E504-K508 IonicContact OE2-NZ 2.68Å; E504-K508 PolarHBondContact OE2-NZ 2.77Å; Q505-K508 WeakPolarHBondContact O-CB 3.46Å; Q505-K508 PolarHBondContact O-N 2.96Å; T506-K508 PolarHBondContact O-N 3.07Å; K508-L511 PolarHBondContact O-N 2.89Å; K508-T512 WeakPolarHBondContact O-CG2 3.04Å; K508-T512 PolarHBondContact O-N 3.32Å; K508-T512 PolarHBondContact O-OG1 2.99Å
509E96.9Very high96.2Very high81 Ų8195.9 Ų95.938%0.37950%0.496SS..Hα-helixtrans-69.1-38.7176.6-70.7168.7-157.500112.6Q505 T506 L507 T512 K513Q505-E509 PolarHBondContact NE2-OE1 3.44Å; Q505-E509 WeakPolarHBondContact O-CG 3.15Å; Q505-E509 PolarHBondContact O-N 2.91Å; T506-E509 WeakPolarHBondContact O-CB 3.42Å; T506-E509 PolarHBondContact O-N 2.94Å; L507-E509 VanDerWaalsContact C-N 3.35Å; E509-T512 PolarHBondContact O-N 2.87Å; E509-T512 PolarHBondContact O-OG1 2.85Å; E509-K513 WeakPolarHBondContact O-CE 3.4Å; E509-K513 VanDerWaalsContact O-CG 3.23Å; E509-K513 WeakPolarHBondContact O-CG 3.46Å; E509-K513 PolarHBondContact O-N 2.83Å
510D95.2Very high96.1Very high83 Ų8394.7 Ų94.744%0.44449%0.494SS..Hα-helixtrans-70.7-33.6174.2-68.9-28.6000111.8T506 L507 K513 L514T506-D510 PolarHBondContact O-N 3.24Å; L507-D510 PolarHBondContact O-N 3.04Å; D510-K513 PolarHBondContact O-N 3.18Å; D510-K513 WeakPolarHBondContact OD1-CD 3.48Å; D510-K513 WeakPolarHBondContact OD1-CE 3.36Å; D510-K513 IonicContact OD1-NZ 3.85Å; D510-K513 PolarHBondContact OD1-NZ 2.96Å; D510-L514 WeakPolarHBondContact O-CB 3.44Å; D510-L514 PolarHBondContact O-N 3Å
511L97.1Very high96.2Very high85 Ų8594 Ų9445%0.44549%0.487SS..Hα-helixtrans-66.3-35.8171.4-178.761.2000112.5L507 K508 K515L507-L511 VanDerWaalsContact O-CB 3.25Å; L507-L511 WeakPolarHBondContact O-CB 3.45Å; L507-L511 PolarHBondContact O-N 2.78Å; K508-L511 PolarHBondContact O-N 2.89Å; L511-K515 HydrophobicContact CG-CD 4.5Å; L511-K515 WeakPolarHBondContact O-CB 3.34Å; L511-K515 VanDerWaalsContact O-CG 3.27Å; L511-K515 WeakPolarHBondContact O-CG 3.44Å; L511-K515 PolarHBondContact O-N 2.92Å
512T94.8Very high96.1Very high79 Ų7994.2 Ų94.249%0.48549%0.488SS..Hα-helixtrans-72.7-38.8173.554.90000111.9K508 E509 L514 K515 T516K508-T512 WeakPolarHBondContact O-CG2 3.04Å; K508-T512 PolarHBondContact O-N 3.32Å; K508-T512 PolarHBondContact O-OG1 2.99Å; E509-T512 PolarHBondContact O-N 2.87Å; E509-T512 PolarHBondContact O-OG1 2.85Å; T512-L514 VanDerWaalsContact C-N 3.35Å; T512-L514 PolarHBondContact O-N 3.28Å; T512-K515 PolarHBondContact O-N 2.75Å; T512-T516 PolarHBondContact O-N 3.24Å; T512-T516 PolarHBondContact O-OG1 2.86Å; T512-T516 VanDerWaalsContact O-OG1 3.09Å
513K97.7Very high96Very high117 Ų11791.2 Ų91.251%0.50948%0.479SS..Hα-helixtrans-56.6-47170-67.9163.5-146.3163.30111.3E509 D510 K515 T516 L517E509-K513 WeakPolarHBondContact O-CE 3.4Å; E509-K513 VanDerWaalsContact O-CG 3.23Å; E509-K513 WeakPolarHBondContact O-CG 3.46Å; E509-K513 PolarHBondContact O-N 2.83Å; D510-K513 PolarHBondContact O-N 3.18Å; D510-K513 WeakPolarHBondContact OD1-CD 3.48Å; D510-K513 WeakPolarHBondContact OD1-CE 3.36Å; D510-K513 IonicContact OD1-NZ 3.85Å; D510-K513 PolarHBondContact OD1-NZ 2.96Å; K513-K515 PolarHBondContact O-N 3.07Å; K513-T516 PolarHBondContact O-N 3.42Å; K513-L517 PolarHBondContact O-N 3.24Å
514L96.8Very high96Very high101 Ų10192 Ų9253%0.52948%0.477SS..Hα-helixtrans-64.7-38.3178.6-177.260.8000112.5D510 T512 L517 T518D510-L514 WeakPolarHBondContact O-CB 3.44Å; D510-L514 PolarHBondContact O-N 3Å; T512-L514 VanDerWaalsContact C-N 3.35Å; T512-L514 PolarHBondContact O-N 3.28Å; L514-L517 PolarHBondContact O-N 3.24Å; L514-T518 WeakPolarHBondContact O-CB 3.42Å; L514-T518 PolarHBondContact O-N 3.28Å; L514-T518 PolarHBondContact O-OG1 2.86Å
515K96.9Very high95.8Very high125 Ų12595.8 Ų95.854%0.54349%0.487SS..Hα-helixtrans-62.2-46.2172.3-77170.3179.4-179.60111.6L511 T512 K513 T518 V519L511-K515 HydrophobicContact CG-CD 4.5Å; L511-K515 WeakPolarHBondContact O-CB 3.34Å; L511-K515 VanDerWaalsContact O-CG 3.27Å; L511-K515 WeakPolarHBondContact O-CG 3.44Å; L511-K515 PolarHBondContact O-N 2.92Å; T512-K515 PolarHBondContact O-N 2.75Å; K513-K515 PolarHBondContact O-N 3.07Å; K515-T518 WeakPolarHBondContact O-CB 3.39Å; K515-T518 PolarHBondContact O-N 2.95Å; K515-V519 WeakPolarHBondContact O-CG2 3.36Å; K515-V519 PolarHBondContact O-N 3.4Å
516T95.1Very high95.8Very high86 Ų8697.6 Ų97.653%0.52849%0.493SS..Hα-helixtrans-61.2-44.5176.3-58.10000111.8T512 K513 T518 V519 M520T512-T516 PolarHBondContact O-N 3.24Å; T512-T516 PolarHBondContact O-OG1 2.86Å; T512-T516 VanDerWaalsContact O-OG1 3.09Å; K513-T516 PolarHBondContact O-N 3.42Å; T516-T518 VanDerWaalsContact C-N 3.31Å; T516-T518 PolarHBondContact O-N 3.02Å; T516-V519 PolarHBondContact O-N 3.23Å; T516-M520 WeakPolarHBondContact O-CG 3.5Å; T516-M520 PolarHBondContact O-N 2.82Å
517L96.8Very high95.8Very high88 Ų8896.4 Ų96.446%0.46149%0.491SS..Hα-helixtrans-61-39.4174.2179.662000111.9K513 L514 M520 L521K513-L517 PolarHBondContact O-N 3.24Å; L514-L517 PolarHBondContact O-N 3.24Å; L517-M520 PolarHBondContact O-N 3.41Å; L517-L521 HydrophobicContact CD1-CD1 4.3Å; L517-L521 HydrophobicContact CD1-CG 4.34Å; L517-L521 HydrophobicContact CG-CD1 4.1Å; L517-L521 WeakPolarHBondContact O-CB 3.48Å; L517-L521 WeakPolarHBondContact O-CG 3.23Å; L517-L521 PolarHBondContact O-N 2.87Å
518T95.4Very high95.7Very high74 Ų7495.9 Ų95.945%0.45449%0.486SS..Hα-helixtrans-64.2-41.3176.5-55.90000111.4L514 K515 T516 L521 V522L514-T518 WeakPolarHBondContact O-CB 3.42Å; L514-T518 PolarHBondContact O-N 3.28Å; L514-T518 PolarHBondContact O-OG1 2.86Å; K515-T518 WeakPolarHBondContact O-CB 3.39Å; K515-T518 PolarHBondContact O-N 2.95Å; T516-T518 VanDerWaalsContact C-N 3.31Å; T516-T518 PolarHBondContact O-N 3.02Å; T518-L521 PolarHBondContact O-N 2.87Å; T518-V522 WeakPolarHBondContact O-CG2 3.49Å; T518-V522 PolarHBondContact O-N 3.4Å
519V95.7Very high95.5Very high85 Ų8594.2 Ų94.252%0.51549%0.49SS..Hα-helixtrans-62.7-47.5173.7173.70000110.8K515 T516 L521 V522 D523K515-V519 WeakPolarHBondContact O-CG2 3.36Å; K515-V519 PolarHBondContact O-N 3.4Å; T516-V519 PolarHBondContact O-N 3.23Å; V519-L521 VanDerWaalsContact C-N 3.34Å; V519-L521 PolarHBondContact O-N 2.96Å; V519-V522 PolarHBondContact O-N 3.13Å; V519-V522 VanDerWaalsContact O-N 3.07Å; V519-D523 PolarHBondContact O-N 3.41Å
520M95.5Very high95.4Very high102 Ų10294.9 Ų94.950%0.50250%0.496SS..Hα-helixtrans-56.2-45.6176.1-71.9175.759.500112.4T516 L517 V522 D523 E524T516-M520 WeakPolarHBondContact O-CG 3.5Å; T516-M520 PolarHBondContact O-N 2.82Å; L517-M520 PolarHBondContact O-N 3.41Å; M520-V522 VanDerWaalsContact C-N 3.3Å; M520-V522 PolarHBondContact O-N 3.42Å; M520-D523 PolarHBondContact O-N 3.5Å; M520-E524 WeakPolarHBondContact O-CB 3.5Å; M520-E524 WeakPolarHBondContact O-CG 3.32Å; M520-E524 PolarHBondContact O-N 3.12Å
521L94.8Very high95.4Very high79 Ų7997.6 Ų97.641%0.41450%0.504SS..Hα-helixtrans-67.2-28.7177.8-70.5170000113L517 T518 V519 R525L517-L521 HydrophobicContact CD1-CD1 4.3Å; L517-L521 HydrophobicContact CD1-CG 4.34Å; L517-L521 HydrophobicContact CG-CD1 4.1Å; L517-L521 WeakPolarHBondContact O-CB 3.48Å; L517-L521 WeakPolarHBondContact O-CG 3.23Å; L517-L521 PolarHBondContact O-N 2.87Å; T518-L521 PolarHBondContact O-N 2.87Å; V519-L521 VanDerWaalsContact C-N 3.34Å; V519-L521 PolarHBondContact O-N 2.96Å; L521-R525 WeakPolarHBondContact O-CB 3.36Å; L521-R525 WeakPolarHBondContact O-CD 3.16Å; L521-R525 WeakPolarHBondContact O-CG 3.22Å; L521-R525 PolarHBondContact O-N 3.49Å
522V96.6Very high95.3Very high81 Ų8198.6 Ų98.649%0.49151%0.509SS..Hα-helixtrans-72.8-42.8172.3167.50000111T518 V519 M520 R525 K526T518-V522 WeakPolarHBondContact O-CG2 3.49Å; T518-V522 PolarHBondContact O-N 3.4Å; V519-V522 PolarHBondContact O-N 3.13Å; V519-V522 VanDerWaalsContact O-N 3.07Å; M520-V522 VanDerWaalsContact C-N 3.3Å; M520-V522 PolarHBondContact O-N 3.42Å; V522-R525 PolarHBondContact O-N 3.34Å; V522-K526 WeakPolarHBondContact O-CB 3.38Å; V522-K526 PolarHBondContact O-N 3.49Å
523D93.9Very high95.3Very high91 Ų91100.7 Ų100.749%0.48751%0.512SS..Hα-helixtrans-67-37.8176.1-76.2-34.3000112.2V519 M520 K526 A527V519-D523 PolarHBondContact O-N 3.41Å; M520-D523 PolarHBondContact O-N 3.5Å; D523-K526 PolarHBondContact O-N 3.4Å; D523-A527 WeakPolarHBondContact O-CB 3.34Å; D523-A527 PolarHBondContact O-N 2.84Å
524E94.8Very high95.1Very high102 Ų102100.4 Ų100.448%0.47751%0.512SS..Hα-helixtrans-63.6-45.4171.4-76.9-179.9179.300111.9M520 K526 A527 M528M520-E524 WeakPolarHBondContact O-CB 3.5Å; M520-E524 WeakPolarHBondContact O-CG 3.32Å; M520-E524 PolarHBondContact O-N 3.12Å; E524-K526 VanDerWaalsContact C-N 3.31Å; E524-K526 PolarHBondContact O-N 2.91Å; E524-A527 PolarHBondContact O-N 3.36Å; E524-M528 HydrophobicContact CB-CE 4.44Å; E524-M528 WeakPolarHBondContact O-CB 3.31Å; E524-M528 WeakPolarHBondContact O-CG 3.37Å; E524-M528 PolarHBondContact O-N 2.96Å
525R91.6Very high94.9Very high176 Ų176101 Ų10166%0.66451%0.513SS*.Hα-helixtrans-59.3-41.4173.3-79.4171.1177.3175.9-0.1112L521 V522 M528 A529L521-R525 WeakPolarHBondContact O-CB 3.36Å; L521-R525 WeakPolarHBondContact O-CD 3.16Å; L521-R525 WeakPolarHBondContact O-CG 3.22Å; L521-R525 PolarHBondContact O-N 3.49Å; V522-R525 PolarHBondContact O-N 3.34Å; R525-M528 HydrophobicContact CG-CE 4.43Å; R525-M528 PolarHBondContact O-N 2.85Å; R525-A529 WeakPolarHBondContact O-CB 3.45Å; R525-A529 PolarHBondContact O-N 3.26Å
526K96.4Very high94.6Very high129 Ų129100.6 Ų100.656%0.56151%0.514SS*.Hα-helixtrans-64.2-48.2175.7-174.9178.3176.8-1770111.4V522 D523 E524 M528 A529 D530V522-K526 WeakPolarHBondContact O-CB 3.38Å; V522-K526 PolarHBondContact O-N 3.49Å; D523-K526 PolarHBondContact O-N 3.4Å; E524-K526 VanDerWaalsContact C-N 3.31Å; E524-K526 PolarHBondContact O-N 2.91Å; K526-M528 VanDerWaalsContact C-N 3.27Å; K526-M528 PolarHBondContact O-N 3.29Å; K526-A529 WeakPolarHBondContact O-CB 3.31Å; K526-A529 PolarHBondContact O-N 2.83Å; K526-A529 VanDerWaalsContact O-N 3.1Å; K526-D530 PolarHBondContact O-N 2.86Å
527A95.4Very high94.6Very high47 Ų47100.5 Ų100.539%0.38851%0.51SS..Hα-helixtrans-63-31.617600000112.9D523 E524 K531D523-A527 WeakPolarHBondContact O-CB 3.34Å; D523-A527 PolarHBondContact O-N 2.84Å; E524-A527 PolarHBondContact O-N 3.36Å; A527-K531 WeakPolarHBondContact O-CB 3.33Å; A527-K531 WeakPolarHBondContact O-CD 3.42Å; A527-K531 WeakPolarHBondContact O-CG 3.39Å; A527-K531 PolarHBondContact O-N 2.89Å; A527-K531 VanDerWaalsContact O-N 3.14Å
528M94.5Very high94.5Very high110 Ų110102.1 Ų102.154%0.54251%0.513SS..Hα-helixtrans-71.6-40.7170.8-74.6-170.8-80.300112.3E524 R525 K526 K531 L532E524-M528 HydrophobicContact CB-CE 4.44Å; E524-M528 WeakPolarHBondContact O-CB 3.31Å; E524-M528 WeakPolarHBondContact O-CG 3.37Å; E524-M528 PolarHBondContact O-N 2.96Å; R525-M528 HydrophobicContact CG-CE 4.43Å; R525-M528 PolarHBondContact O-N 2.85Å; K526-M528 VanDerWaalsContact C-N 3.27Å; K526-M528 PolarHBondContact O-N 3.29Å; M528-K531 PolarHBondContact O-N 3.46Å; M528-L532 WeakPolarHBondContact O-CB 3.31Å; M528-L532 PolarHBondContact O-N 3.43Å
529A94.3Very high94.4Very high57 Ų57102.8 Ų102.847%0.47152%0.517SS..Hα-helixtrans-64.3-41.8175.100000112.1R525 K526 L532 K533R525-A529 WeakPolarHBondContact O-CB 3.45Å; R525-A529 PolarHBondContact O-N 3.26Å; K526-A529 WeakPolarHBondContact O-CB 3.31Å; K526-A529 PolarHBondContact O-N 2.83Å; K526-A529 VanDerWaalsContact O-N 3.1Å; A529-L532 PolarHBondContact O-N 3.25Å; A529-K533 WeakPolarHBondContact O-CB 3.46Å; A529-K533 PolarHBondContact O-N 2.8Å
530D94.8Very high94.2Very high95 Ų95105 Ų10551%0.50852%0.521SS..Hα-helixtrans-64.7-38.5175-73.2-35.5000111.7K526 Q534K526-D530 PolarHBondContact O-N 2.86Å; D530-Q534 WeakPolarHBondContact O-CB 3.5Å; D530-Q534 PolarHBondContact O-N 3.1Å
531K95.3Very high94.1Very high141 Ų141105.3 Ų105.361%0.61353%0.525SS*.Hα-helixtrans-63.5-45.1170.7-76.4168.9-176.3175.10111.9A527 M528 Q534 M535A527-K531 WeakPolarHBondContact O-CB 3.33Å; A527-K531 WeakPolarHBondContact O-CD 3.42Å; A527-K531 WeakPolarHBondContact O-CG 3.39Å; A527-K531 PolarHBondContact O-N 2.89Å; A527-K531 VanDerWaalsContact O-N 3.14Å; M528-K531 PolarHBondContact O-N 3.46Å; K531-Q534 WeakPolarHBondContact O-CB 3.5Å; K531-Q534 PolarHBondContact O-N 3.25Å; K531-Q534 VanDerWaalsContact O-N 3.15Å; K531-M535 WeakPolarHBondContact O-CG 3.21Å; K531-M535 PolarHBondContact O-N 3.4Å
532L94.4Very high94Very high105 Ų105104.6 Ų104.655%0.5553%0.527SS..Hα-helixtrans-60.6-48.5178-168.2161.1000110.2M528 A529 Q534 M535 E536M528-L532 WeakPolarHBondContact O-CB 3.31Å; M528-L532 PolarHBondContact O-N 3.43Å; A529-L532 PolarHBondContact O-N 3.25Å; L532-Q534 VanDerWaalsContact C-N 3.28Å; L532-Q534 PolarHBondContact O-N 3.43Å; L532-M535 CarbonylContact O-C 3.51Å; L532-M535 WeakPolarHBondContact O-CA 3.44Å; L532-M535 WeakPolarHBondContact O-CB 3.42Å; L532-M535 PolarHBondContact O-N 2.96Å; L532-E536 WeakPolarHBondContact O-CB 3.32Å; L532-E536 PolarHBondContact O-N 2.83Å
533K94.6Very high93.9Very high124 Ų124103.9 Ų103.954%0.53952%0.523SS..Hα-helixtrans-59.8-34.9173.7-170.3172.7-177174.70112.4A529 N537A529-K533 WeakPolarHBondContact O-CB 3.46Å; A529-K533 PolarHBondContact O-N 2.8Å; K533-N537 WeakPolarHBondContact O-CB 3.4Å; K533-N537 PolarHBondContact O-N 3.44Å; K533-N537 PolarHBondContact O-ND2 2.96Å
534Q94Very high93.8Very high111 Ų111101.7 Ų101.752%0.51952%0.522SS..Hα-helixtrans-68.6-38.3172.9-161.2-160.571.400112.1D530 K531 L532 K538D530-Q534 WeakPolarHBondContact O-CB 3.5Å; D530-Q534 PolarHBondContact O-N 3.1Å; K531-Q534 WeakPolarHBondContact O-CB 3.5Å; K531-Q534 PolarHBondContact O-N 3.25Å; K531-Q534 VanDerWaalsContact O-N 3.15Å; L532-Q534 VanDerWaalsContact C-N 3.28Å; L532-Q534 PolarHBondContact O-N 3.43Å; Q534-K538 VanDerWaalsContact O-CG 3.29Å; Q534-K538 WeakPolarHBondContact O-CG 3.37Å; Q534-K538 PolarHBondContact O-N 2.72Å
535M91.6Very high93.8Very high113 Ų113104.1 Ų104.156%0.55753%0.531SS*.Hα-helixtrans-67.6-44.2174.4-66.6-168-57.600111.6K531 L532 N537 K538 V539K531-M535 WeakPolarHBondContact O-CG 3.21Å; K531-M535 PolarHBondContact O-N 3.4Å; L532-M535 CarbonylContact O-C 3.51Å; L532-M535 WeakPolarHBondContact O-CA 3.44Å; L532-M535 WeakPolarHBondContact O-CB 3.42Å; L532-M535 PolarHBondContact O-N 2.96Å; M535-N537 PolarHBondContact O-N 3.18Å; M535-K538 CarbonylContact O-C 3.59Å; M535-K538 WeakPolarHBondContact O-CA 3.47Å; M535-K538 WeakPolarHBondContact O-CB 3.48Å; M535-K538 PolarHBondContact O-N 3.45Å; M535-K538 VanDerWaalsContact O-N 3.08Å; M535-V539 WeakPolarHBondContact O-CG2 3.25Å; M535-V539 PolarHBondContact O-N 3.46Å
536E91.9Very high93.7Very high117 Ų117101.3 Ų101.355%0.54753%0.528SS..Hα-helixtrans-56.1-49.1173.8179.9-179.4-138.500111.3L532 K538 V539 Q540L532-E536 WeakPolarHBondContact O-CB 3.32Å; L532-E536 PolarHBondContact O-N 2.83Å; E536-K538 VanDerWaalsContact C-N 3.31Å; E536-K538 PolarHBondContact O-N 3.29Å; E536-V539 PolarHBondContact O-N 2.8Å; E536-Q540 WeakPolarHBondContact O-CB 3.46Å; E536-Q540 PolarHBondContact O-N 3.44Å
537N93.9Very high93.5Very high84 Ų84100.1 Ų100.145%0.44953%0.525SS..Hα-helixtrans-61.5-36.1174.2-79-61.3000112.8K533 M535 N541K533-N537 WeakPolarHBondContact O-CB 3.4Å; K533-N537 PolarHBondContact O-N 3.44Å; K533-N537 PolarHBondContact O-ND2 2.96Å; M535-N537 PolarHBondContact O-N 3.18Å; N537-N541 VanDerWaalsContact O-CB 3.3Å; N537-N541 WeakPolarHBondContact O-CB 3.3Å; N537-N541 VanDerWaalsContact O-CG 3.28Å; N537-N541 PolarHBondContact O-N 2.86Å; N537-N541 PolarHBondContact O-ND2 3.47Å
538K95.6Very high93.3Very high122 Ų122100 Ų10053%0.5352%0.524SS..Hα-helixtrans-66.6-45.3174.2-77164.2172.3170.80111.4Q534 M535 E536 N541 S542Q534-K538 VanDerWaalsContact O-CG 3.29Å; Q534-K538 WeakPolarHBondContact O-CG 3.37Å; Q534-K538 PolarHBondContact O-N 2.72Å; M535-K538 CarbonylContact O-C 3.59Å; M535-K538 WeakPolarHBondContact O-CA 3.47Å; M535-K538 WeakPolarHBondContact O-CB 3.48Å; M535-K538 PolarHBondContact O-N 3.45Å; M535-K538 VanDerWaalsContact O-N 3.08Å; E536-K538 VanDerWaalsContact C-N 3.31Å; E536-K538 PolarHBondContact O-N 3.29Å; K538-N541 PolarHBondContact O-N 3.14Å; K538-S542 PolarHBondContact O-N 2.86Å; K538-S542 PolarHBondContact O-OG 3.39Å
539V92.7Very high93Very high87 Ų8799.2 Ų99.253%0.52752%0.519SS..Hα-helixtrans-59.4-53.3175.7169.70000109.7M535 E536 N541 S542 T543M535-V539 WeakPolarHBondContact O-CG2 3.25Å; M535-V539 PolarHBondContact O-N 3.46Å; E536-V539 PolarHBondContact O-N 2.8Å; V539-N541 VanDerWaalsContact C-N 3.3Å; V539-N541 PolarHBondContact O-N 3.4Å; V539-S542 WeakPolarHBondContact CA-OG 3.47Å; V539-S542 CarbonylContact O-C 3.58Å; V539-S542 WeakPolarHBondContact O-CA 3.26Å; V539-S542 PolarHBondContact O-N 3.44Å; V539-S542 PolarHBondContact O-OG 2.78Å; V539-T543 PolarHBondContact O-N 2.79Å; V539-T543 PolarHBondContact O-OG1 3.33Å; V539-T543 VanDerWaalsContact O-OG1 3.07Å
540Q92.4Very high92.7Very high131 Ų131101.3 Ų101.361%0.61252%0.519SS*.Hα-helixtrans-59.4-38.5179.9-169.367-9.300112.6E536 T543 G544E536-Q540 WeakPolarHBondContact O-CB 3.46Å; E536-Q540 PolarHBondContact O-N 3.44Å; Q540-T543 PolarHBondContact O-N 3.19Å; Q540-G544 PolarHBondContact O-N 2.71Å
541N93.6Very high92.5Very high110 Ų110101.1 Ų101.159%0.58852%0.518SS*.Hα-helixtrans-66.1-36.5172.1-80.4-52.1000112.9N537 K538 V539 K545N537-N541 VanDerWaalsContact O-CB 3.3Å; N537-N541 WeakPolarHBondContact O-CB 3.3Å; N537-N541 VanDerWaalsContact O-CG 3.28Å; N537-N541 PolarHBondContact O-N 2.86Å; N537-N541 PolarHBondContact O-ND2 3.47Å; K538-N541 PolarHBondContact O-N 3.14Å; V539-N541 VanDerWaalsContact C-N 3.3Å; V539-N541 PolarHBondContact O-N 3.4Å; N541-K545 WeakPolarHBondContact O-CG 3.48Å; N541-K545 PolarHBondContact O-N 3.34Å; N541-K545 VanDerWaalsContact O-N 3.12Å
542S92.6Very high92.4Very high64 Ų6499.9 Ų99.945%0.44851%0.512SS..Hα-helixtrans-72.4-36.9173.762.20000112.9K538 V539 K545 L546K538-S542 PolarHBondContact O-N 2.86Å; K538-S542 PolarHBondContact O-OG 3.39Å; V539-S542 WeakPolarHBondContact CA-OG 3.47Å; V539-S542 CarbonylContact O-C 3.58Å; V539-S542 WeakPolarHBondContact O-CA 3.26Å; V539-S542 PolarHBondContact O-N 3.44Å; V539-S542 PolarHBondContact O-OG 2.78Å; S542-K545 PolarHBondContact O-N 2.98Å; S542-L546 WeakPolarHBondContact O-CB 3.49Å; S542-L546 PolarHBondContact O-N 3Å
543T92.6Very high92.3Very high66 Ų6698.6 Ų98.641%0.40551%0.509SS..Hα-helixtrans-64-43172.8-54.60000110.9V539 Q540 K545 L546 Q547V539-T543 PolarHBondContact O-N 2.79Å; V539-T543 PolarHBondContact O-OG1 3.33Å; V539-T543 VanDerWaalsContact O-OG1 3.07Å; Q540-T543 PolarHBondContact O-N 3.19Å; T543-K545 PolarHBondContact O-N 2.9Å; T543-L546 PolarHBondContact O-N 3.14Å; T543-Q547 WeakPolarHBondContact O-CB 3.45Å; T543-Q547 PolarHBondContact O-N 2.81Å
544G93.3Very high92Very high45 Ų4596 Ų9646%0.46450%0.503SS..Hα-helixtrans-62-40.2174.200000113Q540 A548Q540-G544 PolarHBondContact O-N 2.71Å; G544-A548 WeakPolarHBondContact O-CB 3.41Å; G544-A548 PolarHBondContact O-N 3.47Å
545K93.4Very high91.9Very high152 Ų15292.6 Ų92.666%0.66149%0.492SS*.Hα-helixtrans-65-45.4171.7-74173.7-179.6-176.40112N541 S542 T543 Q547 A548 E549N541-K545 WeakPolarHBondContact O-CG 3.48Å; N541-K545 PolarHBondContact O-N 3.34Å; N541-K545 VanDerWaalsContact O-N 3.12Å; S542-K545 PolarHBondContact O-N 2.98Å; T543-K545 PolarHBondContact O-N 2.9Å; K545-Q547 VanDerWaalsContact C-N 3.33Å; K545-Q547 PolarHBondContact O-N 3.26Å; K545-A548 WeakPolarHBondContact O-CB 3.34Å; K545-A548 PolarHBondContact O-N 3.32Å; K545-A548 VanDerWaalsContact O-N 3.14Å; K545-E549 PolarHBondContact O-N 3.12Å
546L90.9Very high91.9Very high118 Ų11891.7 Ų91.762%0.61849%0.492SS*.Hα-helixtrans-61.6-41.7178-179.860.8000111.3S542 T543 A548 E549 Q550S542-L546 WeakPolarHBondContact O-CB 3.49Å; S542-L546 PolarHBondContact O-N 3Å; T543-L546 PolarHBondContact O-N 3.14Å; L546-A548 VanDerWaalsContact C-N 3.35Å; L546-E549 PolarHBondContact O-N 3.46Å; L546-Q550 VanDerWaalsContact O-CB 3.31Å; L546-Q550 WeakPolarHBondContact O-CB 3.3Å; L546-Q550 PolarHBondContact O-N 2.77Å
547Q91.9Very high91.6Very high104 Ų10489.1 Ų89.149%0.48649%0.485SS..Hα-helixtrans-65-37.7174.1-170.164.155.900111.8T543 K545 Q550 N551T543-Q547 WeakPolarHBondContact O-CB 3.45Å; T543-Q547 PolarHBondContact O-N 2.81Å; K545-Q547 VanDerWaalsContact C-N 3.33Å; K545-Q547 PolarHBondContact O-N 3.26Å; Q547-Q550 PolarHBondContact O-N 2.93Å; Q547-N551 PolarHBondContact NE2-OD1 2.82Å; Q547-N551 WeakPolarHBondContact O-CB 3.38Å; Q547-N551 PolarHBondContact O-N 3.28Å; Q547-N551 PolarHBondContact O-OD1 2.81Å
548A91Very high91.3Very high44 Ų4491.3 Ų91.336%0.36449%0.492SS..Hα-helixtrans-65.1-41.4174.200000112.2G544 K545 L546 N551 K552G544-A548 WeakPolarHBondContact O-CB 3.41Å; G544-A548 PolarHBondContact O-N 3.47Å; K545-A548 WeakPolarHBondContact O-CB 3.34Å; K545-A548 PolarHBondContact O-N 3.32Å; K545-A548 VanDerWaalsContact O-N 3.14Å; L546-A548 VanDerWaalsContact C-N 3.35Å; A548-N551 PolarHBondContact O-N 3.39Å; A548-K552 WeakPolarHBondContact O-CG 3.27Å; A548-K552 PolarHBondContact O-N 3.08Å
549E88.3Confident91.1Very high93 Ų9392 Ų9244%0.43550%0.496SS..Hα-helixtrans-67.9-39.7172.2-61.3-45.1131.900112.2K545 L546 N551 K552 V553K545-E549 PolarHBondContact O-N 3.12Å; L546-E549 PolarHBondContact O-N 3.46Å; E549-N551 VanDerWaalsContact C-N 3.32Å; E549-N551 PolarHBondContact O-N 3.02Å; E549-K552 VanDerWaalsContact CD-NZ 3.3Å; E549-K552 WeakPolarHBondContact O-CB 3.47Å; E549-K552 PolarHBondContact O-N 2.86Å; E549-K552 IonicContact OE1-NZ 3.18Å; E549-K552 PolarHBondContact OE1-NZ 3.02Å; E549-K552 WeakPolarHBondContact OE2-CD 3.26Å; E549-K552 IonicContact OE2-NZ 3.33Å; E549-K552 PolarHBondContact OE2-NZ 3.48Å; E549-V553 WeakPolarHBondContact O-CB 3.35Å; E549-V553 WeakPolarHBondContact O-CG2 3.15Å; E549-V553 PolarHBondContact O-N 3.44Å
550Q87.8Confident90.9Very high101 Ų10193.2 Ų93.247%0.47250%0.498SS..Hα-helixtrans-59.5-42.4173.9-172.965.63300111.3L546 Q547 V553 T554L546-Q550 VanDerWaalsContact O-CB 3.31Å; L546-Q550 WeakPolarHBondContact O-CB 3.3Å; L546-Q550 PolarHBondContact O-N 2.77Å; Q547-Q550 PolarHBondContact O-N 2.93Å; Q550-V553 PolarHBondContact O-N 2.94Å; Q550-T554 WeakPolarHBondContact O-CB 3.37Å; Q550-T554 PolarHBondContact O-N 2.91Å; Q550-T554 PolarHBondContact O-OG1 2.79Å
551N90.6Very high90.7Very high91 Ų9191.5 Ų91.549%0.48749%0.492SS..Hα-helixtrans-66.9-39.5176.2-67.9-1.8000111.5Q547 A548 E549 T554 S555Q547-N551 PolarHBondContact NE2-OD1 2.82Å; Q547-N551 WeakPolarHBondContact O-CB 3.38Å; Q547-N551 PolarHBondContact O-N 3.28Å; Q547-N551 PolarHBondContact O-OD1 2.81Å; A548-N551 PolarHBondContact O-N 3.39Å; E549-N551 VanDerWaalsContact C-N 3.32Å; E549-N551 PolarHBondContact O-N 3.02Å; N551-T554 PolarHBondContact O-N 3.15Å; N551-S555 PolarHBondContact O-N 2.77Å
