A0A087XCL2_POEFO Loading...

Meis homeobox 1

AlphaFold DB (A0A3B5Q1Q2), UniProt , Accession A0A087XCL2, Species POEFO (Poecilia formosa, Amazon molly), Gene MEIS1, Length 387 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
1M41.2Very low37Very low254 Ų254174.4 Ų174.4100%1.25184%0.836SS**  0147.50-127.7156.7177.800107.4
2A33.6Very low36.4Very low87 Ų87164.5 Ų164.572%0.71981%0.814SS**  trans-132.2156.2-165.900000113.3
3Q38Very low36.3Very low175 Ų175165.2 Ų165.282%0.81882%0.817SS**  trans75.2146.9155.2-68.4171.2-15.300120.9
4R37Very low35.9Very low211 Ų211164.6 Ų164.680%0.79682%0.819SS**  trans74.2121.6164.7-47.5-148.5-177.7-137.13116
5Y32Very low35.8Very low212 Ų212158.3 Ų158.383%0.83181%0.813SS**  -136.7124.353.4-118.8-95.4000114.8D7Y5-D7 HydrophobicContact CE1-CB 4.44Å
6E36.2Very low35.6Very low184 Ų184158.3 Ų158.386%0.8682%0.822SS**  trans-108.2127.9143.7-75.3177.3100.100105.8
7D35.6Very low35.2Very low145 Ų145153.6 Ų153.678%0.77582%0.821SS**  trans-164.9151.9143.9-122.3-46.4000110.2Y5Y5-D7 HydrophobicContact CE1-CB 4.44Å
8L37.3Very low35.1Very low132 Ų132154.3 Ų154.369%0.69182%0.823SS**  trans-102.9172.6-170.6-148.673.3000111.2
9P44.9Very low35.6Very low118 Ų118151.5 Ų151.577%0.76681%0.814SS**  -144.5150.992.436.9-21.5000115.7
10H38.1Very low35.3Very low167 Ų167151.1 Ų151.177%0.77382%0.817SS**  trans-63.5151.4159.3-101.627.9000111
11Y32.8Very low35.5Very low233 Ų233149.5 Ų149.591%0.91481%0.813SS**  trans-140.3151.8156.8-127.7-88000109.4
12G30.3Very low35.2Very low56 Ų56145.1 Ų145.158%0.57779%0.791SS**  trans-165.5168.3-179.900000112.1
13M34.6Very low35.4Very low173 Ų173152 Ų15285%0.85280%0.8SS**  trans66.7148.4-166.2-53.6-52.5-150.500113.5
14D31.2Very low35Very low157 Ų157146.8 Ų146.884%0.8479%0.793SS**  cis-127.9171.72.8-89.5-63.3000111.4
15G33.8Very low34.8Very low71 Ų71144.4 Ų144.473%0.73280%0.796SS**  trans-130.7152.9179.600000115.1
16V32.8Very low35.7Very low158 Ų158138.1 Ų138.196%0.95878%0.781SS**  trans-148.4133.3176.2-169.30000109.3
17G28.6Very low35.5Very low78 Ų78138.2 Ų138.280%0.80478%0.781SS**  trans149.154.6172.500000119.1
18I33.2Very low35.3Very low167 Ų167135 Ų13586%0.85678%0.783SS**  trans-66.1156.6170.9-80.2170.9000111.1
19P44.6Very low35Very low100 Ų100134 Ų13465%0.64979%0.793SS**  cis-133.7165.917.233.6-13.5000118.6
20T30.8Very low34.4Very low144 Ų144139 Ų13988%0.88380%0.797SS**  trans-143.1122.2137.5-58.90000108.9
21T38.5Very low34Very low117 Ų117137 Ų13772%0.71880%0.802SS**  trans-147.2143.8174.553.30000110.9
22M35.3Very low34Very low162 Ų162133.4 Ų133.480%0.79880%0.795SS**  trans169130132.6-90-60.6174.100109.7
23Y37.2Very low33.9Very low233 Ų233140 Ų14091%0.91481%0.811SS**  trans63.9140.3-178.9-73-95.9000118.1
24G30.3Very low33.8Very low64 Ų64136.8 Ų136.866%0.6681%0.812SS**  cis164.745.9-8.700000121.1
25D32.5Very low33.8Very low161 Ų161135.2 Ų135.286%0.86181%0.808SS**  trans62.1178.3160.1-125.610000116.7
26P50.7Low33.7Very low81 Ų81140 Ų14053%0.52681%0.81SS.*  cis-133.9171.3-13.936.8-18000117.6
27H33.3Very low33.8Very low186 Ų186138 Ų13886%0.86179%0.794SS**  trans78.5122.8157.7-52.7-41.4000120.7
28G29.6Very low33.9Very low78 Ų78141.1 Ų141.180%0.80479%0.792SS**  trans-165.332.2-178.800000117.9
29A32.2Very low34Very low110 Ų110140.2 Ų140.291%0.90978%0.784SS**  trans68158.9174.500000118.9
30R31.2Very low33.2Very low223 Ų223139 Ų13984%0.84279%0.789SS**  trans-108.7155.9-178.3-72.4170.5162168-7.9111.2
31S29.7Very low33.9Very low126 Ų126138 Ų13888%0.88179%0.785SS**  trans-139.3144.8139.1-168.30000109.2
32M33.1Very low33.6Very low156 Ų156140.1 Ų140.177%0.76879%0.787SS**  trans-112.8135.1-177.4-69.8-160.3-92.100111.1
33Q29.3Very low33.4Very low196 Ų196139 Ų13992%0.91678%0.784SS**PPolyproline II helixtrans-95.6131.9161.1-71.9-179.1-43.100109
34A32.2Very low33.1Very low105 Ų105136.1 Ų136.187%0.86878%0.778SS**PPolyproline II helixtrans-94.9135.9173.800000110.1
35V31.3Very low33.4Very low124 Ų124137.7 Ų137.775%0.75278%0.779SS**PPolyproline II helixtrans-102.3141.4179.5-1790000109.4L37V35-L37 HydrophobicContact CG1-CD1 3.7Å
36H31.5Very low33.4Very low170 Ų170139.2 Ų139.279%0.78778%0.78SS**  trans-146.2120.8163.6-165.2-89.2000111.7
37L35.2Very low32.6Very low117 Ų117142.3 Ų142.361%0.61379%0.788SS**  trans-98.6143.4170-82.966.3000109.2V35V35-L37 HydrophobicContact CG1-CD1 3.7Å
38N30.2Very low32.4Very low143 Ų143143.7 Ų143.777%0.76579%0.787SS**  trans-152.7171.4142.8-150.93.6000112.2
39H34.5Very low33.2Very low148 Ų148144.5 Ų144.569%0.68578%0.778SS**  trans-134.3133-151.8-39.680.9000114.2
40G29.2Very low33.2Very low74 Ų74147.5 Ų147.576%0.76377%0.773SS**  trans79.7175.6158.700000118.3
41P44.8Very low33.4Very low123 Ų123141.6 Ų141.680%0.79976%0.762SS**  -136.1161.7-58.339.1-28.1000115
42Q33.3Very low34.1Very low162 Ų162140.5 Ų140.576%0.75776%0.76SS**  trans35.1124.8154-87.4-78.320.500121.3
43L29.8Very low34.3Very low139 Ų139140.4 Ų140.473%0.72876%0.757SS**  176.7147.8110.5-94.4-179.8000115
44H32.1Very low35.1Very low173 Ų173137.5 Ų137.580%0.80175%0.753SS**  trans65.7147.9156.9-75.7106.5000122.8
45S34.8Very low35.3Very low96 Ų96138.4 Ų138.467%0.67174%0.744SS**  trans-99.9152179166.40000111.1
46H34.1Very low36.1Very low193 Ų193138 Ų13889%0.89475%0.747SS**  trans-151.7152.2144.3-94.6-57.6000113.7
47Q32.4Very low37Very low146 Ų146136.8 Ų136.868%0.68274%0.743SS**  trans-71.6149.7-173.8-163.977.336.400113.7
48Y29.7Very low37.9Very low216 Ų216136.4 Ų136.485%0.84775%0.747SS**  172.1163.2123.1-85.6-47.4000112.8
49P46.5Very low39.2Very low94 Ų94135.1 Ų135.161%0.6175%0.747SS**  trans-130.3136.1-146.736.8-17.1000115.4
50H32.8Very low40.3Very low174 Ų174132.4 Ų132.481%0.80674%0.744SS**  trans-128.2110.7174.3-81.2-76000114.6
51T36Very low41.9Very low99 Ų99136.6 Ų136.661%0.60775%0.746SS**  trans45.6111.5138.851.50000118.9H53T51-H53 PolarHBondContact O-CD2 2.88Å; T51-H53 PolarHBondContact O-N 2.94Å
52A42.8Very low42.6Very low102 Ų102132.7 Ų132.784%0.84373%0.728SS**  trans-62.5118.2167.900000111.6
53H38.1Very low44Very low154 Ų154128 Ų12871%0.71371%0.713SS**  trans-108.8107.3163.3-71.5-79.1000108.7T51 N55T51-H53 PolarHBondContact O-CD2 2.88Å; T51-H53 PolarHBondContact O-N 2.94Å; H53-N55 PolarHBondContact O-N 3.25Å
54T45.8Very low45.8Very low135 Ų135124.9 Ų124.983%0.82870%0.703SS**  trans-76.170.2176.252.30000110.4S56T54-S56 VanDerWaalsContact C-N 3.31Å; T54-S56 PolarHBondContact O-N 3.47Å
55N36.5Very low47.9Very low125 Ų125120.8 Ų120.867%0.66869%0.69SS**  trans-70.890.5169.6-92.85000109.2H53 M57H53-N55 PolarHBondContact O-N 3.25Å; N55-M57 HydrophobicContact CB-CE 4.47Å; N55-M57 PolarHBondContact O-N 3.01Å
56S48.6Very low50.2Low116 Ų116121.5 Ų121.581%0.81169%0.686SS**  trans-66.583.1163.454.40000108.9T54T54-S56 VanDerWaalsContact C-N 3.31Å; T54-S56 PolarHBondContact O-N 3.47Å
57M50.7Low52.7Low144 Ų144116.2 Ų116.271%0.70966%0.664SS**PPolyproline II helixtrans-56.9132.4170.4-70-65.217900108.9N55N55-M57 HydrophobicContact CB-CE 4.47Å; N55-M57 PolarHBondContact O-N 3.01Å
58P53.8Low55.3Low109 Ų109110.4 Ų110.471%0.70864%0.642SS**PPolyproline II helixtrans-60.5141.2170.627.5-33.6000108.7S60P58-S60 PolarHBondContact O-N 3.26Å
59P57.5Low58.2Low115 Ų115105.3 Ų105.375%0.74763%0.628SS**PPolyproline II helixtrans-59129.6-178.624.2-33.4000109.9M61P59-M61 PolarHBondContact O-N 2.87Å
60S57.8Low60.3Low91 Ų91107 Ų10764%0.63663%0.626SS**  trans-59.8112.4179.2-179.40000109.3P58 G62 S63P58-S60 PolarHBondContact O-N 3.26Å; S60-G62 PolarHBondContact O-N 3.04Å; S60-S63 WeakPolarHBondContact O-CB 3.4Å; S60-S63 PolarHBondContact O-N 3.07Å
61M61.6Low63Low163 Ų163106.2 Ų106.280%0.80362%0.616SS**Hα-helixtrans-59.7-24.8-171.8-152.3168.8-166.400112.3P59 S63 S64 V65P59-M61 PolarHBondContact O-N 2.87Å; M61-S63 VanDerWaalsContact C-N 3.33Å; M61-S63 PolarHBondContact O-N 3.36Å; M61-S64 PolarHBondContact O-N 3.44Å; M61-V65 WeakPolarHBondContact O-CG2 3.44Å
62G59.6Low65.5Low40 Ų40105.6 Ų105.641%0.41261%0.609SS.*Hα-helixtrans-67.6-21.2173.500000115.3S60 N66S60-G62 PolarHBondContact O-N 3.04Å; G62-N66 PolarHBondContact O-ND2 3.22Å
63S63.1Low67.8Low65 Ų65106.1 Ų106.146%0.45559%0.592SS.*Hα-helixtrans-64.4-54.7169.3-166.50000109.4S60 M61 V65 N66 D67S60-S63 WeakPolarHBondContact O-CB 3.4Å; S60-S63 PolarHBondContact O-N 3.07Å; M61-S63 VanDerWaalsContact C-N 3.33Å; M61-S63 PolarHBondContact O-N 3.36Å; S63-V65 PolarHBondContact O-N 3.03Å; S63-N66 CarbonylContact O-C 3.51Å; S63-N66 WeakPolarHBondContact O-CA 3.32Å; S63-N66 WeakPolarHBondContact O-CB 3.44Å; S63-N66 PolarHBondContact O-N 2.96Å; S63-D67 PolarHBondContact O-N 3.31Å; S63-D67 PolarHBondContact OG-OD2 3.03Å
64S67.1Low70.4Confident73 Ų73103 Ų10351%0.5158%0.581SS.*Hα-helixtrans-57.8-27.6-173.5-52.30000114.2M61 A68M61-S64 PolarHBondContact O-N 3.44Å; S64-A68 WeakPolarHBondContact O-CB 3.43Å; S64-A68 PolarHBondContact O-N 3.39Å
65V76.4Confident72.5Confident87 Ų8798.7 Ų98.753%0.52756%0.559SS.*Hα-helixtrans-74.8-39.7173.7-157.20000112M61 S63 A68 L69M61-V65 WeakPolarHBondContact O-CG2 3.44Å; S63-V65 PolarHBondContact O-N 3.03Å; V65-A68 PolarHBondContact O-N 3.24Å; V65-L69 PolarHBondContact O-N 3.05Å
66N83.9Confident75.1Confident110 Ų11095.2 Ų95.259%0.58854%0.54SS*.Hα-helixtrans-68.6-38.6173.2-76.5-85000111.2G62 S63 A68 L69 K70G62-N66 PolarHBondContact O-ND2 3.22Å; S63-N66 CarbonylContact O-C 3.51Å; S63-N66 WeakPolarHBondContact O-CA 3.32Å; S63-N66 WeakPolarHBondContact O-CB 3.44Å; S63-N66 PolarHBondContact O-N 2.96Å; N66-A68 PolarHBondContact O-N 2.83Å; N66-L69 PolarHBondContact O-N 2.86Å; N66-K70 VanDerWaalsContact O-CB 3.28Å; N66-K70 WeakPolarHBondContact O-CB 3.42Å; N66-K70 PolarHBondContact O-N 2.89Å
67D86.6Confident77.2Confident82 Ų8296.2 Ų96.244%0.43953%0.527SS..Hα-helixtrans-68.5-20.9174.2-63.1-53.3000112.6S63 R71S63-D67 PolarHBondContact O-N 3.31Å; S63-D67 PolarHBondContact OG-OD2 3.03Å; D67-R71 WeakPolarHBondContact O-CG 3.48Å; D67-R71 PolarHBondContact O-NE 3.05Å
68A87.3Confident79Confident25 Ų2592.5 Ų92.521%0.20753%0.525CS..Hα-helixtrans-78-59.4167.100000111.1S64 V65 N66 K70 R71 D72S64-A68 WeakPolarHBondContact O-CB 3.43Å; S64-A68 PolarHBondContact O-N 3.39Å; V65-A68 PolarHBondContact O-N 3.24Å; N66-A68 PolarHBondContact O-N 2.83Å; A68-K70 PolarHBondContact O-N 3.03Å; A68-R71 WeakPolarHBondContact O-CA 3.25Å; A68-R71 PolarHBondContact O-N 2.72Å; A68-D72 VanDerWaalsContact O-CG 3.25Å; A68-D72 PolarHBondContact O-N 3.43Å
69L89.1Confident80.8Confident108 Ų10887.6 Ų87.657%0.56549%0.493SS*.Hα-helixtrans-49.9-37.7178.1-83.3161.4000113V65 N66 K73V65-L69 PolarHBondContact O-N 3.05Å; N66-L69 PolarHBondContact O-N 2.86Å; L69-K73 WeakPolarHBondContact O-CB 3.41Å; L69-K73 PolarHBondContact O-N 3.22Å
70K91.8Very high82.3Confident130 Ų13084 Ų8457%0.56547%0.47SS*.Hα-helixtrans-66.5-44.1175.1-176178175.4-174.50112.7N66 A68 K73 D74N66-K70 VanDerWaalsContact O-CB 3.28Å; N66-K70 WeakPolarHBondContact O-CB 3.42Å; N66-K70 PolarHBondContact O-N 2.89Å; A68-K70 PolarHBondContact O-N 3.03Å; K70-K73 WeakPolarHBondContact O-CB 3.38Å; K70-K73 PolarHBondContact O-N 1.77Å; K70-D74 WeakPolarHBondContact O-CB 3.48Å; K70-D74 PolarHBondContact O-N 2.84Å
71R88.6Confident83.9Confident158 Ų15880.5 Ų80.560%0.59644%0.444SS*.Hα-helixtrans-66.6-39.7177.2-71178.9-56.4107.94.4111.7D67 A68 D74 A75D67-R71 WeakPolarHBondContact O-CG 3.48Å; D67-R71 PolarHBondContact O-NE 3.05Å; A68-R71 WeakPolarHBondContact O-CA 3.25Å; A68-R71 PolarHBondContact O-N 2.72Å; R71-D74 PolarHBondContact O-N 2.78Å; R71-A75 VanDerWaalsContact O-CB 3.32Å; R71-A75 WeakPolarHBondContact O-CB 3.46Å; R71-A75 PolarHBondContact O-N 2.66Å
72D89.6Confident85.4Confident86 Ų8675 Ų7546%0.4642%0.416SS..Hα-helixtrans-66.6-42179.1-54-28.5000110.1A68 A75 I76A68-D72 VanDerWaalsContact O-CG 3.25Å; A68-D72 PolarHBondContact O-N 3.43Å; D72-A75 PolarHBondContact O-N 2.94Å; D72-I76 WeakPolarHBondContact O-CG1 3.18Å; D72-I76 PolarHBondContact O-N 3.4Å; D72-I76 VanDerWaalsContact O-N 3.09Å
73K91.2Very high86.9Confident113 Ų11376.8 Ų76.849%0.49142%0.42SS..Hα-helixtrans-56.8-56.9168.3176.4-179.5171.4175.20111.6L69 K70 A75 I76 Y77L69-K73 WeakPolarHBondContact O-CB 3.41Å; L69-K73 PolarHBondContact O-N 3.22Å; K70-K73 WeakPolarHBondContact O-CB 3.38Å; K70-K73 PolarHBondContact O-N 1.77Å; K73-A75 PolarHBondContact O-N 2.97Å; K73-I76 WeakPolarHBondContact O-CB 3.32Å; K73-I76 PolarHBondContact O-N 3.25Å; K73-Y77 HydrophobicContact CD-CD2 4.5Å; K73-Y77 HydrophobicContact CD-CE2 4.13Å; K73-Y77 VanDerWaalsContact CE-CE2 3.44Å; K73-Y77 HydrophobicContact CG-CD2 3.63Å; K73-Y77 HydrophobicContact CG-CE2 3.59Å; K73-Y77 WeakPolarHBondContact O-CD2 3.48Å; K73-Y77 PolarHBondContact O-N 3.13Å
74D91.4Very high88.4Confident87 Ų8774.4 Ų74.447%0.46540%0.402SS..Hα-helixtrans-60.5-31.6-176.3-67.6-16.9000111.4K70 R71 G78K70-D74 WeakPolarHBondContact O-CB 3.48Å; K70-D74 PolarHBondContact O-N 2.84Å; R71-D74 PolarHBondContact O-N 2.78Å; D74-G78 PolarHBondContact O-N 3.22Å
75A90.9Very high89.7Confident45 Ų4572.2 Ų72.237%0.37238%0.384SS..Hα-helixtrans-68.8-39.1172.200000113.4R71 D72 K73 H79 L139R71-A75 VanDerWaalsContact O-CB 3.32Å; R71-A75 WeakPolarHBondContact O-CB 3.46Å; R71-A75 PolarHBondContact O-N 2.66Å; D72-A75 PolarHBondContact O-N 2.94Å; K73-A75 PolarHBondContact O-N 2.97Å; A75-H79 PolarHBondContact O-N 3.46Å; A75-L139 HydrophobicContact CB-CD2 4.06Å
76I91.4Very high90.5Very high52 Ų5270 Ų7027%0.26738%0.375SS..Hα-helixtrans-64.8-48.6173.7-70.2162.1000110.7D72 K73 G78 H79 F82 L139 M143D72-I76 WeakPolarHBondContact O-CG1 3.18Å; D72-I76 PolarHBondContact O-N 3.4Å; D72-I76 VanDerWaalsContact O-N 3.09Å; K73-I76 WeakPolarHBondContact O-CB 3.32Å; K73-I76 PolarHBondContact O-N 3.25Å; I76-G78 VanDerWaalsContact C-N 3.28Å; I76-G78 PolarHBondContact O-N 3.08Å; I76-H79 VanDerWaalsContact O-CB 3.26Å; I76-H79 WeakPolarHBondContact O-CB 3.48Å; I76-H79 PolarHBondContact O-N 3.22Å; I76-H79 VanDerWaalsContact O-N 3.15Å; I76-F82 HydrophobicContact CG2-CD2 4.04Å; I76-F82 HydrophobicContact CG2-CE2 4.33Å; I76-F82 WeakPolarHBondContact O-CB 2.97Å; I76-F82 WeakPolarHBondContact O-CD2 3.37Å; I76-L139 HydrophobicContact CG1-CD1 3.76Å; I76-M143 HydrophobicContact CG2-SD 4.03Å
77Y91.3Very high91Very high138 Ų13867.2 Ų67.254%0.54136%0.36SS..Hα-helixtrans-66.1-29.1178.4-79.4-85.7000113K73 H79 F82K73-Y77 HydrophobicContact CD-CD2 4.5Å; K73-Y77 HydrophobicContact CD-CE2 4.13Å; K73-Y77 VanDerWaalsContact CE-CE2 3.44Å; K73-Y77 HydrophobicContact CG-CD2 3.63Å; K73-Y77 HydrophobicContact CG-CE2 3.59Å; K73-Y77 WeakPolarHBondContact O-CD2 3.48Å; K73-Y77 PolarHBondContact O-N 3.13Å; Y77-H79 VanDerWaalsContact C-N 3.33Å; Y77-F82 HydrophobicContact CD1-CD1 4.37Å; Y77-F82 HydrophobicContact CD1-CD2 4.42Å; Y77-F82 AromaticContact CD1-CE1 3.68Å; Y77-F82 HydrophobicContact CD1-CE1 3.68Å; Y77-F82 AromaticContact CD1-CE2 3.73Å; Y77-F82 HydrophobicContact CD1-CE2 3.73Å; Y77-F82 AromaticContact CD1-CZ 3.33Å; Y77-F82 HydrophobicContact CD1-CZ 3.33Å; Y77-F82 HydrophobicContact CE1-CE1 4.01Å; Y77-F82 AromaticContact CE1-CE2 3.85Å; Y77-F82 HydrophobicContact CE1-CE2 3.85Å; Y77-F82 AromaticContact CE1-CZ 3.32Å; Y77-F82 HydrophobicContact CE1-CZ 3.32Å; Y77-F82 HydrophobicContact CG-CE2 4.22Å; Y77-F82 HydrophobicContact CG-CZ 4.25Å
78G89.1Confident91.3Very high66 Ų6663.3 Ų63.368%0.6834%0.339SS*.THydrogen-bonded Turntrans-82.4-1.3174.300000115.1D74 I76D74-G78 PolarHBondContact O-N 3.22Å; I76-G78 VanDerWaalsContact C-N 3.28Å; I76-G78 PolarHBondContact O-N 3.08Å
79H90.6Very high91.6Very high6 Ų667.9 Ų67.93%0.02835%0.354CS..SBendtrans-77.4138.8-174.5-166-88.9000112.1A75 I76 Y77 L81 F82 S134 D140 M143A75-H79 PolarHBondContact O-N 3.46Å; I76-H79 VanDerWaalsContact O-CB 3.26Å; I76-H79 WeakPolarHBondContact O-CB 3.48Å; I76-H79 PolarHBondContact O-N 3.22Å; I76-H79 VanDerWaalsContact O-N 3.15Å; Y77-H79 VanDerWaalsContact C-N 3.33Å; H79-L81 VanDerWaalsContact CE1-CB 3.49Å; H79-L81 WeakPolarHBondContact CE1-CB 3.48Å; H79-L81 WeakPolarHBondContact CE1-CD1 3.16Å; H79-L81 WeakPolarHBondContact CE1-CG 3.35Å; H79-L81 WeakPolarHBondContact ND1-CB 3.24Å; H79-L81 PolarHBondContact ND1-N 2.94Å; H79-L81 PolarHBondContact O-N 3.47Å; H79-L81 VanDerWaalsContact O-N 3.13Å; H79-F82 WeakPolarHBondContact O-CB 2.95Å; H79-F82 PolarHBondContact O-N 2.85Å; H79-S134 WeakPolarHBondContact NE2-CB 3.48Å; H79-S134 PolarHBondContact NE2-OG 2.89Å; H79-D140 IonicContact CD2-OD1 3.92Å; H79-D140 IonicContact CE1-OD1 3.89Å; H79-D140 WeakPolarHBondContact NE2-CA 3.44Å; H79-D140 WeakPolarHBondContact NE2-CB 3.49Å; H79-D140 PolarHBondContact NE2-N 3.09Å; H79-D140 CovalentContact NE2-OD1 1.77Å; H79-D140 IonicContact NE2-OD1 2.69Å; H79-D140 PolarHBondContact NE2-OD1 3.41Å; H79-D140 IonicContact NE2-OD2 3.77Å; H79-M143 HydrophobicContact CB-CE 4.09Å; H79-M143 HydrophobicContact CB-CG 4.44Å
