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22 kDa alpha-zein 8

Zeins are major seed storage proteins.

AlphaFold DB , UniProt , Accession Q9AR71, Species MAIZE (Zea mays, Maize), Gene AZS22-8, Length 266 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
1M60.2Low72.8Confident211 Ų211116.1 Ų116.1100%1.03965%0.651SS**  0-410-74.9-74.9-166.200112.8T3M1-T3 PolarHBondContact O-N 3.25Å
2A61.7Low73.4Confident72 Ų72116.6 Ų116.660%0.59565%0.65SS**Hα-helixtrans-61.7-36-174.900000116.2K4 I5 L6A2-K4 VanDerWaalsContact C-N 3.33Å; A2-K4 PolarHBondContact O-N 3.43Å; A2-I5 PolarHBondContact O-N 3.08Å; A2-L6 PolarHBondContact O-N 3.23Å
3T67.1Low73.5Confident118 Ų118112.1 Ų112.172%0.72464%0.637SS**Hα-helixtrans-65.7-31.7-174.2-32.90000113.7M1 A7M1-T3 PolarHBondContact O-N 3.25Å; T3-A7 PolarHBondContact O-N 3.03Å
4K70.2Confident73.7Confident168 Ų168113 Ų11373%0.7364%0.638SS**Hα-helixtrans-73.6-29.7180-59.3-178.281.4-179.80112.1A2 L8A2-K4 VanDerWaalsContact C-N 3.33Å; A2-K4 PolarHBondContact O-N 3.43Å; K4-L8 PolarHBondContact O-N 3.17Å
5I75.6Confident73.4Confident104 Ų104115.9 Ų115.953%0.53364%0.642SS.*Hα-helixtrans-72.3-43177.7-62.2174.6000110.1A2 A7 L8 L9A2-I5 PolarHBondContact O-N 3.08Å; I5-A7 VanDerWaalsContact C-N 3.31Å; I5-A7 PolarHBondContact O-N 3.41Å; I5-L8 PolarHBondContact O-N 3.38Å; I5-L9 HydrophobicContact CG2-CD1 3.66Å; I5-L9 VanDerWaalsContact O-CD1 3.25Å; I5-L9 WeakPolarHBondContact O-CD1 3.4Å; I5-L9 PolarHBondContact O-N 3.39Å
6L73.9Confident72.9Confident123 Ų123114.1 Ų114.164%0.64464%0.635SS**Hα-helixtrans-60.4-39175.9-78.2166.4000112.6A2 L9 A10A2-L6 PolarHBondContact O-N 3.23Å; L6-L9 PolarHBondContact O-N 3.47Å; L6-A10 WeakPolarHBondContact O-CB 3.42Å; L6-A10 PolarHBondContact O-N 3.17Å
7A76.4Confident72.1Confident62 Ų62112.2 Ų112.251%0.51263%0.631SS.*Hα-helixtrans-65-39.8176.100000112.6T3 I5 A10 L11T3-A7 PolarHBondContact O-N 3.03Å; I5-A7 VanDerWaalsContact C-N 3.31Å; I5-A7 PolarHBondContact O-N 3.41Å; A7-A10 PolarHBondContact O-N 3.14Å; A7-L11 PolarHBondContact O-N 3.49Å
8L79.1Confident71Confident126 Ų126110.5 Ų110.566%0.6663%0.633SS**Hα-helixtrans-65.5-41.4175-89.3161.1000112.2K4 I5 L11 L12K4-L8 PolarHBondContact O-N 3.17Å; I5-L8 PolarHBondContact O-N 3.38Å; L8-L11 PolarHBondContact O-N 3.04Å; L8-L12 WeakPolarHBondContact O-CB 3.4Å; L8-L12 PolarHBondContact O-N 2.79Å
9L79.3Confident70Confident109 Ų109110.2 Ų110.257%0.57163%0.634SS**Hα-helixtrans-64.3-41.1174.6-90.995.7000112.3I5 L6 L12 A13I5-L9 HydrophobicContact CG2-CD1 3.66Å; I5-L9 VanDerWaalsContact O-CD1 3.25Å; I5-L9 WeakPolarHBondContact O-CD1 3.4Å; I5-L9 PolarHBondContact O-N 3.39Å; L6-L9 PolarHBondContact O-N 3.47Å; L9-L12 PolarHBondContact O-N 3.29Å; L9-A13 PolarHBondContact O-N 2.78Å
10A78.4Confident68.9Low64 Ų64111.6 Ų111.653%0.52964%0.639SS.*Hα-helixtrans-63.7-40.8177.700000111.9L6 A7 A13 L14L6-A10 WeakPolarHBondContact O-CB 3.42Å; L6-A10 PolarHBondContact O-N 3.17Å; A7-A10 PolarHBondContact O-N 3.14Å; A10-A13 PolarHBondContact O-N 2.93Å; A10-L14 PolarHBondContact O-N 3.35Å; A10-L14 VanDerWaalsContact O-N 3.09Å
11L78.4Confident67.6Low120 Ų120109.8 Ų109.863%0.62864%0.638SS**Hα-helixtrans-66.9-38177.4-151.1108.4000111.8A7 L8 L14 F15A7-L11 PolarHBondContact O-N 3.49Å; L8-L11 PolarHBondContact O-N 3.04Å; L11-L14 PolarHBondContact O-N 3.38Å; L11-F15 PolarHBondContact O-N 3.5Å; L11-F15 VanDerWaalsContact O-N 3.09Å
12L80.1Confident66.8Low122 Ų122109 Ų10964%0.63963%0.629SS**Hα-helixtrans-65.9-41.7176.3-160.178.2000111.8L8 L9 L14 F15 V16L8-L12 WeakPolarHBondContact O-CB 3.4Å; L8-L12 PolarHBondContact O-N 2.79Å; L9-L12 PolarHBondContact O-N 3.29Å; L12-L14 VanDerWaalsContact C-N 3.33Å; L12-L14 PolarHBondContact O-N 2.81Å; L12-F15 PolarHBondContact O-N 3.48Å; L12-V16 WeakPolarHBondContact O-CG2 3.48Å; L12-V16 PolarHBondContact O-N 3.08Å; L12-V16 VanDerWaalsContact O-N 3.08Å
13A75.4Confident66.1Low58 Ų58113 Ų11348%0.47964%0.639SS.*Hα-helixtrans-64.3-37.3176.500000112.4L9 A10 S17L9-A13 PolarHBondContact O-N 2.78Å; A10-A13 PolarHBondContact O-N 2.93Å; A13-S17 WeakPolarHBondContact O-CB 3.44Å; A13-S17 PolarHBondContact O-N 2.89Å; A13-S17 VanDerWaalsContact O-N 3.15Å; A13-S17 PolarHBondContact O-OG 2.78Å
14L75.9Confident65.1Low125 Ų125113.8 Ų113.865%0.65464%0.637SS**Hα-helixtrans-66.3-38.8175-167.769.3000111.6A10 L11 L12 S17 A18A10-L14 PolarHBondContact O-N 3.35Å; A10-L14 VanDerWaalsContact O-N 3.09Å; L11-L14 PolarHBondContact O-N 3.38Å; L12-L14 VanDerWaalsContact C-N 3.33Å; L12-L14 PolarHBondContact O-N 2.81Å; L14-S17 PolarHBondContact O-N 2.96Å; L14-A18 PolarHBondContact O-N 3.37Å; L14-A18 VanDerWaalsContact O-N 3.13Å
15F69.3Low63.8Low156 Ų156111.4 Ų111.468%0.68464%0.639SS**Hα-helixtrans-69.5-37.7-179.9-137.7-93.1000112.9L11 L12 S17 A18 T19L11-F15 PolarHBondContact O-N 3.5Å; L11-F15 VanDerWaalsContact O-N 3.09Å; L12-F15 PolarHBondContact O-N 3.48Å; F15-S17 VanDerWaalsContact C-N 3.31Å; F15-A18 PolarHBondContact O-N 2.84Å; F15-T19 PolarHBondContact O-OG1 3.13Å; F15-T19 VanDerWaalsContact O-OG1 3.08Å
16V65Low61.9Low88 Ų88115 Ų11553%0.53365%0.653SS.*Hα-helixtrans-67.2-35.1173.5172.30000111.1L12 T19L12-V16 WeakPolarHBondContact O-CG2 3.48Å; L12-V16 PolarHBondContact O-N 3.08Å; L12-V16 VanDerWaalsContact O-N 3.08Å; V16-T19 PolarHBondContact O-N 3.02Å
17S59.2Low60.2Low82 Ų82115 Ų11557%0.57366%0.662SS**Hα-helixtrans-71.1-31.1179.5-56.70000113.1A13 L14 F15 T19A13-S17 WeakPolarHBondContact O-CB 3.44Å; A13-S17 PolarHBondContact O-N 2.89Å; A13-S17 VanDerWaalsContact O-N 3.15Å; A13-S17 PolarHBondContact O-OG 2.78Å; L14-S17 PolarHBondContact O-N 2.96Å; F15-S17 VanDerWaalsContact C-N 3.31Å; S17-T19 VanDerWaalsContact C-N 3.29Å; S17-T19 PolarHBondContact O-N 3.44Å
18A53.5Low58.5Low81 Ų81117.3 Ų117.367%0.66968%0.675SS**Hα-helixtrans-75.5-15.4177.800000113.9L14 F15L14-A18 PolarHBondContact O-N 3.37Å; L14-A18 VanDerWaalsContact O-N 3.13Å; F15-A18 PolarHBondContact O-N 2.84Å
19T52.1Low56.4Low104 Ų104119.4 Ų119.464%0.63869%0.686SS**Hα-helixtrans-89.7-16.9-177.3-51.30000112.6F15 V16 S17F15-T19 PolarHBondContact O-OG1 3.13Å; F15-T19 VanDerWaalsContact O-OG1 3.08Å; V16-T19 PolarHBondContact O-N 3.02Å; S17-T19 VanDerWaalsContact C-N 3.29Å; S17-T19 PolarHBondContact O-N 3.44Å
20N46.7Very low54.4Low139 Ų139118.4 Ų118.474%0.74369%0.693SS**SBendtrans-103.410.2-175.6-73.6-17.1000114.9
21A43.1Very low52.7Low74 Ų74120.7 Ų120.761%0.61270%0.702SS**  trans-104.957.917700000111.8
22F42.1Very low50.7Low193 Ų193120.2 Ų120.285%0.84671%0.709SS**  trans-119.387.9159.8-119.8-93.1000108.3I24F22-I24 PolarHBondContact O-N 2.85Å
23I46.9Very low48.6Very low158 Ų158118.3 Ų118.381%0.8171%0.711SS**  trans-72.4105.3172.7-64171.7000106.7P25I23-P25 WeakPolarHBondContact O-CD 3.41Å
24I47Very low47Very low133 Ų133123 Ų12368%0.68273%0.726SS**  trans-85.3115.8169.2-60.8171000107.1F22 Q26F22-I24 PolarHBondContact O-N 2.85Å; I24-Q26 PolarHBondContact O-N 3.3Å
25P43.1Very low45.3Very low119 Ų119124 Ų12477%0.77373%0.731SS**  trans-73.8108.2166.728.9-27.9000108.2I23 C27I23-P25 WeakPolarHBondContact O-CD 3.41Å; P25-C27 PolarHBondContact O-N 2.81Å
26Q34.7Very low43.7Very low178 Ų178121.6 Ų121.683%0.83273%0.731SS**  trans-73.4116.2167.5-68.8-164.3-25.200109.5I24I24-Q26 PolarHBondContact O-N 3.3Å
27C39.1Very low42.6Very low123 Ų123125.9 Ų125.983%0.83175%0.745SS**  trans-152.292.6155.1-93.20000109.6P25P25-C27 PolarHBondContact O-N 2.81Å
28S39.7Very low41.4Very low112 Ų112132.2 Ų132.278%0.78376%0.763SS**  trans59125.3132.3-60.80000122.8
29L35.9Very low40.7Very low170 Ų170135.6 Ų135.689%0.8977%0.769SS**  trans90.3113.3138.6-104.876.8000119.9
30A37.7Very low40Very low88 Ų88141.7 Ų141.773%0.72778%0.78SS**  trans-74.1-163.9170.900000112.3
31P41.3Very low39.7Very low111 Ų111140.4 Ų140.472%0.72178%0.779SS**  cis-130-179.4-2325.3-2.6000112.2
32S36.1Very low39.5Very low111 Ų111142.2 Ų142.278%0.77678%0.782SS**  trans105.5132.1149.7-44.70000118.6
33A37.1Very low39.2Very low82 Ų82139.1 Ų139.168%0.67878%0.78SS**  trans98.1104.6138.500000120.2
34I41.1Very low38.8Very low155 Ų155137.2 Ų137.280%0.79578%0.78SS**  75.6101.9126.5-55.7162000118.3
35I40.4Very low38.1Very low147 Ų147140 Ų14075%0.75479%0.793SS**  trans13.9163.4134.7-15.9179.6000120.5
36P36.9Very low37.8Very low106 Ų106136.9 Ų136.969%0.68878%0.783SS**  -120144.8-8838.2-21.6000112.1
37Q40.1Very low38Very low178 Ų178138.9 Ų138.983%0.83279%0.789SS**  trans-136.2106.1175.5-57.3-16725.600112.8L39Q37-L39 PolarHBondContact O-N 3.03Å; Q37-L39 VanDerWaalsContact O-N 3.09Å
38F35.6Very low38.1Very low214 Ų214141.1 Ų141.194%0.93979%0.787SS**  trans-32.3103.3150.3-87-105.3000111.9
39L38.2Very low38.5Very low152 Ų152142.3 Ų142.380%0.79678%0.78SS**  trans-146.2109.8159.9-77.7177.5000110.1Q37Q37-L39 PolarHBondContact O-N 3.03Å; Q37-L39 VanDerWaalsContact O-N 3.09Å
40R36.9Very low39Very low233 Ų233141.4 Ų141.488%0.87978%0.776SS**  trans-100.1128.4154.8174-176.3-83.9165.4-5.7107.5
41P41.4Very low39.9Very low111 Ų111140 Ų14072%0.72176%0.764SS**  trans-129113142.811.510.1000109.2
42V38.5Very low40.7Very low112 Ų112138.2 Ų138.268%0.67975%0.751SS**  69.1110.485.8-179.10000114.2
43T34.9Very low41.6Very low128 Ų128139.7 Ų139.779%0.78575%0.745SS**  trans63.7115.8156.737.70000121.4
44S39Very low42.5Very low118 Ų118138.5 Ų138.583%0.82574%0.736SS**  -147.9133.7116.1104.60000109.5G46S44-G46 PolarHBondContact O-N 3.16Å
45M32.9Very low43.4Very low191 Ų191137.9 Ų137.994%0.94172%0.724SS**  trans-66124-178.2-65.4-165.2-70.900110.9
46G37.2Very low44.5Very low55 Ų55139.2 Ų139.257%0.56772%0.72SS**  trans-166.7127.7169.200000107.7S44 E48S44-G46 PolarHBondContact O-N 3.16Å; G46-E48 PolarHBondContact O-N 3.05Å
47F37.5Very low45.9Very low220 Ų220139.7 Ų139.797%0.96572%0.716SS**  trans-61.279.6179.2-71-97.8000110.3H49F47-H49 VanDerWaalsContact C-N 3.3Å; F47-H49 PolarHBondContact O-N 3.14Å
48E41.1Very low47.1Very low170 Ų170137.8 Ų137.879%0.79471%0.707SS**  trans-73.994.5171.4-67.8-154.1120.400107.9G46 L50G46-E48 PolarHBondContact O-N 3.05Å; E48-L50 PolarHBondContact O-N 3.14Å
49H47.9Very low48.5Very low136 Ų136132.3 Ų132.363%0.6368%0.684SS**  trans-24.9122.2175-149.749.5000113F47 A51 V52F47-H49 VanDerWaalsContact C-N 3.3Å; F47-H49 PolarHBondContact O-N 3.14Å; H49-A51 PolarHBondContact O-N 3.07Å; H49-V52 HydrophobicContact CB-CG2 4.19Å; H49-V52 PolarHBondContact O-N 3.33Å
50L47.4Very low49.5Very low152 Ų152127.7 Ų127.780%0.79667%0.668SS**Hα-helixtrans-45.8-29.7177.2-139.584000112.7E48 A54E48-L50 PolarHBondContact O-N 3.14Å; L50-A54 WeakPolarHBondContact O-CB 3.32Å; L50-A54 PolarHBondContact O-N 3.33Å
51A55.9Low50.4Low58 Ų58121.3 Ų121.348%0.47965%0.651SS.*Hα-helixtrans-67.4-37.3175.900000114.2H49 A54 Y55H49-A51 PolarHBondContact O-N 3.07Å; A51-A54 PolarHBondContact O-N 3.42Å; A51-Y55 WeakPolarHBondContact O-CB 2.92Å; A51-Y55 PolarHBondContact O-N 2.82Å
52V57.8Low51Low74 Ų74118.5 Ų118.545%0.44864%0.637SS.*Hα-helixtrans-71-38.6178.4178.20000110.2H49 Y55 R56H49-V52 HydrophobicContact CB-CG2 4.19Å; H49-V52 PolarHBondContact O-N 3.33Å; V52-Y55 PolarHBondContact O-N 3.5Å; V52-R56 WeakPolarHBondContact O-CG 3.18Å; V52-R56 PolarHBondContact O-N 3Å
53Q55.4Low51.6Low142 Ų142115.3 Ų115.366%0.66462%0.622SS**Hα-helixtrans-67-40.1174.5-169.9162.311.500111.8R56 L57Q53-R56 PolarHBondContact O-N 3.02Å; Q53-L57 WeakPolarHBondContact O-CB 3.47Å; Q53-L57 PolarHBondContact O-N 3.08Å
54A55.5Low52.4Low57 Ų57112.5 Ų112.547%0.47161%0.608SS.*Hα-helixtrans-61.8-42.4172.900000112L50 A51 L57 Q58L50-A54 WeakPolarHBondContact O-CB 3.32Å; L50-A54 PolarHBondContact O-N 3.33Å; A51-A54 PolarHBondContact O-N 3.42Å; A54-L57 PolarHBondContact O-N 3.49Å; A54-Q58 WeakPolarHBondContact O-CB 3.36Å; A54-Q58 PolarHBondContact O-N 3.23Å
55Y61.3Low53Low142 Ų142111.4 Ų111.456%0.55760%0.596SS**Hα-helixtrans-64.7-42.5177.5-169.7-95.9000112.3A51 V52 L57 Q58 Q59A51-Y55 WeakPolarHBondContact O-CB 2.92Å; A51-Y55 PolarHBondContact O-N 2.82Å; V52-Y55 PolarHBondContact O-N 3.5Å; Y55-L57 PolarHBondContact O-N 3.24Å; Y55-Q58 PolarHBondContact O-N 3.35Å; Y55-Q59 WeakPolarHBondContact O-CB 3.36Å; Y55-Q59 PolarHBondContact O-N 2.96Å
56R63.6Low53.9Low175 Ų175108 Ų10866%0.6658%0.581SS**Hα-helixtrans-62.2-42.1174.3-72.8-73.6-150.1-144.10.9112.1V52 Q53 Q59 A60V52-R56 WeakPolarHBondContact O-CG 3.18Å; V52-R56 PolarHBondContact O-N 3Å; Q53-R56 PolarHBondContact O-N 3.02Å; R56-Q59 PolarHBondContact O-N 3.36Å; R56-A60 WeakPolarHBondContact O-CB 3.48Å; R56-A60 PolarHBondContact O-N 2.8Å
57L66Low54.3Low115 Ų115111 Ų11160%0.60258%0.58SS**Hα-helixtrans-64.4-44.4176.9-163.892.5000110.7Q53 A54 Y55 Q59 A60 L61Q53-L57 WeakPolarHBondContact O-CB 3.47Å; Q53-L57 PolarHBondContact O-N 3.08Å; A54-L57 PolarHBondContact O-N 3.49Å; Y55-L57 PolarHBondContact O-N 3.24Å; L57-Q59 VanDerWaalsContact C-N 3.32Å; L57-Q59 PolarHBondContact O-N 3.32Å; L57-A60 PolarHBondContact O-N 2.76Å; L57-L61 HydrophobicContact CD2-CD1 4.11Å; L57-L61 HydrophobicContact CG-CD1 3.8Å; L57-L61 WeakPolarHBondContact O-CB 3.43Å; L57-L61 WeakPolarHBondContact O-CD1 3.44Å; L57-L61 PolarHBondContact O-N 3.03Å
58Q65.5Low55.1Low138 Ų138107.2 Ų107.265%0.64557%0.566SS**Hα-helixtrans-63.2-39.1177.5-169.3171.221.700111.7A54 Y55 L61 A62A54-Q58 WeakPolarHBondContact O-CB 3.36Å; A54-Q58 PolarHBondContact O-N 3.23Å; Y55-Q58 PolarHBondContact O-N 3.35Å; Q58-L61 PolarHBondContact O-N 3.31Å; Q58-A62 VanDerWaalsContact O-CB 3.28Å; Q58-A62 WeakPolarHBondContact O-CB 3.44Å; Q58-A62 PolarHBondContact O-N 2.94Å