552K93.9Very high90.3Very high115 Ų11590 Ų9050%0.548%0.482SS..Hα-helixtrans-63.1-47.8172.5-74.6163.9173.9179.40111.8A548 E549 T554 S555 V556A548-K552 WeakPolarHBondContact O-CG 3.27Å; A548-K552 PolarHBondContact O-N 3.08Å; E549-K552 VanDerWaalsContact CD-NZ 3.3Å; E549-K552 WeakPolarHBondContact O-CB 3.47Å; E549-K552 PolarHBondContact O-N 2.86Å; E549-K552 IonicContact OE1-NZ 3.18Å; E549-K552 PolarHBondContact OE1-NZ 3.02Å; E549-K552 WeakPolarHBondContact OE2-CD 3.26Å; E549-K552 IonicContact OE2-NZ 3.33Å; E549-K552 PolarHBondContact OE2-NZ 3.48Å; K552-T554 VanDerWaalsContact C-N 3.31Å; K552-T554 PolarHBondContact O-N 3.14Å; K552-S555 CarbonylContact O-C 3.57Å; K552-S555 PolarHBondContact O-N 2.92Å; K552-V556 WeakPolarHBondContact O-CG2 3.37Å; K552-V556 PolarHBondContact O-N 3.07Å
553V91.9Very high90Very high78 Ų7893.5 Ų93.547%0.47349%0.491SS..Hα-helixtrans-58.6-45.1176.6168.60000109.9E549 Q550 S555 V556 T557E549-V553 WeakPolarHBondContact O-CB 3.35Å; E549-V553 WeakPolarHBondContact O-CG2 3.15Å; E549-V553 PolarHBondContact O-N 3.44Å; Q550-V553 PolarHBondContact O-N 2.94Å; V553-S555 PolarHBondContact O-N 2.96Å; V553-V556 CarbonylContact O-C 3.54Å; V553-V556 PolarHBondContact O-N 2.98Å; V553-V556 VanDerWaalsContact O-N 3.14Å; V553-T557 PolarHBondContact O-N 2.91Å; V553-T557 PolarHBondContact O-OG1 3.39Å; V553-T557 VanDerWaalsContact O-OG1 3.1Å
554T88.8Confident89.5Confident69 Ų6993.4 Ų93.442%0.42349%0.493SS..Hα-helixtrans-57.5-47.6175.1-55.50000111.2Q550 N551 K552 V556 T557 E558Q550-T554 WeakPolarHBondContact O-CB 3.37Å; Q550-T554 PolarHBondContact O-N 2.91Å; Q550-T554 PolarHBondContact O-OG1 2.79Å; N551-T554 PolarHBondContact O-N 3.15Å; K552-T554 VanDerWaalsContact C-N 3.31Å; K552-T554 PolarHBondContact O-N 3.14Å; T554-V556 VanDerWaalsContact C-N 3.35Å; T554-V556 PolarHBondContact O-N 3.33Å; T554-T557 WeakPolarHBondContact CA-OG1 3.45Å; T554-T557 PolarHBondContact O-N 2.95Å; T554-T557 PolarHBondContact O-OG1 3.37Å; T554-E558 WeakPolarHBondContact O-CB 3.31Å; T554-E558 PolarHBondContact O-N 3.25Å
555S91.1Very high89.2Confident41 Ų4195.6 Ų95.629%0.28749%0.49SS..Hα-helixtrans-65-33.7175.9-173.30000113.4N551 K552 V553 K559N551-S555 PolarHBondContact O-N 2.77Å; K552-S555 CarbonylContact O-C 3.57Å; K552-S555 PolarHBondContact O-N 2.92Å; V553-S555 PolarHBondContact O-N 2.96Å; S555-K559 WeakPolarHBondContact O-CB 3.45Å; S555-K559 WeakPolarHBondContact O-CD 3.22Å; S555-K559 VanDerWaalsContact O-CG 3.22Å; S555-K559 WeakPolarHBondContact O-CG 3.37Å; S555-K559 PolarHBondContact O-N 2.98Å
556V90.9Very high89Confident93 Ų9395.4 Ų95.456%0.56449%0.489SS*.Hα-helixtrans-69.8-42.8174.1169.30000110.7K552 V553 T554 K559 L560K552-V556 WeakPolarHBondContact O-CG2 3.37Å; K552-V556 PolarHBondContact O-N 3.07Å; V553-V556 CarbonylContact O-C 3.54Å; V553-V556 PolarHBondContact O-N 2.98Å; V553-V556 VanDerWaalsContact O-N 3.14Å; T554-V556 VanDerWaalsContact C-N 3.35Å; T554-V556 PolarHBondContact O-N 3.33Å; V556-K559 PolarHBondContact O-N 3.46Å; V556-L560 VanDerWaalsContact O-CB 3.27Å; V556-L560 WeakPolarHBondContact O-CB 3.32Å; V556-L560 PolarHBondContact O-N 2.9Å
557T85.8Confident88.8Confident64 Ų6492.4 Ų92.439%0.39348%0.481SS..Hα-helixtrans-66.1-37.4174.349.40000112.1V553 T554 L560 I561V553-T557 PolarHBondContact O-N 2.91Å; V553-T557 PolarHBondContact O-OG1 3.39Å; V553-T557 VanDerWaalsContact O-OG1 3.1Å; T554-T557 WeakPolarHBondContact CA-OG1 3.45Å; T554-T557 PolarHBondContact O-N 2.95Å; T554-T557 PolarHBondContact O-OG1 3.37Å; T557-L560 PolarHBondContact O-N 2.99Å; T557-I561 VanDerWaalsContact O-CB 3.3Å; T557-I561 WeakPolarHBondContact O-CB 3.46Å; T557-I561 WeakPolarHBondContact O-CD1 3.42Å; T557-I561 WeakPolarHBondContact O-CG1 3.37Å; T557-I561 PolarHBondContact O-N 3.39Å
558E88.2Confident88.5Confident130 Ų13092.8 Ų92.861%0.60749%0.486SS*.Hα-helixtrans-64.9-44.9175.1-177.3176.5-13900111.5T554 I561 E562T554-E558 WeakPolarHBondContact O-CB 3.31Å; T554-E558 PolarHBondContact O-N 3.25Å; E558-I561 PolarHBondContact O-N 3.24Å; E558-E562 PolarHBondContact O-N 3.49Å
559K90.7Very high88.3Confident137 Ų13797.2 Ų97.260%0.59649%0.493SS*.Hα-helixtrans-61.3-45173-75.5167.2-177168.70112S555 V556 I561 E562 E563S555-K559 WeakPolarHBondContact O-CB 3.45Å; S555-K559 WeakPolarHBondContact O-CD 3.22Å; S555-K559 VanDerWaalsContact O-CG 3.22Å; S555-K559 WeakPolarHBondContact O-CG 3.37Å; S555-K559 PolarHBondContact O-N 2.98Å; V556-K559 PolarHBondContact O-N 3.46Å; K559-I561 VanDerWaalsContact C-N 3.29Å; K559-I561 PolarHBondContact O-N 2.89Å; K559-E562 PolarHBondContact O-N 3.43Å; K559-E563 VanDerWaalsContact O-CB 3.28Å; K559-E563 WeakPolarHBondContact O-CB 3.34Å; K559-E563 PolarHBondContact O-N 2.83Å
560L89.3Confident88.1Confident112 Ų11295.4 Ų95.459%0.58649%0.491SS*.Hα-helixtrans-63.1-36.2176.4-177.763.4000111.7V556 T557 S564V556-L560 VanDerWaalsContact O-CB 3.27Å; V556-L560 WeakPolarHBondContact O-CB 3.32Å; V556-L560 PolarHBondContact O-N 2.9Å; T557-L560 PolarHBondContact O-N 2.99Å; L560-S564 WeakPolarHBondContact O-CB 3.32Å; L560-S564 PolarHBondContact O-N 2.92Å
561I87.3Confident88.1Confident95 Ų9596.7 Ų96.749%0.48750%0.495SS..Hα-helixtrans-67.9-43.5174.1-75163.5000111T557 E558 K559 S564 K565T557-I561 VanDerWaalsContact O-CB 3.3Å; T557-I561 WeakPolarHBondContact O-CB 3.46Å; T557-I561 WeakPolarHBondContact O-CD1 3.42Å; T557-I561 WeakPolarHBondContact O-CG1 3.37Å; T557-I561 PolarHBondContact O-N 3.39Å; E558-I561 PolarHBondContact O-N 3.24Å; K559-I561 VanDerWaalsContact C-N 3.29Å; K559-I561 PolarHBondContact O-N 2.89Å; I561-S564 PolarHBondContact O-N 3.42Å; I561-K565 HydrophobicContact CG2-CD 4.22Å; I561-K565 WeakPolarHBondContact O-CB 3.45Å; I561-K565 VanDerWaalsContact O-CG 3.27Å; I561-K565 WeakPolarHBondContact O-CG 3.42Å; I561-K565 PolarHBondContact O-N 3.07Å
562E86.4Confident87.9Confident78 Ų7895 Ų9536%0.36449%0.494SS..Hα-helixtrans-74.4-32.5178.5-160.260.5-137.800113E558 K559 K565 K566 R569E558-E562 PolarHBondContact O-N 3.49Å; K559-E562 PolarHBondContact O-N 3.43Å; E562-K565 PolarHBondContact O-N 3.38Å; E562-K565 WeakPolarHBondContact OE2-CD 3.33Å; E562-K565 WeakPolarHBondContact OE2-CE 3.49Å; E562-K565 IonicContact OE2-NZ 3.77Å; E562-K565 PolarHBondContact OE2-NZ 3.04Å; E562-K566 VanDerWaalsContact O-CB 3.26Å; E562-K566 WeakPolarHBondContact O-CB 3.38Å; E562-K566 PolarHBondContact O-N 2.99Å; E562-R569 IonicContact OE1-CZ 2.79Å; E562-R569 IonicContact OE1-NH1 3.79Å; E562-R569 PolarHBondContact OE1-NH1 3.28Å; E562-R569 IonicContact OE1-NH2 2.65Å; E562-R569 PolarHBondContact OE1-NH2 2.94Å
563E85.4Confident87.5Confident137 Ų13794.2 Ų94.264%0.6449%0.492SS*.Hα-helixtrans-67.3-40.9169.8-174.1158.6-143.600111.4K559 K566 A567K559-E563 VanDerWaalsContact O-CB 3.28Å; K559-E563 WeakPolarHBondContact O-CB 3.34Å; K559-E563 PolarHBondContact O-N 2.83Å; E563-K566 PolarHBondContact O-N 2.62Å; E563-A567 WeakPolarHBondContact O-CB 3.4Å; E563-A567 PolarHBondContact O-N 3.49Å
564S81.8Confident87.2Confident64 Ų6496 Ų9645%0.44850%0.498SS..Hα-helixtrans-62-46.3171.7179.60000112.1L560 I561 K566 A567 L568L560-S564 WeakPolarHBondContact O-CB 3.32Å; L560-S564 PolarHBondContact O-N 2.92Å; I561-S564 PolarHBondContact O-N 3.42Å; S564-K566 VanDerWaalsContact C-N 3.32Å; S564-K566 PolarHBondContact O-N 2.82Å; S564-A567 PolarHBondContact O-N 3.48Å; S564-L568 WeakPolarHBondContact O-CB 3.29Å; S564-L568 PolarHBondContact O-N 3.31Å
565K88.1Confident86.9Confident92 Ų9297.6 Ų97.640%0.450%0.501SS..Hα-helixtrans-58.3-42.4171.8-73.6162.4-178.61630111.5I561 E562 L568 R569I561-K565 HydrophobicContact CG2-CD 4.22Å; I561-K565 WeakPolarHBondContact O-CB 3.45Å; I561-K565 VanDerWaalsContact O-CG 3.27Å; I561-K565 WeakPolarHBondContact O-CG 3.42Å; I561-K565 PolarHBondContact O-N 3.07Å; E562-K565 PolarHBondContact O-N 3.38Å; E562-K565 WeakPolarHBondContact OE2-CD 3.33Å; E562-K565 WeakPolarHBondContact OE2-CE 3.49Å; E562-K565 IonicContact OE2-NZ 3.77Å; E562-K565 PolarHBondContact OE2-NZ 3.04Å; K565-L568 PolarHBondContact O-N 3.06Å; K565-R569 WeakPolarHBondContact O-CG 3.45Å; K565-R569 PolarHBondContact O-N 2.91Å
566K88.3Confident86.8Confident148 Ų148101 Ų10164%0.64351%0.512SS*.Hα-helixtrans-65.6-41.6178.6-174-178.4177.8-174.10111.7E562 E563 S564 R569 S570E562-K566 VanDerWaalsContact O-CB 3.26Å; E562-K566 WeakPolarHBondContact O-CB 3.38Å; E562-K566 PolarHBondContact O-N 2.99Å; E563-K566 PolarHBondContact O-N 2.62Å; S564-K566 VanDerWaalsContact C-N 3.32Å; S564-K566 PolarHBondContact O-N 2.82Å; K566-R569 PolarHBondContact O-N 3.27Å; K566-S570 PolarHBondContact O-N 3.48Å; K566-S570 PolarHBondContact O-OG 2.91Å
567A86.6Confident86.6Confident55 Ų55102.3 Ų102.346%0.45551%0.51SS..Hα-helixtrans-67.1-34.8174.100000112.5E563 S564 S570 K571E563-A567 WeakPolarHBondContact O-CB 3.4Å; E563-A567 PolarHBondContact O-N 3.49Å; S564-A567 PolarHBondContact O-N 3.48Å; A567-S570 PolarHBondContact O-OG 3.03Å; A567-K571 WeakPolarHBondContact O-CB 3.45Å; A567-K571 PolarHBondContact O-N 2.9Å
568L86.4Confident86.5Confident111 Ų111104.9 Ų104.958%0.58152%0.52SS*.Hα-helixtrans-66.1-42.5171.6-85.2158.6000112S564 K565 K571 A572S564-L568 WeakPolarHBondContact O-CB 3.29Å; S564-L568 PolarHBondContact O-N 3.31Å; K565-L568 PolarHBondContact O-N 3.06Å; L568-K571 PolarHBondContact O-N 2.79Å; L568-A572 WeakPolarHBondContact O-CB 3.46Å; L568-A572 PolarHBondContact O-N 3.24Å
569R87.9Confident86.5Confident138 Ų138101.3 Ų101.352%0.52151%0.508SS..Hα-helixtrans-61.1-51.1173.6-69.2174-157139.112.7111.1E562 K565 K566 K571 A572 E573E562-R569 IonicContact OE1-CZ 2.79Å; E562-R569 IonicContact OE1-NH1 3.79Å; E562-R569 PolarHBondContact OE1-NH1 3.28Å; E562-R569 IonicContact OE1-NH2 2.65Å; E562-R569 PolarHBondContact OE1-NH2 2.94Å; K565-R569 WeakPolarHBondContact O-CG 3.45Å; K565-R569 PolarHBondContact O-N 2.91Å; K566-R569 PolarHBondContact O-N 3.27Å; R569-K571 VanDerWaalsContact C-N 3.34Å; R569-K571 PolarHBondContact O-N 3.3Å; R569-A572 WeakPolarHBondContact O-CB 3.22Å; R569-A572 PolarHBondContact O-N 2.85Å; R569-A572 VanDerWaalsContact O-N 3.13Å; R569-E573 PolarHBondContact O-N 3.46Å
570S83.9Confident86.2Confident55 Ų55100.1 Ų100.139%0.38550%0.503SS..Hα-helixtrans-67.9-31.2-179.964.40000113.3K566 A567 L574K566-S570 PolarHBondContact O-N 3.48Å; K566-S570 PolarHBondContact O-OG 2.91Å; A567-S570 PolarHBondContact O-OG 3.03Å; S570-L574 WeakPolarHBondContact O-CG 3.43Å; S570-L574 PolarHBondContact O-N 3.14Å
571K86.1Confident86Confident127 Ų12797.3 Ų97.355%0.55250%0.496SS*.Hα-helixtrans-62.3-47.2168.7-174.5-168.6169.6-163.70111A567 L568 R569 E573 L574 E575A567-K571 WeakPolarHBondContact O-CB 3.45Å; A567-K571 PolarHBondContact O-N 2.9Å; L568-K571 PolarHBondContact O-N 2.79Å; R569-K571 VanDerWaalsContact C-N 3.34Å; R569-K571 PolarHBondContact O-N 3.3Å; K571-E573 VanDerWaalsContact C-N 3.35Å; K571-E573 PolarHBondContact O-N 3.33Å; K571-L574 PolarHBondContact O-N 3.48Å; K571-L574 VanDerWaalsContact O-N 3.14Å; K571-E575 WeakPolarHBondContact O-CB 3.3Å; K571-E575 PolarHBondContact O-N 3.28Å
572A86.3Confident85.9Confident57 Ų5795.4 Ų95.447%0.47149%0.489SS..Hα-helixtrans-61.7-41.5178.600000112L568 R569 L574 E575 E576L568-A572 WeakPolarHBondContact O-CB 3.46Å; L568-A572 PolarHBondContact O-N 3.24Å; R569-A572 WeakPolarHBondContact O-CB 3.22Å; R569-A572 PolarHBondContact O-N 2.85Å; R569-A572 VanDerWaalsContact O-N 3.13Å; A572-L574 VanDerWaalsContact C-N 3.31Å; A572-L574 PolarHBondContact O-N 2.84Å; A572-E575 PolarHBondContact O-N 2.86Å; A572-E576 WeakPolarHBondContact O-CB 3.47Å; A572-E576 PolarHBondContact O-N 3.43Å
573E87Confident86.1Confident97 Ų9797.1 Ų97.145%0.45350%0.495SS..Hα-helixtrans-61.2-36.6173-70.9175.5-139.300113.1R569 K571 K577R569-E573 PolarHBondContact O-N 3.46Å; K571-E573 VanDerWaalsContact C-N 3.35Å; K571-E573 PolarHBondContact O-N 3.33Å; E573-K577 WeakPolarHBondContact O-CB 3.46Å; E573-K577 VanDerWaalsContact O-CD 3.27Å; E573-K577 WeakPolarHBondContact O-CD 3.49Å; E573-K577 WeakPolarHBondContact O-CG 3.32Å; E573-K577 PolarHBondContact O-N 3.47Å; E573-K577 IonicContact OE2-NZ 2.63Å; E573-K577 PolarHBondContact OE2-NZ 2.78Å
574L84.4Confident86.2Confident115 Ų11596.5 Ų96.560%0.60249%0.492SS*.Hα-helixtrans-73.1-35.7175.6-74170.5000111.9S570 K571 A572 K577 M578S570-L574 WeakPolarHBondContact O-CG 3.43Å; S570-L574 PolarHBondContact O-N 3.14Å; K571-L574 PolarHBondContact O-N 3.48Å; K571-L574 VanDerWaalsContact O-N 3.14Å; A572-L574 VanDerWaalsContact C-N 3.31Å; A572-L574 PolarHBondContact O-N 2.84Å; L574-K577 PolarHBondContact O-N 3.14Å; L574-M578 VanDerWaalsContact O-CB 3.3Å; L574-M578 WeakPolarHBondContact O-CB 3.14Å; L574-M578 PolarHBondContact O-N 2.92Å
575E83.5Confident86.4Confident104 Ų104100.1 Ų100.149%0.48650%0.496SS..Hα-helixtrans-69.2-37.5176.4-166.4162.717300111.3K571 A572 M578 C579K571-E575 WeakPolarHBondContact O-CB 3.3Å; K571-E575 PolarHBondContact O-N 3.28Å; A572-E575 PolarHBondContact O-N 2.86Å; E575-M578 HydrophobicContact CG-CE 4.41Å; E575-M578 PolarHBondContact O-N 3.37Å; E575-C579 WeakPolarHBondContact O-CB 3.34Å; E575-C579 PolarHBondContact O-N 3.18Å
576E87.5Confident86.4Confident113 Ų11399 Ų9953%0.52849%0.494SS..Hα-helixtrans-62.9-50.7168.6179.5175.2-152.800111.8A572 M578 C579 F580A572-E576 WeakPolarHBondContact O-CB 3.47Å; A572-E576 PolarHBondContact O-N 3.43Å; E576-M578 VanDerWaalsContact C-N 3.27Å; E576-M578 PolarHBondContact O-N 2.82Å; E576-C579 WeakPolarHBondContact O-CA 3.48Å; E576-C579 VanDerWaalsContact O-CB 3.32Å; E576-C579 WeakPolarHBondContact O-CB 3.43Å; E576-C579 PolarHBondContact O-N 3.26Å; E576-F580 HydrophobicContact CG-CD2 3.89Å; E576-F580 HydrophobicContact CG-CE2 3.8Å; E576-F580 WeakPolarHBondContact O-CD2 3.39Å; E576-F580 PolarHBondContact O-N 2.96Å
577K87.8Confident86.5Confident119 Ų11996.4 Ų96.452%0.51749%0.487SS..Hα-helixtrans-59.3-37.9176.9-73.5161.2-169.9154.90111.9E573 L574 F580 A581E573-K577 WeakPolarHBondContact O-CB 3.46Å; E573-K577 VanDerWaalsContact O-CD 3.27Å; E573-K577 WeakPolarHBondContact O-CD 3.49Å; E573-K577 WeakPolarHBondContact O-CG 3.32Å; E573-K577 PolarHBondContact O-N 3.47Å; E573-K577 IonicContact OE2-NZ 2.63Å; E573-K577 PolarHBondContact OE2-NZ 2.78Å; L574-K577 PolarHBondContact O-N 3.14Å; K577-F580 PolarHBondContact O-N 3.05Å; K577-A581 WeakPolarHBondContact O-CB 3.45Å; K577-A581 PolarHBondContact O-N 3.07Å
578M84.4Confident86.6Confident119 Ų11999.2 Ų99.259%0.58649%0.494SS*.Hα-helixtrans-65.4-42172.7-175.7178.567.700111.7L574 E575 E576 A581 T582L574-M578 VanDerWaalsContact O-CB 3.3Å; L574-M578 WeakPolarHBondContact O-CB 3.14Å; L574-M578 PolarHBondContact O-N 2.92Å; E575-M578 HydrophobicContact CG-CE 4.41Å; E575-M578 PolarHBondContact O-N 3.37Å; E576-M578 VanDerWaalsContact C-N 3.27Å; E576-M578 PolarHBondContact O-N 2.82Å; M578-A581 PolarHBondContact O-N 2.88Å; M578-T582 WeakPolarHBondContact O-CG2 3.44Å; M578-T582 PolarHBondContact O-N 2.96Å; M578-T582 PolarHBondContact O-OG1 3.24Å
579C86.4Confident86.7Confident54 Ų5499.8 Ų99.837%0.36549%0.492SS..Hα-helixtrans-59.9-46.1175-176.20000111.5E575 E576 T582 K583E575-C579 WeakPolarHBondContact O-CB 3.34Å; E575-C579 PolarHBondContact O-N 3.18Å; E576-C579 WeakPolarHBondContact O-CA 3.48Å; E576-C579 VanDerWaalsContact O-CB 3.32Å; E576-C579 WeakPolarHBondContact O-CB 3.43Å; E576-C579 PolarHBondContact O-N 3.26Å; C579-T582 WeakPolarHBondContact CA-OG1 3.45Å; C579-T582 PolarHBondContact O-N 3.24Å; C579-T582 PolarHBondContact O-OG1 3.48Å; C579-K583 WeakPolarHBondContact O-CG 3.43Å; C579-K583 PolarHBondContact O-N 2.8Å
580F86Confident86.7Confident113 Ų11395.9 Ų95.950%0.49649%0.489SS..Hα-helixtrans-57.9-50.7171.8-84.5-78000112E576 K577 T582 K583 E584E576-F580 HydrophobicContact CG-CD2 3.89Å; E576-F580 HydrophobicContact CG-CE2 3.8Å; E576-F580 WeakPolarHBondContact O-CD2 3.39Å; E576-F580 PolarHBondContact O-N 2.96Å; K577-F580 PolarHBondContact O-N 3.05Å; F580-T582 VanDerWaalsContact C-N 3.28Å; F580-T582 PolarHBondContact O-N 3.31Å; F580-K583 WeakPolarHBondContact O-CB 3.18Å; F580-K583 PolarHBondContact O-N 2.86Å; F580-E584 PolarHBondContact O-N 2.65Å
581A85.1Confident87.1Confident52 Ų5299.2 Ų99.243%0.4350%0.497SS..Hα-helixtrans-60.6-33.5178.200000113.2K577 M578 R585K577-A581 WeakPolarHBondContact O-CB 3.45Å; K577-A581 PolarHBondContact O-N 3.07Å; M578-A581 PolarHBondContact O-N 2.88Å; A581-R585 VanDerWaalsContact O-CB 3.25Å; A581-R585 WeakPolarHBondContact O-CB 3.29Å; A581-R585 PolarHBondContact O-N 2.85Å
582T84.7Confident87.1Confident55 Ų5597.9 Ų97.934%0.33750%0.495SS..Hα-helixtrans-70.6-36.4173.653.80000113.1M578 C579 F580 R585 D586M578-T582 WeakPolarHBondContact O-CG2 3.44Å; M578-T582 PolarHBondContact O-N 2.96Å; M578-T582 PolarHBondContact O-OG1 3.24Å; C579-T582 WeakPolarHBondContact CA-OG1 3.45Å; C579-T582 PolarHBondContact O-N 3.24Å; C579-T582 PolarHBondContact O-OG1 3.48Å; F580-T582 VanDerWaalsContact C-N 3.28Å; F580-T582 PolarHBondContact O-N 3.31Å; T582-R585 PolarHBondContact O-N 2.83Å; T582-D586 WeakPolarHBondContact O-CB 3.4Å; T582-D586 PolarHBondContact O-N 2.86Å
583K89.4Confident87.2Confident114 Ų114102.1 Ų102.150%0.49650%0.499SS..Hα-helixtrans-64.8-49172.8-69.4167.6-178.3169.20110.7C579 F580 R585 D586 D587C579-K583 WeakPolarHBondContact O-CG 3.43Å; C579-K583 PolarHBondContact O-N 2.8Å; F580-K583 WeakPolarHBondContact O-CB 3.18Å; F580-K583 PolarHBondContact O-N 2.86Å; K583-R585 VanDerWaalsContact C-N 3.32Å; K583-R585 PolarHBondContact O-N 2.82Å; K583-D586 PolarHBondContact O-N 3.17Å; K583-D587 PolarHBondContact O-N 3.26Å
584E87.9Confident87.2Confident125 Ų125100.5 Ų100.558%0.58450%0.496SS*.Hα-helixtrans-59.1-42.3176.2-69.4-175.614600112F580 D586 D587 L588F580-E584 PolarHBondContact O-N 2.65Å; E584-D586 VanDerWaalsContact C-N 3.33Å; E584-D586 PolarHBondContact O-N 3.45Å; E584-D587 PolarHBondContact O-N 3.39Å; E584-L588 VanDerWaalsContact O-CB 3.29Å; E584-L588 WeakPolarHBondContact O-CB 3.5Å; E584-L588 WeakPolarHBondContact O-CG 3.45Å; E584-L588 PolarHBondContact O-N 3.1Å
585R87Confident87.3Confident139 Ų13999.8 Ų99.853%0.52549%0.489SS..Hα-helixtrans-57.9-44.4173.1-177.2-155.172.1-173.4-6.8111.6A581 T582 K583 L588 K589A581-R585 VanDerWaalsContact O-CB 3.25Å; A581-R585 WeakPolarHBondContact O-CB 3.29Å; A581-R585 PolarHBondContact O-N 2.85Å; T582-R585 PolarHBondContact O-N 2.83Å; K583-R585 VanDerWaalsContact C-N 3.32Å; K583-R585 PolarHBondContact O-N 2.82Å; R585-L588 PolarHBondContact O-N 3.11Å; R585-K589 VanDerWaalsContact O-CB 3.28Å; R585-K589 WeakPolarHBondContact O-CB 3.45Å; R585-K589 PolarHBondContact O-N 2.95Å
586D88.3Confident87.5Confident68 Ų6898.6 Ų98.636%0.36448%0.484SS..Hα-helixtrans-78-31.4-176.1-70-20.7000112.5T582 K583 E584 K589 A590T582-D586 WeakPolarHBondContact O-CB 3.4Å; T582-D586 PolarHBondContact O-N 2.86Å; K583-D586 PolarHBondContact O-N 3.17Å; E584-D586 VanDerWaalsContact C-N 3.33Å; E584-D586 PolarHBondContact O-N 3.45Å; D586-K589 PolarHBondContact O-N 3.45Å; D586-A590 WeakPolarHBondContact O-CB 3.45Å; D586-A590 PolarHBondContact O-N 3.04Å
587D90.6Very high87.5Confident94 Ų9498 Ų9850%0.50348%0.481SS..Hα-helixtrans-64.1-42.7166.6-75.1-22.4000111.8K583 E584 K589 A590 K591K583-D587 PolarHBondContact O-N 3.26Å; E584-D587 PolarHBondContact O-N 3.39Å; D587-K589 VanDerWaalsContact C-N 3.32Å; D587-A590 PolarHBondContact O-N 3.22Å; D587-K591 WeakPolarHBondContact O-CB 3.18Å; D587-K591 WeakPolarHBondContact O-CD 3.26Å; D587-K591 VanDerWaalsContact O-CG 3.26Å; D587-K591 WeakPolarHBondContact O-CG 3.46Å; D587-K591 PolarHBondContact O-N 3.39Å
588L87.4Confident87.5Confident114 Ų11499 Ų9960%0.59748%0.481SS*.Hα-helixtrans-64.5-37.5173.3-74.8169000111.4E584 R585 K591 L592E584-L588 VanDerWaalsContact O-CB 3.29Å; E584-L588 WeakPolarHBondContact O-CB 3.5Å; E584-L588 WeakPolarHBondContact O-CG 3.45Å; E584-L588 PolarHBondContact O-N 3.1Å; R585-L588 PolarHBondContact O-N 3.11Å; L588-K591 PolarHBondContact O-N 2.84Å; L588-L592 WeakPolarHBondContact O-CB 3.43Å; L588-L592 PolarHBondContact O-N 2.9Å
589K88.4Confident87.5Confident124 Ų12498.2 Ų98.254%0.53948%0.48SS..Hα-helixtrans-70.1-34.7175.7-168.4175.6-177.1178.90112.2R585 D586 D587 R593R585-K589 VanDerWaalsContact O-CB 3.28Å; R585-K589 WeakPolarHBondContact O-CB 3.45Å; R585-K589 PolarHBondContact O-N 2.95Å; D586-K589 PolarHBondContact O-N 3.45Å; D587-K589 VanDerWaalsContact C-N 3.32Å; K589-R593 WeakPolarHBondContact O-CG 3.4Å; K589-R593 PolarHBondContact O-N 3.47Å
590A89.3Confident87.5Confident55 Ų55101.1 Ų101.146%0.45549%0.486SS..Hα-helixtrans-67.5-44.5171.700000111.4D586 D587 L592 R593 T594D586-A590 WeakPolarHBondContact O-CB 3.45Å; D586-A590 PolarHBondContact O-N 3.04Å; D587-A590 PolarHBondContact O-N 3.22Å; A590-L592 PolarHBondContact O-N 2.64Å; A590-R593 WeakPolarHBondContact O-CB 3.39Å; A590-R593 PolarHBondContact O-N 2.88Å; A590-T594 PolarHBondContact O-N 2.94Å
591K90.6Very high87.6Confident125 Ų125101.3 Ų101.354%0.54349%0.492SS..Hα-helixtrans-58.4-46.3172.4-71160.9-173165.20111.2D587 L588 R593 T594 E595D587-K591 WeakPolarHBondContact O-CB 3.18Å; D587-K591 WeakPolarHBondContact O-CD 3.26Å; D587-K591 VanDerWaalsContact O-CG 3.26Å; D587-K591 WeakPolarHBondContact O-CG 3.46Å; D587-K591 PolarHBondContact O-N 3.39Å; L588-K591 PolarHBondContact O-N 2.84Å; K591-R593 PolarHBondContact O-N 2.94Å; K591-T594 PolarHBondContact O-N 2.9Å; K591-T594 VanDerWaalsContact O-N 3.17Å; K591-T594 PolarHBondContact O-OG1 3.36Å; K591-E595 PolarHBondContact O-N 2.97Å
592L86.9Confident87.7Confident99 Ų99103.7 Ų103.752%0.51850%0.497SS..Hα-helixtrans-58-45.6175.3-179.462.5000111.8L588 A590 T594 E595 E596L588-L592 WeakPolarHBondContact O-CB 3.43Å; L588-L592 PolarHBondContact O-N 2.9Å; A590-L592 PolarHBondContact O-N 2.64Å; L592-T594 VanDerWaalsContact C-N 3.33Å; L592-T594 PolarHBondContact O-N 3.21Å; L592-E595 CarbonylContact O-C 3.55Å; L592-E595 PolarHBondContact O-N 3.04Å; L592-E595 VanDerWaalsContact O-N 3.14Å; L592-E596 HydrophobicContact CD1-CG 4.48Å; L592-E596 HydrophobicContact CG-CG 4.42Å; L592-E596 WeakPolarHBondContact O-CG 3.44Å; L592-E596 PolarHBondContact O-N 3.29Å
593R88.6Confident87.6Confident147 Ų147106.5 Ų106.556%0.55551%0.507SS*.Hα-helixtrans-56.6-44.3174.6-71.8-88.9-136.2127.66.9112.3K589 A590 K591 E595 E596 E597K589-R593 WeakPolarHBondContact O-CG 3.4Å; K589-R593 PolarHBondContact O-N 3.47Å; A590-R593 WeakPolarHBondContact O-CB 3.39Å; A590-R593 PolarHBondContact O-N 2.88Å; K591-R593 PolarHBondContact O-N 2.94Å; R593-E595 VanDerWaalsContact C-N 3.31Å; R593-E595 PolarHBondContact O-N 3.42Å; R593-E596 WeakPolarHBondContact O-CB 3.3Å; R593-E596 PolarHBondContact O-N 3.47Å; R593-E597 WeakPolarHBondContact O-CB 3.38Å; R593-E597 WeakPolarHBondContact O-CG 3.34Å; R593-E597 PolarHBondContact O-N 3.49Å
594T87.8Confident87.5Confident63 Ų63104.4 Ų104.439%0.38751%0.506SS..Hα-helixtrans-67.4-30.4178.1580000113.1A590 K591 L592 R598A590-T594 PolarHBondContact O-N 2.94Å; K591-T594 PolarHBondContact O-N 2.9Å; K591-T594 VanDerWaalsContact O-N 3.17Å; K591-T594 PolarHBondContact O-OG1 3.36Å; L592-T594 VanDerWaalsContact C-N 3.33Å; L592-T594 PolarHBondContact O-N 3.21Å; T594-R598 WeakPolarHBondContact O-CG 3.5Å; T594-R598 PolarHBondContact O-N 3.17Å