80P89.3Confident91.7Very high39 Ų3968.3 Ų68.325%0.25335%0.354SS..THydrogen-bonded Turntrans-57.1-29.7179.421.1-33.7000114F82 P83 F122 I126 L132P80-F82 VanDerWaalsContact C-N 3.33Å; P80-P83 WeakPolarHBondContact O-CD 3.28Å; P80-F122 WeakPolarHBondContact O-CZ 3.44Å; P80-I126 HydrophobicContact CB-CD1 4.1Å; P80-I126 WeakPolarHBondContact O-CD1 3.2Å; P80-L132 WeakPolarHBondContact CG-O 3.44Å
81L91.6Very high91.6Very high18 Ų1863.2 Ų63.29%0.09433%0.331CS..THydrogen-bonded Turntrans-82.1-5177.2-57.8-178.9000114.2H79 L84 L85 F122 M143 I144 I147H79-L81 VanDerWaalsContact CE1-CB 3.49Å; H79-L81 WeakPolarHBondContact CE1-CB 3.48Å; H79-L81 WeakPolarHBondContact CE1-CD1 3.16Å; H79-L81 WeakPolarHBondContact CE1-CG 3.35Å; H79-L81 WeakPolarHBondContact ND1-CB 3.24Å; H79-L81 PolarHBondContact ND1-N 2.94Å; H79-L81 PolarHBondContact O-N 3.47Å; H79-L81 VanDerWaalsContact O-N 3.13Å; L81-L84 PolarHBondContact O-N 2.95Å; L81-L85 PolarHBondContact O-N 3.35Å; L81-L85 VanDerWaalsContact O-N 3.07Å; L81-F122 HydrophobicContact CD2-CE1 3.82Å; L81-F122 HydrophobicContact CD2-CZ 4.03Å; L81-M143 HydrophobicContact CB-CB 4.26Å; L81-M143 HydrophobicContact CB-CE 4.2Å; L81-M143 HydrophobicContact CD1-CB 4.14Å; L81-I144 HydrophobicContact CD1-CG1 3.72Å; L81-I147 HydrophobicContact CB-CD1 4.02Å
82F92.8Very high91.7Very high48 Ų4856 Ų5621%0.21131%0.305CS..Hα-helixtrans-58-42.8-177.2-176-94.3000114.5I76 Y77 H79 P80 L84 L85 A86 M143I76-F82 HydrophobicContact CG2-CD2 4.04Å; I76-F82 HydrophobicContact CG2-CE2 4.33Å; I76-F82 WeakPolarHBondContact O-CB 2.97Å; I76-F82 WeakPolarHBondContact O-CD2 3.37Å; Y77-F82 HydrophobicContact CD1-CD1 4.37Å; Y77-F82 HydrophobicContact CD1-CD2 4.42Å; Y77-F82 AromaticContact CD1-CE1 3.68Å; Y77-F82 HydrophobicContact CD1-CE1 3.68Å; Y77-F82 AromaticContact CD1-CE2 3.73Å; Y77-F82 HydrophobicContact CD1-CE2 3.73Å; Y77-F82 AromaticContact CD1-CZ 3.33Å; Y77-F82 HydrophobicContact CD1-CZ 3.33Å; Y77-F82 HydrophobicContact CE1-CE1 4.01Å; Y77-F82 AromaticContact CE1-CE2 3.85Å; Y77-F82 HydrophobicContact CE1-CE2 3.85Å; Y77-F82 AromaticContact CE1-CZ 3.32Å; Y77-F82 HydrophobicContact CE1-CZ 3.32Å; Y77-F82 HydrophobicContact CG-CE2 4.22Å; Y77-F82 HydrophobicContact CG-CZ 4.25Å; H79-F82 WeakPolarHBondContact O-CB 2.95Å; H79-F82 PolarHBondContact O-N 2.85Å; P80-F82 VanDerWaalsContact C-N 3.33Å; F82-L84 VanDerWaalsContact C-N 3.28Å; F82-L84 PolarHBondContact O-N 3.05Å; F82-L85 PolarHBondContact O-N 2.87Å; F82-L85 VanDerWaalsContact O-N 3.16Å; F82-A86 HydrophobicContact CE1-CB 4.19Å; F82-A86 HydrophobicContact CZ-CB 4.35Å; F82-A86 PolarHBondContact O-N 2.82Å; F82-M143 HydrophobicContact CB-CE 4.14Å; F82-M143 HydrophobicContact CD2-CE 4.44Å
83P92.7Very high91.8Very high77 Ų7757 Ų5750%0.531%0.307SS..Hα-helixtrans-61.9-35.3178.8-22.934.6000113P80 L87 F122P80-P83 WeakPolarHBondContact O-CD 3.28Å; P83-L87 VanDerWaalsContact O-CB 3.31Å; P83-L87 WeakPolarHBondContact O-CB 3.49Å; P83-L87 PolarHBondContact O-N 3.06Å; P83-F122 HydrophobicContact CB-CE2 4.17Å; P83-F122 HydrophobicContact CG-CE2 4.43Å
84L93.3Very high91.6Very high14 Ų1455.1 Ų55.17%0.07330%0.302CS..Hα-helixtrans-73.1-35.1176.6-172.665.6000111.9L81 F82 I88 F115 I119 F122 I147L81-L84 PolarHBondContact O-N 2.95Å; F82-L84 VanDerWaalsContact C-N 3.28Å; F82-L84 PolarHBondContact O-N 3.05Å; L84-I88 WeakPolarHBondContact O-CG2 3.46Å; L84-I88 PolarHBondContact O-N 3.44Å; L84-F115 HydrophobicContact CD1-CE2 3.64Å; L84-F115 HydrophobicContact CD1-CZ 3.83Å; L84-F115 HydrophobicContact CG-CE2 4.43Å; L84-F115 HydrophobicContact CG-CZ 4.25Å; L84-I119 HydrophobicContact CD1-CG1 4.07Å; L84-I119 HydrophobicContact CD2-CG1 4.3Å; L84-F122 HydrophobicContact CB-CD1 4.11Å; L84-F122 HydrophobicContact CB-CD2 4.04Å; L84-F122 HydrophobicContact CB-CE1 3.94Å; L84-F122 HydrophobicContact CB-CE2 3.87Å; L84-F122 HydrophobicContact CB-CG 4.15Å; L84-F122 HydrophobicContact CB-CZ 3.8Å; L84-F122 HydrophobicContact CD1-CB 4.36Å; L84-F122 HydrophobicContact CD1-CD1 4.45Å; L84-F122 HydrophobicContact CD1-CG 4.28Å; L84-F122 HydrophobicContact CD2-CD1 3.76Å; L84-F122 HydrophobicContact CD2-CE1 3.86Å; L84-F122 HydrophobicContact CD2-CG 4.38Å; L84-F122 HydrophobicContact CG-CD1 4.34Å; L84-F122 HydrophobicContact CG-CE1 4.47Å; L84-I147 HydrophobicContact CB-CD1 4.32Å; L84-I147 HydrophobicContact CD2-CD1 4.21Å; L84-I147 HydrophobicContact CD2-CG2 4.38Å; L84-I147 HydrophobicContact CG-CD1 4.32Å
85L94.4Very high91.4Very high28 Ų2851.1 Ų51.115%0.14728%0.281CS..Hα-helixtrans-66.3-39.6172.8179.462.9000112.1L81 F82 I88 F89 M143 A146 I147 L150L81-L85 PolarHBondContact O-N 3.35Å; L81-L85 VanDerWaalsContact O-N 3.07Å; F82-L85 PolarHBondContact O-N 2.87Å; F82-L85 VanDerWaalsContact O-N 3.16Å; L85-I88 WeakPolarHBondContact O-CG2 3.3Å; L85-F89 WeakPolarHBondContact O-CB 3.45Å; L85-F89 PolarHBondContact O-N 3.24Å; L85-M143 HydrophobicContact CB-CE 4.07Å; L85-M143 HydrophobicContact CD2-CE 3.57Å; L85-M143 HydrophobicContact CD2-SD 3.76Å; L85-M143 HydrophobicContact CG-CE 4.47Å; L85-A146 HydrophobicContact CD1-CB 3.78Å; L85-I147 HydrophobicContact CB-CD1 4.24Å; L85-I147 HydrophobicContact CB-CG1 3.97Å; L85-I147 HydrophobicContact CD1-CG1 3.95Å; L85-L150 HydrophobicContact CD1-CD1 3.76Å
86A94.6Very high91.1Very high40 Ų4053.2 Ų53.233%0.33129%0.289SS..Hα-helixtrans-66-47.817500000111.4F82 I88 F89 E90F82-A86 HydrophobicContact CE1-CB 4.19Å; F82-A86 HydrophobicContact CZ-CB 4.35Å; F82-A86 PolarHBondContact O-N 2.82Å; A86-I88 PolarHBondContact O-N 3.39Å; A86-F89 WeakPolarHBondContact O-CB 3.39Å; A86-F89 PolarHBondContact O-N 3.36Å; A86-E90 PolarHBondContact O-N 3.42Å
87L92.9Very high90.4Very high52 Ų5254.8 Ų54.827%0.27230%0.304SS..Hα-helixtrans-62.3-40.5-179-174.1154.8000112.6P83 K91 F115 D118P83-L87 VanDerWaalsContact O-CB 3.31Å; P83-L87 WeakPolarHBondContact O-CB 3.49Å; P83-L87 PolarHBondContact O-N 3.06Å; L87-K91 HydrophobicContact CD2-CD 4.22Å; L87-K91 PolarHBondContact O-N 3.49Å; L87-F115 HydrophobicContact CD2-CD2 3.7Å; L87-F115 HydrophobicContact CD2-CE2 3.79Å; L87-D118 HydrophobicContact CD1-CB 4.24Å; L87-D118 HydrophobicContact CD2-CB 3.78Å
88I93.1Very high89Confident0 Ų051.6 Ų51.60%030%0.299CS..Hα-helixtrans-71.3-33176.8-158.2-178.3000112.3L84 L85 A86 C92 F115 I147 L150 R151L84-I88 WeakPolarHBondContact O-CG2 3.46Å; L84-I88 PolarHBondContact O-N 3.44Å; L85-I88 WeakPolarHBondContact O-CG2 3.3Å; A86-I88 PolarHBondContact O-N 3.39Å; I88-C92 PolarHBondContact O-N 3.36Å; I88-C92 VanDerWaalsContact O-N 3.07Å; I88-C92 PolarHBondContact O-SG 3.15Å; I88-F115 HydrophobicContact CB-CD2 4.34Å; I88-F115 HydrophobicContact CB-CE1 4.35Å; I88-F115 HydrophobicContact CB-CE2 3.61Å; I88-F115 HydrophobicContact CB-CZ 3.63Å; I88-F115 HydrophobicContact CD1-CD1 3.96Å; I88-F115 HydrophobicContact CD1-CE1 3.25Å; I88-F115 HydrophobicContact CD1-CE2 4.12Å; I88-F115 HydrophobicContact CD1-CZ 3.38Å; I88-F115 HydrophobicContact CG1-CD1 4.17Å; I88-F115 HydrophobicContact CG1-CD2 4.17Å; I88-F115 HydrophobicContact CG1-CE1 3.75Å; I88-F115 HydrophobicContact CG1-CE2 3.77Å; I88-F115 HydrophobicContact CG1-CG 4.38Å; I88-F115 HydrophobicContact CG1-CZ 3.56Å; I88-I147 HydrophobicContact CD1-CG2 4.43Å; I88-I147 WeakPolarHBondContact CD1-O 3.4Å; I88-L150 HydrophobicContact CD1-CB 3.87Å; I88-L150 HydrophobicContact CG1-CB 4.18Å; I88-L150 HydrophobicContact CG2-CB 3.89Å; I88-L150 HydrophobicContact CG2-CD1 3.82Å; I88-R151 HydrophobicContact CD1-CB 3.67Å; I88-R151 HydrophobicContact CD1-CG 4.45Å; I88-R151 VanDerWaalsContact CD1-N 3.27Å
89F93.4Very high87.5Confident121 Ų12153.3 Ų53.353%0.53130%0.298SS..Hα-helixtrans-65.8-46.1173.8-175-86.9000111.1L85 A86 K91 C92 E93 L150L85-F89 WeakPolarHBondContact O-CB 3.45Å; L85-F89 PolarHBondContact O-N 3.24Å; A86-F89 WeakPolarHBondContact O-CB 3.39Å; A86-F89 PolarHBondContact O-N 3.36Å; F89-K91 PolarHBondContact O-N 2.91Å; F89-C92 WeakPolarHBondContact O-CB 3.26Å; F89-C92 PolarHBondContact O-N 3.48Å; F89-C92 VanDerWaalsContact O-N 3.07Å; F89-E93 PolarHBondContact O-N 3.38Å; F89-L150 HydrophobicContact CB-CD1 4.31Å; F89-L150 HydrophobicContact CD2-CD1 4.34Å
90E91.5Very high86Confident117 Ų11758.6 Ų58.655%0.54732%0.318SS..Hα-helixtrans-58.1-43.9175-177.2176.2-166.200111.9A86 C92 E93 L94A86-E90 PolarHBondContact O-N 3.42Å; E90-C92 VanDerWaalsContact C-N 3.34Å; E90-C92 PolarHBondContact O-N 2.93Å; E90-E93 PolarHBondContact O-N 2.99Å; E90-L94 HydrophobicContact CG-CD1 4.05Å; E90-L94 HydrophobicContact CG-CG 4.48Å; E90-L94 WeakPolarHBondContact O-CB 3.23Å; E90-L94 VanDerWaalsContact O-CG 3.3Å; E90-L94 WeakPolarHBondContact O-CG 3.49Å; E90-L94 PolarHBondContact O-N 3.35Å
91K90.3Very high84.1Confident22 Ų2263.4 Ų63.410%0.09634%0.337CS..Hα-helixtrans-61.9-37.4172.9-76.9-174.7-169.4-95.40113.2L87 F89 A95 V109 S114 F115 D118 L154L87-K91 HydrophobicContact CD2-CD 4.22Å; L87-K91 PolarHBondContact O-N 3.49Å; F89-K91 PolarHBondContact O-N 2.91Å; K91-A95 WeakPolarHBondContact O-CB 3.22Å; K91-A95 PolarHBondContact O-N 3.29Å; K91-V109 PolarHBondContact NZ-O 2.69Å; K91-S114 PolarHBondContact NZ-OG 3.01Å; K91-F115 HydrophobicContact CD-CB 3.98Å; K91-F115 HydrophobicContact CD-CD2 4.08Å; K91-F115 HydrophobicContact CD-CG 4.39Å; K91-D118 WeakPolarHBondContact CE-OD2 3.21Å; K91-D118 IonicContact NZ-OD2 3.93Å; K91-D118 PolarHBondContact NZ-OD2 3.21Å; K91-L154 HydrophobicContact CB-CD1 4.2Å; K91-L154 HydrophobicContact CB-CD2 4.17Å; K91-L154 HydrophobicContact CD-CD2 4.28Å
92C91.4Very high82Confident8 Ų868.7 Ų68.75%0.05437%0.372CS..Hα-helixtrans-66.5-43.6175.3-65.90000111.3I88 F89 E90 A95 T96I88-C92 PolarHBondContact O-N 3.36Å; I88-C92 VanDerWaalsContact O-N 3.07Å; I88-C92 PolarHBondContact O-SG 3.15Å; F89-C92 WeakPolarHBondContact O-CB 3.26Å; F89-C92 PolarHBondContact O-N 3.48Å; F89-C92 VanDerWaalsContact O-N 3.07Å; E90-C92 VanDerWaalsContact C-N 3.34Å; E90-C92 PolarHBondContact O-N 2.93Å; C92-A95 PolarHBondContact O-N 2.9Å; C92-T96 WeakPolarHBondContact O-CG2 3.47Å; C92-T96 PolarHBondContact O-N 3.15Å; C92-T96 PolarHBondContact O-OG1 3.22Å
93E90.1Very high80Confident106 Ų10670.1 Ų70.150%0.49540%0.4SS..Hα-helixtrans-60.3-52.5176.1-174.8168.5-166.200110.9F89 E90 A95 T96 C97F89-E93 PolarHBondContact O-N 3.38Å; E90-E93 PolarHBondContact O-N 2.99Å; E93-A95 VanDerWaalsContact C-N 3.3Å; E93-A95 PolarHBondContact O-N 3.08Å; E93-T96 CarbonylContact O-C 3.59Å; E93-T96 PolarHBondContact O-N 3.44Å; E93-T96 PolarHBondContact O-OG1 2.96Å; E93-C97 WeakPolarHBondContact O-CB 3.16Å; E93-C97 PolarHBondContact O-N 3.13Å; E93-C97 PolarHBondContact O-SG 2.98Å; E93-C97 VanDerWaalsContact O-SG 3.32Å
94L87.5Confident77.9Confident73 Ų7371.9 Ų71.938%0.38241%0.41SS..Hα-helixtrans-58.6-38176.3-69.3171.9000112.9E90 C97 T98 C110E90-L94 HydrophobicContact CG-CD1 4.05Å; E90-L94 HydrophobicContact CG-CG 4.48Å; E90-L94 WeakPolarHBondContact O-CB 3.23Å; E90-L94 VanDerWaalsContact O-CG 3.3Å; E90-L94 WeakPolarHBondContact O-CG 3.49Å; E90-L94 PolarHBondContact O-N 3.35Å; L94-C97 PolarHBondContact O-N 3Å; L94-T98 WeakPolarHBondContact O-CB 3.41Å; L94-T98 WeakPolarHBondContact O-CG2 3.33Å; L94-T98 PolarHBondContact O-N 3.38Å; L94-T98 VanDerWaalsContact O-N 3.15Å; L94-T98 PolarHBondContact O-OG1 3.1Å; L94-C110 VanDerWaalsContact CB-SG 3.57Å
95A86.4Confident75.5Confident3 Ų376 Ų763%0.02545%0.446CS..Hα-helixtrans-63.7-38.6173.500000112K91 C92 E93 C110 L154 L157 H161K91-A95 WeakPolarHBondContact O-CB 3.22Å; K91-A95 PolarHBondContact O-N 3.29Å; C92-A95 PolarHBondContact O-N 2.9Å; E93-A95 VanDerWaalsContact C-N 3.3Å; E93-A95 PolarHBondContact O-N 3.08Å; A95-C110 HydrophobicContact CB-CB 4.05Å; A95-L154 HydrophobicContact CB-CD1 4.04Å; A95-L157 HydrophobicContact CB-CB 4.28Å; A95-L157 HydrophobicContact CB-CD1 3.81Å; A95-H161 PolarHBondContact O-CE1 3.31Å; A95-H161 PolarHBondContact O-NE2 3.13Å
96T86.3Confident73.2Confident90 Ų9076.4 Ų76.455%0.55246%0.457SS*.Hα-helixtrans-76-23.6175.359.50000114C92 E93 L157C92-T96 WeakPolarHBondContact O-CG2 3.47Å; C92-T96 PolarHBondContact O-N 3.15Å; C92-T96 PolarHBondContact O-OG1 3.22Å; E93-T96 CarbonylContact O-C 3.59Å; E93-T96 PolarHBondContact O-N 3.44Å; E93-T96 PolarHBondContact O-OG1 2.96Å; T96-L157 HydrophobicContact CG2-CD1 3.84Å; T96-L157 HydrophobicContact CG2-CD2 4.02Å
97C76Confident71.3Confident85 Ų8575.8 Ų75.857%0.57445%0.454SS*.Hα-helixtrans-92-18.7-174-74.90000115E93 L94 P99E93-C97 WeakPolarHBondContact O-CB 3.16Å; E93-C97 PolarHBondContact O-N 3.13Å; E93-C97 PolarHBondContact O-SG 2.98Å; E93-C97 VanDerWaalsContact O-SG 3.32Å; L94-C97 PolarHBondContact O-N 3Å; C97-P99 VanDerWaalsContact O-CD 3.27Å; C97-P99 WeakPolarHBondContact O-CD 3.28Å
98T62.8Low69.6Low71 Ų7178.9 Ų78.944%0.43647%0.471SS..  trans-82117.9-167.931.80000114L94 R100L94-T98 WeakPolarHBondContact O-CB 3.41Å; L94-T98 WeakPolarHBondContact O-CG2 3.33Å; L94-T98 PolarHBondContact O-N 3.38Å; L94-T98 VanDerWaalsContact O-N 3.15Å; L94-T98 PolarHBondContact O-OG1 3.1Å; T98-R100 PolarHBondContact O-N 3.04Å
99P57.1Low68.3Low102 Ų10282.8 Ų82.866%0.66249%0.494SS*.  trans-67.2121.3149.7-2.621.2000106.5C97 E101C97-P99 VanDerWaalsContact O-CD 3.27Å; C97-P99 WeakPolarHBondContact O-CD 3.28Å; P99-E101 PolarHBondContact O-N 2.89Å
100R58.9Low67.2Low117 Ų11778.1 Ų78.144%0.44248%0.477SS..  trans-75.874.7-179.2-148.3175.7-155.7-1788.9110.1T98 P102 G107 D165T98-R100 PolarHBondContact O-N 3.04Å; R100-P102 WeakPolarHBondContact O-CD 3.49Å; R100-P102 VanDerWaalsContact O-N 3.15Å; R100-G107 PolarHBondContact NH2-O 3.49Å; R100-D165 IonicContact CZ-OD2 3.9Å; R100-D165 IonicContact NE-OD2 2.64Å; R100-D165 IonicContact NH1-OD2 1.77Å; R100-D165 PolarHBondContact NH1-OD2 3.43Å
101E49.7Very low66.5Low140 Ų14073.2 Ų73.265%0.65446%0.455SS*.  trans-52.4113.8-179.5-87.2-64.7113.100110.7P99 G103 V104P99-E101 PolarHBondContact O-N 2.89Å; E101-G103 VanDerWaalsContact C-N 3.3Å; E101-G103 PolarHBondContact O-N 3.22Å; E101-V104 PolarHBondContact O-N 3.49Å
102P45.9Very low65.8Low128 Ų12873.2 Ų73.283%0.83146%0.458SS*.THydrogen-bonded Turntrans-80.374.9-164.332.2-36.6000111.9R100R100-P102 WeakPolarHBondContact O-CD 3.49Å; R100-P102 VanDerWaalsContact O-N 3.15Å
103G51.2Low65.4Low78 Ų7880.3 Ų80.380%0.80449%0.49SS*.THydrogen-bonded Turntrans172.6-18.8176.400000115.2E101E101-G103 VanDerWaalsContact C-N 3.3Å; E101-G103 PolarHBondContact O-N 3.22Å
104V48.2Very low65.1Low115 Ų11576.5 Ų76.570%0.69748%0.475SS*.SBendtrans-83136.7174.3-177.20000109.7E101 G106E101-V104 PolarHBondContact O-N 3.49Å; V104-G106 PolarHBondContact O-N 3.05Å
105A44.1Very low65.1Low101 Ų10173 Ų7384%0.83546%0.457SS*.SBendtrans-72.842.1174.100000113.1
106G45.4Very low65.2Low36 Ų3675.9 Ų75.937%0.37147%0.472SS..  trans-93.19.2177.200000113.7V104 D108 V109V104-G106 PolarHBondContact O-N 3.05Å; G106-D108 VanDerWaalsContact C-N 3.27Å; G106-D108 PolarHBondContact O-N 3.12Å; G106-V109 PolarHBondContact O-N 2.94Å
107G54.2Low65.4Low26 Ų2678.1 Ų78.127%0.26848%0.476SS..THydrogen-bonded Turntrans-53.6-41.8-173.800000113.6R100R100-G107 PolarHBondContact NH2-O 3.49Å
108D58.8Low66.1Low117 Ų11776.3 Ų76.363%0.62646%0.461SS*.THydrogen-bonded Turntrans-93.7-10.4-170.7-47.6-62.7000114.3G106 C110 S111 S114G106-D108 VanDerWaalsContact C-N 3.27Å; G106-D108 PolarHBondContact O-N 3.12Å; D108-C110 PolarHBondContact O-N 3.07Å; D108-C110 VanDerWaalsContact O-N 3.15Å; D108-S111 WeakPolarHBondContact O-CB 3.43Å; D108-S111 PolarHBondContact O-N 3.22Å; D108-S114 VanDerWaalsContact O-CB 3.28Å; D108-S114 WeakPolarHBondContact O-CB 3.35Å; D108-S114 PolarHBondContact O-OG 3.39Å
109V65.1Low67.3Low83 Ų8375.6 Ų75.650%0.50345%0.453SS..THydrogen-bonded Turntrans-57.6-36.1-173.2176.50000111.9K91 G106 S114K91-V109 PolarHBondContact NZ-O 2.69Å; G106-V109 PolarHBondContact O-N 2.94Å; V109-S114 PolarHBondContact O-OG 3.04Å
110C70.3Confident68.9Low23 Ų2372.7 Ų72.716%0.15544%0.438CS..THydrogen-bonded Turntrans-109.210.4178.1-58.70000113.6L94 A95 D108 L154L94-C110 VanDerWaalsContact CB-SG 3.57Å; A95-C110 HydrophobicContact CB-CB 4.05Å; D108-C110 PolarHBondContact O-N 3.07Å; D108-C110 VanDerWaalsContact O-N 3.15Å; C110-L154 WeakPolarHBondContact O-CD1 3.45Å
111S77.8Confident70.4Confident13 Ų1370.8 Ų70.89%0.09144%0.439CS..SBendtrans-76153.7178-88.50000112.6D108 E113 S114 F115 E158D108-S111 WeakPolarHBondContact O-CB 3.43Å; D108-S111 PolarHBondContact O-N 3.22Å; S111-E113 PolarHBondContact O-N 2.86Å; S111-S114 PolarHBondContact O-N 3.23Å; S111-S114 PolarHBondContact O-OG 3.27Å; S111-S114 VanDerWaalsContact O-OG 3.09Å; S111-F115 PolarHBondContact O-N 3.4Å; S111-E158 WeakPolarHBondContact CA-OE1 3.43Å; S111-E158 WeakPolarHBondContact CB-OE1 3.47Å; S111-E158 PolarHBondContact OG-OE1 3.49Å
112S75.7Confident72.2Confident22 Ų2265.7 Ų65.715%0.15442%0.415CS..Hα-helixtrans-66.2-22.9178.161.50000113.3N116 L155 E158S112-N116 PolarHBondContact O-N 3.49Å; S112-N116 PolarHBondContact O-ND2 2.78Å; S112-L155 VanDerWaalsContact CB-CD2 3.41Å; S112-L155 VanDerWaalsContact OG-CD2 3.32Å; S112-L155 WeakPolarHBondContact OG-CD2 3.32Å; S112-E158 WeakPolarHBondContact CB-OE2 3.34Å; S112-E158 PolarHBondContact N-OE1 3.45Å; S112-E158 PolarHBondContact N-OE2 3.32Å; S112-E158 VanDerWaalsContact N-OE2 3.13Å; S112-E158 PolarHBondContact OG-OE2 2.96Å
