A0A087WPU8_MOUSE Loading...

Transcription factor

AlphaFold DB , UniProt , Accession A0A087WPU8, Species MOUSE (Mus musculus, Mouse), Gene Tfdp2, Length 446 aa.

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(Predicted Aligned Error values between residue pairs)
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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M30.5Very low33.2Very low228 Ų228132.8 Ų132.8100%1.12378%0.784SS**  0101.20-71.7166.5176.500106.2
2T30.6Very low32.6Very low134 Ų134135.8 Ų135.882%0.82279%0.794SS**  55.7128.698.554.80000113.2
3A31.2Very low32.4Very low79 Ų79131.8 Ų131.865%0.65379%0.786SS**  cis164.5150.4-10.400000105.8
4K37.8Very low31.9Very low188 Ų188134.9 Ų134.982%0.81779%0.789SS**  trans61.5125.1151.5-68.7173.9178.6-175.60117.9
5N36.1Very low31.7Very low135 Ų135135.1 Ų135.172%0.72278%0.784SS**  -175142.865.1-97.5-31.3000108.8
6V34.4Very low31.4Very low140 Ų140140.6 Ų140.685%0.84879%0.788SS**  54.5122.987.7-175.30000113.2
7G29Very low31.2Very low61 Ų61136.6 Ų136.663%0.62979%0.786SS**  cis167.6153.9-6.100000112.2
8L29.3Very low30.9Very low172 Ų172141.1 Ų141.190%0.90180%0.795SS**  trans32.7158.3144.3-69.8154.7000122.1
9P49.5Very low31Very low105 Ų105141.7 Ų141.768%0.68280%0.795SS**  cis-145-167.1-2439.2-19.5000115.4
10S27.8Very low31Very low102 Ų102141 Ų14171%0.71379%0.789SS**  trans81.5133.2151.7-112.20000118.3
11T29.1Very low30.9Very low117 Ų117141.2 Ų141.272%0.71878%0.784SS**  cis170.5131.2-13.824.20000104.4
12N26.1Very low30.9Very low168 Ų168137.1 Ų137.190%0.89877%0.767SS**  trans-161147.8162.5-108.9-40.7000112.5
13A29.4Very low30.8Very low84 Ų84140.2 Ų140.269%0.69477%0.769SS**  trans50.899.3159.200000120
14E26.2Very low30.8Very low176 Ų176141.9 Ų141.982%0.82278%0.776SS**  32.6111.9104.1-152.1-175.8-15000118.4
15L28.1Very low31Very low137 Ų137138.7 Ų138.772%0.71777%0.774SS**  175.7145.2116-115.993.4000114.1
16R27.4Very low30.7Very low223 Ų223139 Ų13984%0.84278%0.781SS**  trans39115.5149.5-70.3-171.5177.4-100.8-1.7121.3
17G27.4Very low31.1Very low74 Ų74142 Ų14276%0.76378%0.783SS**  trans-60.8170.1172.400000118.3
18F27Very low31Very low217 Ų217142.5 Ų142.595%0.95279%0.788SS**  trans-135.7158.7161.7-94-82.8000109.7
19I32.2Very low31.1Very low152 Ų152141.7 Ų141.778%0.77978%0.784SS**  trans-89.6131.8-179.9-69.1159.8000108.2
20D30.2Very low30.2Very low127 Ų127143.8 Ų143.868%0.67979%0.788SS**  162.3153.6108.7-129.6-12.4000115.4
21Q29.9Very low30.3Very low146 Ų146144.3 Ų144.368%0.68279%0.792SS**  trans62.8109.2152.1-68.7167.554.900123.2
22N30.4Very low30.3Very low143 Ų143146.1 Ų146.177%0.76580%0.797SS**  trans46.8123.2134.3-64.6-58.4000122
23F29.4Very low30.4Very low199 Ų199143.5 Ų143.587%0.87379%0.786SS**  -179.3101.7117.7-105-71.2000114.5
24S31.1Very low30.3Very low113 Ų113144.1 Ų144.179%0.7979%0.791SS**  trans64.3163149.977.90000120.5
25P40.2Very low30.4Very low121 Ų121144.2 Ų144.279%0.78679%0.789SS**  trans-105.7148.2-152.238.5-34.1000116.3
26T29.8Very low30.4Very low142 Ų142143.6 Ų143.687%0.87179%0.793SS**  trans-125.6120.5161.645.10000112.2G28T26-G28 PolarHBondContact O-N 3.35Å
27K44Very low30.5Very low203 Ų203139.6 Ų139.688%0.88379%0.794SS**  trans-25.9113.2172.8-62.3172177.4-1800115
28G27.1Very low30.5Very low71 Ų71141 Ų14173%0.73279%0.792SS**  trans-86.6114.816000000110.1T26 I30T26-G28 PolarHBondContact O-N 3.35Å; G28-I30 PolarHBondContact O-N 3.25Å
29N31.8Very low30.9Very low155 Ų155136.8 Ų136.883%0.82979%0.789SS**  trans-72.5120.9171.1-68.8-19.7000109.2
30I30.2Very low30.8Very low150 Ų150135.3 Ų135.377%0.76979%0.787SS**  trans-86114.6166.9-57.6176.4000107.5G28 L32G28-I30 PolarHBondContact O-N 3.25Å; I30-L32 HydrophobicContact CG2-CD1 3.94Å; I30-L32 HydrophobicContact CG2-CG 4.13Å
31S28.8Very low31.1Very low113 Ų113137.6 Ų137.679%0.7980%0.8SS**  trans-96.7117.2167.1-169.20000108.2
32L29.8Very low31.1Very low155 Ų155135.2 Ų135.281%0.81280%0.799SS**  trans-112.3110.7175.1-96.9156.1000108.7I30I30-L32 HydrophobicContact CG2-CD1 3.94Å; I30-L32 HydrophobicContact CG2-CG 4.13Å
33V27.7Very low31.5Very low113 Ų113134.7 Ų134.769%0.68580%0.804SS**  trans-82.7112.7172.3176.90000107.9F35V33-F35 HydrophobicContact CG1-CD2 4.4Å; V33-F35 HydrophobicContact CG1-CE2 4.07Å
34A28.5Very low31.6Very low96 Ų96130.8 Ų130.879%0.79380%0.796SS**PPolyproline II helixtrans-93.4123.9173.400000110.4
35F27.8Very low31.7Very low178 Ų178135.4 Ų135.478%0.78180%0.802SS**PPolyproline II helixtrans-90.4135.7164.8-76.2-88.2000109.5V33 V37V33-F35 HydrophobicContact CG1-CD2 4.4Å; V33-F35 HydrophobicContact CG1-CE2 4.07Å; F35-V37 PolarHBondContact O-N 3.44Å
36P28.5Very low31.4Very low124 Ų124137.1 Ų137.181%0.80580%0.803SS**PPolyproline II helixtrans-73.9123.317429.8-32.4000110.2
37V29.1Very low31.5Very low140 Ų140137.7 Ų137.785%0.84880%0.8SS**  trans-94.5114.1169.7-179.60000108.5F35F35-V37 PolarHBondContact O-N 3.44Å
38S28Very low31.1Very low103 Ų103133.9 Ų133.972%0.7280%0.796SS**  trans-66.4146.1175.3-61.30000111.8T40S38-T40 PolarHBondContact O-N 2.89Å
39S34.9Very low31.3Very low128 Ų128139.5 Ų139.590%0.89580%0.8SS**  trans-55.5122.1-178.5-56.30000113.7
40T29.7Very low31.6Very low122 Ų122138.2 Ų138.275%0.74880%0.798SS**  trans-126.5122.2165.1580000110.1S38 S42S38-T40 PolarHBondContact O-N 2.89Å; T40-S42 PolarHBondContact O-N 2.85Å
41N37.2Very low31.6Very low175 Ų175139.1 Ų139.194%0.93680%0.803SS**  trans-70.6115.5177.7-78.3-42.2000111.6
42S30.1Very low31.9Very low95 Ų95136.3 Ų136.366%0.66479%0.793SS**  trans-164.2146.5149.259.60000111.7T40T40-S42 PolarHBondContact O-N 2.85Å
43P37.9Very low32Very low133 Ų133135.7 Ų135.786%0.86480%0.798SS**  trans-102.392.8-179.836.3-30.5000112.7
44T31.7Very low32.1Very low117 Ų117136.8 Ų136.872%0.71880%0.798SS**  trans-131.295.5168.535.70000111.5I46T44-I46 PolarHBondContact O-N 2.96Å
45K32.6Very low32.7Very low210 Ų210139.5 Ų139.591%0.91380%0.8SS**  trans-74.8100.8168.5-85.6-171.3174.1-177.30110.1
46I33.8Very low32.9Very low157 Ų157136.1 Ų136.181%0.80579%0.793SS**PPolyproline II helixtrans-80.3118.2161.7-60.9174.9000107.8T44T44-I46 PolarHBondContact O-N 2.96Å
47L33.4Very low33.3Very low154 Ų154138 Ų13881%0.80680%0.796SS**PPolyproline II helixtrans-97.8117.7167.9-84.2164.1000108.9K49L47-K49 PolarHBondContact O-N 2.84Å
48P34Very low34Very low122 Ų122136 Ų13679%0.79278%0.784SS**PPolyproline II helixtrans-72.1126167.928.9-31.1000109.8
49K32.7Very low34.8Very low190 Ų190133.4 Ų133.483%0.82677%0.774SS**PPolyproline II helixtrans-88.1141.7171.2-102.3178.1175.8176.30110.4L47L47-K49 PolarHBondContact O-N 2.84Å
50T37.2Very low36.1Very low128 Ų128130.3 Ų130.379%0.78575%0.751SS**  trans56.4111.4157.161.50000118.5
51L30.9Very low37.2Very low168 Ų168130 Ų13088%0.8874%0.741SS**  trans-121.8141.6145.4-82.9169.3000108.9
52G34.3Very low39.1Very low55 Ų55122.9 Ų122.957%0.56770%0.703SS**  trans-74.6-179.9178.300000113.2I54G52-I54 PolarHBondContact O-N 2.85Å
53P31.5Very low41.2Very low142 Ų142123.9 Ų123.992%0.92270%0.699SS**  trans-68.6114.5-172.727.9-34.4000111.9
54I31.5Very low43Very low135 Ų135119.8 Ų119.869%0.69267%0.669SS**  trans-96.2116164.4-63.4176000107.2G52 V56G52-I54 PolarHBondContact O-N 2.85Å; I54-V56 PolarHBondContact O-N 2.96Å
55N39.6Very low44.1Very low154 Ų154117.4 Ų117.482%0.82466%0.658SS**  trans-80.2105.9177.4-175-4.4000109.8
56V32.9Very low45Very low106 Ų106110.7 Ų110.764%0.64263%0.634SS**  trans-128.6122.9163.8-81.70000108.7I54 V58I54-V56 PolarHBondContact O-N 2.96Å; V56-V58 PolarHBondContact O-N 3.31Å
57N37.4Very low45.2Very low164 Ų164108.9 Ų108.988%0.87763%0.633SS**  trans-76.574.2179.7-177.742.4000110.8
58V43.4Very low45.5Very low97 Ų97109.7 Ų109.759%0.58863%0.632SS**  trans-131.5131.4169.9-172.90000106.6V56 Q61V56-V58 PolarHBondContact O-N 3.31Å; V58-Q61 HydrophobicContact CG1-CG 4.44Å
59G44.3Very low45.5Very low50 Ų50115.1 Ų115.152%0.51564%0.637SS.*  trans-59.7157.6176.800000111.7Q61G59-Q61 WeakPolarHBondContact O-CG 3.44Å; G59-Q61 PolarHBondContact O-N 3.41Å
60P62.1Low45.5Very low63 Ų63113.4 Ų113.441%0.40964%0.635SS.*  trans-64107.3-177.827.7-34.9000110.6F302 F306P60-F302 HydrophobicContact CG-CB 4.5Å; P60-F306 HydrophobicContact CB-CE1 4.13Å
61Q52.1Low45.3Very low116 Ų116111.6 Ų111.654%0.54263%0.634SS.*EExtended strand (participates in β ladder)trans-97.6137.7175.3-58.3-160.6-52.100110.2V58 G59 L299 N301V58-Q61 HydrophobicContact CG1-CG 4.44Å; G59-Q61 WeakPolarHBondContact O-CG 3.44Å; G59-Q61 PolarHBondContact O-N 3.41Å; Q61-L299 HydrophobicContact CB-CD1 4.24Å; Q61-N301 WeakPolarHBondContact CG-OD1 3.21Å; Q61-N301 PolarHBondContact NE2-OD1 2.81Å