595E85.6Confident87.5Confident99 Ų99104.9 Ų104.946%0.46351%0.506SS..Hα-helixtrans-79-31.5172.1-67-52.4129.300112.8K591 L592 R593 E597 R598 N599K591-E595 PolarHBondContact O-N 2.97Å; L592-E595 CarbonylContact O-C 3.55Å; L592-E595 PolarHBondContact O-N 3.04Å; L592-E595 VanDerWaalsContact O-N 3.14Å; R593-E595 VanDerWaalsContact C-N 3.31Å; R593-E595 PolarHBondContact O-N 3.42Å; E595-E597 VanDerWaalsContact C-N 3.29Å; E595-E597 PolarHBondContact O-N 3.43Å; E595-R598 PolarHBondContact O-N 3.05Å; E595-R598 WeakPolarHBondContact OE1-CD 3.43Å; E595-R598 IonicContact OE1-CZ 3.7Å; E595-R598 IonicContact OE1-NE 2.68Å; E595-R598 IonicContact OE1-NH1 2.74Å; E595-R598 PolarHBondContact OE1-NH1 3.26Å; E595-N599 WeakPolarHBondContact O-CB 3.48Å; E595-N599 PolarHBondContact O-N 2.78Å
596E87.1Confident87.3Confident79 Ų79102.4 Ų102.437%0.36951%0.506SS..Hα-helixtrans-63-36.5168.4-74.1174.9-177.200111.5L592 R593 N599 K600L592-E596 HydrophobicContact CD1-CG 4.48Å; L592-E596 HydrophobicContact CG-CG 4.42Å; L592-E596 WeakPolarHBondContact O-CG 3.44Å; L592-E596 PolarHBondContact O-N 3.29Å; R593-E596 WeakPolarHBondContact O-CB 3.3Å; R593-E596 PolarHBondContact O-N 3.47Å; E596-N599 PolarHBondContact O-N 2.92Å; E596-K600 WeakPolarHBondContact O-CD 3.22Å; E596-K600 VanDerWaalsContact O-CG 3.26Å; E596-K600 WeakPolarHBondContact O-CG 3.19Å; E596-K600 PolarHBondContact O-N 2.96Å
597E88.7Confident86.9Confident101 Ų101102.2 Ų102.247%0.47251%0.505SS..Hα-helixtrans-69.7-45.9174.8-74.8161.6-17000111.1R593 E595 N599 K600 D601R593-E597 WeakPolarHBondContact O-CB 3.38Å; R593-E597 WeakPolarHBondContact O-CG 3.34Å; R593-E597 PolarHBondContact O-N 3.49Å; E595-E597 VanDerWaalsContact C-N 3.29Å; E595-E597 PolarHBondContact O-N 3.43Å; E597-N599 VanDerWaalsContact C-N 3.28Å; E597-N599 PolarHBondContact O-N 3.14Å; E597-K600 PolarHBondContact O-N 3.03Å; E597-D601 PolarHBondContact O-N 3.39Å
598R87.9Confident86.6Confident140 Ų140103.6 Ų103.653%0.52851%0.51SS..Hα-helixtrans-58.7-38.2169.7-75-178176.5104.813.7112.8T594 E595 D601 L602T594-R598 WeakPolarHBondContact O-CG 3.5Å; T594-R598 PolarHBondContact O-N 3.17Å; E595-R598 PolarHBondContact O-N 3.05Å; E595-R598 WeakPolarHBondContact OE1-CD 3.43Å; E595-R598 IonicContact OE1-CZ 3.7Å; E595-R598 IonicContact OE1-NE 2.68Å; E595-R598 IonicContact OE1-NH1 2.74Å; E595-R598 PolarHBondContact OE1-NH1 3.26Å; R598-D601 PolarHBondContact O-N 3.47Å; R598-L602 WeakPolarHBondContact O-CB 3.43Å; R598-L602 VanDerWaalsContact O-CG 3.3Å; R598-L602 WeakPolarHBondContact O-CG 3.33Å; R598-L602 PolarHBondContact O-N 3.38Å
599N83.4Confident86.2Confident103 Ų103104.3 Ų104.355%0.55151%0.512SS*.Hα-helixtrans-68.8-37.9178.1-165.115000111.4E595 E596 E597 L602 E603E595-N599 WeakPolarHBondContact O-CB 3.48Å; E595-N599 PolarHBondContact O-N 2.78Å; E596-N599 PolarHBondContact O-N 2.92Å; E597-N599 VanDerWaalsContact C-N 3.28Å; E597-N599 PolarHBondContact O-N 3.14Å; N599-L602 PolarHBondContact O-N 2.81Å; N599-E603 VanDerWaalsContact O-CB 3.26Å; N599-E603 WeakPolarHBondContact O-CB 3.41Å; N599-E603 PolarHBondContact O-N 3.24Å
600K87.7Confident85.7Confident114 Ų114103.7 Ų103.750%0.49651%0.509SS..Hα-helixtrans-64.5-39.8171.6-72.5159.1-169.1154.10112.2E596 E597 E603 S604E596-K600 WeakPolarHBondContact O-CD 3.22Å; E596-K600 VanDerWaalsContact O-CG 3.26Å; E596-K600 WeakPolarHBondContact O-CG 3.19Å; E596-K600 PolarHBondContact O-N 2.96Å; E597-K600 PolarHBondContact O-N 3.03Å; K600-E603 PolarHBondContact O-N 3.44Å; K600-S604 WeakPolarHBondContact O-CB 3.38Å; K600-S604 PolarHBondContact O-N 2.67Å
601D87.5Confident85.1Confident117 Ų117108.3 Ų108.363%0.62652%0.519SS*.Hα-helixtrans-61.7-47.2172.9-88.2-1.8000111.2E597 R598 S604 K605E597-D601 PolarHBondContact O-N 3.39Å; R598-D601 PolarHBondContact O-N 3.47Å; D601-S604 PolarHBondContact O-N 2.76Å; D601-S604 PolarHBondContact O-OG 3.44Å; D601-K605 WeakPolarHBondContact O-CB 3.08Å; D601-K605 PolarHBondContact O-N 2.85Å
602L86.1Confident84.5Confident103 Ų103110.9 Ų110.954%0.53953%0.526SS..Hα-helixtrans-61.9-42.1174.9-72.3170.2000112.1R598 N599 K605 V606R598-L602 WeakPolarHBondContact O-CB 3.43Å; R598-L602 VanDerWaalsContact O-CG 3.3Å; R598-L602 WeakPolarHBondContact O-CG 3.33Å; R598-L602 PolarHBondContact O-N 3.38Å; N599-L602 PolarHBondContact O-N 2.81Å; L602-K605 WeakPolarHBondContact O-CB 3.27Å; L602-K605 PolarHBondContact O-N 3.45Å; L602-V606 WeakPolarHBondContact O-CB 3.34Å; L602-V606 VanDerWaalsContact O-CG2 3.3Å; L602-V606 WeakPolarHBondContact O-CG2 3.27Å; L602-V606 PolarHBondContact O-N 3.45Å
603E84.5Confident83.6Confident114 Ų114111.6 Ų111.653%0.53353%0.529SS..Hα-helixtrans-66.2-37.4176.4-179.4173.7-156.700111.7N599 K600 K605 V606 N607N599-E603 VanDerWaalsContact O-CB 3.26Å; N599-E603 WeakPolarHBondContact O-CB 3.41Å; N599-E603 PolarHBondContact O-N 3.24Å; K600-E603 PolarHBondContact O-N 3.44Å; E603-K605 VanDerWaalsContact C-N 3.32Å; E603-K605 PolarHBondContact O-N 2.87Å; E603-V606 PolarHBondContact O-N 2.93Å; E603-N607 WeakPolarHBondContact CG-ND2 3.36Å; E603-N607 VanDerWaalsContact O-CB 3.31Å; E603-N607 WeakPolarHBondContact O-CB 3.35Å; E603-N607 PolarHBondContact O-N 3.2Å; E603-N607 PolarHBondContact O-ND2 3.38Å
604S85.7Confident82.5Confident69 Ų69109.1 Ų109.148%0.48352%0.524SS..Hα-helixtrans-64.1-39.7173.584.20000111.2K600 D601 N607 M608K600-S604 WeakPolarHBondContact O-CB 3.38Å; K600-S604 PolarHBondContact O-N 2.67Å; D601-S604 PolarHBondContact O-N 2.76Å; D601-S604 PolarHBondContact O-OG 3.44Å; S604-N607 PolarHBondContact O-N 2.85Å; S604-M608 WeakPolarHBondContact O-CB 3.13Å; S604-M608 PolarHBondContact O-N 2.9Å
605K88.3Confident81.2Confident136 Ų136109.3 Ų109.359%0.59153%0.528SS*.Hα-helixtrans-69.2-41.3177.3-163.8173.3-175.1175.70111.5D601 L602 E603 M608 M609D601-K605 WeakPolarHBondContact O-CB 3.08Å; D601-K605 PolarHBondContact O-N 2.85Å; L602-K605 WeakPolarHBondContact O-CB 3.27Å; L602-K605 PolarHBondContact O-N 3.45Å; E603-K605 VanDerWaalsContact C-N 3.32Å; E603-K605 PolarHBondContact O-N 2.87Å; K605-M608 PolarHBondContact O-N 2.85Å; K605-M609 WeakPolarHBondContact O-CG 3.29Å; K605-M609 PolarHBondContact O-N 2.73Å
606V82.4Confident79.9Confident86 Ų86109.9 Ų109.952%0.52153%0.534SS..Hα-helixtrans-63.8-42.2171.5166.90000110.9L602 E603 M608 M609 K610L602-V606 WeakPolarHBondContact O-CB 3.34Å; L602-V606 VanDerWaalsContact O-CG2 3.3Å; L602-V606 WeakPolarHBondContact O-CG2 3.27Å; L602-V606 PolarHBondContact O-N 3.45Å; E603-V606 PolarHBondContact O-N 2.93Å; V606-M608 PolarHBondContact O-N 3.21Å; V606-M609 CarbonylContact O-C 3.55Å; V606-M609 PolarHBondContact O-N 2.66Å; V606-K610 VanDerWaalsContact O-CB 3.24Å; V606-K610 WeakPolarHBondContact O-CB 3.38Å; V606-K610 PolarHBondContact O-N 3.25Å
607N81.3Confident78.3Confident65 Ų65110 Ų11035%0.34853%0.534SS..Hα-helixtrans-67.9-33.4175.7-83.9-59.3000112.6E603 S604 K610 K611E603-N607 WeakPolarHBondContact CG-ND2 3.36Å; E603-N607 VanDerWaalsContact O-CB 3.31Å; E603-N607 WeakPolarHBondContact O-CB 3.35Å; E603-N607 PolarHBondContact O-N 3.2Å; E603-N607 PolarHBondContact O-ND2 3.38Å; S604-N607 PolarHBondContact O-N 2.85Å; N607-K610 PolarHBondContact O-N 3.49Å; N607-K611 WeakPolarHBondContact O-CB 3.28Å; N607-K611 WeakPolarHBondContact O-CG 3.3Å; N607-K611 PolarHBondContact O-N 2.94Å
608M83.9Confident76.6Confident123 Ų123109.8 Ų109.861%0.60654%0.54SS*.Hα-helixtrans-65.9-43.7170.9-169.7-173.1-64.600111.4S604 K605 V606 K611 R612S604-M608 WeakPolarHBondContact O-CB 3.13Å; S604-M608 PolarHBondContact O-N 2.9Å; K605-M608 PolarHBondContact O-N 2.85Å; V606-M608 PolarHBondContact O-N 3.21Å; M608-K611 PolarHBondContact O-N 3.31Å; M608-R612 PolarHBondContact O-N 3.33Å; M608-R612 VanDerWaalsContact O-N 3.08Å
609M78.2Confident74.9Confident129 Ų129109.6 Ų109.664%0.63555%0.548SS*.Hα-helixtrans-63-41.3172.8-73.6-179.766.400111.9K605 V606 R612 L613K605-M609 WeakPolarHBondContact O-CG 3.29Å; K605-M609 PolarHBondContact O-N 2.73Å; V606-M609 CarbonylContact O-C 3.55Å; V606-M609 PolarHBondContact O-N 2.66Å; M609-R612 WeakPolarHBondContact O-CB 3.32Å; M609-R612 PolarHBondContact O-N 2.91Å; M609-L613 WeakPolarHBondContact O-CB 3.43Å; M609-L613 PolarHBondContact O-N 2.74Å
610K78.1Confident73Confident110 Ų110111.9 Ų111.948%0.47856%0.555SS.*Hα-helixtrans-65.5-40178.8-171.2174.7-178.8178.20111.9V606 N607 L613 Q614V606-K610 VanDerWaalsContact O-CB 3.24Å; V606-K610 WeakPolarHBondContact O-CB 3.38Å; V606-K610 PolarHBondContact O-N 3.25Å; N607-K610 PolarHBondContact O-N 3.49Å; K610-L613 PolarHBondContact O-N 3.23Å; K610-Q614 WeakPolarHBondContact O-CB 3.47Å; K610-Q614 VanDerWaalsContact O-CG 3.27Å; K610-Q614 WeakPolarHBondContact O-CG 3.4Å; K610-Q614 PolarHBondContact O-N 2.96Å
611K77.8Confident71.1Confident152 Ų152114.4 Ų114.466%0.66156%0.562SS**Hα-helixtrans-64.4-42.6172.1-75.4177.6178.7-178.60112N607 M608 Q614 S615N607-K611 WeakPolarHBondContact O-CB 3.28Å; N607-K611 WeakPolarHBondContact O-CG 3.3Å; N607-K611 PolarHBondContact O-N 2.94Å; M608-K611 PolarHBondContact O-N 3.31Å; K611-Q614 PolarHBondContact O-N 3.11Å; K611-S615 PolarHBondContact O-N 3.15Å; K611-S615 PolarHBondContact O-OG 3.44Å; K611-S615 VanDerWaalsContact O-OG 3.14Å
612R76.8Confident68.8Low180 Ų180117.9 Ų117.968%0.67957%0.574SS**Hα-helixtrans-59.5-45.3172.2-101.5179.6162.6148.7-4.5112.2M608 M609 S615 L616M608-R612 PolarHBondContact O-N 3.33Å; M608-R612 VanDerWaalsContact O-N 3.08Å; M609-R612 WeakPolarHBondContact O-CB 3.32Å; M609-R612 PolarHBondContact O-N 2.91Å; R612-S615 PolarHBondContact O-N 2.88Å; R612-S615 PolarHBondContact O-OG 3.43Å; R612-L616 PolarHBondContact O-N 3.08Å
613L68.8Low66.3Low113 Ų113121.9 Ų121.959%0.59258%0.583SS**Hα-helixtrans-61.7-51.4177.8-169.868.2000110.4M609 K610 S615 L616 E617M609-L613 WeakPolarHBondContact O-CB 3.43Å; M609-L613 PolarHBondContact O-N 2.74Å; K610-L613 PolarHBondContact O-N 3.23Å; L613-S615 VanDerWaalsContact C-N 3.3Å; L613-S615 PolarHBondContact O-N 3.41Å; L613-L616 PolarHBondContact O-N 3.12Å; L613-E617 WeakPolarHBondContact O-CB 3.5Å; L613-E617 PolarHBondContact O-N 3.37Å
614Q65.6Low63.8Low96 Ų96122.9 Ų122.945%0.44959%0.592SS.*Hα-helixtrans-60.6-34179.8-74.5178-43.500113.4K610 K611 L616 E617 T618K610-Q614 WeakPolarHBondContact O-CB 3.47Å; K610-Q614 VanDerWaalsContact O-CG 3.27Å; K610-Q614 WeakPolarHBondContact O-CG 3.4Å; K610-Q614 PolarHBondContact O-N 2.96Å; K611-Q614 PolarHBondContact O-N 3.11Å; Q614-L616 VanDerWaalsContact C-N 3.31Å; Q614-L616 PolarHBondContact O-N 2.8Å; Q614-E617 PolarHBondContact O-N 3.24Å; Q614-T618 PolarHBondContact O-N 3.35Å; Q614-T618 VanDerWaalsContact O-N 3.15Å; Q614-T618 PolarHBondContact O-OG1 3.03Å
615S60.9Low61Low67 Ų67130.3 Ų130.347%0.46961%0.609SS.*Hα-helixtrans-70.9-21.7174.453.80000114.6K611 R612 L613 T618K611-S615 PolarHBondContact O-N 3.15Å; K611-S615 PolarHBondContact O-OG 3.44Å; K611-S615 VanDerWaalsContact O-OG 3.14Å; R612-S615 PolarHBondContact O-N 2.88Å; R612-S615 PolarHBondContact O-OG 3.43Å; L613-S615 VanDerWaalsContact C-N 3.3Å; L613-S615 PolarHBondContact O-N 3.41Å; S615-T618 PolarHBondContact O-OG1 2.92Å
616L57Low58Low111 Ų111130.2 Ų130.258%0.58163%0.626SS**Hα-helixtrans-86.8-40.4171.2-67.4165.3000110.5R612 L613 Q614 T618 I619 E620R612-L616 PolarHBondContact O-N 3.08Å; L613-L616 PolarHBondContact O-N 3.12Å; Q614-L616 VanDerWaalsContact C-N 3.31Å; Q614-L616 PolarHBondContact O-N 2.8Å; L616-T618 PolarHBondContact O-N 3.11Å; L616-T618 VanDerWaalsContact O-N 3.15Å; L616-I619 PolarHBondContact O-N 2.86Å; L616-E620 PolarHBondContact O-N 3.45Å; L616-E620 VanDerWaalsContact O-N 3.12Å
617E54Low55.4Low80 Ų80136 Ų13637%0.37464%0.644SS.*Hα-helixtrans-59.6-23.8177.2-151.7-160.1138.400113L613 Q614 R621L613-E617 WeakPolarHBondContact O-CB 3.5Å; L613-E617 PolarHBondContact O-N 3.37Å; Q614-E617 PolarHBondContact O-N 3.24Å; E617-R621 VanDerWaalsContact O-CZ 3.23Å; E617-R621 PolarHBondContact O-NH1 3Å; E617-R621 PolarHBondContact O-NH2 3.48Å; E617-R621 IonicContact OE1-CZ 3.63Å; E617-R621 IonicContact OE1-NE 2.9Å; E617-R621 IonicContact OE1-NH2 2.65Å; E617-R621 PolarHBondContact OE1-NH2 2.77Å
618T51.8Low52.9Low98 Ų98137.2 Ų137.260%0.60166%0.663SS**Hα-helixtrans-76-17.417240.40000115Q614 S615 L616Q614-T618 PolarHBondContact O-N 3.35Å; Q614-T618 VanDerWaalsContact O-N 3.15Å; Q614-T618 PolarHBondContact O-OG1 3.03Å; S615-T618 PolarHBondContact O-OG1 2.92Å; L616-T618 PolarHBondContact O-N 3.11Å; L616-T618 VanDerWaalsContact O-N 3.15Å
619I53Low50.4Low135 Ų135139.4 Ų139.469%0.69267%0.669SS**Hα-helixtrans-100.3-34.3179.1-61.6174.7000110.7L616 R621L616-I619 PolarHBondContact O-N 2.86Å; I619-R621 VanDerWaalsContact C-N 3.33Å; I619-R621 PolarHBondContact O-N 2.58Å
620E44.4Very low48.1Very low152 Ų152140.2 Ų140.271%0.7167%0.671SS**Hα-helixtrans-73.6-21.7-175.6-167.2166.2-152.100113.8L616 E622 Y623L616-E620 PolarHBondContact O-N 3.45Å; L616-E620 VanDerWaalsContact O-N 3.12Å; E620-E622 PolarHBondContact O-N 3.49Å; E620-Y623 PolarHBondContact O-N 3.24Å
621R46.4Very low46Very low166 Ų166142 Ų14263%0.62668%0.681SS**THydrogen-bonded Turntrans-74.29.9-170.8-132.7-179.7-73.1103.8-10.6115.8E617 I619E617-R621 VanDerWaalsContact O-CZ 3.23Å; E617-R621 PolarHBondContact O-NH1 3Å; E617-R621 PolarHBondContact O-NH2 3.48Å; E617-R621 IonicContact OE1-CZ 3.63Å; E617-R621 IonicContact OE1-NE 2.9Å; E617-R621 IonicContact OE1-NH2 2.65Å; E617-R621 PolarHBondContact OE1-NH2 2.77Å; I619-R621 VanDerWaalsContact C-N 3.33Å; I619-R621 PolarHBondContact O-N 2.58Å
622E40.7Very low43.7Very low191 Ų191141.5 Ų141.589%0.89368%0.681SS**THydrogen-bonded Turntrans-120-0.4179.3-158.7162-137.400114E620E620-E622 PolarHBondContact O-N 3.49Å
623Y32.5Very low41.6Very low186 Ų186139 Ų13973%0.72968%0.681SS**SBendtrans-13288.3-172.4-165.2-100.3000116E620E620-Y623 PolarHBondContact O-N 3.24Å
624L32.9Very low39.7Very low135 Ų135141.1 Ų141.171%0.70769%0.685SS**  trans62.5140.8163-57.7167.2000116.5
625R25.8Very low37.9Very low225 Ų225142.5 Ų142.585%0.84970%0.7SS**  cis72.97029.3-158.7-162.8-72.4-154.81.4115.7
626S26.1Very low37.1Very low135 Ų135144.9 Ų144.994%0.94472%0.715SS**  trans-163.4-177.9152.7-89.40000113.5
627K28.1Very low35.7Very low206 Ų206147.6 Ų147.690%0.89673%0.729SS**  trans-120.3158.3-156.1-93-175172.8-1800116.3
628A27.2Very low34.6Very low91 Ų91147.1 Ų147.175%0.75274%0.739SS**  trans79.6152.7148.300000118.5
629K32.4Very low33.5Very low170 Ų170150.4 Ų150.474%0.73975%0.752SS**  cis-166.2167.3-0.1-132.9161.9157.5-103.70112.4
630E29Very low32.2Very low145 Ų145155.6 Ų155.668%0.67876%0.763SS**  trans63.2156.2158.4-82.4144.291.700121.2
631E34.4Very low31.5Very low147 Ų147156.8 Ų156.869%0.68777%0.766SS**  cis-170.1172.8-35.5-154.9-165.4-137.600112.5
632Q30.5Very low30.7Very low142 Ų142157.4 Ų157.466%0.66478%0.776SS**  trans95110.6157-49.3-152.1-2.600119.4
633L32.6Very low30.2Very low128 Ų128156.9 Ų156.967%0.6777%0.774SS**  83.3135.369.9-75166.9000113.6
634K28.3Very low30.7Very low157 Ų157156.9 Ų156.968%0.68378%0.781SS**  cis-139.2177.415.4-67.594.5-175.8169.10109.5
635T27Very low31Very low125 Ų125156.2 Ų156.277%0.76778%0.778SS**  cis71.5151.122.162.30000117.5
636P44.3Very low32.1Very low118 Ų118153.2 Ų153.277%0.76678%0.778SS**  cis-128.2177-7.932.8-9.8000114.7
637L29.1Very low33.6Very low168 Ų168155 Ų15588%0.8877%0.769SS**  cis74.4142.147.9-113.276.1000115.6
638A29.6Very low34.8Very low70 Ų70150.2 Ų150.258%0.57976%0.757SS**  cis-165.1164.16.500000116.3
639N29Very low36.1Very low166 Ų166153.7 Ų153.789%0.88876%0.755SS**  trans64.4139.7144.9-65.5-11.5000126.7
640R26.8Very low37.3Very low244 Ų244151.3 Ų151.392%0.92175%0.751SS**  -172.6156.8120.3-176.6164.6-79.3-105.15.3113.4
641F28.8Very low38.7Very low178 Ų178150.6 Ų150.678%0.78175%0.751SS**  trans-113.5159.7178.5-95.9-101.1000113.5
642Q29.1Very low40Very low179 Ų179148.1 Ų148.184%0.83675%0.746SS**  trans56.4144.4153.3-73.4161.9-36.200118.8
643Q29.9Very low41.5Very low179 Ų179148 Ų14884%0.83675%0.745SS**  -171.1161.358.5173.3170.4-10.600111.9
644E43.1Very low43.3Very low187 Ų187147.3 Ų147.387%0.87474%0.738SS**  trans-94.8128.8169.2-55.8174.9125.300112.1
645D40.8Very low45Very low121 Ų121143.7 Ų143.765%0.64773%0.729SS**  trans-167.7101.1149.7-173.99.5000110.8
646N48.5Very low47.1Very low161 Ų161143.2 Ų143.286%0.86172%0.718SS**  trans-159.748.7177.1-97.1-41.1000112.1
647K56.8Low48.1Very low173 Ų173142.6 Ų142.675%0.75271%0.705SS**SBendtrans-141.4-0.3177.9-147163.8-174.61720116.3
648V53.3Low49.7Very low105 Ų105139.7 Ų139.764%0.63669%0.69SS**SBendtrans-99-23.9-177-177.10000112.8T652V648-T652 PolarHBondContact O-OG1 3.32Å
649K54.8Low51.2Low164 Ų164145.4 Ų145.471%0.71370%0.697SS**SBendtrans-73.2-41.6-176.3-82.1-179.1175172.60114.2T652K649-T652 PolarHBondContact O-N 2.82Å
650D57.7Low53.1Low121 Ų121144.4 Ų144.465%0.64768%0.68SS**Hα-helixtrans-69.8-41.6-171.3-57.2-10.7000112.2T652 Q653D650-T652 PolarHBondContact O-N 2.91Å; D650-T652 VanDerWaalsContact O-N 3.15Å; D650-Q653 PolarHBondContact O-N 3.35Å; D650-Q653 VanDerWaalsContact O-N 3.08Å
651L58.2Low55Low130 Ų130140.1 Ų140.168%0.68167%0.668SS**Hα-helixtrans-64.8-18.9179.6-67.4173.9000113.5
652T62.9Low56.5Low95 Ų95138.1 Ų138.158%0.58367%0.665SS**Hα-helixtrans-76.2-31.4175.2-510000111.8V648 K649 D650V648-T652 PolarHBondContact O-OG1 3.32Å; K649-T652 PolarHBondContact O-N 2.82Å; D650-T652 PolarHBondContact O-N 2.91Å; D650-T652 VanDerWaalsContact O-N 3.15Å
653Q62.2Low58Low138 Ų138137.2 Ų137.265%0.64566%0.658SS**Hα-helixtrans-81.8-35.9-173.7-59.5-175.819.500112.3D650 V655 E656 H657D650-Q653 PolarHBondContact O-N 3.35Å; D650-Q653 VanDerWaalsContact O-N 3.08Å; Q653-V655 VanDerWaalsContact C-N 3.32Å; Q653-V655 PolarHBondContact O-N 2.79Å; Q653-E656 PolarHBondContact O-N 3.37Å; Q653-H657 PolarHBondContact O-N 3.39Å
654E69.7Low59Low114 Ų114134 Ų13453%0.53365%0.647SS.*Hα-helixtrans-61-39178.7-164.661.9-153.400112.5E656 H657 L658E654-E656 VanDerWaalsContact C-N 3.31Å; E654-E656 PolarHBondContact O-N 2.96Å; E654-H657 WeakPolarHBondContact O-CB 3.36Å; E654-H657 PolarHBondContact O-N 2.75Å; E654-L658 PolarHBondContact O-N 3.48Å
655V64.6Low59.4Low81 Ų81131.2 Ų131.249%0.49164%0.636SS.*Hα-helixtrans-66.1-31.9-179.2175.40000112.2Q653 R659Q653-V655 VanDerWaalsContact C-N 3.32Å; Q653-V655 PolarHBondContact O-N 2.79Å; V655-R659 PolarHBondContact O-N 2.97Å
656E71.1Confident59.8Low115 Ų115132.9 Ų132.954%0.53764%0.637SS.*Hα-helixtrans-77.1-30.4174-67.3-153.7152.500113.4Q653 E654 R659 R660Q653-E656 PolarHBondContact O-N 3.37Å; E654-E656 VanDerWaalsContact C-N 3.31Å; E654-E656 PolarHBondContact O-N 2.96Å; E656-R659 PolarHBondContact O-N 3.42Å; E656-R660 PolarHBondContact O-N 3.35Å; E656-R660 PolarHBondContact O-NE 3.35Å; E656-R660 IonicContact OE2-NH2 2.72Å
657H64.1Low60Low106 Ų106130.2 Ų130.249%0.49163%0.626SS.*Hα-helixtrans-64.2-44.1176.8-168.2-17.7000111.1Q653 E654 R660 K661Q653-H657 PolarHBondContact O-N 3.39Å; E654-H657 WeakPolarHBondContact O-CB 3.36Å; E654-H657 PolarHBondContact O-N 2.75Å; H657-R660 PolarHBondContact O-N 2.94Å; H657-K661 PolarHBondContact O-N 3.39Å
658L63.2Low59.9Low106 Ų106127.3 Ų127.356%0.55562%0.623SS**Hα-helixtrans-67.8-35.6178.8-67.3172.7000112.5E654 R660 K661 L662E654-L658 PolarHBondContact O-N 3.48Å; L658-R660 VanDerWaalsContact C-N 3.33Å; L658-R660 PolarHBondContact O-N 3.27Å; L658-K661 PolarHBondContact O-N 2.88Å; L658-L662 PolarHBondContact O-N 2.85Å
659R60.8Low59.8Low191 Ų191128.9 Ų128.972%0.72162%0.624SS**Hα-helixtrans-64.4-32.7175.3-82.8-179.6169.6166.5-1.6113.8V655 E656V655-R659 PolarHBondContact O-N 2.97Å; E656-R659 PolarHBondContact O-N 3.42Å
660R69.3Low59.5Low145 Ų145129 Ų12955%0.54763%0.626SS.*Hα-helixtrans-70.8-48.2173.7-85.1171.5-94.8145.1-9.6111.7E656 H657 L658 L662 K663E656-R660 PolarHBondContact O-N 3.35Å; E656-R660 PolarHBondContact O-NE 3.35Å; E656-R660 IonicContact OE2-NH2 2.72Å; H657-R660 PolarHBondContact O-N 2.94Å; L658-R660 VanDerWaalsContact C-N 3.33Å; L658-R660 PolarHBondContact O-N 3.27Å; R660-L662 PolarHBondContact O-N 3.24Å; R660-L662 VanDerWaalsContact O-N 3.12Å; R660-K663 WeakPolarHBondContact O-CB 3.44Å; R660-K663 PolarHBondContact O-N 2.9Å
661K67.1Low59Low154 Ų154130.8 Ų130.867%0.6764%0.636SS**Hα-helixtrans-59.5-27.9-177.4-165.6172.5-176.4177.30114.4H657 L658H657-K661 PolarHBondContact O-N 3.39Å; L658-K661 PolarHBondContact O-N 2.88Å
662L60.4Low58.6Low136 Ų136128.7 Ų128.771%0.71263%0.633SS**Hα-helixtrans-76.9-21.5175.7-170.164.3000113.6L658 R660L658-L662 PolarHBondContact O-N 2.85Å; R660-L662 PolarHBondContact O-N 3.24Å; R660-L662 VanDerWaalsContact O-N 3.12Å
663K60.3Low58.2Low159 Ų159131.4 Ų131.469%0.69164%0.643SS**Hα-helixtrans-80.3-41.6-175.7-166.1-179.7-179.9-173.10112.1R660 K666R660-K663 WeakPolarHBondContact O-CB 3.44Å; R660-K663 PolarHBondContact O-N 2.9Å; K663-K666 PolarHBondContact O-N 3.36Å
664D49.4Very low57.9Low113 Ų113134.6 Ų134.660%0.60465%0.654SS**Hα-helixtrans-71.1-36.4-173.4-54.5-30.8000112K666 V667D664-K666 PolarHBondContact O-N 3.1Å; D664-V667 PolarHBondContact O-N 3.39Å
665M52.4Low57Low128 Ų128132.8 Ų132.863%0.63165%0.651SS**THydrogen-bonded Turntrans-62.3-25.6179.9-155.6-17090.500113.3T668M665-T668 PolarHBondContact O-OG1 3.08Å
666K48.5Very low56.7Low156 Ų156133.9 Ų133.968%0.67866%0.66SS**THydrogen-bonded Turntrans-80.6-16.2-177-163.2172.8-178.5-176.70113.6K663 D664K663-K666 PolarHBondContact O-N 3.36Å; D664-K666 PolarHBondContact O-N 3.1Å
667V53Low56Low104 Ų104134.9 Ų134.963%0.6367%0.665SS**THydrogen-bonded Turntrans-84.8-33.1177.7-178.10000111D664 E669D664-V667 PolarHBondContact O-N 3.39Å; V667-E669 PolarHBondContact O-N 3.5Å
668T54.7Low56Low113 Ų113137.9 Ų137.969%0.69367%0.673SS**THydrogen-bonded Turntrans-68.5-8.8176.932.40000115.5M665M665-T668 PolarHBondContact O-OG1 3.08Å
669E52.4Low56.3Low138 Ų138137.9 Ų137.965%0.64567%0.67SS**THydrogen-bonded Turntrans-96.3-16.9-175.2-161.2166.3-140.100113.1V667V667-E669 PolarHBondContact O-N 3.5Å
670E47.3Very low56.9Low165 Ų165131.7 Ų131.777%0.77165%0.654SS**THydrogen-bonded Turntrans-97-21.8-170.5-158.7160.3-155.400113.8
671D47.7Very low57.2Low159 Ų159130 Ų13085%0.8566%0.655SS**SBendtrans-90-2.3-177.5-111-19.8000114.5L673D671-L673 VanDerWaalsContact C-N 3.34Å; D671-L673 PolarHBondContact O-N 2.87Å
672S50Low57.5Low87 Ų87127.9 Ų127.961%0.60865%0.648SS**  trans-86.912.1-169.869.70000115.7
673L54.5Low58.5Low151 Ų151126.9 Ų126.979%0.79164%0.637SS**SBendtrans-99.39.9-163.4-85.2167.1000116.7D671D671-L673 VanDerWaalsContact C-N 3.34Å; D671-L673 PolarHBondContact O-N 2.87Å
674K55.1Low59.5Low205 Ų205126.7 Ų126.789%0.89163%0.632SS**  trans-143.597173.6-68.5-175.6-177.61720113
675T51.2Low61Low76 Ų76127.8 Ų127.847%0.46663%0.632SS.*  trans-128.7151.8170.4610000111.3E677T675-E677 PolarHBondContact O-N 3.5Å; T675-E677 VanDerWaalsContact O-N 3.1Å
676P57.6Low62.5Low105 Ų105124.9 Ų124.968%0.68262%0.621SS**THydrogen-bonded Turntrans-67-8178.628.3-36.4000113.6Y678 E679 T680P676-Y678 VanDerWaalsContact C-N 3.28Å; P676-Y678 PolarHBondContact O-N 2.92Å; P676-E679 PolarHBondContact O-N 3.45Å; P676-T680 PolarHBondContact O-N 3.37Å