59Q65.4Low55.7Low100 Ų100102 Ų10247%0.46755%0.546SS..Hα-helixtrans-70.8-37.7177.1-161.416345.100112Y55 R56 L57 A62 A63Y55-Q59 WeakPolarHBondContact O-CB 3.36Å; Y55-Q59 PolarHBondContact O-N 2.96Å; R56-Q59 PolarHBondContact O-N 3.36Å; L57-Q59 VanDerWaalsContact C-N 3.32Å; L57-Q59 PolarHBondContact O-N 3.32Å; Q59-A62 PolarHBondContact O-N 2.84Å; Q59-A63 VanDerWaalsContact O-CB 3.28Å; Q59-A63 WeakPolarHBondContact O-CB 3.46Å; Q59-A63 PolarHBondContact O-N 2.97Å
60A58.9Low56Low55 Ų55100.6 Ų100.646%0.45554%0.543SS..Hα-helixtrans-66.7-39.3173.200000112.3R56 L57 S64R56-A60 WeakPolarHBondContact O-CB 3.48Å; R56-A60 PolarHBondContact O-N 2.8Å; L57-A60 PolarHBondContact O-N 2.76Å; A60-S64 WeakPolarHBondContact O-CB 3.48Å; A60-S64 PolarHBondContact O-N 3Å; A60-S64 PolarHBondContact O-OG 2.95Å
61L56Low56.2Low99 Ų9997.9 Ų97.952%0.51853%0.529SS..Hα-helixtrans-66.3-45.7172.1-95.398.4000111.3L57 Q58 A63 S64 V65L57-L61 HydrophobicContact CD2-CD1 4.11Å; L57-L61 HydrophobicContact CG-CD1 3.8Å; L57-L61 WeakPolarHBondContact O-CB 3.43Å; L57-L61 WeakPolarHBondContact O-CD1 3.44Å; L57-L61 PolarHBondContact O-N 3.03Å; Q58-L61 PolarHBondContact O-N 3.31Å; L61-A63 VanDerWaalsContact C-N 3.32Å; L61-A63 PolarHBondContact O-N 3.38Å; L61-S64 PolarHBondContact O-N 3.48Å; L61-S64 VanDerWaalsContact O-N 3.14Å; L61-V65 WeakPolarHBondContact O-CB 3.45Å; L61-V65 WeakPolarHBondContact O-CG2 3.39Å; L61-V65 PolarHBondContact O-N 3.46Å
62A53Low56Low51 Ų51101.6 Ų101.642%0.42154%0.536SS..Hα-helixtrans-61.2-41.5177.900000111.8Q58 Q59 L66Q58-A62 VanDerWaalsContact O-CB 3.28Å; Q58-A62 WeakPolarHBondContact O-CB 3.44Å; Q58-A62 PolarHBondContact O-N 2.94Å; Q59-A62 PolarHBondContact O-N 2.84Å; A62-L66 WeakPolarHBondContact O-CB 3.42Å; A62-L66 PolarHBondContact O-N 3.41Å
63A51.9Low55.8Low46 Ų46103.5 Ų103.538%0.3854%0.543SS..Hα-helixtrans-64.3-39.5174.100000112Q59 L61 Q67Q59-A63 VanDerWaalsContact O-CB 3.28Å; Q59-A63 WeakPolarHBondContact O-CB 3.46Å; Q59-A63 PolarHBondContact O-N 2.97Å; L61-A63 VanDerWaalsContact C-N 3.32Å; L61-A63 PolarHBondContact O-N 3.38Å; A63-Q67 VanDerWaalsContact O-CB 3.29Å; A63-Q67 WeakPolarHBondContact O-CB 3.36Å; A63-Q67 VanDerWaalsContact O-CG 3.3Å; A63-Q67 WeakPolarHBondContact O-CG 3.42Å; A63-Q67 PolarHBondContact O-N 2.88Å
64S50.5Low55.8Low68 Ų68102.9 Ų102.948%0.47654%0.54SS..Hα-helixtrans-71.2-40.2178.8-58.90000112.5A60 L61 L66 Q67 Q68A60-S64 WeakPolarHBondContact O-CB 3.48Å; A60-S64 PolarHBondContact O-N 3Å; A60-S64 PolarHBondContact O-OG 2.95Å; L61-S64 PolarHBondContact O-N 3.48Å; L61-S64 VanDerWaalsContact O-N 3.14Å; S64-L66 VanDerWaalsContact C-N 3.32Å; S64-L66 PolarHBondContact O-N 2.85Å; S64-Q67 PolarHBondContact O-N 3.16Å; S64-Q68 PolarHBondContact O-N 2.65Å; S64-Q68 VanDerWaalsContact O-N 3.1Å
65V51.7Low55.7Low96 Ų96107.4 Ų107.458%0.58255%0.552SS**Hα-helixtrans-67.4-31.4178.2172.70000111.6L61 P69L61-V65 WeakPolarHBondContact O-CB 3.45Å; L61-V65 WeakPolarHBondContact O-CG2 3.39Å; L61-V65 PolarHBondContact O-N 3.46Å; V65-P69 WeakPolarHBondContact O-CD 3.17Å; V65-P69 WeakPolarHBondContact O-CG 3.36Å
66L52Low55.2Low118 Ų118104.9 Ų104.962%0.61855%0.545SS*.Hα-helixtrans-84.9-32.6174.3-78.6170.1000113.6A62 S64 P69 I70A62-L66 WeakPolarHBondContact O-CB 3.42Å; A62-L66 PolarHBondContact O-N 3.41Å; S64-L66 VanDerWaalsContact C-N 3.32Å; S64-L66 PolarHBondContact O-N 2.85Å; L66-P69 VanDerWaalsContact O-CD 3.3Å; L66-P69 WeakPolarHBondContact O-CD 3.44Å; L66-P69 VanDerWaalsContact O-CG 3.31Å; L66-P69 WeakPolarHBondContact O-CG 3.46Å; L66-I70 WeakPolarHBondContact O-CD1 3.2Å; L66-I70 WeakPolarHBondContact O-CG1 3.47Å
67Q46.5Very low54.6Low118 Ų118100.3 Ų100.355%0.55154%0.54SS*.Hα-helixtrans-76.8-32.3-179.5-77.9-1586000114A63 S64 I70 N71A63-Q67 VanDerWaalsContact O-CB 3.29Å; A63-Q67 WeakPolarHBondContact O-CB 3.36Å; A63-Q67 VanDerWaalsContact O-CG 3.3Å; A63-Q67 WeakPolarHBondContact O-CG 3.42Å; A63-Q67 PolarHBondContact O-N 2.88Å; S64-Q67 PolarHBondContact O-N 3.16Å; Q67-I70 PolarHBondContact O-N 2.93Å; Q67-N71 PolarHBondContact O-N 2.87Å
68Q53Low53.8Low142 Ų14299.6 Ų99.666%0.66454%0.536SS*.Hα-helixtrans-56.5-49.5175.3-83.5-170.5-47.700113.6S64 I70 Q72S64-Q68 PolarHBondContact O-N 2.65Å; S64-Q68 VanDerWaalsContact O-N 3.1Å; Q68-I70 VanDerWaalsContact C-N 3.35Å; Q68-I70 PolarHBondContact O-N 3.49Å; Q68-Q72 WeakPolarHBondContact O-CB 3.29Å; Q68-Q72 WeakPolarHBondContact O-CG 3.43Å; Q68-Q72 PolarHBondContact O-N 3.47Å
69P54.5Low52.8Low60 Ų6095.3 Ų95.339%0.3953%0.525SS..Hα-helixtrans-68.7-31.9178.223.4-31.3000112.4V65 L66 Q72 L73V65-P69 WeakPolarHBondContact O-CD 3.17Å; V65-P69 WeakPolarHBondContact O-CG 3.36Å; L66-P69 VanDerWaalsContact O-CD 3.3Å; L66-P69 WeakPolarHBondContact O-CD 3.44Å; L66-P69 VanDerWaalsContact O-CG 3.31Å; L66-P69 WeakPolarHBondContact O-CG 3.46Å; P69-Q72 PolarHBondContact O-N 2.98Å; P69-L73 WeakPolarHBondContact O-CB 3.45Å; P69-L73 PolarHBondContact O-N 3.43Å
70I54.8Low52.1Low107 Ų10794.5 Ų94.555%0.54952%0.521SS..Hα-helixtrans-69.2-45.3178.9-65.5170.4000111.2L66 Q67 Q68 Q72 L73 Q74L66-I70 WeakPolarHBondContact O-CD1 3.2Å; L66-I70 WeakPolarHBondContact O-CG1 3.47Å; Q67-I70 PolarHBondContact O-N 2.93Å; Q68-I70 VanDerWaalsContact C-N 3.35Å; Q68-I70 PolarHBondContact O-N 3.49Å; I70-Q72 VanDerWaalsContact C-N 3.31Å; I70-Q72 PolarHBondContact O-N 2.92Å; I70-L73 PolarHBondContact O-N 3.37Å; I70-Q74 WeakPolarHBondContact O-CB 3.26Å; I70-Q74 PolarHBondContact O-N 3.36Å
71N50Low51.8Low94 Ų9496.8 Ų96.850%0.50353%0.525SS..Hα-helixtrans-66.5-34.1175.6-81-19.4000111.9Q67 Q75Q67-N71 PolarHBondContact O-N 2.87Å; N71-Q75 WeakPolarHBondContact O-CB 3.31Å; N71-Q75 PolarHBondContact O-N 3.29Å
72Q53.2Low51.6Low136 Ų13695.6 Ų95.664%0.63652%0.522SS*.Hα-helixtrans-67.5-40.4171.6-82.1-169.1-1400112.6Q68 P69 I70 Q76Q68-Q72 WeakPolarHBondContact O-CB 3.29Å; Q68-Q72 WeakPolarHBondContact O-CG 3.43Å; Q68-Q72 PolarHBondContact O-N 3.47Å; P69-Q72 PolarHBondContact O-N 2.98Å; I70-Q72 VanDerWaalsContact C-N 3.31Å; I70-Q72 PolarHBondContact O-N 2.92Å; Q72-Q76 VanDerWaalsContact O-CB 3.25Å; Q72-Q76 WeakPolarHBondContact O-CB 3.48Å; Q72-Q76 PolarHBondContact O-N 2.8Å
73L52.6Low51.4Low115 Ų11598 Ų9860%0.60253%0.526SS*.Hα-helixtrans-66.6-38.9176.1-110.3163.5000111.6P69 I70 Q76 S77P69-L73 WeakPolarHBondContact O-CB 3.45Å; P69-L73 PolarHBondContact O-N 3.43Å; I70-L73 PolarHBondContact O-N 3.37Å; L73-Q76 PolarHBondContact O-N 3.45Å; L73-S77 WeakPolarHBondContact O-CB 3.38Å; L73-S77 PolarHBondContact O-N 2.87Å
74Q55.1Low51.5Low128 Ų128102.2 Ų102.260%0.59854%0.538SS*.Hα-helixtrans-71.8-41.8178.6-153.3-159.637.600111.5I70 Q76 S77 L78I70-Q74 WeakPolarHBondContact O-CB 3.26Å; I70-Q74 PolarHBondContact O-N 3.36Å; Q74-Q76 VanDerWaalsContact C-N 3.32Å; Q74-S77 PolarHBondContact O-N 3.3Å; Q74-L78 PolarHBondContact O-N 3.13Å
75Q53.7Low51.6Low152 Ų152102.3 Ų102.371%0.7154%0.536SS*.Hα-helixtrans-63.3-39.3170.1-89.3-153.525.600111.9N71 S77 L78 A79N71-Q75 WeakPolarHBondContact O-CB 3.31Å; N71-Q75 PolarHBondContact O-N 3.29Å; Q75-S77 VanDerWaalsContact C-N 3.35Å; Q75-L78 PolarHBondContact O-N 3.1Å; Q75-A79 VanDerWaalsContact O-CB 3.3Å; Q75-A79 WeakPolarHBondContact O-CB 3.19Å; Q75-A79 PolarHBondContact O-N 2.93Å
76Q50.7Low51.8Low89 Ų89102.6 Ų102.642%0.41653%0.533SS..Hα-helixtrans-61.7-45.4173.5-97.5-160.9-27.800110.6Q72 L73 Q74 L78 A79 H80Q72-Q76 VanDerWaalsContact O-CB 3.25Å; Q72-Q76 WeakPolarHBondContact O-CB 3.48Å; Q72-Q76 PolarHBondContact O-N 2.8Å; L73-Q76 PolarHBondContact O-N 3.45Å; Q74-Q76 VanDerWaalsContact C-N 3.32Å; Q76-L78 VanDerWaalsContact C-N 3.34Å; Q76-L78 PolarHBondContact O-N 3.11Å; Q76-A79 PolarHBondContact O-N 3.37Å; Q76-H80 WeakPolarHBondContact O-CB 3.34Å; Q76-H80 PolarHBondContact O-N 3.34Å; Q76-H80 PolarHBondContact O-ND1 3.37Å
77S51.6Low51.7Low79 Ų7999.6 Ų99.655%0.55253%0.525SS*.Hα-helixtrans-63-42.2-179.3-173.10000111.2L73 Q74 Q75 H80 L81L73-S77 WeakPolarHBondContact O-CB 3.38Å; L73-S77 PolarHBondContact O-N 2.87Å; Q74-S77 PolarHBondContact O-N 3.3Å; Q75-S77 VanDerWaalsContact C-N 3.35Å; S77-H80 PolarHBondContact O-N 3.37Å; S77-L81 VanDerWaalsContact O-CB 3.31Å; S77-L81 WeakPolarHBondContact O-CB 3.36Å; S77-L81 PolarHBondContact O-N 3.42Å
78L48.4Very low51.9Low100 Ų10097.4 Ų97.452%0.52452%0.52SS..Hα-helixtrans-64.7-41173.5-84.3166.5000112.4Q74 Q75 Q76 L81 T82Q74-L78 PolarHBondContact O-N 3.13Å; Q75-L78 PolarHBondContact O-N 3.1Å; Q76-L78 VanDerWaalsContact C-N 3.34Å; Q76-L78 PolarHBondContact O-N 3.11Å; L78-L81 PolarHBondContact O-N 2.85Å; L78-T82 VanDerWaalsContact O-CB 3.3Å; L78-T82 WeakPolarHBondContact O-CB 3.33Å; L78-T82 PolarHBondContact O-N 2.81Å; L78-T82 PolarHBondContact O-OG1 3.11Å
79A45.8Very low52.1Low49 Ų4996.4 Ų96.441%0.40552%0.515SS..Hα-helixtrans-64.8-42.7175.800000111.5Q75 Q76 T82 I83Q75-A79 VanDerWaalsContact O-CB 3.3Å; Q75-A79 WeakPolarHBondContact O-CB 3.19Å; Q75-A79 PolarHBondContact O-N 2.93Å; Q76-A79 PolarHBondContact O-N 3.37Å; A79-T82 PolarHBondContact O-N 2.72Å; A79-I83 WeakPolarHBondContact O-CB 3.42Å; A79-I83 WeakPolarHBondContact O-CG1 3.45Å; A79-I83 PolarHBondContact O-N 3.2Å
80H51.2Low52Low83 Ų8396.5 Ų96.538%0.38451%0.511SS..Hα-helixtrans-65.7-42.3175.9-74.493.6000111.6Q76 S77 I83 Q84Q76-H80 WeakPolarHBondContact O-CB 3.34Å; Q76-H80 PolarHBondContact O-N 3.34Å; Q76-H80 PolarHBondContact O-ND1 3.37Å; S77-H80 PolarHBondContact O-N 3.37Å; H80-I83 PolarHBondContact O-N 3.4Å; H80-Q84 VanDerWaalsContact O-CB 3.28Å; H80-Q84 WeakPolarHBondContact O-CB 3.34Å; H80-Q84 PolarHBondContact O-N 3.32Å
81L51.2Low51.9Low103 Ų10397.5 Ų97.554%0.53951%0.513SS..Hα-helixtrans-64.9-42.1176.9-166.679.9000111S77 L78 Q84 T85S77-L81 VanDerWaalsContact O-CB 3.31Å; S77-L81 WeakPolarHBondContact O-CB 3.36Å; S77-L81 PolarHBondContact O-N 3.42Å; L78-L81 PolarHBondContact O-N 2.85Å; L81-Q84 PolarHBondContact O-N 3.47Å; L81-T85 VanDerWaalsContact O-CB 3.31Å; L81-T85 WeakPolarHBondContact O-CB 3.1Å; L81-T85 PolarHBondContact O-N 3.12Å; L81-T85 PolarHBondContact O-OG1 3.48Å
82T51.4Low52.1Low74 Ų74101 Ų10145%0.45453%0.526SS..Hα-helixtrans-67.2-41.2178.5-50.80000110.8L78 A79 T85 I86L78-T82 VanDerWaalsContact O-CB 3.3Å; L78-T82 WeakPolarHBondContact O-CB 3.33Å; L78-T82 PolarHBondContact O-N 2.81Å; L78-T82 PolarHBondContact O-OG1 3.11Å; A79-T82 PolarHBondContact O-N 2.72Å; T82-T85 PolarHBondContact O-N 2.51Å; T82-I86 HydrophobicContact CG2-CD1 3.85Å; T82-I86 HydrophobicContact CG2-CG1 4.43Å; T82-I86 WeakPolarHBondContact O-CB 3.34Å; T82-I86 WeakPolarHBondContact O-CG1 3.37Å; T82-I86 PolarHBondContact O-N 3.18Å
83I50.7Low52.1Low101 Ų101100.9 Ų100.952%0.51853%0.526SS..Hα-helixtrans-66.6-42175.8-69.9169.2000111.1A79 H80 T85 I86 A87A79-I83 WeakPolarHBondContact O-CB 3.42Å; A79-I83 WeakPolarHBondContact O-CG1 3.45Å; A79-I83 PolarHBondContact O-N 3.2Å; H80-I83 PolarHBondContact O-N 3.4Å; I83-T85 VanDerWaalsContact C-N 3.31Å; I83-T85 PolarHBondContact O-N 3.47Å; I83-I86 PolarHBondContact O-N 3.27Å; I83-A87 WeakPolarHBondContact O-CB 3.3Å; I83-A87 PolarHBondContact O-N 3.21Å
84Q52.4Low51.7Low135 Ų13598.7 Ų98.763%0.63151%0.511SS*.Hα-helixtrans-65.9-38.4177.5-155.9179.496.900110.6H80 L81 T88H80-Q84 VanDerWaalsContact O-CB 3.28Å; H80-Q84 WeakPolarHBondContact O-CB 3.34Å; H80-Q84 PolarHBondContact O-N 3.32Å; L81-Q84 PolarHBondContact O-N 3.47Å; Q84-T88 VanDerWaalsContact O-CB 3.29Å; Q84-T88 WeakPolarHBondContact O-CB 3.12Å; Q84-T88 WeakPolarHBondContact O-CG2 3.13Å; Q84-T88 PolarHBondContact O-N 3.05Å; Q84-T88 PolarHBondContact O-OG1 2.92Å
85T54.1Low51.1Low70 Ų7097.1 Ų97.143%0.42951%0.507SS..Hα-helixtrans-67.3-43.4175.2-53.60000111.5L81 T82 I83 T88 Q89L81-T85 VanDerWaalsContact O-CB 3.31Å; L81-T85 WeakPolarHBondContact O-CB 3.1Å; L81-T85 PolarHBondContact O-N 3.12Å; L81-T85 PolarHBondContact O-OG1 3.48Å; T82-T85 PolarHBondContact O-N 2.51Å; I83-T85 VanDerWaalsContact C-N 3.31Å; I83-T85 PolarHBondContact O-N 3.47Å; T85-T88 WeakPolarHBondContact CA-OG1 3.44Å; T85-T88 PolarHBondContact O-OG1 3.14Å; T85-Q89 WeakPolarHBondContact O-CB 3.34Å; T85-Q89 PolarHBondContact O-N 3.13Å
86I55Low50.6Low101 Ų10194.3 Ų94.352%0.51850%0.501SS..Hα-helixtrans-66.7-44.6177.4-67.9166.1000110.5T82 I83 T88 Q90T82-I86 HydrophobicContact CG2-CD1 3.85Å; T82-I86 HydrophobicContact CG2-CG1 4.43Å; T82-I86 WeakPolarHBondContact O-CB 3.34Å; T82-I86 WeakPolarHBondContact O-CG1 3.37Å; T82-I86 PolarHBondContact O-N 3.18Å; I83-I86 PolarHBondContact O-N 3.27Å; I86-T88 PolarHBondContact O-N 2.72Å; I86-Q90 VanDerWaalsContact O-CB 3.31Å; I86-Q90 WeakPolarHBondContact O-CB 3.29Å; I86-Q90 PolarHBondContact O-N 3.13Å
87A50.5Low50.2Low55 Ų5592.3 Ų92.346%0.45550%0.5SS..Hα-helixtrans-65.5-38.2179.500000112.2I83 Q91I83-A87 WeakPolarHBondContact O-CB 3.3Å; I83-A87 PolarHBondContact O-N 3.21Å; A87-Q91 WeakPolarHBondContact O-CB 3.5Å; A87-Q91 PolarHBondContact O-N 3.31Å
88T50.9Low49.6Very low73 Ų7392.2 Ų92.245%0.44849%0.493SS..Hα-helixtrans-75.9-38.7177.852.50000112.7Q84 T85 I86 Q91 Q92Q84-T88 VanDerWaalsContact O-CB 3.29Å; Q84-T88 WeakPolarHBondContact O-CB 3.12Å; Q84-T88 WeakPolarHBondContact O-CG2 3.13Å; Q84-T88 PolarHBondContact O-N 3.05Å; Q84-T88 PolarHBondContact O-OG1 2.92Å; T85-T88 WeakPolarHBondContact CA-OG1 3.44Å; T85-T88 PolarHBondContact O-OG1 3.14Å; I86-T88 PolarHBondContact O-N 2.72Å; T88-Q91 PolarHBondContact O-N 3.38Å; T88-Q92 PolarHBondContact O-N 3.48Å