62M76.9Confident45.2Very low25 Ų25111 Ų11112%0.12363%0.632CS.*EExtended strand (participates in β ladder)trans-127.8128.1174.7-174-163.462.900110.1I64 I279 L299 F300 F306 I308M62-I64 HydrophobicContact CE-CD1 3.5Å; M62-I64 HydrophobicContact CE-CG1 3.81Å; M62-I64 HydrophobicContact SD-CD1 4.14Å; M62-I64 HydrophobicContact SD-CG1 4.21Å; M62-I279 HydrophobicContact CE-CD1 3.54Å; M62-I279 HydrophobicContact SD-CD1 4.17Å; M62-L299 WeakPolarHBondContact O-CA 3.45Å; M62-F300 HydrophobicContact CE-CB 4.11Å; M62-F300 HydrophobicContact CE-CD2 3.39Å; M62-F300 HydrophobicContact CE-CE2 4.04Å; M62-F300 HydrophobicContact CE-CG 4.02Å; M62-F300 PolarHBondContact N-O 3.18Å; M62-F300 PolarHBondContact O-N 3.17Å; M62-F306 HydrophobicContact CB-CZ 4.23Å; M62-F306 HydrophobicContact SD-CE2 4.35Å; M62-I308 HydrophobicContact SD-CD1 3.89Å
63I74.4Confident45.1Very low115 Ų115114.6 Ų114.659%0.5965%0.648SS**EExtended strand (participates in β ladder)trans-109.5126.2174.2-60.1170.1000108.4Y298 L299I63-Y298 CarbonylContact C-O 3.59Å; I63-Y298 WeakPolarHBondContact CA-O 3.43Å; I63-L299 HydrophobicContact CG1-CD1 3.73Å
64I76.8Confident45.1Very low47 Ų47111.3 Ų111.324%0.24164%0.64CS.*EExtended strand (participates in β ladder)trans-112.5114.3169.9-62.6175.3000107.9M62 I277 I279 E297 Y298 F300M62-I64 HydrophobicContact CE-CD1 3.5Å; M62-I64 HydrophobicContact CE-CG1 3.81Å; M62-I64 HydrophobicContact SD-CD1 4.14Å; M62-I64 HydrophobicContact SD-CG1 4.21Å; I64-I277 HydrophobicContact CD1-CD1 4.2Å; I64-I279 HydrophobicContact CD1-CD1 4.37Å; I64-E297 WeakPolarHBondContact O-CA 3.38Å; I64-Y298 PolarHBondContact N-O 2.78Å; I64-Y298 PolarHBondContact O-N 2.85Å; I64-F300 HydrophobicContact CD1-CE2 4.41Å
65S53.3Low45Very low68 Ų68110.6 Ų110.648%0.47665%0.647SS.*EExtended strand (participates in β ladder)trans-110.5131.2171.8-50.90000109.5F296 E297S65-F296 CarbonylContact C-O 3.53Å; S65-F296 VanDerWaalsContact CA-O 3.3Å; S65-F296 WeakPolarHBondContact CA-O 3.35Å; S65-E297 PolarHBondContact OG-OE1 2.73Å; S65-E297 VanDerWaalsContact OG-OE1 3.05Å
66T52.4Low44.7Very low68 Ų68109.4 Ų109.442%0.41765%0.645SS.*PPolyproline II helixtrans-99.4136-179.549.20000112.2F296T66-F296 PolarHBondContact N-O 3.4Å; T66-F296 WeakPolarHBondContact OG1-CD1 3.35Å; T66-F296 PolarHBondContact OG1-O 3.11Å
67P37Very low44.7Very low120 Ų120112.3 Ų112.378%0.77966%0.656SS**PPolyproline II helixtrans-74.3138.9-179.629.1-33.8000111.9R69P67-R69 PolarHBondContact O-N 2.85Å
68Q40Very low44.5Very low170 Ų170112.7 Ų112.779%0.79466%0.656SS**PPolyproline II helixtrans-62.9128.9-178.1-70.7-177-10.800112.5F296Q68-F296 HydrophobicContact CG-CE1 4.42Å
69R35.6Very low43.7Very low236 Ų236111.2 Ų111.289%0.89166%0.661SS**  trans-112.7116.7165-167.6179.6-165.8179.65.8109.3P67 A71P67-R69 PolarHBondContact O-N 2.85Å; R69-A71 PolarHBondContact O-N 2.73Å
70I32.7Very low43Very low154 Ų154115.8 Ų115.879%0.7967%0.674SS**  trans-63.8128173.5-61.3171.2000108.6
71A31.4Very low41.6Very low91 Ų91118.6 Ų118.675%0.75269%0.692SS**  trans-90.4104.8-176.200000111.5R69R69-A71 PolarHBondContact O-N 2.73Å
72N29.3Very low40.5Very low156 Ų156123.5 Ų123.583%0.83471%0.707SS**  trans-108.5117.4160.9-88.127.5000109.5
73S32.7Very low38.6Very low129 Ų129128.7 Ų128.790%0.90274%0.74SS**  trans-80.6126.3176.5-56.40000110.9
74G31.7Very low36.9Very low74 Ų74129 Ų12976%0.76375%0.75SS**  trans173.1105.4172.900000116
75S29.6Very low34.8Very low120 Ų120131.4 Ų131.484%0.83978%0.776SS**  trans40.3125.9152.3-150.80000121.5
76V33.6Very low33.9Very low129 Ų129134.5 Ų134.578%0.78280%0.795SS**  trans-81123.4167.7174.30000110.7
77L31.9Very low32.7Very low166 Ų166135.3 Ų135.387%0.86981%0.808SS**  trans-144.8142.4151.8-78.3-175.8000111.1
78I32.6Very low32.3Very low172 Ų172138.1 Ų138.188%0.88281%0.813SS**  trans-92.9136.6-178.8-66.3170.3000109.3
79G26.8Very low31.7Very low67 Ų67137.1 Ų137.169%0.69182%0.819SS**  trans-170.9132.1172.500000113.9
80N30.7Very low31.3Very low146 Ų146132 Ų13278%0.78181%0.814SS**  trans-69.2150.4178.2-69.24.2000112.5
81P31.3Very low31.1Very low122 Ų122134 Ų13479%0.79282%0.82SS**  trans-89.9101.4163.834-28.5000111.1
82Y29.6Very low31Very low218 Ų218134.8 Ų134.886%0.85582%0.815SS**  trans-130113.6153.1-93.5-78.6000108.1
83T37.8Very low31Very low135 Ų135137 Ų13783%0.82882%0.82SS**PPolyproline II helixtrans-87.4128.9-176.644.60000111.8
84P38.8Very low30.9Very low122 Ų122138 Ų13879%0.79281%0.814SS**PPolyproline II helixtrans-89.9144160.834.1-29.7000111.2
85A32.3Very low30.8Very low96 Ų96138.9 Ų138.979%0.79381%0.814SS**PPolyproline II helixtrans-76.6149.517400000112.1
86P33.8Very low30.7Very low133 Ų133142.4 Ų142.486%0.86482%0.817SS**PPolyproline II helixtrans-86.4148.5166.135-31.8000111.1
87A28.4Very low30.6Very low85 Ų85141.3 Ų141.370%0.70282%0.821SS**  trans-126.2150.1176.500000111.7
88M27.1Very low30.4Very low179 Ų179138.5 Ų138.588%0.88282%0.822SS**  trans69.4121.7160.3-47.8-167.7179.300119.8
89V27.6Very low30.1Very low150 Ų150133.3 Ų133.391%0.90981%0.811SS**  -141.2137.4120.9176.70000108.1
90T28.2Very low30.1Very low129 Ų129142.4 Ų142.479%0.79183%0.825SS**  trans-100.9151.6175.540.70000111.6
91Q27.6Very low30.2Very low196 Ų196141.8 Ų141.892%0.91683%0.826SS**  trans-139.6141.5157-151.8170.435.700111.2
92T29.6Very low30.7Very low106 Ų106141.3 Ų141.365%0.6582%0.823SS**  trans-95.2151.1-163.348.20000113.7
93H28.9Very low30.7Very low203 Ų203135.5 Ų135.594%0.9481%0.814SS**  trans-145.2154.5140-100.9-76.2000111.3
94I31.7Very low30.3Very low151 Ų151135.5 Ų135.577%0.77481%0.809SS**  trans-125140.1-160.7-65.9162.2000110.6
95A30.2Very low30Very low91 Ų91141.1 Ų141.175%0.75281%0.814SS**  trans-175.196.714600000107.6
96E27Very low30Very low194 Ų194145.3 Ų145.391%0.90782%0.815SS**  90.1138.889.3-95.9-167.5169.400114
97A30Very low29.9Very low106 Ų106149.1 Ų149.188%0.87681%0.812SS**  trans-147137.1-167.100000113.4
98A29.1Very low30Very low107 Ų107149.6 Ų149.688%0.88482%0.815SS**  trans-168.6144.915600000106.8
99G26.2Very low30.2Very low63 Ų63151 Ų15165%0.64981%0.811SS**  cis148.6165.53.800000109.1
100W26.7Very low30.4Very low258 Ų258150.8 Ų150.898%0.97780%0.8SS**  trans87.9132.8168.2-62.673.6000120.9
101V31.9Very low30.5Very low134 Ų134153.8 Ų153.881%0.81280%0.803SS**  trans-165.6154.2-172167.20000105.8
102P43.3Very low31Very low112 Ų112150.9 Ų150.973%0.72779%0.792SS**  cis-130.5-166.94.830.8-6.9000115.6
103S27.8Very low31.2Very low95 Ų95152.4 Ų152.466%0.66480%0.796SS**  112.1125.5127.2-107.10000122.5
104D30.8Very low31.3Very low135 Ų135148.6 Ų148.672%0.72279%0.792SS**  trans64.4116.9142.4-68.8-68.2000123.5
105R32.7Very low31.5Very low241 Ų241148.5 Ų148.591%0.90979%0.793SS**  172.2120.3107.2-90165.3-160.2-151.55.3116.7
106K32.4Very low31.5Very low183 Ų183153.5 Ų153.580%0.79680%0.798SS**  trans25.5126.1135.7-88.7173.4176.61650123.5
107R31.5Very low31.7Very low214 Ų214147.6 Ų147.681%0.80878%0.779SS**  103116.3113.4-176.5-176.9-78.3-175.6-6.6121.8
108A29Very low32Very low94 Ų94151.9 Ų151.978%0.77778%0.781SS**  trans66.1158.9149.500000118.5
109R32.5Very low32.2Very low209 Ų209151.5 Ų151.579%0.78977%0.771SS**  cis-157.1142.817.7-170.7172.9-179.8178.70.2113.9
110E31.6Very low33.1Very low145 Ų145158.6 Ų158.668%0.67878%0.784SS**  trans17.5134.3153.4-55.2162.8161.900123.1
111F29.7Very low33.8Very low193 Ų193158.1 Ų158.185%0.84678%0.782SS**  trans-158.5108136.9-134.4-95.1000113.7
112I39Very low34.1Very low135 Ų135156.9 Ų156.969%0.69278%0.78SS**  trans27.7111.4143-53.9174.5000117.3
113D32.3Very low34Very low137 Ų137161.1 Ų161.173%0.73379%0.787SS**  84.4123.260.2-169.124.4000115.6
114S32.3Very low34.7Very low124 Ų124167 Ų16787%0.86780%0.8SS**  trans-172.691.1163.9-82.70000111.2
115D35.5Very low35.1Very low149 Ų149161.9 Ų161.980%0.79778%0.78SS**  trans-66.2135.8167.8-128.3-19.9000112
116F29.8Very low36Very low195 Ų195158.1 Ų158.186%0.85578%0.777SS**  trans-155.5100.2148.1-146.4-109.1000116.6
117S32Very low37.1Very low71 Ų71157.4 Ų157.450%0.49778%0.775SS.*  trans72.5100.8143.675.60000119.9S119S117-S119 PolarHBondContact O-N 3.37Å
118E36.4Very low38.3Very low196 Ų196154.8 Ų154.892%0.91678%0.777SS**  trans-60.6124.4145.7-175.9174.9-172.700110.1
119S32Very low40.1Very low98 Ų98151.5 Ų151.569%0.68575%0.751SS**  trans-142.389.2174.6-89.90000113.2S117 R121S117-S119 PolarHBondContact O-N 3.37Å; S119-R121 PolarHBondContact O-N 3.11Å