677E56.5Low64.2Low136 Ų136122 Ų12264%0.63661%0.613SS**Hα-helixtrans-62.4-35.1-179.8-60.2-176.7130.800112T675 E679 T680 L681T675-E677 PolarHBondContact O-N 3.5Å; T675-E677 VanDerWaalsContact O-N 3.1Å; E677-E679 PolarHBondContact O-N 3.34Å; E677-T680 CarbonylContact O-C 3.59Å; E677-T680 PolarHBondContact O-N 2.99Å; E677-T680 VanDerWaalsContact O-N 3.15Å; E677-T680 PolarHBondContact O-OG1 2.8Å; E677-L681 WeakPolarHBondContact O-CB 3.43Å; E677-L681 PolarHBondContact O-N 2.75Å
678Y63.8Low65.7Low168 Ų168122.4 Ų122.466%0.65961%0.608SS**Hα-helixtrans-58.6-45.5178.7-168.4-84.7000112.1P676 T680 L681 E682P676-Y678 VanDerWaalsContact C-N 3.28Å; P676-Y678 PolarHBondContact O-N 2.92Å; Y678-T680 VanDerWaalsContact C-N 3.32Å; Y678-T680 PolarHBondContact O-N 3.28Å; Y678-L681 WeakPolarHBondContact O-CB 3.28Å; Y678-L681 PolarHBondContact O-N 3.44Å; Y678-L681 VanDerWaalsContact O-N 3.08Å; Y678-E682 PolarHBondContact O-N 2.79Å
679E69.8Low66.9Low107 Ų107121.2 Ų121.250%0.560%0.595SS.*Hα-helixtrans-66.8-33.8178.4-163.2-170.7152.500111.7P676 E677 L681 K683P676-E679 PolarHBondContact O-N 3.45Å; E677-E679 PolarHBondContact O-N 3.34Å; E679-L681 VanDerWaalsContact C-N 3.31Å; E679-K683 WeakPolarHBondContact O-CB 3.46Å; E679-K683 WeakPolarHBondContact O-CG 3.4Å; E679-K683 PolarHBondContact O-N 3.21Å; E679-K683 VanDerWaalsContact OE1-CE 3.29Å; E679-K683 WeakPolarHBondContact OE1-CE 3.35Å; E679-K683 IonicContact OE1-NZ 2.62Å; E679-K683 PolarHBondContact OE1-NZ 2.94Å
680T73.6Confident68.5Low61 Ų61120 Ų12037%0.37459%0.589SS.*Hα-helixtrans-73.4-23.2172.875.10000113.2P676 E677 Y678 R684P676-T680 PolarHBondContact O-N 3.37Å; E677-T680 CarbonylContact O-C 3.59Å; E677-T680 PolarHBondContact O-N 2.99Å; E677-T680 VanDerWaalsContact O-N 3.15Å; E677-T680 PolarHBondContact O-OG1 2.8Å; Y678-T680 VanDerWaalsContact C-N 3.32Å; Y678-T680 PolarHBondContact O-N 3.28Å; T680-R684 WeakPolarHBondContact O-CB 3.19Å; T680-R684 WeakPolarHBondContact O-CG 3.29Å; T680-R684 PolarHBondContact O-N 2.91Å; T680-R684 PolarHBondContact O-NE 3.47Å; T680-R684 PolarHBondContact OG1-NH2 3.1Å
681L75.1Confident70.5Confident110 Ų110119.8 Ų119.858%0.57658%0.581SS**Hα-helixtrans-80.5-40.8175.9-172.662.9000110.3E677 Y678 E679 R684 F685E677-L681 WeakPolarHBondContact O-CB 3.43Å; E677-L681 PolarHBondContact O-N 2.75Å; Y678-L681 WeakPolarHBondContact O-CB 3.28Å; Y678-L681 PolarHBondContact O-N 3.44Å; Y678-L681 VanDerWaalsContact O-N 3.08Å; E679-L681 VanDerWaalsContact C-N 3.31Å; L681-R684 CarbonylContact O-C 3.55Å; L681-R684 PolarHBondContact O-N 2.88Å; L681-F685 WeakPolarHBondContact O-CB 3.25Å; L681-F685 PolarHBondContact O-N 2.84Å
682E75.2Confident72.1Confident109 Ų109114.6 Ų114.651%0.50956%0.561SS.*Hα-helixtrans-62.5-46.8173.5-173.8165.1-13900111.6Y678 R684 F685 V686Y678-E682 PolarHBondContact O-N 2.79Å; E682-R684 VanDerWaalsContact C-N 3.3Å; E682-R684 PolarHBondContact O-N 2.65Å; E682-F685 WeakPolarHBondContact O-CB 3.44Å; E682-F685 PolarHBondContact O-N 3.4Å; E682-F685 VanDerWaalsContact O-N 3.12Å; E682-V686 WeakPolarHBondContact O-CG2 3.49Å; E682-V686 PolarHBondContact O-N 2.84Å
683K80.4Confident73.9Confident115 Ų115115.7 Ų115.750%0.555%0.554SS.*Hα-helixtrans-62.7-34.5173.3-71.6172.9-172.9170.70112.7E679 N687E679-K683 WeakPolarHBondContact O-CB 3.46Å; E679-K683 WeakPolarHBondContact O-CG 3.4Å; E679-K683 PolarHBondContact O-N 3.21Å; E679-K683 VanDerWaalsContact OE1-CE 3.29Å; E679-K683 WeakPolarHBondContact OE1-CE 3.35Å; E679-K683 IonicContact OE1-NZ 2.62Å; E679-K683 PolarHBondContact OE1-NZ 2.94Å; K683-N687 WeakPolarHBondContact O-CB 3.35Å; K683-N687 PolarHBondContact O-N 2.84Å; K683-N687 VanDerWaalsContact O-N 3.11Å; K683-N687 PolarHBondContact O-ND2 3.39Å; K683-N687 PolarHBondContact O-OD1 3.33Å
684R80.8Confident75.5Confident154 Ų154111.1 Ų111.158%0.58154%0.538SS*.Hα-helixtrans-68.6-39.2171.8-84.1179-82.9-165.1-2.3112.2T680 L681 E682 N687 E688T680-R684 WeakPolarHBondContact O-CB 3.19Å; T680-R684 WeakPolarHBondContact O-CG 3.29Å; T680-R684 PolarHBondContact O-N 2.91Å; T680-R684 PolarHBondContact O-NE 3.47Å; T680-R684 PolarHBondContact OG1-NH2 3.1Å; L681-R684 CarbonylContact O-C 3.55Å; L681-R684 PolarHBondContact O-N 2.88Å; E682-R684 VanDerWaalsContact C-N 3.3Å; E682-R684 PolarHBondContact O-N 2.65Å; R684-N687 PolarHBondContact O-N 3.27Å; R684-E688 VanDerWaalsContact O-CB 3.29Å; R684-E688 WeakPolarHBondContact O-CB 3.46Å; R684-E688 PolarHBondContact O-N 2.79Å
685F81.3Confident77.1Confident136 Ų136106.1 Ų106.160%0.59652%0.521SS*.Hα-helixtrans-65.3-40.7176.8-179.9-102.4000112.5L681 E682 E688 Q689L681-F685 WeakPolarHBondContact O-CB 3.25Å; L681-F685 PolarHBondContact O-N 2.84Å; E682-F685 WeakPolarHBondContact O-CB 3.44Å; E682-F685 PolarHBondContact O-N 3.4Å; E682-F685 VanDerWaalsContact O-N 3.12Å; F685-E688 PolarHBondContact O-N 3.14Å; F685-Q689 WeakPolarHBondContact O-CB 3.2Å; F685-Q689 PolarHBondContact O-N 3.05Å
686V83.8Confident78.8Confident68 Ų68108.7 Ų108.741%0.41253%0.529SS..Hα-helixtrans-63.2-51.2173.2174.40000110.8E682 E688 Q689 E690E682-V686 WeakPolarHBondContact O-CG2 3.49Å; E682-V686 PolarHBondContact O-N 2.84Å; V686-E688 VanDerWaalsContact C-N 3.27Å; V686-E688 PolarHBondContact O-N 3.36Å; V686-Q689 WeakPolarHBondContact O-CB 3.31Å; V686-Q689 PolarHBondContact O-N 3.28Å; V686-Q689 VanDerWaalsContact O-N 3.11Å; V686-E690 PolarHBondContact O-N 3.36Å
687N84.8Confident80.2Confident95 Ų95110.5 Ų110.551%0.50853%0.529SS..Hα-helixtrans-59.8-36.2178.4-69-2.9000112.6K683 R684 E690 R691K683-N687 WeakPolarHBondContact O-CB 3.35Å; K683-N687 PolarHBondContact O-N 2.84Å; K683-N687 VanDerWaalsContact O-N 3.11Å; K683-N687 PolarHBondContact O-ND2 3.39Å; K683-N687 PolarHBondContact O-OD1 3.33Å; R684-N687 PolarHBondContact O-N 3.27Å; N687-E690 PolarHBondContact O-N 2.88Å; N687-R691 PolarHBondContact O-N 3.31Å
688E83.6Confident81.7Confident112 Ų112110 Ų11052%0.52353%0.526SS..Hα-helixtrans-74.4-34.2177.3-16359.5-155.900111.8R684 F685 V686 E690 R691 A692R684-E688 VanDerWaalsContact O-CB 3.29Å; R684-E688 WeakPolarHBondContact O-CB 3.46Å; R684-E688 PolarHBondContact O-N 2.79Å; F685-E688 PolarHBondContact O-N 3.14Å; V686-E688 VanDerWaalsContact C-N 3.27Å; V686-E688 PolarHBondContact O-N 3.36Å; E688-E690 VanDerWaalsContact C-N 3.34Å; E688-R691 WeakPolarHBondContact O-CB 3.48Å; E688-R691 PolarHBondContact O-N 3.45Å; E688-A692 WeakPolarHBondContact O-CB 3.42Å; E688-A692 PolarHBondContact O-N 2.85Å
689Q80.1Confident82.8Confident89 Ų89106 Ų10642%0.41652%0.516SS..Hα-helixtrans-66.8-35.4171.4-165.5-169.6104.900111.9F685 V686 A692 K693F685-Q689 WeakPolarHBondContact O-CB 3.2Å; F685-Q689 PolarHBondContact O-N 3.05Å; V686-Q689 WeakPolarHBondContact O-CB 3.31Å; V686-Q689 PolarHBondContact O-N 3.28Å; V686-Q689 VanDerWaalsContact O-N 3.11Å; Q689-A692 PolarHBondContact O-N 3.12Å; Q689-K693 VanDerWaalsContact O-CG 3.32Å; Q689-K693 WeakPolarHBondContact O-CG 3.33Å; Q689-K693 PolarHBondContact O-N 3.2Å
690E85.7Confident83.7Confident112 Ų112105.5 Ų105.552%0.52351%0.514SS..Hα-helixtrans-69.2-41.5172.7-71.3-178.6173.300111.8V686 N687 E688 A692 K693 A694V686-E690 PolarHBondContact O-N 3.36Å; N687-E690 PolarHBondContact O-N 2.88Å; E688-E690 VanDerWaalsContact C-N 3.34Å; E690-A692 VanDerWaalsContact C-N 3.34Å; E690-A692 PolarHBondContact O-N 3.1Å; E690-K693 PolarHBondContact O-N 3.05Å; E690-A694 PolarHBondContact O-N 2.81Å
691R89.3Confident84.4Confident161 Ų161106 Ų10661%0.60852%0.516SS*.Hα-helixtrans-55.8-46.7168.2-104.5-167.7174.496.97.3112.3N687 E688 K693 A694 L695N687-R691 PolarHBondContact O-N 3.31Å; E688-R691 WeakPolarHBondContact O-CB 3.48Å; E688-R691 PolarHBondContact O-N 3.45Å; R691-K693 VanDerWaalsContact C-N 3.29Å; R691-K693 PolarHBondContact O-N 3.27Å; R691-A694 PolarHBondContact O-N 3.46Å; R691-L695 WeakPolarHBondContact O-CB 3.32Å; R691-L695 WeakPolarHBondContact O-CG 3.47Å; R691-L695 PolarHBondContact O-N 3.46Å
692A81.4Confident84.7Confident50 Ų50103.8 Ų103.841%0.41351%0.51SS..Hα-helixtrans-63.7-33.6179.500000112.5E688 Q689 E690 M696E688-A692 WeakPolarHBondContact O-CB 3.42Å; E688-A692 PolarHBondContact O-N 2.85Å; Q689-A692 PolarHBondContact O-N 3.12Å; E690-A692 VanDerWaalsContact C-N 3.34Å; E690-A692 PolarHBondContact O-N 3.1Å; A692-M696 VanDerWaalsContact O-CB 3.3Å; A692-M696 WeakPolarHBondContact O-CB 3.45Å; A692-M696 PolarHBondContact O-N 2.97Å; A692-M696 VanDerWaalsContact O-N 3.11Å
693K87.4Confident85.4Confident110 Ų110106.1 Ų106.148%0.47851%0.514SS..Hα-helixtrans-68.6-47.5171.9-70.9164.1-170.3161.40111.6Q689 E690 R691 L695 M696 E697Q689-K693 VanDerWaalsContact O-CG 3.32Å; Q689-K693 WeakPolarHBondContact O-CG 3.33Å; Q689-K693 PolarHBondContact O-N 3.2Å; E690-K693 PolarHBondContact O-N 3.05Å; R691-K693 VanDerWaalsContact C-N 3.29Å; R691-K693 PolarHBondContact O-N 3.27Å; K693-L695 PolarHBondContact O-N 2.85Å; K693-M696 WeakPolarHBondContact O-CB 3.38Å; K693-M696 PolarHBondContact O-N 2.94Å; K693-M696 VanDerWaalsContact O-N 3.1Å; K693-E697 PolarHBondContact O-N 2.84Å
694A88.9Confident85.5Confident55 Ų55106 Ų10646%0.45551%0.513SS..Hα-helixtrans-60.1-45.3178.300000112.1E690 R691 M696 E697 E698E690-A694 PolarHBondContact O-N 2.81Å; R691-A694 PolarHBondContact O-N 3.46Å; A694-M696 VanDerWaalsContact C-N 3.28Å; A694-M696 PolarHBondContact O-N 3.22Å; A694-E697 PolarHBondContact O-N 3.34Å; A694-E698 WeakPolarHBondContact O-CB 3.49Å; A694-E698 PolarHBondContact O-N 3.08Å
695L89.9Confident85.7Confident99 Ų99103.6 Ų103.652%0.51851%0.509SS..Hα-helixtrans-64.9-30.4175-70.2169.4000112.6R691 K693 L699R691-L695 WeakPolarHBondContact O-CB 3.32Å; R691-L695 WeakPolarHBondContact O-CG 3.47Å; R691-L695 PolarHBondContact O-N 3.46Å; K693-L695 PolarHBondContact O-N 2.85Å; L695-L699 WeakPolarHBondContact O-CB 3.35Å; L695-L699 PolarHBondContact O-N 3.29Å
696M85.1Confident85.5Confident131 Ų131101.9 Ų101.965%0.64551%0.505SS*.Hα-helixtrans-71.2-39.4174.5-169.7-177.8-53.300111.7A692 K693 A694 L699 E700A692-M696 VanDerWaalsContact O-CB 3.3Å; A692-M696 WeakPolarHBondContact O-CB 3.45Å; A692-M696 PolarHBondContact O-N 2.97Å; A692-M696 VanDerWaalsContact O-N 3.11Å; K693-M696 WeakPolarHBondContact O-CB 3.38Å; K693-M696 PolarHBondContact O-N 2.94Å; K693-M696 VanDerWaalsContact O-N 3.1Å; A694-M696 VanDerWaalsContact C-N 3.28Å; A694-M696 PolarHBondContact O-N 3.22Å; M696-L699 PolarHBondContact O-N 2.99Å; M696-E700 PolarHBondContact O-N 3.48Å
697E88.1Confident85.4Confident143 Ų143102.5 Ų102.567%0.66851%0.51SS*.Hα-helixtrans-68.4-44.3175.2-173164.9-157.700111.6K693 A694 L699 E700 V701K693-E697 PolarHBondContact O-N 2.84Å; A694-E697 PolarHBondContact O-N 3.34Å; E697-L699 VanDerWaalsContact C-N 3.32Å; E697-L699 PolarHBondContact O-N 2.57Å; E697-E700 CarbonylContact O-C 3.53Å; E697-E700 PolarHBondContact O-N 3.12Å; E697-E700 VanDerWaalsContact O-N 3.07Å; E697-V701 WeakPolarHBondContact O-CG2 3.48Å; E697-V701 PolarHBondContact O-N 3.38Å
698E87.8Confident85.1Confident124 Ų124103.8 Ų103.858%0.57951%0.514SS*.Hα-helixtrans-60-39.9173-175.5175.6-155.900112A694 E700 V701 S702A694-E698 WeakPolarHBondContact O-CB 3.49Å; A694-E698 PolarHBondContact O-N 3.08Å; E698-E700 VanDerWaalsContact C-N 3.34Å; E698-V701 PolarHBondContact O-N 3.27Å; E698-S702 WeakPolarHBondContact O-CB 3.44Å; E698-S702 PolarHBondContact O-N 3.47Å; E698-S702 PolarHBondContact O-OG 2.93Å
699L87.8Confident84.8Confident86 Ų86106.2 Ų106.245%0.4552%0.519SS..Hα-helixtrans-67.4-33.8173.8-173.4152.7000111.8L695 M696 E697 R703L695-L699 WeakPolarHBondContact O-CB 3.35Å; L695-L699 PolarHBondContact O-N 3.29Å; M696-L699 PolarHBondContact O-N 2.99Å; E697-L699 VanDerWaalsContact C-N 3.32Å; E697-L699 PolarHBondContact O-N 2.57Å; L699-R703 HydrophobicContact CD2-CG 4.32Å; L699-R703 VanDerWaalsContact CD2-CZ 3.42Å; L699-R703 WeakPolarHBondContact O-CB 3.35Å; L699-R703 WeakPolarHBondContact O-CG 3.46Å; L699-R703 PolarHBondContact O-N 3.13Å
700E88.6Confident84.7Confident96 Ų96105.7 Ų105.745%0.44952%0.517SS..Hα-helixtrans-75.5-34.6175.1-158.7178.3117.100112.9M696 E697 E698 R703 K704M696-E700 PolarHBondContact O-N 3.48Å; E697-E700 CarbonylContact O-C 3.53Å; E697-E700 PolarHBondContact O-N 3.12Å; E697-E700 VanDerWaalsContact O-N 3.07Å; E698-E700 VanDerWaalsContact C-N 3.34Å; E700-R703 PolarHBondContact O-N 3.01Å; E700-K704 WeakPolarHBondContact O-CD 3.26Å; E700-K704 VanDerWaalsContact O-CG 3.29Å; E700-K704 WeakPolarHBondContact O-CG 3.29Å; E700-K704 PolarHBondContact O-N 2.88Å; E700-K704 WeakPolarHBondContact OE1-CE 3.26Å; E700-K704 IonicContact OE1-NZ 3.65Å; E700-K704 PolarHBondContact OE1-NZ 3.18Å
701V87.9Confident84Confident70 Ų70104.5 Ų104.542%0.42451%0.514SS..Hα-helixtrans-60.7-50.1167.3172.60000109.8E697 E698 R703 K704 E705E697-V701 WeakPolarHBondContact O-CG2 3.48Å; E697-V701 PolarHBondContact O-N 3.38Å; E698-V701 PolarHBondContact O-N 3.27Å; V701-R703 VanDerWaalsContact C-N 3.27Å; V701-R703 PolarHBondContact O-N 2.97Å; V701-K704 WeakPolarHBondContact O-CA 3.4Å; V701-K704 WeakPolarHBondContact O-CB 3.39Å; V701-K704 PolarHBondContact O-N 3.05Å; V701-E705 PolarHBondContact O-N 3.44Å
702S81.4Confident83.2Confident64 Ų64100.3 Ų100.345%0.44850%0.504SS..Hα-helixtrans-56.7-38.2176.1-59.30000112.4E698 L706E698-S702 WeakPolarHBondContact O-CB 3.44Å; E698-S702 PolarHBondContact O-N 3.47Å; E698-S702 PolarHBondContact O-OG 2.93Å; S702-L706 VanDerWaalsContact O-CB 3.31Å; S702-L706 WeakPolarHBondContact O-CB 3.4Å; S702-L706 PolarHBondContact O-N 3.2Å
703R88.4Confident82.4Confident158 Ų158103.7 Ų103.760%0.59651%0.511SS*.Hα-helixtrans-66.3-43172.7-79.8174.7174.5167.71.6112.5L699 E700 V701 L706 T707L699-R703 HydrophobicContact CD2-CG 4.32Å; L699-R703 VanDerWaalsContact CD2-CZ 3.42Å; L699-R703 WeakPolarHBondContact O-CB 3.35Å; L699-R703 WeakPolarHBondContact O-CG 3.46Å; L699-R703 PolarHBondContact O-N 3.13Å; E700-R703 PolarHBondContact O-N 3.01Å; V701-R703 VanDerWaalsContact C-N 3.27Å; V701-R703 PolarHBondContact O-N 2.97Å; R703-L706 PolarHBondContact O-N 2.9Å; R703-T707 WeakPolarHBondContact O-CG2 3.3Å; R703-T707 PolarHBondContact O-N 3.19Å; R703-T707 PolarHBondContact O-OG1 3.13Å
704K83.4Confident81.7Confident112 Ų112104.4 Ų104.449%0.48751%0.514SS..Hα-helixtrans-62.6-45.4177.5-72.8159.4-174.7158.90110.3E700 V701 T707 M708E700-K704 WeakPolarHBondContact O-CD 3.26Å; E700-K704 VanDerWaalsContact O-CG 3.29Å; E700-K704 WeakPolarHBondContact O-CG 3.29Å; E700-K704 PolarHBondContact O-N 2.88Å; E700-K704 WeakPolarHBondContact OE1-CE 3.26Å; E700-K704 IonicContact OE1-NZ 3.65Å; E700-K704 PolarHBondContact OE1-NZ 3.18Å; V701-K704 WeakPolarHBondContact O-CA 3.4Å; V701-K704 WeakPolarHBondContact O-CB 3.39Å; V701-K704 PolarHBondContact O-N 3.05Å; K704-T707 PolarHBondContact O-N 3.15Å; K704-T707 PolarHBondContact O-OG1 3.24Å; K704-M708 WeakPolarHBondContact O-CG 3.47Å; K704-M708 PolarHBondContact O-N 3.45Å
705E85.4Confident80.7Confident105 Ų105107.4 Ų107.449%0.49152%0.517SS..Hα-helixtrans-60-47.2172.4-69-172.4177.200112V701 T707 M708 Y709V701-E705 PolarHBondContact O-N 3.44Å; E705-T707 VanDerWaalsContact C-N 3.28Å; E705-T707 PolarHBondContact O-N 3.15Å; E705-M708 CarbonylContact O-C 3.56Å; E705-M708 WeakPolarHBondContact O-CA 3.46Å; E705-M708 WeakPolarHBondContact O-CB 3.21Å; E705-M708 PolarHBondContact O-N 2.84Å; E705-Y709 HydrophobicContact CB-CD2 4.45Å; E705-Y709 HydrophobicContact CB-CE2 4.3Å; E705-Y709 WeakPolarHBondContact O-CD2 3.43Å; E705-Y709 PolarHBondContact O-N 3.12Å
706L77.5Confident79.5Confident99 Ų99107.7 Ų107.752%0.51852%0.515SS..Hα-helixtrans-57.2-39.7175.7-166.777.8000112.1S702 R703 M708 Y709 Q710S702-L706 VanDerWaalsContact O-CB 3.31Å; S702-L706 WeakPolarHBondContact O-CB 3.4Å; S702-L706 PolarHBondContact O-N 3.2Å; R703-L706 PolarHBondContact O-N 2.9Å; L706-M708 VanDerWaalsContact C-N 3.34Å; L706-Y709 PolarHBondContact O-N 3.03Å; L706-Q710 WeakPolarHBondContact O-CB 3.47Å; L706-Q710 VanDerWaalsContact O-CG 3.31Å; L706-Q710 WeakPolarHBondContact O-CG 3.49Å; L706-Q710 PolarHBondContact O-N 2.89Å
707T80.3Confident78.2Confident82 Ų82104.1 Ų104.150%0.50350%0.502SS..Hα-helixtrans-69.6-29.7174.658.30000113.4R703 K704 E705 L711R703-T707 WeakPolarHBondContact O-CG2 3.3Å; R703-T707 PolarHBondContact O-N 3.19Å; R703-T707 PolarHBondContact O-OG1 3.13Å; K704-T707 PolarHBondContact O-N 3.15Å; K704-T707 PolarHBondContact O-OG1 3.24Å; E705-T707 VanDerWaalsContact C-N 3.28Å; E705-T707 PolarHBondContact O-N 3.15Å; T707-L711 VanDerWaalsContact O-CB 3.31Å; T707-L711 WeakPolarHBondContact O-CB 3.44Å; T707-L711 PolarHBondContact O-N 3.46Å
708M80.1Confident77.3Confident121 Ų121102.7 Ų102.760%0.59650%0.499SS*.Hα-helixtrans-71.1-42.7172.1-74.2-65.5-66.600111.6K704 E705 L706 L711 N712K704-M708 WeakPolarHBondContact O-CG 3.47Å; K704-M708 PolarHBondContact O-N 3.45Å; E705-M708 CarbonylContact O-C 3.56Å; E705-M708 WeakPolarHBondContact O-CA 3.46Å; E705-M708 WeakPolarHBondContact O-CB 3.21Å; E705-M708 PolarHBondContact O-N 2.84Å; L706-M708 VanDerWaalsContact C-N 3.34Å; M708-L711 CarbonylContact O-C 3.59Å; M708-L711 PolarHBondContact O-N 3.49Å; M708-N712 PolarHBondContact O-N 3.14Å
709Y76.4Confident76.7Confident163 Ų163103.1 Ų103.164%0.63950%0.501SS*.Hα-helixtrans-60.6-48.5172.2-75.1-66.3000111.4E705 L706 L711 N712 E713E705-Y709 HydrophobicContact CB-CD2 4.45Å; E705-Y709 HydrophobicContact CB-CE2 4.3Å; E705-Y709 WeakPolarHBondContact O-CD2 3.43Å; E705-Y709 PolarHBondContact O-N 3.12Å; L706-Y709 PolarHBondContact O-N 3.03Å; Y709-L711 PolarHBondContact O-N 3.48Å; Y709-N712 PolarHBondContact O-N 3Å; Y709-E713 VanDerWaalsContact O-CB 3.28Å; Y709-E713 WeakPolarHBondContact O-CB 3.41Å; Y709-E713 PolarHBondContact O-N 3.16Å
710Q77.4Confident76Confident78 Ų78105 Ų10536%0.36451%0.508SS..Hα-helixtrans-60.9-27.4174.8-72.7177.118.700113.5L706 K714L706-Q710 WeakPolarHBondContact O-CB 3.47Å; L706-Q710 VanDerWaalsContact O-CG 3.31Å; L706-Q710 WeakPolarHBondContact O-CG 3.49Å; L706-Q710 PolarHBondContact O-N 2.89Å; Q710-K714 WeakPolarHBondContact O-CB 3.22Å; Q710-K714 VanDerWaalsContact O-CD 3.22Å; Q710-K714 WeakPolarHBondContact O-CD 3.3Å; Q710-K714 WeakPolarHBondContact O-CG 3.5Å; Q710-K714 PolarHBondContact O-N 2.98Å
711L72.6Confident75.5Confident88 Ų88106.5 Ų106.546%0.46152%0.515SS..Hα-helixtrans-80.8-26.6174.4-176.361.1000112.3T707 M708 Y709 K715T707-L711 VanDerWaalsContact O-CB 3.31Å; T707-L711 WeakPolarHBondContact O-CB 3.44Å; T707-L711 PolarHBondContact O-N 3.46Å; M708-L711 CarbonylContact O-C 3.59Å; M708-L711 PolarHBondContact O-N 3.49Å; Y709-L711 PolarHBondContact O-N 3.48Å; L711-K715 WeakPolarHBondContact O-CD 3.41Å; L711-K715 WeakPolarHBondContact O-CG 3.31Å
712N71.6Confident75.3Confident73 Ų73107.4 Ų107.439%0.3952%0.52SS..Hα-helixtrans-79.2-47.7173.9-153.474000111.5M708 Y709 K714 K715 E716M708-N712 PolarHBondContact O-N 3.14Å; Y709-N712 PolarHBondContact O-N 3Å; N712-K714 PolarHBondContact O-N 2.82Å; N712-K715 CarbonylContact O-C 3.56Å; N712-K715 WeakPolarHBondContact O-CA 3.43Å; N712-K715 WeakPolarHBondContact O-CB 3.3Å; N712-K715 PolarHBondContact O-N 2.94Å; N712-E716 PolarHBondContact ND2-OE1 3.08Å; N712-E716 PolarHBondContact ND2-OE2 3.15Å; N712-E716 PolarHBondContact O-N 2.7Å
713E65Low75.4Confident121 Ų121109 Ų10957%0.56552%0.523SS*.Hα-helixtrans-52.8-39.9172.5-178.2-174.9-145.700111.4Y709 K715 E716 C717Y709-E713 VanDerWaalsContact O-CB 3.28Å; Y709-E713 WeakPolarHBondContact O-CB 3.41Å; Y709-E713 PolarHBondContact O-N 3.16Å; E713-K715 VanDerWaalsContact C-N 3.33Å; E713-K715 PolarHBondContact O-N 3.12Å; E713-E716 PolarHBondContact O-N 3.47Å; E713-C717 WeakPolarHBondContact O-CB 3.35Å; E713-C717 PolarHBondContact O-N 3.39Å
714K73.2Confident75.4Confident124 Ų124108.2 Ų108.254%0.53952%0.521SS..Hα-helixtrans-70.1-22.4173.3-75.7169-168.7161.20114.2Q710 N712 N718Q710-K714 WeakPolarHBondContact O-CB 3.22Å; Q710-K714 VanDerWaalsContact O-CD 3.22Å; Q710-K714 WeakPolarHBondContact O-CD 3.3Å; Q710-K714 WeakPolarHBondContact O-CG 3.5Å; Q710-K714 PolarHBondContact O-N 2.98Å; N712-K714 PolarHBondContact O-N 2.82Å; K714-N718 PolarHBondContact O-ND2 3.18Å
715K67.9Low75.6Confident119 Ų119109.1 Ų109.152%0.51753%0.525SS..Hα-helixtrans-82.6-43171.5-67.1164.4-171.7169.60110.6L711 N712 E713 N718 Q719L711-K715 WeakPolarHBondContact O-CD 3.41Å; L711-K715 WeakPolarHBondContact O-CG 3.31Å; N712-K715 CarbonylContact O-C 3.56Å; N712-K715 WeakPolarHBondContact O-CA 3.43Å; N712-K715 WeakPolarHBondContact O-CB 3.3Å; N712-K715 PolarHBondContact O-N 2.94Å; E713-K715 VanDerWaalsContact C-N 3.33Å; E713-K715 PolarHBondContact O-N 3.12Å; K715-N718 WeakPolarHBondContact O-CB 3.43Å; K715-N718 PolarHBondContact O-N 3.24Å; K715-Q719 PolarHBondContact O-N 3.38Å
716E63.7Low75.5Confident105 Ų105111.5 Ų111.549%0.49153%0.53SS..Hα-helixtrans-62.3-50.6177-73.3169.6133.900110.7N712 E713 N718 Q719 E720N712-E716 PolarHBondContact ND2-OE1 3.08Å; N712-E716 PolarHBondContact ND2-OE2 3.15Å; N712-E716 PolarHBondContact O-N 2.7Å; E713-E716 PolarHBondContact O-N 3.47Å; E716-N718 PolarHBondContact O-N 3.35Å; E716-Q719 CarbonylContact O-C 3.51Å; E716-Q719 WeakPolarHBondContact O-CA 3.27Å; E716-Q719 PolarHBondContact O-N 3.29Å; E716-E720 WeakPolarHBondContact O-CB 3.38Å; E716-E720 WeakPolarHBondContact O-CG 3.14Å; E716-E720 PolarHBondContact O-N 3.28Å
717C57Low76Confident55 Ų55111.7 Ų111.737%0.37253%0.531SS..Hα-helixtrans-56.8-34.6175.3177.10000113.2E713 H721E713-C717 WeakPolarHBondContact O-CB 3.35Å; E713-C717 PolarHBondContact O-N 3.39Å; C717-H721 WeakPolarHBondContact O-CB 3.38Å; C717-H721 PolarHBondContact O-N 3.41Å; C717-H721 PolarHBondContact O-ND1 3.33Å
718N70.2Confident76.4Confident113 Ų113112 Ų11260%0.60453%0.525SS*.Hα-helixtrans-69.3-40.5172.4-86.1-53.5000112.1K714 K715 E716 H721 V722K714-N718 PolarHBondContact O-ND2 3.18Å; K715-N718 WeakPolarHBondContact O-CB 3.43Å; K715-N718 PolarHBondContact O-N 3.24Å; E716-N718 PolarHBondContact O-N 3.35Å; N718-H721 PolarHBondContact O-N 3.44Å; N718-V722 WeakPolarHBondContact O-CG2 3.27Å; N718-V722 PolarHBondContact O-N 3.4Å
719Q75.7Confident76.6Confident134 Ų134110.2 Ų110.263%0.62652%0.515SS*.Hα-helixtrans-70.9-38.9177-174.6163.2-33.200112K715 E716 V722 L723K715-Q719 PolarHBondContact O-N 3.38Å; E716-Q719 CarbonylContact O-C 3.51Å; E716-Q719 WeakPolarHBondContact O-CA 3.27Å; E716-Q719 PolarHBondContact O-N 3.29Å; Q719-V722 PolarHBondContact O-N 2.92Å; Q719-L723 HydrophobicContact CG-CD1 4.36Å; Q719-L723 WeakPolarHBondContact O-CG 3.24Å; Q719-L723 PolarHBondContact O-N 3Å
720E72.8Confident76.8Confident126 Ų126107 Ų10759%0.58951%0.506SS*.Hα-helixtrans-61.7-41.3170.5-72-175.6144.900111.6E716 V722 L723 Y724E716-E720 WeakPolarHBondContact O-CB 3.38Å; E716-E720 WeakPolarHBondContact O-CG 3.14Å; E716-E720 PolarHBondContact O-N 3.28Å; E720-V722 VanDerWaalsContact C-N 3.31Å; E720-V722 PolarHBondContact O-N 3.42Å; E720-L723 PolarHBondContact O-N 3.28Å; E720-Y724 WeakPolarHBondContact O-CB 3.38Å; E720-Y724 PolarHBondContact O-N 3.46Å