89Q55.8Low49.1Very low121 Ų12192 Ų9257%0.56550%0.5SS*.Hα-helixtrans-65.5-43172-110.7-153.893.200111.6T85 Q91 Q92 Q93T85-Q89 WeakPolarHBondContact O-CB 3.34Å; T85-Q89 PolarHBondContact O-N 3.13Å; Q89-Q91 VanDerWaalsContact C-N 3.33Å; Q89-Q91 PolarHBondContact O-N 3.41Å; Q89-Q92 PolarHBondContact O-N 3.03Å; Q89-Q93 WeakPolarHBondContact O-CB 3.46Å; Q89-Q93 PolarHBondContact O-N 3.06Å
90Q53.6Low48.8Very low61 Ų6198.1 Ų98.129%0.28552%0.521SS..Hα-helixtrans-63.2-42.3176-108.1-135.551.400110.8I86 F94I86-Q90 VanDerWaalsContact O-CB 3.31Å; I86-Q90 WeakPolarHBondContact O-CB 3.29Å; I86-Q90 PolarHBondContact O-N 3.13Å; Q90-F94 HydrophobicContact CB-CD2 4.31Å; Q90-F94 HydrophobicContact CG-CD2 3.76Å; Q90-F94 HydrophobicContact CG-CE2 3.93Å; Q90-F94 WeakPolarHBondContact O-CA 3.25Å; Q90-F94 WeakPolarHBondContact O-CB 3.34Å; Q90-F94 PolarHBondContact O-N 3.17Å
91Q52.5Low48.4Very low128 Ų12899.3 Ų99.360%0.59853%0.529SS*.Hα-helixtrans-57.7-54.1174.7-107.4-15314.700111.3A87 T88 Q89 Q93 L95A87-Q91 WeakPolarHBondContact O-CB 3.5Å; A87-Q91 PolarHBondContact O-N 3.31Å; T88-Q91 PolarHBondContact O-N 3.38Å; Q89-Q91 VanDerWaalsContact C-N 3.33Å; Q89-Q91 PolarHBondContact O-N 3.41Å; Q91-Q93 VanDerWaalsContact C-N 3.35Å; Q91-Q93 PolarHBondContact O-N 3.29Å; Q91-L95 HydrophobicContact CB-CD1 3.86Å; Q91-L95 HydrophobicContact CG-CD1 3.62Å; Q91-L95 WeakPolarHBondContact O-CB 3.44Å; Q91-L95 WeakPolarHBondContact O-CD1 3.42Å; Q91-L95 PolarHBondContact O-N 2.93Å
92Q54.5Low47.8Very low168 Ų168101.3 Ų101.379%0.78554%0.54SS*.Hα-helixtrans-67.3-33.9-174.3-78.2-167.840.600113.8T88 Q89T88-Q92 PolarHBondContact O-N 3.48Å; Q89-Q92 PolarHBondContact O-N 3.03Å
93Q51.9Low47.3Very low134 Ų134104 Ų10463%0.62656%0.556SS**Hα-helixtrans-89.4-27.3-176.7-160.8172.3-46.300113.2Q89 Q91Q89-Q93 WeakPolarHBondContact O-CB 3.46Å; Q89-Q93 PolarHBondContact O-N 3.06Å; Q91-Q93 VanDerWaalsContact C-N 3.35Å; Q91-Q93 PolarHBondContact O-N 3.29Å
94F44.9Very low46.8Very low68 Ų68104.5 Ų104.530%0.29856%0.564SS.*Hα-helixtrans-101.5-10.7-179.8-71.8-97.4000114.3Q90 P96 A97 L98Q90-F94 HydrophobicContact CB-CD2 4.31Å; Q90-F94 HydrophobicContact CG-CD2 3.76Å; Q90-F94 HydrophobicContact CG-CE2 3.93Å; Q90-F94 WeakPolarHBondContact O-CA 3.25Å; Q90-F94 WeakPolarHBondContact O-CB 3.34Å; Q90-F94 PolarHBondContact O-N 3.17Å; F94-P96 VanDerWaalsContact C-CD 3.5Å; F94-P96 VanDerWaalsContact C-N 3.3Å; F94-A97 HydrophobicContact CD1-CB 4.43Å; F94-A97 PolarHBondContact O-N 3.35Å; F94-L98 HydrophobicContact CB-CD1 3.78Å; F94-L98 HydrophobicContact CB-CG 4.08Å; F94-L98 WeakPolarHBondContact O-CB 3.31Å; F94-L98 WeakPolarHBondContact O-CG 3.45Å; F94-L98 PolarHBondContact O-N 3Å
95L42.9Very low46.7Very low96 Ų96102.5 Ų102.550%0.50356%0.557SS.*Hα-helixtrans-53.3-41.3174.1-109.571.8000113.1Q91 S99Q91-L95 HydrophobicContact CB-CD1 3.86Å; Q91-L95 HydrophobicContact CG-CD1 3.62Å; Q91-L95 WeakPolarHBondContact O-CB 3.44Å; Q91-L95 WeakPolarHBondContact O-CD1 3.42Å; Q91-L95 PolarHBondContact O-N 2.93Å; L95-S99 PolarHBondContact O-OG 2.83Å
96P43.3Very low46.2Very low92 Ų92102.9 Ų102.960%0.59756%0.561SS**Hα-helixtrans-75.3-27.1175.5-15.230000113.9F94F94-P96 VanDerWaalsContact C-CD 3.5Å; F94-P96 VanDerWaalsContact C-N 3.3Å
97A41.9Very low46Very low47 Ų47100.8 Ų100.839%0.38855%0.553SS.*Hα-helixtrans-86-33.6-176.400000112.7F94 Q100F94-A97 HydrophobicContact CD1-CB 4.43Å; F94-A97 PolarHBondContact O-N 3.35Å; A97-Q100 PolarHBondContact O-N 3.37Å
98L39Very low46.1Very low77 Ų7799.9 Ų99.940%0.40355%0.545SS..Hα-helixtrans-71.8-30.3177.8-76.1164.9000112.2F94 Q100 L101F94-L98 HydrophobicContact CB-CD1 3.78Å; F94-L98 HydrophobicContact CB-CG 4.08Å; F94-L98 WeakPolarHBondContact O-CB 3.31Å; F94-L98 WeakPolarHBondContact O-CG 3.45Å; F94-L98 PolarHBondContact O-N 3Å; L98-Q100 PolarHBondContact O-N 2.82Å; L98-Q100 VanDerWaalsContact O-N 3.17Å; L98-L101 PolarHBondContact O-N 2.85Å; L98-L101 VanDerWaalsContact O-N 3.14Å
99S36.8Very low46Very low97 Ų97102.7 Ų102.768%0.67855%0.549SS*.THydrogen-bonded Turntrans-64.4-13.8172.8-65.20000113.9L95L95-S99 PolarHBondContact O-OG 2.83Å
100Q40.7Very low45.8Very low177 Ų17799.3 Ų99.383%0.82753%0.534SS*.THydrogen-bonded Turntrans-101-4.1175.5-63.7-137.138.200113.9A97 L98 D102A97-Q100 PolarHBondContact O-N 3.37Å; L98-Q100 PolarHBondContact O-N 2.82Å; L98-Q100 VanDerWaalsContact O-N 3.17Å; Q100-D102 VanDerWaalsContact C-N 3.33Å; Q100-D102 PolarHBondContact O-N 2.69Å
101L41.7Very low45.8Very low107 Ų107101.2 Ų101.256%0.5654%0.543SS*.  trans-98.830.2-179-91.9143.6000112.6L98 V103 V104L98-L101 PolarHBondContact O-N 2.85Å; L98-L101 VanDerWaalsContact O-N 3.14Å; L101-V103 PolarHBondContact O-N 3.48Å; L101-V104 PolarHBondContact O-N 3.41Å
102D38.5Very low46Very low145 Ų145102.2 Ų102.278%0.77555%0.548SS*.THydrogen-bonded Turntrans-55.36.1-166.9-163.532.1000118Q100Q100-D102 VanDerWaalsContact C-N 3.33Å; Q100-D102 PolarHBondContact O-N 2.69Å
103V40.8Very low46Very low130 Ų13098.2 Ų98.279%0.78853%0.529SS*.THydrogen-bonded Turntrans-146.2-16.7-178.5-164.70000115L101L101-V103 PolarHBondContact O-N 3.48Å
104V42.1Very low46Very low113 Ų11392.8 Ų92.869%0.68551%0.505SS*.SBendtrans-11880.6-164.9-167.20000111.7L101L101-V104 PolarHBondContact O-N 3.41Å
105N49.2Very low46.2Very low92 Ų9294.9 Ų94.949%0.49252%0.519SS..  trans39.474.5158.1-162.3-15.5000115.5V107 A108 Y109N105-V107 PolarHBondContact O-N 2.84Å; N105-V107 WeakPolarHBondContact OD1-CB 3.31Å; N105-V107 PolarHBondContact OD1-N 2.86Å; N105-A108 HydrophobicContact CB-CB 4.05Å; N105-A108 PolarHBondContact O-N 3.42Å; N105-A108 PolarHBondContact OD1-N 3.27Å; N105-Y109 PolarHBondContact O-N 2.84Å
106P43.1Very low46.6Very low78 Ų7894.6 Ų94.651%0.50653%0.53SS..Hα-helixtrans-58.1-24.2176.923.4-33.8000112.7L110P106-L110 PolarHBondContact O-N 3.32Å
107V50.9Low46.9Very low58 Ų5894.8 Ų94.835%0.35253%0.534SS..Hα-helixtrans-70.9-36.7177.7178.90000111.9N105 Q111N105-V107 PolarHBondContact O-N 2.84Å; N105-V107 WeakPolarHBondContact OD1-CB 3.31Å; N105-V107 PolarHBondContact OD1-N 2.86Å; V107-Q111 WeakPolarHBondContact O-CB 3.21Å; V107-Q111 WeakPolarHBondContact O-CG 3.44Å; V107-Q111 PolarHBondContact O-N 3.44Å
108A52.2Low47.1Very low35 Ų3595.9 Ų95.929%0.28953%0.533SS..Hα-helixtrans-69-37.7177.300000112.1N105 Q111 Q112N105-A108 HydrophobicContact CB-CB 4.05Å; N105-A108 PolarHBondContact O-N 3.42Å; N105-A108 PolarHBondContact OD1-N 3.27Å; A108-Q111 PolarHBondContact O-N 2.96Å; A108-Q112 PolarHBondContact O-N 3.24Å
109Y49.4Very low47.7Very low132 Ų13297.1 Ų97.152%0.51855%0.546SS..Hα-helixtrans-65.5-45.5176.3-171.5-95.7000111.3N105 Q112 Q113N105-Y109 PolarHBondContact O-N 2.84Å; Y109-Q112 PolarHBondContact O-N 2.97Å; Y109-Q113 PolarHBondContact O-N 3.32Å; Y109-Q113 VanDerWaalsContact O-N 3.08Å; Y109-Q113 PolarHBondContact OH-NE2 3.48Å
110L51.5Low48.2Very low51 Ų5198.1 Ų98.127%0.26754%0.543SS..Hα-helixtrans-63.8-42.1176.6-89.4-84.1000111.7P106 Q112 Q113 V114P106-L110 PolarHBondContact O-N 3.32Å; L110-Q112 PolarHBondContact O-N 3Å; L110-Q113 PolarHBondContact O-N 3.21Å; L110-V114 WeakPolarHBondContact O-CB 3.4Å; L110-V114 WeakPolarHBondContact O-CG2 3.3Å; L110-V114 PolarHBondContact O-N 3Å
111Q54.8Low48.7Very low100 Ų10091.3 Ų91.347%0.46752%0.517SS..Hα-helixtrans-62-43.4176.1-82.5-163.275.900112.6V107 A108 V114 L115 L122V107-Q111 WeakPolarHBondContact O-CB 3.21Å; V107-Q111 WeakPolarHBondContact O-CG 3.44Å; V107-Q111 PolarHBondContact O-N 3.44Å; A108-Q111 PolarHBondContact O-N 2.96Å; Q111-V114 PolarHBondContact O-N 2.89Å; Q111-L115 WeakPolarHBondContact O-CB 3.28Å; Q111-L115 PolarHBondContact O-N 3.11Å; Q111-L122 HydrophobicContact CB-CD1 4.41Å; Q111-L122 HydrophobicContact CG-CD1 4.18Å
112Q56.1Low48.8Very low150 Ų15088.3 Ų88.370%0.70150%0.501SS*.Hα-helixtrans-66.2-41.9179.7-79.9-168.468.400112.7A108 Y109 L110 V114 A116A108-Q112 PolarHBondContact O-N 3.24Å; Y109-Q112 PolarHBondContact O-N 2.97Å; L110-Q112 PolarHBondContact O-N 3Å; Q112-V114 VanDerWaalsContact C-N 3.32Å; Q112-V114 PolarHBondContact O-N 2.81Å; Q112-A116 PolarHBondContact O-N 3.3Å
113Q55.3Low49.3Very low83 Ų8383.5 Ų83.539%0.38848%0.481SS..Hα-helixtrans-71.2-32.5-178.2-154.1171.757.900111.8Y109 L110 S117Y109-Q113 PolarHBondContact O-N 3.32Å; Y109-Q113 VanDerWaalsContact O-N 3.08Å; Y109-Q113 PolarHBondContact OH-NE2 3.48Å; L110-Q113 PolarHBondContact O-N 3.21Å; Q113-S117 PolarHBondContact O-OG 3.5Å
114V50.1Low49.9Very low21 Ų2181.2 Ų81.213%0.12747%0.465CS..Hα-helixtrans-78.9-36.7179174.70000111.5L110 Q111 Q112 A116 S117 N118 A121 L122 V125L110-V114 WeakPolarHBondContact O-CB 3.4Å; L110-V114 WeakPolarHBondContact O-CG2 3.3Å; L110-V114 PolarHBondContact O-N 3Å; Q111-V114 PolarHBondContact O-N 2.89Å; Q112-V114 VanDerWaalsContact C-N 3.32Å; Q112-V114 PolarHBondContact O-N 2.81Å; V114-A116 VanDerWaalsContact C-N 3.27Å; V114-A116 PolarHBondContact O-N 3.39Å; V114-S117 PolarHBondContact O-N 3.21Å; V114-S117 VanDerWaalsContact O-N 3.15Å; V114-N118 PolarHBondContact O-N 3.39Å; V114-N118 VanDerWaalsContact O-N 3.09Å; V114-A121 HydrophobicContact CG1-CB 3.54Å; V114-A121 WeakPolarHBondContact CG1-O 3.42Å; V114-L122 HydrophobicContact CG1-CB 4.2Å; V114-L122 HydrophobicContact CG1-CD1 4.43Å; V114-L122 VanDerWaalsContact CG1-N 3.26Å; V114-V125 HydrophobicContact CB-CG2 4.49Å; V114-V125 HydrophobicContact CG1-CB 4.49Å; V114-V125 HydrophobicContact CG1-CG2 3.95Å; V114-V125 HydrophobicContact CG2-CG2 3.98Å
115L50Low50.3Low112 Ų11278.1 Ų78.159%0.58645%0.446SS*.Hα-helixtrans-61.3-35.1173.6-166.973.6000112Q111 S117 L122Q111-L115 WeakPolarHBondContact O-CB 3.28Å; Q111-L115 PolarHBondContact O-N 3.11Å; L115-S117 VanDerWaalsContact C-N 3.32Å; L115-L122 HydrophobicContact CD1-CD2 3.68Å
116A50.6Low50.6Low90 Ų9076.6 Ų76.674%0.74445%0.446SS*.Hα-helixtrans-73.4-21.2177.300000113.9Q112 V114Q112-A116 PolarHBondContact O-N 3.3Å; V114-A116 VanDerWaalsContact C-N 3.27Å; V114-A116 PolarHBondContact O-N 3.39Å
117S49.3Very low51.1Low95 Ų9573.6 Ų73.666%0.66443%0.428SS*.Hα-helixtrans-105.1-38.5-168.2-53.40000113Q113 V114 L115Q113-S117 PolarHBondContact O-OG 3.5Å; V114-S117 PolarHBondContact O-N 3.21Å; V114-S117 VanDerWaalsContact O-N 3.15Å; L115-S117 VanDerWaalsContact C-N 3.32Å
118N47.7Very low51.3Low71 Ų7177.5 Ų77.538%0.3844%0.437SS..  trans-171124.5177.5-160.6-46.4000111.5V114 L120 A121 L122V114-N118 PolarHBondContact O-N 3.39Å; V114-N118 VanDerWaalsContact O-N 3.09Å; N118-L120 PolarHBondContact O-N 2.95Å; N118-L120 VanDerWaalsContact OD1-CB 3.23Å; N118-L120 WeakPolarHBondContact OD1-CB 3.42Å; N118-L120 PolarHBondContact OD1-N 3.42Å; N118-A121 HydrophobicContact CB-CB 3.89Å; N118-A121 WeakPolarHBondContact O-CA 3.47Å; N118-A121 WeakPolarHBondContact O-CB 3.41Å; N118-A121 PolarHBondContact O-N 2.96Å; N118-L122 PolarHBondContact O-N 3.42Å
119P50Low51.8Low103 Ų10379.4 Ų79.467%0.66944%0.44SS*.Hα-helixtrans-62.6-26.6175.324.5-32.9000113.3A121 L122 A123P119-A121 VanDerWaalsContact C-N 3.28Å; P119-A121 PolarHBondContact O-N 2.83Å; P119-L122 PolarHBondContact O-N 2.96Å; P119-A123 PolarHBondContact O-N 3.18Å
120L49.3Very low52.4Low118 Ų11876.2 Ų76.262%0.61843%0.43SS*.Hα-helixtrans-67.8-30.8171.6-66.6163.3000111.8N118 L122 A123 N124N118-L120 PolarHBondContact O-N 2.95Å; N118-L120 VanDerWaalsContact OD1-CB 3.23Å; N118-L120 WeakPolarHBondContact OD1-CB 3.42Å; N118-L120 PolarHBondContact OD1-N 3.42Å; L120-L122 VanDerWaalsContact C-N 3.33Å; L120-A123 PolarHBondContact O-N 3.46Å; L120-N124 PolarHBondContact O-N 3.28Å; L120-N124 VanDerWaalsContact O-N 3.12Å; L120-N124 PolarHBondContact O-ND2 3.14Å
121A49.9Very low52.9Low33 Ų3375.2 Ų75.227%0.27342%0.424SS..Hα-helixtrans-70.9-32.1174.900000111.1V114 N118 P119 N124 V125V114-A121 HydrophobicContact CG1-CB 3.54Å; V114-A121 WeakPolarHBondContact CG1-O 3.42Å; N118-A121 HydrophobicContact CB-CB 3.89Å; N118-A121 WeakPolarHBondContact O-CA 3.47Å; N118-A121 WeakPolarHBondContact O-CB 3.41Å; N118-A121 PolarHBondContact O-N 2.96Å; P119-A121 VanDerWaalsContact C-N 3.28Å; P119-A121 PolarHBondContact O-N 2.83Å; A121-N124 PolarHBondContact O-N 3.5Å; A121-V125 WeakPolarHBondContact O-CB 3.23Å; A121-V125 VanDerWaalsContact O-CG2 3.28Å; A121-V125 WeakPolarHBondContact O-CG2 3.46Å; A121-V125 PolarHBondContact O-N 3.36Å
122L44.6Very low53.4Low44 Ų4475.3 Ų75.323%0.2343%0.425CS..Hα-helixtrans-65.8-42.5174.3-168.577.1000111.4Q111 V114 L115 N118 P119 L120 N124 V125 A126Q111-L122 HydrophobicContact CB-CD1 4.41Å; Q111-L122 HydrophobicContact CG-CD1 4.18Å; V114-L122 HydrophobicContact CG1-CB 4.2Å; V114-L122 HydrophobicContact CG1-CD1 4.43Å; V114-L122 VanDerWaalsContact CG1-N 3.26Å; L115-L122 HydrophobicContact CD1-CD2 3.68Å; N118-L122 PolarHBondContact O-N 3.42Å; P119-L122 PolarHBondContact O-N 2.96Å; L120-L122 VanDerWaalsContact C-N 3.33Å; L122-N124 VanDerWaalsContact C-N 3.28Å; L122-N124 PolarHBondContact O-N 3.05Å; L122-V125 PolarHBondContact O-N 2.94Å; L122-A126 WeakPolarHBondContact O-CB 3.42Å; L122-A126 PolarHBondContact O-N 3.15Å