120K46.4Very low42.3Very low212 Ų212145.5 Ų145.592%0.92273%0.731SS**  trans17.392.2151.4-64.7-177.9-179.9175.30116.3
121R40.3Very low44.9Very low248 Ų248140.2 Ų140.294%0.93672%0.716SS**  trans-113.897.1154.9-81.5-172172.9174.90.2112.5S119S119-R121 PolarHBondContact O-N 3.11Å
122S37.9Very low47.9Very low109 Ų109134.5 Ų134.576%0.76269%0.694SS**  trans68.688.2147.1-147.80000118.9K124S122-K124 PolarHBondContact O-N 3.01Å
123K41.7Very low50.3Low201 Ų201138 Ų13887%0.87470%0.698SS**  19.895120.3-157.5171.3-171.6177.90114.3G125K123-G125 PolarHBondContact O-N 2.99Å
124K42.9Very low53.2Low218 Ų218133.9 Ų133.995%0.94867%0.674SS**  trans-67.471170.6-172176.2-179.2177.70109.9S122S122-K124 PolarHBondContact O-N 3.01Å
125G40.2Very low56.1Low28 Ų28128.3 Ų128.329%0.28964%0.635SS.*  trans-77.7162.3-171.700000114K123 K127K123-G125 PolarHBondContact O-N 2.99Å; G125-K127 PolarHBondContact O-N 3.37Å
126D50.1Low58.9Low161 Ų161122.9 Ų122.986%0.86161%0.608SS**  trans-65.661-171.5-49.7-86.6000114.3N128D126-N128 PolarHBondContact O-N 2.95Å
127K55.5Low61.9Low169 Ų169117.5 Ų117.574%0.73559%0.587SS**G310 helixtrans-80.6-2.3-179.6-67.5179.6-178.81790113.5G125 G129 K130G125-K127 PolarHBondContact O-N 3.37Å; K127-G129 PolarHBondContact O-N 2.86Å; K127-K130 PolarHBondContact O-N 3.06Å
128N56.9Low64.8Low159 Ų159116.7 Ų116.785%0.8557%0.574SS**G310 helixtrans-62.1-15.5-172.3-67.262000114.7D126D126-N128 PolarHBondContact O-N 2.95Å
129G67Low67.6Low24 Ų24107.3 Ų107.325%0.24753%0.53CS..G310 helixtrans-116.82.5-178.200000117.4K127 H134K127-G129 PolarHBondContact O-N 2.86Å; G129-H134 PolarHBondContact O-ND1 2.9Å
130K78.8Confident70.6Confident83 Ų83103.8 Ų103.836%0.36151%0.506SS..SBendtrans-115.46.6-176.2-64.3-157.1-171.1-159.30115.4K127 F135 F162 D176K127-K130 PolarHBondContact O-N 3.06Å; K130-F135 WeakPolarHBondContact O-CE2 3.45Å; K130-F162 HydrophobicContact CD-CE1 4.11Å; K130-F162 HydrophobicContact CD-CZ 3.94Å; K130-F162 HydrophobicContact CG-CE1 4.2Å; K130-F162 HydrophobicContact CG-CE2 4.31Å; K130-F162 HydrophobicContact CG-CZ 3.54Å; K130-D176 IonicContact NZ-OD1 3.44Å; K130-D176 PolarHBondContact NZ-OD1 2.86Å; K130-D176 IonicContact NZ-OD2 2.66Å; K130-D176 PolarHBondContact NZ-OD2 3Å
131G86.8Confident72.8Confident35 Ų3596.4 Ų96.436%0.36147%0.474SS..SBendtrans-85.3160.4-178.700000114.5R133 H134 F135G131-R133 PolarHBondContact O-N 3.17Å; G131-H134 WeakPolarHBondContact O-CB 3.47Å; G131-H134 PolarHBondContact O-N 3.05Å; G131-F135 WeakPolarHBondContact O-CD2 3.22Å; G131-F135 PolarHBondContact O-N 3.31Å
132L91.2Very high75.4Confident72 Ų7285 Ų8538%0.37743%0.431SS..Hα-helixtrans-54.3-39175.6178.462.3000111.9H134 F135 S136 R183 D186L132-H134 VanDerWaalsContact C-N 3.28Å; L132-H134 PolarHBondContact O-N 2.93Å; L132-F135 PolarHBondContact O-N 3.17Å; L132-S136 WeakPolarHBondContact O-CB 3.44Å; L132-S136 PolarHBondContact O-N 2.68Å; L132-S136 PolarHBondContact O-OG 3.24Å; L132-R183 HydrophobicContact CD1-CB 4.26Å; L132-D186 HydrophobicContact CD1-CB 3.73Å; L132-D186 HydrophobicContact CD2-CB 4.35Å
133R91.1Very high78.1Confident209 Ų20979.8 Ų79.879%0.78940%0.395SS*.Hα-helixtrans-54.2-41.5174.6-173.1-178.9-176.1-82.41.3112.9G131 M137G131-R133 PolarHBondContact O-N 3.17Å; R133-M137 WeakPolarHBondContact O-CB 3.48Å; R133-M137 PolarHBondContact O-N 3.25Å; R133-M137 VanDerWaalsContact O-N 3.11Å
134H91.4Very high80.5Confident50 Ų5075.3 Ų75.323%0.23138%0.377CS..Hα-helixtrans-70.4-45.5179-178.4-122.7000111.2G129 G131 L132 M137 K138G129-H134 PolarHBondContact O-ND1 2.9Å; G131-H134 WeakPolarHBondContact O-CB 3.47Å; G131-H134 PolarHBondContact O-N 3.05Å; L132-H134 VanDerWaalsContact C-N 3.28Å; L132-H134 PolarHBondContact O-N 2.93Å; H134-M137 PolarHBondContact O-N 2.89Å; H134-K138 WeakPolarHBondContact O-CG 3.15Å; H134-K138 PolarHBondContact O-N 3.01Å
135F93.6Very high83Confident8 Ų873 Ų734%0.03536%0.363CS..Hα-helixtrans-65.8-38.6177-65.1-56.2000112.8K130 G131 L132 K138 V139 F162 I180 R183K130-F135 WeakPolarHBondContact O-CE2 3.45Å; G131-F135 WeakPolarHBondContact O-CD2 3.22Å; G131-F135 PolarHBondContact O-N 3.31Å; L132-F135 PolarHBondContact O-N 3.17Å; F135-K138 PolarHBondContact O-N 2.98Å; F135-V139 WeakPolarHBondContact O-CB 3.39Å; F135-V139 WeakPolarHBondContact O-CG2 3.45Å; F135-V139 PolarHBondContact O-N 2.52Å; F135-F162 HydrophobicContact CE1-CD2 4.46Å; F135-I180 HydrophobicContact CD1-CG1 4.47Å; F135-I180 HydrophobicContact CE1-CD1 4.29Å; F135-I180 HydrophobicContact CE1-CG1 3.68Å; F135-I180 HydrophobicContact CE1-CG2 4.47Å; F135-I180 HydrophobicContact CE2-CG1 4.47Å; F135-I180 HydrophobicContact CZ-CD1 4.45Å; F135-I180 HydrophobicContact CZ-CG1 3.67Å; F135-R183 HydrophobicContact CB-CB 4.07Å; F135-R183 HydrophobicContact CD2-CB 3.85Å; F135-R183 HydrophobicContact CD2-CG 3.85Å; F135-R183 HydrophobicContact CE2-CG 4.35Å; F135-R183 HydrophobicContact CG-CB 4.15Å
136S94.6Very high85.5Confident34 Ų3475 Ų7524%0.23836%0.363CS..Hα-helixtrans-63.4-41.8174.9-59.90000112.2L132 C140L132-S136 WeakPolarHBondContact O-CB 3.44Å; L132-S136 PolarHBondContact O-N 2.68Å; L132-S136 PolarHBondContact O-OG 3.24Å; S136-C140 VanDerWaalsContact O-CB 3.3Å; S136-C140 WeakPolarHBondContact O-CB 3.43Å; S136-C140 PolarHBondContact O-N 3.11Å
137M92.7Very high87.3Confident83 Ų8368.7 Ų68.741%0.40934%0.336SS..Hα-helixtrans-60.3-48.6173.5-172.1179.681.900111R133 H134 C140 E141R133-M137 WeakPolarHBondContact O-CB 3.48Å; R133-M137 PolarHBondContact O-N 3.25Å; R133-M137 VanDerWaalsContact O-N 3.11Å; H134-M137 PolarHBondContact O-N 2.89Å; M137-C140 WeakPolarHBondContact O-CB 3.44Å; M137-C140 PolarHBondContact O-N 3.01Å; M137-E141 WeakPolarHBondContact O-CG 3.41Å; M137-E141 PolarHBondContact O-N 3.27Å
138K93.9Very high89.1Confident53 Ų5364 Ų6423%0.2332%0.322CS..Hα-helixtrans-67.1-36.8179.6-71.6-73.1160.8-141.90113.7H134 F135 E141 K142 L158H134-K138 WeakPolarHBondContact O-CG 3.15Å; H134-K138 PolarHBondContact O-N 3.01Å; F135-K138 PolarHBondContact O-N 2.98Å; K138-E141 IonicContact NZ-OE1 2.65Å; K138-E141 PolarHBondContact NZ-OE1 3.04Å; K138-E141 IonicContact NZ-OE2 2.69Å; K138-E141 PolarHBondContact NZ-OE2 3.14Å; K138-K142 WeakPolarHBondContact O-CB 3.33Å; K138-K142 PolarHBondContact O-N 2.94Å; K138-L158 HydrophobicContact CB-CD2 3.69Å
139V95.5Very high91Very high0 Ų056.9 Ų56.90%028%0.284CS..Hα-helixtrans-63.1-45171.8167.60000110.6F135 K142 V143 V154 L158 V184 A187 L188 L191F135-V139 WeakPolarHBondContact O-CB 3.39Å; F135-V139 WeakPolarHBondContact O-CG2 3.45Å; F135-V139 PolarHBondContact O-N 2.52Å; V139-K142 PolarHBondContact O-N 3.02Å; V139-V143 HydrophobicContact CG1-CG2 4.43Å; V139-V143 WeakPolarHBondContact O-CG2 3.33Å; V139-V143 PolarHBondContact O-N 2.8Å; V139-V154 HydrophobicContact CG1-CG1 4.36Å; V139-V154 HydrophobicContact CG2-CG1 4.05Å; V139-L158 HydrophobicContact CG2-CD1 3.58Å; V139-V184 HydrophobicContact CG2-CB 4.28Å; V139-V184 HydrophobicContact CG2-CG1 4.13Å; V139-V184 HydrophobicContact CG2-CG2 3.84Å; V139-A187 HydrophobicContact CB-CB 4.04Å; V139-A187 HydrophobicContact CG1-CB 4.06Å; V139-A187 HydrophobicContact CG2-CB 4.1Å; V139-L188 HydrophobicContact CG1-CD2 3.57Å; V139-L188 HydrophobicContact CG1-CG 3.94Å; V139-L191 HydrophobicContact CG1-CD1 3.91Å
140C93.5Very high92.4Very high24 Ų2457.5 Ų57.516%0.16229%0.285CS..Hα-helixtrans-60.1-53.5177.4-167.70000111.4S136 M137 K142 V143 Q144 L191S136-C140 VanDerWaalsContact O-CB 3.3Å; S136-C140 WeakPolarHBondContact O-CB 3.43Å; S136-C140 PolarHBondContact O-N 3.11Å; M137-C140 WeakPolarHBondContact O-CB 3.44Å; M137-C140 PolarHBondContact O-N 3.01Å; C140-K142 PolarHBondContact O-N 2.93Å; C140-V143 PolarHBondContact O-N 3.41Å; C140-Q144 VanDerWaalsContact O-CB 3.28Å; C140-Q144 WeakPolarHBondContact O-CB 3.46Å; C140-Q144 PolarHBondContact O-N 3.42Å; C140-L191 HydrophobicContact CB-CD1 4.2Å; C140-L191 HydrophobicContact CB-CD2 4.45Å
141E94.1Very high93.2Very high56 Ų5654.9 Ų54.926%0.26227%0.272SS..Hα-helixtrans-53-41.2174.6-72.4173.4-149.100112.5M137 K138 R145M137-E141 WeakPolarHBondContact O-CG 3.41Å; M137-E141 PolarHBondContact O-N 3.27Å; K138-E141 IonicContact NZ-OE1 2.65Å; K138-E141 PolarHBondContact NZ-OE1 3.04Å; K138-E141 IonicContact NZ-OE2 2.69Å; K138-E141 PolarHBondContact NZ-OE2 3.14Å; E141-R145 VanDerWaalsContact O-CB 3.3Å; E141-R145 WeakPolarHBondContact O-CB 3.34Å; E141-R145 PolarHBondContact O-N 3.37Å