721H78.3Confident77.4Confident126 Ų126107.9 Ų107.958%0.58351%0.51SS*.Hα-helixtrans-61-38.7173.2-89.473.8000112.3C717 N718 K725C717-H721 WeakPolarHBondContact O-CB 3.38Å; C717-H721 PolarHBondContact O-N 3.41Å; C717-H721 PolarHBondContact O-ND1 3.33Å; N718-H721 PolarHBondContact O-N 3.44Å; H721-K725 VanDerWaalsContact O-CB 3.28Å; H721-K725 WeakPolarHBondContact O-CB 3.07Å; H721-K725 PolarHBondContact O-N 2.9Å
722V82.8Confident78.2Confident90 Ų90106.3 Ų106.355%0.54551%0.51SS..Hα-helixtrans-68.1-41.8174.8171.90000111.5N718 Q719 E720 R726N718-V722 WeakPolarHBondContact O-CG2 3.27Å; N718-V722 PolarHBondContact O-N 3.4Å; Q719-V722 PolarHBondContact O-N 2.92Å; E720-V722 VanDerWaalsContact C-N 3.31Å; E720-V722 PolarHBondContact O-N 3.42Å; V722-R726 WeakPolarHBondContact O-CB 3.36Å; V722-R726 PolarHBondContact O-N 3.35Å
723L84.7Confident79.1Confident97 Ų97108.2 Ų108.251%0.50852%0.515SS..Hα-helixtrans-67.8-41.6176.9-70.6172.2000112.1Q719 E720 R726 L727Q719-L723 HydrophobicContact CG-CD1 4.36Å; Q719-L723 WeakPolarHBondContact O-CG 3.24Å; Q719-L723 PolarHBondContact O-N 3Å; E720-L723 PolarHBondContact O-N 3.28Å; L723-R726 PolarHBondContact O-N 3.46Å; L723-L727 WeakPolarHBondContact O-CB 3.36Å; L723-L727 PolarHBondContact O-N 3.42Å
724Y87.5Confident80.1Confident141 Ų141106.1 Ų106.155%0.55351%0.514SS*.Hα-helixtrans-65.8-40.4175.8180-98.7000111.8E720 L727 K728E720-Y724 WeakPolarHBondContact O-CB 3.38Å; E720-Y724 PolarHBondContact O-N 3.46Å; Y724-L727 PolarHBondContact O-N 2.86Å; Y724-K728 HydrophobicContact CE1-CG 4.16Å; Y724-K728 PolarHBondContact O-N 3.38Å
725K86.8Confident81Confident131 Ų131102.9 Ų102.957%0.5751%0.507SS*.Hα-helixtrans-61.7-47.4172.2-175.4174.6-174.4-80.80111.1H721 L727 K728 E729H721-K725 VanDerWaalsContact O-CB 3.28Å; H721-K725 WeakPolarHBondContact O-CB 3.07Å; H721-K725 PolarHBondContact O-N 2.9Å; K725-L727 VanDerWaalsContact C-N 3.33Å; K725-L727 PolarHBondContact O-N 3.42Å; K725-K728 PolarHBondContact O-N 2.97Å; K725-E729 WeakPolarHBondContact CE-OE1 3.49Å; K725-E729 WeakPolarHBondContact CG-OE1 3.41Å; K725-E729 IonicContact NZ-OE1 2.77Å; K725-E729 PolarHBondContact NZ-OE1 3.33Å; K725-E729 WeakPolarHBondContact O-CG 3.48Å; K725-E729 PolarHBondContact O-N 2.93Å
726R84.4Confident82.1Confident155 Ų155101.7 Ų101.759%0.58550%0.503SS*.Hα-helixtrans-61.3-39.9175.1-177.5177.5-69.9175.3-1.9112V722 L723 E729 E730V722-R726 WeakPolarHBondContact O-CB 3.36Å; V722-R726 PolarHBondContact O-N 3.35Å; L723-R726 PolarHBondContact O-N 3.46Å; R726-E729 PolarHBondContact O-N 3.29Å; R726-E730 WeakPolarHBondContact O-CB 3.18Å; R726-E730 PolarHBondContact O-N 3.28Å
727L88.3Confident83.5Confident104 Ų104101.8 Ų101.855%0.54551%0.506SS..Hα-helixtrans-62.6-44.1176.5-179.862.7000111.2L723 Y724 K725 E730 E731L723-L727 WeakPolarHBondContact O-CB 3.36Å; L723-L727 PolarHBondContact O-N 3.42Å; Y724-L727 PolarHBondContact O-N 2.86Å; K725-L727 VanDerWaalsContact C-N 3.33Å; K725-L727 PolarHBondContact O-N 3.42Å; L727-E730 PolarHBondContact O-N 2.94Å; L727-E731 VanDerWaalsContact O-CB 3.28Å; L727-E731 WeakPolarHBondContact O-CB 3.23Å; L727-E731 PolarHBondContact O-N 3.23Å
728K89.1Confident85.1Confident88 Ų88102.6 Ų102.638%0.38351%0.512SS..Hα-helixtrans-67.3-34.2175-78.5-71.8170-155.30113.2Y724 K725 E731 A732Y724-K728 HydrophobicContact CE1-CG 4.16Å; Y724-K728 PolarHBondContact O-N 3.38Å; K725-K728 PolarHBondContact O-N 2.97Å; K728-E731 WeakPolarHBondContact CD-OE2 3.38Å; K728-E731 WeakPolarHBondContact CE-OE2 3.27Å; K728-E731 IonicContact NZ-OE1 3.23Å; K728-E731 PolarHBondContact NZ-OE1 3.43Å; K728-E731 IonicContact NZ-OE2 2.88Å; K728-E731 PolarHBondContact NZ-OE2 3.42Å; K728-A732 WeakPolarHBondContact O-CB 3.3Å; K728-A732 PolarHBondContact O-N 2.7Å
729E83.8Confident86.2Confident83 Ų83103.7 Ų103.739%0.38851%0.508SS..Hα-helixtrans-65.1-38.4170.9-72.4166.2-175.800111.9K725 R726 K733K725-E729 WeakPolarHBondContact CE-OE1 3.49Å; K725-E729 WeakPolarHBondContact CG-OE1 3.41Å; K725-E729 IonicContact NZ-OE1 2.77Å; K725-E729 PolarHBondContact NZ-OE1 3.33Å; K725-E729 WeakPolarHBondContact O-CG 3.48Å; K725-E729 PolarHBondContact O-N 2.93Å; R726-E729 PolarHBondContact O-N 3.29Å; E729-K733 WeakPolarHBondContact O-CG 3.4Å; E729-K733 PolarHBondContact O-N 2.77Å
730E81.1Confident87Confident96 Ų96101.7 Ų101.745%0.44950%0.498SS..Hα-helixtrans-76.2-36.8178.1-146.463.4-146.800112.7R726 L727 A732 K733 S734R726-E730 WeakPolarHBondContact O-CB 3.18Å; R726-E730 PolarHBondContact O-N 3.28Å; L727-E730 PolarHBondContact O-N 2.94Å; E730-A732 VanDerWaalsContact C-N 3.3Å; E730-A732 PolarHBondContact O-N 3.38Å; E730-K733 PolarHBondContact O-N 3.06Å; E730-K733 IonicContact OE1-NZ 3.55Å; E730-K733 IonicContact OE2-NZ 2.64Å; E730-K733 PolarHBondContact OE2-NZ 2.97Å; E730-S734 WeakPolarHBondContact O-CB 3.26Å; E730-S734 PolarHBondContact O-N 2.81Å
731E89Confident88Confident96 Ų9698.8 Ų98.845%0.44949%0.489SS..Hα-helixtrans-60.3-39.7171.3-174.9-174.5143.100111.1L727 K728 S734 S735L727-E731 VanDerWaalsContact O-CB 3.28Å; L727-E731 WeakPolarHBondContact O-CB 3.23Å; L727-E731 PolarHBondContact O-N 3.23Å; K728-E731 WeakPolarHBondContact CD-OE2 3.38Å; K728-E731 WeakPolarHBondContact CE-OE2 3.27Å; K728-E731 IonicContact NZ-OE1 3.23Å; K728-E731 PolarHBondContact NZ-OE1 3.43Å; K728-E731 IonicContact NZ-OE2 2.88Å; K728-E731 PolarHBondContact NZ-OE2 3.42Å; E731-S734 PolarHBondContact O-N 3.42Å; E731-S735 VanDerWaalsContact O-CB 3.29Å; E731-S735 WeakPolarHBondContact O-CB 3.34Å; E731-S735 PolarHBondContact O-N 3.07Å
732A88.8Confident88.7Confident56 Ų5696.6 Ų96.646%0.46349%0.485SS..Hα-helixtrans-65.6-40.5174.100000112.7K728 E730 S735 H736K728-A732 WeakPolarHBondContact O-CB 3.3Å; K728-A732 PolarHBondContact O-N 2.7Å; E730-A732 VanDerWaalsContact C-N 3.3Å; E730-A732 PolarHBondContact O-N 3.38Å; A732-S735 WeakPolarHBondContact O-CB 3.37Å; A732-H736 PolarHBondContact O-N 3.27Å
733K92.1Very high89.1Confident112 Ų11294.7 Ų94.749%0.48748%0.479SS..Hα-helixtrans-65.5-44.5173.1-65.8168.8-153.2165.40111.7E729 E730 S735 H736 L737E729-K733 WeakPolarHBondContact O-CG 3.4Å; E729-K733 PolarHBondContact O-N 2.77Å; E730-K733 PolarHBondContact O-N 3.06Å; E730-K733 IonicContact OE1-NZ 3.55Å; E730-K733 IonicContact OE2-NZ 2.64Å; E730-K733 PolarHBondContact OE2-NZ 2.97Å; K733-S735 VanDerWaalsContact C-N 3.34Å; K733-S735 PolarHBondContact O-N 3.32Å; K733-H736 WeakPolarHBondContact O-CB 3.5Å; K733-H736 PolarHBondContact O-N 3.09Å; K733-L737 PolarHBondContact O-N 2.83Å
734S85.6Confident89.5Confident78 Ų7895.3 Ų95.355%0.54548%0.482SS..Hα-helixtrans-61.2-42.3176.7-1740000111.5E730 E731 H736 L737 S738E730-S734 WeakPolarHBondContact O-CB 3.26Å; E730-S734 PolarHBondContact O-N 2.81Å; E731-S734 PolarHBondContact O-N 3.42Å; S734-H736 VanDerWaalsContact C-N 3.32Å; S734-H736 PolarHBondContact O-N 3.03Å; S734-L737 PolarHBondContact O-N 2.84Å; S734-S738 VanDerWaalsContact O-CB 3.26Å; S734-S738 WeakPolarHBondContact O-CB 3.42Å; S734-S738 PolarHBondContact O-N 3.25Å
735S90.8Very high89.7Confident56 Ų5694.5 Ų94.539%0.39248%0.481SS..Hα-helixtrans-59-39.6170.6172.50000112.7E731 A732 K733 R739E731-S735 VanDerWaalsContact O-CB 3.29Å; E731-S735 WeakPolarHBondContact O-CB 3.34Å; E731-S735 PolarHBondContact O-N 3.07Å; A732-S735 WeakPolarHBondContact O-CB 3.37Å; K733-S735 VanDerWaalsContact C-N 3.34Å; K733-S735 PolarHBondContact O-N 3.32Å; S735-R739 WeakPolarHBondContact O-CG 3.35Å; S735-R739 PolarHBondContact O-N 3.12Å; S735-R739 VanDerWaalsContact O-N 3.15Å; S735-R739 PolarHBondContact O-NE 2.97Å; S735-R739 PolarHBondContact OG-NE 3.06Å; S735-R739 PolarHBondContact OG-NH2 3.31Å
736H91.9Very high90Very high94 Ų9494.7 Ų94.744%0.43548%0.484SS..Hα-helixtrans-69.5-47.7177.8-168.7-18.2000111.7A732 K733 S734 S738 R739 E740A732-H736 PolarHBondContact O-N 3.27Å; K733-H736 WeakPolarHBondContact O-CB 3.5Å; K733-H736 PolarHBondContact O-N 3.09Å; S734-H736 VanDerWaalsContact C-N 3.32Å; S734-H736 PolarHBondContact O-N 3.03Å; H736-S738 VanDerWaalsContact C-N 3.3Å; H736-S738 PolarHBondContact O-N 2.64Å; H736-R739 WeakPolarHBondContact O-CB 3.31Å; H736-R739 PolarHBondContact O-N 3.48Å; H736-R739 VanDerWaalsContact O-N 3.13Å; H736-E740 IonicContact CE1-OE1 3.06Å; H736-E740 PolarHBondContact CE1-OE1 3.41Å; H736-E740 IonicContact ND1-OE1 2.81Å; H736-E740 WeakPolarHBondContact O-CG 3.36Å; H736-E740 PolarHBondContact O-N 2.94Å
737L92.3Very high90.5Very high106 Ų10692.1 Ų92.156%0.55548%0.477SS*.Hα-helixtrans-62.9-37.4177.8-175.562.4000111.5K733 S734 E740 V741K733-L737 PolarHBondContact O-N 2.83Å; S734-L737 PolarHBondContact O-N 2.84Å; L737-E740 PolarHBondContact O-N 3.1Å; L737-V741 WeakPolarHBondContact O-CB 3.45Å; L737-V741 VanDerWaalsContact O-CG2 3.31Å; L737-V741 WeakPolarHBondContact O-CG2 3.44Å; L737-V741 PolarHBondContact O-N 2.95Å
738S91.2Very high90.7Very high72 Ų7291.9 Ų91.950%0.50348%0.475SS..Hα-helixtrans-61.3-43.7173-173.10000111.7S734 H736 V741 T742S734-S738 VanDerWaalsContact O-CB 3.26Å; S734-S738 WeakPolarHBondContact O-CB 3.42Å; S734-S738 PolarHBondContact O-N 3.25Å; H736-S738 VanDerWaalsContact C-N 3.3Å; H736-S738 PolarHBondContact O-N 2.64Å; S738-V741 PolarHBondContact O-N 3.32Å; S738-T742 PolarHBondContact O-N 3.08Å; S738-T742 PolarHBondContact O-OG1 3.48Å
739R93.8Very high90.9Very high137 Ų13793.9 Ų93.952%0.51749%0.486SS..Hα-helixtrans-63.9-39174.7-80.2174.4-79.4131.1-8.3113S735 H736 T742 A743S735-R739 WeakPolarHBondContact O-CG 3.35Å; S735-R739 PolarHBondContact O-N 3.12Å; S735-R739 VanDerWaalsContact O-N 3.15Å; S735-R739 PolarHBondContact O-NE 2.97Å; S735-R739 PolarHBondContact OG-NE 3.06Å; S735-R739 PolarHBondContact OG-NH2 3.31Å; H736-R739 WeakPolarHBondContact O-CB 3.31Å; H736-R739 PolarHBondContact O-N 3.48Å; H736-R739 VanDerWaalsContact O-N 3.13Å; R739-T742 WeakPolarHBondContact CA-OG1 3.42Å; R739-T742 PolarHBondContact O-N 3.01Å; R739-T742 PolarHBondContact O-OG1 3.02Å; R739-A743 WeakPolarHBondContact O-CB 3.34Å; R739-A743 PolarHBondContact O-N 3.06Å
740E91.6Very high91.3Very high91 Ų9195.8 Ų95.843%0.42550%0.495SS..Hα-helixtrans-65.1-43.3173.2-69.7177.3152.400111.6H736 L737 T742 A743 L744H736-E740 IonicContact CE1-OE1 3.06Å; H736-E740 PolarHBondContact CE1-OE1 3.41Å; H736-E740 IonicContact ND1-OE1 2.81Å; H736-E740 WeakPolarHBondContact O-CG 3.36Å; H736-E740 PolarHBondContact O-N 2.94Å; L737-E740 PolarHBondContact O-N 3.1Å; E740-T742 VanDerWaalsContact C-N 3.33Å; E740-T742 PolarHBondContact O-N 2.77Å; E740-A743 PolarHBondContact O-N 3.43Å; E740-L744 WeakPolarHBondContact O-CB 3.02Å; E740-L744 VanDerWaalsContact O-CG 3.28Å; E740-L744 WeakPolarHBondContact O-CG 3.45Å; E740-L744 PolarHBondContact O-N 2.82Å
741V93.6Very high91.9Very high66 Ų6698 Ų9840%0.450%0.5SS..Hα-helixtrans-63.4-37175.5168.10000111.7L737 S738 K745L737-V741 WeakPolarHBondContact O-CB 3.45Å; L737-V741 VanDerWaalsContact O-CG2 3.31Å; L737-V741 WeakPolarHBondContact O-CG2 3.44Å; L737-V741 PolarHBondContact O-N 2.95Å; S738-V741 PolarHBondContact O-N 3.32Å; V741-K745 HydrophobicContact CG1-CD 4.4Å; V741-K745 WeakPolarHBondContact O-CB 3.49Å; V741-K745 VanDerWaalsContact O-CG 3.29Å; V741-K745 WeakPolarHBondContact O-CG 3.44Å; V741-K745 PolarHBondContact O-N 3.18Å
742T92.9Very high92Very high79 Ų7998.3 Ų98.349%0.48550%0.503SS..Hα-helixtrans-69.2-42.4173.147.50000112.5S738 R739 E740 L744 K745 E746S738-T742 PolarHBondContact O-N 3.08Å; S738-T742 PolarHBondContact O-OG1 3.48Å; R739-T742 WeakPolarHBondContact CA-OG1 3.42Å; R739-T742 PolarHBondContact O-N 3.01Å; R739-T742 PolarHBondContact O-OG1 3.02Å; E740-T742 VanDerWaalsContact C-N 3.33Å; E740-T742 PolarHBondContact O-N 2.77Å; T742-L744 VanDerWaalsContact C-N 3.35Å; T742-L744 PolarHBondContact O-N 3.08Å; T742-K745 WeakPolarHBondContact O-CB 3.34Å; T742-K745 PolarHBondContact O-N 3.38Å; T742-E746 WeakPolarHBondContact O-CB 3.49Å; T742-E746 PolarHBondContact O-N 2.98Å
743A92.6Very high92.1Very high51 Ų5197.1 Ų97.142%0.42150%0.496SS..Hα-helixtrans-65.8-36.517700000112.3R739 E740 E746 K747R739-A743 WeakPolarHBondContact O-CB 3.34Å; R739-A743 PolarHBondContact O-N 3.06Å; E740-A743 PolarHBondContact O-N 3.43Å; A743-E746 PolarHBondContact O-N 3.4Å; A743-K747 VanDerWaalsContact O-CB 3.31Å; A743-K747 WeakPolarHBondContact O-CB 3.4Å; A743-K747 PolarHBondContact O-N 2.67Å
744L91.9Very high92.1Very high109 Ų10995.3 Ų95.357%0.57150%0.495SS*.Hα-helixtrans-66.5-39.8172.4-73.7169.6000111.7E740 T742 I748E740-L744 WeakPolarHBondContact O-CB 3.02Å; E740-L744 VanDerWaalsContact O-CG 3.28Å; E740-L744 WeakPolarHBondContact O-CG 3.45Å; E740-L744 PolarHBondContact O-N 2.82Å; T742-L744 VanDerWaalsContact C-N 3.35Å; T742-L744 PolarHBondContact O-N 3.08Å; L744-I748 WeakPolarHBondContact O-CB 3.44Å; L744-I748 WeakPolarHBondContact O-CD1 3.38Å; L744-I748 VanDerWaalsContact O-CG1 3.22Å; L744-I748 WeakPolarHBondContact O-CG1 3.5Å; L744-I748 PolarHBondContact O-N 3.02Å
745K92.6Very high92.2Very high124 Ų12497.7 Ų97.754%0.53950%0.497SS..Hα-helixtrans-62.8-46.9173-78.2173.5179-177.60111.7V741 T742 I748 H749V741-K745 HydrophobicContact CG1-CD 4.4Å; V741-K745 WeakPolarHBondContact O-CB 3.49Å; V741-K745 VanDerWaalsContact O-CG 3.29Å; V741-K745 WeakPolarHBondContact O-CG 3.44Å; V741-K745 PolarHBondContact O-N 3.18Å; T742-K745 WeakPolarHBondContact O-CB 3.34Å; T742-K745 PolarHBondContact O-N 3.38Å; K745-I748 PolarHBondContact O-N 2.82Å; K745-H749 PolarHBondContact O-N 2.66Å; K745-H749 VanDerWaalsContact O-N 3.09Å; K745-H749 PolarHBondContact O-ND1 3.42Å
746E91.9Very high92.3Very high136 Ų136100.2 Ų100.264%0.63650%0.503SS*.Hα-helixtrans-57.2-50.7176.9-176.9168.5-146.500110.7T742 A743 I748 H749 E750T742-E746 WeakPolarHBondContact O-CB 3.49Å; T742-E746 PolarHBondContact O-N 2.98Å; A743-E746 PolarHBondContact O-N 3.4Å; E746-I748 VanDerWaalsContact C-N 3.29Å; E746-I748 PolarHBondContact O-N 2.83Å; E746-H749 CarbonylContact O-C 3.59Å; E746-H749 WeakPolarHBondContact O-CA 3.33Å; E746-H749 WeakPolarHBondContact O-CB 3.46Å; E746-H749 PolarHBondContact O-N 3.26Å; E746-E750 PolarHBondContact O-N 3.05Å
747K95.2Very high92.2Very high101 Ų10198.4 Ų98.444%0.43950%0.501SS..Hα-helixtrans-62.4-30.6177.4-166.3168.7-171.5172.30114A743 E750 Y751A743-K747 VanDerWaalsContact O-CB 3.31Å; A743-K747 WeakPolarHBondContact O-CB 3.4Å; A743-K747 PolarHBondContact O-N 2.67Å; K747-E750 PolarHBondContact O-N 3.48Å; K747-Y751 HydrophobicContact CD-CE2 4.15Å; K747-Y751 WeakPolarHBondContact CE-OH 3.46Å; K747-Y751 HydrophobicContact CG-CD2 4.07Å; K747-Y751 HydrophobicContact CG-CE2 3.7Å; K747-Y751 WeakPolarHBondContact O-CD2 3.37Å; K747-Y751 PolarHBondContact O-N 3.05Å
748I93.8Very high92.2Very high98 Ų9898.3 Ų98.350%0.50350%0.5SS..Hα-helixtrans-66.7-40170.9-73.9163.4000111L744 K745 E746 Y751 M752L744-I748 WeakPolarHBondContact O-CB 3.44Å; L744-I748 WeakPolarHBondContact O-CD1 3.38Å; L744-I748 VanDerWaalsContact O-CG1 3.22Å; L744-I748 WeakPolarHBondContact O-CG1 3.5Å; L744-I748 PolarHBondContact O-N 3.02Å; K745-I748 PolarHBondContact O-N 2.82Å; E746-I748 VanDerWaalsContact C-N 3.29Å; E746-I748 PolarHBondContact O-N 2.83Å; I748-Y751 PolarHBondContact O-N 2.88Å; I748-M752 HydrophobicContact CG2-SD 4.44Å; I748-M752 WeakPolarHBondContact O-CG 3.47Å; I748-M752 PolarHBondContact O-N 2.84Å
749H92.4Very high92.2Very high131 Ų13198.3 Ų98.361%0.60650%0.499SS*.Hα-helixtrans-69.3-35.9175.2-69.175.1000111.8K745 E746 M752 G753K745-H749 PolarHBondContact O-N 2.66Å; K745-H749 VanDerWaalsContact O-N 3.09Å; K745-H749 PolarHBondContact O-ND1 3.42Å; E746-H749 CarbonylContact O-C 3.59Å; E746-H749 WeakPolarHBondContact O-CA 3.33Å; E746-H749 WeakPolarHBondContact O-CB 3.46Å; E746-H749 PolarHBondContact O-N 3.26Å; H749-M752 PolarHBondContact O-N 3.38Å; H749-G753 PolarHBondContact O-N 2.85Å
750E92.9Very high92.1Very high123 Ų12397.6 Ų97.658%0.57550%0.496SS*.Hα-helixtrans-58.3-49.5169.3-66.6-174.2134.500111.1E746 K747 M752 G753 T754E746-E750 PolarHBondContact O-N 3.05Å; K747-E750 PolarHBondContact O-N 3.48Å; E750-M752 PolarHBondContact O-N 2.93Å; E750-G753 WeakPolarHBondContact O-CA 3.39Å; E750-G753 PolarHBondContact O-N 3.01Å; E750-G753 VanDerWaalsContact O-N 3.12Å; E750-T754 PolarHBondContact O-N 3.26Å
751Y92.6Very high92.2Very high141 Ų14199.4 Ų99.455%0.55351%0.506SS*.Hα-helixtrans-61.3-43.2178.6-77.6-52.9000112.2K747 I748 G753 T754 E755K747-Y751 HydrophobicContact CD-CE2 4.15Å; K747-Y751 WeakPolarHBondContact CE-OH 3.46Å; K747-Y751 HydrophobicContact CG-CD2 4.07Å; K747-Y751 HydrophobicContact CG-CE2 3.7Å; K747-Y751 WeakPolarHBondContact O-CD2 3.37Å; K747-Y751 PolarHBondContact O-N 3.05Å; I748-Y751 PolarHBondContact O-N 2.88Å; Y751-G753 VanDerWaalsContact C-N 3.33Å; Y751-G753 PolarHBondContact O-N 3.02Å; Y751-T754 WeakPolarHBondContact CA-OG1 3.44Å; Y751-T754 PolarHBondContact O-N 2.98Å; Y751-T754 VanDerWaalsContact O-N 3.15Å; Y751-T754 PolarHBondContact O-OG1 3.41Å; Y751-E755 PolarHBondContact O-N 3.46Å
752M91.2Very high92.1Very high103 Ų103103.5 Ų103.551%0.50752%0.519SS..Hα-helixtrans-58.6-43.4172.3-72.4178.864.200111.8I748 H749 E750 T754 E755 E756I748-M752 HydrophobicContact CG2-SD 4.44Å; I748-M752 WeakPolarHBondContact O-CG 3.47Å; I748-M752 PolarHBondContact O-N 2.84Å; H749-M752 PolarHBondContact O-N 3.38Å; E750-M752 PolarHBondContact O-N 2.93Å; M752-T754 VanDerWaalsContact C-N 3.31Å; M752-T754 PolarHBondContact O-N 2.86Å; M752-E755 PolarHBondContact O-N 2.72Å; M752-E756 PolarHBondContact O-N 3.47Å
753G91.2Very high92.1Very high32 Ų32104 Ų10433%0.3352%0.521SS..Hα-helixtrans-60.8-36.8174.900000113.3H749 E750 Y751 S757H749-G753 PolarHBondContact O-N 2.85Å; E750-G753 WeakPolarHBondContact O-CA 3.39Å; E750-G753 PolarHBondContact O-N 3.01Å; E750-G753 VanDerWaalsContact O-N 3.12Å; Y751-G753 VanDerWaalsContact C-N 3.33Å; Y751-G753 PolarHBondContact O-N 3.02Å; G753-S757 WeakPolarHBondContact O-CB 3.44Å; G753-S757 PolarHBondContact O-N 2.94Å; G753-S757 VanDerWaalsContact O-N 3.13Å
754T91.6Very high92.1Very high73 Ų73106.1 Ų106.145%0.44853%0.526SS..Hα-helixtrans-70.5-39.3172.863.90000112.6E750 Y751 M752 S757 I758E750-T754 PolarHBondContact O-N 3.26Å; Y751-T754 WeakPolarHBondContact CA-OG1 3.44Å; Y751-T754 PolarHBondContact O-N 2.98Å; Y751-T754 VanDerWaalsContact O-N 3.15Å; Y751-T754 PolarHBondContact O-OG1 3.41Å; M752-T754 VanDerWaalsContact C-N 3.31Å; M752-T754 PolarHBondContact O-N 2.86Å; T754-S757 WeakPolarHBondContact O-CB 3.14Å; T754-S757 PolarHBondContact O-N 2.84Å; T754-S757 VanDerWaalsContact O-N 3.11Å; T754-I758 WeakPolarHBondContact O-CG1 3.31Å; T754-I758 PolarHBondContact O-N 3.05Å
755E88.2Confident92.2Very high129 Ų129106.7 Ų106.760%0.60353%0.525SS*.Hα-helixtrans-64.4-43.5177-176.8171.9-150.500111.6Y751 M752 S757 I758 C759Y751-E755 PolarHBondContact O-N 3.46Å; M752-E755 PolarHBondContact O-N 2.72Å; E755-S757 VanDerWaalsContact C-N 3.27Å; E755-S757 PolarHBondContact O-N 3.16Å; E755-I758 PolarHBondContact O-N 3.45Å; E755-C759 WeakPolarHBondContact O-CB 3.2Å; E755-C759 PolarHBondContact O-N 2.96Å; E755-C759 PolarHBondContact O-SG 3.17Å
756E92.4Very high92.2Very high109 Ų109103.1 Ų103.151%0.50952%0.516SS..Hα-helixtrans-58.7-40.1170.2-72.7-172.1-173.600112M752 C759 R760M752-E756 PolarHBondContact O-N 3.47Å; E756-C759 WeakPolarHBondContact O-CB 3.49Å; E756-C759 PolarHBondContact O-N 2.91Å; E756-R760 WeakPolarHBondContact O-CG 3.23Å; E756-R760 PolarHBondContact O-N 3.4Å; E756-R760 IonicContact OE2-CZ 2.66Å; E756-R760 IonicContact OE2-NH1 2.61Å; E756-R760 PolarHBondContact OE2-NH1 3.03Å; E756-R760 IonicContact OE2-NH2 3.92Å
757S90.1Very high92.3Very high56 Ų5698.8 Ų98.839%0.39250%0.498SS..Hα-helixtrans-65.9-40.1179.7-147.70000111.7G753 T754 E755 R760 M761G753-S757 WeakPolarHBondContact O-CB 3.44Å; G753-S757 PolarHBondContact O-N 2.94Å; G753-S757 VanDerWaalsContact O-N 3.13Å; T754-S757 WeakPolarHBondContact O-CB 3.14Å; T754-S757 PolarHBondContact O-N 2.84Å; T754-S757 VanDerWaalsContact O-N 3.11Å; E755-S757 VanDerWaalsContact C-N 3.27Å; E755-S757 PolarHBondContact O-N 3.16Å; S757-R760 PolarHBondContact O-N 3.26Å; S757-M761 WeakPolarHBondContact O-CB 3.4Å; S757-M761 PolarHBondContact O-N 3.49Å
758I92.8Very high92.3Very high104 Ų10499.3 Ų99.353%0.53351%0.506SS..Hα-helixtrans-64.4-41.4172.5-67.2163000110.5T754 E755 M761 K762T754-I758 WeakPolarHBondContact O-CG1 3.31Å; T754-I758 PolarHBondContact O-N 3.05Å; E755-I758 PolarHBondContact O-N 3.45Å; I758-M761 PolarHBondContact O-N 2.96Å; I758-K762 VanDerWaalsContact O-CB 3.26Å; I758-K762 WeakPolarHBondContact O-CB 3.31Å; I758-K762 PolarHBondContact O-N 3Å
759C91.2Very high92.1Very high71 Ų71100.3 Ų100.348%0.4851%0.508SS..Hα-helixtrans-62.8-41.6175.3-71.60000112.8E755 E756 T763E755-C759 WeakPolarHBondContact O-CB 3.2Å; E755-C759 PolarHBondContact O-N 2.96Å; E755-C759 PolarHBondContact O-SG 3.17Å; E756-C759 WeakPolarHBondContact O-CB 3.49Å; E756-C759 PolarHBondContact O-N 2.91Å; C759-T763 PolarHBondContact O-N 3.48Å; C759-T763 VanDerWaalsContact O-N 3.14Å; C759-T763 PolarHBondContact O-OG1 3.16Å
760R92.3Very high92.1Very high123 Ų123101.9 Ų101.946%0.46451%0.509SS..Hα-helixtrans-61.1-54.9172.1-73-177.9-70-99.6-0.8110.7E756 S757 K762 T763 D764E756-R760 WeakPolarHBondContact O-CG 3.23Å; E756-R760 PolarHBondContact O-N 3.4Å; E756-R760 IonicContact OE2-CZ 2.66Å; E756-R760 IonicContact OE2-NH1 2.61Å; E756-R760 PolarHBondContact OE2-NH1 3.03Å; E756-R760 IonicContact OE2-NH2 3.92Å; S757-R760 PolarHBondContact O-N 3.26Å; R760-K762 VanDerWaalsContact C-N 3.3Å; R760-K762 PolarHBondContact O-N 2.87Å; R760-T763 CarbonylContact O-C 3.53Å; R760-T763 WeakPolarHBondContact O-CA 3.49Å; R760-T763 WeakPolarHBondContact O-CB 3.2Å; R760-T763 PolarHBondContact O-N 2.8Å; R760-D764 PolarHBondContact O-N 3.26Å
761M92.8Very high92.2Very high128 Ų128102.1 Ų102.163%0.63151%0.508SS*.Hα-helixtrans-55.7-41179.6-171.3-166.4-59.800112.9S757 I758 T763 D764 H765S757-M761 WeakPolarHBondContact O-CB 3.4Å; S757-M761 PolarHBondContact O-N 3.49Å; I758-M761 PolarHBondContact O-N 2.96Å; M761-T763 VanDerWaalsContact C-N 3.33Å; M761-T763 PolarHBondContact O-N 3.47Å; M761-D764 PolarHBondContact O-N 3.35Å; M761-H765 WeakPolarHBondContact O-CB 3.49Å; M761-H765 PolarHBondContact O-N 2.91Å
762K92.1Very high92.2Very high153 Ų153100.4 Ų100.467%0.66551%0.508SS*.Hα-helixtrans-65.2-35.7175.7-173.9176.7-178.9179.30112.3I758 R760 S766I758-K762 VanDerWaalsContact O-CB 3.26Å; I758-K762 WeakPolarHBondContact O-CB 3.31Å; I758-K762 PolarHBondContact O-N 3Å; R760-K762 VanDerWaalsContact C-N 3.3Å; R760-K762 PolarHBondContact O-N 2.87Å; K762-S766 WeakPolarHBondContact O-CB 3.37Å; K762-S766 PolarHBondContact O-N 3.37Å; K762-S766 PolarHBondContact O-OG 3.16Å