123A48.4Very low53.8Low44 Ų4472.7 Ų72.736%0.36441%0.412SS..Hα-helixtrans-59.6-41.4174.200000111.4P119 L120 A127P119-A123 PolarHBondContact O-N 3.18Å; L120-A123 PolarHBondContact O-N 3.46Å; A123-A127 WeakPolarHBondContact O-CB 3.48Å; A123-A127 PolarHBondContact O-N 2.93Å
124N53.4Low54Low82 Ų8269.3 Ų69.344%0.43940%0.397SS..Hα-helixtrans-71.1-34.8177.4-71.9-18.1000113.1L120 A121 L122 A127 Y128L120-N124 PolarHBondContact O-N 3.28Å; L120-N124 VanDerWaalsContact O-N 3.12Å; L120-N124 PolarHBondContact O-ND2 3.14Å; A121-N124 PolarHBondContact O-N 3.5Å; L122-N124 VanDerWaalsContact C-N 3.28Å; L122-N124 PolarHBondContact O-N 3.05Å; N124-A127 PolarHBondContact O-N 3.46Å; N124-Y128 VanDerWaalsContact O-CB 3.3Å; N124-Y128 WeakPolarHBondContact O-CB 3.47Å; N124-Y128 PolarHBondContact O-N 2.96Å
125V51.1Low54.5Low48 Ų4872.5 Ų72.529%0.29141%0.41SS..Hα-helixtrans-70.5-43.5175.5168.90000110.8V114 A121 L122 A127 Y128 Q129V114-V125 HydrophobicContact CB-CG2 4.49Å; V114-V125 HydrophobicContact CG1-CB 4.49Å; V114-V125 HydrophobicContact CG1-CG2 3.95Å; V114-V125 HydrophobicContact CG2-CG2 3.98Å; A121-V125 WeakPolarHBondContact O-CB 3.23Å; A121-V125 VanDerWaalsContact O-CG2 3.28Å; A121-V125 WeakPolarHBondContact O-CG2 3.46Å; A121-V125 PolarHBondContact O-N 3.36Å; L122-V125 PolarHBondContact O-N 2.94Å; V125-A127 VanDerWaalsContact C-N 3.31Å; V125-A127 PolarHBondContact O-N 3.37Å; V125-Y128 PolarHBondContact O-N 3.28Å; V125-Q129 WeakPolarHBondContact O-CB 3.34Å; V125-Q129 PolarHBondContact O-N 2.96Å
126A54Low55.1Low60 Ų6074.4 Ų74.450%0.49642%0.416SS..Hα-helixtrans-60.7-42.6173.200000111.2L122 Q129 Q130L122-A126 WeakPolarHBondContact O-CB 3.42Å; L122-A126 PolarHBondContact O-N 3.15Å; A126-Q129 PolarHBondContact O-N 3.23Å; A126-Q130 WeakPolarHBondContact O-CB 3.12Å; A126-Q130 PolarHBondContact O-N 3.36Å
127A53.6Low55.5Low15 Ų1575.1 Ų75.112%0.12440%0.403CS..Hα-helixtrans-60.9-44.2173.700000112.3A123 N124 V125 Q130 Q131 L173A123-A127 WeakPolarHBondContact O-CB 3.48Å; A123-A127 PolarHBondContact O-N 2.93Å; N124-A127 PolarHBondContact O-N 3.46Å; V125-A127 VanDerWaalsContact C-N 3.31Å; V125-A127 PolarHBondContact O-N 3.37Å; A127-Q130 PolarHBondContact O-N 3.05Å; A127-Q131 WeakPolarHBondContact O-CB 3.48Å; A127-Q131 PolarHBondContact O-N 3.42Å; A127-L173 HydrophobicContact CB-CD1 3.56Å; A127-L173 HydrophobicContact CB-CG 4.12Å
128Y56.8Low56.1Low140 Ų14072.5 Ų72.555%0.54938%0.381SS..Hα-helixtrans-68.4-38.1178.4-168.3-94.5000112.6N124 V125 Q131 Q132N124-Y128 VanDerWaalsContact O-CB 3.3Å; N124-Y128 WeakPolarHBondContact O-CB 3.47Å; N124-Y128 PolarHBondContact O-N 2.96Å; V125-Y128 PolarHBondContact O-N 3.28Å; Y128-Q131 WeakPolarHBondContact O-CB 3.47Å; Y128-Q131 PolarHBondContact O-N 2.87Å; Y128-Q132 HydrophobicContact CD1-CG 4.36Å; Y128-Q132 HydrophobicContact CE1-CG 4.02Å; Y128-Q132 PolarHBondContact O-N 3.45Å
129Q62.5Low56.8Low75 Ų7572.8 Ų72.835%0.3539%0.387SS..Hα-helixtrans-65-45.2175.5-130.6-81.93000110.7V125 A126 Q131 Q132 Q133V125-Q129 WeakPolarHBondContact O-CB 3.34Å; V125-Q129 PolarHBondContact O-N 2.96Å; A126-Q129 PolarHBondContact O-N 3.23Å; Q129-Q131 VanDerWaalsContact C-N 3.25Å; Q129-Q131 PolarHBondContact O-N 3.31Å; Q129-Q132 WeakPolarHBondContact O-CB 3.41Å; Q129-Q132 PolarHBondContact O-N 3.31Å; Q129-Q132 VanDerWaalsContact O-N 3.11Å; Q129-Q133 PolarHBondContact O-N 2.95Å
130Q61.8Low57.3Low65 Ų6570.4 Ų70.430%0.30438%0.376SS..Hα-helixtrans-58.8-40.7174.4-161.2-85.610.100110.9A126 A127 Q132 Q133 L134A126-Q130 WeakPolarHBondContact O-CB 3.12Å; A126-Q130 PolarHBondContact O-N 3.36Å; A127-Q130 PolarHBondContact O-N 3.05Å; Q130-Q132 PolarHBondContact O-N 3.32Å; Q130-Q133 PolarHBondContact O-N 3.03Å; Q130-L134 HydrophobicContact CG-CD2 4.43Å; Q130-L134 WeakPolarHBondContact O-CB 3.35Å; Q130-L134 WeakPolarHBondContact O-CD2 3.43Å; Q130-L134 PolarHBondContact O-N 2.95Å
131Q61.9Low57.8Low30 Ų3065.5 Ų65.514%0.1435%0.35CS..Hα-helixtrans-63.3-40175.9-166.9-140.163.800112.8A127 Y128 Q129 L134 Q135 Q176A127-Q131 WeakPolarHBondContact O-CB 3.48Å; A127-Q131 PolarHBondContact O-N 3.42Å; Y128-Q131 WeakPolarHBondContact O-CB 3.47Å; Y128-Q131 PolarHBondContact O-N 2.87Å; Q129-Q131 VanDerWaalsContact C-N 3.25Å; Q129-Q131 PolarHBondContact O-N 3.31Å; Q131-L134 PolarHBondContact O-N 3.45Å; Q131-Q135 VanDerWaalsContact CD-NE2 3.31Å; Q131-Q135 PolarHBondContact O-N 2.79Å; Q131-Q135 PolarHBondContact O-NE2 3.4Å; Q131-Q176 VanDerWaalsContact NE2-CD 3.25Å
132Q65.8Low58.1Low103 Ų10365.7 Ų65.748%0.48135%0.349SS..Hα-helixtrans-64.8-46.4175.3-88.2-10211.300111.7Y128 Q129 Q130 L134 Q135 Q136Y128-Q132 HydrophobicContact CD1-CG 4.36Å; Y128-Q132 HydrophobicContact CE1-CG 4.02Å; Y128-Q132 PolarHBondContact O-N 3.45Å; Q129-Q132 WeakPolarHBondContact O-CB 3.41Å; Q129-Q132 PolarHBondContact O-N 3.31Å; Q129-Q132 VanDerWaalsContact O-N 3.11Å; Q130-Q132 PolarHBondContact O-N 3.32Å; Q132-L134 VanDerWaalsContact C-N 3.33Å; Q132-L134 PolarHBondContact O-N 3.36Å; Q132-Q135 PolarHBondContact O-N 2.97Å; Q132-Q136 PolarHBondContact O-N 3Å
133Q63.6Low58.6Low94 Ų9470 Ų7044%0.43937%0.369SS..Hα-helixtrans-59.3-45.9173.5-84.4-166.1-24.800111Q129 Q130 Q135 Q136 F137Q129-Q133 PolarHBondContact O-N 2.95Å; Q130-Q133 PolarHBondContact O-N 3.03Å; Q133-Q135 VanDerWaalsContact C-N 3.32Å; Q133-Q135 PolarHBondContact O-N 3.34Å; Q133-Q136 PolarHBondContact O-N 3.38Å; Q133-Q136 VanDerWaalsContact O-N 3.08Å; Q133-F137 HydrophobicContact CB-CD2 4.28Å; Q133-F137 WeakPolarHBondContact O-CB 3.27Å; Q133-F137 WeakPolarHBondContact O-CD2 3.12Å; Q133-F137 PolarHBondContact O-N 3.33Å
134L60.7Low59Low13 Ų1370.9 Ų70.97%0.06837%0.367CS..Hα-helixtrans-60.4-40.4179.2-91.7-86.1000112.1Q130 Q131 Q132 Q136 F137 L138 L159 L177Q130-L134 HydrophobicContact CG-CD2 4.43Å; Q130-L134 WeakPolarHBondContact O-CB 3.35Å; Q130-L134 WeakPolarHBondContact O-CD2 3.43Å; Q130-L134 PolarHBondContact O-N 2.95Å; Q131-L134 PolarHBondContact O-N 3.45Å; Q132-L134 VanDerWaalsContact C-N 3.33Å; Q132-L134 PolarHBondContact O-N 3.36Å; L134-Q136 VanDerWaalsContact C-N 3.35Å; L134-Q136 PolarHBondContact O-N 3.33Å; L134-F137 PolarHBondContact O-N 3.19Å; L134-L138 WeakPolarHBondContact O-CA 3.49Å; L134-L138 VanDerWaalsContact O-CB 3.31Å; L134-L138 WeakPolarHBondContact O-CB 3.37Å; L134-L138 VanDerWaalsContact O-CD1 3.26Å; L134-L138 WeakPolarHBondContact O-CD1 3.41Å; L134-L138 PolarHBondContact O-N 3.42Å; L134-L159 HydrophobicContact CD1-CD1 4.13Å; L134-L159 HydrophobicContact CD1-CD2 4.26Å; L134-L159 HydrophobicContact CD2-CD2 3.65Å; L134-L177 HydrophobicContact CD1-CD1 3.73Å; L134-L177 HydrophobicContact CG-CD1 4Å
135Q60.7Low59.2Low88 Ų8867.7 Ų67.741%0.41135%0.351SS..Hα-helixtrans-64-38.5174.1-84.6159.693.900112.6Q131 Q132 Q133 P139Q131-Q135 VanDerWaalsContact CD-NE2 3.31Å; Q131-Q135 PolarHBondContact O-N 2.79Å; Q131-Q135 PolarHBondContact O-NE2 3.4Å; Q132-Q135 PolarHBondContact O-N 2.97Å; Q133-Q135 VanDerWaalsContact C-N 3.32Å; Q133-Q135 PolarHBondContact O-N 3.34Å; Q135-P139 WeakPolarHBondContact O-CD 3.29Å
136Q61.3Low59.2Low152 Ų15271.1 Ų71.171%0.7137%0.366SS*.Hα-helixtrans-72.5-34.4177.7-162.4-174.4-9.100112.3Q132 Q133 L134 P139Q132-Q136 PolarHBondContact O-N 3Å; Q133-Q136 PolarHBondContact O-N 3.38Å; Q133-Q136 VanDerWaalsContact O-N 3.08Å; L134-Q136 VanDerWaalsContact C-N 3.35Å; L134-Q136 PolarHBondContact O-N 3.33Å; Q136-P139 WeakPolarHBondContact O-CD 3.31Å
137F60.1Low59.4Low104 Ų10474.4 Ų74.446%0.45638%0.379SS..Hα-helixtrans-84.7-16.7178.2-80.4-76.6000113.3Q133 L134 A140 L141Q133-F137 HydrophobicContact CB-CD2 4.28Å; Q133-F137 WeakPolarHBondContact O-CB 3.27Å; Q133-F137 WeakPolarHBondContact O-CD2 3.12Å; Q133-F137 PolarHBondContact O-N 3.33Å; L134-F137 PolarHBondContact O-N 3.19Å; F137-A140 PolarHBondContact O-N 3.07Å; F137-A140 VanDerWaalsContact O-N 3.13Å; F137-L141 HydrophobicContact CB-CD1 4.34Å; F137-L141 WeakPolarHBondContact O-CB 3.37Å; F137-L141 PolarHBondContact O-N 3.03Å
138L61.5Low59.8Low41 Ų4177.1 Ų77.122%0.21539%0.392CS..Hα-helixtrans-55.2-44.4-177.8-131.680.2000114.1L134 L141 S142 Q180L134-L138 WeakPolarHBondContact O-CA 3.49Å; L134-L138 VanDerWaalsContact O-CB 3.31Å; L134-L138 WeakPolarHBondContact O-CB 3.37Å; L134-L138 VanDerWaalsContact O-CD1 3.26Å; L134-L138 WeakPolarHBondContact O-CD1 3.41Å; L134-L138 PolarHBondContact O-N 3.42Å; L138-L141 PolarHBondContact O-N 3.29Å; L138-S142 WeakPolarHBondContact O-CB 3.1Å; L138-S142 PolarHBondContact O-N 3.25Å; L138-S142 PolarHBondContact O-OG 3.08Å; L138-Q180 HydrophobicContact CD1-CB 4.42Å; L138-Q180 HydrophobicContact CD2-CB 4.09Å; L138-Q180 HydrophobicContact CD2-CG 4.28Å
139P61.6Low59.6Low77 Ų7772.4 Ų72.450%0.538%0.378SS..Hα-helixtrans-65.4-40.5176.8-19.832.1000112Q135 Q136 S142 Q143Q135-P139 WeakPolarHBondContact O-CD 3.29Å; Q136-P139 WeakPolarHBondContact O-CD 3.31Å; P139-S142 PolarHBondContact O-N 3.48Å; P139-Q143 WeakPolarHBondContact O-CG 3.44Å; P139-Q143 PolarHBondContact O-N 3.36Å; P139-Q143 VanDerWaalsContact O-N 3.08Å
140A61Low59.3Low53 Ų5372 Ų7244%0.43839%0.388SS..Hα-helixtrans-68.3-38.9177.400000111.7F137 Q143 L144F137-A140 PolarHBondContact O-N 3.07Å; F137-A140 VanDerWaalsContact O-N 3.13Å; A140-Q143 PolarHBondContact O-N 3.5Å; A140-L144 WeakPolarHBondContact O-CB 3.48Å; A140-L144 PolarHBondContact O-N 3.49Å
141L60.4Low59.2Low15 Ų1570.4 Ų70.48%0.07939%0.386CS..Hα-helixtrans-63.7-40.3175.1-89.2167.3000111.8F137 L138 L144 A145 Y152 Q155 L159F137-L141 HydrophobicContact CB-CD1 4.34Å; F137-L141 WeakPolarHBondContact O-CB 3.37Å; F137-L141 PolarHBondContact O-N 3.03Å; L138-L141 PolarHBondContact O-N 3.29Å; L141-L144 PolarHBondContact O-N 3.49Å; L141-A145 WeakPolarHBondContact O-CB 3.02Å; L141-A145 PolarHBondContact O-N 2.91Å; L141-Y152 HydrophobicContact CB-CD2 4.39Å; L141-Y152 HydrophobicContact CB-CE2 4.03Å; L141-Y152 HydrophobicContact CD2-CD2 3.67Å; L141-Y152 HydrophobicContact CD2-CE2 3.76Å; L141-Y152 HydrophobicContact CG-CE2 4.43Å; L141-Y152 WeakPolarHBondContact O-CD2 3.32Å; L141-Q155 HydrophobicContact CD2-CB 4.13Å; L141-L159 HydrophobicContact CD1-CD1 4.31Å
142S56.2Low59Low36 Ų3669.1 Ų69.125%0.25238%0.38SS..Hα-helixtrans-66.6-40.2176.7-60.80000111.6L138 P139 A145 M146L138-S142 WeakPolarHBondContact O-CB 3.1Å; L138-S142 PolarHBondContact O-N 3.25Å; L138-S142 PolarHBondContact O-OG 3.08Å; P139-S142 PolarHBondContact O-N 3.48Å; S142-A145 PolarHBondContact O-N 3.37Å; S142-M146 WeakPolarHBondContact O-CG 3.3Å; S142-M146 PolarHBondContact O-N 3.28Å
143Q54.6Low58.5Low136 Ų13666.3 Ų66.364%0.63637%0.368SS*.Hα-helixtrans-66-39.7172-71.3-176.549.600111.9P139 A140 A145 M146 V147P139-Q143 WeakPolarHBondContact O-CG 3.44Å; P139-Q143 PolarHBondContact O-N 3.36Å; P139-Q143 VanDerWaalsContact O-N 3.08Å; A140-Q143 PolarHBondContact O-N 3.5Å; Q143-A145 VanDerWaalsContact C-N 3.32Å; Q143-A145 PolarHBondContact O-N 2.82Å; Q143-M146 PolarHBondContact O-N 2.66Å; Q143-V147 WeakPolarHBondContact O-CG2 3.19Å; Q143-V147 PolarHBondContact O-N 2.86Å
144L57.1Low58.3Low62 Ų6268.2 Ų68.233%0.32538%0.376SS..Hα-helixtrans-64.5-37.7175.9-158.476000111.4A140 L141 M146 V147 N148 A151 Q155A140-L144 WeakPolarHBondContact O-CB 3.48Å; A140-L144 PolarHBondContact O-N 3.49Å; L141-L144 PolarHBondContact O-N 3.49Å; L144-M146 VanDerWaalsContact C-N 3.26Å; L144-M146 PolarHBondContact O-N 3.43Å; L144-V147 PolarHBondContact O-N 3.43Å; L144-N148 CarbonylContact O-C 3.16Å; L144-N148 WeakPolarHBondContact O-CA 3.46Å; L144-N148 PolarHBondContact O-N 2.88Å; L144-A151 HydrophobicContact CD2-CB 4.12Å; L144-A151 HydrophobicContact CG-CB 4.27Å; L144-Q155 HydrophobicContact CD2-CG 4.38Å
145A56.4Low58.3Low14 Ų1471.6 Ų71.612%0.11639%0.392CS..Hα-helixtrans-62.6-32.8174.500000112.6L141 S142 Q143 Y152L141-A145 WeakPolarHBondContact O-CB 3.02Å; L141-A145 PolarHBondContact O-N 2.91Å; S142-A145 PolarHBondContact O-N 3.37Å; Q143-A145 VanDerWaalsContact C-N 3.32Å; Q143-A145 PolarHBondContact O-N 2.82Å; A145-Y152 HydrophobicContact CB-CD1 3.93Å; A145-Y152 HydrophobicContact CB-CD2 3.92Å; A145-Y152 HydrophobicContact CB-CE1 4.23Å; A145-Y152 HydrophobicContact CB-CE2 4.27Å; A145-Y152 HydrophobicContact CB-CG 3.76Å
146M52.2Low58.3Low121 Ų12168 Ų6860%0.59638%0.375SS*.Hα-helixtrans-76.4-39.8176.8-67.9-120.268.700113.2S142 Q143 L144S142-M146 WeakPolarHBondContact O-CG 3.3Å; S142-M146 PolarHBondContact O-N 3.28Å; Q143-M146 PolarHBondContact O-N 2.66Å; L144-M146 VanDerWaalsContact C-N 3.26Å; L144-M146 PolarHBondContact O-N 3.43Å
147V58.7Low57.9Low128 Ų12867 Ų6778%0.77637%0.37SS*.Hα-helixtrans-87.5-36.6-174.5179.40000112Q143 L144Q143-V147 WeakPolarHBondContact O-CG2 3.19Å; Q143-V147 PolarHBondContact O-N 2.86Å; L144-V147 PolarHBondContact O-N 3.43Å
148N62.2Low57.6Low73 Ų7367.6 Ų67.639%0.3938%0.378SS..  trans-150.685.5-177-169.4-21.2000111.1L144 A150 A151 Y152L144-N148 CarbonylContact O-C 3.16Å; L144-N148 WeakPolarHBondContact O-CA 3.46Å; L144-N148 PolarHBondContact O-N 2.88Å; N148-A150 PolarHBondContact O-N 3.47Å; N148-A150 VanDerWaalsContact O-N 3.14Å; N148-A150 WeakPolarHBondContact OD1-CB 3.19Å; N148-A150 PolarHBondContact OD1-N 2.95Å; N148-A150 VanDerWaalsContact OD1-N 3.16Å; N148-A151 HydrophobicContact CB-CB 3.93Å; N148-A151 PolarHBondContact O-N 3.5Å; N148-A151 PolarHBondContact OD1-N 3.45Å; N148-Y152 PolarHBondContact O-N 2.92Å; N148-Y152 VanDerWaalsContact O-N 3.14Å