142K94.2Very high93.6Very high8 Ų857.5 Ų57.54%0.03528%0.278CS..Hα-helixtrans-72.4-45.5-175-170.970.671.5162.10112.2K138 V139 C140 R145 K146 V154 E157 E161K138-K142 WeakPolarHBondContact O-CB 3.33Å; K138-K142 PolarHBondContact O-N 2.94Å; V139-K142 PolarHBondContact O-N 3.02Å; C140-K142 PolarHBondContact O-N 2.93Å; K142-R145 PolarHBondContact O-N 3.32Å; K142-K146 HydrophobicContact CD-CD 4.48Å; K142-K146 HydrophobicContact CG-CD 4.48Å; K142-K146 PolarHBondContact O-N 3.26Å; K142-K146 VanDerWaalsContact O-N 3.14Å; K142-V154 HydrophobicContact CG-CG1 4.34Å; K142-V154 HydrophobicContact CG-CG2 4.23Å; K142-E157 VanDerWaalsContact CD-OE2 3.25Å; K142-E157 WeakPolarHBondContact CD-OE2 3.46Å; K142-E157 WeakPolarHBondContact CE-OE2 3.27Å; K142-E157 IonicContact NZ-OE2 3.84Å; K142-E157 PolarHBondContact NZ-OE2 2.89Å; K142-E161 IonicContact NZ-OE1 2.67Å; K142-E161 PolarHBondContact NZ-OE1 2.76Å; K142-E161 IonicContact NZ-OE2 2.8Å
143V94.9Very high93.7Very high0 Ų057.4 Ų57.40%028%0.276CS..Hα-helixtrans-66.2-41.8176.1-179.60000110.2V139 C140 R145 K146 G147 T149 V154 L188 I197 I204 W206V139-V143 HydrophobicContact CG1-CG2 4.43Å; V139-V143 WeakPolarHBondContact O-CG2 3.33Å; V139-V143 PolarHBondContact O-N 2.8Å; C140-V143 PolarHBondContact O-N 3.41Å; V143-R145 PolarHBondContact O-N 2.94Å; V143-K146 PolarHBondContact O-N 2.95Å; V143-G147 PolarHBondContact O-N 2.86Å; V143-T149 HydrophobicContact CB-CG2 4.34Å; V143-T149 HydrophobicContact CG1-CG2 4.21Å; V143-T149 HydrophobicContact CG2-CG2 3.91Å; V143-V154 HydrophobicContact CG2-CG2 4.13Å; V143-L188 HydrophobicContact CG2-CD2 4.19Å; V143-I197 HydrophobicContact CB-CG2 4.4Å; V143-I197 HydrophobicContact CG1-CB 4.49Å; V143-I197 HydrophobicContact CG1-CG2 3.75Å; V143-I204 HydrophobicContact CG1-CG2 3.93Å; V143-I204 HydrophobicContact CG2-CG2 4.25Å; V143-W206 HydrophobicContact CB-CE3 4.43Å; V143-W206 HydrophobicContact CG1-CB 4.22Å; V143-W206 HydrophobicContact CG1-CE3 4.22Å
144Q92.4Very high93.9Very high107 Ų10747.5 Ų47.550%0.524%0.238SC..Hα-helixtrans-58-48.7175-175.7-179.92500112.2C140 K146 G147 W206C140-Q144 VanDerWaalsContact O-CB 3.28Å; C140-Q144 WeakPolarHBondContact O-CB 3.46Å; C140-Q144 PolarHBondContact O-N 3.42Å; Q144-K146 PolarHBondContact O-N 3.12Å; Q144-G147 PolarHBondContact O-N 2.86Å; Q144-W206 HydrophobicContact CB-CD2 3.81Å; Q144-W206 HydrophobicContact CB-CE3 3.76Å; Q144-W206 HydrophobicContact CB-CH2 3.93Å; Q144-W206 HydrophobicContact CB-CZ2 3.97Å; Q144-W206 HydrophobicContact CB-CZ3 3.83Å; Q144-W206 HydrophobicContact CG-CD2 4.08Å; Q144-W206 HydrophobicContact CG-CE3 4.47Å; Q144-W206 HydrophobicContact CG-CH2 4.17Å; Q144-W206 HydrophobicContact CG-CZ2 3.74Å
145R94.1Very high94.1Very high170 Ų17045.1 Ų45.164%0.64223%0.227SC*.Hα-helixtrans-67-36.1-177.4-170.4-177.1-55.4146.111.2113.2E141 K142 V143E141-R145 VanDerWaalsContact O-CB 3.3Å; E141-R145 WeakPolarHBondContact O-CB 3.34Å; E141-R145 PolarHBondContact O-N 3.37Å; K142-R145 PolarHBondContact O-N 3.32Å; V143-R145 PolarHBondContact O-N 2.94Å
146K92.3Very high94Very high71 Ų7147.7 Ų47.731%0.30924%0.242SC..Hα-helixtrans-81.7-26.4179-72.1178.9176.1-80.50112.8K142 V143 Q144 T148 T149 E153 E157K142-K146 HydrophobicContact CD-CD 4.48Å; K142-K146 HydrophobicContact CG-CD 4.48Å; K142-K146 PolarHBondContact O-N 3.26Å; K142-K146 VanDerWaalsContact O-N 3.14Å; V143-K146 PolarHBondContact O-N 2.95Å; Q144-K146 PolarHBondContact O-N 3.12Å; K146-T148 PolarHBondContact O-N 3.25Å; K146-T149 WeakPolarHBondContact CD-OG1 3.19Å; K146-E153 HydrophobicContact CD-CG 4.47Å; K146-E153 WeakPolarHBondContact CE-OE1 3.11Å; K146-E153 IonicContact NZ-OE1 2.7Å; K146-E153 PolarHBondContact NZ-OE1 2.95Å; K146-E157 WeakPolarHBondContact CE-OE1 3.22Å; K146-E157 WeakPolarHBondContact CE-OE2 3.36Å; K146-E157 IonicContact NZ-OE1 2.92Å; K146-E157 PolarHBondContact NZ-OE1 3.29Å; K146-E157 IonicContact NZ-OE2 2.62Å
147G88.7Confident93.9Very high27 Ų2749 Ų4928%0.27824%0.244SC..SBendtrans71.9-48.4-175.300000113.1V143 Q144 K205 W206V143-G147 PolarHBondContact O-N 2.86Å; Q144-G147 PolarHBondContact O-N 2.86Å; G147-K205 WeakPolarHBondContact O-CA 3.49Å; G147-W206 PolarHBondContact O-N 2.92Å
148T94.1Very high93.9Very high72 Ų7245.4 Ų45.444%0.44223%0.226SC..EExtended strand (participates in β ladder)trans-132.8133.3170.4-59.10000109.4K146 E203 I204 K205K146-T148 PolarHBondContact O-N 3.25Å; T148-E203 HydrophobicContact CG2-CG 3.57Å; T148-E203 VanDerWaalsContact CG2-OE1 3.32Å; T148-E203 WeakPolarHBondContact CG2-OE1 3.35Å; T148-I204 CarbonylContact C-O 3.59Å; T148-I204 WeakPolarHBondContact CA-O 3.4Å; T148-K205 HydrophobicContact CG2-CG 4.18Å
149T95.9Very high93.7Very high8 Ų843.5 Ų43.55%0.04922%0.219CC..EExtended strand (participates in β ladder)trans-155.9-175.6-174.2-172.60000111.3V143 K146 E153 V154 I204V143-T149 HydrophobicContact CB-CG2 4.34Å; V143-T149 HydrophobicContact CG1-CG2 4.21Å; V143-T149 HydrophobicContact CG2-CG2 3.91Å; K146-T149 WeakPolarHBondContact CD-OG1 3.19Å; T149-E153 VanDerWaalsContact CA-OE2 3.29Å; T149-E153 WeakPolarHBondContact CA-OE2 3.47Å; T149-E153 WeakPolarHBondContact CB-OE2 3.34Å; T149-E153 PolarHBondContact OG1-OE2 2.85Å; T149-V154 HydrophobicContact CG2-CG2 3.58Å; T149-I204 HydrophobicContact CG2-CB 4.16Å; T149-I204 HydrophobicContact CG2-CG2 4.46Å; T149-I204 PolarHBondContact N-O 3.36Å; T149-I204 PolarHBondContact O-N 3.02Å
150S96.4Very high93.4Very high38 Ų3846.5 Ų46.527%0.26624%0.24SC..EExtended strand (participates in β ladder)trans-130.5160.5174.972.40000112.4N152 E153 V154 K202S150-N152 VanDerWaalsContact C-N 3.32Å; S150-N152 PolarHBondContact O-N 2.66Å; S150-E153 PolarHBondContact N-OE2 2.94Å; S150-E153 PolarHBondContact O-N 3.19Å; S150-E153 WeakPolarHBondContact OG-CB 3.21Å; S150-E153 PolarHBondContact OG-N 3.25Å; S150-V154 WeakPolarHBondContact O-CG2 3.37Å; S150-V154 PolarHBondContact O-N 3.18Å; S150-K202 WeakPolarHBondContact CB-O 3.39Å
151Y95.9Very high93.1Very high27 Ų2748.9 Ų48.911%0.10625%0.249CC..Hα-helixtrans-54.9-44.9179163.7-95.9000113A155 R181 V184 Y185 L188Y151-A155 HydrophobicContact CE1-CB 4.41Å; Y151-A155 HydrophobicContact CE2-CB 4.22Å; Y151-A155 VanDerWaalsContact O-CB 3.23Å; Y151-A155 WeakPolarHBondContact O-CB 3.33Å; Y151-A155 PolarHBondContact O-N 3.44Å; Y151-R181 WeakPolarHBondContact OH-CB 3.35Å; Y151-R181 PolarHBondContact OH-O 3.07Å; Y151-V184 HydrophobicContact CD2-CG1 3.82Å; Y151-V184 HydrophobicContact CE2-CB 4.07Å; Y151-V184 HydrophobicContact CE2-CG1 3.68Å; Y151-Y185 HydrophobicContact CD1-CE1 4.1Å; Y151-Y185 AromaticContact CD2-CD1 3.78Å; Y151-Y185 HydrophobicContact CD2-CD1 3.78Å; Y151-Y185 AromaticContact CD2-CE1 3.48Å; Y151-Y185 HydrophobicContact CD2-CE1 3.48Å; Y151-Y185 VanDerWaalsContact CD2-CE1 3.48Å; Y151-Y185 AromaticContact CD2-CZ 3.99Å; Y151-Y185 AromaticContact CE1-CE1 3.99Å; Y151-Y185 HydrophobicContact CE1-CE1 3.99Å; Y151-Y185 HydrophobicContact CE1-CE2 4.16Å; Y151-Y185 AromaticContact CE1-CZ 3.53Å; Y151-Y185 WeakPolarHBondContact CE1-OH 3.24Å; Y151-Y185 AromaticContact CE2-CD1 3.57Å; Y151-Y185 HydrophobicContact CE2-CD1 3.57Å; Y151-Y185 AromaticContact CE2-CD2 3.95Å; Y151-Y185 HydrophobicContact CE2-CD2 3.95Å; Y151-Y185 AromaticContact CE2-CE1 3.33Å; Y151-Y185 HydrophobicContact CE2-CE1 3.33Å; Y151-Y185 AromaticContact CE2-CE2 3.75Å; Y151-Y185 HydrophobicContact CE2-CE2 3.75Å; Y151-Y185 AromaticContact CE2-CG 3.88Å; Y151-Y185 HydrophobicContact CE2-CG 3.88Å; Y151-Y185 AromaticContact CE2-CZ 3.44Å; Y151-Y185 VanDerWaalsContact CE2-CZ 3.44Å; Y151-Y185 AromaticContact CG-CE1 3.87Å; Y151-Y185 HydrophobicContact CG-CE1 3.87Å; Y151-Y185 AromaticContact CZ-CE1 3.62Å; Y151-Y185 AromaticContact CZ-CE2 3.44Å; Y151-Y185 VanDerWaalsContact CZ-CE2 3.44Å; Y151-Y185 AromaticContact CZ-CZ 3.19Å; Y151-Y185 WeakPolarHBondContact OH-CE2 3.34Å; Y151-L188 HydrophobicContact CD2-CD1 3.91Å
152N94.8Very high92.5Very high91 Ų9147.8 Ų47.849%0.48724%0.243SC..Hα-helixtrans-67.3-43-178.1-72.1-38.1000111S150 A155 D156 R181S150-N152 VanDerWaalsContact C-N 3.32Å; S150-N152 PolarHBondContact O-N 2.66Å; N152-A155 PolarHBondContact O-N 3.41Å; N152-D156 VanDerWaalsContact O-CB 3.3Å; N152-D156 WeakPolarHBondContact O-CB 3.36Å; N152-D156 PolarHBondContact O-N 3.46Å; N152-R181 PolarHBondContact OD1-NH1 3.3Å