113E82.3Confident74.2Confident158 Ų15861.4 Ų61.474%0.73839%0.391SS*.Hα-helixtrans-68.7-45.8175.3-171.7151.8106.800112.6S111 F115 N116 E117S111-E113 PolarHBondContact O-N 2.86Å; E113-F115 VanDerWaalsContact C-N 3.28Å; E113-F115 PolarHBondContact O-N 3.02Å; E113-N116 WeakPolarHBondContact O-CA 3.42Å; E113-N116 WeakPolarHBondContact O-CB 3.36Å; E113-N116 PolarHBondContact O-N 3.19Å; E113-E117 PolarHBondContact O-N 3.26Å
114S84.6Confident75.8Confident25 Ų2564.5 Ų64.518%0.17538%0.382CS..Hα-helixtrans-63.2-36.3176.467.10000111.6K91 D108 V109 S111 N116 E117 D118K91-S114 PolarHBondContact NZ-OG 3.01Å; D108-S114 VanDerWaalsContact O-CB 3.28Å; D108-S114 WeakPolarHBondContact O-CB 3.35Å; D108-S114 PolarHBondContact O-OG 3.39Å; V109-S114 PolarHBondContact O-OG 3.04Å; S111-S114 PolarHBondContact O-N 3.23Å; S111-S114 PolarHBondContact O-OG 3.27Å; S111-S114 VanDerWaalsContact O-OG 3.09Å; S114-N116 VanDerWaalsContact C-N 3.28Å; S114-N116 PolarHBondContact O-N 2.97Å; S114-E117 WeakPolarHBondContact O-CB 3.46Å; S114-E117 PolarHBondContact O-N 2.99Å; S114-E117 VanDerWaalsContact O-N 3.07Å; S114-D118 PolarHBondContact O-N 3.27Å; S114-D118 VanDerWaalsContact O-OD2 3.1Å
115F86.8Confident77.5Confident1 Ų163.9 Ų63.90%0.00437%0.371CS..Hα-helixtrans-65.6-27.5172.9-174.7-115.7000113.7L84 L87 I88 K91 S111 E113 E117 D118 I119 I147 R151 L154L84-F115 HydrophobicContact CD1-CE2 3.64Å; L84-F115 HydrophobicContact CD1-CZ 3.83Å; L84-F115 HydrophobicContact CG-CE2 4.43Å; L84-F115 HydrophobicContact CG-CZ 4.25Å; L87-F115 HydrophobicContact CD2-CD2 3.7Å; L87-F115 HydrophobicContact CD2-CE2 3.79Å; I88-F115 HydrophobicContact CB-CD2 4.34Å; I88-F115 HydrophobicContact CB-CE1 4.35Å; I88-F115 HydrophobicContact CB-CE2 3.61Å; I88-F115 HydrophobicContact CB-CZ 3.63Å; I88-F115 HydrophobicContact CD1-CD1 3.96Å; I88-F115 HydrophobicContact CD1-CE1 3.25Å; I88-F115 HydrophobicContact CD1-CE2 4.12Å; I88-F115 HydrophobicContact CD1-CZ 3.38Å; I88-F115 HydrophobicContact CG1-CD1 4.17Å; I88-F115 HydrophobicContact CG1-CD2 4.17Å; I88-F115 HydrophobicContact CG1-CE1 3.75Å; I88-F115 HydrophobicContact CG1-CE2 3.77Å; I88-F115 HydrophobicContact CG1-CG 4.38Å; I88-F115 HydrophobicContact CG1-CZ 3.56Å; K91-F115 HydrophobicContact CD-CB 3.98Å; K91-F115 HydrophobicContact CD-CD2 4.08Å; K91-F115 HydrophobicContact CD-CG 4.39Å; S111-F115 PolarHBondContact O-N 3.4Å; E113-F115 VanDerWaalsContact C-N 3.28Å; E113-F115 PolarHBondContact O-N 3.02Å; F115-E117 VanDerWaalsContact C-N 3.34Å; F115-D118 HydrophobicContact CD2-CB 4.21Å; F115-D118 PolarHBondContact O-N 3.32Å; F115-I119 HydrophobicContact CD1-CD1 3.87Å; F115-I119 HydrophobicContact CD1-CG1 4.41Å; F115-I119 HydrophobicContact CE1-CD1 3.46Å; F115-I119 VanDerWaalsContact CE1-CD1 3.46Å; F115-I119 HydrophobicContact CE1-CG1 3.92Å; F115-I119 HydrophobicContact CE2-CG1 4.3Å; F115-I119 HydrophobicContact CZ-CD1 3.91Å; F115-I119 HydrophobicContact CZ-CG1 3.84Å; F115-I119 VanDerWaalsContact O-CG1 3.32Å; F115-I119 WeakPolarHBondContact O-CG1 3.46Å; F115-I119 PolarHBondContact O-N 3.36Å; F115-I147 HydrophobicContact CZ-CG2 4.47Å; F115-R151 HydrophobicContact CD1-CG 4.15Å; F115-R151 HydrophobicContact CE1-CB 4.39Å; F115-R151 HydrophobicContact CE1-CG 4.1Å; F115-L154 HydrophobicContact CB-CD2 4.17Å; F115-L154 HydrophobicContact CG-CD2 4.49Å
116N88.6Confident79.1Confident63 Ų6360 Ų6034%0.33734%0.336SS..Hα-helixtrans-69.9-32.9171.4-61.6-41.7000111.7S112 E113 S114 A120 R151S112-N116 PolarHBondContact O-N 3.49Å; S112-N116 PolarHBondContact O-ND2 2.78Å; E113-N116 WeakPolarHBondContact O-CA 3.42Å; E113-N116 WeakPolarHBondContact O-CB 3.36Å; E113-N116 PolarHBondContact O-N 3.19Å; S114-N116 VanDerWaalsContact C-N 3.28Å; S114-N116 PolarHBondContact O-N 2.97Å; N116-A120 WeakPolarHBondContact O-CB 3.45Å; N116-A120 PolarHBondContact O-N 3.47Å; N116-A120 VanDerWaalsContact O-N 3.08Å; N116-R151 PolarHBondContact OD1-NH2 3.15Å
117E90.5Very high80.4Confident137 Ų13768.5 Ų68.564%0.6436%0.357SS*.Hα-helixtrans-68.7-42.9171.1-176.8162.1-144.500111.5E113 S114 F115 I119 A120 V121E113-E117 PolarHBondContact O-N 3.26Å; S114-E117 WeakPolarHBondContact O-CB 3.46Å; S114-E117 PolarHBondContact O-N 2.99Å; S114-E117 VanDerWaalsContact O-N 3.07Å; F115-E117 VanDerWaalsContact C-N 3.34Å; E117-I119 VanDerWaalsContact C-N 3.34Å; E117-I119 PolarHBondContact O-N 3.07Å; E117-A120 CarbonylContact O-C 3.09Å; E117-A120 WeakPolarHBondContact O-CA 3.49Å; E117-A120 WeakPolarHBondContact O-CB 3.29Å; E117-A120 PolarHBondContact O-N 3.37Å; E117-V121 HydrophobicContact CG-CG2 4.44Å; E117-V121 WeakPolarHBondContact O-CG2 3.34Å; E117-V121 PolarHBondContact O-N 3Å
118D89.3Confident81.1Confident47 Ų4771.3 Ų71.325%0.25138%0.378SS..Hα-helixtrans-58.3-43.1174.2-70.1-55.7000111.8L87 K91 S114 F115 A120 V121 F122L87-D118 HydrophobicContact CD1-CB 4.24Å; L87-D118 HydrophobicContact CD2-CB 3.78Å; K91-D118 WeakPolarHBondContact CE-OD2 3.21Å; K91-D118 IonicContact NZ-OD2 3.93Å; K91-D118 PolarHBondContact NZ-OD2 3.21Å; S114-D118 PolarHBondContact O-N 3.27Å; S114-D118 VanDerWaalsContact O-OD2 3.1Å; F115-D118 HydrophobicContact CD2-CB 4.21Å; F115-D118 PolarHBondContact O-N 3.32Å; D118-A120 VanDerWaalsContact C-N 3.3Å; D118-A120 PolarHBondContact O-N 3.19Å; D118-V121 PolarHBondContact O-N 2.91Å; D118-F122 WeakPolarHBondContact O-CB 3.41Å; D118-F122 PolarHBondContact O-N 3.01Å
119I89.9Confident81.5Confident55 Ų5572 Ų7228%0.28238%0.377SS..Hα-helixtrans-57-43.5170.2-71.7164.9000111L84 F115 E117 F122 A123L84-I119 HydrophobicContact CD1-CG1 4.07Å; L84-I119 HydrophobicContact CD2-CG1 4.3Å; F115-I119 HydrophobicContact CD1-CD1 3.87Å; F115-I119 HydrophobicContact CD1-CG1 4.41Å; F115-I119 HydrophobicContact CE1-CD1 3.46Å; F115-I119 VanDerWaalsContact CE1-CD1 3.46Å; F115-I119 HydrophobicContact CE1-CG1 3.92Å; F115-I119 HydrophobicContact CE2-CG1 4.3Å; F115-I119 HydrophobicContact CZ-CD1 3.91Å; F115-I119 HydrophobicContact CZ-CG1 3.84Å; F115-I119 VanDerWaalsContact O-CG1 3.32Å; F115-I119 WeakPolarHBondContact O-CG1 3.46Å; F115-I119 PolarHBondContact O-N 3.36Å; E117-I119 VanDerWaalsContact C-N 3.34Å; E117-I119 PolarHBondContact O-N 3.07Å; I119-F122 PolarHBondContact O-N 3.03Å; I119-A123 WeakPolarHBondContact O-CB 3.2Å; I119-A123 PolarHBondContact O-N 3.23Å
120A90Very high81.4Confident41 Ų4176.3 Ų76.334%0.33939%0.389SS..Hα-helixtrans-70.8-32.4-178.400000113.1N116 E117 D118 K124N116-A120 WeakPolarHBondContact O-CB 3.45Å; N116-A120 PolarHBondContact O-N 3.47Å; N116-A120 VanDerWaalsContact O-N 3.08Å; E117-A120 CarbonylContact O-C 3.09Å; E117-A120 WeakPolarHBondContact O-CA 3.49Å; E117-A120 WeakPolarHBondContact O-CB 3.29Å; E117-A120 PolarHBondContact O-N 3.37Å; D118-A120 VanDerWaalsContact C-N 3.3Å; D118-A120 PolarHBondContact O-N 3.19Å; A120-K124 VanDerWaalsContact O-CD 3.3Å; A120-K124 WeakPolarHBondContact O-CD 3.33Å; A120-K124 WeakPolarHBondContact O-CE 3.32Å; A120-K124 WeakPolarHBondContact O-CG 3.47Å; A120-K124 PolarHBondContact O-N 3.06Å
121V89.5Confident81.3Confident77 Ų7780.1 Ų80.147%0.46741%0.414SS..Hα-helixtrans-68.9-50.4171.11730000110.1E117 D118 A123 K124 Q125E117-V121 HydrophobicContact CG-CG2 4.44Å; E117-V121 WeakPolarHBondContact O-CG2 3.34Å; E117-V121 PolarHBondContact O-N 3Å; D118-V121 PolarHBondContact O-N 2.91Å; V121-A123 VanDerWaalsContact C-N 3.33Å; V121-A123 PolarHBondContact O-N 3.16Å; V121-K124 WeakPolarHBondContact O-CB 3.39Å; V121-K124 PolarHBondContact O-N 3.31Å; V121-Q125 PolarHBondContact O-N 3.19Å
122F88.9Confident80.6Confident34 Ų3483.4 Ų83.415%0.14943%0.43CS..Hα-helixtrans-57.9-42.5177.9178.7-96.2000112.6P80 L81 P83 L84 D118 I119 K124 Q125 I126P80-F122 WeakPolarHBondContact O-CZ 3.44Å; L81-F122 HydrophobicContact CD2-CE1 3.82Å; L81-F122 HydrophobicContact CD2-CZ 4.03Å; P83-F122 HydrophobicContact CB-CE2 4.17Å; P83-F122 HydrophobicContact CG-CE2 4.43Å; L84-F122 HydrophobicContact CB-CD1 4.11Å; L84-F122 HydrophobicContact CB-CD2 4.04Å; L84-F122 HydrophobicContact CB-CE1 3.94Å; L84-F122 HydrophobicContact CB-CE2 3.87Å; L84-F122 HydrophobicContact CB-CG 4.15Å; L84-F122 HydrophobicContact CB-CZ 3.8Å; L84-F122 HydrophobicContact CD1-CB 4.36Å; L84-F122 HydrophobicContact CD1-CD1 4.45Å; L84-F122 HydrophobicContact CD1-CG 4.28Å; L84-F122 HydrophobicContact CD2-CD1 3.76Å; L84-F122 HydrophobicContact CD2-CE1 3.86Å; L84-F122 HydrophobicContact CD2-CG 4.38Å; L84-F122 HydrophobicContact CG-CD1 4.34Å; L84-F122 HydrophobicContact CG-CE1 4.47Å; D118-F122 WeakPolarHBondContact O-CB 3.41Å; D118-F122 PolarHBondContact O-N 3.01Å; I119-F122 PolarHBondContact O-N 3.03Å; F122-K124 VanDerWaalsContact C-N 3.3Å; F122-K124 PolarHBondContact O-N 2.88Å; F122-Q125 PolarHBondContact O-N 3.2Å; F122-I126 HydrophobicContact CE1-CD1 3.69Å; F122-I126 HydrophobicContact CE1-CG1 4.34Å; F122-I126 HydrophobicContact CE2-CD1 3.73Å; F122-I126 HydrophobicContact CE2-CG1 4.23Å; F122-I126 HydrophobicContact CZ-CD1 3.21Å; F122-I126 HydrophobicContact CZ-CG1 4.05Å; F122-I126 PolarHBondContact O-N 2.92Å
123A86.4Confident80.1Confident38 Ų3888.7 Ų88.731%0.31445%0.45SS..Hα-helixtrans-67.6-25.3176.300000113.7I119 V121 R127I119-A123 WeakPolarHBondContact O-CB 3.2Å; I119-A123 PolarHBondContact O-N 3.23Å; V121-A123 VanDerWaalsContact C-N 3.33Å; V121-A123 PolarHBondContact O-N 3.16Å; A123-R127 VanDerWaalsContact O-CD 3.29Å; A123-R127 WeakPolarHBondContact O-CD 3.39Å; A123-R127 WeakPolarHBondContact O-CG 3.48Å
124K85.6Confident79.6Confident143 Ų14383 Ų8362%0.62243%0.428SS*.Hα-helixtrans-73.3-44.6169.1-67.8158.9-168.1166.60110.4A120 V121 F122A120-K124 VanDerWaalsContact O-CD 3.3Å; A120-K124 WeakPolarHBondContact O-CD 3.33Å; A120-K124 WeakPolarHBondContact O-CE 3.32Å; A120-K124 WeakPolarHBondContact O-CG 3.47Å; A120-K124 PolarHBondContact O-N 3.06Å; V121-K124 WeakPolarHBondContact O-CB 3.39Å; V121-K124 PolarHBondContact O-N 3.31Å; F122-K124 VanDerWaalsContact C-N 3.3Å; F122-K124 PolarHBondContact O-N 2.88Å
125Q83.3Confident79.2Confident102 Ų10288.3 Ų88.348%0.47747%0.465SS..Hα-helixtrans-62-52.5-178.4-173.264.121.200112.4V121 F122 R127 A128 E129V121-Q125 PolarHBondContact O-N 3.19Å; F122-Q125 PolarHBondContact O-N 3.2Å; Q125-R127 VanDerWaalsContact C-N 3.29Å; Q125-R127 PolarHBondContact O-N 2.96Å; Q125-A128 WeakPolarHBondContact O-CB 3.4Å; Q125-A128 PolarHBondContact O-N 2.92Å; Q125-E129 PolarHBondContact NE2-OE2 3.12Å
126I78.9Confident79.1Confident20 Ų2091.6 Ų91.610%0.10348%0.482CS..Hα-helixtrans-65.7-32.1-176.3-65.5-161.7000112.5P80 F122 A128 E129 K130 L132P80-I126 HydrophobicContact CB-CD1 4.1Å; P80-I126 WeakPolarHBondContact O-CD1 3.2Å; F122-I126 HydrophobicContact CE1-CD1 3.69Å; F122-I126 HydrophobicContact CE1-CG1 4.34Å; F122-I126 HydrophobicContact CE2-CD1 3.73Å; F122-I126 HydrophobicContact CE2-CG1 4.23Å; F122-I126 HydrophobicContact CZ-CD1 3.21Å; F122-I126 HydrophobicContact CZ-CG1 4.05Å; F122-I126 PolarHBondContact O-N 2.92Å; I126-A128 PolarHBondContact O-N 2.8Å; I126-A128 VanDerWaalsContact O-N 3.08Å; I126-E129 PolarHBondContact O-N 3.16Å; I126-E129 VanDerWaalsContact O-N 3.1Å; I126-K130 PolarHBondContact O-N 3.4Å; I126-L132 HydrophobicContact CB-CD2 4.25Å; I126-L132 HydrophobicContact CG2-CD2 3.6Å; I126-L132 HydrophobicContact CG2-CG 3.82Å
127R71.3Confident79.1Confident214 Ų21492.6 Ų92.681%0.80849%0.492SS*.Hα-helixtrans-59.9-17.6172.9-77.1176.8-176179.43.6113.8A123 Q125A123-R127 VanDerWaalsContact O-CD 3.29Å; A123-R127 WeakPolarHBondContact O-CD 3.39Å; A123-R127 WeakPolarHBondContact O-CG 3.48Å; Q125-R127 VanDerWaalsContact C-N 3.29Å; Q125-R127 PolarHBondContact O-N 2.96Å
128A70.3Confident79.1Confident84 Ų8493.6 Ų93.669%0.69450%0.497SS*.Hα-helixtrans-92-23.2175.900000114Q125 I126Q125-A128 WeakPolarHBondContact O-CB 3.4Å; Q125-A128 PolarHBondContact O-N 2.92Å; I126-A128 PolarHBondContact O-N 2.8Å; I126-A128 VanDerWaalsContact O-N 3.08Å
129E65.8Low79.2Confident132 Ų13292.4 Ų92.462%0.61749%0.49SS*.Hα-helixtrans-122.3-28.1-160.5-65.4-163.8122.900117.8Q125 I126Q125-E129 PolarHBondContact NE2-OE2 3.12Å; I126-E129 PolarHBondContact O-N 3.16Å; I126-E129 VanDerWaalsContact O-N 3.1Å
130K64.4Low79.2Confident174 Ų17490.2 Ų90.276%0.75748%0.479SS*.SBendtrans-168.4169.6178.3-106.9133.4-170172.70114.7I126I126-K130 PolarHBondContact O-N 3.4Å
131P66.6Low79.3Confident103 Ų10392.4 Ų92.467%0.66949%0.486SS*.  trans-56.1140.7166-22.634.6000112.2F133P131-F133 VanDerWaalsContact C-N 3.3Å; P131-F133 PolarHBondContact O-N 3.35Å
132L63.4Low79.6Confident81 Ų8193.3 Ų93.342%0.42449%0.487SS..SBendtrans-71.4-19.6-178.3-86.1156.4000114.9P80 I126P80-L132 WeakPolarHBondContact CG-O 3.44Å; I126-L132 HydrophobicContact CB-CD2 4.25Å; I126-L132 HydrophobicContact CG2-CD2 3.6Å; I126-L132 HydrophobicContact CG2-CG 3.82Å
133F66.9Low79.8Confident134 Ų13491.9 Ų91.959%0.58848%0.481SS*.SBendtrans-117.3142.9-169.7-64.3-73.8000110.1P131 D140 I144P131-F133 VanDerWaalsContact C-N 3.3Å; P131-F133 PolarHBondContact O-N 3.35Å; F133-D140 WeakPolarHBondContact CB-OD2 3.31Å; F133-D140 HydrophobicContact CD1-CB 4.17Å; F133-I144 HydrophobicContact CE1-CD1 4.43Å
134S71.8Confident80.1Confident39 Ų3992.9 Ų92.927%0.27348%0.48SS..  trans-82.1177.3176.376.30000110.9H79 N136 D140H79-S134 WeakPolarHBondContact NE2-CB 3.48Å; H79-S134 PolarHBondContact NE2-OG 2.89Å; S134-N136 PolarHBondContact O-N 2.9Å; S134-N136 PolarHBondContact OG-N 3.14Å; S134-N136 VanDerWaalsContact OG-N 3.07Å; S134-N136 PolarHBondContact OG-O 3.13Å; S134-N136 VanDerWaalsContact OG-O 3.08Å; S134-D140 VanDerWaalsContact CB-OD1 3.25Å; S134-D140 WeakPolarHBondContact CB-OD1 3.44Å; S134-D140 PolarHBondContact N-OD1 3.4Å; S134-D140 PolarHBondContact N-OD2 3.37Å; S134-D140 PolarHBondContact OG-OD1 2.88Å
135S75.8Confident80.6Confident135 Ų13591.2 Ų91.294%0.94448%0.475SS*.SBendtrans-71.3-1.3169.4-50.60000113.4
136N85Confident81.2Confident71 Ų7187.9 Ų87.938%0.3847%0.465SS..  trans-123.4101.6-178.9-177.21.3000111.3S134 E138 L139 D140S134-N136 PolarHBondContact O-N 2.9Å; S134-N136 PolarHBondContact OG-N 3.14Å; S134-N136 VanDerWaalsContact OG-N 3.07Å; S134-N136 PolarHBondContact OG-O 3.13Å; S134-N136 VanDerWaalsContact OG-O 3.08Å; N136-E138 PolarHBondContact O-N 2.76Å; N136-E138 WeakPolarHBondContact OD1-CB 3.39Å; N136-E138 PolarHBondContact OD1-N 3.04Å; N136-L139 HydrophobicContact CB-CB 4.14Å; N136-L139 PolarHBondContact O-N 3.08Å; N136-D140 PolarHBondContact O-N 2.82Å; N136-D140 VanDerWaalsContact O-N 3.13Å
137P86.6Confident81.9Confident84 Ų8487.7 Ų87.755%0.54546%0.464SS..Hα-helixtrans-67.2-20.9-179.228.8-35.4000113.4N141P137-N141 WeakPolarHBondContact O-CB 3.3Å; P137-N141 PolarHBondContact O-N 2.85Å; P137-N141 PolarHBondContact O-ND2 3.26Å
138E91.4Very high83Confident157 Ų15782.5 Ų82.573%0.73445%0.449SS*.Hα-helixtrans-69.4-41.8175.7-58.6-177.9162.500110.7N136 N141 L142N136-E138 PolarHBondContact O-N 2.76Å; N136-E138 WeakPolarHBondContact OD1-CB 3.39Å; N136-E138 PolarHBondContact OD1-N 3.04Å; E138-N141 PolarHBondContact O-N 3.39Å; E138-L142 WeakPolarHBondContact O-CB 3.22Å; E138-L142 PolarHBondContact O-N 3.4Å
139L90.9Very high84.2Confident22 Ų2283.1 Ų83.112%0.11544%0.443CS..Hα-helixtrans-66.6-42.3174.3178.960.4000111.3A75 I76 N136 N141 L142 M143A75-L139 HydrophobicContact CB-CD2 4.06Å; I76-L139 HydrophobicContact CG1-CD1 3.76Å; N136-L139 HydrophobicContact CB-CB 4.14Å; N136-L139 PolarHBondContact O-N 3.08Å; L139-N141 VanDerWaalsContact C-N 3.31Å; L139-N141 PolarHBondContact O-N 3.08Å; L139-L142 PolarHBondContact O-N 3.19Å; L139-M143 HydrophobicContact CD1-CG 4.01Å; L139-M143 HydrophobicContact CD1-SD 4.49Å; L139-M143 HydrophobicContact CG-CG 4.36Å; L139-M143 WeakPolarHBondContact O-CB 3.39Å; L139-M143 VanDerWaalsContact O-CG 3.23Å; L139-M143 WeakPolarHBondContact O-CG 3.18Å; L139-M143 PolarHBondContact O-N 2.97Å
140D90.1Very high85.6Confident9 Ų978.5 Ų78.55%0.04842%0.423CS..Hα-helixtrans-57.4-45.3175.8-62.1-15.2000111.3H79 F133 S134 N136 M143 I144H79-D140 IonicContact CD2-OD1 3.92Å; H79-D140 IonicContact CE1-OD1 3.89Å; H79-D140 WeakPolarHBondContact NE2-CA 3.44Å; H79-D140 WeakPolarHBondContact NE2-CB 3.49Å; H79-D140 PolarHBondContact NE2-N 3.09Å; H79-D140 CovalentContact NE2-OD1 1.77Å; H79-D140 IonicContact NE2-OD1 2.69Å; H79-D140 PolarHBondContact NE2-OD1 3.41Å; H79-D140 IonicContact NE2-OD2 3.77Å; F133-D140 WeakPolarHBondContact CB-OD2 3.31Å; F133-D140 HydrophobicContact CD1-CB 4.17Å; S134-D140 VanDerWaalsContact CB-OD1 3.25Å; S134-D140 WeakPolarHBondContact CB-OD1 3.44Å; S134-D140 PolarHBondContact N-OD1 3.4Å; S134-D140 PolarHBondContact N-OD2 3.37Å; S134-D140 PolarHBondContact OG-OD1 2.88Å; N136-D140 PolarHBondContact O-N 2.82Å; N136-D140 VanDerWaalsContact O-N 3.13Å; D140-M143 PolarHBondContact O-N 3.34Å; D140-I144 WeakPolarHBondContact O-CD1 3.29Å; D140-I144 VanDerWaalsContact O-CG1 3.24Å; D140-I144 WeakPolarHBondContact O-CG1 3.29Å; D140-I144 PolarHBondContact O-N 2.94Å