149P51.6Low57.2Low41 Ų4168 Ų6827%0.26638%0.38SS..Hα-helixtrans-60.3-24.4178.721.9-31.9000112.8L153 L188P149-L153 WeakPolarHBondContact O-CD2 3.46Å; P149-L153 WeakPolarHBondContact O-CG 3.28Å; P149-L153 PolarHBondContact O-N 2.71Å; P149-L188 HydrophobicContact CB-CD1 4.02Å
150A56.6Low56.7Low67 Ų6767.8 Ų67.855%0.55438%0.38SS*.Hα-helixtrans-72.5-36.6174.900000112.6N148 L153 Q154N148-A150 PolarHBondContact O-N 3.47Å; N148-A150 VanDerWaalsContact O-N 3.14Å; N148-A150 WeakPolarHBondContact OD1-CB 3.19Å; N148-A150 PolarHBondContact OD1-N 2.95Å; N148-A150 VanDerWaalsContact OD1-N 3.16Å; A150-L153 PolarHBondContact O-N 3.39Å; A150-Q154 PolarHBondContact O-N 3.46Å
151A59.6Low55.7Low31 Ų3169.4 Ų69.426%0.25639%0.389SS..Hα-helixtrans-71.2-35.8176.100000112.3L144 N148 L153 Q154 Q155L144-A151 HydrophobicContact CD2-CB 4.12Å; L144-A151 HydrophobicContact CG-CB 4.27Å; N148-A151 HydrophobicContact CB-CB 3.93Å; N148-A151 PolarHBondContact O-N 3.5Å; N148-A151 PolarHBondContact OD1-N 3.45Å; A151-L153 PolarHBondContact O-N 2.8Å; A151-Q154 PolarHBondContact O-N 2.82Å; A151-Q155 PolarHBondContact O-N 2.85Å
152Y58.4Low54.8Low3 Ų372.5 Ų72.51%0.01241%0.411CS..Hα-helixtrans-58.4-38.2172.2178.8-114.7000112L141 A145 N148 Q155 Q156L141-Y152 HydrophobicContact CB-CD2 4.39Å; L141-Y152 HydrophobicContact CB-CE2 4.03Å; L141-Y152 HydrophobicContact CD2-CD2 3.67Å; L141-Y152 HydrophobicContact CD2-CE2 3.76Å; L141-Y152 HydrophobicContact CG-CE2 4.43Å; L141-Y152 WeakPolarHBondContact O-CD2 3.32Å; A145-Y152 HydrophobicContact CB-CD1 3.93Å; A145-Y152 HydrophobicContact CB-CD2 3.92Å; A145-Y152 HydrophobicContact CB-CE1 4.23Å; A145-Y152 HydrophobicContact CB-CE2 4.27Å; A145-Y152 HydrophobicContact CB-CG 3.76Å; N148-Y152 PolarHBondContact O-N 2.92Å; N148-Y152 VanDerWaalsContact O-N 3.14Å; Y152-Q155 PolarHBondContact O-N 2.78Å; Y152-Q156 VanDerWaalsContact CZ-NE2 3.27Å; Y152-Q156 PolarHBondContact O-N 3.27Å; Y152-Q156 PolarHBondContact OH-NE2 3.29Å
153L53.5Low53.9Low44 Ų4475.9 Ų75.923%0.2343%0.433CS..Hα-helixtrans-68.5-41.2-178.8-77.1-103000112P149 A150 A151 Q156 Q157 Q199P149-L153 WeakPolarHBondContact O-CD2 3.46Å; P149-L153 WeakPolarHBondContact O-CG 3.28Å; P149-L153 PolarHBondContact O-N 2.71Å; A150-L153 PolarHBondContact O-N 3.39Å; A151-L153 PolarHBondContact O-N 2.8Å; L153-Q156 PolarHBondContact O-N 3.32Å; L153-Q157 WeakPolarHBondContact O-CG 3.21Å; L153-Q157 PolarHBondContact O-N 3.33Å; L153-Q199 HydrophobicContact CD1-CG 4.29Å
154Q60Low53.2Low133 Ų13374.6 Ų74.662%0.62143%0.429SS*.Hα-helixtrans-60.5-46.3173.9-80.7-91.3-7.700111.6A150 A151 Q156 Q157 L158A150-Q154 PolarHBondContact O-N 3.46Å; A151-Q154 PolarHBondContact O-N 2.82Å; Q154-Q156 PolarHBondContact O-N 2.85Å; Q154-Q157 PolarHBondContact O-N 3.23Å; Q154-L158 PolarHBondContact O-N 2.98Å
155Q61.7Low52.3Low84 Ų8477.7 Ų77.739%0.39345%0.451SS..Hα-helixtrans-64.5-39.4177.6-87.1-92.465.600112.5L141 L144 A151 Y152 L158 L159L141-Q155 HydrophobicContact CD2-CB 4.13Å; L144-Q155 HydrophobicContact CD2-CG 4.38Å; A151-Q155 PolarHBondContact O-N 2.85Å; Y152-Q155 PolarHBondContact O-N 2.78Å; Q155-L158 WeakPolarHBondContact O-CB 3.46Å; Q155-L158 PolarHBondContact O-N 3.19Å; Q155-L159 WeakPolarHBondContact O-CG 3.31Å; Q155-L159 PolarHBondContact O-N 2.58Å
156Q59.2Low51.2Low12 Ų1282.9 Ų82.96%0.05648%0.481CS..Hα-helixtrans-71.4-32.6179.1-117.8-15568.600113.3Y152 L153 Q154 L159 S160 I181Y152-Q156 VanDerWaalsContact CZ-NE2 3.27Å; Y152-Q156 PolarHBondContact O-N 3.27Å; Y152-Q156 PolarHBondContact OH-NE2 3.29Å; L153-Q156 PolarHBondContact O-N 3.32Å; Q154-Q156 PolarHBondContact O-N 2.85Å; Q156-L159 PolarHBondContact O-N 3.14Å; Q156-S160 PolarHBondContact O-N 3.49Å; Q156-S160 PolarHBondContact O-OG 2.94Å; Q156-I181 HydrophobicContact CG-CD1 4.17Å
157Q54.5Low50.5Low131 Ų13179.8 Ų79.861%0.61248%0.479SS*.Hα-helixtrans-64.6-41.9172.8-76.8-170.8-7.800111.3L153 Q154 L159 S160 S161L153-Q157 WeakPolarHBondContact O-CG 3.21Å; L153-Q157 PolarHBondContact O-N 3.33Å; Q154-Q157 PolarHBondContact O-N 3.23Å; Q157-L159 VanDerWaalsContact C-N 3.26Å; Q157-L159 PolarHBondContact O-N 3.43Å; Q157-S160 PolarHBondContact O-N 2.88Å; Q157-S161 WeakPolarHBondContact O-CB 3.3Å; Q157-S161 PolarHBondContact O-N 3.39Å; Q157-S161 PolarHBondContact O-OG 3.4Å
158L53.5Low49.8Very low117 Ų11780.9 Ų80.961%0.61348%0.481SS*.Hα-helixtrans-57.2-39.1173.5-85.4154.1000112.4Q154 Q155Q154-L158 PolarHBondContact O-N 2.98Å; Q155-L158 WeakPolarHBondContact O-CB 3.46Å; Q155-L158 PolarHBondContact O-N 3.19Å
159L53.4Low48.8Very low51 Ų5179.5 Ų79.527%0.26748%0.48SS..Hα-helixtrans-71.4-34.9177.7-70.9164.2000113.3L134 L141 Q155 Q156 Q157L134-L159 HydrophobicContact CD1-CD1 4.13Å; L134-L159 HydrophobicContact CD1-CD2 4.26Å; L134-L159 HydrophobicContact CD2-CD2 3.65Å; L141-L159 HydrophobicContact CD1-CD1 4.31Å; Q155-L159 WeakPolarHBondContact O-CG 3.31Å; Q155-L159 PolarHBondContact O-N 2.58Å; Q156-L159 PolarHBondContact O-N 3.14Å; Q157-L159 VanDerWaalsContact C-N 3.26Å; Q157-L159 PolarHBondContact O-N 3.43Å
160S50.2Low48.8Very low72 Ų7280 Ų8050%0.50348%0.483SS..Hα-helixtrans-82.2-18.4-178.9-53.50000113.2Q156 Q157 S162Q156-S160 PolarHBondContact O-N 3.49Å; Q156-S160 PolarHBondContact O-OG 2.94Å; Q157-S160 PolarHBondContact O-N 2.88Å; S160-S162 VanDerWaalsContact C-N 3.26Å; S160-S162 PolarHBondContact O-N 3.33Å
161S40Very low48.5Very low87 Ų8780.3 Ų80.361%0.60848%0.478SS*.THydrogen-bonded Turntrans-825.5-174.7-58.40000114.2Q157 P163Q157-S161 WeakPolarHBondContact O-CB 3.3Å; Q157-S161 PolarHBondContact O-N 3.39Å; Q157-S161 PolarHBondContact O-OG 3.4Å; S161-P163 WeakPolarHBondContact O-CD 3.17Å
162S40.6Very low48Very low80 Ų8084.1 Ų84.156%0.55949%0.487SS*.  trans-85104.3173.3-78.10000109.9S160 L164S160-S162 VanDerWaalsContact C-N 3.26Å; S160-S162 PolarHBondContact O-N 3.33Å; S162-L164 PolarHBondContact O-N 3.21Å
163P37.6Very low47.7Very low107 Ų10786.3 Ų86.370%0.69550%0.498SS*.  trans-7183.6170.431.4-35.4000108.6S161 V165S161-P163 WeakPolarHBondContact O-CD 3.17Å; P163-V165 HydrophobicContact CB-CG2 3.91Å; P163-V165 PolarHBondContact O-N 3.26Å
164L40Very low48Very low108 Ų10886.8 Ų86.857%0.56550%0.499SS*.  trans-73.669.9157.9-98.387000108.1S162 V166S162-L164 PolarHBondContact O-N 3.21Å; L164-V166 VanDerWaalsContact C-N 3.26Å; L164-V166 PolarHBondContact O-N 3.44Å
165V39.6Very low47.9Very low128 Ų12884.5 Ų84.578%0.77649%0.489SS*.  trans-87.766.1171.9176.90000107.4P163P163-V165 HydrophobicContact CB-CG2 3.91Å; P163-V165 PolarHBondContact O-N 3.26Å
166V32.9Very low47.9Very low123 Ų12382.6 Ų82.675%0.74548%0.48SS*.SBendtrans-150.6111.3167.2-171.80000110.1L164L164-V166 VanDerWaalsContact C-N 3.26Å; L164-V166 PolarHBondContact O-N 3.44Å
167G37.7Very low48.1Very low55 Ų5584.3 Ų84.357%0.56749%0.489SS*.SBendtrans77.6167.4166.500000115.2A169 P170G167-A169 PolarHBondContact O-N 3.11Å; G167-P170 WeakPolarHBondContact O-CD 3.13Å
168N43.8Very low48.4Very low151 Ų15178.3 Ų78.381%0.80746%0.461SS*.SBendtrans-70.715.3-178-62.7-48.5000115P170 T171N168-P170 VanDerWaalsContact C-CD 3.41Å; N168-T171 PolarHBondContact O-OG1 2.85Å; N168-T171 VanDerWaalsContact O-OG1 3.12Å
169A41.1Very low48.9Very low45 Ų4578.6 Ų78.637%0.37246%0.459SS..  trans-76.9-27.9176.500000116.6G167 T171G167-A169 PolarHBondContact O-N 3.11Å; A169-T171 VanDerWaalsContact C-N 3.28Å; A169-T171 PolarHBondContact O-N 3.49Å
170P52Low49.3Very low52 Ų5278.4 Ų78.434%0.33846%0.457SS..Hα-helixtrans-73.5-20.3-173.728.6-31.3000112.3G167 N168 Q174G167-P170 WeakPolarHBondContact O-CD 3.13Å; N168-P170 VanDerWaalsContact C-CD 3.41Å; P170-Q174 WeakPolarHBondContact O-CB 3.36Å; P170-Q174 PolarHBondContact O-N 3.15Å
171T49.2Very low49.9Very low72 Ų7275.6 Ų75.644%0.44244%0.436SS..Hα-helixtrans-69.7-36178.935.40000113.1N168 A169 Q175N168-T171 PolarHBondContact O-OG1 2.85Å; N168-T171 VanDerWaalsContact O-OG1 3.12Å; A169-T171 VanDerWaalsContact C-N 3.28Å; A169-T171 PolarHBondContact O-N 3.49Å; T171-Q175 WeakPolarHBondContact O-CB 3.41Å; T171-Q175 PolarHBondContact O-N 3.44Å; T171-Q175 VanDerWaalsContact O-N 3.14Å
172Y49.3Very low51Low112 Ų11273 Ų7344%0.43942%0.417SS..Hα-helixtrans-75.4-45.2177.9-175.1-97.7000111.7Q174 Q175 Q176Y172-Q174 PolarHBondContact O-N 3.4Å; Y172-Q175 PolarHBondContact O-N 2.91Å; Y172-Q176 WeakPolarHBondContact O-CB 3.41Å; Y172-Q176 PolarHBondContact O-N 3.42Å
173L53Low52.1Low48 Ų4872.6 Ų72.625%0.25141%0.412SS..Hα-helixtrans-65-40.3177.7-88.4-129.5000112.3A127 Q176 L177A127-L173 HydrophobicContact CB-CD1 3.56Å; A127-L173 HydrophobicContact CB-CG 4.12Å; L173-Q176 PolarHBondContact O-N 2.78Å; L173-L177 VanDerWaalsContact O-CB 3.23Å; L173-L177 WeakPolarHBondContact O-CB 3.35Å; L173-L177 PolarHBondContact O-N 3.3Å
174Q58.1Low53.4Low54 Ų5467.9 Ų67.925%0.25238%0.382SS..Hα-helixtrans-65.7-41.1176.4-176.8-114.5106.200111.1P170 Y172 L178 L206P170-Q174 WeakPolarHBondContact O-CB 3.36Å; P170-Q174 PolarHBondContact O-N 3.15Å; Y172-Q174 PolarHBondContact O-N 3.4Å; Q174-L178 HydrophobicContact CG-CD1 4.28Å; Q174-L178 WeakPolarHBondContact O-CB 3.33Å; Q174-L178 WeakPolarHBondContact O-CD1 3.31Å; Q174-L178 PolarHBondContact O-N 3.08Å; Q174-L206 HydrophobicContact CG-CD2 3.93Å; Q174-L206 VanDerWaalsContact OE1-CD1 3.23Å
175Q58.5Low54.5Low86 Ų8662.8 Ų62.840%0.40236%0.356SS..Hα-helixtrans-61.6-43.6171.6-90.7-158.19200112.6T171 Y172 L178 Q179T171-Q175 WeakPolarHBondContact O-CB 3.41Å; T171-Q175 PolarHBondContact O-N 3.44Å; T171-Q175 VanDerWaalsContact O-N 3.14Å; Y172-Q175 PolarHBondContact O-N 2.91Å; Q175-L178 WeakPolarHBondContact O-CB 3.41Å; Q175-L178 PolarHBondContact O-N 3.09Å; Q175-Q179 WeakPolarHBondContact O-CG 3.48Å; Q175-Q179 PolarHBondContact O-N 2.99Å
176Q62.3Low55.7Low44 Ų4458.9 Ų58.921%0.20633%0.332CS..Hα-helixtrans-69.3-40.3-178.3-160.9-163.7-11.700111.8Q131 Y172 L173 L178 Q179 Q180Q131-Q176 VanDerWaalsContact NE2-CD 3.25Å; Y172-Q176 WeakPolarHBondContact O-CB 3.41Å; Y172-Q176 PolarHBondContact O-N 3.42Å; L173-Q176 PolarHBondContact O-N 2.78Å; Q176-L178 VanDerWaalsContact C-N 3.3Å; Q176-L178 PolarHBondContact O-N 3.41Å; Q176-Q179 PolarHBondContact O-N 3.42Å; Q176-Q180 PolarHBondContact O-N 3.47Å; Q176-Q180 VanDerWaalsContact O-N 3.1Å
177L62.3Low57.1Low47 Ų4758.1 Ų58.125%0.24632%0.321CS..Hα-helixtrans-60.1-45.2173.9-170110.8000109.7L134 L173 Q179 Q180 I181L134-L177 HydrophobicContact CD1-CD1 3.73Å; L134-L177 HydrophobicContact CG-CD1 4Å; L173-L177 VanDerWaalsContact O-CB 3.23Å; L173-L177 WeakPolarHBondContact O-CB 3.35Å; L173-L177 PolarHBondContact O-N 3.3Å; L177-Q179 PolarHBondContact O-N 3.25Å; L177-Q180 CarbonylContact O-C 3.59Å; L177-Q180 PolarHBondContact O-N 3.37Å; L177-Q180 VanDerWaalsContact O-N 3.13Å; L177-I181 HydrophobicContact CD2-CD1 4.05Å; L177-I181 HydrophobicContact CG-CD1 4.42Å; L177-I181 WeakPolarHBondContact O-CB 3.25Å; L177-I181 PolarHBondContact O-N 3.4Å
178L61.7Low58.4Low5 Ų555.8 Ų55.83%0.02630%0.295CS..Hα-helixtrans-59.3-44.5174.8-99.1147.4000113.3Q174 Q175 Q176 Q180 I181 V182 F203 L206 Q217 L221Q174-L178 HydrophobicContact CG-CD1 4.28Å; Q174-L178 WeakPolarHBondContact O-CB 3.33Å; Q174-L178 WeakPolarHBondContact O-CD1 3.31Å; Q174-L178 PolarHBondContact O-N 3.08Å; Q175-L178 WeakPolarHBondContact O-CB 3.41Å; Q175-L178 PolarHBondContact O-N 3.09Å; Q176-L178 VanDerWaalsContact C-N 3.3Å; Q176-L178 PolarHBondContact O-N 3.41Å; L178-Q180 PolarHBondContact O-N 2.87Å; L178-I181 PolarHBondContact O-N 2.8Å; L178-I181 VanDerWaalsContact O-N 3.11Å; L178-V182 WeakPolarHBondContact O-CB 3.45Å; L178-V182 WeakPolarHBondContact O-CG2 3.15Å; L178-V182 PolarHBondContact O-N 3.48Å; L178-F203 HydrophobicContact CD1-CD1 3.94Å; L178-F203 HydrophobicContact CD1-CE1 3.91Å; L178-F203 HydrophobicContact CD2-CD1 3.83Å; L178-F203 HydrophobicContact CD2-CE1 3.5Å; L178-F203 HydrophobicContact CD2-CZ 4.06Å; L178-F203 HydrophobicContact CG-CD1 4.13Å; L178-F203 HydrophobicContact CG-CE1 3.67Å; L178-L206 HydrophobicContact CD1-CD1 4.19Å; L178-Q217 HydrophobicContact CD1-CG 4.28Å; L178-L221 HydrophobicContact CD2-CD1 3.78Å; L178-L221 HydrophobicContact CD2-CD2 3.64Å; L178-L221 HydrophobicContact CD2-CG 4.01Å
179Q62.5Low59.3Low124 Ų12449.1 Ų49.158%0.57926%0.261SS*.Hα-helixtrans-61.4-32.9176-71.6-158.196.900112.7Q175 Q176 L177 P183Q175-Q179 WeakPolarHBondContact O-CG 3.48Å; Q175-Q179 PolarHBondContact O-N 2.99Å; Q176-Q179 PolarHBondContact O-N 3.42Å; L177-Q179 PolarHBondContact O-N 3.25Å; Q179-P183 WeakPolarHBondContact O-CD 3.34Å
180Q62.5Low60.4Low46 Ų4652.7 Ų52.722%0.21528%0.278CS..Hα-helixtrans-77.5-29.3173.8-87.1-173.462.200113.6L138 Q176 L177 L178 P183L138-Q180 HydrophobicContact CD1-CB 4.42Å; L138-Q180 HydrophobicContact CD2-CB 4.09Å; L138-Q180 HydrophobicContact CD2-CG 4.28Å; Q176-Q180 PolarHBondContact O-N 3.47Å; Q176-Q180 VanDerWaalsContact O-N 3.1Å; L177-Q180 CarbonylContact O-C 3.59Å; L177-Q180 PolarHBondContact O-N 3.37Å; L177-Q180 VanDerWaalsContact O-N 3.13Å; L178-Q180 PolarHBondContact O-N 2.87Å; Q180-P183 WeakPolarHBondContact O-CD 3.19Å