153E94.1Very high91.9Very high70 Ų7050.2 Ų50.233%0.32726%0.259SS..Hα-helixtrans-58.9-48.9177-175.9-174.4-168.400111.9K146 T149 S150 A155 E157K146-E153 HydrophobicContact CD-CG 4.47Å; K146-E153 WeakPolarHBondContact CE-OE1 3.11Å; K146-E153 IonicContact NZ-OE1 2.7Å; K146-E153 PolarHBondContact NZ-OE1 2.95Å; T149-E153 VanDerWaalsContact CA-OE2 3.29Å; T149-E153 WeakPolarHBondContact CA-OE2 3.47Å; T149-E153 WeakPolarHBondContact CB-OE2 3.34Å; T149-E153 PolarHBondContact OG1-OE2 2.85Å; S150-E153 PolarHBondContact N-OE2 2.94Å; S150-E153 PolarHBondContact O-N 3.19Å; S150-E153 WeakPolarHBondContact OG-CB 3.21Å; S150-E153 PolarHBondContact OG-N 3.25Å; E153-A155 PolarHBondContact O-N 3.36Å; E153-E157 WeakPolarHBondContact O-CB 3.39Å; E153-E157 WeakPolarHBondContact O-CG 3.31Å; E153-E157 PolarHBondContact O-N 3.21Å
154V95.1Very high90.9Very high0 Ų056.2 Ų56.20%029%0.291CS..Hα-helixtrans-62.5-43.6175.6175.90000111.2V139 K142 V143 T149 S150 L158 V184V139-V154 HydrophobicContact CG1-CG1 4.36Å; V139-V154 HydrophobicContact CG2-CG1 4.05Å; K142-V154 HydrophobicContact CG-CG1 4.34Å; K142-V154 HydrophobicContact CG-CG2 4.23Å; V143-V154 HydrophobicContact CG2-CG2 4.13Å; T149-V154 HydrophobicContact CG2-CG2 3.58Å; S150-V154 WeakPolarHBondContact O-CG2 3.37Å; S150-V154 PolarHBondContact O-N 3.18Å; V154-L158 HydrophobicContact CG1-CD1 3.94Å; V154-L158 WeakPolarHBondContact O-CB 3.3Å; V154-L158 WeakPolarHBondContact O-CG 3.28Å; V154-L158 PolarHBondContact O-N 3.21Å; V154-V184 HydrophobicContact CG1-CG1 4.15Å
155A94.6Very high89.8Confident0 Ų056.1 Ų56.10%030%0.302CS..Hα-helixtrans-68.3-44.1-178.200000112.8Y151 N152 E153 L158 V159 R181 V184Y151-A155 HydrophobicContact CE1-CB 4.41Å; Y151-A155 HydrophobicContact CE2-CB 4.22Å; Y151-A155 VanDerWaalsContact O-CB 3.23Å; Y151-A155 WeakPolarHBondContact O-CB 3.33Å; Y151-A155 PolarHBondContact O-N 3.44Å; N152-A155 PolarHBondContact O-N 3.41Å; E153-A155 PolarHBondContact O-N 3.36Å; A155-L158 PolarHBondContact O-N 3.27Å; A155-V159 WeakPolarHBondContact O-CB 3.4Å; A155-V159 WeakPolarHBondContact O-CG2 3.25Å; A155-V159 PolarHBondContact O-N 3.08Å; A155-R181 HydrophobicContact CB-CG 4.07Å; A155-V184 HydrophobicContact CB-CG1 4.47Å; A155-V184 HydrophobicContact CB-CG2 4.46Å
156D92.8Very high88.3Confident63 Ų6351.4 Ų51.434%0.33729%0.29SS..Hα-helixtrans-74.8-33.8-176.5-72.6-47.7000112.3N152 V159 S160 R181N152-D156 VanDerWaalsContact O-CB 3.3Å; N152-D156 WeakPolarHBondContact O-CB 3.36Å; N152-D156 PolarHBondContact O-N 3.46Å; D156-V159 PolarHBondContact O-N 2.95Å; D156-S160 WeakPolarHBondContact O-CB 3.39Å; D156-S160 PolarHBondContact O-N 3.03Å; D156-R181 IonicContact OD1-CZ 3.15Å; D156-R181 IonicContact OD1-NE 2.69Å; D156-R181 IonicContact OD1-NH2 3.14Å; D156-R181 PolarHBondContact OD1-NH2 2.89Å; D156-R181 IonicContact OD2-CZ 3.74Å; D156-R181 IonicContact OD2-NH2 3.5Å; D156-R181 PolarHBondContact OD2-NH2 3.49Å
157E92.9Very high86.6Confident61 Ų6156.3 Ų56.329%0.28532%0.319SS..Hα-helixtrans-64.3-42.5169.3-76.5-172.4-154.700112.2K142 K146 E153 S160 E161K142-E157 VanDerWaalsContact CD-OE2 3.25Å; K142-E157 WeakPolarHBondContact CD-OE2 3.46Å; K142-E157 WeakPolarHBondContact CE-OE2 3.27Å; K142-E157 IonicContact NZ-OE2 3.84Å; K142-E157 PolarHBondContact NZ-OE2 2.89Å; K146-E157 WeakPolarHBondContact CE-OE1 3.22Å; K146-E157 WeakPolarHBondContact CE-OE2 3.36Å; K146-E157 IonicContact NZ-OE1 2.92Å; K146-E157 PolarHBondContact NZ-OE1 3.29Å; K146-E157 IonicContact NZ-OE2 2.62Å; E153-E157 WeakPolarHBondContact O-CB 3.39Å; E153-E157 WeakPolarHBondContact O-CG 3.31Å; E153-E157 PolarHBondContact O-N 3.21Å; E157-S160 PolarHBondContact O-N 3.38Å; E157-E161 WeakPolarHBondContact O-CB 3.49Å; E157-E161 WeakPolarHBondContact O-CG 3.38Å; E157-E161 PolarHBondContact O-N 3.46Å
158L91.1Very high85.2Confident7 Ų758.6 Ų58.64%0.03732%0.323CS..Hα-helixtrans-69-33.3178-68.5175.9000112.7K138 V139 V154 A155 F162 I180 V184K138-L158 HydrophobicContact CB-CD2 3.69Å; V139-L158 HydrophobicContact CG2-CD1 3.58Å; V154-L158 HydrophobicContact CG1-CD1 3.94Å; V154-L158 WeakPolarHBondContact O-CB 3.3Å; V154-L158 WeakPolarHBondContact O-CG 3.28Å; V154-L158 PolarHBondContact O-N 3.21Å; A155-L158 PolarHBondContact O-N 3.27Å; L158-F162 VanDerWaalsContact O-CB 3.24Å; L158-F162 WeakPolarHBondContact O-CB 3.41Å; L158-F162 PolarHBondContact O-N 3.32Å; L158-I180 HydrophobicContact CB-CG2 4.03Å; L158-V184 HydrophobicContact CD1-CG2 3.9Å
159V90.6Very high83.6Confident13 Ų1361.8 Ų61.88%0.07934%0.336CS..Hα-helixtrans-66.9-43172.1169.80000110.9A155 D156 F162 T163 Q177 I180A155-V159 WeakPolarHBondContact O-CB 3.4Å; A155-V159 WeakPolarHBondContact O-CG2 3.25Å; A155-V159 PolarHBondContact O-N 3.08Å; D156-V159 PolarHBondContact O-N 2.95Å; V159-F162 PolarHBondContact O-N 3.37Å; V159-T163 VanDerWaalsContact O-CB 3.29Å; V159-T163 WeakPolarHBondContact O-CB 3.48Å; V159-T163 PolarHBondContact O-N 3.28Å; V159-T163 PolarHBondContact O-OG1 3.39Å; V159-Q177 HydrophobicContact CG1-CB 3.97Å; V159-Q177 HydrophobicContact CG1-CG 3.86Å; V159-Q177 HydrophobicContact CG2-CB 4.31Å; V159-Q177 HydrophobicContact CG2-CG 3.97Å; V159-I180 HydrophobicContact CG2-CB 3.9Å; V159-I180 HydrophobicContact CG2-CD1 4.02Å; V159-I180 HydrophobicContact CG2-CG2 3.76Å
160S88.1Confident81.8Confident63 Ų6365.7 Ų65.744%0.44137%0.369SS..Hα-helixtrans-62.1-54175.5-1740000111.3D156 E157 F162 T163 N164D156-S160 WeakPolarHBondContact O-CB 3.39Å; D156-S160 PolarHBondContact O-N 3.03Å; E157-S160 PolarHBondContact O-N 3.38Å; S160-F162 VanDerWaalsContact C-N 3.26Å; S160-F162 PolarHBondContact O-N 2.76Å; S160-T163 PolarHBondContact O-N 2.66Å; S160-T163 VanDerWaalsContact O-N 3.11Å; S160-N164 WeakPolarHBondContact O-CB 3.49Å; S160-N164 PolarHBondContact O-N 3.17Å; S160-N164 PolarHBondContact O-OD1 2.95Å
161E87.4Confident80Confident75 Ų7567.9 Ų67.935%0.3539%0.39SS..Hα-helixtrans-54.1-42.4177.5-76.3176.1-175.200112.1K142 E157 S165K142-E161 IonicContact NZ-OE1 2.67Å; K142-E161 PolarHBondContact NZ-OE1 2.76Å; K142-E161 IonicContact NZ-OE2 2.8Å; E157-E161 WeakPolarHBondContact O-CB 3.49Å; E157-E161 WeakPolarHBondContact O-CG 3.38Å; E157-E161 PolarHBondContact O-N 3.46Å; E161-S165 VanDerWaalsContact O-CB 3.22Å; E161-S165 WeakPolarHBondContact O-CB 3.49Å; E161-S165 PolarHBondContact O-N 3.27Å; E161-S165 PolarHBondContact O-OG 3.01Å
162F82.5Confident78.5Confident33 Ų3369.9 Ų69.915%0.14540%0.402CS..Hα-helixtrans-74.1-33.2-179.1-156.3-92.1000113.4K130 F135 L158 V159 S160 I180K130-F162 HydrophobicContact CD-CE1 4.11Å; K130-F162 HydrophobicContact CD-CZ 3.94Å; K130-F162 HydrophobicContact CG-CE1 4.2Å; K130-F162 HydrophobicContact CG-CE2 4.31Å; K130-F162 HydrophobicContact CG-CZ 3.54Å; F135-F162 HydrophobicContact CE1-CD2 4.46Å; L158-F162 VanDerWaalsContact O-CB 3.24Å; L158-F162 WeakPolarHBondContact O-CB 3.41Å; L158-F162 PolarHBondContact O-N 3.32Å; V159-F162 PolarHBondContact O-N 3.37Å; S160-F162 VanDerWaalsContact C-N 3.26Å; S160-F162 PolarHBondContact O-N 2.76Å; F162-I180 HydrophobicContact CB-CD1 3.82Å; F162-I180 HydrophobicContact CD1-CD1 4.22Å; F162-I180 HydrophobicContact CG-CD1 4.09Å
163T82.1Confident77.2Confident59 Ų5967.4 Ų67.436%0.36239%0.392SS..Hα-helixtrans-75.7-33.2176.9-53.50000111.9V159 S160V159-T163 VanDerWaalsContact O-CB 3.29Å; V159-T163 WeakPolarHBondContact O-CB 3.48Å; V159-T163 PolarHBondContact O-N 3.28Å; V159-T163 PolarHBondContact O-OG1 3.39Å; S160-T163 PolarHBondContact O-N 2.66Å; S160-T163 VanDerWaalsContact O-N 3.11Å
164N73.6Confident76.2Confident125 Ų12566.6 Ų66.667%0.66840%0.397SS*.Hα-helixtrans-82.2-28178.5-77.471.8000113.4S160 N166S160-N164 WeakPolarHBondContact O-CB 3.49Å; S160-N164 PolarHBondContact O-N 3.17Å; S160-N164 PolarHBondContact O-OD1 2.95Å; N164-N166 VanDerWaalsContact C-N 3.29Å; N164-N166 PolarHBondContact O-N 3.02Å
165S69Low75.4Confident106 Ų10673.9 Ų73.974%0.74143%0.426SS*.SBendtrans-78.1-11.6-179.8-60.40000114.1E161E161-S165 VanDerWaalsContact O-CB 3.22Å; E161-S165 WeakPolarHBondContact O-CB 3.49Å; E161-S165 PolarHBondContact O-N 3.27Å; E161-S165 PolarHBondContact O-OG 3.01Å
166N61.5Low74.8Confident70 Ų7074.9 Ų74.937%0.37443%0.431SS..SBendtrans-136117.8-174.3-156.52.4000107.7N164 H168N164-N166 VanDerWaalsContact C-N 3.29Å; N164-N166 PolarHBondContact O-N 3.02Å; N166-H168 PolarHBondContact O-N 3.48Å
167N57.9Low74.6Confident175 Ų17575.4 Ų75.494%0.93643%0.432SS*.  trans-7067.9-178.8-77.9-38.9000111.1
168H58.8Low74.4Confident75 Ų7580.1 Ų80.135%0.34745%0.451SS..  trans-90.6144.3-164.4-141.3-64.8000111.9N166 A170 D172N166-H168 PolarHBondContact O-N 3.48Å; H168-A170 PolarHBondContact O-N 3.36Å; H168-D172 WeakPolarHBondContact CE1-CB 3.38Å; H168-D172 IonicContact CE1-OD2 3.16Å; H168-D172 PolarHBondContact CE1-OD2 3.11Å; H168-D172 WeakPolarHBondContact ND1-CB 3.37Å; H168-D172 IonicContact ND1-OD2 3.3Å; H168-D172 PolarHBondContact ND1-OD2 2.89Å