141N93.4Very high86.9Confident88 Ų8874.4 Ų74.447%0.47140%0.403SS..Hα-helixtrans-64.9-43.4176.5-84.1-81.5000112.4P137 E138 L139 M143 I144 Q145P137-N141 WeakPolarHBondContact O-CB 3.3Å; P137-N141 PolarHBondContact O-N 2.85Å; P137-N141 PolarHBondContact O-ND2 3.26Å; E138-N141 PolarHBondContact O-N 3.39Å; L139-N141 VanDerWaalsContact C-N 3.31Å; L139-N141 PolarHBondContact O-N 3.08Å; N141-M143 PolarHBondContact O-N 3.45Å; N141-I144 PolarHBondContact O-N 2.93Å; N141-Q145 WeakPolarHBondContact O-CB 3.5Å; N141-Q145 VanDerWaalsContact O-CG 3.3Å; N141-Q145 WeakPolarHBondContact O-CG 3.36Å; N141-Q145 PolarHBondContact O-N 3.19Å
142L94.3Very high88.2Confident96 Ų9675.2 Ų75.250%0.50340%0.396SS..Hα-helixtrans-59.1-45.8176.8176.962.6000111.7E138 L139 Q145 A146E138-L142 WeakPolarHBondContact O-CB 3.22Å; E138-L142 PolarHBondContact O-N 3.4Å; L139-L142 PolarHBondContact O-N 3.19Å; L142-Q145 PolarHBondContact O-N 3.33Å; L142-A146 WeakPolarHBondContact O-CB 3.39Å; L142-A146 PolarHBondContact O-N 3.35Å
143M94.1Very high89.6Confident4 Ų475.2 Ų75.22%0.0239%0.394CS..Hα-helixtrans-64.8-41.6179.2-67.5-67.2-67.400111.8I76 H79 L81 F82 L85 L139 D140 N141 I147I76-M143 HydrophobicContact CG2-SD 4.03Å; H79-M143 HydrophobicContact CB-CE 4.09Å; H79-M143 HydrophobicContact CB-CG 4.44Å; L81-M143 HydrophobicContact CB-CB 4.26Å; L81-M143 HydrophobicContact CB-CE 4.2Å; L81-M143 HydrophobicContact CD1-CB 4.14Å; F82-M143 HydrophobicContact CB-CE 4.14Å; F82-M143 HydrophobicContact CD2-CE 4.44Å; L85-M143 HydrophobicContact CB-CE 4.07Å; L85-M143 HydrophobicContact CD2-CE 3.57Å; L85-M143 HydrophobicContact CD2-SD 3.76Å; L85-M143 HydrophobicContact CG-CE 4.47Å; L139-M143 HydrophobicContact CD1-CG 4.01Å; L139-M143 HydrophobicContact CD1-SD 4.49Å; L139-M143 HydrophobicContact CG-CG 4.36Å; L139-M143 WeakPolarHBondContact O-CB 3.39Å; L139-M143 VanDerWaalsContact O-CG 3.23Å; L139-M143 WeakPolarHBondContact O-CG 3.18Å; L139-M143 PolarHBondContact O-N 2.97Å; D140-M143 PolarHBondContact O-N 3.34Å; N141-M143 PolarHBondContact O-N 3.45Å; M143-I147 WeakPolarHBondContact O-CD1 3.47Å; M143-I147 WeakPolarHBondContact O-CG1 3.4Å; M143-I147 PolarHBondContact O-N 3.27Å; M143-I147 VanDerWaalsContact O-N 3.12Å
144I92.6Very high90.8Very high58 Ų5869 Ų6930%0.29737%0.366SS..Hα-helixtrans-63-45.7174.9-70.3166.1000111L81 F133 D140 N141 I147 Q148L81-I144 HydrophobicContact CD1-CG1 3.72Å; F133-I144 HydrophobicContact CE1-CD1 4.43Å; D140-I144 WeakPolarHBondContact O-CD1 3.29Å; D140-I144 VanDerWaalsContact O-CG1 3.24Å; D140-I144 WeakPolarHBondContact O-CG1 3.29Å; D140-I144 PolarHBondContact O-N 2.94Å; N141-I144 PolarHBondContact O-N 2.93Å; I144-I147 PolarHBondContact O-N 3.26Å; I144-Q148 HydrophobicContact CG2-CG 4.49Å; I144-Q148 WeakPolarHBondContact O-CB 3.3Å; I144-Q148 VanDerWaalsContact O-CG 3.28Å; I144-Q148 WeakPolarHBondContact O-CG 3.28Å; I144-Q148 PolarHBondContact O-N 3.18Å
145Q95.8Very high91.6Very high108 Ų10869.2 Ų69.251%0.50536%0.364SS..Hα-helixtrans-64.7-41.7178.8-72.7175.33000112N141 L142 I147 Q148 V149N141-Q145 WeakPolarHBondContact O-CB 3.5Å; N141-Q145 VanDerWaalsContact O-CG 3.3Å; N141-Q145 WeakPolarHBondContact O-CG 3.36Å; N141-Q145 PolarHBondContact O-N 3.19Å; L142-Q145 PolarHBondContact O-N 3.33Å; Q145-I147 PolarHBondContact O-N 2.8Å; Q145-Q148 PolarHBondContact O-N 3.46Å; Q145-V149 WeakPolarHBondContact O-CG2 3.14Å; Q145-V149 PolarHBondContact O-N 2.97Å
146A96Very high92.4Very high32 Ų3267.1 Ų67.126%0.26434%0.34SS..Hα-helixtrans-60.7-45.5176.700000112.1L85 L142 Q148 V149 L150L85-A146 HydrophobicContact CD1-CB 3.78Å; L142-A146 WeakPolarHBondContact O-CB 3.39Å; L142-A146 PolarHBondContact O-N 3.35Å; A146-Q148 VanDerWaalsContact C-N 3.35Å; A146-Q148 PolarHBondContact O-N 3.39Å; A146-V149 PolarHBondContact O-N 3.38Å; A146-L150 WeakPolarHBondContact O-CG 3.49Å; A146-L150 PolarHBondContact O-N 3.06Å
147I94.4Very high92.7Very high17 Ų1765 Ų659%0.08733%0.328CS..Hα-helixtrans-63.6-39.9175.2-68.1163.3000111.1L81 L84 L85 I88 F115 M143 I144 Q145 R151L81-I147 HydrophobicContact CB-CD1 4.02Å; L84-I147 HydrophobicContact CB-CD1 4.32Å; L84-I147 HydrophobicContact CD2-CD1 4.21Å; L84-I147 HydrophobicContact CD2-CG2 4.38Å; L84-I147 HydrophobicContact CG-CD1 4.32Å; L85-I147 HydrophobicContact CB-CD1 4.24Å; L85-I147 HydrophobicContact CB-CG1 3.97Å; L85-I147 HydrophobicContact CD1-CG1 3.95Å; I88-I147 HydrophobicContact CD1-CG2 4.43Å; I88-I147 WeakPolarHBondContact CD1-O 3.4Å; F115-I147 HydrophobicContact CZ-CG2 4.47Å; M143-I147 WeakPolarHBondContact O-CD1 3.47Å; M143-I147 WeakPolarHBondContact O-CG1 3.4Å; M143-I147 PolarHBondContact O-N 3.27Å; M143-I147 VanDerWaalsContact O-N 3.12Å; I144-I147 PolarHBondContact O-N 3.26Å; Q145-I147 PolarHBondContact O-N 2.8Å; I147-R151 WeakPolarHBondContact O-CB 3.25Å; I147-R151 PolarHBondContact O-N 3.38Å
148Q94Very high92.7Very high104 Ų10463 Ų6349%0.48631%0.312SS..Hα-helixtrans-63.8-47.1176.5-75.2172.8-1.300112.3I144 Q145 A146 R151 F152I144-Q148 HydrophobicContact CG2-CG 4.49Å; I144-Q148 WeakPolarHBondContact O-CB 3.3Å; I144-Q148 VanDerWaalsContact O-CG 3.28Å; I144-Q148 WeakPolarHBondContact O-CG 3.28Å; I144-Q148 PolarHBondContact O-N 3.18Å; Q145-Q148 PolarHBondContact O-N 3.46Å; A146-Q148 VanDerWaalsContact C-N 3.35Å; A146-Q148 PolarHBondContact O-N 3.39Å; Q148-R151 WeakPolarHBondContact O-CB 3.33Å; Q148-R151 PolarHBondContact O-N 2.97Å; Q148-F152 WeakPolarHBondContact O-CD2 3.32Å; Q148-F152 PolarHBondContact O-N 3.35Å
149V96.1Very high92.6Very high97 Ų9761 Ų6159%0.58830%0.301SS*.Hα-helixtrans-62.4-46.1179.6170.30000111.1Q145 A146 R151 F152 H153Q145-V149 WeakPolarHBondContact O-CG2 3.14Å; Q145-V149 PolarHBondContact O-N 2.97Å; A146-V149 PolarHBondContact O-N 3.38Å; V149-R151 VanDerWaalsContact C-N 3.27Å; V149-R151 PolarHBondContact O-N 3.43Å; V149-F152 PolarHBondContact O-N 3.01Å; V149-H153 PolarHBondContact O-N 2.91Å
150L94.5Very high92.6Very high35 Ų3563.7 Ų63.718%0.18332%0.317CS..Hα-helixtrans-64.2-32.2176-69.8170.8000112L85 I88 F89 A146 H153 L154L85-L150 HydrophobicContact CD1-CD1 3.76Å; I88-L150 HydrophobicContact CD1-CB 3.87Å; I88-L150 HydrophobicContact CG1-CB 4.18Å; I88-L150 HydrophobicContact CG2-CB 3.89Å; I88-L150 HydrophobicContact CG2-CD1 3.82Å; F89-L150 HydrophobicContact CB-CD1 4.31Å; F89-L150 HydrophobicContact CD2-CD1 4.34Å; A146-L150 WeakPolarHBondContact O-CG 3.49Å; A146-L150 PolarHBondContact O-N 3.06Å; L150-H153 PolarHBondContact O-N 3.43Å; L150-L154 PolarHBondContact O-N 3.01Å
151R92.2Very high92.4Very high88 Ų8865.3 Ų65.333%0.33233%0.325SS..Hα-helixtrans-67.9-37.2174.7-168175.2-179.7-94.62.8112.4I88 F115 N116 I147 Q148 V149 L155I88-R151 HydrophobicContact CD1-CB 3.67Å; I88-R151 HydrophobicContact CD1-CG 4.45Å; I88-R151 VanDerWaalsContact CD1-N 3.27Å; F115-R151 HydrophobicContact CD1-CG 4.15Å; F115-R151 HydrophobicContact CE1-CB 4.39Å; F115-R151 HydrophobicContact CE1-CG 4.1Å; N116-R151 PolarHBondContact OD1-NH2 3.15Å; I147-R151 WeakPolarHBondContact O-CB 3.25Å; I147-R151 PolarHBondContact O-N 3.38Å; Q148-R151 WeakPolarHBondContact O-CB 3.33Å; Q148-R151 PolarHBondContact O-N 2.97Å; V149-R151 VanDerWaalsContact C-N 3.27Å; V149-R151 PolarHBondContact O-N 3.43Å; R151-L155 WeakPolarHBondContact O-CD1 3.01Å; R151-L155 WeakPolarHBondContact O-CG 3.24Å; R151-L155 PolarHBondContact O-N 3.05Å
152F93.3Very high92.1Very high121 Ų12167.3 Ų67.353%0.53133%0.331SS..Hα-helixtrans-66.1-40.8170.8-76.3-67.8000111.6Q148 V149 L155 E156Q148-F152 WeakPolarHBondContact O-CD2 3.32Å; Q148-F152 PolarHBondContact O-N 3.35Å; V149-F152 PolarHBondContact O-N 3.01Å; F152-L155 WeakPolarHBondContact O-CB 3.11Å; F152-L155 PolarHBondContact O-N 3.43Å; F152-E156 WeakPolarHBondContact O-CG 3.24Å; F152-E156 PolarHBondContact O-N 3.29Å
153H92.9Very high91.8Very high81 Ų8168.9 Ų68.938%0.37534%0.339SS..Hα-helixtrans-64.3-42.6178-166.349.4000112.6V149 L150 L155 E156 L157V149-H153 PolarHBondContact O-N 2.91Å; L150-H153 PolarHBondContact O-N 3.43Å; H153-L155 VanDerWaalsContact C-N 3.3Å; H153-L155 PolarHBondContact O-N 3.07Å; H153-E156 IonicContact ND1-OE2 3.66Å; H153-E156 WeakPolarHBondContact O-CB 3.45Å; H153-E156 PolarHBondContact O-N 3.44Å; H153-L157 WeakPolarHBondContact O-CG 3.44Å; H153-L157 PolarHBondContact O-N 3.2Å
154L91.2Very high91.5Very high2 Ų271.8 Ų71.81%0.0136%0.359CS..Hα-helixtrans-60.1-40.2174.9-168.665.5000111.8K91 A95 C110 F115 L150 E156 L157 E158K91-L154 HydrophobicContact CB-CD1 4.2Å; K91-L154 HydrophobicContact CB-CD2 4.17Å; K91-L154 HydrophobicContact CD-CD2 4.28Å; A95-L154 HydrophobicContact CB-CD1 4.04Å; C110-L154 WeakPolarHBondContact O-CD1 3.45Å; F115-L154 HydrophobicContact CB-CD2 4.17Å; F115-L154 HydrophobicContact CG-CD2 4.49Å; L150-L154 PolarHBondContact O-N 3.01Å; L154-E156 VanDerWaalsContact C-N 3.27Å; L154-E156 PolarHBondContact O-N 2.88Å; L154-L157 PolarHBondContact O-N 3.28Å; L154-E158 WeakPolarHBondContact O-CB 3.38Å; L154-E158 PolarHBondContact O-N 3.07Å
155L90.1Very high91.2Very high44 Ų4472.1 Ų72.123%0.2336%0.362CS..Hα-helixtrans-67.5-20.5173.5-77.7164.8000114S112 R151 F152 H153 K159S112-L155 VanDerWaalsContact CB-CD2 3.41Å; S112-L155 VanDerWaalsContact OG-CD2 3.32Å; S112-L155 WeakPolarHBondContact OG-CD2 3.32Å; R151-L155 WeakPolarHBondContact O-CD1 3.01Å; R151-L155 WeakPolarHBondContact O-CG 3.24Å; R151-L155 PolarHBondContact O-N 3.05Å; F152-L155 WeakPolarHBondContact O-CB 3.11Å; F152-L155 PolarHBondContact O-N 3.43Å; H153-L155 VanDerWaalsContact C-N 3.3Å; H153-L155 PolarHBondContact O-N 3.07Å; L155-K159 WeakPolarHBondContact O-CD 3.47Å; L155-K159 VanDerWaalsContact O-CE 3.24Å; L155-K159 WeakPolarHBondContact O-CE 3.49Å; L155-K159 VanDerWaalsContact O-CG 3.31Å; L155-K159 WeakPolarHBondContact O-CG 3.46Å
156E92.2Very high90.9Very high92 Ų9271.6 Ų71.643%0.4336%0.362SS..Hα-helixtrans-83.6-42.1172.8-72.6176.1162.200111.3F152 H153 L154 E158 K159 V160F152-E156 WeakPolarHBondContact O-CG 3.24Å; F152-E156 PolarHBondContact O-N 3.29Å; H153-E156 IonicContact ND1-OE2 3.66Å; H153-E156 WeakPolarHBondContact O-CB 3.45Å; H153-E156 PolarHBondContact O-N 3.44Å; L154-E156 VanDerWaalsContact C-N 3.27Å; L154-E156 PolarHBondContact O-N 2.88Å; E156-E158 VanDerWaalsContact C-N 3.32Å; E156-E158 PolarHBondContact O-N 2.77Å; E156-K159 PolarHBondContact O-N 2.91Å; E156-V160 WeakPolarHBondContact O-CG2 3.47Å; E156-V160 PolarHBondContact O-N 2.88Å
157L89.8Confident90.6Very high25 Ų2576.2 Ų76.213%0.13138%0.377CS..Hα-helixtrans-60.3-41.5173.6-65.7172.2000111.5A95 T96 H153 L154 K159 V160 H161A95-L157 HydrophobicContact CB-CB 4.28Å; A95-L157 HydrophobicContact CB-CD1 3.81Å; T96-L157 HydrophobicContact CG2-CD1 3.84Å; T96-L157 HydrophobicContact CG2-CD2 4.02Å; H153-L157 WeakPolarHBondContact O-CG 3.44Å; H153-L157 PolarHBondContact O-N 3.2Å; L154-L157 PolarHBondContact O-N 3.28Å; L157-K159 PolarHBondContact O-N 3.49Å; L157-V160 WeakPolarHBondContact O-CB 3.42Å; L157-V160 PolarHBondContact O-N 3.18Å; L157-V160 VanDerWaalsContact O-N 3.11Å; L157-H161 PolarHBondContact O-N 3.36Å
158E87.9Confident90.3Very high44 Ų4478.2 Ų78.221%0.20639%0.392CS..Hα-helixtrans-57.6-45.3175.3-174.2160.1-130.400112.4S111 S112 L154 E156 V160 H161 E162S111-E158 WeakPolarHBondContact CA-OE1 3.43Å; S111-E158 WeakPolarHBondContact CB-OE1 3.47Å; S111-E158 PolarHBondContact OG-OE1 3.49Å; S112-E158 WeakPolarHBondContact CB-OE2 3.34Å; S112-E158 PolarHBondContact N-OE1 3.45Å; S112-E158 PolarHBondContact N-OE2 3.32Å; S112-E158 VanDerWaalsContact N-OE2 3.13Å; S112-E158 PolarHBondContact OG-OE2 2.96Å; L154-E158 WeakPolarHBondContact O-CB 3.38Å; L154-E158 PolarHBondContact O-N 3.07Å; E156-E158 VanDerWaalsContact C-N 3.32Å; E156-E158 PolarHBondContact O-N 2.77Å; E158-V160 VanDerWaalsContact C-N 3.34Å; E158-V160 PolarHBondContact O-N 3.37Å; E158-H161 WeakPolarHBondContact O-CB 3.31Å; E158-H161 PolarHBondContact O-N 3.41Å; E158-E162 PolarHBondContact O-N 3.02Å
159K89.4Confident90Very high115 Ų11580 Ų8050%0.540%0.4SS..Hα-helixtrans-64.2-36.2174.4-64.7163.2-166.5161.90112.6L155 E156 L157 H161 E162 L163L155-K159 WeakPolarHBondContact O-CD 3.47Å; L155-K159 VanDerWaalsContact O-CE 3.24Å; L155-K159 WeakPolarHBondContact O-CE 3.49Å; L155-K159 VanDerWaalsContact O-CG 3.31Å; L155-K159 WeakPolarHBondContact O-CG 3.46Å; E156-K159 PolarHBondContact O-N 2.91Å; L157-K159 PolarHBondContact O-N 3.49Å; K159-H161 VanDerWaalsContact C-N 3.32Å; K159-E162 PolarHBondContact O-N 3.07Å; K159-L163 WeakPolarHBondContact O-CG 3.45Å; K159-L163 PolarHBondContact O-N 3.31Å; K159-L163 VanDerWaalsContact O-N 3.11Å
160V90.9Very high89.7Confident77 Ų7783.1 Ų83.147%0.46740%0.401SS..Hα-helixtrans-64.7-40.5175.1171.60000110.1E156 L157 E158 L163 C164E156-V160 WeakPolarHBondContact O-CG2 3.47Å; E156-V160 PolarHBondContact O-N 2.88Å; L157-V160 WeakPolarHBondContact O-CB 3.42Å; L157-V160 PolarHBondContact O-N 3.18Å; L157-V160 VanDerWaalsContact O-N 3.11Å; E158-V160 VanDerWaalsContact C-N 3.34Å; E158-V160 PolarHBondContact O-N 3.37Å; V160-L163 PolarHBondContact O-N 3.17Å; V160-C164 PolarHBondContact O-N 2.89Å; V160-C164 PolarHBondContact O-SG 3.12Å; V160-C164 VanDerWaalsContact O-SG 3.37Å
161H85.5Confident89.5Confident43 Ų4387.8 Ų87.820%0.19942%0.417CS..Hα-helixtrans-65.3-42.8175-63.7166.8000112.6A95 L157 E158 K159 L163 C164 D165A95-H161 PolarHBondContact O-CE1 3.31Å; A95-H161 PolarHBondContact O-NE2 3.13Å; L157-H161 PolarHBondContact O-N 3.36Å; E158-H161 WeakPolarHBondContact O-CB 3.31Å; E158-H161 PolarHBondContact O-N 3.41Å; K159-H161 VanDerWaalsContact C-N 3.32Å; H161-L163 VanDerWaalsContact C-N 3.29Å; H161-L163 PolarHBondContact O-N 3.5Å; H161-C164 PolarHBondContact O-N 3.11Å; H161-D165 WeakPolarHBondContact O-CB 3.3Å; H161-D165 PolarHBondContact O-N 2.83Å
162E87.3Confident89.3Confident131 Ų13187.7 Ų87.761%0.61242%0.422SS*.Hα-helixtrans-56.2-42.2172.5-70.3-170.1138.700112.5E158 K159 N166E158-E162 PolarHBondContact O-N 3.02Å; K159-E162 PolarHBondContact O-N 3.07Å; E162-N166 VanDerWaalsContact O-CB 3.26Å; E162-N166 WeakPolarHBondContact O-CB 3.42Å; E162-N166 PolarHBondContact O-N 2.94Å
163L87.9Confident89.1Confident129 Ų12985.2 Ų85.268%0.67542%0.42SS*.Hα-helixtrans-68.3-40.6178.9-71.1171.1000112.3K159 V160 H161 F167K159-L163 WeakPolarHBondContact O-CG 3.45Å; K159-L163 PolarHBondContact O-N 3.31Å; K159-L163 VanDerWaalsContact O-N 3.11Å; V160-L163 PolarHBondContact O-N 3.17Å; H161-L163 VanDerWaalsContact C-N 3.29Å; H161-L163 PolarHBondContact O-N 3.5Å; L163-F167 WeakPolarHBondContact O-CB 3.47Å; L163-F167 PolarHBondContact O-N 2.6Å
164C88.3Confident88.8Confident65 Ų6584.5 Ų84.544%0.43942%0.423SS..Hα-helixtrans-62.4-48173.7-74.30000111.5V160 H161 N166 F167 C168V160-C164 PolarHBondContact O-N 2.89Å; V160-C164 PolarHBondContact O-SG 3.12Å; V160-C164 VanDerWaalsContact O-SG 3.37Å; H161-C164 PolarHBondContact O-N 3.11Å; C164-N166 PolarHBondContact O-N 3.21Å; C164-F167 WeakPolarHBondContact O-CB 3.46Å; C164-F167 PolarHBondContact O-N 3.35Å; C164-C168 WeakPolarHBondContact O-CB 3.42Å; C164-C168 PolarHBondContact O-N 3.07Å; C164-C168 PolarHBondContact O-SG 3.37Å; C164-C168 VanDerWaalsContact O-SG 3.36Å
165D85.6Confident88.7Confident65 Ų6587.9 Ų87.935%0.34844%0.441SS..Hα-helixtrans-66.2-39.5179.6-74.2-6.6000111.7R100 H161 F167 C168 H169R100-D165 IonicContact CZ-OD2 3.9Å; R100-D165 IonicContact NE-OD2 2.64Å; R100-D165 IonicContact NH1-OD2 1.77Å; R100-D165 PolarHBondContact NH1-OD2 3.43Å; H161-D165 WeakPolarHBondContact O-CB 3.3Å; H161-D165 PolarHBondContact O-N 2.83Å; D165-F167 VanDerWaalsContact C-N 3.33Å; D165-F167 PolarHBondContact O-N 3.11Å; D165-C168 PolarHBondContact O-N 3.48Å; D165-H169 VanDerWaalsContact O-CB 3.24Å; D165-H169 WeakPolarHBondContact O-CB 3.4Å; D165-H169 PolarHBondContact O-N 2.89Å
166N88.8Confident88.3Confident96 Ų9694 Ų9451%0.51347%0.466SS..Hα-helixtrans-62.1-41.3174.1-164-86.4000111.7E162 C164 R170E162-N166 VanDerWaalsContact O-CB 3.26Å; E162-N166 WeakPolarHBondContact O-CB 3.42Å; E162-N166 PolarHBondContact O-N 2.94Å; C164-N166 PolarHBondContact O-N 3.21Å; N166-R170 VanDerWaalsContact O-CB 3.3Å; N166-R170 WeakPolarHBondContact O-CB 3.44Å; N166-R170 WeakPolarHBondContact O-CD 3.28Å; N166-R170 WeakPolarHBondContact O-CG 3.41Å; N166-R170 PolarHBondContact O-N 3.07Å; N166-R170 VanDerWaalsContact O-N 3.09Å; N166-R170 VanDerWaalsContact OD1-CD 3.23Å; N166-R170 WeakPolarHBondContact OD1-CD 3.36Å
167F91.4Very high87.7Confident130 Ų13092.8 Ų92.857%0.5748%0.478SS*.Hα-helixtrans-62.9-51.4174.2173.1-95.3000111.5L163 C164 D165 R170 Y171L163-F167 WeakPolarHBondContact O-CB 3.47Å; L163-F167 PolarHBondContact O-N 2.6Å; C164-F167 WeakPolarHBondContact O-CB 3.46Å; C164-F167 PolarHBondContact O-N 3.35Å; D165-F167 VanDerWaalsContact C-N 3.33Å; D165-F167 PolarHBondContact O-N 3.11Å; F167-R170 PolarHBondContact O-N 3.02Å; F167-Y171 VanDerWaalsContact O-CB 3.27Å; F167-Y171 WeakPolarHBondContact O-CB 3.45Å; F167-Y171 PolarHBondContact O-N 2.98Å