181I62.6Low61Low13 Ų1353.3 Ų53.37%0.06729%0.288CS..Hα-helixtrans-85.8-27.1-177.6-114.9165.6000111.8Q156 L177 L178 A184 L185 F203Q156-I181 HydrophobicContact CG-CD1 4.17Å; L177-I181 HydrophobicContact CD2-CD1 4.05Å; L177-I181 HydrophobicContact CG-CD1 4.42Å; L177-I181 WeakPolarHBondContact O-CB 3.25Å; L177-I181 PolarHBondContact O-N 3.4Å; L178-I181 PolarHBondContact O-N 2.8Å; L178-I181 VanDerWaalsContact O-N 3.11Å; I181-A184 WeakPolarHBondContact O-CB 3.34Å; I181-A184 PolarHBondContact O-N 2.97Å; I181-L185 HydrophobicContact CG2-CD1 3.39Å; I181-L185 HydrophobicContact CG2-CD2 4.45Å; I181-L185 HydrophobicContact CG2-CG 3.68Å; I181-L185 WeakPolarHBondContact O-CG 3.33Å; I181-L185 PolarHBondContact O-N 3.43Å; I181-F203 HydrophobicContact CG2-CZ 4.33Å
182V63.4Low61.9Low33 Ų3352.7 Ų52.720%0.228%0.282CS..Hα-helixtrans-51.8-44.6179162.60000112.9L178 A184 L185 T186 L221L178-V182 WeakPolarHBondContact O-CB 3.45Å; L178-V182 WeakPolarHBondContact O-CG2 3.15Å; L178-V182 PolarHBondContact O-N 3.48Å; V182-A184 PolarHBondContact O-N 3.05Å; V182-L185 PolarHBondContact O-N 3.04Å; V182-T186 WeakPolarHBondContact O-CB 3.48Å; V182-T186 PolarHBondContact O-N 3.25Å; V182-T186 PolarHBondContact O-OG1 3.32Å; V182-L221 HydrophobicContact CG2-CD2 3.96Å
183P64.5Low62.5Low71 Ų7149.6 Ų49.646%0.46128%0.275SS..Hα-helixtrans-61.9-41.8174.5-24.133.7000113.5Q179 Q180 T186 Q187Q179-P183 WeakPolarHBondContact O-CD 3.34Å; Q180-P183 WeakPolarHBondContact O-CD 3.19Å; P183-T186 WeakPolarHBondContact O-CB 3.47Å; P183-T186 PolarHBondContact O-N 3.49Å; P183-Q187 PolarHBondContact O-N 3.15Å; P183-Q187 VanDerWaalsContact O-N 3.07Å
184A63.4Low63.2Low9 Ų950.2 Ų50.27%0.07429%0.287CS..Hα-helixtrans-68.3-40.7177.800000111.6I181 V182 T186 Q187 L188I181-A184 WeakPolarHBondContact O-CB 3.34Å; I181-A184 PolarHBondContact O-N 2.97Å; V182-A184 PolarHBondContact O-N 3.05Å; A184-T186 VanDerWaalsContact C-N 3.33Å; A184-Q187 PolarHBondContact O-N 3.38Å; A184-L188 PolarHBondContact O-N 3.48Å
185L64.6Low63.5Low1 Ų148.5 Ų48.51%0.00528%0.282CS..Hα-helixtrans-61.8-41.9172.6-67.8-178.6000110.8I181 V182 Q187 L188 A189 Y196 Q199 F203 L221I181-L185 HydrophobicContact CG2-CD1 3.39Å; I181-L185 HydrophobicContact CG2-CD2 4.45Å; I181-L185 HydrophobicContact CG2-CG 3.68Å; I181-L185 WeakPolarHBondContact O-CG 3.33Å; I181-L185 PolarHBondContact O-N 3.43Å; V182-L185 PolarHBondContact O-N 3.04Å; L185-Q187 VanDerWaalsContact C-N 3.32Å; L185-Q187 PolarHBondContact O-N 2.93Å; L185-L188 CarbonylContact O-C 3.52Å; L185-L188 WeakPolarHBondContact O-CA 3.37Å; L185-L188 WeakPolarHBondContact O-CB 3.3Å; L185-L188 PolarHBondContact O-N 3.23Å; L185-L188 VanDerWaalsContact O-N 3.08Å; L185-A189 PolarHBondContact O-N 2.86Å; L185-Y196 HydrophobicContact CB-CD2 4.37Å; L185-Y196 HydrophobicContact CB-CE2 3.71Å; L185-Y196 WeakPolarHBondContact O-CD2 3.48Å; L185-Y196 WeakPolarHBondContact O-CE2 3.25Å; L185-Q199 HydrophobicContact CD2-CB 4.35Å; L185-Q199 VanDerWaalsContact CD2-CD 3.41Å; L185-Q199 HydrophobicContact CD2-CG 4.23Å; L185-F203 HydrophobicContact CD1-CE2 4.22Å; L185-F203 HydrophobicContact CD1-CZ 4.4Å; L185-L221 HydrophobicContact CD1-CD2 3.68Å
186T64.2Low63.9Low46 Ų4644.5 Ų44.528%0.28226%0.263SS..Hα-helixtrans-61-41.9177.5-600000111.3V182 P183 A184 L188 A189 V190 P224V182-T186 WeakPolarHBondContact O-CB 3.48Å; V182-T186 PolarHBondContact O-N 3.25Å; V182-T186 PolarHBondContact O-OG1 3.32Å; P183-T186 WeakPolarHBondContact O-CB 3.47Å; P183-T186 PolarHBondContact O-N 3.49Å; A184-T186 VanDerWaalsContact C-N 3.33Å; T186-L188 VanDerWaalsContact C-N 3.32Å; T186-L188 PolarHBondContact O-N 3.28Å; T186-A189 WeakPolarHBondContact O-CB 3.46Å; T186-A189 PolarHBondContact O-N 3.09Å; T186-V190 WeakPolarHBondContact O-CG2 2.98Å; T186-V190 PolarHBondContact O-N 2.8Å; T186-P224 HydrophobicContact CG2-CB 3.61Å
187Q62Low63.9Low107 Ų10743.6 Ų43.650%0.526%0.26SS..Hα-helixtrans-65.1-37.1173.8-68.9-165.65500112.2P183 A184 L185 A189 V190 A191P183-Q187 PolarHBondContact O-N 3.15Å; P183-Q187 VanDerWaalsContact O-N 3.07Å; A184-Q187 PolarHBondContact O-N 3.38Å; L185-Q187 VanDerWaalsContact C-N 3.32Å; L185-Q187 PolarHBondContact O-N 2.93Å; Q187-A189 VanDerWaalsContact C-N 3.35Å; Q187-V190 PolarHBondContact O-N 3.27Å; Q187-A191 WeakPolarHBondContact O-CB 3.45Å; Q187-A191 PolarHBondContact O-N 3.24Å
188L64.4Low64Low5 Ų547.4 Ų47.43%0.02628%0.276CS..Hα-helixtrans-66.3-35.7173.1-17068.7000112.2P149 A184 L185 T186 V190 A191 N192 A195P149-L188 HydrophobicContact CB-CD1 4.02Å; A184-L188 PolarHBondContact O-N 3.48Å; L185-L188 CarbonylContact O-C 3.52Å; L185-L188 WeakPolarHBondContact O-CA 3.37Å; L185-L188 WeakPolarHBondContact O-CB 3.3Å; L185-L188 PolarHBondContact O-N 3.23Å; L185-L188 VanDerWaalsContact O-N 3.08Å; T186-L188 VanDerWaalsContact C-N 3.32Å; T186-L188 PolarHBondContact O-N 3.28Å; L188-V190 PolarHBondContact O-N 3.26Å; L188-A191 PolarHBondContact O-N 3.46Å; L188-N192 HydrophobicContact CD1-CB 4.31Å; L188-N192 CarbonylContact O-C 3.19Å; L188-N192 WeakPolarHBondContact O-CA 3.4Å; L188-N192 PolarHBondContact O-N 3.41Å; L188-N192 VanDerWaalsContact O-O 3.1Å; L188-A195 HydrophobicContact CD1-CB 4.3Å; L188-A195 HydrophobicContact CD2-CB 4.18Å; L188-A195 HydrophobicContact CG-CB 4.34Å
189A64.2Low64.1Low11 Ų1147.5 Ų47.59%0.09128%0.276CS..Hα-helixtrans-59.3-38.517500000111.8L185 T186 Q187 Y196 L225L185-A189 PolarHBondContact O-N 2.86Å; T186-A189 WeakPolarHBondContact O-CB 3.46Å; T186-A189 PolarHBondContact O-N 3.09Å; Q187-A189 VanDerWaalsContact C-N 3.35Å; A189-Y196 HydrophobicContact CB-CD1 4.35Å; A189-Y196 HydrophobicContact CB-CD2 3.52Å; A189-Y196 HydrophobicContact CB-CE2 3.75Å; A189-Y196 HydrophobicContact CB-CG 3.82Å; A189-L225 HydrophobicContact CB-CD2 4.36Å
190V64.5Low64.1Low120 Ų12042 Ų4273%0.72725%0.251SS*.Hα-helixtrans-75.4-43.4178.2178.60000111.4T186 Q187 L188T186-V190 WeakPolarHBondContact O-CG2 2.98Å; T186-V190 PolarHBondContact O-N 2.8Å; Q187-V190 PolarHBondContact O-N 3.27Å; L188-V190 PolarHBondContact O-N 3.26Å
191A64.1Low64.1Low66 Ų6644.6 Ų44.655%0.54527%0.266SS..Hα-helixtrans-77.7-35.7-176.700000113.5Q187 L188Q187-A191 WeakPolarHBondContact O-CB 3.45Å; Q187-A191 PolarHBondContact O-N 3.24Å; L188-A191 PolarHBondContact O-N 3.46Å
192N68.2Low63.8Low59 Ų5947.4 Ų47.432%0.31629%0.285SS..  trans-154.985.1-176-169.5-21.5000111.4L188 A194 A195 Y196L188-N192 HydrophobicContact CD1-CB 4.31Å; L188-N192 CarbonylContact O-C 3.19Å; L188-N192 WeakPolarHBondContact O-CA 3.4Å; L188-N192 PolarHBondContact O-N 3.41Å; L188-N192 VanDerWaalsContact O-O 3.1Å; N192-A194 PolarHBondContact O-N 3.12Å; N192-A194 PolarHBondContact OD1-N 3.48Å; N192-A195 HydrophobicContact CB-CB 3.95Å; N192-A195 VanDerWaalsContact CG-CB 3.49Å; N192-A195 PolarHBondContact O-N 2.96Å; N192-A195 VanDerWaalsContact O-N 3.12Å; N192-A195 PolarHBondContact OD1-N 3.39Å; N192-Y196 PolarHBondContact O-N 2.86Å; N192-Y196 VanDerWaalsContact O-N 3.11Å
193P62.3Low63.5Low47 Ų4747 Ų4731%0.30528%0.281SS..Hα-helixtrans-62.6-25.5-178.423.1-33.3000113.5L197P193-L197 PolarHBondContact O-N 3.12Å
194A66Low62.9Low60 Ų6045.8 Ų45.850%0.49627%0.27SS..Hα-helixtrans-70.9-40.9175.600000111.8N192 Y196 L197 Q198N192-A194 PolarHBondContact O-N 3.12Å; N192-A194 PolarHBondContact OD1-N 3.48Å; A194-Y196 VanDerWaalsContact C-N 3.33Å; A194-L197 PolarHBondContact O-N 2.78Å; A194-Q198 PolarHBondContact O-N 2.94Å
195A65.5Low62.3Low18 Ų1853.2 Ų53.215%0.14930%0.303CS..Hα-helixtrans-66.8-35.1174.700000112.1L188 N192 L197 Q198 Q199L188-A195 HydrophobicContact CD1-CB 4.3Å; L188-A195 HydrophobicContact CD2-CB 4.18Å; L188-A195 HydrophobicContact CG-CB 4.34Å; N192-A195 HydrophobicContact CB-CB 3.95Å; N192-A195 VanDerWaalsContact CG-CB 3.49Å; N192-A195 PolarHBondContact O-N 2.96Å; N192-A195 VanDerWaalsContact O-N 3.12Å; N192-A195 PolarHBondContact OD1-N 3.39Å; A195-L197 PolarHBondContact O-N 3.24Å; A195-Q198 PolarHBondContact O-N 2.83Å; A195-Q199 PolarHBondContact O-N 2.87Å
196Y66.2Low61.7Low2 Ų254.6 Ų54.61%0.00831%0.31CS..Hα-helixtrans-58.5-45.3175.7-172.7-96000113L185 A189 N192 A194 Q198 Q199 L200 L221 P224 L225L185-Y196 HydrophobicContact CB-CD2 4.37Å; L185-Y196 HydrophobicContact CB-CE2 3.71Å; L185-Y196 WeakPolarHBondContact O-CD2 3.48Å; L185-Y196 WeakPolarHBondContact O-CE2 3.25Å; A189-Y196 HydrophobicContact CB-CD1 4.35Å; A189-Y196 HydrophobicContact CB-CD2 3.52Å; A189-Y196 HydrophobicContact CB-CE2 3.75Å; A189-Y196 HydrophobicContact CB-CG 3.82Å; N192-Y196 PolarHBondContact O-N 2.86Å; N192-Y196 VanDerWaalsContact O-N 3.11Å; A194-Y196 VanDerWaalsContact C-N 3.33Å; Y196-Q198 VanDerWaalsContact C-N 3.32Å; Y196-Q198 PolarHBondContact O-N 3.46Å; Y196-Q199 WeakPolarHBondContact O-CB 2.75Å; Y196-Q199 PolarHBondContact O-N 3.25Å; Y196-L200 HydrophobicContact CD1-CD1 4.09Å; Y196-L200 HydrophobicContact CD1-CG 4.42Å; Y196-L200 HydrophobicContact CE1-CD1 3.68Å; Y196-L200 HydrophobicContact CE1-CD2 4.35Å; Y196-L200 HydrophobicContact CE1-CG 4.08Å; Y196-L200 PolarHBondContact O-N 3.37Å; Y196-L221 PolarHBondContact OH-O 2.81Å; Y196-P224 VanDerWaalsContact OH-CG 3.3Å; Y196-P224 WeakPolarHBondContact OH-CG 3.42Å; Y196-L225 HydrophobicContact CD1-CD1 3.84Å; Y196-L225 HydrophobicContact CD1-CD2 3.37Å; Y196-L225 HydrophobicContact CD1-CG 3.77Å; Y196-L225 HydrophobicContact CE1-CD1 3.46Å; Y196-L225 VanDerWaalsContact CE1-CD1 3.46Å; Y196-L225 HydrophobicContact CE1-CD2 3.54Å; Y196-L225 HydrophobicContact CE1-CG 3.37Å; Y196-L225 HydrophobicContact CG-CD2 4.25Å
197L62.9Low60.9Low26 Ų2657.9 Ų57.914%0.13633%0.331CS..Hα-helixtrans-64.7-36.8179.5-66.1-166.8000112.6P193 A194 A195 Q199 L200 L225 F235P193-L197 PolarHBondContact O-N 3.12Å; A194-L197 PolarHBondContact O-N 2.78Å; A195-L197 PolarHBondContact O-N 3.24Å; L197-Q199 PolarHBondContact O-N 3.33Å; L197-L200 HydrophobicContact CD2-CD1 4.29Å; L197-L200 PolarHBondContact O-N 3.14Å; L197-L225 HydrophobicContact CD2-CD1 4Å; L197-F235 HydrophobicContact CD1-CB 3.8Å; L197-F235 HydrophobicContact CD1-CD2 4.18Å; L197-F235 HydrophobicContact CD1-CG 3.95Å; L197-F235 HydrophobicContact CD2-CB 4.25Å; L197-F235 HydrophobicContact CD2-CD1 3.56Å; L197-F235 HydrophobicContact CD2-CD2 4.31Å; L197-F235 HydrophobicContact CD2-CE1 3.83Å; L197-F235 HydrophobicContact CD2-CG 3.79Å; L197-F235 HydrophobicContact CD2-CZ 4.35Å; L197-F235 HydrophobicContact CG-CG 4.39Å
198Q64.9Low60.3Low126 Ų12656.9 Ų56.959%0.58933%0.332SS*.Hα-helixtrans-63.7-28.6174.4-64.7-7467.400111.9A194 A195 Y196A194-Q198 PolarHBondContact O-N 2.94Å; A195-Q198 PolarHBondContact O-N 2.83Å; Y196-Q198 VanDerWaalsContact C-N 3.32Å; Y196-Q198 PolarHBondContact O-N 3.46Å
199Q63.1Low59.5Low7 Ų761.5 Ų61.53%0.03336%0.364CS..Hα-helixtrans-78.8-19.9179-121.8175.8-5.800114L153 L185 A195 Y196 L197 L201 P202 F203L153-Q199 HydrophobicContact CD1-CG 4.29Å; L185-Q199 HydrophobicContact CD2-CB 4.35Å; L185-Q199 VanDerWaalsContact CD2-CD 3.41Å; L185-Q199 HydrophobicContact CD2-CG 4.23Å; A195-Q199 PolarHBondContact O-N 2.87Å; Y196-Q199 WeakPolarHBondContact O-CB 2.75Å; Y196-Q199 PolarHBondContact O-N 3.25Å; L197-Q199 PolarHBondContact O-N 3.33Å; Q199-L201 VanDerWaalsContact C-N 3.33Å; Q199-P202 WeakPolarHBondContact O-CD 3.34Å; Q199-P202 WeakPolarHBondContact O-CG 3Å; Q199-F203 WeakPolarHBondContact O-CD2 3.37Å; Q199-F203 VanDerWaalsContact O-CE2 3.27Å; Q199-F203 WeakPolarHBondContact O-CE2 2.96Å
200L63.4Low58.9Low9 Ų965.5 Ų65.55%0.04738%0.384CS..Hα-helixtrans-76.4-19.5177-70.5176.9000113.6Y196 L197 F203 L221 L222 L225 F235Y196-L200 HydrophobicContact CD1-CD1 4.09Å; Y196-L200 HydrophobicContact CD1-CG 4.42Å; Y196-L200 HydrophobicContact CE1-CD1 3.68Å; Y196-L200 HydrophobicContact CE1-CD2 4.35Å; Y196-L200 HydrophobicContact CE1-CG 4.08Å; Y196-L200 PolarHBondContact O-N 3.37Å; L197-L200 HydrophobicContact CD2-CD1 4.29Å; L197-L200 PolarHBondContact O-N 3.14Å; L200-F203 PolarHBondContact O-N 3.22Å; L200-L221 HydrophobicContact CD2-CB 4.03Å; L200-L221 HydrophobicContact CD2-CD1 4.38Å; L200-L221 HydrophobicContact CD2-CD2 4.41Å; L200-L222 HydrophobicContact CD1-CD2 4.29Å; L200-L225 HydrophobicContact CD1-CD1 4.16Å; L200-F235 HydrophobicContact CB-CE1 4.29Å; L200-F235 HydrophobicContact CB-CZ 3.88Å; L200-F235 HydrophobicContact CD1-CD1 4.5Å; L200-F235 HydrophobicContact CD1-CE1 3.49Å; L200-F235 VanDerWaalsContact CD1-CE1 3.49Å; L200-F235 HydrophobicContact CD1-CZ 3.95Å
201L61.6Low58.4Low101 Ų10162.4 Ų62.453%0.52937%0.368SS..THydrogen-bonded Turntrans-54.7-52.3179.1-95.4144.8000114.5Q199 F203 N204Q199-L201 VanDerWaalsContact C-N 3.33Å; L201-F203 VanDerWaalsContact C-N 3.26Å; L201-F203 PolarHBondContact O-N 3.2Å; L201-N204 PolarHBondContact O-N 2.99Å
202P56.1Low58Low72 Ų7262.6 Ų62.647%0.46837%0.37SS..G310 helixtrans-66-25.5179.420.7-30.9000113.6Q199 N204 Q205Q199-P202 WeakPolarHBondContact O-CD 3.34Å; Q199-P202 WeakPolarHBondContact O-CG 3Å; P202-N204 PolarHBondContact O-N 3.14Å; P202-Q205 PolarHBondContact O-N 3.23Å
203F57.8Low57.4Low24 Ų2461.1 Ų61.111%0.10537%0.365CS..G310 helixtrans-74.2-11.4177-62.6-72.5000113.6L178 I181 L185 Q199 L200 L201 Q205 L206 L221L178-F203 HydrophobicContact CD1-CD1 3.94Å; L178-F203 HydrophobicContact CD1-CE1 3.91Å; L178-F203 HydrophobicContact CD2-CD1 3.83Å; L178-F203 HydrophobicContact CD2-CE1 3.5Å; L178-F203 HydrophobicContact CD2-CZ 4.06Å; L178-F203 HydrophobicContact CG-CD1 4.13Å; L178-F203 HydrophobicContact CG-CE1 3.67Å; I181-F203 HydrophobicContact CG2-CZ 4.33Å; L185-F203 HydrophobicContact CD1-CE2 4.22Å; L185-F203 HydrophobicContact CD1-CZ 4.4Å; Q199-F203 WeakPolarHBondContact O-CD2 3.37Å; Q199-F203 VanDerWaalsContact O-CE2 3.27Å; Q199-F203 WeakPolarHBondContact O-CE2 2.96Å; L200-F203 PolarHBondContact O-N 3.22Å; L201-F203 VanDerWaalsContact C-N 3.26Å; L201-F203 PolarHBondContact O-N 3.2Å; F203-Q205 PolarHBondContact O-N 3.2Å; F203-L206 HydrophobicContact CB-CD1 4.48Å; F203-L206 HydrophobicContact CD1-CD1 4.36Å; F203-L206 VanDerWaalsContact O-CG 3.31Å; F203-L206 WeakPolarHBondContact O-CG 3.33Å; F203-L221 HydrophobicContact CB-CD1 4.24Å; F203-L221 HydrophobicContact CG-CD1 4.21Å