169L59.8Low74.4Confident138 Ų13882.2 Ų82.272%0.72346%0.463SS*.  trans-60.9135.9173.5-61.3175.6000110.5A171 D172L169-A171 PolarHBondContact O-N 3.28Å; L169-D172 PolarHBondContact O-N 3.36Å; L169-D172 VanDerWaalsContact O-N 3.13Å
170A58.6Low74.4Confident90 Ų9081.7 Ų81.774%0.74446%0.459SS*.THydrogen-bonded Turntrans-63-8.8-168.800000115.8H168 S173H168-A170 PolarHBondContact O-N 3.36Å; A170-S173 PolarHBondContact O-OG 3.28Å; A170-S173 VanDerWaalsContact O-OG 3.09Å
171A58.4Low74.7Confident85 Ų8581.7 Ų81.770%0.70245%0.45SS*.THydrogen-bonded Turntrans-79.8-32.2176.200000113.1L169L169-A171 PolarHBondContact O-N 3.28Å
172D64.4Low75Confident68 Ų6884.2 Ų84.236%0.36446%0.456SS..THydrogen-bonded Turntrans-85.7-21.2-174.1-62.2-60.3000113.1H168 L169 A174 Y175 D176H168-D172 WeakPolarHBondContact CE1-CB 3.38Å; H168-D172 IonicContact CE1-OD2 3.16Å; H168-D172 PolarHBondContact CE1-OD2 3.11Å; H168-D172 WeakPolarHBondContact ND1-CB 3.37Å; H168-D172 IonicContact ND1-OD2 3.3Å; H168-D172 PolarHBondContact ND1-OD2 2.89Å; L169-D172 PolarHBondContact O-N 3.36Å; L169-D172 VanDerWaalsContact O-N 3.13Å; D172-A174 VanDerWaalsContact C-N 3.26Å; D172-A174 PolarHBondContact O-N 2.98Å; D172-Y175 WeakPolarHBondContact O-CB 3.27Å; D172-Y175 PolarHBondContact O-N 2.81Å; D172-D176 PolarHBondContact O-N 3.07Å
173S68Low75.6Confident40 Ų4086.3 Ų86.328%0.2846%0.463SS..Hα-helixtrans-57.9-37.5178.859.40000112.4A170 Y175 Q177A170-S173 PolarHBondContact O-OG 3.28Å; A170-S173 VanDerWaalsContact O-OG 3.09Å; S173-Y175 VanDerWaalsContact C-N 3.33Å; S173-Y175 PolarHBondContact O-N 3.39Å; S173-Q177 VanDerWaalsContact O-CB 3.24Å; S173-Q177 WeakPolarHBondContact O-CB 3.3Å; S173-Q177 PolarHBondContact O-N 3.27Å
174A73.4Confident76.3Confident52 Ų5283.5 Ų83.543%0.4345%0.446SS..Hα-helixtrans-69.6-28.1176.400000113.3D172 K178D172-A174 VanDerWaalsContact C-N 3.26Å; D172-A174 PolarHBondContact O-N 2.98Å; A174-K178 WeakPolarHBondContact O-CG 3.35Å
175Y78.1Confident77.4Confident154 Ų15482.3 Ų82.360%0.60443%0.433SS*.Hα-helixtrans-78.4-48.6174.4178.3-95.5000110.8D172 S173 Q177 K178 N179D172-Y175 WeakPolarHBondContact O-CB 3.27Å; D172-Y175 PolarHBondContact O-N 2.81Å; S173-Y175 VanDerWaalsContact C-N 3.33Å; S173-Y175 PolarHBondContact O-N 3.39Å; Y175-Q177 VanDerWaalsContact C-N 3.29Å; Y175-Q177 PolarHBondContact O-N 2.92Å; Y175-K178 PolarHBondContact O-N 3.49Å; Y175-N179 PolarHBondContact O-N 3.42Å
176D81.5Confident78.6Confident20 Ų2078.7 Ų78.711%0.10741%0.405CS..Hα-helixtrans-60.7-38.4176.6-85.21.2000110.9K130 D172 K178 N179 I180K130-D176 IonicContact NZ-OD1 3.44Å; K130-D176 PolarHBondContact NZ-OD1 2.86Å; K130-D176 IonicContact NZ-OD2 2.66Å; K130-D176 PolarHBondContact NZ-OD2 3Å; D172-D176 PolarHBondContact O-N 3.07Å; D176-K178 PolarHBondContact O-N 3.17Å; D176-N179 PolarHBondContact O-N 3.03Å; D176-I180 WeakPolarHBondContact O-CB 3.36Å; D176-I180 WeakPolarHBondContact O-CG1 3.33Å; D176-I180 PolarHBondContact O-N 2.56Å
177Q88.3Confident80.3Confident75 Ų7575.4 Ų75.435%0.3539%0.387SS..Hα-helixtrans-58-45.6173.8-179.2176.343.400113V159 S173 Y175 N179 R181V159-Q177 HydrophobicContact CG1-CB 3.97Å; V159-Q177 HydrophobicContact CG1-CG 3.86Å; V159-Q177 HydrophobicContact CG2-CB 4.31Å; V159-Q177 HydrophobicContact CG2-CG 3.97Å; S173-Q177 VanDerWaalsContact O-CB 3.24Å; S173-Q177 WeakPolarHBondContact O-CB 3.3Å; S173-Q177 PolarHBondContact O-N 3.27Å; Y175-Q177 VanDerWaalsContact C-N 3.29Å; Y175-Q177 PolarHBondContact O-N 2.92Å; Q177-N179 VanDerWaalsContact C-N 3.34Å; Q177-R181 WeakPolarHBondContact O-CB 3.26Å; Q177-R181 WeakPolarHBondContact O-CG 3.48Å; Q177-R181 PolarHBondContact O-N 3.16Å
178K90.1Very high82.1Confident160 Ų16067.4 Ų67.470%0.69634%0.344SS*.Hα-helixtrans-66.2-38.5176.5-71.9176.5-178.2177.70111.4A174 Y175 D176 R182A174-K178 WeakPolarHBondContact O-CG 3.35Å; Y175-K178 PolarHBondContact O-N 3.49Å; D176-K178 PolarHBondContact O-N 3.17Å; K178-R182 PolarHBondContact O-N 3.48Å; K178-R182 VanDerWaalsContact O-N 3.12Å
179N90.1Very high83.8Confident51 Ų5168.1 Ų68.127%0.27335%0.351SS..Hα-helixtrans-64.9-51.9178.2-161-75000111.5Y175 D176 Q177 R181 R182 R183Y175-N179 PolarHBondContact O-N 3.42Å; D176-N179 PolarHBondContact O-N 3.03Å; Q177-N179 VanDerWaalsContact C-N 3.34Å; N179-R181 PolarHBondContact O-N 3.22Å; N179-R182 PolarHBondContact O-N 3Å; N179-R182 VanDerWaalsContact O-N 3.12Å; N179-R183 VanDerWaalsContact O-CG 3.3Å; N179-R183 WeakPolarHBondContact O-CG 3.43Å; N179-R183 PolarHBondContact O-N 3.33Å
180I91.3Very high85.5Confident2 Ų266 Ų661%0.0134%0.344CS..Hα-helixtrans-56.8-50.6178.2-66.1164.7000110F135 L158 V159 F162 D176 R182 R183 V184F135-I180 HydrophobicContact CD1-CG1 4.47Å; F135-I180 HydrophobicContact CE1-CD1 4.29Å; F135-I180 HydrophobicContact CE1-CG1 3.68Å; F135-I180 HydrophobicContact CE1-CG2 4.47Å; F135-I180 HydrophobicContact CE2-CG1 4.47Å; F135-I180 HydrophobicContact CZ-CD1 4.45Å; F135-I180 HydrophobicContact CZ-CG1 3.67Å; L158-I180 HydrophobicContact CB-CG2 4.03Å; V159-I180 HydrophobicContact CG2-CB 3.9Å; V159-I180 HydrophobicContact CG2-CD1 4.02Å; V159-I180 HydrophobicContact CG2-CG2 3.76Å; F162-I180 HydrophobicContact CB-CD1 3.82Å; F162-I180 HydrophobicContact CD1-CD1 4.22Å; F162-I180 HydrophobicContact CG-CD1 4.09Å; D176-I180 WeakPolarHBondContact O-CB 3.36Å; D176-I180 WeakPolarHBondContact O-CG1 3.33Å; D176-I180 PolarHBondContact O-N 2.56Å; I180-R182 VanDerWaalsContact C-N 3.3Å; I180-R182 PolarHBondContact O-N 3.38Å; I180-R183 PolarHBondContact O-N 3.24Å; I180-V184 HydrophobicContact CG2-CG2 4.17Å; I180-V184 WeakPolarHBondContact O-CG2 3.26Å; I180-V184 PolarHBondContact O-N 2.93Å
181R94.2Very high87.1Confident63 Ų6362.7 Ų62.724%0.23831%0.313CS..Hα-helixtrans-54.1-42.8176.5-80.8178173.4-90.94.6112.5Y151 N152 A155 D156 Q177 N179 Y185Y151-R181 WeakPolarHBondContact OH-CB 3.35Å; Y151-R181 PolarHBondContact OH-O 3.07Å; N152-R181 PolarHBondContact OD1-NH1 3.3Å; A155-R181 HydrophobicContact CB-CG 4.07Å; D156-R181 IonicContact OD1-CZ 3.15Å; D156-R181 IonicContact OD1-NE 2.69Å; D156-R181 IonicContact OD1-NH2 3.14Å; D156-R181 PolarHBondContact OD1-NH2 2.89Å; D156-R181 IonicContact OD2-CZ 3.74Å; D156-R181 IonicContact OD2-NH2 3.5Å; D156-R181 PolarHBondContact OD2-NH2 3.49Å; Q177-R181 WeakPolarHBondContact O-CB 3.26Å; Q177-R181 WeakPolarHBondContact O-CG 3.48Å; Q177-R181 PolarHBondContact O-N 3.16Å; N179-R181 PolarHBondContact O-N 3.22Å; R181-Y185 VanDerWaalsContact O-CD2 3.24Å; R181-Y185 WeakPolarHBondContact O-CD2 3.36Å
182R94.4Very high88.7Confident127 Ų12761.8 Ų61.848%0.47930%0.295SS..Hα-helixtrans-65.2-42175.3-179.265-165.782.36.6112.3K178 N179 I180 Y185 D186K178-R182 PolarHBondContact O-N 3.48Å; K178-R182 VanDerWaalsContact O-N 3.12Å; N179-R182 PolarHBondContact O-N 3Å; N179-R182 VanDerWaalsContact O-N 3.12Å; I180-R182 VanDerWaalsContact C-N 3.3Å; I180-R182 PolarHBondContact O-N 3.38Å; R182-Y185 PolarHBondContact O-N 3.35Å; R182-D186 IonicContact CZ-OD1 3.23Å; R182-D186 IonicContact CZ-OD2 3.61Å; R182-D186 IonicContact NH1-OD1 3.87Å; R182-D186 PolarHBondContact NH1-OD1 2.87Å; R182-D186 IonicContact NH1-OD2 2.78Å; R182-D186 PolarHBondContact NH1-OD2 3.05Å; R182-D186 IonicContact NH2-OD1 2.93Å; R182-D186 PolarHBondContact NH2-OD1 3.38Å; R182-D186 IonicContact NH2-OD2 3.56Å; R182-D186 PolarHBondContact O-N 2.88Å
183R95.2Very high90Very high77 Ų7762.7 Ų62.729%0.29131%0.312SS..Hα-helixtrans-69.9-33.4-179.6-64.1-76.683.9124.7-4.2113.1L132 F135 N179 I180 Y185 D186 A187L132-R183 HydrophobicContact CD1-CB 4.26Å; F135-R183 HydrophobicContact CB-CB 4.07Å; F135-R183 HydrophobicContact CD2-CB 3.85Å; F135-R183 HydrophobicContact CD2-CG 3.85Å; F135-R183 HydrophobicContact CE2-CG 4.35Å; F135-R183 HydrophobicContact CG-CB 4.15Å; N179-R183 VanDerWaalsContact O-CG 3.3Å; N179-R183 WeakPolarHBondContact O-CG 3.43Å; N179-R183 PolarHBondContact O-N 3.33Å; I180-R183 PolarHBondContact O-N 3.24Å; R183-Y185 VanDerWaalsContact C-N 3.31Å; R183-Y185 PolarHBondContact O-N 2.89Å; R183-D186 IonicContact CZ-OD2 2.72Å; R183-D186 VanDerWaalsContact CZ-OD2 3.23Å; R183-D186 IonicContact NE-OD2 3.91Å; R183-D186 PolarHBondContact NE-OD2 3.15Å; R183-D186 IonicContact NH2-OD2 3.67Å; R183-D186 PolarHBondContact NH2-OD2 3.4Å; R183-D186 PolarHBondContact O-N 3.44Å; R183-A187 PolarHBondContact O-N 3.43Å