168C87.8Confident87Confident59 Ų5999.5 Ų99.540%0.39951%0.507SS..Hα-helixtrans-59.7-48.9179.6-73.90000111.9C164 D165 R170 Y171 I172C164-C168 WeakPolarHBondContact O-CB 3.42Å; C164-C168 PolarHBondContact O-N 3.07Å; C164-C168 PolarHBondContact O-SG 3.37Å; C164-C168 VanDerWaalsContact O-SG 3.36Å; D165-C168 PolarHBondContact O-N 3.48Å; C168-R170 PolarHBondContact O-N 3.49Å; C168-Y171 PolarHBondContact O-N 3.18Å; C168-Y171 VanDerWaalsContact O-N 3.17Å; C168-I172 WeakPolarHBondContact O-CB 3.25Å; C168-I172 VanDerWaalsContact O-CG1 3.28Å; C168-I172 WeakPolarHBondContact O-CG1 3.28Å; C168-I172 PolarHBondContact O-N 2.85Å
169H87.4Confident86Confident141 Ų141103 Ų10365%0.65352%0.524SS*.Hα-helixtrans-58-47.6177.2-175.8100.7000111.7D165 Y171 S173D165-H169 VanDerWaalsContact O-CB 3.24Å; D165-H169 WeakPolarHBondContact O-CB 3.4Å; D165-H169 PolarHBondContact O-N 2.89Å; H169-Y171 VanDerWaalsContact C-N 3.34Å; H169-Y171 PolarHBondContact O-N 3.48Å; H169-S173 VanDerWaalsContact O-CB 3.22Å; H169-S173 WeakPolarHBondContact O-CB 3.4Å; H169-S173 PolarHBondContact O-N 3.21Å
170R88.9Confident84.5Confident162 Ų162100.9 Ų100.961%0.61152%0.522SS*.Hα-helixtrans-62.9-39.2175.9-77.2169.345.7153.2-4.6112.7N166 F167 C168 C174N166-R170 VanDerWaalsContact O-CB 3.3Å; N166-R170 WeakPolarHBondContact O-CB 3.44Å; N166-R170 WeakPolarHBondContact O-CD 3.28Å; N166-R170 WeakPolarHBondContact O-CG 3.41Å; N166-R170 PolarHBondContact O-N 3.07Å; N166-R170 VanDerWaalsContact O-N 3.09Å; N166-R170 VanDerWaalsContact OD1-CD 3.23Å; N166-R170 WeakPolarHBondContact OD1-CD 3.36Å; F167-R170 PolarHBondContact O-N 3.02Å; C168-R170 PolarHBondContact O-N 3.49Å; R170-C174 VanDerWaalsContact O-CB 3.28Å; R170-C174 WeakPolarHBondContact O-CB 3.13Å; R170-C174 PolarHBondContact O-N 3.09Å; R170-C174 PolarHBondContact O-SG 2.59Å
171Y91.3Very high83.1Confident133 Ų133102.9 Ų102.952%0.52253%0.529SS..Hα-helixtrans-67.8-48.8-179.6-176-113.3000110.9F167 C168 H169 S173 C174 L175F167-Y171 VanDerWaalsContact O-CB 3.27Å; F167-Y171 WeakPolarHBondContact O-CB 3.45Å; F167-Y171 PolarHBondContact O-N 2.98Å; C168-Y171 PolarHBondContact O-N 3.18Å; C168-Y171 VanDerWaalsContact O-N 3.17Å; H169-Y171 VanDerWaalsContact C-N 3.34Å; H169-Y171 PolarHBondContact O-N 3.48Å; Y171-S173 PolarHBondContact O-N 3.35Å; Y171-C174 CarbonylContact O-C 3.51Å; Y171-C174 WeakPolarHBondContact O-CA 3.32Å; Y171-C174 WeakPolarHBondContact O-CB 3.39Å; Y171-C174 PolarHBondContact O-N 2.97Å; Y171-C174 VanDerWaalsContact O-N 3.12Å; Y171-L175 HydrophobicContact CD1-CD1 3.96Å; Y171-L175 HydrophobicContact CE1-CD1 3.56Å; Y171-L175 HydrophobicContact CE1-CG 4.32Å; Y171-L175 WeakPolarHBondContact O-CG 3.46Å; Y171-L175 PolarHBondContact O-N 3.13Å
172I88.3Confident81.7Confident86 Ų86106.5 Ų106.544%0.44155%0.55SS..Hα-helixtrans-59.6-44.6174.5-66.4164.5000110.8C168 C174 L175 K176C168-I172 WeakPolarHBondContact O-CB 3.25Å; C168-I172 VanDerWaalsContact O-CG1 3.28Å; C168-I172 WeakPolarHBondContact O-CG1 3.28Å; C168-I172 PolarHBondContact O-N 2.85Å; I172-C174 VanDerWaalsContact C-N 3.33Å; I172-C174 PolarHBondContact O-N 3.39Å; I172-L175 PolarHBondContact O-N 2.65Å; I172-K176 HydrophobicContact CG2-CD 4.13Å; I172-K176 HydrophobicContact CG2-CG 4.38Å; I172-K176 WeakPolarHBondContact O-CB 3.42Å; I172-K176 WeakPolarHBondContact O-CG 3.07Å; I172-K176 PolarHBondContact O-N 2.9Å
173S88.4Confident80.2Confident69 Ų69107 Ų10748%0.48356%0.556SS.*Hα-helixtrans-59.3-42.8174.2-177.40000111.9H169 Y171 L175 G177H169-S173 VanDerWaalsContact O-CB 3.22Å; H169-S173 WeakPolarHBondContact O-CB 3.4Å; H169-S173 PolarHBondContact O-N 3.21Å; Y171-S173 PolarHBondContact O-N 3.35Å; S173-L175 VanDerWaalsContact C-N 3.34Å; S173-L175 PolarHBondContact O-N 3.17Å; S173-G177 PolarHBondContact O-N 3.16Å
174C87.1Confident78.7Confident67 Ų67106 Ų10645%0.45356%0.555SS.*Hα-helixtrans-69.6-24.9175.7-75.30000114.2R170 Y171 I172 K178R170-C174 VanDerWaalsContact O-CB 3.28Å; R170-C174 WeakPolarHBondContact O-CB 3.13Å; R170-C174 PolarHBondContact O-N 3.09Å; R170-C174 PolarHBondContact O-SG 2.59Å; Y171-C174 CarbonylContact O-C 3.51Å; Y171-C174 WeakPolarHBondContact O-CA 3.32Å; Y171-C174 WeakPolarHBondContact O-CB 3.39Å; Y171-C174 PolarHBondContact O-N 2.97Å; Y171-C174 VanDerWaalsContact O-N 3.12Å; I172-C174 VanDerWaalsContact C-N 3.33Å; I172-C174 PolarHBondContact O-N 3.39Å; C174-K178 WeakPolarHBondContact O-CB 3.48Å; C174-K178 VanDerWaalsContact O-CD 3.23Å; C174-K178 WeakPolarHBondContact O-CD 3.15Å; C174-K178 WeakPolarHBondContact O-CG 3.01Å
175L87.9Confident77.1Confident73 Ų73109.3 Ų109.338%0.38257%0.567SS.*Hα-helixtrans-78.8-51172.4-72.7175.1000110.8Y171 I172 S173 G177 K178 M179Y171-L175 HydrophobicContact CD1-CD1 3.96Å; Y171-L175 HydrophobicContact CE1-CD1 3.56Å; Y171-L175 HydrophobicContact CE1-CG 4.32Å; Y171-L175 WeakPolarHBondContact O-CG 3.46Å; Y171-L175 PolarHBondContact O-N 3.13Å; I172-L175 PolarHBondContact O-N 2.65Å; S173-L175 VanDerWaalsContact C-N 3.34Å; S173-L175 PolarHBondContact O-N 3.17Å; L175-G177 PolarHBondContact O-N 3.42Å; L175-K178 PolarHBondContact O-N 3.09Å; L175-M179 PolarHBondContact O-N 3.27Å
176K82Confident75.5Confident171 Ų171113.2 Ų113.274%0.74359%0.588SS**Hα-helixtrans-56.3-35.6176-72.6-175.9175.8-1740112.3I172 K178I172-K176 HydrophobicContact CG2-CD 4.13Å; I172-K176 HydrophobicContact CG2-CG 4.38Å; I172-K176 WeakPolarHBondContact O-CB 3.42Å; I172-K176 WeakPolarHBondContact O-CG 3.07Å; I172-K176 PolarHBondContact O-N 2.9Å; K176-K178 VanDerWaalsContact C-N 3.32Å; K176-K178 PolarHBondContact O-N 3.37Å
177G79.3Confident73.8Confident68 Ų68116.5 Ų116.570%0.70161%0.605SS**THydrogen-bonded Turntrans-83.711.1174.400000116.2S173 L175S173-G177 PolarHBondContact O-N 3.16Å; L175-G177 PolarHBondContact O-N 3.42Å
178K74.8Confident71.9Confident166 Ų166122.2 Ų122.272%0.72262%0.623SS**THydrogen-bonded Turntrans-136.8-23.4179.4-74-179.5-167.8170.70114.9C174 L175 K176C174-K178 WeakPolarHBondContact O-CB 3.48Å; C174-K178 VanDerWaalsContact O-CD 3.23Å; C174-K178 WeakPolarHBondContact O-CD 3.15Å; C174-K178 WeakPolarHBondContact O-CG 3.01Å; L175-K178 PolarHBondContact O-N 3.09Å; K176-K178 VanDerWaalsContact C-N 3.32Å; K176-K178 PolarHBondContact O-N 3.37Å
179M66.9Low70.1Confident117 Ų117129.2 Ų129.258%0.57665%0.65SS**SBendtrans-67.3130.8169.8-74-17265.200109.3L175 I181L175-M179 PolarHBondContact O-N 3.27Å; M179-I181 PolarHBondContact O-N 2.75Å
180P57.7Low68.1Low70 Ų70126.6 Ų126.646%0.45566%0.661SS.*  trans-59.3134.6166.1-20.132.7000109.5D182P180-D182 PolarHBondContact O-N 3.38Å
181I61.8Low65.7Low120 Ų120122.5 Ų122.562%0.61567%0.67SS**G310 helixtrans-68.2-25.3177.3-148.174000110.9M179 L183 V184M179-I181 PolarHBondContact O-N 2.75Å; I181-L183 PolarHBondContact O-N 2.96Å; I181-V184 PolarHBondContact O-N 2.84Å
182D57.3Low63.2Low118 Ų118122 Ų12263%0.63169%0.685SS**G310 helixtrans-66.4-17.8-173.4-39.4-62.7000113.2P180 V184P180-D182 PolarHBondContact O-N 3.38Å; D182-V184 VanDerWaalsContact C-N 3.28Å; D182-V184 PolarHBondContact O-N 3.04Å
183L55.6Low61.1Low142 Ų142128 Ų12874%0.74371%0.708SS**G310 helixtrans-85.14.7174.7-78.6168.5000113.8I181I181-L183 PolarHBondContact O-N 2.96Å
184V57.1Low58.5Low108 Ų108130.3 Ų130.366%0.65572%0.724SS**SBendtrans-122.7-4.1-178.1-165.90000111.9I181 D182I181-V184 PolarHBondContact O-N 2.84Å; D182-V184 VanDerWaalsContact C-N 3.28Å; D182-V184 PolarHBondContact O-N 3.04Å
185I54.6Low56.3Low134 Ų134134.6 Ų134.669%0.68774%0.743SS**  trans-136.362.7-178.2-41.8179.9000110.5
186D52Low53.6Low147 Ų147138.9 Ų138.979%0.78677%0.766SS**  trans-135.670.6173.5-158.4-24000110
187D52.7Low51.8Low166 Ų166139.1 Ų139.189%0.88877%0.77SS**SBendtrans-16818167.2-125.6-27.8000115.1
188R52Low49.8Very low249 Ų249144.1 Ų144.194%0.9478%0.775SS**SBendtrans-148.734-175.4-152.5165.5170.4153.9-1118.7
189E49.8Very low47.8Very low207 Ų207142 Ų14297%0.96777%0.77SS**SBendtrans-147.6105.3157-161.6170.117200113.2
190G44.1Very low46.3Very low86 Ų86141.7 Ų141.789%0.88778%0.775SS**  trans152.289.4169.700000115.5
191G39.7Very low45.1Very low76 Ų76148.8 Ų148.878%0.78479%0.793SS**  trans165.390171.700000117.2
192S39Very low43.8Very low122 Ų122147.8 Ų147.885%0.85380%0.797SS**  trans2.1123.6156.3-57.90000121.5
193K43.2Very low42.8Very low213 Ų213149.1 Ų149.193%0.92681%0.809SS**  trans5125.6146.3-63.3178.4174.8-1770119.3
194S34.8Very low41.6Very low117 Ų117147.2 Ų147.282%0.81881%0.813SS**  -161.3144.4118.4-1660000111
195D40.2Very low40.3Very low157 Ų157150.4 Ų150.484%0.8483%0.826SS**  trans-72.2144.1156.7-69-72.7000110
196N32.1Very low39.1Very low163 Ų163151.1 Ų151.187%0.87283%0.831SS**  trans-165.4164.3134.5-152-1.8000110.2
197E43.3Very low38.2Very low176 Ų176152.6 Ų152.682%0.82283%0.833SS**  trans-102.5165.2-166.8-60.8-172.484.800116.2
198E37.8Very low37.1Very low172 Ų172150.4 Ų150.480%0.80483%0.826SS**  trans82.7154.8150.6-113.9-158.4127.200123.9
199I33.1Very low36Very low122 Ų122143.1 Ų143.163%0.62681%0.813SS**  trans79.975.9154-67.6161.9000120.4
200T34.3Very low35.1Very low111 Ų111145.5 Ų145.568%0.68181%0.813SS**  trans66.7142.5133.863.80000124.7
201R32.8Very low34.8Very low218 Ų218148.1 Ų148.182%0.82381%0.807SS**  trans87.493.7145.2-86.6-173.7-76.2-171.1-5.2120.7
202S34.3Very low34.5Very low100 Ų100154.8 Ų154.870%0.69981%0.808SS**  107.8143.5114.8-620000119.5
203V36.2Very low34.1Very low146 Ų146154.7 Ų154.789%0.88580%0.798SS**  trans5797.3164.1-62.60000119.3
204A29.5Very low33.5Very low101 Ų101153.3 Ų153.384%0.83580%0.795SS**  trans-148.5152.2143.900000109.5
205L31.7Very low33.4Very low176 Ų176154 Ų15492%0.92179%0.789SS**  trans-70.1136.8177-135.971.2000110
206D29Very low33.1Very low148 Ų148154.1 Ų154.179%0.79179%0.79SS**  trans-73.9146.7171.6-172.7-133.2000111.5
207Q31.8Very low33.4Very low178 Ų178151.8 Ų151.883%0.83278%0.782SS**  trans-10384.1-166.4-177175.696.100110.4S209Q207-S209 PolarHBondContact O-N 3.47Å
208T31.4Very low32.9Very low120 Ų120148.1 Ų148.174%0.73678%0.782SS**  trans-63.4102.9-178.4-470000111.8W210T208-W210 PolarHBondContact O-N 3.47Å
209S28.7Very low32.7Very low96 Ų96145.6 Ų145.667%0.67178%0.783SS**  trans-61.1123.5-178.3-1800000113.2Q207 N211Q207-S209 PolarHBondContact O-N 3.47Å; S209-N211 PolarHBondContact O-N 3.02Å
210W30.7Very low32.6Very low258 Ų258146.3 Ų146.398%0.97779%0.793SS**  trans-88.371.8164.9-75.491.3000110.5T208T208-W210 PolarHBondContact O-N 3.47Å
211N37.4Very low32.5Very low140 Ų140152.4 Ų152.475%0.74980%0.804SS**  trans-154.282.4175-151.918.1000113.4S209S209-N211 PolarHBondContact O-N 3.02Å
212R33.4Very low32.5Very low216 Ų216147.8 Ų147.882%0.81581%0.805SS**  trans178.1153.1161.2-102-179.9106.3137.918.7108.5
213D29.8Very low32.4Very low120 Ų120147.1 Ų147.164%0.64281%0.814SS**  cis-131.1160.21.8-93.1-69.2000110.9
214H31.1Very low32Very low185 Ų185144 Ų14486%0.85681%0.811SS**  trans-130.3151.9145.9-165.862.7000107.9
215D33.8Very low32.1Very low131 Ų131145.8 Ų145.870%0.70181%0.812SS**  trans-64.6143.1-160.5-129.5-86000114.2
216D33.3Very low32.8Very low160 Ų160143.4 Ų143.486%0.85681%0.807SS**  trans-154.3142.4133.9-135.8-31.4000111.1
217T37.9Very low32.7Very low114 Ų114139.6 Ų139.670%0.69980%0.803SS**  trans-106.2119.8-159.7-177.20000114
218A32.9Very low33.6Very low99 Ų99136.9 Ų136.982%0.81880%0.8SS**  trans-142.790.8177.800000112
219S33Very low33.6Very low119 Ų119136 Ų13683%0.83280%0.8SS**  trans-99.8127.8174.6-81.80000111.9
220T31.4Very low33.8Very low137 Ų137137.2 Ų137.284%0.8481%0.808SS**  trans-131.9117.2171.9520000112.3
221R31.7Very low33.7Very low239 Ų239128.3 Ų128.390%0.90280%0.796SS**  trans-162.8105.7149.1-121174.3-178.4-118-2.9115.2
222S33.1Very low33.2Very low120 Ų120125.2 Ų125.284%0.83980%0.798SS**  trans46.2119.7132.3-50.60000121.7
223G32.3Very low33.1Very low86 Ų86122.9 Ų122.989%0.88780%0.796SS**  trans167.797.415000000116.2
224G27.8Very low33.3Very low80 Ų80123 Ų12383%0.82580%0.801SS**  trans122133.4161.600000117.2
225T31.9Very low33.7Very low139 Ų139119 Ų11985%0.85379%0.793SS**  trans-133.4171.4168.951.30000108
226P47Very low34Very low126 Ų126121.1 Ų121.182%0.81880%0.799SS**  cis-122.9-169.5-2.235.3-15.3000113.6
227G27.1Very low34.1Very low69 Ų69118.5 Ų118.571%0.71179%0.793SS**  trans-84.8-150.3172.700000113.9
228P51Low34.1Very low120 Ų120116.1 Ų116.178%0.77979%0.791SS**  cis-141.2-170.11243.2-24.1000116.5
229S29.5Very low34.2Very low103 Ų103119 Ų11972%0.7279%0.793SS**  trans83.2126148-62.60000123
230S34.1Very low34.5Very low120 Ų120119.9 Ų119.984%0.83979%0.788SS**  trans57.4125134.666.50000123.1
231G28.8Very low34.8Very low72 Ų72117.9 Ų117.974%0.74278%0.78SS**  121.9112.6107.600000118.8
232G26.8Very low35.4Very low75 Ų75110.3 Ų110.377%0.77376%0.763SS**  trans69.7-174.7164.600000115.9
233H30.2Very low35.6Very low167 Ų167112.1 Ų112.177%0.77376%0.759SS**  cis-174172.1-23.444.3-176.9000110.3
234T34.5Very low35.9Very low122 Ų122116.5 Ų116.575%0.74876%0.756SS**  trans75.5121.8179.374.50000114.4
235S40.6Very low36.4Very low101 Ų101116.1 Ų116.171%0.70675%0.752SS**  77140.974.3-55.10000112.5
236H39.5Very low36.8Very low175 Ų175118 Ų11881%0.8176%0.757SS**  cis-162.71636.5-118.3-158.2000106.7
237S35.8Very low36.3Very low105 Ų105115.4 Ų115.473%0.73475%0.753SS**  cis-151.3-172.12-73.60000106.7
238G36.2Very low37.1Very low64 Ų64119.8 Ų119.866%0.6676%0.76SS**  cis-172.5-175.55.300000111.5
239D35.2Very low36.3Very low159 Ų159121.3 Ų121.385%0.8576%0.761SS**  trans-66.9168.3-166.6-46.8-90.7000114.6
240N40.5Very low36.6Very low139 Ų139123.1 Ų123.174%0.74376%0.763SS**  cis-173.9143.643-174.761.7000114.6
241S38.3Very low37.1Very low94 Ų94122.4 Ų122.466%0.65776%0.758SS**  trans52.1153.3154.2-740000122.2
242S42.7Very low37.9Very low80 Ų80126 Ų12656%0.55977%0.765SS**  cis-163.8148.3-5.8-116.90000110.6
243E37.9Very low38.6Very low159 Ų159127 Ų12774%0.74377%0.766SS**  trans54.7154.5144.7-65.3157.699.700119.3
244Q39.3Very low39.2Very low177 Ų177124.9 Ų124.983%0.82777%0.77SS**  cis-155.6158.2-1.6-123.4169.630.400104.7
245G38.3Very low40.4Very low73 Ų73124.9 Ų124.975%0.75377%0.772SS**  cis176.3164.21.400000107.6
246D39.3Very low40.1Very low177 Ų177125.2 Ų125.295%0.94777%0.774SS**  trans-68.7148.5-177.4-88.9-63.2000114.1
247G37.5Very low40.6Very low72 Ų72123.6 Ų123.674%0.74278%0.777SS**  trans-161.5112.6173.700000111.5
248L42.5Very low40.7Very low161 Ų161121.9 Ų121.984%0.84378%0.776SS**  trans-93.8164.3179-69.3171.5000112
249D34.8Very low40.9Very low153 Ų153126.4 Ų126.482%0.81879%0.785SS**  trans106.5139140.698.463.7000122.8
250N35.4Very low41.3Very low141 Ų141126.4 Ų126.475%0.75479%0.785SS**  trans76.6136.5151.2-156.542.1000122.7
251S44.9Very low41.6Very low105 Ų105126.7 Ų126.773%0.73479%0.787SS**  trans-95.5138-174.5-53.10000112.4
252V46.3Very low42.2Very low147 Ų147126.4 Ų126.489%0.89178%0.778SS**  trans-137.5150.1153.6-71.90000109.5
253A41.6Very low42.7Very low96 Ų96127.5 Ų127.579%0.79378%0.783SS**  trans-118.8139.2-169.600000113.5
254S42.3Very low43.2Very low123 Ų123124.5 Ų124.586%0.8677%0.772SS**  trans-179.1162.1145.6-83.90000111.9
255P58.8Low43.7Very low121 Ų121123.2 Ų123.279%0.78676%0.764SS**  trans-110.4148.6-164.739-32000116.6
256S34.9Very low44.1Very low108 Ų108128 Ų12876%0.75577%0.767SS**  trans-164.4117.8158.4-87.90000107.5
257T49.4Very low44.7Very low141 Ų141127.4 Ų127.487%0.86576%0.756SS**  59.9117.885.665.40000115.3
258G39.3Very low45.3Very low70 Ų70132.9 Ų132.972%0.72276%0.759SS**  trans116.284.8-170.400000109
259D40.3Very low45.4Very low158 Ų158132.4 Ų132.485%0.84575%0.752SS**  7775.156-143.7-111000111.1D261D259-D261 PolarHBondContact O-N 3.3Å
260D43.8Very low45.8Very low159 Ų159132.3 Ų132.385%0.8575%0.752SS**  trans-76.4107.8174.1-69.5-79.3000110.7D262D260-D262 PolarHBondContact O-N 3.11Å; D260-D262 VanDerWaalsContact O-N 3.08Å
261D47Very low46.4Very low145 Ų145135.6 Ų135.678%0.77576%0.759SS**  trans-73.196174.8-162-69.5000110.2D259 P263D259-D261 PolarHBondContact O-N 3.3Å; D261-P263 VanDerWaalsContact O-CD 3.31Å; D261-P263 WeakPolarHBondContact O-CD 3.28Å
262D50.8Low46.7Very low88 Ų88138.6 Ų138.647%0.47176%0.759SS.*  trans-91.1103.8174170.3-117000110.3D260 D264 K265D260-D262 PolarHBondContact O-N 3.11Å; D260-D262 VanDerWaalsContact O-N 3.08Å; D262-D264 VanDerWaalsContact C-N 3.29Å; D262-D264 PolarHBondContact O-N 3.44Å; D262-K265 WeakPolarHBondContact OD1-CE 3.49Å; D262-K265 IonicContact OD1-NZ 3.78Å
263P51.7Low47.2Very low103 Ų103142.7 Ų142.767%0.66976%0.758SS**THydrogen-bonded Turntrans-78.2-2.7-166.930.5-37.1000115D261D261-P263 VanDerWaalsContact O-CD 3.31Å; D261-P263 WeakPolarHBondContact O-CD 3.28Å
264D49.9Very low48.1Very low97 Ų97142.1 Ų142.152%0.51976%0.762SS.*THydrogen-bonded Turntrans-86.8-15.7-174.9-145.1-106.4000114.3D262 E266 K267D262-D264 VanDerWaalsContact C-N 3.29Å; D262-D264 PolarHBondContact O-N 3.44Å; D264-E266 VanDerWaalsContact C-N 3.3Å; D264-E266 PolarHBondContact O-N 3.11Å; D264-K267 IonicContact OD2-NZ 3.77Å; D264-K267 PolarHBondContact OD2-NZ 3.43Å