204N52.5Low57.2Low45 Ų4560.3 Ų60.324%0.24136%0.357CS..G310 helixtrans-74.5-10.2172-88.4-18.4000113.5L201 P202 Y214 Q239L201-N204 PolarHBondContact O-N 2.99Å; P202-N204 PolarHBondContact O-N 3.14Å; N204-Y214 PolarHBondContact OD1-OH 2.9Å; N204-Q239 PolarHBondContact ND2-OE1 3.31Å; N204-Q239 PolarHBondContact OD1-OE1 3.35Å; N204-Q239 VanDerWaalsContact OD1-OE1 3.06Å
205Q49.1Very low57Low166 Ų16661.3 Ų61.378%0.77635%0.353SS*.G310 helixtrans-943.4-177.8-63.9-77.680.100113.2P202 F203 T207P202-Q205 PolarHBondContact O-N 3.23Å; F203-Q205 PolarHBondContact O-N 3.2Å; Q205-T207 PolarHBondContact O-N 3.34Å; Q205-T207 VanDerWaalsContact O-N 3.14Å
206L53Low57Low29 Ų2966.3 Ų66.315%0.15237%0.374CS..SBendtrans-65.2118.7-177.8-61.2177.7000109.8Q174 L178 F203 V208 Y214Q174-L206 HydrophobicContact CG-CD2 3.93Å; Q174-L206 VanDerWaalsContact OE1-CD1 3.23Å; L178-L206 HydrophobicContact CD1-CD1 4.19Å; F203-L206 HydrophobicContact CB-CD1 4.48Å; F203-L206 HydrophobicContact CD1-CD1 4.36Å; F203-L206 VanDerWaalsContact O-CG 3.31Å; F203-L206 WeakPolarHBondContact O-CG 3.33Å; L206-V208 PolarHBondContact O-N 3.06Å; L206-Y214 HydrophobicContact CB-CD2 4.3Å; L206-Y214 HydrophobicContact CB-CE2 4.35Å
207T47.1Very low56.9Low116 Ų11667 Ų6771%0.71238%0.377SS*.  trans-50.1123.1-177.2-53.10000110.7Q205 S209Q205-T207 PolarHBondContact O-N 3.34Å; Q205-T207 VanDerWaalsContact O-N 3.14Å; T207-S209 WeakPolarHBondContact CG2-OG 3.35Å; T207-S209 PolarHBondContact O-N 2.83Å
208V50.4Low57Low85 Ų8567.4 Ų67.452%0.51538%0.377SS..  trans-72.232.4-171.7-158.90000112.8L206 N210L206-V208 PolarHBondContact O-N 3.06Å; V208-N210 PolarHBondContact O-N 3.44Å
209S46.4Very low57.1Low102 Ų10267.3 Ų67.371%0.71338%0.376SS*.SBendtrans-71.1-14.8-178.9-59.90000112.7T207T207-S209 WeakPolarHBondContact CG2-OG 3.35Å; T207-S209 PolarHBondContact O-N 2.83Å
210N52.8Low57.3Low96 Ų9671.1 Ų71.151%0.51339%0.394SS..  trans-141.589.2174.9-168.2-28.8000111.1V208 A212 A213 Y214V208-N210 PolarHBondContact O-N 3.44Å; N210-A212 PolarHBondContact O-N 3.08Å; N210-A212 PolarHBondContact OD1-N 3.48Å; N210-A213 HydrophobicContact CB-CB 4.01Å; N210-A213 PolarHBondContact O-N 3.35Å; N210-A213 PolarHBondContact OD1-N 3.13Å; N210-A213 VanDerWaalsContact OD1-N 3.14Å; N210-Y214 PolarHBondContact O-N 3.44Å
211S52.3Low57.3Low54 Ų5471 Ų7138%0.37839%0.393SS..Hα-helixtrans-56.6-32-177.6-510000113.6L215S211-L215 WeakPolarHBondContact O-CG 3.47Å; S211-L215 PolarHBondContact O-N 2.99Å
212A55.9Low57.4Low71 Ų7167.7 Ų67.759%0.58738%0.376SS*.Hα-helixtrans-74.2-44179.300000111.9N210 L215 Q216N210-A212 PolarHBondContact O-N 3.08Å; N210-A212 PolarHBondContact OD1-N 3.48Å; A212-L215 PolarHBondContact O-N 3.09Å; A212-Q216 PolarHBondContact O-N 3.43Å; A212-Q216 VanDerWaalsContact O-N 3.11Å
213A55.4Low57.8Low27 Ų2770.1 Ų70.122%0.22339%0.385CS..Hα-helixtrans-64.8-42.1176.300000111.4N210 L215 Q216 Q217N210-A213 HydrophobicContact CB-CB 4.01Å; N210-A213 PolarHBondContact O-N 3.35Å; N210-A213 PolarHBondContact OD1-N 3.13Å; N210-A213 VanDerWaalsContact OD1-N 3.14Å; A213-L215 PolarHBondContact O-N 3.42Å; A213-Q216 PolarHBondContact O-N 3.15Å; A213-Q217 WeakPolarHBondContact O-CB 3.16Å; A213-Q217 PolarHBondContact O-N 3.38Å
214Y58.7Low57.9Low31 Ų3170.3 Ų70.312%0.12239%0.388CS..Hα-helixtrans-59.9-43.6177.1178.7-102.7000112.5N204 L206 N210 Q217 R218N204-Y214 PolarHBondContact OD1-OH 2.9Å; L206-Y214 HydrophobicContact CB-CD2 4.3Å; L206-Y214 HydrophobicContact CB-CE2 4.35Å; N210-Y214 PolarHBondContact O-N 3.44Å; Y214-Q217 PolarHBondContact O-N 3.3Å; Y214-R218 HydrophobicContact CE1-CG 4.05Å; Y214-R218 HydrophobicContact CE2-CG 4.38Å; Y214-R218 WeakPolarHBondContact O-CB 3.44Å; Y214-R218 PolarHBondContact O-N 3.48Å
215L62.8Low58.1Low81 Ų8168.7 Ų68.742%0.42438%0.38SS..Hα-helixtrans-69.7-40.1179.2-73.2-176.7000113.3S211 A212 A213 Q217 R218 Q219S211-L215 WeakPolarHBondContact O-CG 3.47Å; S211-L215 PolarHBondContact O-N 2.99Å; A212-L215 PolarHBondContact O-N 3.09Å; A213-L215 PolarHBondContact O-N 3.42Å; L215-Q217 VanDerWaalsContact C-N 3.34Å; L215-R218 PolarHBondContact O-N 3.07Å; L215-Q219 PolarHBondContact O-N 2.94Å
216Q65.3Low58.5Low123 Ų12365 Ų6558%0.57538%0.378SS*.Hα-helixtrans-60.5-45.8172.5-92.5-105-64.400111.2A212 A213 Q219 Q220A212-Q216 PolarHBondContact O-N 3.43Å; A212-Q216 VanDerWaalsContact O-N 3.11Å; A213-Q216 PolarHBondContact O-N 3.15Å; Q216-Q219 WeakPolarHBondContact O-CB 3.28Å; Q216-Q219 PolarHBondContact O-N 3.46Å; Q216-Q219 VanDerWaalsContact O-N 3.15Å; Q216-Q220 PolarHBondContact O-N 3.19Å
217Q63.6Low58.5Low17 Ų1768.4 Ų68.48%0.07940%0.4CS..Hα-helixtrans-66-41.5179.8-169.9-152.2-37.300111.8L178 A213 Y214 L215 Q219 Q220 L221L178-Q217 HydrophobicContact CD1-CG 4.28Å; A213-Q217 WeakPolarHBondContact O-CB 3.16Å; A213-Q217 PolarHBondContact O-N 3.38Å; Y214-Q217 PolarHBondContact O-N 3.3Å; L215-Q217 VanDerWaalsContact C-N 3.34Å; Q217-Q219 VanDerWaalsContact C-N 3.31Å; Q217-Q219 PolarHBondContact O-N 3.43Å; Q217-Q220 PolarHBondContact O-N 3.47Å; Q217-L221 WeakPolarHBondContact O-CB 2.94Å; Q217-L221 WeakPolarHBondContact O-CG 2.96Å; Q217-L221 PolarHBondContact O-N 3.26Å
218R65.4Low58.8Low34 Ų3469 Ų6913%0.12841%0.405CS..Hα-helixtrans-56.9-44.4169.6-96.9-93.3-66.5-130-2.6111.2Y214 L215 L221 L222 Q239Y214-R218 HydrophobicContact CE1-CG 4.05Å; Y214-R218 HydrophobicContact CE2-CG 4.38Å; Y214-R218 WeakPolarHBondContact O-CB 3.44Å; Y214-R218 PolarHBondContact O-N 3.48Å; L215-R218 PolarHBondContact O-N 3.07Å; R218-L221 PolarHBondContact O-N 2.81Å; R218-L222 HydrophobicContact CB-CD1 4.5Å; R218-L222 VanDerWaalsContact O-CB 3.31Å; R218-L222 WeakPolarHBondContact O-CB 3.23Å; R218-L222 VanDerWaalsContact O-CD1 3.29Å; R218-L222 WeakPolarHBondContact O-CD1 3.45Å; R218-L222 WeakPolarHBondContact O-CG 3.5Å; R218-L222 PolarHBondContact O-N 3.24Å; R218-Q239 VanDerWaalsContact NH1-CD 3.27Å; R218-Q239 PolarHBondContact NH1-O 3.1Å; R218-Q239 PolarHBondContact NH2-O 3.23Å
219Q67Low59.2Low124 Ų12466.7 Ų66.758%0.57939%0.39SS*.Hα-helixtrans-62.8-43.3177.1-89.2166.265.200112.3L215 Q216 Q217 L221 L222 N223L215-Q219 PolarHBondContact O-N 2.94Å; Q216-Q219 WeakPolarHBondContact O-CB 3.28Å; Q216-Q219 PolarHBondContact O-N 3.46Å; Q216-Q219 VanDerWaalsContact O-N 3.15Å; Q217-Q219 VanDerWaalsContact C-N 3.31Å; Q217-Q219 PolarHBondContact O-N 3.43Å; Q219-L221 VanDerWaalsContact C-N 3.34Å; Q219-L221 PolarHBondContact O-N 2.93Å; Q219-L222 PolarHBondContact O-N 3.31Å; Q219-L222 VanDerWaalsContact O-N 3.14Å; Q219-N223 WeakPolarHBondContact O-CB 3.44Å; Q219-N223 PolarHBondContact O-N 3.07Å
220Q66.2Low59.7Low87 Ų8766.6 Ų66.641%0.40739%0.387SS..Hα-helixtrans-63.3-39.4176.9-72-178.1-27.700112.4Q216 Q217 L222 P224Q216-Q220 PolarHBondContact O-N 3.19Å; Q217-Q220 PolarHBondContact O-N 3.47Å; Q220-L222 VanDerWaalsContact C-N 3.31Å; Q220-P224 WeakPolarHBondContact O-CD 3.31Å
221L63.8Low60Low7 Ų767.3 Ų67.34%0.03739%0.39CS..Hα-helixtrans-71.4-22.4174.3-73.5171.3000113.4L178 V182 L185 Y196 L200 F203 Q217 R218 Q219L178-L221 HydrophobicContact CD2-CD1 3.78Å; L178-L221 HydrophobicContact CD2-CD2 3.64Å; L178-L221 HydrophobicContact CD2-CG 4.01Å; V182-L221 HydrophobicContact CG2-CD2 3.96Å; L185-L221 HydrophobicContact CD1-CD2 3.68Å; Y196-L221 PolarHBondContact OH-O 2.81Å; L200-L221 HydrophobicContact CD2-CB 4.03Å; L200-L221 HydrophobicContact CD2-CD1 4.38Å; L200-L221 HydrophobicContact CD2-CD2 4.41Å; F203-L221 HydrophobicContact CB-CD1 4.24Å; F203-L221 HydrophobicContact CG-CD1 4.21Å; Q217-L221 WeakPolarHBondContact O-CB 2.94Å; Q217-L221 WeakPolarHBondContact O-CG 2.96Å; Q217-L221 PolarHBondContact O-N 3.26Å; R218-L221 PolarHBondContact O-N 2.81Å; Q219-L221 VanDerWaalsContact C-N 3.34Å; Q219-L221 PolarHBondContact O-N 2.93Å
222L64.1Low60.3Low30 Ų3065 Ų6516%0.15737%0.374CS..Hα-helixtrans-95.2-19.5179.2-68.1165.2000112.2L200 R218 Q219 Q220 L225 L236L200-L222 HydrophobicContact CD1-CD2 4.29Å; R218-L222 HydrophobicContact CB-CD1 4.5Å; R218-L222 VanDerWaalsContact O-CB 3.31Å; R218-L222 WeakPolarHBondContact O-CB 3.23Å; R218-L222 VanDerWaalsContact O-CD1 3.29Å; R218-L222 WeakPolarHBondContact O-CD1 3.45Å; R218-L222 WeakPolarHBondContact O-CG 3.5Å; R218-L222 PolarHBondContact O-N 3.24Å; Q219-L222 PolarHBondContact O-N 3.31Å; Q219-L222 VanDerWaalsContact O-N 3.14Å; Q220-L222 VanDerWaalsContact C-N 3.31Å; L222-L225 HydrophobicContact CD2-CD1 4.09Å; L222-L225 WeakPolarHBondContact O-CB 3.3Å; L222-L225 PolarHBondContact O-N 3.45Å; L222-L236 HydrophobicContact CD1-CD2 3.91Å; L222-L236 HydrophobicContact CD2-CD2 3.61Å; L222-L236 HydrophobicContact CG-CD2 4.22Å
223N64.7Low60.5Low124 Ų12466 Ų6666%0.66337%0.373SS*.G310 helixtrans-55.2-42.9-179.2-160.958.2000115Q219 L225 A226Q219-N223 WeakPolarHBondContact O-CB 3.44Å; Q219-N223 PolarHBondContact O-N 3.07Å; N223-L225 PolarHBondContact O-N 3.44Å; N223-A226 WeakPolarHBondContact O-CB 3.49Å; N223-A226 PolarHBondContact O-N 3.43Å
224P58.7Low60.8Low27 Ų2767.7 Ų67.718%0.17539%0.387CS..G310 helixtrans-70.8-11.5178.728.3-35.1000113.6T186 Y196 Q220 A226T186-P224 HydrophobicContact CG2-CB 3.61Å; Y196-P224 VanDerWaalsContact OH-CG 3.3Å; Y196-P224 WeakPolarHBondContact OH-CG 3.42Å; Q220-P224 WeakPolarHBondContact O-CD 3.31Å; P224-A226 VanDerWaalsContact C-N 3.28Å; P224-A226 PolarHBondContact O-N 3.3Å
225L57.7Low61Low12 Ų1267.9 Ų67.96%0.06339%0.388CS..G310 helixtrans-84.88.4175-67.5176.7000113.6A189 Y196 L197 L200 L222 N223 V227 V232A189-L225 HydrophobicContact CB-CD2 4.36Å; Y196-L225 HydrophobicContact CD1-CD1 3.84Å; Y196-L225 HydrophobicContact CD1-CD2 3.37Å; Y196-L225 HydrophobicContact CD1-CG 3.77Å; Y196-L225 HydrophobicContact CE1-CD1 3.46Å; Y196-L225 VanDerWaalsContact CE1-CD1 3.46Å; Y196-L225 HydrophobicContact CE1-CD2 3.54Å; Y196-L225 HydrophobicContact CE1-CG 3.37Å; Y196-L225 HydrophobicContact CG-CD2 4.25Å; L197-L225 HydrophobicContact CD2-CD1 4Å; L200-L225 HydrophobicContact CD1-CD1 4.16Å; L222-L225 HydrophobicContact CD2-CD1 4.09Å; L222-L225 WeakPolarHBondContact O-CB 3.3Å; L222-L225 PolarHBondContact O-N 3.45Å; N223-L225 PolarHBondContact O-N 3.44Å; L225-V227 PolarHBondContact O-N 3.18Å; L225-V232 HydrophobicContact CB-CG1 3.7Å; L225-V232 HydrophobicContact CB-CG2 4.25Å; L225-V232 HydrophobicContact CD1-CG1 4.15Å; L225-V232 HydrophobicContact CD1-CG2 4.34Å; L225-V232 HydrophobicContact CD2-CG2 3.67Å; L225-V232 HydrophobicContact CG-CG1 4.39Å; L225-V232 HydrophobicContact CG-CG2 4.32Å
226A56.7Low61.1Low88 Ų8866.6 Ų66.673%0.72738%0.382SS*.  trans-64.81.3178.300000114.8N223 P224N223-A226 WeakPolarHBondContact O-CB 3.49Å; N223-A226 PolarHBondContact O-N 3.43Å; P224-A226 VanDerWaalsContact C-N 3.28Å; P224-A226 PolarHBondContact O-N 3.3Å
227V54.4Low61Low101 Ų10167 Ų6761%0.61238%0.384SS*.SBendtrans-73.5133.5169.9-173.30000108.7L225 N229L225-V227 PolarHBondContact O-N 3.18Å; V227-N229 VanDerWaalsContact C-N 3.27Å; V227-N229 PolarHBondContact O-N 2.73Å
228P51.9Low61.1Low127 Ų12772 Ų7283%0.82541%0.407SS*.  trans-69.280.9-176.528.6-34.9000111.4
229N59.6Low60.9Low37 Ų3770.6 Ų70.620%0.19840%0.402CS..  trans-106.2118.9172.2-176.8-7.2000108.8V227 L231 V232 T233V227-N229 VanDerWaalsContact C-N 3.27Å; V227-N229 PolarHBondContact O-N 2.73Å; N229-L231 PolarHBondContact O-N 3.2Å; N229-L231 VanDerWaalsContact O-N 3.13Å; N229-L231 WeakPolarHBondContact OD1-CB 3.32Å; N229-L231 PolarHBondContact OD1-N 3.14Å; N229-L231 VanDerWaalsContact OD1-N 3.14Å; N229-V232 HydrophobicContact CB-CB 4.1Å; N229-V232 HydrophobicContact CB-CG2 3.78Å; N229-V232 WeakPolarHBondContact O-CA 3.47Å; N229-V232 VanDerWaalsContact O-CB 3.29Å; N229-V232 WeakPolarHBondContact O-CB 3.04Å; N229-V232 PolarHBondContact O-N 2.95Å; N229-T233 PolarHBondContact O-N 3.06Å; N229-T233 VanDerWaalsContact O-N 3.13Å; N229-T233 PolarHBondContact O-OG1 3.3Å
230P56.9Low60.5Low101 Ų10170.3 Ų70.366%0.65640%0.4SS*.Hα-helixtrans-59-28.1-178.922.8-33.6000113.3T233 A234P230-T233 PolarHBondContact O-N 3.41Å; P230-A234 PolarHBondContact O-N 2.81Å
231L59.2Low59.8Low111 Ų11171.3 Ų71.358%0.58141%0.408SS*.Hα-helixtrans-67.8-35.6174-68.6165.8000112.2N229 F235N229-L231 PolarHBondContact O-N 3.2Å; N229-L231 VanDerWaalsContact O-N 3.13Å; N229-L231 WeakPolarHBondContact OD1-CB 3.32Å; N229-L231 PolarHBondContact OD1-N 3.14Å; N229-L231 VanDerWaalsContact OD1-N 3.14Å; L231-F235 VanDerWaalsContact O-CB 3.3Å; L231-F235 WeakPolarHBondContact O-CB 3.29Å; L231-F235 PolarHBondContact O-N 2.83Å