763T92.3Very high92.2Very high88 Ų8898.7 Ų98.754%0.5450%0.503SS..Hα-helixtrans-72-40.2176.3-55.30000111.5C759 R760 M761 S766 T767C759-T763 PolarHBondContact O-N 3.48Å; C759-T763 VanDerWaalsContact O-N 3.14Å; C759-T763 PolarHBondContact O-OG1 3.16Å; R760-T763 CarbonylContact O-C 3.53Å; R760-T763 WeakPolarHBondContact O-CA 3.49Å; R760-T763 WeakPolarHBondContact O-CB 3.2Å; R760-T763 PolarHBondContact O-N 2.8Å; M761-T763 VanDerWaalsContact C-N 3.33Å; M761-T763 PolarHBondContact O-N 3.47Å; T763-S766 PolarHBondContact O-N 2.89Å; T763-T767 WeakPolarHBondContact O-CB 3.44Å; T763-T767 PolarHBondContact O-N 2.93Å; T763-T767 PolarHBondContact O-OG1 3.04Å
764D93.3Very high92.3Very high97 Ų97102 Ų10252%0.51951%0.51SS..Hα-helixtrans-66.5-44.6174.8-69.2-37.9000111.6R760 M761 S766 T767 L768R760-D764 PolarHBondContact O-N 3.26Å; M761-D764 PolarHBondContact O-N 3.35Å; D764-S766 PolarHBondContact O-N 3.5Å; D764-T767 CarbonylContact O-C 3.55Å; D764-T767 WeakPolarHBondContact O-CB 3.45Å; D764-T767 PolarHBondContact O-N 3.42Å; D764-T767 VanDerWaalsContact O-N 3.09Å; D764-L768 WeakPolarHBondContact O-CB 3.32Å; D764-L768 WeakPolarHBondContact O-CG 3.49Å; D764-L768 PolarHBondContact O-N 3.42Å
765H92.9Very high92.3Very high121 Ų121104 Ų10456%0.5651%0.514SS*.Hα-helixtrans-56.9-48.2172.8-179.187.4000111.6M761 T767 L768 Q769M761-H765 WeakPolarHBondContact O-CB 3.49Å; M761-H765 PolarHBondContact O-N 2.91Å; H765-T767 PolarHBondContact O-N 3.23Å; H765-L768 PolarHBondContact O-N 2.83Å; H765-Q769 WeakPolarHBondContact O-CB 3.47Å; H765-Q769 PolarHBondContact O-N 2.66Å
766S93.9Very high92.5Very high48 Ų48101.8 Ų101.834%0.33650%0.504SS..Hα-helixtrans-60.4-33.2175.8-56.80000112.5K762 T763 D764 R770K762-S766 WeakPolarHBondContact O-CB 3.37Å; K762-S766 PolarHBondContact O-N 3.37Å; K762-S766 PolarHBondContact O-OG 3.16Å; T763-S766 PolarHBondContact O-N 2.89Å; D764-S766 PolarHBondContact O-N 3.5Å; S766-R770 WeakPolarHBondContact O-CB 3.42Å; S766-R770 PolarHBondContact O-N 2.95Å
767T93.2Very high92.5Very high45 Ų45100.3 Ų100.328%0.27650%0.502SS..Hα-helixtrans-78.1-37.4178.4-60.40000112T763 D764 H765 R770 K771T763-T767 WeakPolarHBondContact O-CB 3.44Å; T763-T767 PolarHBondContact O-N 2.93Å; T763-T767 PolarHBondContact O-OG1 3.04Å; D764-T767 CarbonylContact O-C 3.55Å; D764-T767 WeakPolarHBondContact O-CB 3.45Å; D764-T767 PolarHBondContact O-N 3.42Å; D764-T767 VanDerWaalsContact O-N 3.09Å; H765-T767 PolarHBondContact O-N 3.23Å; T767-R770 PolarHBondContact O-N 3.42Å; T767-K771 WeakPolarHBondContact O-CG 3.42Å; T767-K771 PolarHBondContact O-N 2.9Å
768L94.1Very high92.7Very high113 Ų113104 Ų10459%0.59251%0.507SS*.Hα-helixtrans-64.9-44.2172.2-78.1163000111.2D764 H765 R770 K771 L772D764-L768 WeakPolarHBondContact O-CB 3.32Å; D764-L768 WeakPolarHBondContact O-CG 3.49Å; D764-L768 PolarHBondContact O-N 3.42Å; H765-L768 PolarHBondContact O-N 2.83Å; L768-R770 VanDerWaalsContact C-N 3.31Å; L768-R770 PolarHBondContact O-N 3.47Å; L768-K771 PolarHBondContact O-N 3.41Å; L768-K771 VanDerWaalsContact O-N 3.12Å; L768-L772 WeakPolarHBondContact O-CB 3.47Å; L768-L772 PolarHBondContact O-N 3.31Å
769Q91.3Very high92.8Very high118 Ų118103.5 Ų103.555%0.55151%0.506SS*.Hα-helixtrans-60-40.2174.6-167.2179.731.500111.8H765 T773H765-Q769 WeakPolarHBondContact O-CB 3.47Å; H765-Q769 PolarHBondContact O-N 2.66Å; Q769-T773 WeakPolarHBondContact O-CG2 3.39Å; Q769-T773 PolarHBondContact O-N 3.36Å; Q769-T773 PolarHBondContact O-OG1 3.37Å
770R92.5Very high92.9Very high164 Ų164106 Ų10662%0.61951%0.509SS*.Hα-helixtrans-67.1-37.3173.3-163.8-173.5-58.1130.55.1112.8S766 T767 L768 T773 Q774S766-R770 WeakPolarHBondContact O-CB 3.42Å; S766-R770 PolarHBondContact O-N 2.95Å; T767-R770 PolarHBondContact O-N 3.42Å; L768-R770 VanDerWaalsContact C-N 3.31Å; L768-R770 PolarHBondContact O-N 3.47Å; R770-T773 WeakPolarHBondContact CA-OG1 3.39Å; R770-T773 PolarHBondContact O-OG1 2.98Å; R770-Q774 VanDerWaalsContact O-CB 3.3Å; R770-Q774 WeakPolarHBondContact O-CB 3.25Å; R770-Q774 PolarHBondContact O-N 3.4Å
771K94Very high93Very high129 Ų129104.1 Ų104.156%0.56151%0.505SS*.Hα-helixtrans-68.5-43.4175.1-76.8176.3178.11790111.8T767 L768 Q774 Q775T767-K771 WeakPolarHBondContact O-CG 3.42Å; T767-K771 PolarHBondContact O-N 2.9Å; L768-K771 PolarHBondContact O-N 3.41Å; L768-K771 VanDerWaalsContact O-N 3.12Å; K771-Q774 PolarHBondContact O-N 3.35Å; K771-Q775 WeakPolarHBondContact O-CB 3.5Å; K771-Q775 PolarHBondContact O-N 2.84Å
772L93.3Very high92.9Very high105 Ų105102.4 Ų102.455%0.5550%0.498SS..Hα-helixtrans-60-53.3177.5179.462.6000110.9L768 Q774 Q775 E776L768-L772 WeakPolarHBondContact O-CB 3.47Å; L768-L772 PolarHBondContact O-N 3.31Å; L772-Q774 VanDerWaalsContact C-N 3.32Å; L772-Q774 PolarHBondContact O-N 2.84Å; L772-Q775 CarbonylContact O-C 3.58Å; L772-Q775 WeakPolarHBondContact O-CA 3.29Å; L772-Q775 PolarHBondContact O-N 3.48Å; L772-E776 PolarHBondContact O-N 3.35Å
773T91.7Very high92.9Very high67 Ų6798 Ų9841%0.41149%0.49SS..Hα-helixtrans-60.6-37.9176.7470000112.7Q769 R770 Q775 E776 V777Q769-T773 WeakPolarHBondContact O-CG2 3.39Å; Q769-T773 PolarHBondContact O-N 3.36Å; Q769-T773 PolarHBondContact O-OG1 3.37Å; R770-T773 WeakPolarHBondContact CA-OG1 3.39Å; R770-T773 PolarHBondContact O-OG1 2.98Å; T773-Q775 VanDerWaalsContact C-N 3.33Å; T773-Q775 PolarHBondContact O-N 3Å; T773-E776 PolarHBondContact O-N 2.92Å; T773-V777 WeakPolarHBondContact O-CG2 3.31Å; T773-V777 PolarHBondContact O-N 3.48Å
774Q93.4Very high92.9Very high101 Ų10199.9 Ų99.947%0.47249%0.487SS..Hα-helixtrans-66.4-33.7172.5-162-169.354.100112.5R770 K771 L772 V777 R778R770-Q774 VanDerWaalsContact O-CB 3.3Å; R770-Q774 WeakPolarHBondContact O-CB 3.25Å; R770-Q774 PolarHBondContact O-N 3.4Å; K771-Q774 PolarHBondContact O-N 3.35Å; L772-Q774 VanDerWaalsContact C-N 3.32Å; L772-Q774 PolarHBondContact O-N 2.84Å; Q774-V777 PolarHBondContact O-N 3.43Å; Q774-R778 VanDerWaalsContact CD-NH2 3.27Å; Q774-R778 WeakPolarHBondContact O-CG 3.09Å; Q774-R778 PolarHBondContact O-N 3.17Å; Q774-R778 VanDerWaalsContact OE1-CZ 3.28Å
775Q91.6Very high92.9Very high114 Ų114100.8 Ų100.853%0.53349%0.488SS..Hα-helixtrans-76-33.5176.5-170.6162.6-9.100112.3K771 L772 T773 V777 R778 N779K771-Q775 WeakPolarHBondContact O-CB 3.5Å; K771-Q775 PolarHBondContact O-N 2.84Å; L772-Q775 CarbonylContact O-C 3.58Å; L772-Q775 WeakPolarHBondContact O-CA 3.29Å; L772-Q775 PolarHBondContact O-N 3.48Å; T773-Q775 VanDerWaalsContact C-N 3.33Å; T773-Q775 PolarHBondContact O-N 3Å; Q775-V777 VanDerWaalsContact C-N 3.32Å; Q775-V777 PolarHBondContact O-N 2.98Å; Q775-R778 PolarHBondContact O-N 2.92Å; Q775-N779 WeakPolarHBondContact O-CB 3.47Å; Q775-N779 PolarHBondContact O-N 3.31Å; Q775-N779 PolarHBondContact O-OD1 3.44Å
776E90.8Very high92.7Very high84 Ų84100.5 Ų100.539%0.39349%0.489SS..Hα-helixtrans-60.6-41.3167.3-71174.4-159.900111.9L772 T773 N779 K780L772-E776 PolarHBondContact O-N 3.35Å; T773-E776 PolarHBondContact O-N 2.92Å; E776-N779 PolarHBondContact O-N 2.91Å; E776-K780 WeakPolarHBondContact O-CB 3.17Å; E776-K780 WeakPolarHBondContact O-CD 3.49Å; E776-K780 VanDerWaalsContact O-CG 3.25Å; E776-K780 WeakPolarHBondContact O-CG 3.3Å; E776-K780 PolarHBondContact O-N 2.97Å; E776-K780 IonicContact OE2-NZ 3.66Å
777V93.9Very high92.7Very high78 Ų78103.3 Ų103.347%0.47350%0.496SS..Hα-helixtrans-63.5-45.9174.5170.50000110.8T773 Q774 Q775 N779 K780 E781T773-V777 WeakPolarHBondContact O-CG2 3.31Å; T773-V777 PolarHBondContact O-N 3.48Å; Q774-V777 PolarHBondContact O-N 3.43Å; Q775-V777 VanDerWaalsContact C-N 3.32Å; Q775-V777 PolarHBondContact O-N 2.98Å; V777-N779 VanDerWaalsContact C-N 3.35Å; V777-N779 PolarHBondContact O-N 2.9Å; V777-K780 CarbonylContact O-C 3.57Å; V777-K780 PolarHBondContact O-N 3.37Å; V777-E781 PolarHBondContact O-N 3Å
778R94.4Very high92.6Very high132 Ų132102.9 Ų102.950%0.49850%0.497SS..Hα-helixtrans-61.6-38.7173.5-71.8-171.2-170.991.5-1113Q774 Q775 K780 E781 L782Q774-R778 VanDerWaalsContact CD-NH2 3.27Å; Q774-R778 WeakPolarHBondContact O-CG 3.09Å; Q774-R778 PolarHBondContact O-N 3.17Å; Q774-R778 VanDerWaalsContact OE1-CZ 3.28Å; Q775-R778 PolarHBondContact O-N 2.92Å; R778-K780 VanDerWaalsContact C-N 3.35Å; R778-E781 WeakPolarHBondContact O-CA 3.27Å; R778-E781 VanDerWaalsContact O-CB 3.31Å; R778-E781 WeakPolarHBondContact O-CB 3.4Å; R778-E781 PolarHBondContact O-N 3.38Å; R778-E781 VanDerWaalsContact O-N 3.11Å; R778-L782 WeakPolarHBondContact O-CB 3.33Å; R778-L782 PolarHBondContact O-N 3.18Å
779N93.2Very high92.4Very high95 Ų95102.9 Ų102.951%0.50850%0.497SS..Hα-helixtrans-66.9-37.9176.4-71.1-0.8000111.1Q775 E776 V777 E781 A783Q775-N779 WeakPolarHBondContact O-CB 3.47Å; Q775-N779 PolarHBondContact O-N 3.31Å; Q775-N779 PolarHBondContact O-OD1 3.44Å; E776-N779 PolarHBondContact O-N 2.91Å; V777-N779 VanDerWaalsContact C-N 3.35Å; V777-N779 PolarHBondContact O-N 2.9Å; N779-E781 VanDerWaalsContact C-N 3.25Å; N779-E781 PolarHBondContact O-N 3.45Å; N779-A783 VanDerWaalsContact O-CB 3.23Å; N779-A783 WeakPolarHBondContact O-CB 3.3Å; N779-A783 PolarHBondContact O-N 3.48Å
780K94.2Very high92.3Very high124 Ų124101.4 Ų101.454%0.53950%0.497SS..Hα-helixtrans-68-23171.2-70.7162-176.6162.30112.7E776 V777 R778 R784E776-K780 WeakPolarHBondContact O-CB 3.17Å; E776-K780 WeakPolarHBondContact O-CD 3.49Å; E776-K780 VanDerWaalsContact O-CG 3.25Å; E776-K780 WeakPolarHBondContact O-CG 3.3Å; E776-K780 PolarHBondContact O-N 2.97Å; E776-K780 IonicContact OE2-NZ 3.66Å; V777-K780 CarbonylContact O-C 3.57Å; V777-K780 PolarHBondContact O-N 3.37Å; R778-K780 VanDerWaalsContact C-N 3.35Å; K780-R784 WeakPolarHBondContact O-CG 3.32Å; K780-R784 PolarHBondContact O-NE 3.26Å
781E93.4Very high92.2Very high82 Ų8299.1 Ų99.138%0.38349%0.488SS..Hα-helixtrans-77.2-54.9172-158.8117.3-99.900111.2V777 R778 N779 A783 R784 E785V777-E781 PolarHBondContact O-N 3Å; R778-E781 WeakPolarHBondContact O-CA 3.27Å; R778-E781 VanDerWaalsContact O-CB 3.31Å; R778-E781 WeakPolarHBondContact O-CB 3.4Å; R778-E781 PolarHBondContact O-N 3.38Å; R778-E781 VanDerWaalsContact O-N 3.11Å; N779-E781 VanDerWaalsContact C-N 3.25Å; N779-E781 PolarHBondContact O-N 3.45Å; E781-A783 PolarHBondContact O-N 3.32Å; E781-R784 VanDerWaalsContact CA-NH2 3.26Å; E781-R784 VanDerWaalsContact CD-NH2 3.35Å; E781-R784 CarbonylContact O-C 3.59Å; E781-R784 WeakPolarHBondContact O-CA 3.37Å; E781-R784 WeakPolarHBondContact O-CB 3.41Å; E781-R784 PolarHBondContact O-N 3.34Å; E781-R784 IonicContact OE1-CZ 2.72Å; E781-R784 IonicContact OE1-NH1 2.68Å; E781-R784 PolarHBondContact OE1-NH1 3.13Å; E781-R784 IonicContact OE1-NH2 3.6Å; E781-R784 PolarHBondContact OE1-NH2 3.05Å; E781-E785 PolarHBondContact O-N 3.09Å
782L91.2Very high91.9Very high93 Ų9396.4 Ų96.449%0.48748%0.478SS..Hα-helixtrans-58.5-35176.7-174.363.8000111.9R778 E785 M786R778-L782 WeakPolarHBondContact O-CB 3.33Å; R778-L782 PolarHBondContact O-N 3.18Å; L782-E785 PolarHBondContact O-N 2.99Å; L782-M786 HydrophobicContact CG-CG 4.5Å; L782-M786 WeakPolarHBondContact O-CB 3.48Å; L782-M786 WeakPolarHBondContact O-CG 3.43Å; L782-M786 PolarHBondContact O-N 2.84Å
783A91.8Very high91.4Very high59 Ų5995.7 Ų95.749%0.48847%0.474SS..Hα-helixtrans-63.8-42.3172.200000112.5N779 E781 M786 E787N779-A783 VanDerWaalsContact O-CB 3.23Å; N779-A783 WeakPolarHBondContact O-CB 3.3Å; N779-A783 PolarHBondContact O-N 3.48Å; E781-A783 PolarHBondContact O-N 3.32Å; A783-M786 PolarHBondContact O-N 3.1Å; A783-E787 WeakPolarHBondContact O-CB 3.4Å; A783-E787 PolarHBondContact O-N 3.44Å
784R93.7Very high91Very high128 Ų12895 Ų9548%0.48347%0.466SS..Hα-helixtrans-64.8-39174.1-76.4175.5-78129.7-10111.6K780 E781 A788K780-R784 WeakPolarHBondContact O-CG 3.32Å; K780-R784 PolarHBondContact O-NE 3.26Å; E781-R784 VanDerWaalsContact CA-NH2 3.26Å; E781-R784 VanDerWaalsContact CD-NH2 3.35Å; E781-R784 CarbonylContact O-C 3.59Å; E781-R784 WeakPolarHBondContact O-CA 3.37Å; E781-R784 WeakPolarHBondContact O-CB 3.41Å; E781-R784 PolarHBondContact O-N 3.34Å; E781-R784 IonicContact OE1-CZ 2.72Å; E781-R784 IonicContact OE1-NH1 2.68Å; E781-R784 PolarHBondContact OE1-NH1 3.13Å; E781-R784 IonicContact OE1-NH2 3.6Å; E781-R784 PolarHBondContact OE1-NH2 3.05Å; R784-A788 VanDerWaalsContact O-CB 3.26Å; R784-A788 WeakPolarHBondContact O-CB 3.49Å; R784-A788 PolarHBondContact O-N 3.39Å
785E93Very high90.6Very high117 Ų11795.8 Ų95.855%0.54747%0.465SS..Hα-helixtrans-67.3-44.5175.4-69.4178.8169.400112E781 L782 A788 L789E781-E785 PolarHBondContact O-N 3.09Å; L782-E785 PolarHBondContact O-N 2.99Å; E785-A788 PolarHBondContact O-N 2.95Å; E785-L789 WeakPolarHBondContact O-CB 3.41Å; E785-L789 PolarHBondContact O-N 3.44Å
786M88.5Confident89.8Confident115 Ų11598 Ų9857%0.56747%0.469SS*.Hα-helixtrans-65.8-37175.7-75.1-160.177.300112.2L782 A783 T790L782-M786 HydrophobicContact CG-CG 4.5Å; L782-M786 WeakPolarHBondContact O-CB 3.48Å; L782-M786 WeakPolarHBondContact O-CG 3.43Å; L782-M786 PolarHBondContact O-N 2.84Å; A783-M786 PolarHBondContact O-N 3.1Å; M786-T790 VanDerWaalsContact O-CB 3.23Å; M786-T790 WeakPolarHBondContact O-CB 3.25Å; M786-T790 PolarHBondContact O-N 2.89Å; M786-T790 PolarHBondContact O-OG1 3.08Å
787E92.6Very high89Confident106 Ų106100.4 Ų100.450%0.49548%0.475SS..Hα-helixtrans-68.3-38.9173.4-159.8-143.6122.300111A783 T790 R791A783-E787 WeakPolarHBondContact O-CB 3.4Å; A783-E787 PolarHBondContact O-N 3.44Å; E787-T790 PolarHBondContact O-N 3.43Å; E787-R791 WeakPolarHBondContact O-CB 3.48Å; E787-R791 WeakPolarHBondContact O-CG 3.4Å; E787-R791 PolarHBondContact O-N 2.89Å; E787-R791 IonicContact OE1-CZ 3.2Å; E787-R791 IonicContact OE1-NE 2.74Å; E787-R791 PolarHBondContact OE1-NE 3.3Å; E787-R791 IonicContact OE1-NH2 2.75Å; E787-R791 PolarHBondContact OE1-NH2 2.91Å; E787-R791 IonicContact OE2-NH2 2.84Å
788A91.4Very high87.8Confident36 Ų36104.7 Ų104.730%0.29848%0.482SS..Hα-helixtrans-64.5-44.9173.700000112.5R784 E785 T790 R791 E792R784-A788 VanDerWaalsContact O-CB 3.26Å; R784-A788 WeakPolarHBondContact O-CB 3.49Å; R784-A788 PolarHBondContact O-N 3.39Å; E785-A788 PolarHBondContact O-N 2.95Å; A788-T790 VanDerWaalsContact C-N 3.32Å; A788-R791 CarbonylContact O-C 3.59Å; A788-R791 WeakPolarHBondContact O-CB 3.35Å; A788-R791 PolarHBondContact O-N 3.45Å; A788-E792 WeakPolarHBondContact O-CB 3.31Å; A788-E792 PolarHBondContact O-N 3.43Å
789L90.6Very high86.2Confident113 Ų113105.5 Ų105.559%0.59249%0.49SS*.Hα-helixtrans-67-33.2174.7-174.364000111.6E785 E792 L793E785-L789 WeakPolarHBondContact O-CB 3.41Å; E785-L789 PolarHBondContact O-N 3.44Å; L789-E792 HydrophobicContact CD1-CB 4.49Å; L789-E792 WeakPolarHBondContact O-CB 3.31Å; L789-E792 PolarHBondContact O-N 2.98Å; L789-L793 VanDerWaalsContact O-CB 3.26Å; L789-L793 WeakPolarHBondContact O-CB 3.45Å; L789-L793 PolarHBondContact O-N 3.11Å
790T89.6Confident84.4Confident88 Ų88104.8 Ų104.854%0.5449%0.492SS..Hα-helixtrans-67.9-40.9172.7-60.60000110.9M786 E787 A788 E792 L793 E794M786-T790 VanDerWaalsContact O-CB 3.23Å; M786-T790 WeakPolarHBondContact O-CB 3.25Å; M786-T790 PolarHBondContact O-N 2.89Å; M786-T790 PolarHBondContact O-OG1 3.08Å; E787-T790 PolarHBondContact O-N 3.43Å; A788-T790 VanDerWaalsContact C-N 3.32Å; T790-E792 VanDerWaalsContact C-N 3.32Å; T790-L793 PolarHBondContact O-N 3.21Å; T790-E794 VanDerWaalsContact O-CB 3.23Å; T790-E794 WeakPolarHBondContact O-CB 3.33Å; T790-E794 PolarHBondContact O-N 3.18Å
791R90.6Very high82.4Confident116 Ų116106.2 Ų106.244%0.43850%0.498SS..Hα-helixtrans-63.2-37170.7-76.4-176.5-97.1105.5-5.5111.9E787 A788 R795E787-R791 WeakPolarHBondContact O-CB 3.48Å; E787-R791 WeakPolarHBondContact O-CG 3.4Å; E787-R791 PolarHBondContact O-N 2.89Å; E787-R791 IonicContact OE1-CZ 3.2Å; E787-R791 IonicContact OE1-NE 2.74Å; E787-R791 PolarHBondContact OE1-NE 3.3Å; E787-R791 IonicContact OE1-NH2 2.75Å; E787-R791 PolarHBondContact OE1-NH2 2.91Å; E787-R791 IonicContact OE2-NH2 2.84Å; A788-R791 CarbonylContact O-C 3.59Å; A788-R791 WeakPolarHBondContact O-CB 3.35Å; A788-R791 PolarHBondContact O-N 3.45Å; R791-R795 WeakPolarHBondContact O-CG 3.11Å; R791-R795 PolarHBondContact O-N 3.34Å
792E87.8Confident80.1Confident72 Ų72106.9 Ų106.934%0.33651%0.512SS..Hα-helixtrans-64.7-48.5173.5-157.970.5-92.600112A788 L789 T790 E794 R795 Y796A788-E792 WeakPolarHBondContact O-CB 3.31Å; A788-E792 PolarHBondContact O-N 3.43Å; L789-E792 HydrophobicContact CD1-CB 4.49Å; L789-E792 WeakPolarHBondContact O-CB 3.31Å; L789-E792 PolarHBondContact O-N 2.98Å; T790-E792 VanDerWaalsContact C-N 3.32Å; E792-E794 VanDerWaalsContact C-N 3.31Å; E792-E794 PolarHBondContact O-N 3.48Å; E792-R795 WeakPolarHBondContact O-CA 3.49Å; E792-R795 VanDerWaalsContact O-CB 3.31Å; E792-R795 WeakPolarHBondContact O-CB 3.38Å; E792-R795 PolarHBondContact O-N 3.28Å; E792-R795 VanDerWaalsContact O-N 3.15Å; E792-R795 IonicContact OE1-CZ 3.1Å; E792-R795 IonicContact OE1-NE 2.75Å; E792-R795 PolarHBondContact OE1-NE 2.72Å; E792-R795 IonicContact OE1-NH2 3.25Å; E792-R795 PolarHBondContact OE1-NH2 2.72Å; E792-R795 IonicContact OE2-CZ 2.91Å; E792-R795 IonicContact OE2-NH2 2.67Å; E792-R795 PolarHBondContact OE2-NH2 3.19Å; E792-Y796 HydrophobicContact CG-CD2 4.18Å; E792-Y796 HydrophobicContact CG-CE2 3.86Å; E792-Y796 WeakPolarHBondContact O-CD2 3.41Å; E792-Y796 PolarHBondContact O-N 2.72Å
793L82.3Confident78Confident89 Ų89109 Ų10947%0.46652%0.523SS..Hα-helixtrans-70.1-30.9-178.8-156.2155.1000111.2L789 T790 Y796 R797L789-L793 VanDerWaalsContact O-CB 3.26Å; L789-L793 WeakPolarHBondContact O-CB 3.45Å; L789-L793 PolarHBondContact O-N 3.11Å; T790-L793 PolarHBondContact O-N 3.21Å; L793-Y796 PolarHBondContact O-N 2.73Å; L793-R797 HydrophobicContact CD2-CG 4.25Å; L793-R797 WeakPolarHBondContact O-CB 3.4Å; L793-R797 WeakPolarHBondContact O-CG 3.42Å; L793-R797 PolarHBondContact O-N 2.86Å
794E83.9Confident75.9Confident54 Ų54117.3 Ų117.325%0.25254%0.542SS..Hα-helixtrans-74.4-32.2170.3-174.954.8-156.900112.5T790 E792 R797 R798T790-E794 VanDerWaalsContact O-CB 3.23Å; T790-E794 WeakPolarHBondContact O-CB 3.33Å; T790-E794 PolarHBondContact O-N 3.18Å; E792-E794 VanDerWaalsContact C-N 3.31Å; E792-E794 PolarHBondContact O-N 3.48Å; E794-R797 PolarHBondContact O-N 3.42Å; E794-R797 WeakPolarHBondContact OE2-CD 3.41Å; E794-R798 WeakPolarHBondContact O-CB 3.12Å; E794-R798 VanDerWaalsContact O-CG 3.27Å; E794-R798 WeakPolarHBondContact O-CG 3.42Å; E794-R798 PolarHBondContact O-N 3.19Å; E794-R798 IonicContact OE1-CZ 4Å; E794-R798 IonicContact OE1-NE 3.78Å; E794-R798 PolarHBondContact OE1-NE 3.36Å; E794-R798 IonicContact OE1-NH2 3.62Å; E794-R798 PolarHBondContact OE1-NH2 3.16Å
795R83.6Confident73.6Confident117 Ų117117.7 Ų117.744%0.44256%0.561SS.*Hα-helixtrans-58.6-51.8164-77.6-172.9-73.5-107.712.5110.2R791 E792 R797 R798 F799R791-R795 WeakPolarHBondContact O-CG 3.11Å; R791-R795 PolarHBondContact O-N 3.34Å; E792-R795 WeakPolarHBondContact O-CA 3.49Å; E792-R795 VanDerWaalsContact O-CB 3.31Å; E792-R795 WeakPolarHBondContact O-CB 3.38Å; E792-R795 PolarHBondContact O-N 3.28Å; E792-R795 VanDerWaalsContact O-N 3.15Å; E792-R795 IonicContact OE1-CZ 3.1Å; E792-R795 IonicContact OE1-NE 2.75Å; E792-R795 PolarHBondContact OE1-NE 2.72Å; E792-R795 IonicContact OE1-NH2 3.25Å; E792-R795 PolarHBondContact OE1-NH2 2.72Å; E792-R795 IonicContact OE2-CZ 2.91Å; E792-R795 IonicContact OE2-NH2 2.67Å; E792-R795 PolarHBondContact OE2-NH2 3.19Å; R795-R797 VanDerWaalsContact C-N 3.33Å; R795-R797 PolarHBondContact O-N 2.88Å; R795-R798 PolarHBondContact O-N 3.22Å; R795-F799 VanDerWaalsContact O-CD2 3.25Å; R795-F799 WeakPolarHBondContact O-CD2 3.48Å; R795-F799 PolarHBondContact O-N 2.86Å
796Y74.4Confident71.2Confident159 Ų159115.8 Ų115.862%0.62457%0.573SS**Hα-helixtrans-60.6-37.2177.2-77.7-65.2000113.2E792 L793 F799 S800E792-Y796 HydrophobicContact CG-CD2 4.18Å; E792-Y796 HydrophobicContact CG-CE2 3.86Å; E792-Y796 WeakPolarHBondContact O-CD2 3.41Å; E792-Y796 PolarHBondContact O-N 2.72Å; L793-Y796 PolarHBondContact O-N 2.73Å; Y796-F799 PolarHBondContact O-N 2.84Å; Y796-S800 PolarHBondContact O-N 2.98Å; Y796-S800 PolarHBondContact O-OG 2.71Å
797R75Confident68.9Low136 Ų136118.2 Ų118.251%0.51359%0.585SS.*Hα-helixtrans-65.8-33.4172.3-81.4174.5169.7169.3-0113.2L793 E794 R795 S800 K801L793-R797 HydrophobicContact CD2-CG 4.25Å; L793-R797 WeakPolarHBondContact O-CB 3.4Å; L793-R797 WeakPolarHBondContact O-CG 3.42Å; L793-R797 PolarHBondContact O-N 2.86Å; E794-R797 PolarHBondContact O-N 3.42Å; E794-R797 WeakPolarHBondContact OE2-CD 3.41Å; R795-R797 VanDerWaalsContact C-N 3.33Å; R795-R797 PolarHBondContact O-N 2.88Å; R797-S800 WeakPolarHBondContact CA-OG 3.14Å; R797-S800 PolarHBondContact O-OG 2.93Å; R797-K801 VanDerWaalsContact O-CB 3.23Å; R797-K801 WeakPolarHBondContact O-CB 3.35Å; R797-K801 WeakPolarHBondContact O-CD 3.32Å; R797-K801 WeakPolarHBondContact O-CG 3.46Å; R797-K801 PolarHBondContact O-N 3.42Å
798R69.2Low66.5Low168 Ų168120.2 Ų120.263%0.63460%0.599SS**Hα-helixtrans-73.6-40.6174.9-71.3169.8-171-154.92.1111E794 R795 K801 S802E794-R798 WeakPolarHBondContact O-CB 3.12Å; E794-R798 VanDerWaalsContact O-CG 3.27Å; E794-R798 WeakPolarHBondContact O-CG 3.42Å; E794-R798 PolarHBondContact O-N 3.19Å; E794-R798 IonicContact OE1-CZ 4Å; E794-R798 IonicContact OE1-NE 3.78Å; E794-R798 PolarHBondContact OE1-NE 3.36Å; E794-R798 IonicContact OE1-NH2 3.62Å; E794-R798 PolarHBondContact OE1-NH2 3.16Å; R795-R798 PolarHBondContact O-N 3.22Å; R798-K801 PolarHBondContact O-N 3.34Å; R798-S802 WeakPolarHBondContact O-CB 3.19Å; R798-S802 PolarHBondContact O-N 3.01Å
799F59.7Low63.9Low149 Ų149122 Ų12265%0.65462%0.621SS**Hα-helixtrans-61.1-42.1171.1-80-67.2000112.7R795 Y796 S802R795-F799 VanDerWaalsContact O-CD2 3.25Å; R795-F799 WeakPolarHBondContact O-CD2 3.48Å; R795-F799 PolarHBondContact O-N 2.86Å; Y796-F799 PolarHBondContact O-N 2.84Å; F799-S802 WeakPolarHBondContact O-CB 3.41Å; F799-S802 PolarHBondContact O-N 3.38Å
800S55.3Low61.7Low80 Ų80127.4 Ų127.456%0.55963%0.633SS**Hα-helixtrans-74.2-36177.7650000113.5Y796 R797 S802 L803Y796-S800 PolarHBondContact O-N 2.98Å; Y796-S800 PolarHBondContact O-OG 2.71Å; R797-S800 WeakPolarHBondContact CA-OG 3.14Å; R797-S800 PolarHBondContact O-OG 2.93Å; S800-S802 PolarHBondContact O-N 3.11Å; S800-L803 PolarHBondContact O-N 3.17Å; S800-L803 VanDerWaalsContact O-N 3.11Å
801K53.6Low59.7Low153 Ų153133.9 Ų133.967%0.66565%0.648SS**Hα-helixtrans-66.2-23170.7-74.7171.5-179.2176.50113.3R797 R798 L803R797-K801 VanDerWaalsContact O-CB 3.23Å; R797-K801 WeakPolarHBondContact O-CB 3.35Å; R797-K801 WeakPolarHBondContact O-CD 3.32Å; R797-K801 WeakPolarHBondContact O-CG 3.46Å; R797-K801 PolarHBondContact O-N 3.42Å; R798-K801 PolarHBondContact O-N 3.34Å; K801-L803 PolarHBondContact O-N 3.44Å
802S45.4Very low57.1Low97 Ų97138.6 Ų138.668%0.67867%0.672SS**THydrogen-bonded Turntrans-68-11171.9-152.40000113.2R798 F799 S800R798-S802 WeakPolarHBondContact O-CB 3.19Å; R798-S802 PolarHBondContact O-N 3.01Å; F799-S802 WeakPolarHBondContact O-CB 3.41Å; F799-S802 PolarHBondContact O-N 3.38Å; S800-S802 PolarHBondContact O-N 3.11Å
803L46.7Very low55Low137 Ų137140 Ų14072%0.71769%0.69SS**THydrogen-bonded Turntrans-12047.5-172.2-71171.8000114S800 K801S800-L803 PolarHBondContact O-N 3.17Å; S800-L803 VanDerWaalsContact O-N 3.11Å; K801-L803 PolarHBondContact O-N 3.44Å