265K49.1Very low49.9Very low150 Ų150143.5 Ų143.565%0.65276%0.758SS**G310 helixtrans-62.3-27.8-177.6-82.1167.8-171.7155.20115D262 K267 K268D262-K265 WeakPolarHBondContact OD1-CE 3.49Å; D262-K265 IonicContact OD1-NZ 3.78Å; K265-K267 VanDerWaalsContact C-N 3.26Å; K265-K267 PolarHBondContact O-N 3.46Å; K265-K268 PolarHBondContact O-N 2.97Å
266E47.5Very low51.3Low173 Ų173140.5 Ų140.581%0.80873%0.733SS**G310 helixtrans-59.5-34.1-176.3-73.4-141.8114.700113.4D264 K268D264-E266 VanDerWaalsContact C-N 3.3Å; D264-E266 PolarHBondContact O-N 3.11Å; E266-K268 PolarHBondContact O-N 3.19Å
267K50.5Low53.9Low164 Ų164139.2 Ų139.271%0.71372%0.722SS**G310 helixtrans-62.2-19.1-174.5-67.8167.1-174162.80113.7D264 K265D264-K267 IonicContact OD2-NZ 3.77Å; D264-K267 PolarHBondContact OD2-NZ 3.43Å; K265-K267 VanDerWaalsContact C-N 3.26Å; K265-K267 PolarHBondContact O-N 3.46Å
268K49.8Very low55.7Low188 Ų188141.1 Ų141.182%0.81772%0.718SS**G310 helixtrans-95-12.9-168.2-144.7164-172.7171.70115.1K265 E266K265-K268 PolarHBondContact O-N 2.97Å; E266-K268 PolarHBondContact O-N 3.19Å
269H45.2Very low58.2Low150 Ų150142.8 Ų142.869%0.69471%0.714SS**  trans-92.5-10.7-169.4-107.6-55.4000116.9K271H269-K271 PolarHBondContact O-N 3.19Å
270N44.2Very low60.8Low151 Ų151135.3 Ų135.381%0.80768%0.675SS**  trans-82.133.6-173.9-89.9-16.7000115.8K272N270-K272 PolarHBondContact O-N 3.04Å
271K47.3Very low63.1Low210 Ų210129 Ų12991%0.91364%0.642SS**  trans-88.225167.6-68.3-173.1176.6-179.60113.5H269H269-K271 PolarHBondContact O-N 3.19Å
272K51.3Low65.4Low169 Ų169127 Ų12774%0.73563%0.631SS**SBendtrans-82.4142.2167.7-67.7172.8-177.6170.30108.5N270 G274N270-K272 PolarHBondContact O-N 3.04Å; K272-G274 PolarHBondContact O-N 3.41Å
273R56.3Low67.5Low232 Ų232125.1 Ų125.188%0.87562%0.621SS**  trans-45.7133.3-171.8-68.4178.5179.7155.21.7111.9I275R273-I275 WeakPolarHBondContact O-CG1 2.82Å; R273-I275 PolarHBondContact O-N 3Å
274G61Low69.6Low85 Ų85120.2 Ų120.288%0.87659%0.589SS**  trans-53.997.5-172.200000114.2K272K272-G274 PolarHBondContact O-N 3.41Å
275I79.4Confident71.7Confident152 Ų152121 Ų12178%0.77959%0.585SS**  trans-111.4121171.1-68.6163.2000105.8R273R273-I275 WeakPolarHBondContact O-CG1 2.82Å; R273-I275 PolarHBondContact O-N 3Å
276F87.9Confident73.9Confident57 Ų57116.2 Ų116.225%0.2557%0.573CS.*  trans-62.9153.5177.7-60.6-59.9000111.2T281 M284 L311 Q315 W319F276-T281 PolarHBondContact O-OG1 3Å; F276-M284 HydrophobicContact CD2-CE 4.2Å; F276-L311 HydrophobicContact CB-CD1 4.25Å; F276-L311 HydrophobicContact CD1-CD1 3.74Å; F276-L311 HydrophobicContact CD1-CD2 3.51Å; F276-L311 HydrophobicContact CD1-CG 4.3Å; F276-L311 HydrophobicContact CD2-CD1 4.25Å; F276-L311 HydrophobicContact CE1-CD1 4.1Å; F276-L311 HydrophobicContact CE1-CD2 3.94Å; F276-L311 HydrophobicContact CG-CD1 3.83Å; F276-L311 HydrophobicContact CG-CD2 4.29Å; F276-L311 HydrophobicContact CZ-CD1 4.49Å; F276-Q315 HydrophobicContact CE1-CB 3.93Å; F276-Q315 HydrophobicContact CE1-CG 3.95Å; F276-Q315 HydrophobicContact CZ-CB 3.81Å; F276-Q315 HydrophobicContact CZ-CG 4.07Å; F276-W319 AromaticContact CD2-CD1 3.71Å; F276-W319 HydrophobicContact CE2-CB 4.24Å; F276-W319 AromaticContact CE2-CD1 3.84Å; F276-W319 HydrophobicContact CE2-CG 4.44Å
277P89.8Confident76.2Confident81 Ų81109.2 Ų109.253%0.52654%0.539SS..  trans-49147.2176.2-28.735.5000112.7V279 A280 T281P277-V279 VanDerWaalsContact C-N 3.26Å; P277-V279 PolarHBondContact O-N 3.37Å; P277-A280 HydrophobicContact CB-CB 4.18Å; P277-A280 PolarHBondContact O-N 3.31Å; P277-T281 WeakPolarHBondContact O-CB 3.48Å; P277-T281 PolarHBondContact O-N 3.15Å; P277-T281 PolarHBondContact O-OG1 3.32Å
278K88.1Confident78.3Confident181 Ų181101.4 Ų101.479%0.78751%0.505SS*.Hα-helixtrans-57.4-40.9-179.9-69.4-178-179.3175.80111.6T281 N282K278-T281 PolarHBondContact O-N 3.31Å; K278-N282 WeakPolarHBondContact O-CB 3.32Å; K278-N282 PolarHBondContact O-N 3.48Å; K278-N282 PolarHBondContact O-OD1 3.44Å
279V92.1Very high80.3Confident105 Ų10597.1 Ų97.164%0.63649%0.487SS*.Hα-helixtrans-59.6-54.7176.4-177.70000110.9P277 T281 N282 I283P277-V279 VanDerWaalsContact C-N 3.26Å; P277-V279 PolarHBondContact O-N 3.37Å; V279-T281 VanDerWaalsContact C-N 3.32Å; V279-T281 PolarHBondContact O-N 3.18Å; V279-N282 PolarHBondContact O-N 2.93Å; V279-N282 VanDerWaalsContact O-N 3.08Å; V279-I283 HydrophobicContact CG1-CD1 4.04Å; V279-I283 WeakPolarHBondContact O-CG1 3.32Å; V279-I283 PolarHBondContact O-N 3.16Å
280A93.3Very high82.6Confident2 Ų297 Ų972%0.01749%0.486CS..Hα-helixtrans-54.7-45.8176.600000112.7P277 N282 I283 M284 T309 L311P277-A280 HydrophobicContact CB-CB 4.18Å; P277-A280 PolarHBondContact O-N 3.31Å; A280-N282 VanDerWaalsContact C-N 3.34Å; A280-N282 PolarHBondContact O-N 2.94Å; A280-I283 PolarHBondContact O-N 3.17Å; A280-M284 PolarHBondContact O-N 2.81Å; A280-T309 HydrophobicContact CB-CG2 4.13Å; A280-L311 HydrophobicContact CB-CD1 4.13Å; A280-L311 HydrophobicContact CB-CG 4.34Å
281T93.8Very high84.8Confident25 Ų2592.5 Ų92.515%0.15346%0.46CS..Hα-helixtrans-65.8-35.8178.2-56.70000112.3F276 P277 K278 V279 R285 W319F276-T281 PolarHBondContact O-OG1 3Å; P277-T281 WeakPolarHBondContact O-CB 3.48Å; P277-T281 PolarHBondContact O-N 3.15Å; P277-T281 PolarHBondContact O-OG1 3.32Å; K278-T281 PolarHBondContact O-N 3.31Å; V279-T281 VanDerWaalsContact C-N 3.32Å; V279-T281 PolarHBondContact O-N 3.18Å; T281-R285 HydrophobicContact CG2-CG 4.48Å; T281-R285 WeakPolarHBondContact O-CB 3.5Å; T281-R285 WeakPolarHBondContact O-CG 3.39Å; T281-R285 PolarHBondContact O-N 3.24Å; T281-W319 HydrophobicContact CG2-CZ2 4.45Å
282N95Very high86.8Confident103 Ų10385.2 Ų85.255%0.55143%0.431SS*.Hα-helixtrans-69.5-40.5178.2-73.5-5.8000111.9K278 V279 A280 R285 A286K278-N282 WeakPolarHBondContact O-CB 3.32Å; K278-N282 PolarHBondContact O-N 3.48Å; K278-N282 PolarHBondContact O-OD1 3.44Å; V279-N282 PolarHBondContact O-N 2.93Å; V279-N282 VanDerWaalsContact O-N 3.08Å; A280-N282 VanDerWaalsContact C-N 3.34Å; A280-N282 PolarHBondContact O-N 2.94Å; N282-R285 PolarHBondContact O-N 2.95Å; N282-A286 WeakPolarHBondContact O-CB 3.22Å; N282-A286 PolarHBondContact O-N 2.99Å
283I94.4Very high88.4Confident50 Ų5083 Ų8326%0.25643%0.432SS..Hα-helixtrans-61.2-51.3175.7-66.6163.7000110.2V279 A280 R285 A286 W287 L305 D308 T309V279-I283 HydrophobicContact CG1-CD1 4.04Å; V279-I283 WeakPolarHBondContact O-CG1 3.32Å; V279-I283 PolarHBondContact O-N 3.16Å; A280-I283 PolarHBondContact O-N 3.17Å; I283-R285 VanDerWaalsContact C-N 3.31Å; I283-R285 PolarHBondContact O-N 3.49Å; I283-A286 PolarHBondContact O-N 3.32Å; I283-W287 PolarHBondContact O-N 2.95Å; I283-W287 VanDerWaalsContact O-N 3.09Å; I283-L305 HydrophobicContact CG2-CD2 3.9Å; I283-D308 HydrophobicContact CD1-CB 4.41Å; I283-D308 WeakPolarHBondContact CD1-O 3.26Å; I283-D308 HydrophobicContact CG2-CB 4.19Å; I283-T309 HydrophobicContact CB-CG2 3.92Å; I283-T309 HydrophobicContact CD1-CG2 4.22Å; I283-T309 HydrophobicContact CG2-CG2 3.84Å
284M96Very high89.9Confident0 Ų078.9 Ų78.90%042%0.422CS..Hα-helixtrans-63.3-34.8178-64.2-174.2-73.900112.7F276 A280 L288 T309 L311 V316 W319 F320F276-M284 HydrophobicContact CD2-CE 4.2Å; A280-M284 PolarHBondContact O-N 2.81Å; M284-L288 WeakPolarHBondContact O-CB 3.32Å; M284-L288 PolarHBondContact O-N 3.01Å; M284-T309 HydrophobicContact CG-CG2 4.05Å; M284-L311 HydrophobicContact CE-CD1 3.56Å; M284-L311 HydrophobicContact SD-CD1 4.16Å; M284-V316 HydrophobicContact SD-CG1 4.43Å; M284-V316 HydrophobicContact SD-CG2 4.3Å; M284-W319 HydrophobicContact CB-CD2 3.95Å; M284-W319 HydrophobicContact CB-CE3 3.63Å; M284-W319 HydrophobicContact CB-CH2 3.82Å; M284-W319 HydrophobicContact CB-CZ2 4.09Å; M284-W319 HydrophobicContact CB-CZ3 3.57Å; M284-W319 HydrophobicContact CE-CB 4.21Å; M284-W319 HydrophobicContact CE-CD2 3.89Å; M284-W319 HydrophobicContact CE-CG 3.65Å; M284-W319 HydrophobicContact CG-CE3 4.36Å; M284-W319 HydrophobicContact SD-CB 3.89Å; M284-W319 HydrophobicContact SD-CD2 3.8Å; M284-W319 HydrophobicContact SD-CE3 4.03Å; M284-W319 HydrophobicContact SD-CG 3.73Å; M284-F320 HydrophobicContact CB-CE2 4.07Å; M284-F320 HydrophobicContact CB-CZ 4.11Å; M284-F320 HydrophobicContact CG-CE2 4.09Å; M284-F320 HydrophobicContact SD-CE2 4.38Å
285R93.5Very high91.3Very high114 Ų11475.2 Ų75.243%0.4338%0.383SS..Hα-helixtrans-65.9-44172.1-79.4174.9177.7-121.50.4112.6T281 N282 I283 W287 L288 F289 W319T281-R285 HydrophobicContact CG2-CG 4.48Å; T281-R285 WeakPolarHBondContact O-CB 3.5Å; T281-R285 WeakPolarHBondContact O-CG 3.39Å; T281-R285 PolarHBondContact O-N 3.24Å; N282-R285 PolarHBondContact O-N 2.95Å; I283-R285 VanDerWaalsContact C-N 3.31Å; I283-R285 PolarHBondContact O-N 3.49Å; R285-W287 PolarHBondContact O-N 3Å; R285-L288 PolarHBondContact O-N 3.39Å; R285-F289 HydrophobicContact CB-CD2 4.26Å; R285-F289 HydrophobicContact CB-CE2 4.11Å; R285-F289 HydrophobicContact CG-CE2 4.44Å; R285-F289 WeakPolarHBondContact O-CD2 3.46Å; R285-F289 PolarHBondContact O-N 2.91Å; R285-W319 HydrophobicContact CG-CH2 3.85Å; R285-W319 HydrophobicContact CG-CZ2 3.81Å
286A95.8Very high92Very high48 Ų4875.2 Ų75.240%0.39737%0.374SS..Hα-helixtrans-59.9-47.4179.400000110.8N282 I283 L288 F289 Q290N282-A286 WeakPolarHBondContact O-CB 3.22Å; N282-A286 PolarHBondContact O-N 2.99Å; I283-A286 PolarHBondContact O-N 3.32Å; A286-L288 PolarHBondContact O-N 2.96Å; A286-F289 PolarHBondContact O-N 3.39Å; A286-Q290 VanDerWaalsContact O-CG 3.3Å; A286-Q290 WeakPolarHBondContact O-CG 3.4Å; A286-Q290 PolarHBondContact O-N 2.99Å
287W96.3Very high92.3Very high26 Ų2673.1 Ų73.110%0.09837%0.366CS..Hα-helixtrans-60.2-45.5174.1-169.699.2000111.6I283 R285 F289 Q290 H291 P297 L305 F320I283-W287 PolarHBondContact O-N 2.95Å; I283-W287 VanDerWaalsContact O-N 3.09Å; R285-W287 PolarHBondContact O-N 3Å; W287-F289 VanDerWaalsContact C-N 3.34Å; W287-F289 PolarHBondContact O-N 3.21Å; W287-Q290 PolarHBondContact O-N 3.09Å; W287-H291 AromaticContact CD1-CE1 3.78Å; W287-H291 AromaticContact CD1-ND1 3.97Å; W287-H291 AromaticContact CD2-CE1 3.97Å; W287-H291 AromaticContact CD2-ND1 3.48Å; W287-H291 AromaticContact CE2-CE1 3.46Å; W287-H291 VanDerWaalsContact CE2-CE1 3.46Å; W287-H291 AromaticContact CE2-CG 3.79Å; W287-H291 AromaticContact CE2-ND1 3.35Å; W287-H291 AromaticContact CE2-NE2 3.93Å; W287-H291 HydrophobicContact CE3-CB 4.13Å; W287-H291 AromaticContact CE3-ND1 3.9Å; W287-H291 AromaticContact CG-ND1 3.86Å; W287-H291 HydrophobicContact CH2-CB 3.65Å; W287-H291 AromaticContact CH2-CG 3.64Å; W287-H291 HydrophobicContact CZ2-CB 4.12Å; W287-H291 AromaticContact CZ2-CD2 3.69Å; W287-H291 AromaticContact CZ2-CE1 3.83Å; W287-H291 AromaticContact CZ2-CG 3.56Å; W287-H291 AromaticContact CZ2-ND1 3.65Å; W287-H291 AromaticContact CZ2-NE2 3.85Å; W287-H291 HydrophobicContact CZ3-CB 3.68Å; W287-H291 AromaticContact CZ3-CG 3.97Å; W287-H291 AromaticContact NE1-CE1 3.37Å; W287-H291 PolarHBondContact NE1-CE1 3.46Å; W287-H291 AromaticContact NE1-ND1 3.69Å; W287-H291 AromaticContact NE1-NE2 3.96Å; W287-H291 PolarHBondContact O-N 3.46Å; W287-H291 VanDerWaalsContact O-N 3.08Å; W287-H291 PolarHBondContact O-ND1 3.24Å; W287-P297 VanDerWaalsContact CH2-CA 3.48Å; W287-P297 HydrophobicContact CH2-CB 3.63Å; W287-P297 HydrophobicContact CH2-CG 4.18Å; W287-P297 HydrophobicContact CZ2-CB 3.68Å; W287-P297 HydrophobicContact CZ3-CB 4.07Å; W287-P297 HydrophobicContact CZ3-CG 4.22Å; W287-L305 HydrophobicContact CB-CD1 4.41Å; W287-L305 HydrophobicContact CB-CD2 4.06Å; W287-L305 HydrophobicContact CD2-CD1 4.15Å; W287-L305 HydrophobicContact CG-CD1 3.94Å; W287-L305 HydrophobicContact CG-CD2 4.27Å; W287-F320 HydrophobicContact CB-CZ 4.5Å; W287-F320 HydrophobicContact CD2-CE1 4.44Å; W287-F320 HydrophobicContact CD2-CZ 4.32Å; W287-F320 HydrophobicContact CE3-CD1 4.4Å; W287-F320 AromaticContact CE3-CE1 3.43Å; W287-F320 HydrophobicContact CE3-CE1 3.43Å; W287-F320 VanDerWaalsContact CE3-CE1 3.43Å; W287-F320 AromaticContact CE3-CZ 3.71Å; W287-F320 HydrophobicContact CE3-CZ 3.71Å; W287-F320 HydrophobicContact CZ3-CD1 4.39Å; W287-F320 AromaticContact CZ3-CE1 3.83Å; W287-F320 HydrophobicContact CZ3-CE1 3.83Å; W287-F320 HydrophobicContact CZ3-CZ 4.43Å
288L94.1Very high92.5Very high0 Ų072 Ų720%036%0.361CS..Hα-helixtrans-60.2-41179.3-176.966.6000112.8M284 R285 A286 H291 L292 P295 W319 F320 A323 R324 I327 V328M284-L288 WeakPolarHBondContact O-CB 3.32Å; M284-L288 PolarHBondContact O-N 3.01Å; R285-L288 PolarHBondContact O-N 3.39Å; A286-L288 PolarHBondContact O-N 2.96Å; L288-H291 CarbonylContact O-C 3.43Å; L288-H291 PolarHBondContact O-N 3.26Å; L288-L292 PolarHBondContact O-N 3.48Å; L288-P295 HydrophobicContact CD1-CB 3.6Å; L288-W319 HydrophobicContact CB-CH2 4.45Å; L288-W319 HydrophobicContact CB-CZ3 4.33Å; L288-W319 HydrophobicContact CD2-CH2 3.95Å; L288-W319 HydrophobicContact CD2-CZ3 4.07Å; L288-F320 HydrophobicContact CB-CE1 3.99Å; L288-F320 HydrophobicContact CD1-CD1 4.16Å; L288-F320 HydrophobicContact CD1-CE1 4.04Å; L288-A323 HydrophobicContact CD2-CB 3.75Å; L288-R324 HydrophobicContact CD1-CG 4.46Å; L288-I327 HydrophobicContact CD2-CD1 4.01Å; L288-V328 HydrophobicContact CD1-CG2 4.1Å
289F91.6Very high92.9Very high99 Ų9969.1 Ų69.143%0.43435%0.35SS..Hα-helixtrans-73.9-29.7179.5-71.5-55.8000113R285 A286 W287 H291 L292 I327R285-F289 HydrophobicContact CB-CD2 4.26Å; R285-F289 HydrophobicContact CB-CE2 4.11Å; R285-F289 HydrophobicContact CG-CE2 4.44Å; R285-F289 WeakPolarHBondContact O-CD2 3.46Å; R285-F289 PolarHBondContact O-N 2.91Å; A286-F289 PolarHBondContact O-N 3.39Å; W287-F289 VanDerWaalsContact C-N 3.34Å; W287-F289 PolarHBondContact O-N 3.21Å; F289-H291 VanDerWaalsContact C-N 3.31Å; F289-L292 HydrophobicContact CD1-CD1 4.3Å; F289-L292 HydrophobicContact CD1-CD2 4.12Å; F289-L292 HydrophobicContact CD1-CG 4.41Å; F289-I327 HydrophobicContact CE1-CG2 4.13Å; F289-I327 HydrophobicContact CZ-CG2 4.48Å
290Q92.9Very high93.1Very high146 Ų14669.6 Ų69.668%0.68235%0.345SS*.Hα-helixtrans-67.9-30.9170.2-71.3165.5-6.500112.4A286 W287A286-Q290 VanDerWaalsContact O-CG 3.3Å; A286-Q290 WeakPolarHBondContact O-CG 3.4Å; A286-Q290 PolarHBondContact O-N 2.99Å; W287-Q290 PolarHBondContact O-N 3.09Å
291H91.8Very high93.2Very high58 Ų5872.7 Ų72.727%0.26936%0.359SS..THydrogen-bonded Turntrans-113.734.9-173.6-58.182.2000112.9W287 L288 F289 T293 H294 P295W287-H291 AromaticContact CD1-CE1 3.78Å; W287-H291 AromaticContact CD1-ND1 3.97Å; W287-H291 AromaticContact CD2-CE1 3.97Å; W287-H291 AromaticContact CD2-ND1 3.48Å; W287-H291 AromaticContact CE2-CE1 3.46Å; W287-H291 VanDerWaalsContact CE2-CE1 3.46Å; W287-H291 AromaticContact CE2-CG 3.79Å; W287-H291 AromaticContact CE2-ND1 3.35Å; W287-H291 AromaticContact CE2-NE2 3.93Å; W287-H291 HydrophobicContact CE3-CB 4.13Å; W287-H291 AromaticContact CE3-ND1 3.9Å; W287-H291 AromaticContact CG-ND1 3.86Å; W287-H291 HydrophobicContact CH2-CB 3.65Å; W287-H291 AromaticContact CH2-CG 3.64Å; W287-H291 HydrophobicContact CZ2-CB 4.12Å; W287-H291 AromaticContact CZ2-CD2 3.69Å; W287-H291 AromaticContact CZ2-CE1 3.83Å; W287-H291 AromaticContact CZ2-CG 3.56Å; W287-H291 AromaticContact CZ2-ND1 3.65Å; W287-H291 AromaticContact CZ2-NE2 3.85Å; W287-H291 HydrophobicContact CZ3-CB 3.68Å; W287-H291 AromaticContact CZ3-CG 3.97Å; W287-H291 AromaticContact NE1-CE1 3.37Å; W287-H291 PolarHBondContact NE1-CE1 3.46Å; W287-H291 AromaticContact NE1-ND1 3.69Å; W287-H291 AromaticContact NE1-NE2 3.96Å; W287-H291 PolarHBondContact O-N 3.46Å; W287-H291 VanDerWaalsContact O-N 3.08Å; W287-H291 PolarHBondContact O-ND1 3.24Å; L288-H291 CarbonylContact O-C 3.43Å; L288-H291 PolarHBondContact O-N 3.26Å; F289-H291 VanDerWaalsContact C-N 3.31Å; H291-T293 PolarHBondContact O-N 3.24Å; H291-H294 CarbonylContact O-C 3.57Å; H291-H294 PolarHBondContact O-N 3.47Å; H291-P295 VanDerWaalsContact O-CA 3.24Å; H291-P295 WeakPolarHBondContact O-CA 3.49Å; H291-P295 WeakPolarHBondContact O-CD 3.29Å
292L87.9Confident93.3Very high57 Ų5773.4 Ų73.430%0.29836%0.36SS..SBendtrans-57.4-31.9-176.8-79.5172.1000114.5L288 F289 V328 M331L288-L292 PolarHBondContact O-N 3.48Å; F289-L292 HydrophobicContact CD1-CD1 4.3Å; F289-L292 HydrophobicContact CD1-CD2 4.12Å; F289-L292 HydrophobicContact CD1-CG 4.41Å; L292-V328 HydrophobicContact CD2-CG2 4.06Å; L292-M331 HydrophobicContact CD1-CE 4.29Å
293T84.9Confident93.4Very high122 Ų12272.8 Ų72.875%0.74835%0.352SS*.SBendtrans-72.4-41178.648.90000112.3H291H291-T293 PolarHBondContact O-N 3.24Å
294H87.8Confident93.5Very high146 Ų14674.7 Ų74.768%0.67636%0.36SS*.SBendtrans-13274.7177.9-66.8-80.6000110.8H291 Y296H291-H294 CarbonylContact O-C 3.57Å; H291-H294 PolarHBondContact O-N 3.47Å; H294-Y296 PolarHBondContact O-N 3.03Å