232V58.4Low59.3Low6 Ų674.8 Ų74.84%0.03643%0.426CS..Hα-helixtrans-67.6-41.1174.3166.70000110.2L225 N229 F235 L236L225-V232 HydrophobicContact CB-CG1 3.7Å; L225-V232 HydrophobicContact CB-CG2 4.25Å; L225-V232 HydrophobicContact CD1-CG1 4.15Å; L225-V232 HydrophobicContact CD1-CG2 4.34Å; L225-V232 HydrophobicContact CD2-CG2 3.67Å; L225-V232 HydrophobicContact CG-CG1 4.39Å; L225-V232 HydrophobicContact CG-CG2 4.32Å; N229-V232 HydrophobicContact CB-CB 4.1Å; N229-V232 HydrophobicContact CB-CG2 3.78Å; N229-V232 WeakPolarHBondContact O-CA 3.47Å; N229-V232 VanDerWaalsContact O-CB 3.29Å; N229-V232 WeakPolarHBondContact O-CB 3.04Å; N229-V232 PolarHBondContact O-N 2.95Å; V232-F235 PolarHBondContact O-N 3.44Å; V232-L236 HydrophobicContact CG1-CD1 3.91Å; V232-L236 HydrophobicContact CG1-CG 4.29Å; V232-L236 VanDerWaalsContact O-CB 3.32Å; V232-L236 WeakPolarHBondContact O-CB 3.3Å; V232-L236 WeakPolarHBondContact O-CG 3.28Å; V232-L236 PolarHBondContact O-N 3.47Å
233T59.9Low58.6Low91 Ų9174.6 Ų74.656%0.55843%0.427SS*.Hα-helixtrans-62.5-44.5176.8-49.60000111.3N229 P230 L236 Q237N229-T233 PolarHBondContact O-N 3.06Å; N229-T233 VanDerWaalsContact O-N 3.13Å; N229-T233 PolarHBondContact O-OG1 3.3Å; P230-T233 PolarHBondContact O-N 3.41Å; T233-L236 PolarHBondContact O-N 3.34Å; T233-Q237 WeakPolarHBondContact O-CB 3.48Å; T233-Q237 PolarHBondContact O-N 2.89Å
234A61Low57.7Low63 Ų6376.5 Ų76.552%0.52143%0.426SS..Hα-helixtrans-63.2-42.6175.600000112P230 Q237 Q238P230-A234 PolarHBondContact O-N 2.81Å; A234-Q237 PolarHBondContact O-N 3.33Å; A234-Q238 PolarHBondContact O-N 3.17Å
235F63.9Low56.8Low35 Ų3579 Ų7915%0.15444%0.443CS..Hα-helixtrans-65.9-43176.9-179.9-100.3000112.5L197 L200 L231 V232 Q237 Q238 Q239L197-F235 HydrophobicContact CD1-CB 3.8Å; L197-F235 HydrophobicContact CD1-CD2 4.18Å; L197-F235 HydrophobicContact CD1-CG 3.95Å; L197-F235 HydrophobicContact CD2-CB 4.25Å; L197-F235 HydrophobicContact CD2-CD1 3.56Å; L197-F235 HydrophobicContact CD2-CD2 4.31Å; L197-F235 HydrophobicContact CD2-CE1 3.83Å; L197-F235 HydrophobicContact CD2-CG 3.79Å; L197-F235 HydrophobicContact CD2-CZ 4.35Å; L197-F235 HydrophobicContact CG-CG 4.39Å; L200-F235 HydrophobicContact CB-CE1 4.29Å; L200-F235 HydrophobicContact CB-CZ 3.88Å; L200-F235 HydrophobicContact CD1-CD1 4.5Å; L200-F235 HydrophobicContact CD1-CE1 3.49Å; L200-F235 VanDerWaalsContact CD1-CE1 3.49Å; L200-F235 HydrophobicContact CD1-CZ 3.95Å; L231-F235 VanDerWaalsContact O-CB 3.3Å; L231-F235 WeakPolarHBondContact O-CB 3.29Å; L231-F235 PolarHBondContact O-N 2.83Å; V232-F235 PolarHBondContact O-N 3.44Å; F235-Q237 VanDerWaalsContact C-N 3.32Å; F235-Q237 PolarHBondContact O-N 3.3Å; F235-Q238 PolarHBondContact O-N 3.11Å; F235-Q239 HydrophobicContact CD1-CG 4.01Å; F235-Q239 HydrophobicContact CD2-CG 4.3Å; F235-Q239 HydrophobicContact CE1-CG 3.69Å; F235-Q239 HydrophobicContact CE2-CG 3.97Å; F235-Q239 HydrophobicContact CG-CG 4.32Å; F235-Q239 VanDerWaalsContact CZ-CD 3.45Å; F235-Q239 HydrophobicContact CZ-CG 3.66Å; F235-Q239 WeakPolarHBondContact O-CB 3.17Å; F235-Q239 VanDerWaalsContact O-CG 3.25Å; F235-Q239 WeakPolarHBondContact O-CG 3.36Å; F235-Q239 PolarHBondContact O-N 2.7Å
236L63.8Low56.1Low54 Ų5484.6 Ų84.628%0.28347%0.47SS..Hα-helixtrans-61.4-40.5174.2-81.8174.1000111.6L222 V232 T233 Q239 Q240L222-L236 HydrophobicContact CD1-CD2 3.91Å; L222-L236 HydrophobicContact CD2-CD2 3.61Å; L222-L236 HydrophobicContact CG-CD2 4.22Å; V232-L236 HydrophobicContact CG1-CD1 3.91Å; V232-L236 HydrophobicContact CG1-CG 4.29Å; V232-L236 VanDerWaalsContact O-CB 3.32Å; V232-L236 WeakPolarHBondContact O-CB 3.3Å; V232-L236 WeakPolarHBondContact O-CG 3.28Å; V232-L236 PolarHBondContact O-N 3.47Å; T233-L236 PolarHBondContact O-N 3.34Å; L236-Q239 PolarHBondContact O-N 3.42Å; L236-Q240 WeakPolarHBondContact O-CB 3.29Å; L236-Q240 WeakPolarHBondContact O-CG 3.23Å; L236-Q240 PolarHBondContact O-N 2.99Å
237Q64.7Low55.4Low132 Ų13283.9 Ų83.962%0.61745%0.45SS*.Hα-helixtrans-66.3-42.5177.6-149-14359.500111.2T233 A234 F235 Q240 L241T233-Q237 WeakPolarHBondContact O-CB 3.48Å; T233-Q237 PolarHBondContact O-N 2.89Å; A234-Q237 PolarHBondContact O-N 3.33Å; F235-Q237 VanDerWaalsContact C-N 3.32Å; F235-Q237 PolarHBondContact O-N 3.3Å; Q237-Q240 PolarHBondContact O-N 3.49Å; Q237-L241 PolarHBondContact O-N 3.47Å
238Q64.4Low54.7Low120 Ų12082 Ų8256%0.56144%0.441SS*.Hα-helixtrans-66.4-40.2175.5-148.4-138.585.300111.8A234 F235 Q240 L241 L242A234-Q238 PolarHBondContact O-N 3.17Å; F235-Q238 PolarHBondContact O-N 3.11Å; Q238-Q240 VanDerWaalsContact C-N 3.32Å; Q238-Q240 PolarHBondContact O-N 2.76Å; Q238-L241 WeakPolarHBondContact O-CB 3.39Å; Q238-L241 PolarHBondContact O-N 2.84Å; Q238-L241 VanDerWaalsContact O-N 3.15Å; Q238-L242 WeakPolarHBondContact O-CD1 3.34Å; Q238-L242 PolarHBondContact O-N 3.3Å
239Q61.6Low54.4Low5 Ų582.9 Ų82.92%0.02344%0.438CS..Hα-helixtrans-74-17.4178.1-78.4-125.391.500114.5N204 R218 F235 L236 P243N204-Q239 PolarHBondContact ND2-OE1 3.31Å; N204-Q239 PolarHBondContact OD1-OE1 3.35Å; N204-Q239 VanDerWaalsContact OD1-OE1 3.06Å; R218-Q239 VanDerWaalsContact NH1-CD 3.27Å; R218-Q239 PolarHBondContact NH1-O 3.1Å; R218-Q239 PolarHBondContact NH2-O 3.23Å; F235-Q239 HydrophobicContact CD1-CG 4.01Å; F235-Q239 HydrophobicContact CD2-CG 4.3Å; F235-Q239 HydrophobicContact CE1-CG 3.69Å; F235-Q239 HydrophobicContact CE2-CG 3.97Å; F235-Q239 HydrophobicContact CG-CG 4.32Å; F235-Q239 VanDerWaalsContact CZ-CD 3.45Å; F235-Q239 HydrophobicContact CZ-CG 3.66Å; F235-Q239 WeakPolarHBondContact O-CB 3.17Å; F235-Q239 VanDerWaalsContact O-CG 3.25Å; F235-Q239 WeakPolarHBondContact O-CG 3.36Å; F235-Q239 PolarHBondContact O-N 2.7Å; L236-Q239 PolarHBondContact O-N 3.42Å; Q239-P243 WeakPolarHBondContact O-CD 3.35Å
240Q58.7Low53.7Low118 Ų11888.9 Ų88.955%0.55147%0.467SS*.Hα-helixtrans-74.3-33167.8-81.5179.316.200110.5L236 Q237 Q238 P243 Y244L236-Q240 WeakPolarHBondContact O-CB 3.29Å; L236-Q240 WeakPolarHBondContact O-CG 3.23Å; L236-Q240 PolarHBondContact O-N 2.99Å; Q237-Q240 PolarHBondContact O-N 3.49Å; Q238-Q240 VanDerWaalsContact C-N 3.32Å; Q238-Q240 PolarHBondContact O-N 2.76Å; Q240-P243 WeakPolarHBondContact O-CD 3.21Å; Q240-P243 WeakPolarHBondContact O-CG 3.36Å; Q240-Y244 WeakPolarHBondContact O-CD2 3.28Å; Q240-Y244 VanDerWaalsContact O-CE2 3.28Å; Q240-Y244 WeakPolarHBondContact O-CE2 3.49Å
241L51Low52.8Low108 Ų10887.3 Ų87.357%0.56545%0.453SS*.Hα-helixtrans-71.4-37.2179-71.4158.7000113.2Q237 Q238 Y244 S245Q237-L241 PolarHBondContact O-N 3.47Å; Q238-L241 WeakPolarHBondContact O-CB 3.39Å; Q238-L241 PolarHBondContact O-N 2.84Å; Q238-L241 VanDerWaalsContact O-N 3.15Å; L241-Y244 PolarHBondContact O-N 2.88Å; L241-S245 PolarHBondContact O-OG 3.04Å
242L54.4Low52Low80 Ų8086.9 Ų86.942%0.41946%0.457SS..Hα-helixtrans-60.4-45.5-176.8-93.181.6000116.4Q238 Y244 S245Q238-L242 WeakPolarHBondContact O-CD1 3.34Å; Q238-L242 PolarHBondContact O-N 3.3Å; L242-Y244 VanDerWaalsContact C-N 3.33Å; L242-Y244 PolarHBondContact O-N 3.34Å; L242-S245 PolarHBondContact O-N 2.9Å
243P50.1Low51.5Low26 Ų2689.9 Ų89.917%0.16948%0.483CS..Hα-helixtrans-65.8-36.2-179.321.2-30.3000111.8Q239 Q240 S245 Q246 F247Q239-P243 WeakPolarHBondContact O-CD 3.35Å; Q240-P243 WeakPolarHBondContact O-CD 3.21Å; Q240-P243 WeakPolarHBondContact O-CG 3.36Å; P243-S245 VanDerWaalsContact C-N 3.27Å; P243-S245 PolarHBondContact O-N 3.44Å; P243-Q246 PolarHBondContact O-N 3.4Å; P243-F247 HydrophobicContact CB-CD2 4.02Å; P243-F247 HydrophobicContact CB-CE2 3.99Å; P243-F247 WeakPolarHBondContact O-CB 3.38Å; P243-F247 WeakPolarHBondContact O-CD2 3.23Å; P243-F247 PolarHBondContact O-N 2.89Å
244Y43.9Very low50.9Low165 Ų16589.6 Ų89.665%0.64748%0.478SS*.Hα-helixtrans-65.3-30.4-178.9-68.6-71.6000113.1Q240 L241 L242 S248Q240-Y244 WeakPolarHBondContact O-CD2 3.28Å; Q240-Y244 VanDerWaalsContact O-CE2 3.28Å; Q240-Y244 WeakPolarHBondContact O-CE2 3.49Å; L241-Y244 PolarHBondContact O-N 2.88Å; L242-Y244 VanDerWaalsContact C-N 3.33Å; L242-Y244 PolarHBondContact O-N 3.34Å; Y244-S248 VanDerWaalsContact O-CB 3.23Å; Y244-S248 WeakPolarHBondContact O-CB 3.32Å; Y244-S248 PolarHBondContact O-N 2.85Å; Y244-S248 PolarHBondContact O-OG 2.97Å
245S41.5Very low50.3Low78 Ų7888.8 Ų88.855%0.54547%0.468SS..Hα-helixtrans-69.1-34.8177.3-500000112.8L241 L242 P243L241-S245 PolarHBondContact O-OG 3.04Å; L242-S245 PolarHBondContact O-N 2.9Å; P243-S245 VanDerWaalsContact C-N 3.27Å; P243-S245 PolarHBondContact O-N 3.44Å
246Q42.3Very low49.3Very low131 Ų13197.8 Ų97.861%0.61250%0.501SS*.Hα-helixtrans-80.9-39.4176.2-74.5-88.7-3.400111.7P243 S248 L249P243-Q246 PolarHBondContact O-N 3.4Å; Q246-S248 VanDerWaalsContact C-N 3.31Å; Q246-S248 PolarHBondContact O-N 3.33Å; Q246-L249 PolarHBondContact O-N 3.5Å
247F42.7Very low48.3Very low72 Ų72102.7 Ų102.732%0.31652%0.522SS..Hα-helixtrans-65.1-33176.1-80.1-66.7000112.8P243 L249 N251P243-F247 HydrophobicContact CB-CD2 4.02Å; P243-F247 HydrophobicContact CB-CE2 3.99Å; P243-F247 WeakPolarHBondContact O-CB 3.38Å; P243-F247 WeakPolarHBondContact O-CD2 3.23Å; P243-F247 PolarHBondContact O-N 2.89Å; F247-L249 VanDerWaalsContact C-N 3.33Å; F247-L249 PolarHBondContact O-N 2.95Å; F247-N251 PolarHBondContact O-N 3.04Å
248S40.1Very low47.2Very low62 Ų62103.8 Ų103.843%0.43453%0.528SS..Hα-helixtrans-73.2-21.3179.4-61.40000113.8Y244 Q246Y244-S248 VanDerWaalsContact O-CB 3.23Å; Y244-S248 WeakPolarHBondContact O-CB 3.32Å; Y244-S248 PolarHBondContact O-N 2.85Å; Y244-S248 PolarHBondContact O-OG 2.97Å; Q246-S248 VanDerWaalsContact C-N 3.31Å; Q246-S248 PolarHBondContact O-N 3.33Å
249L44.1Very low46.1Very low145 Ų145103.2 Ų103.276%0.75953%0.534SS*.Hα-helixtrans-81.8-26.6178.8-79.1165.2000113.3Q246 F247Q246-L249 PolarHBondContact O-N 3.5Å; F247-L249 VanDerWaalsContact C-N 3.33Å; F247-L249 PolarHBondContact O-N 2.95Å
250M44.4Very low45.2Very low163 Ų163110.8 Ų110.880%0.80357%0.573SS**Hα-helixtrans-104.9-8.3-176.5-80.5147.686.900114.2
251N38.6Very low44.3Very low68 Ų68111.4 Ų111.436%0.36459%0.585SS.*  trans-143.993.4175.9-162.2-23.5000112.1F247 A253 L254F247-N251 PolarHBondContact O-N 3.04Å; N251-A253 PolarHBondContact O-N 2.92Å; N251-A253 VanDerWaalsContact OD1-CB 3.23Å; N251-A253 WeakPolarHBondContact OD1-CB 3.45Å; N251-A253 PolarHBondContact OD1-N 3.42Å; N251-L254 HydrophobicContact CB-CD1 4.11Å; N251-L254 HydrophobicContact CB-CG 4.26Å; N251-L254 PolarHBondContact O-N 2.79Å; N251-L254 VanDerWaalsContact O-N 3.11Å
252P42.8Very low43.6Very low102 Ų102109.2 Ų109.266%0.66259%0.589SS**THydrogen-bonded Turntrans-66.5-3.4176.827.6-33.9000113.5S255P252-S255 PolarHBondContact O-OG 3.35Å
253A48.4Very low42.5Very low70 Ų70108.5 Ų108.558%0.57960%0.6SS**THydrogen-bonded Turntrans-87-17.1173.300000113.3N251N251-A253 PolarHBondContact O-N 2.92Å; N251-A253 VanDerWaalsContact OD1-CB 3.23Å; N251-A253 WeakPolarHBondContact OD1-CB 3.45Å; N251-A253 PolarHBondContact OD1-N 3.42Å
254L47.6Very low41.6Very low85 Ų85112.3 Ų112.345%0.44563%0.634SS.*THydrogen-bonded Turntrans-91.5-13.2178.1-68.2176.8000113.5N251 W256 Q257N251-L254 HydrophobicContact CB-CD1 4.11Å; N251-L254 HydrophobicContact CB-CG 4.26Å; N251-L254 PolarHBondContact O-N 2.79Å; N251-L254 VanDerWaalsContact O-N 3.11Å; L254-W256 PolarHBondContact O-N 3.45Å; L254-Q257 PolarHBondContact O-N 3.03Å
255S48Very low41.3Very low45 Ų45111.3 Ų111.332%0.31564%0.638SS.*THydrogen-bonded Turntrans-64.5-14.6175.354.50000113.8P252 Q258P252-S255 PolarHBondContact O-OG 3.35Å; S255-Q258 WeakPolarHBondContact O-CG 3.42Å
256W41.5Very low41.2Very low224 Ų224121 Ų12185%0.84867%0.671SS**THydrogen-bonded Turntrans-90.4-4179.9-68.1100.1000114.6L254 Q258L254-W256 PolarHBondContact O-N 3.45Å; W256-Q258 VanDerWaalsContact C-N 3.32Å; W256-Q258 PolarHBondContact O-N 3.09Å
257Q44.7Very low41.1Very low157 Ų157120.5 Ų120.573%0.73467%0.674SS**  trans-96.334175-71.9-167.8-19.200113L254 P259L254-Q257 PolarHBondContact O-N 3.03Å; Q257-P259 VanDerWaalsContact O-CD 3.29Å; Q257-P259 WeakPolarHBondContact O-CD 3.41Å
258Q41.2Very low41.1Very low156 Ų156123.1 Ų123.173%0.72969%0.693SS**  trans-58.1122.6174-58.8-169.6-0.800109.4S255 W256 I260S255-Q258 WeakPolarHBondContact O-CG 3.42Å; W256-Q258 VanDerWaalsContact C-N 3.32Å; W256-Q258 PolarHBondContact O-N 3.09Å; Q258-I260 PolarHBondContact O-N 2.87Å
259P41.3Very low41.1Very low108 Ų108126.4 Ų126.470%0.70171%0.707SS**  trans-63.3119.5152.927.3-26.6000105.3Q257 V261Q257-P259 VanDerWaalsContact O-CD 3.29Å; Q257-P259 WeakPolarHBondContact O-CD 3.41Å; P259-V261 PolarHBondContact O-N 2.71Å
260I43Very low40.9Very low164 Ų164125.4 Ų125.484%0.84170%0.704SS**  trans-60.986.8168.8-59.8168.6000106.2Q258 G262Q258-I260 PolarHBondContact O-N 2.87Å; I260-G262 PolarHBondContact O-N 2.92Å
261V39.4Very low40.7Very low130 Ų130123 Ų12379%0.78870%0.698SS**  trans-84.284.5160.4-179.30000104P259 G263P259-V261 PolarHBondContact O-N 2.71Å; V261-G263 PolarHBondContact O-N 3.43Å
262G35.5Very low40.9Very low63 Ų63126.7 Ų126.765%0.64972%0.72SS**  trans-51.8114173.400000109I260I260-G262 PolarHBondContact O-N 2.92Å
263G31.8Very low40.7Very low65 Ų65128.4 Ų128.467%0.6772%0.724SS**  trans-60.6134.717200000110.2V261 I265V261-G263 PolarHBondContact O-N 3.43Å; G263-I265 PolarHBondContact O-N 3.46Å
264A30.6Very low40.1Very low105 Ų105132.9 Ų132.987%0.86874%0.736SS**  trans-60.9117.2157.800000108.5
265I36.9Very low39.5Very low145 Ų145136.9 Ų136.974%0.74476%0.76SS**  trans-149.9111159.525.3174.1000106.4G263G263-I265 PolarHBondContact O-N 3.46Å
266F40.1Very low38.7Very low281 Ų281145.3 Ų145.3100%1.23280%0.8SS**  trans79.20-176.3-54.7-75.9000117.4

Retrieved 266 of 266 residues in 857.7 ms (Link to these results)