804R47.7Very low52.7Low234 Ų234143.2 Ų143.288%0.88371%0.707SS**  trans169.1135.5139.5-95.5171.2-154.1-140.28.9113
805P45.1Very low50.3Low136 Ų136148.3 Ų148.388%0.88374%0.735SS**  trans-85.4153.3160.8-4.523.5000112.3
806G41.5Very low48Very low77 Ų77151.7 Ų151.779%0.79476%0.756SS**  trans141.5102.4158.600000119
807M41.3Very low46.3Very low165 Ų165150.9 Ų150.981%0.81377%0.767SS**  trans25.4130.8143.6-65173.267.500123.6
808N41.8Very low44.3Very low149 Ų149150.6 Ų150.680%0.79778%0.775SS**  trans56.7125.1132.8-57.4-5.8000122.8
809G37.8Very low42.8Very low73 Ų73149 Ų14975%0.75378%0.784SS**  trans134.7100.9130.900000120.6
810R43.7Very low41.8Very low227 Ų227148.5 Ų148.586%0.85778%0.782SS**  trans41.2125.8146.1-62.2-178.1-178.6-111.5-4.8122.1
811R48.3Very low40.7Very low223 Ų223151.6 Ų151.684%0.84279%0.787SS**  trans43.8117.5140.2-62.4-176.1-175.7-97.83.1120.1
812F35Very low39.5Very low215 Ų215150.2 Ų150.294%0.94379%0.792SS**  trans-136.4157.1141.2-82.9-81.6000109.8
813S44.3Very low38.9Very low103 Ų103154.5 Ų154.572%0.7280%0.801SS**  trans-122.8160.9176.9-59.10000110.6
814D34.2Very low38.3Very low155 Ų155154.7 Ų154.783%0.82981%0.808SS**  trans49.4115.8159.7-54.1-23.7000119.9
815L33.3Very low37.4Very low161 Ų161152.5 Ų152.584%0.84381%0.808SS**  trans-146.3109.9146.8-166.667.5000110.7
816H35.4Very low37.3Very low189 Ų189151.1 Ų151.188%0.87580%0.798SS**  trans-69.9145.1166-76.7176.4000110.7
817V37.2Very low36.8Very low141 Ų141156 Ų15686%0.85581%0.805SS**  trans-125.5141.5160.9179.70000108.6
818L33.7Very low36.3Very low131 Ų131154.6 Ų154.669%0.68680%0.801SS**  trans-120.5129-160.117478.9000112.3K820L818-K820 HydrophobicContact CD2-CD 4.28Å; L818-K820 HydrophobicContact CD2-CG 4.38Å; L818-K820 HydrophobicContact CG-CG 4.4Å
819T39Very low35.9Very low134 Ų134154 Ų15482%0.82280%0.797SS**  trans-144.4114.3153.941.70000106.6
820K38.2Very low35.6Very low139 Ų139158.2 Ų158.260%0.60480%0.799SS**  53.5135.551.5-83.1-173.8167.8-73.60112.5L818L818-K820 HydrophobicContact CD2-CD 4.28Å; L818-K820 HydrophobicContact CD2-CG 4.38Å; L818-K820 HydrophobicContact CG-CG 4.4Å
821E30.6Very low35.2Very low145 Ų145152.6 Ų152.668%0.67880%0.795SS**  cis-167.3153.8-9.9-158.9155.7-148.600105.5
822V29Very low34.8Very low124 Ų124147.5 Ų147.575%0.75279%0.791SS**  173.3147.592.2159.50000107.8
823Q32.5Very low34.4Very low186 Ų186144 Ų14487%0.86978%0.782SS**  trans-117.5151.4165.5-61.7173-4400110
824T35.6Very low33.7Very low141 Ų141144.6 Ų144.687%0.86579%0.786SS**  trans-152.6134.8147.337.10000110.2
825E29.1Very low33.5Very low189 Ų189146 Ų14688%0.88378%0.784SS**  trans-104.3-172.8173.8-121.9-149.6161.200110.3
826P42.2Very low33.2Very low106 Ų106144.1 Ų144.169%0.68878%0.78SS**  trans-110.2178-140.142.2-32000114.9
827L31.4Very low32.7Very low179 Ų179143.5 Ų143.594%0.93778%0.78SS**  trans-131.9142.9162.1-15772.3000110
828D30.6Very low32.3Very low136 Ų136142.1 Ų142.173%0.72777%0.771SS**  trans-111.3143.4-177.4177.524.9000109.8
829L32.3Very low32Very low136 Ų136144.2 Ų144.271%0.71278%0.778SS**  trans175.3142.9138.6-117.773.9000113.3
830M31.3Very low31.5Very low162 Ų162144.3 Ų144.380%0.79877%0.773SS**  trans71.3133.8154.2-61.9-63.3100.200120.8
831S36Very low31.2Very low110 Ų110143.6 Ų143.677%0.76977%0.771SS**  trans-128.4143.5160.1171.70000108.3
832P40.2Very low31.2Very low116 Ų116146 Ų14675%0.75377%0.774SS**  trans-133.9126.414334.1-21.6000114.3
833N27.2Very low31.1Very low142 Ų142144.7 Ų144.776%0.75978%0.776SS**  trans-35131160176.615.9000115.5
834S28Very low31Very low114 Ų114141.9 Ų141.980%0.79777%0.771SS**  trans-152.1166.1159.755.90000111.4
835K30.1Very low30.9Very low184 Ų184141.3 Ų141.380%0.877%0.768SS**  trans-118.4146.4-159.1-66177.9178.2176.60114.8
836T28.3Very low31Very low123 Ų123139.9 Ų139.976%0.75577%0.766SS**  trans56.299145.2-49.90000120.1
837M24.5Very low30.6Very low176 Ų176137.9 Ų137.987%0.86777%0.765SS**  -179.1135.8125-94.7178.4179.900106.6
838V29.2Very low30.4Very low112 Ų112138.8 Ų138.868%0.67976%0.761SS**  cis82.4122.438.6178.50000112.9
839Q26.5Very low30.2Very low175 Ų175138.4 Ų138.482%0.81876%0.758SS**  trans69.1152.8-178.8-66.7160.617.300114.2
840L29.3Very low29.9Very low136 Ų136141.5 Ų141.571%0.71276%0.762SS**  cis-137.4169.518.5-164.363.9000113.2
841E31.9Very low29.9Very low123 Ų123140.3 Ų140.358%0.57576%0.759SS**  trans-35.1179176.1-48.1172.887.200119.1
842R30Very low29.7Very low197 Ų197142.8 Ų142.874%0.74376%0.758SS**  cis-163146.719.2-161.3171.1-94.3174-1.2113.3
843A26.9Very low29.2Very low96 Ų96142.6 Ų142.679%0.79376%0.76SS**  trans-164.4105140.500000112.2
844V31.2Very low29.3Very low126 Ų126144 Ų14476%0.76476%0.762SS**  trans24122.8141.5-164.10000117
845V31.7Very low29.6Very low130 Ų130145 Ų14579%0.78876%0.764SS**  -145.5157.865.5177.60000112.7
846N32.7Very low29.6Very low158 Ų158143.4 Ų143.485%0.84576%0.764SS**  trans-47.8159.8168.4-57.5-22.5000114.4
847G32.5Very low29.7Very low65 Ų65145.1 Ų145.167%0.6777%0.768SS**  cis137.3160.14.100000111.7
848K28.1Very low29.8Very low198 Ų198139.7 Ų139.786%0.86176%0.758SS**  trans86.7144.7-165.2-55.6-75.7-164169.60114.2
849L26.7Very low29.9Very low128 Ų128138.4 Ų138.467%0.6776%0.759SS**  cis-178.6119.3-48-104.2175.5000107.8
850Y26.7Very low30.1Very low201 Ų201136.9 Ų136.979%0.78876%0.756SS**  trans62.5165.1160.5-75.5-108.9000117.2
851D29.5Very low30.1Very low137 Ų137140.2 Ų140.273%0.73376%0.761SS**  cis-142.1177.813.3-144.7-23.4000114
852E31.6Very low30Very low162 Ų162140.4 Ų140.476%0.75778%0.775SS**  trans-90.9173.2-176-57.4-175.6118.200115.2
853S30.6Very low29.9Very low112 Ų112138.2 Ų138.278%0.78378%0.778SS**  trans70.9163.1147.983.10000117.6
854E30.3Very low30Very low171 Ų171141.8 Ų141.880%0.79978%0.779SS**  cis-157.1-176.8-26.4-123-169.4-173.800108.7
855T32.9Very low30Very low136 Ų136142.1 Ų142.183%0.83478%0.775SS**  trans67.9160.2171.467.90000118.2
856D29.9Very low29.8Very low150 Ų150143 Ų14380%0.80277%0.771SS**  cis171.8156-42.6-17627.6000107.1
857D30.3Very low29.4Very low158 Ų158142.4 Ų142.485%0.84577%0.767SS**  trans61.1170.8171.4-148.7-5.3000117.8
858G28.2Very low29.1Very low63 Ų63144.4 Ų144.465%0.64977%0.767SS**  trans120.630159.300000120.7
859A31.1Very low29Very low85 Ų85143.3 Ų143.370%0.70276%0.762SS**  trans31.1144.6150.100000124.6
860N29.5Very low29Very low143 Ų143147.2 Ų147.277%0.76577%0.769SS**  trans76.2120.3146.9-73.7-28.9000123
861Y28.9Very low29Very low206 Ų206143.5 Ų143.581%0.80877%0.768SS**  trans30.6114.6133.4-75.5-89000120.6
862S30.2Very low29.4Very low126 Ų126142.1 Ų142.188%0.88177%0.766SS**  -158.8159.8114.4-83.10000111.8
863N29.3Very low29.3Very low151 Ų151140 Ų14081%0.80777%0.769SS**  trans-99.2171.3-179.3-91-47.8000111.9
864E27.2Very low29.2Very low172 Ų172142.4 Ų142.480%0.80477%0.772SS**  trans73.7147.8165.4-61-154.3112.900118.7
865L31Very low29.1Very low132 Ų132142.2 Ų142.269%0.69177%0.773SS**  cis-166.3153.2-38.2-14676.1000108.8
866Q27.6Very low28.7Very low150 Ų150142.8 Ų142.870%0.70177%0.771SS**  trans80148.5158.1-56.3-176.529.200121.9
867L25.9Very low28.7Very low144 Ų144141.9 Ų141.975%0.75477%0.766SS**  trans72.2134.2146-104.164.8000117.4
868T25.4Very low28.5Very low108 Ų108139.9 Ų139.966%0.66376%0.759SS**  cis-163170.29.4-28.90000112.5
869K26.9Very low28.4Very low175 Ų175144.6 Ų144.676%0.76177%0.77SS**  trans100112.7147.4-71.1176.4-174.3175.50120.5
870Y25.6Very low28.3Very low210 Ų210147.4 Ų147.482%0.82477%0.773SS**  trans64.2100.9136.1-73-83.7000122.3
871T26.3Very low28.4Very low123 Ų123147.2 Ų147.276%0.75577%0.771SS**  -40.7166.2127.441.70000113.7
872P39.1Very low28.3Very low108 Ų108143.7 Ų143.770%0.70177%0.766SS**  cis-153.6174.439.143.8-22.7000120.8
873S29.5Very low28.4Very low116 Ų116143.4 Ų143.481%0.81176%0.755SS**  trans70.4157.6161.177.30000116.5
874L28.2Very low28.3Very low164 Ų164142.7 Ų142.786%0.85975%0.751SS**  cis-133.2143.88.6179.863.8000111.3
875M27.1Very low28.3Very low166 Ų166142.6 Ų142.682%0.81876%0.755SS**  trans-96135.8175.8-179.1160.964.500110.6
876N25.9Very low28.2Very low149 Ų149146.6 Ų146.680%0.79776%0.761SS**  trans-150.3151.8151.6-145.6-5.5000112.6
877N28.6Very low28.2Very low130 Ų130150.7 Ų150.770%0.69577%0.77SS**  trans-76.1174.5169.8-71.1-77.4000108.9
878V26.7Very low28.2Very low116 Ų116148.1 Ų148.170%0.70377%0.77SS**  cis-158.3150.133.3-146.30000110.3
879N27Very low28.2Very low162 Ų162154.6 Ų154.687%0.86678%0.782SS**  -172.9155.5112.5-95.3-31.6000112.8
880N28.2Very low28.3Very low145 Ų145149.1 Ų149.178%0.77578%0.775SS**  trans-133.3-179.4177.8-155.7-31.1000108
881L31.8Very low28.7Very low138 Ų138145.6 Ų145.672%0.72378%0.778SS**  trans71.8152.5-170.5-82.163000114.2
882N27Very low28.6Very low132 Ų132149.5 Ų149.571%0.70679%0.785SS**  cis-131.2158.114.4-154.1-0.5000115.3
883N31.9Very low28Very low121 Ų121151.7 Ų151.765%0.64779%0.79SS**  trans-65.3173.6177.5-53.7-91.5000113.4
884N26.5Very low27.9Very low135 Ų135154.5 Ų154.572%0.72279%0.788SS**  -154.1110.7123.2-115.3-87.7000112.4
885L28.1Very low27.6Very low170 Ų170152.5 Ų152.589%0.8978%0.782SS**  trans-109.6104.7155.3174.664.4000107.3
886R29.7Very low27.5Very low217 Ų217154.3 Ų154.382%0.81979%0.786SS**PPolyproline II helixtrans-86.1126.6170.8-76.5-162.5-170.6-118.29.1110.6
887R26.7Very low27.5Very low235 Ų235154 Ų15489%0.88778%0.784SS**PPolyproline II helixtrans-79.4157145.8-165177.2-70.8-165.2-0.3108.2
888A25.4Very low27.4Very low90 Ų90153.5 Ų153.574%0.74479%0.786SS**PPolyproline II helixtrans-54.6159.4167.600000111.1
889R26.1Very low27.6Very low244 Ų244155.3 Ų155.392%0.92179%0.786SS**  cis-156.7161.636.1-162.3-178.5-164.9174.94.6112.2
890G29.7Very low27.8Very low60 Ų60155.5 Ų155.562%0.61978%0.782SS**  trans-83.1-177.4171.800000115.1
891P33Very low27.8Very low137 Ų137153.7 Ų153.789%0.8978%0.776SS**  trans-83.7-177.1-164.2-12.931.1000116.8
892F23.7Very low27.6Very low205 Ų205153.7 Ų153.790%0.89978%0.776SS**  trans-76.1159.9-178-89.6-102.5000115.7
893L28.4Very low27.7Very low153 Ų153150.3 Ų150.380%0.80177%0.773SS**  trans140.5133.7155.4-75.7163.8000107.2
894K25.6Very low27.6Very low176 Ų176153.1 Ų153.177%0.76578%0.779SS**  cis-153.6145.612.3-135.1165.2-171.7176.80111.1
895T23.1Very low27.6Very low121 Ų121154.6 Ų154.674%0.74278%0.784SS**  trans18.2125.8152.754.40000121.3
896K24Very low27.6Very low205 Ų205155.1 Ų155.189%0.89178%0.782SS**  -166.6154.696.9-122.9176.3179.1178.20113.4
897D26.1Very low28.3Very low143 Ų143149.8 Ų149.877%0.76578%0.775SS**  trans-81.8162.2-177.1-49.2-96.7000114.4
898V26.1Very low28.2Very low119 Ų119146.9 Ų146.972%0.72177%0.771SS**  -174.1124.6121.6142.40000110.8
899H32Very low28.4Very low154 Ų154149.9 Ų149.971%0.71377%0.77SS**  trans25.6150149.9-48.2-40.9000121.8
900Q31.3Very low28.5Very low166 Ų166145.2 Ų145.278%0.77676%0.763SS**  cis-160.8-170.42.2-120.2171.487.700107
901V28.4Very low28.5Very low107 Ų107145.9 Ų145.965%0.64877%0.77SS**  cis-154.7138.29.994.50000108.2
902N28Very low28.4Very low138 Ų138147.3 Ų147.374%0.73877%0.77SS**  49134.8109.7-150.131.3000118.3
903G27.4Very low28.6Very low61 Ų61145.4 Ų145.463%0.62976%0.764SS**  cis-160.6169.45.400000112.3
904K29.6Very low28.6Very low180 Ų180143.6 Ų143.678%0.78375%0.754SS**  74.713478.3-77-164.6174.8-172.20114.8
905M27Very low28.8Very low166 Ų166143.6 Ų143.682%0.81876%0.757SS**  cis-151.3178.1-4.8-62.3-148.470.200112.4
906Q29.3Very low29Very low181 Ų181144.3 Ų144.385%0.84676%0.761SS**  trans-69.2-179.1159.8-104.6179-400113
907P42.6Very low29.2Very low104 Ų104138.2 Ų138.268%0.67576%0.756SS**  cis-138.6-170.5-531.9-7.9000116.4
908Q25.3Very low29.3Very low174 Ų174138.9 Ų138.981%0.81376%0.76SS**  trans99.9135.6133.9-145175.52.800123.1
909H29.6Very low29.5Very low153 Ų153139.8 Ų139.871%0.70877%0.765SS**  trans88.8156.7151.4-123-96.6000123.2
910N29.3Very low29.4Very low146 Ų146140.8 Ų140.878%0.78177%0.772SS**  trans-72.3151.9-160.5-54.4-17.8000117
911G29.6Very low29.3Very low75 Ų75140.8 Ų140.877%0.77378%0.777SS**  trans-177.2134.2161.100000113.9
912N31.2Very low29.3Very low167 Ų167142.1 Ų142.189%0.89379%0.786SS**  trans-66.7150.3-179.6-54.9-34.9000111.5
913H27.3Very low29.5Very low164 Ų164144.2 Ų144.276%0.75979%0.791SS**  175.3135.277.8-171.474.7000112.8
914I27.9Very low29.6Very low116 Ų116146.6 Ų146.660%0.59580%0.796SS**  trans39.4122.5150.2-63.7-170.6000122.7
915Q30.8Very low30.1Very low176 Ų176144 Ų14482%0.82280%0.797SS**  trans53.1148.7152.2-65.8174.33700119.4
916T27.4Very low30.4Very low136 Ų136139.8 Ų139.883%0.83480%0.797SS**  cis-129.1-172.215.647.30000111.4
917G27.8Very low30.7Very low77 Ų77140 Ų14079%0.79480%0.798SS**  trans-143159.8174.600000113.8
918D28.2Very low30.7Very low157 Ų157140.7 Ų140.784%0.8480%0.802SS**  trans-153.4134.8164.3-169.36.9000108.9
919V30.4Very low31.4Very low137 Ų137137.6 Ų137.683%0.8379%0.791SS**  trans-146.5129.1176178.80000109.2
920M29.5Very low32.1Very low175 Ų175138 Ų13886%0.86279%0.793SS**  trans-59.9151.1-175.6-55.1179.171.500114
921L28.8Very low33.3Very low166 Ų166136 Ų13687%0.86978%0.781SS**  trans-125.1141.8161.6-141.877.5000111.7
922T29.4Very low34.2Very low136 Ų136138.2 Ų138.283%0.83477%0.769SS**  trans-91.3156.1-17847.60000112.7
923H30.3Very low35.6Very low182 Ų182134.5 Ų134.584%0.84375%0.753SS**  trans-100.2166.5-171.3-103.6-84.9000115.4
924C31.1Very low36.8Very low111 Ų111129.9 Ų129.975%0.7574%0.736SS**  trans91.1151.4160.3-60.60000118.7
925P40.2Very low37.9Very low124 Ų124128.4 Ų128.481%0.80573%0.734SS**  cis-145.2150.4-4838.3-21.4000116.9
926G32.8Very low38.8Very low78 Ų78123.5 Ų123.580%0.80471%0.713SS**  trans99.4125.3135.600000121.7
927Q34.9Very low39.9Very low187 Ų187125 Ų12587%0.87471%0.711SS**  trans-158.3158.1154.3-105.4-175.79.600110.7
928P42.3Very low41Very low118 Ų118124.2 Ų124.277%0.76670%0.702SS**  trans-96.2166.1-174.837.7-35.2000114.9
929L41.3Very low42.1Very low109 Ų109123.4 Ų123.457%0.57169%0.693SS**  trans-108.8154.9-178.9-61.5178.7000113.2I946L929-I946 HydrophobicContact CB-CG2 4.29Å; L929-I946 HydrophobicContact CD1-CG2 4.14Å
930H44.9Very low43Very low162 Ų162124 Ų12475%0.7569%0.691SS**EExtended strand (participates in β ladder)trans-99.6143173.1-86.2-92.9000112.1I946 T947H930-I946 WeakPolarHBondContact O-CA 3.11Å; H930-T947 PolarHBondContact O-N 2.93Å; H930-T947 VanDerWaalsContact O-N 3.1Å
931I54.2Low43.9Very low104 Ų104119.9 Ų119.953%0.53367%0.671SS.*EExtended strand (participates in β ladder)trans-128.8138.1179.7-50.9-173.2000109.7L944 E945 I946I931-L944 HydrophobicContact CG2-CD2 3.96Å; I931-E945 CarbonylContact C-O 3.5Å; I931-E945 VanDerWaalsContact CA-O 3.32Å; I931-E945 WeakPolarHBondContact CA-O 3.38Å; I931-I946 HydrophobicContact CB-CG1 4.47Å; I931-I946 HydrophobicContact CD1-CD1 3.91Å; I931-I946 HydrophobicContact CD1-CG1 4.12Å; I931-I946 HydrophobicContact CG1-CB 4.47Å; I931-I946 HydrophobicContact CG1-CD1 4.24Å; I931-I946 HydrophobicContact CG1-CG1 3.92Å; I931-I946 HydrophobicContact CG1-CG2 4.18Å; I931-I946 HydrophobicContact CG2-CG1 4.1Å
932K48.8Very low45Very low120 Ų120114.7 Ų114.752%0.52265%0.652SS.*EExtended strand (participates in β ladder)trans-124.6140.4175174.3-179158.4-129.60110L944 E945K932-L944 WeakPolarHBondContact O-CA 3.47Å; K932-E945 HydrophobicContact CB-CB 4.5Å; K932-E945 PolarHBondContact N-O 3.45Å; K932-E945 IonicContact NZ-OE2 2.72Å; K932-E945 PolarHBondContact NZ-OE2 3.48Å; K932-E945 PolarHBondContact O-N 3.37Å
933V59.6Low46Very low90 Ų90111.9 Ų111.955%0.54564%0.635SS.*EExtended strand (participates in β ladder)trans-114.8135-179.5-1580000109.9A942 T943 L944V933-A942 HydrophobicContact CG1-CB 4.08Å; V933-T943 WeakPolarHBondContact CA-O 3.33Å; V933-L944 HydrophobicContact CB-CD2 4.03Å; V933-L944 HydrophobicContact CG1-CD2 3.78Å; V933-L944 HydrophobicContact CG2-CD2 3.6Å
934T53.3Low46.8Very low66 Ų66107.8 Ų107.841%0.40562%0.619SS.*EExtended strand (participates in β ladder)trans-130.3111.9173.9-46.30000110.2A942 T943T934-A942 WeakPolarHBondContact O-CA 2.88Å; T934-T943 PolarHBondContact N-O 3.49Å; T934-T943 PolarHBondContact O-N 3.41Å
935P49.3Very low47.8Very low86 Ų86107.1 Ų107.156%0.55860%0.604SS**EExtended strand (participates in β ladder)trans-78136.3178.9-1429.9000113.2A942P935-A942 HydrophobicContact CB-CB 4.37Å
936D50.1Low48.2Very low73 Ų73106.1 Ų106.139%0.3959%0.591SS.*EExtended strand (participates in β ladder)trans-105120.1164.1173.825.8000110.1G938 H939 M941D936-G938 PolarHBondContact OD1-N 2.96Å; D936-H939 IonicContact OD2-CE1 2.7Å; D936-H939 IonicContact OD2-CG 3.75Å; D936-H939 IonicContact OD2-ND1 2.77Å; D936-H939 PolarHBondContact OD2-ND1 3.3Å; D936-M941 PolarHBondContact N-O 3.26Å; D936-M941 PolarHBondContact O-N 2.91Å; D936-M941 VanDerWaalsContact O-O 3.14Å
937H51.2Low48.9Very low168 Ų168107.1 Ų107.178%0.77858%0.582SS**THydrogen-bonded Turntrans-85.4-3.2179.8-74.217.2000113.9
938G50.2Low49Very low59 Ų59102.1 Ų102.161%0.60857%0.568SS**THydrogen-bonded Turntrans-71.2-34.8170.300000113.4D936D936-G938 PolarHBondContact OD1-N 2.96Å
939H52.3Low49Very low140 Ų140101.3 Ų101.365%0.64856%0.563SS**THydrogen-bonded Turntrans-126.75.9-166-57.996.9000115.2D936 M941D936-H939 IonicContact OD2-CE1 2.7Å; D936-H939 IonicContact OD2-CG 3.75Å; D936-H939 IonicContact OD2-ND1 2.77Å; D936-H939 PolarHBondContact OD2-ND1 3.3Å; H939-M941 HydrophobicContact CB-CB 4.47Å; H939-M941 HydrophobicContact CB-CG 4.37Å; H939-M941 HydrophobicContact CB-SD 4.32Å; H939-M941 PolarHBondContact O-N 3.12Å
940N48.3Very low49Very low149 Ų149103 Ų10380%0.79757%0.572SS**THydrogen-bonded Turntrans53.535.8-170.2-81.1-26.8000113.2
941M49.1Very low48.4Very low90 Ų90101 Ų10144%0.44357%0.571SS.*EExtended strand (participates in β ladder)trans-116.8152.9179.2-74.8175.852.900110.5D936 H939 V962D936-M941 PolarHBondContact N-O 3.26Å; D936-M941 PolarHBondContact O-N 2.91Å; D936-M941 VanDerWaalsContact O-O 3.14Å; H939-M941 HydrophobicContact CB-CB 4.47Å; H939-M941 HydrophobicContact CB-CG 4.37Å; H939-M941 HydrophobicContact CB-SD 4.32Å; H939-M941 PolarHBondContact O-N 3.12Å; M941-V962 HydrophobicContact CE-CB 4.37Å; M941-V962 HydrophobicContact CE-CG1 3.8Å; M941-V962 HydrophobicContact CE-CG2 3.69Å; M941-V962 HydrophobicContact SD-CG1 4.26Å
942A51.3Low47.4Very low57 Ų57104.4 Ų104.447%0.47159%0.585SS.*EExtended strand (participates in β ladder)trans-135.8127.3173.400000109.9V933 T934 P935V933-A942 HydrophobicContact CG1-CB 4.08Å; T934-A942 WeakPolarHBondContact O-CA 2.88Å; P935-A942 HydrophobicContact CB-CB 4.37Å
943T51.1Low46.7Very low77 Ų77104.8 Ų104.847%0.47260%0.598SS.*EExtended strand (participates in β ladder)trans-88.9136.7-174.6-34.80000110V933 T934V933-T943 WeakPolarHBondContact CA-O 3.33Å; T934-T943 PolarHBondContact N-O 3.49Å; T934-T943 PolarHBondContact O-N 3.41Å
944L46.8Very low45.8Very low96 Ų96105.9 Ų105.950%0.50361%0.606SS.*EExtended strand (participates in β ladder)trans-108.2122.2177.5-68.9169.9000110.4I931 K932 V933I931-L944 HydrophobicContact CG2-CD2 3.96Å; K932-L944 WeakPolarHBondContact O-CA 3.47Å; V933-L944 HydrophobicContact CB-CD2 4.03Å; V933-L944 HydrophobicContact CG1-CD2 3.78Å; V933-L944 HydrophobicContact CG2-CD2 3.6Å
945E51.7Low44.8Very low96 Ų96111.2 Ų111.245%0.44963%0.627SS.*EExtended strand (participates in β ladder)trans-101.9126168.8-64.3179.312700108.6I931 K932I931-E945 CarbonylContact C-O 3.5Å; I931-E945 VanDerWaalsContact CA-O 3.32Å; I931-E945 WeakPolarHBondContact CA-O 3.38Å; K932-E945 HydrophobicContact CB-CB 4.5Å; K932-E945 PolarHBondContact N-O 3.45Å; K932-E945 IonicContact NZ-OE2 2.72Å; K932-E945 PolarHBondContact NZ-OE2 3.48Å; K932-E945 PolarHBondContact O-N 3.37Å
946I49.4Very low43.7Very low104 Ų104112.6 Ų112.653%0.53364%0.639SS.*EExtended strand (participates in β ladder)trans-116.3133.1173.5-51.4-173.7000107.6L929 H930 I931L929-I946 HydrophobicContact CB-CG2 4.29Å; L929-I946 HydrophobicContact CD1-CG2 4.14Å; H930-I946 WeakPolarHBondContact O-CA 3.11Å; I931-I946 HydrophobicContact CB-CG1 4.47Å; I931-I946 HydrophobicContact CD1-CD1 3.91Å; I931-I946 HydrophobicContact CD1-CG1 4.12Å; I931-I946 HydrophobicContact CG1-CB 4.47Å; I931-I946 HydrophobicContact CG1-CD1 4.24Å; I931-I946 HydrophobicContact CG1-CG1 3.92Å; I931-I946 HydrophobicContact CG1-CG2 4.18Å; I931-I946 HydrophobicContact CG2-CG1 4.1Å
947T46.1Very low42.9Very low98 Ų98118.3 Ų118.360%0.60166%0.66SS**EExtended strand (participates in β ladder)trans-131.9132.7-176.5-42.50000111.8H930H930-T947 PolarHBondContact O-N 2.93Å; H930-T947 VanDerWaalsContact O-N 3.1Å
948S38.8Very low41.9Very low82 Ų82116.3 Ų116.357%0.57366%0.66SS**  trans-109.9152.2171.253.60000111.3N950S948-N950 PolarHBondContact O-N 3.39Å
949P42.1Very low41Very low102 Ų102119.1 Ų119.166%0.66267%0.67SS**  trans-80.9117.9174.5-10.428.6000112.2
950N39.9Very low40.3Very low143 Ų143117.4 Ų117.477%0.76567%0.67SS**  trans28.9150.5139604.6000121.8S948S948-N950 PolarHBondContact O-N 3.39Å
951T33.7Very low39.6Very low120 Ų120114.9 Ų114.974%0.73667%0.67SS**  cis-143.2166.335.4500000115.7
952E32.2Very low39.1Very low176 Ų176115 Ų11582%0.82268%0.675SS**SBendtrans74.675.9165.8-50.5-157.9161.300119.3
953T33.5Very low38.2Very low129 Ų129118.6 Ų118.679%0.79169%0.685SS**  30148.8127.652.90000122.9
954P41.7Very low37.4Very low112 Ų112120.5 Ų120.573%0.72770%0.699SS**  cis-145.9111.2-26.136.1-14.8000114.6
955Q31.1Very low36.9Very low178 Ų178121.4 Ų121.483%0.83271%0.708SS**  trans-154.2116.4157.4-115.9171.221.500111.1
956S27.8Very low36.1Very low116 Ų116122.8 Ų122.881%0.81173%0.729SS**  trans-94.3112.6-169.8-57.30000112.5
957F32.4Very low35.5Very low192 Ų192122 Ų12284%0.84275%0.747SS**  trans-95.592166.5-75.7-78.8000110.8S959F957-S959 PolarHBondContact O-N 2.96Å
958T30.4Very low35.1Very low126 Ų126120.3 Ų120.377%0.77375%0.749SS**  trans-72.4107.6172.9-54.80000109.9T960T958-T960 HydrophobicContact CG2-CG2 4.42Å
959S32Very low35.4Very low118 Ų118122.3 Ų122.383%0.82576%0.759SS**  trans-108.795.9-179.5-163.10000111.4F957 A961F957-S959 PolarHBondContact O-N 2.96Å; S959-A961 PolarHBondContact O-N 3.27Å
960T36.8Very low35.3Very low105 Ų105123.3 Ų123.364%0.64477%0.766SS**  trans-84.1101.817749.20000111.1T958T958-T960 HydrophobicContact CG2-CG2 4.42Å
961A34.5Very low34.8Very low95 Ų95126.6 Ų126.679%0.78577%0.774SS**  trans-84128172.700000111.3S959S959-A961 PolarHBondContact O-N 3.27Å
962V36.9Very low34.9Very low93 Ų93129.9 Ų129.956%0.56478%0.78SS**  trans-100.6128.6177.2178.80000109.7M941M941-V962 HydrophobicContact CE-CB 4.37Å; M941-V962 HydrophobicContact CE-CG1 3.8Å; M941-V962 HydrophobicContact CE-CG2 3.69Å; M941-V962 HydrophobicContact SD-CG1 4.26Å
963I33.7Very low34.9Very low133 Ų133132.7 Ų132.768%0.68278%0.784SS**  trans-103115.7175.5-57.7176.4000108.9T965I963-T965 PolarHBondContact O-N 3.39Å
964P35Very low34.7Very low116 Ų116133.5 Ų133.575%0.75378%0.781SS**  trans-72.8114.6173.3-14.830.2000110.8
965T34.9Very low34.1Very low115 Ų115134.9 Ų134.971%0.70679%0.788SS**PPolyproline II helixtrans-73.7130.1167.5530000110.1I963 G967I963-T965 PolarHBondContact O-N 3.39Å; T965-G967 PolarHBondContact O-N 3.5Å