295P90.5Very high93.6Very high7 Ų775 Ų755%0.04536%0.362CS..  trans-76.738.7-173.932.5-39000113.6L288 H291 P297 R324 V328L288-P295 HydrophobicContact CD1-CB 3.6Å; H291-P295 VanDerWaalsContact O-CA 3.24Å; H291-P295 WeakPolarHBondContact O-CA 3.49Å; H291-P295 WeakPolarHBondContact O-CD 3.29Å; P295-P297 WeakPolarHBondContact O-CD 3.2Å; P295-R324 HydrophobicContact CB-CG 3.77Å; P295-R324 HydrophobicContact CG-CG 3.72Å; P295-R324 WeakPolarHBondContact O-CD 3.39Å; P295-V328 HydrophobicContact CB-CG2 4.39Å; P295-V328 HydrophobicContact CG-CG1 4.29Å; P295-V328 HydrophobicContact CG-CG2 4.32Å
296Y94.7Very high93.7Very high152 Ų15270.1 Ų70.160%0.59635%0.346SS*.  trans-11685.5-173.7-69.4-108.2000108.3H294 S298 R324H294-Y296 PolarHBondContact O-N 3.03Å; Y296-S298 PolarHBondContact O-N 3.44Å; Y296-R324 VanDerWaalsContact CD1-NH1 3.25Å
297P93.4Very high93.8Very high13 Ų1374.8 Ų74.88%0.08436%0.359CS..  trans-62.8137179.525.1-32.8000110.4W287 P295 Q301 K302 L305 F320W287-P297 VanDerWaalsContact CH2-CA 3.48Å; W287-P297 HydrophobicContact CH2-CB 3.63Å; W287-P297 HydrophobicContact CH2-CG 4.18Å; W287-P297 HydrophobicContact CZ2-CB 3.68Å; W287-P297 HydrophobicContact CZ3-CB 4.07Å; W287-P297 HydrophobicContact CZ3-CG 4.22Å; P295-P297 WeakPolarHBondContact O-CD 3.2Å; P297-Q301 HydrophobicContact CB-CB 3.9Å; P297-K302 HydrophobicContact CB-CG 4.21Å; P297-K302 HydrophobicContact CG-CG 4.12Å; P297-K302 VanDerWaalsContact O-CE 3.28Å; P297-K302 WeakPolarHBondContact O-CE 3.43Å; P297-L305 HydrophobicContact CB-CD1 4.43Å; P297-F320 HydrophobicContact CG-CD1 4.26Å; P297-F320 HydrophobicContact CG-CD2 4.19Å; P297-F320 HydrophobicContact CG-CG 4.06Å
298S95.7Very high93.7Very high59 Ų5977.4 Ų77.441%0.41338%0.375SS..  trans-64.6165.3173.572.10000111.7Y296 E300 Q301 K302Y296-S298 PolarHBondContact O-N 3.44Å; S298-E300 PolarHBondContact O-N 3.47Å; S298-Q301 PolarHBondContact O-N 2.89Å; S298-Q301 VanDerWaalsContact O-N 3.14Å; S298-Q301 WeakPolarHBondContact OG-CG 3.33Å; S298-Q301 PolarHBondContact OG-N 3.33Å; S298-Q301 PolarHBondContact OG-OE1 3.08Å; S298-K302 VanDerWaalsContact O-CG 3.29Å; S298-K302 WeakPolarHBondContact O-CG 3.36Å; S298-K302 PolarHBondContact O-N 3.35Å
299E95.3Very high93.7Very high119 Ų11978.2 Ų78.256%0.55638%0.38SS*.Hα-helixtrans-44.7-48.4171.6-75.5-7796.600112.6K302 K303E299-K302 PolarHBondContact O-N 2.99Å; E299-K302 IonicContact OE1-NZ 2.69Å; E299-K302 PolarHBondContact OE1-NZ 3.17Å; E299-K302 VanDerWaalsContact OE1-NZ 3.13Å; E299-K303 WeakPolarHBondContact O-CG 3.38Å; E299-K303 PolarHBondContact O-N 3.43Å; E299-K303 VanDerWaalsContact O-N 3.12Å
300E96Very high93.9Very high115 Ų11576.9 Ų76.954%0.53739%0.394SS..Hα-helixtrans-71.8-38.8-177.9-151.957.4-139.100112.5S298 K302 K303 Q304S298-E300 PolarHBondContact O-N 3.47Å; E300-K302 VanDerWaalsContact C-N 3.29Å; E300-K302 PolarHBondContact O-N 2.92Å; E300-K303 WeakPolarHBondContact O-CB 3.38Å; E300-K303 PolarHBondContact O-N 2.82Å; E300-K303 VanDerWaalsContact O-N 3.16Å; E300-K303 IonicContact OE1-NZ 2.84Å; E300-K303 WeakPolarHBondContact OE2-CE 3.46Å; E300-K303 IonicContact OE2-NZ 3.13Å; E300-K303 PolarHBondContact OE2-NZ 3.2Å; E300-Q304 PolarHBondContact O-N 3.02Å
301Q96.1Very high93.9Very high68 Ų6870.9 Ų70.932%0.31837%0.367SS..Hα-helixtrans-63.8-35.5174-70.7171.8-37.900111.7P297 S298 L305P297-Q301 HydrophobicContact CB-CB 3.9Å; S298-Q301 PolarHBondContact O-N 2.89Å; S298-Q301 VanDerWaalsContact O-N 3.14Å; S298-Q301 WeakPolarHBondContact OG-CG 3.33Å; S298-Q301 PolarHBondContact OG-N 3.33Å; S298-Q301 PolarHBondContact OG-OE1 3.08Å; Q301-L305 VanDerWaalsContact O-CB 3.29Å; Q301-L305 WeakPolarHBondContact O-CB 3.36Å; Q301-L305 WeakPolarHBondContact O-CD1 3.33Å; Q301-L305 WeakPolarHBondContact O-CG 3.38Å; Q301-L305 PolarHBondContact O-N 2.99Å
302K96.5Very high94.1Very high40 Ų4071.7 Ų71.717%0.17438%0.376CS..Hα-helixtrans-66.1-37.7173.1-62.8162.8-171.6176.20112.1P297 S298 E299 E300 A306 I313 N317P297-K302 HydrophobicContact CB-CG 4.21Å; P297-K302 HydrophobicContact CG-CG 4.12Å; P297-K302 VanDerWaalsContact O-CE 3.28Å; P297-K302 WeakPolarHBondContact O-CE 3.43Å; S298-K302 VanDerWaalsContact O-CG 3.29Å; S298-K302 WeakPolarHBondContact O-CG 3.36Å; S298-K302 PolarHBondContact O-N 3.35Å; E299-K302 PolarHBondContact O-N 2.99Å; E299-K302 IonicContact OE1-NZ 2.69Å; E299-K302 PolarHBondContact OE1-NZ 3.17Å; E299-K302 VanDerWaalsContact OE1-NZ 3.13Å; E300-K302 VanDerWaalsContact C-N 3.29Å; E300-K302 PolarHBondContact O-N 2.92Å; K302-A306 VanDerWaalsContact O-CB 3.28Å; K302-A306 WeakPolarHBondContact O-CB 3.43Å; K302-A306 PolarHBondContact O-N 3.31Å; K302-I313 HydrophobicContact CB-CG2 4.31Å; K302-N317 VanDerWaalsContact CD-OD1 3.25Å; K302-N317 WeakPolarHBondContact CD-OD1 3.45Å; K302-N317 WeakPolarHBondContact CE-OD1 3.4Å; K302-N317 PolarHBondContact NZ-OD1 3.42Å
303K96.4Very high94.4Very high89 Ų8972.6 Ų72.639%0.38738%0.38SS..Hα-helixtrans-65.1-47.6175.2-66.9172.3-157.8164.20111.1E299 E300 L305 A306 Q307 I313E299-K303 WeakPolarHBondContact O-CG 3.38Å; E299-K303 PolarHBondContact O-N 3.43Å; E299-K303 VanDerWaalsContact O-N 3.12Å; E300-K303 WeakPolarHBondContact O-CB 3.38Å; E300-K303 PolarHBondContact O-N 2.82Å; E300-K303 VanDerWaalsContact O-N 3.16Å; E300-K303 IonicContact OE1-NZ 2.84Å; E300-K303 WeakPolarHBondContact OE2-CE 3.46Å; E300-K303 IonicContact OE2-NZ 3.13Å; E300-K303 PolarHBondContact OE2-NZ 3.2Å; K303-L305 PolarHBondContact O-N 3.03Å; K303-A306 WeakPolarHBondContact O-CB 3.4Å; K303-A306 PolarHBondContact O-N 3.15Å; K303-Q307 PolarHBondContact O-N 2.88Å; K303-I313 HydrophobicContact CG-CD1 3.94Å
304Q96.9Very high94.8Very high90 Ų9072.3 Ų72.342%0.42137%0.374SS..Hα-helixtrans-60.7-47.3176.4-167.963.564.400111E300 A306 Q307 D308E300-Q304 PolarHBondContact O-N 3.02Å; Q304-A306 VanDerWaalsContact C-N 3.28Å; Q304-A306 PolarHBondContact O-N 2.8Å; Q304-Q307 WeakPolarHBondContact O-CB 3.29Å; Q304-Q307 PolarHBondContact O-N 3.18Å; Q304-Q307 VanDerWaalsContact O-N 3.13Å; Q304-D308 PolarHBondContact NE2-OD1 3.09Å; Q304-D308 WeakPolarHBondContact O-CB 3.41Å; Q304-D308 PolarHBondContact O-N 3.25Å
305L96.5Very high95Very high8 Ų868.9 Ų68.94%0.04236%0.358CS..Hα-helixtrans-62.8-32.4176.3-71.7166000112.6I283 W287 P297 Q301 K303 T309 V316 F320I283-L305 HydrophobicContact CG2-CD2 3.9Å; W287-L305 HydrophobicContact CB-CD1 4.41Å; W287-L305 HydrophobicContact CB-CD2 4.06Å; W287-L305 HydrophobicContact CD2-CD1 4.15Å; W287-L305 HydrophobicContact CG-CD1 3.94Å; W287-L305 HydrophobicContact CG-CD2 4.27Å; P297-L305 HydrophobicContact CB-CD1 4.43Å; Q301-L305 VanDerWaalsContact O-CB 3.29Å; Q301-L305 WeakPolarHBondContact O-CB 3.36Å; Q301-L305 WeakPolarHBondContact O-CD1 3.33Å; Q301-L305 WeakPolarHBondContact O-CG 3.38Å; Q301-L305 PolarHBondContact O-N 2.99Å; K303-L305 PolarHBondContact O-N 3.03Å; L305-T309 VanDerWaalsContact O-CB 3.28Å; L305-T309 WeakPolarHBondContact O-CB 3.45Å; L305-T309 WeakPolarHBondContact O-CG2 3.33Å; L305-T309 PolarHBondContact O-N 2.69Å; L305-T309 PolarHBondContact O-OG1 3.34Å; L305-V316 HydrophobicContact CB-CG1 4.02Å; L305-F320 HydrophobicContact CD1-CE2 3.8Å; L305-F320 HydrophobicContact CD1-CZ 3.97Å
306A96.8Very high95.3Very high10 Ų1068.5 Ų68.58%0.08336%0.356CS..Hα-helixtrans-66.2-45.7172.100000111.5K302 K303 Q304 T309 G310 L311 I313 V316K302-A306 VanDerWaalsContact O-CB 3.28Å; K302-A306 WeakPolarHBondContact O-CB 3.43Å; K302-A306 PolarHBondContact O-N 3.31Å; K303-A306 WeakPolarHBondContact O-CB 3.4Å; K303-A306 PolarHBondContact O-N 3.15Å; Q304-A306 VanDerWaalsContact C-N 3.28Å; Q304-A306 PolarHBondContact O-N 2.8Å; A306-T309 PolarHBondContact O-N 3.24Å; A306-T309 PolarHBondContact O-OG1 2.91Å; A306-G310 PolarHBondContact O-N 2.82Å; A306-L311 WeakPolarHBondContact CA-O 3.22Å; A306-L311 VanDerWaalsContact CB-O 3.25Å; A306-L311 WeakPolarHBondContact CB-O 3.4Å; A306-L311 PolarHBondContact O-N 3.12Å; A306-I313 HydrophobicContact CB-CG1 3.75Å; A306-V316 HydrophobicContact CB-CG2 4.17Å
307Q96.7Very high95.2Very high146 Ų14663.4 Ų63.468%0.68234%0.339SS*.Hα-helixtrans-60.9-51176.3-173.7178.912.900112K303 Q304 T309 G310K303-Q307 PolarHBondContact O-N 2.88Å; Q304-Q307 WeakPolarHBondContact O-CB 3.29Å; Q304-Q307 PolarHBondContact O-N 3.18Å; Q304-Q307 VanDerWaalsContact O-N 3.13Å; Q307-T309 PolarHBondContact O-N 2.91Å; Q307-G310 PolarHBondContact O-N 3.21Å
308D95.4Very high95.3Very high81 Ų8167.2 Ų67.243%0.43336%0.358SS..Hα-helixtrans-65.2-25.9-177-62.3-10.5000113I283 Q304I283-D308 HydrophobicContact CD1-CB 4.41Å; I283-D308 WeakPolarHBondContact CD1-O 3.26Å; I283-D308 HydrophobicContact CG2-CB 4.19Å; Q304-D308 PolarHBondContact NE2-OD1 3.09Å; Q304-D308 WeakPolarHBondContact O-CB 3.41Å; Q304-D308 PolarHBondContact O-N 3.25Å
309T94.9Very high95.2Very high17 Ų1765.9 Ų65.910%0.10434%0.344CS..Hα-helixtrans-103.8-11.6-175.663.90000114.4A280 I283 M284 L305 A306 Q307 L311A280-T309 HydrophobicContact CB-CG2 4.13Å; I283-T309 HydrophobicContact CB-CG2 3.92Å; I283-T309 HydrophobicContact CD1-CG2 4.22Å; I283-T309 HydrophobicContact CG2-CG2 3.84Å; M284-T309 HydrophobicContact CG-CG2 4.05Å; L305-T309 VanDerWaalsContact O-CB 3.28Å; L305-T309 WeakPolarHBondContact O-CB 3.45Å; L305-T309 WeakPolarHBondContact O-CG2 3.33Å; L305-T309 PolarHBondContact O-N 2.69Å; L305-T309 PolarHBondContact O-OG1 3.34Å; A306-T309 PolarHBondContact O-N 3.24Å; A306-T309 PolarHBondContact O-OG1 2.91Å; Q307-T309 PolarHBondContact O-N 2.91Å; T309-L311 PolarHBondContact O-N 3.37Å; T309-L311 WeakPolarHBondContact OG1-CB 3.49Å; T309-L311 WeakPolarHBondContact OG1-CG 3.32Å; T309-L311 PolarHBondContact OG1-N 3Å
310G94.1Very high95.3Very high71 Ų7160.4 Ų60.473%0.73232%0.319SS*.THydrogen-bonded Turntrans65.620.2-171.400000113.8A306 Q307A306-G310 PolarHBondContact O-N 2.82Å; Q307-G310 PolarHBondContact O-N 3.21Å
311L94.5Very high95.1Very high20 Ų2058.3 Ų58.311%0.10531%0.31CS..  trans-102.3156.1180-60.1-177.7000110.9F276 A280 M284 A306 T309 Q315 V316F276-L311 HydrophobicContact CB-CD1 4.25Å; F276-L311 HydrophobicContact CD1-CD1 3.74Å; F276-L311 HydrophobicContact CD1-CD2 3.51Å; F276-L311 HydrophobicContact CD1-CG 4.3Å; F276-L311 HydrophobicContact CD2-CD1 4.25Å; F276-L311 HydrophobicContact CE1-CD1 4.1Å; F276-L311 HydrophobicContact CE1-CD2 3.94Å; F276-L311 HydrophobicContact CG-CD1 3.83Å; F276-L311 HydrophobicContact CG-CD2 4.29Å; F276-L311 HydrophobicContact CZ-CD1 4.49Å; A280-L311 HydrophobicContact CB-CD1 4.13Å; A280-L311 HydrophobicContact CB-CG 4.34Å; M284-L311 HydrophobicContact CE-CD1 3.56Å; M284-L311 HydrophobicContact SD-CD1 4.16Å; A306-L311 WeakPolarHBondContact CA-O 3.22Å; A306-L311 VanDerWaalsContact CB-O 3.25Å; A306-L311 WeakPolarHBondContact CB-O 3.4Å; A306-L311 PolarHBondContact O-N 3.12Å; T309-L311 PolarHBondContact O-N 3.37Å; T309-L311 WeakPolarHBondContact OG1-CB 3.49Å; T309-L311 WeakPolarHBondContact OG1-CG 3.32Å; T309-L311 PolarHBondContact OG1-N 3Å; L311-Q315 HydrophobicContact CB-CB 4.13Å; L311-V316 HydrophobicContact CB-CG2 4.06Å
312T95.2Very high95Very high76 Ų7658.5 Ų58.547%0.46631%0.314SS..  trans-71.2152.1172.773.30000111L314 Q315 V316T312-L314 PolarHBondContact O-N 2.9Å; T312-L314 VanDerWaalsContact O-N 3.12Å; T312-Q315 WeakPolarHBondContact O-CA 3.5Å; T312-Q315 WeakPolarHBondContact O-CB 3.27Å; T312-Q315 PolarHBondContact O-N 3.23Å; T312-Q315 WeakPolarHBondContact OG1-CG 3.44Å; T312-Q315 PolarHBondContact OG1-N 3.29Å; T312-V316 PolarHBondContact O-N 3.37Å
313I93.1Very high94.8Very high75 Ų7557 Ų5739%0.38531%0.308SS..Hα-helixtrans-54.8-33.9176.1-62.7170.3000111K302 K303 A306 V316 N317K302-I313 HydrophobicContact CB-CG2 4.31Å; K303-I313 HydrophobicContact CG-CD1 3.94Å; A306-I313 HydrophobicContact CB-CG1 3.75Å; I313-V316 PolarHBondContact O-N 2.98Å; I313-N317 WeakPolarHBondContact O-CB 3.37Å; I313-N317 PolarHBondContact O-N 3.38Å; I313-N317 PolarHBondContact O-ND2 3.4Å; I313-N317 VanDerWaalsContact O-ND2 3.11Å
314L93.3Very high94.7Very high117 Ų11755.3 Ų55.361%0.61330%0.299SS*.Hα-helixtrans-67.8-38.3174.1-17760.3000113T312 N318T312-L314 PolarHBondContact O-N 2.9Å; T312-L314 VanDerWaalsContact O-N 3.12Å; L314-N318 WeakPolarHBondContact CD1-ND2 3.21Å; L314-N318 WeakPolarHBondContact O-CB 3.4Å; L314-N318 PolarHBondContact O-N 3.49Å; L314-N318 PolarHBondContact O-ND2 2.82Å
315Q93.9Very high94.4Very high73 Ų7360 Ų6034%0.34131%0.313SS..Hα-helixtrans-65.8-43.1174-74.7167.5-19.100111.3F276 L311 T312 N318 W319F276-Q315 HydrophobicContact CE1-CB 3.93Å; F276-Q315 HydrophobicContact CE1-CG 3.95Å; F276-Q315 HydrophobicContact CZ-CB 3.81Å; F276-Q315 HydrophobicContact CZ-CG 4.07Å; L311-Q315 HydrophobicContact CB-CB 4.13Å; T312-Q315 WeakPolarHBondContact O-CA 3.5Å; T312-Q315 WeakPolarHBondContact O-CB 3.27Å; T312-Q315 PolarHBondContact O-N 3.23Å; T312-Q315 WeakPolarHBondContact OG1-CG 3.44Å; T312-Q315 PolarHBondContact OG1-N 3.29Å; Q315-N318 PolarHBondContact O-N 2.87Å; Q315-W319 WeakPolarHBondContact O-CB 3.3Å; Q315-W319 PolarHBondContact O-N 3.36Å
316V95.6Very high94.1Very high0 Ų068.2 Ų68.20%034%0.344CS..Hα-helixtrans-61.8-49.8175177.40000111M284 L305 A306 L311 T312 I313 N318 W319 F320M284-V316 HydrophobicContact SD-CG1 4.43Å; M284-V316 HydrophobicContact SD-CG2 4.3Å; L305-V316 HydrophobicContact CB-CG1 4.02Å; A306-V316 HydrophobicContact CB-CG2 4.17Å; L311-V316 HydrophobicContact CB-CG2 4.06Å; T312-V316 PolarHBondContact O-N 3.37Å; I313-V316 PolarHBondContact O-N 2.98Å; V316-N318 PolarHBondContact O-N 3.29Å; V316-W319 WeakPolarHBondContact O-CB 3.49Å; V316-W319 PolarHBondContact O-N 3.03Å; V316-W319 VanDerWaalsContact O-N 3.16Å; V316-F320 HydrophobicContact CG1-CD2 3.81Å; V316-F320 HydrophobicContact CG1-CE2 3.92Å; V316-F320 WeakPolarHBondContact O-CD2 3.45Å; V316-F320 PolarHBondContact O-N 3.37Å
317N93.8Very high93.6Very high44 Ų4469.7 Ų69.724%0.23535%0.35CS..Hα-helixtrans-53-51.2175-85.5-45000112K302 I313 W319 F320 I321K302-N317 VanDerWaalsContact CD-OD1 3.25Å; K302-N317 WeakPolarHBondContact CD-OD1 3.45Å; K302-N317 WeakPolarHBondContact CE-OD1 3.4Å; K302-N317 PolarHBondContact NZ-OD1 3.42Å; I313-N317 WeakPolarHBondContact O-CB 3.37Å; I313-N317 PolarHBondContact O-N 3.38Å; I313-N317 PolarHBondContact O-ND2 3.4Å; I313-N317 VanDerWaalsContact O-ND2 3.11Å; N317-W319 VanDerWaalsContact C-N 3.33Å; N317-W319 PolarHBondContact O-N 3.45Å; N317-F320 PolarHBondContact O-N 3.09Å; N317-I321 VanDerWaalsContact O-CG1 3.32Å; N317-I321 WeakPolarHBondContact O-CG1 3.23Å; N317-I321 PolarHBondContact O-N 2.85Å
318N93.7Very high93.1Very high93 Ų9363 Ų6350%0.49732%0.319SS..Hα-helixtrans-63-37.6179.2-82.4-65.9000112.5L314 Q315 V316 N322L314-N318 WeakPolarHBondContact CD1-ND2 3.21Å; L314-N318 WeakPolarHBondContact O-CB 3.4Å; L314-N318 PolarHBondContact O-N 3.49Å; L314-N318 PolarHBondContact O-ND2 2.82Å; Q315-N318 PolarHBondContact O-N 2.87Å; V316-N318 PolarHBondContact O-N 3.29Å; N318-N322 WeakPolarHBondContact O-CB 3.43Å; N318-N322 PolarHBondContact O-N 3.23Å; N318-N322 VanDerWaalsContact O-N 3.09Å
319W95.3Very high92.4Very high32 Ų3263.8 Ų63.812%0.12132%0.32CS..Hα-helixtrans-62.3-48.4175-170.493.6000111.4F276 T281 M284 R285 L288 Q315 V316 N317 I321 N322 A323F276-W319 AromaticContact CD2-CD1 3.71Å; F276-W319 HydrophobicContact CE2-CB 4.24Å; F276-W319 AromaticContact CE2-CD1 3.84Å; F276-W319 HydrophobicContact CE2-CG 4.44Å; T281-W319 HydrophobicContact CG2-CZ2 4.45Å; M284-W319 HydrophobicContact CB-CD2 3.95Å; M284-W319 HydrophobicContact CB-CE3 3.63Å; M284-W319 HydrophobicContact CB-CH2 3.82Å; M284-W319 HydrophobicContact CB-CZ2 4.09Å; M284-W319 HydrophobicContact CB-CZ3 3.57Å; M284-W319 HydrophobicContact CE-CB 4.21Å; M284-W319 HydrophobicContact CE-CD2 3.89Å; M284-W319 HydrophobicContact CE-CG 3.65Å; M284-W319 HydrophobicContact CG-CE3 4.36Å; M284-W319 HydrophobicContact SD-CB 3.89Å; M284-W319 HydrophobicContact SD-CD2 3.8Å; M284-W319 HydrophobicContact SD-CE3 4.03Å; M284-W319 HydrophobicContact SD-CG 3.73Å; R285-W319 HydrophobicContact CG-CH2 3.85Å; R285-W319 HydrophobicContact CG-CZ2 3.81Å; L288-W319 HydrophobicContact CB-CH2 4.45Å; L288-W319 HydrophobicContact CB-CZ3 4.33Å; L288-W319 HydrophobicContact CD2-CH2 3.95Å; L288-W319 HydrophobicContact CD2-CZ3 4.07Å; Q315-W319 WeakPolarHBondContact O-CB 3.3Å; Q315-W319 PolarHBondContact O-N 3.36Å; V316-W319 WeakPolarHBondContact O-CB 3.49Å; V316-W319 PolarHBondContact O-N 3.03Å; V316-W319 VanDerWaalsContact O-N 3.16Å; N317-W319 VanDerWaalsContact C-N 3.33Å; N317-W319 PolarHBondContact O-N 3.45Å; W319-I321 PolarHBondContact O-N 2.84Å; W319-N322 PolarHBondContact O-N 3.36Å; W319-A323 HydrophobicContact CD2-CB 4.2Å; W319-A323 HydrophobicContact CE3-CB 3.84Å; W319-A323 HydrophobicContact CH2-CB 3.74Å; W319-A323 HydrophobicContact CZ2-CB 4.11Å; W319-A323 HydrophobicContact CZ3-CB 3.6Å; W319-A323 VanDerWaalsContact O-CB 3.29Å; W319-A323 WeakPolarHBondContact O-CB 3.4Å; W319-A323 PolarHBondContact O-N 2.81Å