184V96Very high91Very high0 Ų066 Ų660%032%0.324CS..Hα-helixtrans-61.1-39.9174.2172.30000110.9V139 Y151 V154 A155 L158 I180 A187 L188V139-V184 HydrophobicContact CG2-CB 4.28Å; V139-V184 HydrophobicContact CG2-CG1 4.13Å; V139-V184 HydrophobicContact CG2-CG2 3.84Å; Y151-V184 HydrophobicContact CD2-CG1 3.82Å; Y151-V184 HydrophobicContact CE2-CB 4.07Å; Y151-V184 HydrophobicContact CE2-CG1 3.68Å; V154-V184 HydrophobicContact CG1-CG1 4.15Å; A155-V184 HydrophobicContact CB-CG1 4.47Å; A155-V184 HydrophobicContact CB-CG2 4.46Å; L158-V184 HydrophobicContact CD1-CG2 3.9Å; I180-V184 HydrophobicContact CG2-CG2 4.17Å; I180-V184 WeakPolarHBondContact O-CG2 3.26Å; I180-V184 PolarHBondContact O-N 2.93Å; V184-A187 PolarHBondContact O-N 2.96Å; V184-L188 HydrophobicContact CG1-CD1 3.7Å; V184-L188 HydrophobicContact CG1-CG 4.2Å; V184-L188 WeakPolarHBondContact O-CB 3.34Å; V184-L188 VanDerWaalsContact O-CG 3.24Å; V184-L188 WeakPolarHBondContact O-CG 3.36Å; V184-L188 PolarHBondContact O-N 3.49Å
185Y95.6Very high91.8Very high101 Ų10168.5 Ų68.540%0.39633%0.331SS..Hα-helixtrans-63.7-42.4172.9-70.2-59.8000113.3Y151 R181 R182 R183 A187 N189Y151-Y185 HydrophobicContact CD1-CE1 4.1Å; Y151-Y185 AromaticContact CD2-CD1 3.78Å; Y151-Y185 HydrophobicContact CD2-CD1 3.78Å; Y151-Y185 AromaticContact CD2-CE1 3.48Å; Y151-Y185 HydrophobicContact CD2-CE1 3.48Å; Y151-Y185 VanDerWaalsContact CD2-CE1 3.48Å; Y151-Y185 AromaticContact CD2-CZ 3.99Å; Y151-Y185 AromaticContact CE1-CE1 3.99Å; Y151-Y185 HydrophobicContact CE1-CE1 3.99Å; Y151-Y185 HydrophobicContact CE1-CE2 4.16Å; Y151-Y185 AromaticContact CE1-CZ 3.53Å; Y151-Y185 WeakPolarHBondContact CE1-OH 3.24Å; Y151-Y185 AromaticContact CE2-CD1 3.57Å; Y151-Y185 HydrophobicContact CE2-CD1 3.57Å; Y151-Y185 AromaticContact CE2-CD2 3.95Å; Y151-Y185 HydrophobicContact CE2-CD2 3.95Å; Y151-Y185 AromaticContact CE2-CE1 3.33Å; Y151-Y185 HydrophobicContact CE2-CE1 3.33Å; Y151-Y185 AromaticContact CE2-CE2 3.75Å; Y151-Y185 HydrophobicContact CE2-CE2 3.75Å; Y151-Y185 AromaticContact CE2-CG 3.88Å; Y151-Y185 HydrophobicContact CE2-CG 3.88Å; Y151-Y185 AromaticContact CE2-CZ 3.44Å; Y151-Y185 VanDerWaalsContact CE2-CZ 3.44Å; Y151-Y185 AromaticContact CG-CE1 3.87Å; Y151-Y185 HydrophobicContact CG-CE1 3.87Å; Y151-Y185 AromaticContact CZ-CE1 3.62Å; Y151-Y185 AromaticContact CZ-CE2 3.44Å; Y151-Y185 VanDerWaalsContact CZ-CE2 3.44Å; Y151-Y185 AromaticContact CZ-CZ 3.19Å; Y151-Y185 WeakPolarHBondContact OH-CE2 3.34Å; R181-Y185 VanDerWaalsContact O-CD2 3.24Å; R181-Y185 WeakPolarHBondContact O-CD2 3.36Å; R182-Y185 PolarHBondContact O-N 3.35Å; R183-Y185 VanDerWaalsContact C-N 3.31Å; R183-Y185 PolarHBondContact O-N 2.89Å; Y185-A187 VanDerWaalsContact C-N 3.34Å; Y185-A187 PolarHBondContact O-N 3.47Å; Y185-N189 WeakPolarHBondContact O-CB 3.29Å; Y185-N189 PolarHBondContact O-N 3.26Å; Y185-N189 PolarHBondContact O-ND2 3.44Å; Y185-N189 PolarHBondContact O-OD1 3.38Å
186D95.9Very high92.4Very high29 Ų2962 Ų6216%0.15531%0.306CS..Hα-helixtrans-59.2-47.3176.4-66-43.4000110.9L132 R182 R183 V190L132-D186 HydrophobicContact CD1-CB 3.73Å; L132-D186 HydrophobicContact CD2-CB 4.35Å; R182-D186 IonicContact CZ-OD1 3.23Å; R182-D186 IonicContact CZ-OD2 3.61Å; R182-D186 IonicContact NH1-OD1 3.87Å; R182-D186 PolarHBondContact NH1-OD1 2.87Å; R182-D186 IonicContact NH1-OD2 2.78Å; R182-D186 PolarHBondContact NH1-OD2 3.05Å; R182-D186 IonicContact NH2-OD1 2.93Å; R182-D186 PolarHBondContact NH2-OD1 3.38Å; R182-D186 IonicContact NH2-OD2 3.56Å; R182-D186 PolarHBondContact O-N 2.88Å; R183-D186 IonicContact CZ-OD2 2.72Å; R183-D186 VanDerWaalsContact CZ-OD2 3.23Å; R183-D186 IonicContact NE-OD2 3.91Å; R183-D186 PolarHBondContact NE-OD2 3.15Å; R183-D186 IonicContact NH2-OD2 3.67Å; R183-D186 PolarHBondContact NH2-OD2 3.4Å; R183-D186 PolarHBondContact O-N 3.44Å; D186-V190 WeakPolarHBondContact O-CG2 3.37Å; D186-V190 PolarHBondContact O-N 2.9Å
187A96.1Very high92.9Very high1 Ų161.1 Ų61.11%0.00830%0.301CS..Hα-helixtrans-62-51178.800000112.5V139 R183 V184 Y185 N189 V190 L191V139-A187 HydrophobicContact CB-CB 4.04Å; V139-A187 HydrophobicContact CG1-CB 4.06Å; V139-A187 HydrophobicContact CG2-CB 4.1Å; R183-A187 PolarHBondContact O-N 3.43Å; V184-A187 PolarHBondContact O-N 2.96Å; Y185-A187 VanDerWaalsContact C-N 3.34Å; Y185-A187 PolarHBondContact O-N 3.47Å; A187-N189 VanDerWaalsContact C-N 3.32Å; A187-N189 PolarHBondContact O-N 2.89Å; A187-V190 PolarHBondContact O-N 3.45Å; A187-L191 WeakPolarHBondContact O-CB 3.45Å; A187-L191 VanDerWaalsContact O-CG 3.26Å; A187-L191 WeakPolarHBondContact O-CG 3.19Å; A187-L191 PolarHBondContact O-N 2.87Å
188L95.3Very high93.2Very high7 Ų760.1 Ų60.14%0.03730%0.303CS..Hα-helixtrans-62.9-37.6-178.2-70.6172000112.3V139 V143 Y151 V184 M192 I197 I204V139-L188 HydrophobicContact CG1-CD2 3.57Å; V139-L188 HydrophobicContact CG1-CG 3.94Å; V143-L188 HydrophobicContact CG2-CD2 4.19Å; Y151-L188 HydrophobicContact CD2-CD1 3.91Å; V184-L188 HydrophobicContact CG1-CD1 3.7Å; V184-L188 HydrophobicContact CG1-CG 4.2Å; V184-L188 WeakPolarHBondContact O-CB 3.34Å; V184-L188 VanDerWaalsContact O-CG 3.24Å; V184-L188 WeakPolarHBondContact O-CG 3.36Å; V184-L188 PolarHBondContact O-N 3.49Å; L188-M192 VanDerWaalsContact O-CB 3.23Å; L188-M192 WeakPolarHBondContact O-CB 3.38Å; L188-M192 PolarHBondContact O-N 3.03Å; L188-I197 HydrophobicContact CB-CD1 4.3Å; L188-I197 HydrophobicContact CD2-CD1 3.42Å; L188-I197 VanDerWaalsContact CD2-CD1 3.42Å; L188-I197 HydrophobicContact CG-CD1 4.46Å; L188-I204 HydrophobicContact CD1-CD1 3.79Å; L188-I204 HydrophobicContact CD2-CD1 4.08Å; L188-I204 HydrophobicContact CD2-CG2 4.38Å
189N95.6Very high93.3Very high91 Ų9157.3 Ų57.349%0.48729%0.29SS..Hα-helixtrans-65.8-41.7178.7-70.8-5.7000111.8Y185 A187 M192 A193Y185-N189 WeakPolarHBondContact O-CB 3.29Å; Y185-N189 PolarHBondContact O-N 3.26Å; Y185-N189 PolarHBondContact O-ND2 3.44Å; Y185-N189 PolarHBondContact O-OD1 3.38Å; A187-N189 VanDerWaalsContact C-N 3.32Å; A187-N189 PolarHBondContact O-N 2.89Å; N189-M192 PolarHBondContact O-N 3.42Å; N189-A193 WeakPolarHBondContact O-CB 3.41Å; N189-A193 PolarHBondContact O-N 3.02Å
190V94.3Very high93.4Very high94 Ų9460 Ų6057%0.5730%0.302SS*.Hα-helixtrans-70.1-43.8176.5176.70000111.3D186 A187 M192 A193 M194D186-V190 WeakPolarHBondContact O-CG2 3.37Å; D186-V190 PolarHBondContact O-N 2.9Å; A187-V190 PolarHBondContact O-N 3.45Å; V190-M192 PolarHBondContact O-N 2.99Å; V190-A193 PolarHBondContact O-N 3.31Å; V190-M194 HydrophobicContact CG1-CG 4.33Å; V190-M194 WeakPolarHBondContact O-CB 3.35Å; V190-M194 WeakPolarHBondContact O-CG 3.4Å; V190-M194 PolarHBondContact O-N 3.18Å
191L93.8Very high93.3Very high20 Ų2068.9 Ų68.911%0.10534%0.34CS..Hα-helixtrans-60.6-34.2176.5-69.7173.1000112.1V139 C140 A187 N195 I196 I197V139-L191 HydrophobicContact CG1-CD1 3.91Å; C140-L191 HydrophobicContact CB-CD1 4.2Å; C140-L191 HydrophobicContact CB-CD2 4.45Å; A187-L191 WeakPolarHBondContact O-CB 3.45Å; A187-L191 VanDerWaalsContact O-CG 3.26Å; A187-L191 WeakPolarHBondContact O-CG 3.19Å; A187-L191 PolarHBondContact O-N 2.87Å; L191-N195 PolarHBondContact O-N 3.17Å; L191-I196 HydrophobicContact CB-CB 4.39Å; L191-I196 HydrophobicContact CD2-CB 4.19Å; L191-I196 HydrophobicContact CD2-CD1 3.57Å; L191-I196 HydrophobicContact CD2-CG1 4.46Å; L191-I196 HydrophobicContact CD2-CG2 4.11Å; L191-I196 WeakPolarHBondContact O-CB 3.46Å; L191-I196 PolarHBondContact O-N 3.35Å; L191-I197 HydrophobicContact CB-CD1 3.68Å; L191-I197 HydrophobicContact CB-CG1 3.83Å; L191-I197 HydrophobicContact CB-CG2 4.4Å; L191-I197 HydrophobicContact CD1-CD1 4.38Å; L191-I197 PolarHBondContact O-N 3.42Å
192M92.1Very high93.2Very high66 Ų6674.7 Ų74.733%0.32537%0.367SS..Hα-helixtrans-72.2-43175.2-169.8-169.8-35.100112.1L188 N189 V190 M194 N195 I197 K199L188-M192 VanDerWaalsContact O-CB 3.23Å; L188-M192 WeakPolarHBondContact O-CB 3.38Å; L188-M192 PolarHBondContact O-N 3.03Å; N189-M192 PolarHBondContact O-N 3.42Å; V190-M192 PolarHBondContact O-N 2.99Å; M192-M194 VanDerWaalsContact C-N 3.27Å; M192-M194 PolarHBondContact O-N 3.35Å; M192-N195 PolarHBondContact O-N 3.13Å; M192-I197 WeakPolarHBondContact CA-O 3.26Å; M192-I197 HydrophobicContact CB-CG1 4.2Å; M192-K199 HydrophobicContact CE-CB 3.6Å; M192-K199 HydrophobicContact CE-CD 3.57Å; M192-K199 HydrophobicContact CE-CG 4.24Å; M192-K199 HydrophobicContact SD-CB 3.99Å
193A91.6Very high93.2Very high86 Ų8672.4 Ų72.471%0.71136%0.362SS*.Hα-helixtrans-62.9-34175.400000112.5N189 V190 N195N189-A193 WeakPolarHBondContact O-CB 3.41Å; N189-A193 PolarHBondContact O-N 3.02Å; V190-A193 PolarHBondContact O-N 3.31Å; A193-N195 PolarHBondContact O-N 2.85Å