966S35.7Very low33.9Very low126 Ų126132.9 Ų132.988%0.88178%0.782SS**PPolyproline II helixtrans-51.2129-177.9-52.30000113.1
967G36.9Very low34Very low88 Ų88134.2 Ų134.291%0.90778%0.778SS**PPolyproline II helixtrans-70.4137-171.600000114.7T965T965-G967 PolarHBondContact O-N 3.5Å
968G36.9Very low33.7Very low62 Ų62132.5 Ų132.564%0.63977%0.773SS**  trans-130143.5158.700000109.3
969P45.5Very low33.6Very low123 Ų123133 Ų13380%0.79977%0.771SS**  trans-66.8146.1-175.626.5-34.1000112.2K971P969-K971 PolarHBondContact O-N 3.03Å
970P39Very low33.5Very low124 Ų124132 Ų13281%0.80577%0.77SS**  trans-72.9126.7-17128.3-34.9000112.8Q972P970-Q972 PolarHBondContact O-N 3.18Å
971K30.2Very low33.1Very low212 Ų212131.7 Ų131.792%0.92277%0.772SS**  trans-74.3110.8167.7-71.1179.5178176.40109.9P969 R973P969-K971 PolarHBondContact O-N 3.03Å; K971-R973 PolarHBondContact O-N 3.21Å
972Q36.1Very low32.9Very low188 Ų188134 Ų13488%0.87977%0.769SS**  trans-80.2118.1165.2-76.1-164.4-6.400111.5P970P970-Q972 PolarHBondContact O-N 3.18Å
973R32.8Very low32.4Very low236 Ų236134.5 Ų134.589%0.89178%0.777SS**  trans23.2123.8143.1-153.4173.2-172-176.51.2119.1K971K971-R973 PolarHBondContact O-N 3.21Å
974I28.4Very low33.2Very low145 Ų145133.8 Ų133.874%0.74478%0.781SS**  trans-41.1133.1169.5-59.3154.2000114.2I976I974-I976 HydrophobicContact CG2-CG1 3.75Å
975T27.9Very low32.8Very low142 Ų142134 Ų13487%0.87178%0.78SS**  trans-127.4140.2137.8-64.40000107.8
976I28.2Very low32.6Very low135 Ų135133.5 Ų133.569%0.69278%0.778SS**  trans-93.8137.6-173.8-58.6166.8000109.5I974I974-I976 HydrophobicContact CG2-CG1 3.75Å
977I29.6Very low32.4Very low145 Ų145136.7 Ų136.774%0.74478%0.775SS**  trans179.7123.7134-93.7154.6000111.7
978Q26.7Very low31.9Very low155 Ų155137.1 Ų137.172%0.72477%0.765SS**  trans55.3119.5149.9-67.3175.5-1.100123.3
979N28.9Very low31.6Very low138 Ų138141.9 Ų141.974%0.73877%0.774SS**  trans78.2108.2130-56.5-6.4000121.7
980A28.5Very low30.7Very low96 Ų96140.8 Ų140.879%0.79377%0.769SS**  57.6148.5121.600000122.1
981S28.3Very low30.8Very low98 Ų98139.6 Ų139.669%0.68576%0.762SS**  cis-177.8165.1-20.252.30000111
982I30.4Very low30.6Very low143 Ų143135.2 Ų135.273%0.73375%0.753SS**  trans72.2136.3162.3-13.5-177.2000120.3
983S27.6Very low30.3Very low105 Ų105133 Ų13373%0.73475%0.752SS**  trans-77.7-160.8161.1-34.20000111.2
984P49.1Very low30Very low118 Ų118131.6 Ų131.677%0.76675%0.753SS**  cis-138.1-165.9-4.140.1-18.6000116.1
985T28.2Very low30Very low120 Ų120130.2 Ų130.274%0.73676%0.755SS**  trans-59.9160.7168.350.80000113.6
986T30.9Very low30Very low105 Ų105132.6 Ų132.664%0.64475%0.754SS**  -178.4155.375.245.90000114.2
987K31.2Very low29.7Very low192 Ų192132 Ų13284%0.83576%0.76SS**  trans47.7143.7136-64.3174.4-175.6179.10120.2
988S26.5Very low29.6Very low98 Ų98129.4 Ų129.469%0.68576%0.755SS**  cis-176.4-177.9-3.246.30000110.4
989I30.4Very low29.6Very low161 Ų161126.7 Ų126.783%0.82675%0.753SS**  trans99.4135.7164-56.6167.4000115.9
990S26.3Very low29.6Very low101 Ų101127.2 Ų127.271%0.70676%0.755SS**  trans-85.9-169.9-177.756.50000111.8
991P41.3Very low29.6Very low99 Ų99126.7 Ų126.764%0.64375%0.745SS**  cis-142.8-177.78.442.5-22.4000117.2
992T25.7Very low29.6Very low120 Ų120129.8 Ų129.874%0.73675%0.754SS**  trans53.4126.2156.150.60000118.6
993T29.9Very low29.4Very low142 Ų142131.6 Ų131.687%0.87176%0.759SS**  -161.2-178.472.231.80000111.9
994K26.3Very low30.2Very low206 Ų206131.9 Ų131.990%0.89676%0.758SS**  trans-98.6139.2-172.1-51.1165.6-176.7173.30111.6
995S28.8Very low29.2Very low115 Ų115131.9 Ų131.980%0.80476%0.76SS**  -170.9155128.250.60000114.2
996K26.9Very low29.1Very low192 Ų192130.9 Ų130.984%0.83576%0.758SS**  trans-10.6135.8163-58171.8-179.3178.70116.6
997C23.2Very low29.8Very low123 Ų123131.4 Ų131.483%0.83176%0.763SS**  59.9125.762.8-156.30000110.9
998S26.3Very low29.6Very low90 Ų90128.9 Ų128.963%0.62976%0.759SS**  cis-154.717725.954.40000112.7
999S26.7Very low29.7Very low98 Ų98134.6 Ų134.669%0.68577%0.765SS**  trans65155140.2620000119.6
1000I28.6Very low29.5Very low150 Ų150130.9 Ų130.977%0.76976%0.759SS**  cis-162.7161.9-15.2-113167.7000107.5
1001S29.8Very low29.7Very low85 Ų85134 Ų13459%0.59477%0.767SS**  trans55.2124.7160.465.50000121.9
1002D27.2Very low28.9Very low162 Ų162134.5 Ų134.587%0.86677%0.772SS**  80.4146.3125-54.2-2.6000123.6
1003E27.3Very low30.1Very low182 Ų182133.2 Ų133.285%0.8577%0.766SS**  trans-65.5179.3175.4-81-176.898.900115.6
1004P44.4Very low30Very low110 Ų110135.2 Ų135.271%0.71476%0.763SS**  cis-133-173.4-14.121.52.7000114.4
1005C27.6Very low30.3Very low118 Ų118131 Ų13180%0.79776%0.755SS**  trans99.5134.5145.5-148.70000119.7
1006S26.2Very low30.3Very low99 Ų99133.8 Ų133.869%0.69276%0.757SS**  trans-58.6164.116748.60000113.7
1007P45.8Very low30.5Very low117 Ų117128.8 Ų128.876%0.7674%0.743SS**  cis-154.9165.841.243.7-22.5000121.8
1008D26.1Very low30.7Very low138 Ų138129.6 Ų129.674%0.73874%0.744SS**  trans64154.1142.6-159.331.2000122.8
1009R28.9Very low30.9Very low219 Ų219135.1 Ų135.183%0.82675%0.753SS**  trans72.6111.5155.8-97.7171.5-175.6-153.8-0.7121.8
1010A26Very low31Very low83 Ų83135.7 Ų135.769%0.68676%0.756SS**  133135.6101.300000118.2
1011L31.1Very low31Very low167 Ų167139 Ų13987%0.87476%0.759SS**  trans68.498.5149.1-61.8164.8000122
1012S25.1Very low30.9Very low109 Ų109138.5 Ų138.576%0.76276%0.76SS**  7.8169.2109.4-108.90000121.1
1013P49.4Very low31Very low92 Ų92138.1 Ų138.160%0.59776%0.755SS**  cis-147.2-168.41.333.9-8.4000117.8
1014F29.2Very low31.1Very low184 Ų184135.4 Ų135.481%0.80775%0.751SS**  trans64.1110.9149-68.9-44.6000121.2
1015T31.9Very low31.6Very low119 Ų119135.2 Ų135.273%0.7375%0.75SS**  86.5130.267.854.80000117.8
1016M29.6Very low31.8Very low172 Ų172136.5 Ų136.585%0.84775%0.749SS**  -169.8161113.7-106.2-157.373.800114.6
1017T31.1Very low31.7Very low88 Ų88136.8 Ų136.854%0.5475%0.751SS.*  trans-108.9156.5178.439.80000112.3
1018T26.9Very low31Very low140 Ų140137.3 Ų137.386%0.85976%0.756SS**  trans-155.2158.7144.5-18.70000113.6
1019Y29.7Very low31.1Very low206 Ų206134.1 Ų134.181%0.80876%0.756SS**  trans-101.4158.4-165.9-59.8-107.4000114.1
1020S29.3Very low31.2Very low109 Ų109129 Ų12976%0.76275%0.754SS**  170.3134.5122.8-77.60000110.7
1021R29.6Very low31.4Very low219 Ų219131.8 Ų131.883%0.82676%0.762SS**  cis81.7132.645.7-170-169.9-156.9-1506.9112.3
1022A26.4Very low31.4Very low75 Ų75129.8 Ų129.862%0.6276%0.757SS**  cis-173.4173.3-23.200000108
1023M29.6Very low32.9Very low155 Ų155129.9 Ų129.976%0.76476%0.755SS**  167.5159.9118.3-85.3-48.3-179.100114.9
1024T29.6Very low31.9Very low124 Ų124132.5 Ų132.576%0.76176%0.764SS**  trans-130.8-150.1178.655.70000106.9
1025P54.1Low31.9Very low106 Ų106135 Ų13569%0.68877%0.768SS**  cis-120.6-137.7-20.128.9-2.5000109.3
1026D31.9Very low31.8Very low145 Ų145132.9 Ų132.978%0.77576%0.763SS**  cis-163.3171-2.3-143.1-47.2000110.3
1027S25.6Very low31.8Very low106 Ų106133 Ų13374%0.74176%0.763SS**  trans175.7143.3135.5-164.30000113.8
1028C29.8Very low31.8Very low127 Ų127134.2 Ų134.286%0.85878%0.775SS**  trans-45.9168.8-177.1-49.90000118.2
1029G28.5Very low32.9Very low72 Ų72132.6 Ų132.674%0.74277%0.767SS**  cis169-169.17.400000109.3
1030S31.7Very low32.7Very low111 Ų111129.2 Ų129.278%0.77676%0.762SS**  cis178.7150.2-17.650.20000111.6
1031V29.2Very low32.5Very low142 Ų142131.8 Ų131.886%0.86176%0.762SS**  trans77.1159.4165.7-177.40000118.6
1032T32Very low32.5Very low125 Ų125127.7 Ų127.777%0.76776%0.755SS**  trans-123.7-154.7-163.551.50000110.3
1033P56.3Low32.5Very low111 Ų111129.4 Ų129.472%0.72176%0.757SS**  cis-146.4-178.9-0.246.5-26.4000119.7
1034D29.1Very low32.4Very low147 Ų147128 Ų12879%0.78676%0.763SS**  trans60.9134.3141.5-163.729.1000123.4A1036D1034-A1036 PolarHBondContact OD1-N 3.13Å; D1034-A1036 VanDerWaalsContact OD1-N 3.1Å
1035R29.1Very low32.3Very low235 Ų235127.4 Ų127.489%0.88776%0.758SS**  -163.3104.8118.7-162.1160.6-163.7166.56.5116
1036A28.4Very low31.1Very low76 Ų76128.1 Ų128.163%0.62876%0.761SS**  trans69.7167.4143.700000122.4D1034D1034-A1036 PolarHBondContact OD1-N 3.13Å; D1034-A1036 VanDerWaalsContact OD1-N 3.1Å
1037M30.9Very low30.9Very low174 Ų174127.8 Ų127.886%0.85776%0.764SS**  trans-149146.6-170.5-87.7-81.3167.600112.7
1038S31.2Very low31.1Very low113 Ų113126.5 Ų126.579%0.7977%0.768SS**  trans65.4177.8160.6-560000116.3
1039P49.2Very low31Very low106 Ų106125.1 Ų125.169%0.68877%0.766SS**  cis-142.7175.33.644.5-26000119.1
1040I25.6Very low31Very low135 Ų135129.7 Ų129.769%0.69277%0.768SS**  trans78.1116.6138.6-81.1163.1000123.4
1041Q25.3Very low30.7Very low164 Ų164129.7 Ų129.777%0.76676%0.759SS**  trans64163.6135.9-66.5-176.5-2200121.5
1042I28.3Very low30.5Very low132 Ų132130.7 Ų130.768%0.67775%0.754SS**  cis-153.7152.33.9-131.2161.1000114.5
1043V26.7Very low30.2Very low112 Ų112129.3 Ų129.368%0.67975%0.749SS**  trans43.5120.5155.9175.10000122.9V1045V1043-V1045 HydrophobicContact CG1-CG2 3.86Å
1044S27.1Very low28.8Very low125 Ų125131.8 Ų131.887%0.87476%0.756SS**  -165.7169.4129.7-78.90000111.5
1045V28.3Very low28.8Very low111 Ų111130 Ų13067%0.67376%0.755SS**  -155.5127-96126.80000113.5V1043V1043-V1045 HydrophobicContact CG1-CG2 3.86Å
1046T29.2Very low29Very low121 Ų121122.3 Ų122.374%0.74274%0.741SS**  trans58.5157.6161.460.10000119.2
1047T28.1Very low29.1Very low138 Ų138126.6 Ų126.685%0.84775%0.748SS**  cis-166.6166.1-14.221.30000108.4
1048G28.1Very low29.8Very low79 Ų79123.5 Ų123.581%0.81474%0.741SS**  trans142.3153.8146.400000116.3
1049A29Very low29.9Very low98 Ų98123.8 Ų123.881%0.8174%0.738SS**  trans-149.2164.1179.600000112.3
1050Q27.4Very low29.2Very low168 Ų168127.2 Ų127.279%0.78575%0.745SS**  trans75.5149.5164.2-94.6-171.3-99.600121.3
1051D26.4Very low29.6Very low112 Ų112126 Ų12660%0.59974%0.744SS**  trans76.4114.3147.1-64.47.6000123.8
1052H25.5Very low29.8Very low162 Ų162125.8 Ų125.875%0.7575%0.746SS**  63.5111.3125-72.6-58.9000123.8
1053S24.1Very low29.9Very low96 Ų96122.8 Ų122.867%0.67175%0.748SS**  83.7164.8115.8-58.60000121.7
1054L28.1Very low30.1Very low163 Ų163120.8 Ų120.885%0.85375%0.75SS**  trans82126.6174.8-49.9179000114.9
1055S28.5Very low30.4Very low111 Ų111124 Ų12478%0.77675%0.751SS**  cis77145.732-149.10000112.9
1056A33.8Very low30.4Very low72 Ų72122.9 Ų122.960%0.59575%0.753SS**  cis-136.7-153.74.800000109.6
1057E31Very low30.3Very low166 Ų166123 Ų12378%0.77675%0.753SS**  cis-170.7-179-4.8-129.7145-118.500106.4V1059E1057-V1059 HydrophobicContact CG-CG2 4.14Å
1058P45.7Very low30.1Very low109 Ų109125.8 Ų125.871%0.70875%0.754SS**  cis-115.8164.3-21.119.54.3000112.7
1059V32.5Very low30.2Very low119 Ų119133 Ų13372%0.72176%0.756SS**  63.4130.258.5-135.60000111.6E1057E1057-V1059 HydrophobicContact CG-CG2 4.14Å
1060E34.8Very low30.2Very low178 Ų178134.6 Ų134.683%0.83276%0.756SS**  cis-154.6-179.948.7-81.7-169.187.400111.4
1061V34.7Very low30.5Very low110 Ų110132.7 Ų132.767%0.66776%0.756SS**  cis-176.3153-19.9147.10000104.4
1062I28Very low31.3Very low159 Ų159132 Ų13282%0.81576%0.757SS**  cis-144.2172.611.9-142159.3000107.5
1063G30.3Very low31.3Very low70 Ų70131 Ų13172%0.72275%0.753SS**  cis122.7100.6-6.200000114.7
1064G32.4Very low31.6Very low69 Ų69135 Ų13571%0.71175%0.753SS**  trans172.2105.9168.900000119.6
1065H31.9Very low31.6Very low194 Ų194134 Ų13490%0.89875%0.745SS**  trans58.4118.1146-64-75000125.7
1066A30.1Very low31.4Very low86 Ų86133.4 Ų133.471%0.71174%0.74SS**  84.5114118.300000125.1
1067V26.5Very low30.8Very low123 Ų123134.2 Ų134.275%0.74574%0.741SS**  45.2118.5129-165.30000121.3
1068F24.1Very low30.5Very low198 Ų198137.2 Ų137.287%0.86875%0.746SS**  -173.8166.9112.4-116.4-84000114.2
1069R28.6Very low29.6Very low229 Ų229137.9 Ų137.986%0.86474%0.739SS**  trans-89.1166.1164.2-61.3-179.2179.9-171.50.8110.4
1070V29.4Very low29.2Very low133 Ų133137.3 Ų137.381%0.80674%0.736SS**  171.1133.9114.9152.40000111.1
1071T34.5Very low28.6Very low127 Ų127135.5 Ų135.578%0.77973%0.728SS**  trans-98159.9167-28.30000109.3
1072P43Very low28.1Very low97 Ų97133.7 Ų133.763%0.6372%0.72SS**  -146.6149.4120.837.1-23000115.9
1073E25.1Very low28Very low143 Ų143130.4 Ų130.467%0.66871%0.711SS**  trans57.7150.2136.8-65.5179.8108.300120.5
1074R30.3Very low27.8Very low179 Ų179132.4 Ų132.468%0.67571%0.705SS**  cis-156.2166.15.6-130.8171.7-151.3-116.63.8112.4
1075Q27.7Very low27.5Very low143 Ų143133.4 Ų133.467%0.66870%0.701SS**  trans17.1155.7137.5-76.3171.8-3600121.9
1076S24.9Very low27.5Very low97 Ų97128.3 Ų128.368%0.67869%0.687SS**  cis170.1156.9-19.252.20000109.5
1077S21.8Very low27.3Very low89 Ų89126.8 Ų126.862%0.62268%0.68SS**  cis-176.8164.2-30.153.40000109
1078W24.9Very low27.4Very low229 Ų229124.3 Ų124.387%0.86767%0.668SS**  trans67.4169.1-179.5-50.399.5000114.7
1079Q25.2Very low27.5Very low123 Ų123122.1 Ų122.158%0.57567%0.665SS**  cis-161.9150.72.4-144.5179.62.400111.2
1080V24.6Very low27.5Very low108 Ų108116.7 Ų116.766%0.65566%0.658SS**  trans62.3151.2142.5147.30000118.9
1081Q23.6Very low27.4Very low140 Ų140116.6 Ų116.665%0.65465%0.651SS**  cis-170.9168.3-20.6-178170.7-35.500108K457K457-Q1081 PolarHBondContact NZ-O 3.28Å
1082S24.1Very low27Very low72 Ų72117.1 Ų117.150%0.50366%0.655SS.*  trans65.8135.3166.114.90000116.8K457K457-S1082 PolarHBondContact NZ-O 3.44Å
1083S25.1Very low26.7Very low90 Ų90117.7 Ų117.763%0.62966%0.656SS**  72.8138.853.6-52.30000112.6
1084N25.7Very low27.1Very low112 Ų112118.9 Ų118.960%0.59966%0.662SS**  cis-156.2133.613.5-134.24.7000118.2E461E461-N1084 PolarHBondContact OE1-N 3.49Å; E461-N1084 VanDerWaalsContact OE1-N 3.07Å
1085S27.2Very low27.6Very low89 Ų89117.2 Ų117.262%0.62267%0.666SS**  trans74.1162.2142.487.30000122.1
1086S30.3Very low28.5Very low87 Ų87115.7 Ų115.761%0.60866%0.663SS**  trans63.8124.8149.2-49.20000118.7S464S464-S1086 PolarHBondContact OG-O 3.46Å
1087G27.2Very low29.2Very low54 Ų54120.2 Ų120.256%0.55767%0.67SS**  cis-164.8-173.3-2.600000109.5
1088S27.5Very low30.3Very low71 Ų71121.9 Ų121.950%0.49767%0.671SS.*  cis-164.7147.717.755.30000110.7K471K471-S1088 PolarHBondContact NZ-OG 2.92Å; K471-S1088 VanDerWaalsContact NZ-OG 3.14Å
1089N27.1Very low30.9Very low152 Ų152118.7 Ų118.781%0.81367%0.665SS**  38.4137.3129.1-59.64000118.9
1090V27.3Very low31.5Very low116 Ų116118.3 Ų118.370%0.70367%0.666SS**  cis-173.3166.522.389.70000113.9
1091I27.6Very low31.9Very low130 Ų130120.7 Ų120.767%0.66767%0.67SS**  trans57.6130.4158.5-65.8167.4000119.9T1093I1091-T1093 VanDerWaalsContact CG2-N 3.31Å
1092T27.1Very low32.5Very low139 Ų139121.1 Ų121.185%0.85368%0.675SS**  trans-123.5106.7139.849.30000111
1093T36.9Very low32.7Very low109 Ų109119.7 Ų119.767%0.66967%0.672SS**  -145128.4128.849.90000104.9I1091I1091-T1093 VanDerWaalsContact CG2-N 3.31Å
1094E33.8Very low32.7Very low168 Ų168122.8 Ų122.879%0.78568%0.682SS**  cis-153.9158.4-5.652.5-127.313000110.3
1095D39.2Very low34.2Very low143 Ų143121.5 Ų121.577%0.76568%0.679SS**  trans5.3138.4159.7-82.734.2000120.1
1096N47.1Very low34.4Very low112 Ų112125.9 Ų125.960%0.59969%0.688SS**  cis-170.1148.60.5-130.6-46.2000105.6
1097K40.8Very low34.4Very low192 Ų192127.8 Ų127.884%0.83569%0.69SS**  cis-149.2172.637.7-67.7-173.5173.6-178.30113.5
1098I44.4Very low34.4Very low123 Ų123133.5 Ų133.563%0.63170%0.702SS**  trans-111.6162.5-171-53.2153.9000110.6I1100I1098-I1100 HydrophobicContact CG2-CD1 3.87Å; I1098-I1100 HydrophobicContact CG2-CG1 4.19Å
1099H36Very low34.2Very low162 Ų162134.2 Ų134.275%0.7571%0.712SS**  trans164.4126.5130.9-84.3-70.5000109.6
1100I38Very low34.2Very low115 Ų115133.3 Ų133.359%0.5971%0.712SS**  69.1125.856.4-64.8171.9000110.1I1098I1098-I1100 HydrophobicContact CG2-CD1 3.87Å; I1098-I1100 HydrophobicContact CG2-CG1 4.19Å
1101H34.7Very low34.1Very low159 Ų159132.7 Ų132.774%0.73671%0.713SS**  cis-167.1-173.1-4.7-108.7-6.7000108
1102L35.7Very low34.1Very low148 Ų148132.7 Ų132.778%0.77572%0.719SS**  cis-161.1-178.85-131171.7000109.7
1103G27Very low35Very low42 Ų42131.7 Ų131.743%0.43372%0.715SS.*  trans108.3110.3141.900000119.3K294K294-G1103 PolarHBondContact NZ-O 2.64Å
1104N26.1Very low34.5Very low155 Ų155132 Ų13283%0.82972%0.721SS**  trans-90.5-163.4168.4-147.612.4000109
1105P57.6Low34.3Very low85 Ų85132.7 Ų132.755%0.55272%0.724SS**  cis-146.9-168.8-1245.9-26.7000117.8
1106F31.5Very low33.8Very low181 Ų181132.4 Ų132.479%0.79473%0.728SS**  trans80109.8148-93.2-92.8000124.5
1107I29.1Very low33.6Very low128 Ų128133 Ų13366%0.65674%0.738SS**  72152.3125.8-75.1-165.3000125.6
1108Q27.7Very low33Very low173 Ų173127.3 Ų127.381%0.80873%0.733SS**  trans68.8132.7170.8-86.9156.8-66.300117.4
1109A24.6Very low32.3Very low87 Ų87129.4 Ų129.472%0.71975%0.745SS**  cis97.1153.717.700000116.1
1110V25.6Very low32Very low133 Ų133128.7 Ų128.781%0.80674%0.742SS**  trans76.4106.4-169.8-169.80000111.8
1111S25.3Very low31.5Very low103 Ų103130 Ų13072%0.7275%0.745SS**  90.5116.660.2-620000114.8
1112T28.1Very low31.4Very low130 Ų130129.7 Ų129.780%0.79874%0.744SS**  trans11.7147.6142.556.20000120.2
1113P45.5Very low31.2Very low118 Ų118133.4 Ų133.477%0.76675%0.748SS**  cis-158.4154.347.541.5-19.3000121.8
1114S27.7Very low31.5Very low114 Ų114136 Ų13680%0.79776%0.756SS**  trans65.4166132.7-147.20000125
1115Q28.9Very low31.8Very low183 Ų183135.8 Ų135.886%0.85575%0.75SS**  trans81.499.6161.1-79.5174.1-9.300123.4
1116V27.8Very low30.5Very low138 Ų138138.1 Ų138.184%0.83676%0.756SS**  trans-75.3179144.8-98.50000110.9
1117P43.4Very low30.6Very low125 Ų125137 Ų13781%0.81276%0.757SS**  cis-145.3174.31842.2-22.1000120.1
1118G28.1Very low30.7Very low71 Ų71134.1 Ų134.173%0.73275%0.752SS**  trans95151.4150.500000116.7
1119L30.1Very low30.8Very low168 Ų168133.3 Ų133.388%0.8875%0.754SS**  cis-148.9170.1-10.2-139.878.3000105.7
1120Q29.1Very low30.9Very low146 Ų146134.6 Ų134.668%0.68276%0.756SS**  -179.9135.153.1-176.1175.2-21.600110.4
1121E28.4Very low31Very low142 Ų142133 Ų13366%0.66475%0.751SS**  trans56.6156.4149.5-67-175.3131.200123.1
1122Q32.9Very low31.1Very low154 Ų154134.3 Ų134.372%0.7276%0.755SS**  cis-171156.1-21.2175.3-178.2103.300110.2
1123R30.6Very low32Very low225 Ų225133.7 Ų133.785%0.84975%0.753SS**  trans130.894.9150.5-156.8168.9-164.9141.55.7111.5
1124T33.2Very low31.3Very low97 Ų97132.8 Ų132.860%0.59576%0.755SS**  93129.869.9-800000111.4
1125Q33.8Very low31.5Very low151 Ų151131.4 Ų131.471%0.70675%0.75SS**  cis-169.3168.34.1-118.8174.9100113.1
1126I29.2Very low31.7Very low134 Ų134132.9 Ų132.969%0.68775%0.754SS**  trans71154.1145.2-78.8166.7000119
1127I33.7Very low32Very low157 Ų157129.4 Ų129.481%0.80575%0.746SS**  cis-168.8171.4-42.4-143.2156.4000108.5
1128A31.5Very low31.6Very low68 Ų68132 Ų13256%0.56275%0.751SS**  -161.4170.1-71.500000111.8
1129N29.9Very low31.8Very low156 Ų156133.2 Ų133.283%0.83475%0.749SS**  trans72.5157.8143-68.8-7.1000124.7
1130C26.4Very low32.2Very low114 Ų114134.7 Ų134.777%0.7775%0.748SS**  trans95.395.5152.5-69.40000122.5
1131S27.2Very low32.6Very low100 Ų100135.2 Ų135.270%0.69975%0.754SS**  78.5100.9118-52.20000123
1132T28.6Very low32.8Very low130 Ų130134 Ų13480%0.79876%0.756SS**  32.2157.3115.861.90000122.1
1133P46.3Very low32.7Very low117 Ų117132.1 Ų132.176%0.7676%0.76SS**  cis-143.7-171.915.842.3-22.2000117.5
1134A29.6Very low32.8Very low99 Ų99126.6 Ų126.682%0.81876%0.756SS**  trans70.2157.7148.900000120.3
1135A32.5Very low32.8Very low84 Ų84129.8 Ų129.869%0.69477%0.768SS**  cis-169.2144.2-27.900000110.8
1136K34.3Very low32.7Very low215 Ų215131.3 Ų131.394%0.93578%0.777SS**  164.8153.3111.1-81.9166.1-173.1176.80108.8
1137G32.9Very low32.7Very low65 Ų65132.3 Ų132.367%0.6778%0.782SS**  cis145.3151.4-5.900000112.7
1138I34.3Very low32.6Very low178 Ų178134.1 Ų134.191%0.91378%0.784SS**  trans72.2138.3-178.2-53.1172000112.6
1139S32.6Very low33.3Very low97 Ų97136.3 Ų136.368%0.67879%0.793SS**  cis-151.6168.1-18.553.80000107.5
1140K39.2Very low33.2Very low199 Ų199136.1 Ų136.187%0.86580%0.797SS**  cis88.2113.912.9-71.1-165.5173.9-173.40118.8
1141I36.5Very low33.4Very low158 Ų158135.1 Ų135.181%0.8179%0.792SS**  -162.5118.9126.2-101.8155.6000110.1
1142T34.3Very low33.9Very low117 Ų117136.8 Ų136.872%0.71880%0.798SS**  38.4144.4129.2-1.90000120.2
1143S30.3Very low34.8Very low114 Ų114135.6 Ų135.680%0.79779%0.792SS**  cis-149165.125.4-59.30000115.4
1144S31.6Very low34Very low108 Ų108137 Ų13776%0.75579%0.792SS**  trans-107.1156.6179.854.40000113.8
1145I34.7Very low34.1Very low165 Ų165139.3 Ų139.385%0.84679%0.786SS**  trans-154.3149.9148.4-102.8151.2000109.3
1146M30.1Very low34.3Very low182 Ų182144.4 Ų144.490%0.89779%0.787SS**  trans-138.5123.4-175.8172.6-161.5-67.300109.6
1147I31.2Very low35Very low155 Ų155139.8 Ų139.880%0.79578%0.779SS**  trans-147.3121.2170.2-53179.8000111.5
1148K30.8Very low35.1Very low195 Ų195140.8 Ų140.885%0.84878%0.775SS**  trans-166.4161.1157.3-80.6-160179.8-177.30107.6
1149P45.7Very low35.1Very low115 Ų115140.5 Ų140.575%0.74777%0.77SS**  cis-133.9157.9-4638.5-23.7000112.8
1150T27.8Very low35Very low151 Ų151144.2 Ų144.293%0.92678%0.781SS**  trans-148155171.2-31.80000111.6
1151S31.4Very low34.9Very low94 Ų94140 Ų14066%0.65777%0.772SS**  trans-148.8146.5-17155.70000114.8
1152T36.8Very low34.7Very low134 Ų134138.8 Ų138.882%0.82277%0.772SS**  trans70.6164.6168.777.60000116.9
1153P46.9Very low34.9Very low105 Ų105137.3 Ų137.368%0.68277%0.766SS**  cis-137.1162.3-6.427.1-3.2000118.7
1154I31Very low35.3Very low147 Ų147139.8 Ų139.875%0.75477%0.77SS**  trans70.5122.9136.3-70.2170.1000124.9
1155Q32.2Very low36Very low147 Ų147138.7 Ų138.769%0.68777%0.768SS**  trans53171.1145.3-65.8-179.83.100121.2
1156R36.3Very low36.4Very low192 Ų192141.9 Ų141.973%0.72577%0.771SS**  cis-150.5173.92.8-141177.2-83.5163.2-5.3109
1157P49.4Very low36.9Very low117 Ų117145.9 Ų145.976%0.7679%0.787SS**  -127.5156.561.76.320.3000113.8
1158S33Very low37.2Very low86 Ų86145.4 Ų145.460%0.60179%0.787SS**  81.8138.661.3-51.40000114.2
1159Q34.6Very low37.5Very low172 Ų172142.8 Ų142.880%0.80478%0.784SS**  cis-174.4151.1-16.8-125.2173.2-25.100110
1160I31.5Very low37.1Very low175 Ų175144.3 Ų144.390%0.89779%0.786SS**  trans-175.7156.4147.3-103.1159.9000110.4
1161T35.9Very low37.6Very low110 Ų110143.9 Ų143.968%0.67578%0.777SS**  trans-145.5140.6-161.7-46.90000113.1
1162V32.9Very low38Very low134 Ų134147.1 Ų147.181%0.81279%0.785SS**  trans-164112.7147.4168.70000104.7
1163S39.9Very low38.1Very low85 Ų85147.9 Ų147.959%0.59478%0.782SS**  79.89760.1-56.80000115.2
1164N37.3Very low37.4Very low167 Ų167151 Ų15189%0.89379%0.79SS**  -174.8164.1111.2-93.60000112.5
1165A47.1Very low37.9Very low85 Ų85151.3 Ų151.370%0.70279%0.792SS**  trans-145.2-171.1179.600000110
1166Y43Very low38.4Very low231 Ų231151.7 Ų151.791%0.90680%0.801SS**  trans76.5127.6-160.1-55-73.9000111.7
1167E39.8Very low38.6Very low266 Ų266148 Ų148100%1.24381%0.808SS**  cis-118.6021.4-153.4159.8-140.500113.9

Retrieved 1,167 of 1,167 residues in 1324.1 ms (Link to these results)