320F95.9Very high91.8Very high4 Ų466 Ų662%0.01834%0.335CS..Hα-helixtrans-64.9-39-179.7-87.7-77.8000113.4M284 W287 L288 P297 L305 V316 N317 N322 R324M284-F320 HydrophobicContact CB-CE2 4.07Å; M284-F320 HydrophobicContact CB-CZ 4.11Å; M284-F320 HydrophobicContact CG-CE2 4.09Å; M284-F320 HydrophobicContact SD-CE2 4.38Å; W287-F320 HydrophobicContact CB-CZ 4.5Å; W287-F320 HydrophobicContact CD2-CE1 4.44Å; W287-F320 HydrophobicContact CD2-CZ 4.32Å; W287-F320 HydrophobicContact CE3-CD1 4.4Å; W287-F320 AromaticContact CE3-CE1 3.43Å; W287-F320 HydrophobicContact CE3-CE1 3.43Å; W287-F320 VanDerWaalsContact CE3-CE1 3.43Å; W287-F320 AromaticContact CE3-CZ 3.71Å; W287-F320 HydrophobicContact CE3-CZ 3.71Å; W287-F320 HydrophobicContact CZ3-CD1 4.39Å; W287-F320 AromaticContact CZ3-CE1 3.83Å; W287-F320 HydrophobicContact CZ3-CE1 3.83Å; W287-F320 HydrophobicContact CZ3-CZ 4.43Å; L288-F320 HydrophobicContact CB-CE1 3.99Å; L288-F320 HydrophobicContact CD1-CD1 4.16Å; L288-F320 HydrophobicContact CD1-CE1 4.04Å; P297-F320 HydrophobicContact CG-CD1 4.26Å; P297-F320 HydrophobicContact CG-CD2 4.19Å; P297-F320 HydrophobicContact CG-CG 4.06Å; L305-F320 HydrophobicContact CD1-CE2 3.8Å; L305-F320 HydrophobicContact CD1-CZ 3.97Å; V316-F320 HydrophobicContact CG1-CD2 3.81Å; V316-F320 HydrophobicContact CG1-CE2 3.92Å; V316-F320 WeakPolarHBondContact O-CD2 3.45Å; V316-F320 PolarHBondContact O-N 3.37Å; N317-F320 PolarHBondContact O-N 3.09Å; F320-N322 VanDerWaalsContact C-N 3.33Å; F320-N322 PolarHBondContact O-N 2.81Å; F320-R324 WeakPolarHBondContact O-CB 3.24Å; F320-R324 WeakPolarHBondContact O-CD 3.27Å; F320-R324 WeakPolarHBondContact O-CG 3.34Å; F320-R324 PolarHBondContact O-N 2.86Å
321I92.4Very high91.1Very high70 Ų7066.9 Ų66.936%0.35932%0.321SS..Hα-helixtrans-60.8-43173.2-66.8163.6000110.7N317 W319 R325N317-I321 VanDerWaalsContact O-CG1 3.32Å; N317-I321 WeakPolarHBondContact O-CG1 3.23Å; N317-I321 PolarHBondContact O-N 2.85Å; W319-I321 PolarHBondContact O-N 2.84Å; I321-R325 WeakPolarHBondContact O-CG 3.47Å; I321-R325 PolarHBondContact O-N 3.42Å
322N93.6Very high90.4Very high73 Ų7369.3 Ų69.339%0.3933%0.333SS..Hα-helixtrans-71.2-45179.9-161.8-99.1000112.5N318 W319 F320 R325 R326N318-N322 WeakPolarHBondContact O-CB 3.43Å; N318-N322 PolarHBondContact O-N 3.23Å; N318-N322 VanDerWaalsContact O-N 3.09Å; W319-N322 PolarHBondContact O-N 3.36Å; F320-N322 VanDerWaalsContact C-N 3.33Å; F320-N322 PolarHBondContact O-N 2.81Å; N322-R325 PolarHBondContact O-N 3.34Å; N322-R326 WeakPolarHBondContact O-CB 3.22Å; N322-R326 PolarHBondContact O-N 3.47Å; N322-R326 VanDerWaalsContact O-N 3.12Å; N322-R326 WeakPolarHBondContact OD1-CD 3.28Å; N322-R326 PolarHBondContact OD1-NH1 2.85Å
323A93.2Very high89.6Confident7 Ų769.4 Ų69.46%0.05833%0.331CS..Hα-helixtrans-65.6-41.2-177.900000111.9L288 W319 R325 R326 I327L288-A323 HydrophobicContact CD2-CB 3.75Å; W319-A323 HydrophobicContact CD2-CB 4.2Å; W319-A323 HydrophobicContact CE3-CB 3.84Å; W319-A323 HydrophobicContact CH2-CB 3.74Å; W319-A323 HydrophobicContact CZ2-CB 4.11Å; W319-A323 HydrophobicContact CZ3-CB 3.6Å; W319-A323 VanDerWaalsContact O-CB 3.29Å; W319-A323 WeakPolarHBondContact O-CB 3.4Å; W319-A323 PolarHBondContact O-N 2.81Å; A323-R325 PolarHBondContact O-N 2.91Å; A323-R326 PolarHBondContact O-N 3.17Å; A323-I327 HydrophobicContact CB-CD1 4.35Å; A323-I327 WeakPolarHBondContact O-CB 3.43Å; A323-I327 PolarHBondContact O-N 3.17Å
324R94.1Very high89Confident54 Ų5472.7 Ų72.720%0.20435%0.345CS..Iπ-helixtrans-56.1-47.4172.4-85.116324.8-172.6-1.6113L288 P295 Y296 F320 R326 V328 Q329L288-R324 HydrophobicContact CD1-CG 4.46Å; P295-R324 HydrophobicContact CB-CG 3.77Å; P295-R324 HydrophobicContact CG-CG 3.72Å; P295-R324 WeakPolarHBondContact O-CD 3.39Å; Y296-R324 VanDerWaalsContact CD1-NH1 3.25Å; F320-R324 WeakPolarHBondContact O-CB 3.24Å; F320-R324 WeakPolarHBondContact O-CD 3.27Å; F320-R324 WeakPolarHBondContact O-CG 3.34Å; F320-R324 PolarHBondContact O-N 2.86Å; R324-R326 VanDerWaalsContact C-N 3.29Å; R324-R326 PolarHBondContact O-N 2.88Å; R324-V328 HydrophobicContact CG-CG2 4.43Å; R324-V328 PolarHBondContact O-N 2.91Å; R324-Q329 PolarHBondContact O-N 3.4Å
325R90.7Very high88.1Confident188 Ų18870.1 Ų70.171%0.70934%0.336SS*.Iπ-helixtrans-68.4-24.7179.6-69.7178.9-179.5-179.81.9113.5I321 N322 A323I321-R325 WeakPolarHBondContact O-CG 3.47Å; I321-R325 PolarHBondContact O-N 3.42Å; N322-R325 PolarHBondContact O-N 3.34Å; A323-R325 PolarHBondContact O-N 2.91Å
326R90.4Very high87.1Confident182 Ų18271.3 Ų71.369%0.68735%0.345SS*.Iπ-helixtrans-103.1-22.4-175.7-73.9-177.1168.2170.6-14.1115.6N322 A323 R324N322-R326 WeakPolarHBondContact O-CB 3.22Å; N322-R326 PolarHBondContact O-N 3.47Å; N322-R326 VanDerWaalsContact O-N 3.12Å; N322-R326 WeakPolarHBondContact OD1-CD 3.28Å; N322-R326 PolarHBondContact OD1-NH1 2.85Å; A323-R326 PolarHBondContact O-N 3.17Å; R324-R326 VanDerWaalsContact C-N 3.29Å; R324-R326 PolarHBondContact O-N 2.88Å
327I86.7Confident86Confident40 Ų4079.7 Ų79.721%0.20538%0.377CS..Iπ-helixtrans-115.9-57.4-175.1-55.5175.4000109.4L288 F289 A323 M331L288-I327 HydrophobicContact CD2-CD1 4.01Å; F289-I327 HydrophobicContact CE1-CG2 4.13Å; F289-I327 HydrophobicContact CZ-CG2 4.48Å; A323-I327 HydrophobicContact CB-CD1 4.35Å; A323-I327 WeakPolarHBondContact O-CB 3.43Å; A323-I327 PolarHBondContact O-N 3.17Å; I327-M331 HydrophobicContact CG2-SD 4.17Å; I327-M331 VanDerWaalsContact O-CG 3.29Å; I327-M331 WeakPolarHBondContact O-CG 3.28Å; I327-M331 PolarHBondContact O-N 3.5Å
328V85Confident84.7Confident7 Ų780.7 Ų80.74%0.04239%0.391CS..Iπ-helixtrans-74.9-44.7-170.8-171.60000112.2L288 L292 P295 R324 M331 I332L288-V328 HydrophobicContact CD1-CG2 4.1Å; L292-V328 HydrophobicContact CD2-CG2 4.06Å; P295-V328 HydrophobicContact CB-CG2 4.39Å; P295-V328 HydrophobicContact CG-CG1 4.29Å; P295-V328 HydrophobicContact CG-CG2 4.32Å; R324-V328 HydrophobicContact CG-CG2 4.43Å; R324-V328 PolarHBondContact O-N 2.91Å; V328-M331 PolarHBondContact O-N 3.4Å; V328-M331 VanDerWaalsContact O-N 3.17Å; V328-I332 HydrophobicContact CG1-CD1 3.76Å; V328-I332 HydrophobicContact CG1-CG1 4.24Å; V328-I332 WeakPolarHBondContact O-CG1 3.39Å; V328-I332 PolarHBondContact O-N 3.17Å
329Q80.5Confident83.2Confident96 Ų9682 Ų8245%0.44940%0.402SS..Hα-helixtrans-57.3-51.7179.9-78.4-72.1-15.700112.8R324 M331 I332 D333R324-Q329 PolarHBondContact O-N 3.4Å; Q329-M331 VanDerWaalsContact C-N 3.27Å; Q329-M331 PolarHBondContact O-N 3.46Å; Q329-I332 PolarHBondContact O-N 2.87Å; Q329-I332 VanDerWaalsContact O-N 3.16Å; Q329-D333 PolarHBondContact O-N 2.81Å
330P82.9Confident81.4Confident64 Ų6485.4 Ų85.442%0.41643%0.431SS..Hα-helixtrans-57.5-35.1174.5-27.335.9000114.6Q334P330-Q334 WeakPolarHBondContact O-CB 3.23Å; P330-Q334 PolarHBondContact O-N 3.45Å
331M79.4Confident79.5Confident89 Ų8992.9 Ų92.944%0.43847%0.466SS..Hα-helixtrans-67.8-42.7177-69.8173.769.500111.8L292 I327 V328 Q329 Q334 S335L292-M331 HydrophobicContact CD1-CE 4.29Å; I327-M331 HydrophobicContact CG2-SD 4.17Å; I327-M331 VanDerWaalsContact O-CG 3.29Å; I327-M331 WeakPolarHBondContact O-CG 3.28Å; I327-M331 PolarHBondContact O-N 3.5Å; V328-M331 PolarHBondContact O-N 3.4Å; V328-M331 VanDerWaalsContact O-N 3.17Å; Q329-M331 VanDerWaalsContact C-N 3.27Å; Q329-M331 PolarHBondContact O-N 3.46Å; M331-Q334 PolarHBondContact O-N 2.86Å; M331-S335 PolarHBondContact O-N 2.64Å; M331-S335 PolarHBondContact O-OG 3.24Å
332I79.8Confident77.2Confident71 Ų7192.7 Ų92.736%0.36448%0.481SS..Hα-helixtrans-65.2-46.9177.1-68173.7000110.8V328 Q329 Q334 S335 N336V328-I332 HydrophobicContact CG1-CD1 3.76Å; V328-I332 HydrophobicContact CG1-CG1 4.24Å; V328-I332 WeakPolarHBondContact O-CG1 3.39Å; V328-I332 PolarHBondContact O-N 3.17Å; Q329-I332 PolarHBondContact O-N 2.87Å; Q329-I332 VanDerWaalsContact O-N 3.16Å; I332-Q334 VanDerWaalsContact C-N 3.27Å; I332-Q334 PolarHBondContact O-N 3.44Å; I332-S335 WeakPolarHBondContact CA-OG 3.45Å; I332-S335 PolarHBondContact O-N 3.12Å; I332-S335 PolarHBondContact O-OG 3.04Å; I332-N336 WeakPolarHBondContact O-CB 3.16Å; I332-N336 PolarHBondContact O-N 3.36Å; I332-N336 PolarHBondContact O-ND2 2.96Å
333D78.4Confident75Confident79 Ų7993 Ų9342%0.42249%0.494SS..Hα-helixtrans-60.5-38.1176.8-74.7-24.4000111.8Q329 R337Q329-D333 PolarHBondContact O-N 2.81Å; D333-R337 WeakPolarHBondContact O-CB 3.46Å; D333-R337 WeakPolarHBondContact O-CG 3.47Å; D333-R337 PolarHBondContact O-N 2.91Å
334Q80Confident72.8Confident144 Ų14499 Ų9967%0.67353%0.532SS*.Hα-helixtrans-70.4-40.8177.6-169.5168.616.500112.1P330 M331 I332 R337 A338P330-Q334 WeakPolarHBondContact O-CB 3.23Å; P330-Q334 PolarHBondContact O-N 3.45Å; M331-Q334 PolarHBondContact O-N 2.86Å; I332-Q334 VanDerWaalsContact C-N 3.27Å; I332-Q334 PolarHBondContact O-N 3.44Å; Q334-R337 PolarHBondContact O-N 3.45Å; Q334-A338 WeakPolarHBondContact O-CB 3.31Å; Q334-A338 PolarHBondContact O-N 3.21Å
335S74.2Confident70.3Confident62 Ų62106.8 Ų106.843%0.43456%0.563SS.*Hα-helixtrans-65.1-40.4173.251.20000112.3M331 I332 A338 V339M331-S335 PolarHBondContact O-N 2.64Å; M331-S335 PolarHBondContact O-OG 3.24Å; I332-S335 WeakPolarHBondContact CA-OG 3.45Å; I332-S335 PolarHBondContact O-N 3.12Å; I332-S335 PolarHBondContact O-OG 3.04Å; S335-A338 PolarHBondContact O-N 3.22Å; S335-V339 WeakPolarHBondContact O-CG2 3.4Å; S335-V339 PolarHBondContact O-N 3.44Å
336N72.9Confident68.3Low98 Ų98103.7 Ų103.752%0.52456%0.561SS.*Hα-helixtrans-67.2-39.1178.9-68.7-13.1000111.6I332 S340I332-N336 WeakPolarHBondContact O-CB 3.16Å; I332-N336 PolarHBondContact O-N 3.36Å; I332-N336 PolarHBondContact O-ND2 2.96Å; N336-S340 WeakPolarHBondContact O-CB 3.49Å; N336-S340 PolarHBondContact O-N 3.02Å
337R73.2Confident66.6Low177 Ų177100.5 Ų100.567%0.66856%0.564SS**Hα-helixtrans-66.2-41172.4-78.7177.1171.8156.60.6112.7D333 Q334 V339 S340 Q341D333-R337 WeakPolarHBondContact O-CB 3.46Å; D333-R337 WeakPolarHBondContact O-CG 3.47Å; D333-R337 PolarHBondContact O-N 2.91Å; Q334-R337 PolarHBondContact O-N 3.45Å; R337-V339 PolarHBondContact O-N 2.9Å; R337-S340 PolarHBondContact O-N 3.23Å; R337-Q341 WeakPolarHBondContact O-CG 3.48Å; R337-Q341 PolarHBondContact O-N 2.88Å
338A66.4Low64.3Low65 Ų65105.7 Ų105.754%0.53759%0.592SS.*Hα-helixtrans-62.4-41.3177.400000112.2Q334 S335 Q341Q334-A338 WeakPolarHBondContact O-CB 3.31Å; Q334-A338 PolarHBondContact O-N 3.21Å; S335-A338 PolarHBondContact O-N 3.22Å; A338-Q341 PolarHBondContact O-N 3.29Å
339V61.7Low62.4Low120 Ų120108.2 Ų108.273%0.72762%0.62SS**Hα-helixtrans-63.1-43.1172.7169.10000111.4S335 R337 Q341 G342S335-V339 WeakPolarHBondContact O-CG2 3.4Å; S335-V339 PolarHBondContact O-N 3.44Å; R337-V339 PolarHBondContact O-N 2.9Å; V339-Q341 VanDerWaalsContact C-N 3.29Å; V339-Q341 PolarHBondContact O-N 3.48Å; V339-G342 PolarHBondContact O-N 3.43Å
340S57.6Low60.3Low103 Ų103111.7 Ų111.772%0.7264%0.636SS**Hα-helixtrans-70.4-21-178.7-160.10000114N336 R337N336-S340 WeakPolarHBondContact O-CB 3.49Å; N336-S340 PolarHBondContact O-N 3.02Å; R337-S340 PolarHBondContact O-N 3.23Å
341Q56.5Low58.7Low162 Ų162114.8 Ų114.876%0.75766%0.656SS**THydrogen-bonded Turntrans-92.310.9176.5-70.4-176.7-18.300113.9R337 A338 V339 A343R337-Q341 WeakPolarHBondContact O-CG 3.48Å; R337-Q341 PolarHBondContact O-N 2.88Å; A338-Q341 PolarHBondContact O-N 3.29Å; V339-Q341 VanDerWaalsContact C-N 3.29Å; V339-Q341 PolarHBondContact O-N 3.48Å; Q341-A343 PolarHBondContact O-N 3.37Å
342G45.1Very low56.8Low66 Ų66118.4 Ų118.468%0.6867%0.674SS**  trans-70.5-1.9179.200000116.3V339V339-G342 PolarHBondContact O-N 3.43Å
343A46.9Very low54.7Low80 Ų80118 Ų11866%0.66169%0.688SS**SBendtrans-98.1115.6176.100000110.6Q341 Y345Q341-A343 PolarHBondContact O-N 3.37Å; A343-Y345 PolarHBondContact O-N 3.08Å; A343-Y345 VanDerWaalsContact O-N 3.11Å
344P45.5Very low53Low133 Ų133118 Ų11886%0.86471%0.706SS**  trans-74.1104.9-177.229.2-33.9000111.3
345Y43.1Very low50.7Low216 Ų216121 Ų12185%0.84772%0.717SS**  trans-81.2117.1172.4-168.5-93000110.5A343A343-Y345 PolarHBondContact O-N 3.08Å; A343-Y345 VanDerWaalsContact O-N 3.11Å
346N49.1Very low49.4Very low124 Ų124124.8 Ų124.866%0.66374%0.737SS**  trans-82122-176.3-170.177.4000111.2D348N346-D348 PolarHBondContact O-N 3.48Å; N346-D348 VanDerWaalsContact O-N 3.09Å
347P54.7Low48Very low115 Ų115129.4 Ų129.475%0.74776%0.759SS**SBendtrans-9064.8-170.437.2-37.2000113.1
348D38Very low46.4Very low148 Ų148128.9 Ų128.979%0.79177%0.769SS**  trans-149.1148.2160.7-148.9-63.6000108.5N346N346-D348 PolarHBondContact O-N 3.48Å; N346-D348 VanDerWaalsContact O-N 3.09Å
349G44.2Very low44.9Very low61 Ų61128.5 Ų128.563%0.62977%0.771SS**  trans-166.9152.4-165.900000117.9
350Q37.8Very low43.6Very low168 Ų168131 Ų13179%0.78578%0.775SS**  trans-150.6141.2155.7-75.5-149.7-40.400110.3
351P49.1Very low42.6Very low130 Ų130133.5 Ų133.584%0.84478%0.775SS**  trans-88.5120.8164.233.1-27.9000109.8
352M38.7Very low41.5Very low164 Ų164133.2 Ų133.281%0.80877%0.774SS**  trans-137.1128.6177-95.9-64.1-179.700114.2
353G36.4Very low41Very low64 Ų64138.7 Ų138.766%0.6678%0.784SS**  trans36.4100.1149.300000119.1
354G41.1Very low40.3Very low79 Ų79137.7 Ų137.781%0.81478%0.781SS**  trans-71131.1156.500000111
355F33.2Very low39.8Very low205 Ų205140.1 Ų140.190%0.89979%0.785SS**  trans-134.4142.5161.5-93.4-81.7000109.8
356V46.3Very low39.3Very low142 Ų142140.5 Ų140.586%0.86179%0.785SS**  trans-75.6140.4177-87.10000111.5
357M43.4Very low40Very low196 Ų196139.1 Ų139.197%0.96678%0.783SS**  trans-135.6123149.8-107.4-166.9166.700110.4
358D39.3Very low40Very low165 Ų165139.5 Ų139.588%0.88279%0.785SS**  trans-92.9168161.9-162.7-71.3000108.4
359G35Very low39.9Very low57 Ų57135.7 Ų135.759%0.58878%0.781SS**  trans116.263.7169.100000118
360Q35.5Very low40.3Very low174 Ų174138.5 Ų138.581%0.81379%0.788SS**  52.2119.6126.2-154.4-170.221.200120.7
361Q35.3Very low40.3Very low154 Ų154140 Ų14072%0.7280%0.798SS**  168.9147.8113.8-89.7-174.264.100114.8
362H33.1Very low39.8Very low156 Ų156137.9 Ų137.972%0.72280%0.8SS**  trans27.7137.3151.2-64105.2000121.2
363M35.1Very low39.8Very low182 Ų182133.5 Ų133.590%0.89780%0.796SS**  cis-147.8169.93-82.1-115.1-151.500106.3
364G33.6Very low39.9Very low59 Ų59138.7 Ų138.761%0.60881%0.805SS**  cis153.7168.7900000108.9
365I34.7Very low39.7Very low183 Ų183138 Ų13894%0.93880%0.797SS**  trans80.3133.5174-51173.4000117.5
366R32.5Very low39.9Very low224 Ų224136.2 Ų136.285%0.84579%0.794SS**  trans-154.7175.1178.8-118.9-170.378.4-152.22.5107.5
367P63.7Low39.7Very low95 Ų95136.5 Ų136.562%0.61779%0.791SS**  cis-105.7-127.3-35.642.4-27.2000107.5
368P54.9Low39.6Very low124 Ų124135.7 Ų135.781%0.80579%0.787SS**  cis-75.6-156-12.9-10.832000111.8
369G35.9Very low39.3Very low68 Ų68131 Ų13170%0.70178%0.777SS**  cis119.8154.2-13.800000115.2
370P52Low39.5Very low120 Ų120136.1 Ų136.178%0.77979%0.788SS**  cis-132166.65.542.7-27.6000117.2
371M38Very low39.9Very low199 Ų199136 Ų13698%0.9879%0.787SS**  trans47.9136.6145.8-77-170.9161.400124.4
372G39.1Very low39.9Very low86 Ų86132 Ų13289%0.88779%0.788SS**  trans124111.7157.500000112.9
373G36.8Very low40Very low71 Ų71131.8 Ų131.873%0.73279%0.787SS**  cis-172.6-176.8-3.300000111
374M39Very low40Very low174 Ų174135.6 Ų135.686%0.85779%0.791SS**  trans-57.4155.4168.8-70.171.7168.800110.5M376M374-M376 HydrophobicContact CB-SD 4.1Å; M374-M376 HydrophobicContact CG-SD 4.46Å
375G37Very low40.7Very low63 Ų63140.5 Ų140.565%0.64980%0.798SS**  cis101.516526.700000110.4
376M37.3Very low41.1Very low169 Ų169141.2 Ų141.283%0.83379%0.791SS**  trans69.1136.4-166.3-57.673.1172.400112.4M374M374-M376 HydrophobicContact CB-SD 4.1Å; M374-M376 HydrophobicContact CG-SD 4.46Å
377N43.6Very low41.5Very low147 Ų147142.5 Ų142.579%0.78681%0.809SS**  cis87.5147.129.8-166.640.3000114.3
378M39.5Very low40.4Very low180 Ų180144.9 Ų144.989%0.88782%0.819SS**  trans69.2145.4-160.9-59.4180166.600113.9
379G33.6Very low39.6Very low65 Ų65146 Ų14667%0.6782%0.819SS**  cis143.5150-9.300000113.3
380M39Very low39.8Very low165 Ų165150.3 Ų150.381%0.81383%0.826SS**  trans63.3133.6163.7-69156.797.500118.9
381E43.6Very low39.1Very low172 Ų172152.1 Ų152.180%0.80483%0.829SS**  trans70139.4145.3-67.6158-137.500120.5
382G36.4Very low39.1Very low71 Ų71149.2 Ų149.273%0.73282%0.819SS**  trans153.741.5-166.900000110.7
383Q34.1Very low39.1Very low150 Ų150153.4 Ų153.470%0.70182%0.815SS**  69.283.184.1-166.9179.499.200110.9H385Q383-H385 PolarHBondContact O-N 3.06Å; Q383-H385 VanDerWaalsContact O-N 3.15Å; Q383-H385 PolarHBondContact OE1-CE1 3.18Å
384W35.5Very low39.3Very low263 Ų263159.3 Ų159.3100%0.99682%0.821SS**  trans-53.1115.3176.7-65100.6000111.1
385H47.6Very low39.3Very low162 Ų162158.2 Ų158.275%0.7582%0.818SS**  trans-100.3133.7167.5-93.674.4000110.1Q383Q383-H385 PolarHBondContact O-N 3.06Å; Q383-H385 VanDerWaalsContact O-N 3.15Å; Q383-H385 PolarHBondContact OE1-CE1 3.18Å
386Y44.2Very low39.5Very low198 Ų198166.1 Ų166.178%0.77683%0.832SS**  trans-80.6143.4-168.6-148.7-92.3000112.2
387M40Very low39.7Very low251 Ų251165.8 Ų165.8100%1.23683%0.832SS**  trans-155.30155.8-100.1-172.6-175.100109.9

Retrieved 387 of 387 residues in 236.8 ms (Link to these results)