194M88.9Confident93.2Very high109 Ų10968.9 Ų68.954%0.53735%0.348SS..THydrogen-bonded Turntrans-79.76.3173.1-65-60.6-62.500113.7V190 M192 I196 P210V190-M194 HydrophobicContact CG1-CG 4.33Å; V190-M194 WeakPolarHBondContact O-CB 3.35Å; V190-M194 WeakPolarHBondContact O-CG 3.4Å; V190-M194 PolarHBondContact O-N 3.18Å; M192-M194 VanDerWaalsContact C-N 3.27Å; M192-M194 PolarHBondContact O-N 3.35Å; M194-I196 HydrophobicContact CB-CD1 3.7Å; M194-I196 HydrophobicContact CB-CG1 3.96Å; M194-I196 HydrophobicContact CG-CD1 4.49Å; M194-I196 PolarHBondContact O-N 3.43Å; M194-I196 VanDerWaalsContact O-N 3.11Å; M194-P210 WeakPolarHBondContact O-CG 3.07Å
195N90.1Very high93Very high106 Ų10672.3 Ų72.357%0.56736%0.363SS*.THydrogen-bonded Turntrans53.228.4-176.1-161.751.2000114.3L191 M192 A193 I207L191-N195 PolarHBondContact O-N 3.17Å; M192-N195 PolarHBondContact O-N 3.13Å; A193-N195 PolarHBondContact O-N 2.85Å; N195-I207 WeakPolarHBondContact O-CD1 3.4Å; N195-I207 VanDerWaalsContact OD1-CD1 3.31Å; N195-I207 WeakPolarHBondContact OD1-CD1 3.32Å
196I90.3Very high92.9Very high17 Ų1770.2 Ų70.29%0.08736%0.355CS..SBendtrans-79.5-31.9176.1-62.8161.5000110.9L191 M194 W206 I207 G208 L209 P210L191-I196 HydrophobicContact CB-CB 4.39Å; L191-I196 HydrophobicContact CD2-CB 4.19Å; L191-I196 HydrophobicContact CD2-CD1 3.57Å; L191-I196 HydrophobicContact CD2-CG1 4.46Å; L191-I196 HydrophobicContact CD2-CG2 4.11Å; L191-I196 WeakPolarHBondContact O-CB 3.46Å; L191-I196 PolarHBondContact O-N 3.35Å; M194-I196 HydrophobicContact CB-CD1 3.7Å; M194-I196 HydrophobicContact CB-CG1 3.96Å; M194-I196 HydrophobicContact CG-CD1 4.49Å; M194-I196 PolarHBondContact O-N 3.43Å; M194-I196 VanDerWaalsContact O-N 3.11Å; I196-W206 HydrophobicContact CG2-CE3 4.2Å; I196-W206 HydrophobicContact CG2-CH2 3.65Å; I196-W206 HydrophobicContact CG2-CZ2 4.48Å; I196-W206 HydrophobicContact CG2-CZ3 3.48Å; I196-W206 VanDerWaalsContact CG2-CZ3 3.48Å; I196-I207 WeakPolarHBondContact O-CB 3.39Å; I196-I207 PolarHBondContact O-N 3.15Å; I196-G208 VanDerWaalsContact CA-O 3.28Å; I196-G208 WeakPolarHBondContact CA-O 3.46Å; I196-G208 PolarHBondContact O-N 2.99Å; I196-L209 HydrophobicContact CD1-CD2 4.14Å; I196-L209 HydrophobicContact CG1-CD2 4.27Å; I196-L209 HydrophobicContact CG2-CD2 4.02Å; I196-P210 VanDerWaalsContact CG1-CD 3.44Å; I196-P210 HydrophobicContact CG1-CG 4.25Å
197I92.7Very high92.5Very high2 Ų272.8 Ų72.81%0.0137%0.368CS..EExtended strand (participates in β ladder)trans-135.6146.4179.369180000110.2V143 L188 L191 M192 I204 K205 W206 I207V143-I197 HydrophobicContact CB-CG2 4.4Å; V143-I197 HydrophobicContact CG1-CB 4.49Å; V143-I197 HydrophobicContact CG1-CG2 3.75Å; L188-I197 HydrophobicContact CB-CD1 4.3Å; L188-I197 HydrophobicContact CD2-CD1 3.42Å; L188-I197 VanDerWaalsContact CD2-CD1 3.42Å; L188-I197 HydrophobicContact CG-CD1 4.46Å; L191-I197 HydrophobicContact CB-CD1 3.68Å; L191-I197 HydrophobicContact CB-CG1 3.83Å; L191-I197 HydrophobicContact CB-CG2 4.4Å; L191-I197 HydrophobicContact CD1-CD1 4.38Å; L191-I197 PolarHBondContact O-N 3.42Å; M192-I197 WeakPolarHBondContact CA-O 3.26Å; M192-I197 HydrophobicContact CB-CG1 4.2Å; I197-I204 HydrophobicContact CB-CG2 4.32Å; I197-I204 HydrophobicContact CD1-CG2 3.96Å; I197-I204 HydrophobicContact CG1-CG2 4.5Å; I197-K205 CarbonylContact C-O 3.55Å; I197-K205 VanDerWaalsContact CA-O 3.22Å; I197-K205 WeakPolarHBondContact CA-O 3.37Å; I197-K205 WeakPolarHBondContact CB-O 3.34Å; I197-W206 HydrophobicContact CG2-CE3 3.94Å; I197-W206 HydrophobicContact CG2-CZ3 4.34Å; I197-I207 VanDerWaalsContact C-CD1 3.48Å
198S93Very high91.8Very high54 Ų5473.6 Ų73.638%0.37838%0.376SS..EExtended strand (participates in β ladder)trans-98.3147.2167.1-176.80000109.6I204 K205S198-I204 CarbonylContact O-C 3.57Å; S198-I204 VanDerWaalsContact O-CA 3.32Å; S198-I204 WeakPolarHBondContact O-CA 3.33Å; S198-K205 PolarHBondContact N-O 3.21Å; S198-K205 PolarHBondContact O-N 2.58Å
199K93.3Very high91.2Very high100 Ų10078 Ų7844%0.43540%0.399SS..EExtended strand (participates in β ladder)trans-127.5111172.5-177.9-169.4174.6-165.90110.4M192 K201 E203 I204M192-K199 HydrophobicContact CE-CB 3.6Å; M192-K199 HydrophobicContact CE-CD 3.57Å; M192-K199 HydrophobicContact CE-CG 4.24Å; M192-K199 HydrophobicContact SD-CB 3.99Å; K199-K201 WeakPolarHBondContact CE-O 3.35Å; K199-E203 CarbonylContact C-O 3.5Å; K199-E203 WeakPolarHBondContact CA-O 3.25Å; K199-I204 HydrophobicContact CG-CG1 4.21Å
200E91.8Very high89.8Confident109 Ų10977.6 Ų77.651%0.50940%0.402SS..EExtended strand (participates in β ladder)trans-108.9103175.8-168.6179.3175.500109.7K202 E203 K205E200-K202 PolarHBondContact O-N 3.35Å; E200-E203 PolarHBondContact N-O 3.03Å; E200-E203 WeakPolarHBondContact O-CB 3.45Å; E200-E203 PolarHBondContact O-N 3.36Å; E200-K205 IonicContact OE2-NZ 3.8Å
201K89.6Confident88.3Confident188 Ų18877.5 Ų77.582%0.81740%0.402SS*.THydrogen-bonded Turntrans55-94.2-176.1-60.5169.1-178163.90112.8K199K199-K201 WeakPolarHBondContact CE-O 3.35Å
202K91.6Very high86.7Confident185 Ų18582 Ų8280%0.80443%0.426SS*.THydrogen-bonded Turntrans-105.4-14.7179.7-69.7-175.5177179.50113.4S150 E200S150-K202 WeakPolarHBondContact CB-O 3.39Å; E200-K202 PolarHBondContact O-N 3.35Å
203E94Very high85.7Confident79 Ų7982.1 Ų82.137%0.36943%0.433SS..EExtended strand (participates in β ladder)trans-92.5137.4-175.9-166.2176167.600109.8T148 K199 E200 K205T148-E203 HydrophobicContact CG2-CG 3.57Å; T148-E203 VanDerWaalsContact CG2-OE1 3.32Å; T148-E203 WeakPolarHBondContact CG2-OE1 3.35Å; K199-E203 CarbonylContact C-O 3.5Å; K199-E203 WeakPolarHBondContact CA-O 3.25Å; E200-E203 PolarHBondContact N-O 3.03Å; E200-E203 WeakPolarHBondContact O-CB 3.45Å; E200-E203 PolarHBondContact O-N 3.36Å; E203-K205 WeakPolarHBondContact OE1-CE 3.48Å; E203-K205 IonicContact OE1-NZ 2.71Å; E203-K205 PolarHBondContact OE1-NZ 3.02Å; E203-K205 VanDerWaalsContact OE1-NZ 3.15Å; E203-K205 IonicContact OE2-NZ 2.66Å
204I95.6Very high85Confident2 Ų280.8 Ų80.81%0.0142%0.422CS..EExtended strand (participates in β ladder)trans-125.1119.3179.8-58.5171.4000106.9V143 T148 T149 L188 I197 S198 K199V143-I204 HydrophobicContact CG1-CG2 3.93Å; V143-I204 HydrophobicContact CG2-CG2 4.25Å; T148-I204 CarbonylContact C-O 3.59Å; T148-I204 WeakPolarHBondContact CA-O 3.4Å; T149-I204 HydrophobicContact CG2-CB 4.16Å; T149-I204 HydrophobicContact CG2-CG2 4.46Å; T149-I204 PolarHBondContact N-O 3.36Å; T149-I204 PolarHBondContact O-N 3.02Å; L188-I204 HydrophobicContact CD1-CD1 3.79Å; L188-I204 HydrophobicContact CD2-CD1 4.08Å; L188-I204 HydrophobicContact CD2-CG2 4.38Å; I197-I204 HydrophobicContact CB-CG2 4.32Å; I197-I204 HydrophobicContact CD1-CG2 3.96Å; I197-I204 HydrophobicContact CG1-CG2 4.5Å; S198-I204 CarbonylContact O-C 3.57Å; S198-I204 VanDerWaalsContact O-CA 3.32Å; S198-I204 WeakPolarHBondContact O-CA 3.33Å; K199-I204 HydrophobicContact CG-CG1 4.21Å
205K93Very high84.6Confident72 Ų7280.5 Ų80.531%0.31342%0.419SS..EExtended strand (participates in β ladder)trans-109.8135.6-178.6-68.4170.4-179.2156.40109.8G147 T148 I197 S198 E200 E203G147-K205 WeakPolarHBondContact O-CA 3.49Å; T148-K205 HydrophobicContact CG2-CG 4.18Å; I197-K205 CarbonylContact C-O 3.55Å; I197-K205 VanDerWaalsContact CA-O 3.22Å; I197-K205 WeakPolarHBondContact CA-O 3.37Å; I197-K205 WeakPolarHBondContact CB-O 3.34Å; S198-K205 PolarHBondContact N-O 3.21Å; S198-K205 PolarHBondContact O-N 2.58Å; E200-K205 IonicContact OE2-NZ 3.8Å; E203-K205 WeakPolarHBondContact OE1-CE 3.48Å; E203-K205 IonicContact OE1-NZ 2.71Å; E203-K205 PolarHBondContact OE1-NZ 3.02Å; E203-K205 VanDerWaalsContact OE1-NZ 3.15Å; E203-K205 IonicContact OE2-NZ 2.66Å
206W93.1Very high84.1Confident57 Ų5779.9 Ų79.922%0.21641%0.413CS..EExtended strand (participates in β ladder)trans-69.9126.3167.4-179.1-103.6000109.7V143 Q144 G147 I196 I197 L209V143-W206 HydrophobicContact CB-CE3 4.43Å; V143-W206 HydrophobicContact CG1-CB 4.22Å; V143-W206 HydrophobicContact CG1-CE3 4.22Å; Q144-W206 HydrophobicContact CB-CD2 3.81Å; Q144-W206 HydrophobicContact CB-CE3 3.76Å; Q144-W206 HydrophobicContact CB-CH2 3.93Å; Q144-W206 HydrophobicContact CB-CZ2 3.97Å; Q144-W206 HydrophobicContact CB-CZ3 3.83Å; Q144-W206 HydrophobicContact CG-CD2 4.08Å; Q144-W206 HydrophobicContact CG-CE3 4.47Å; Q144-W206 HydrophobicContact CG-CH2 4.17Å; Q144-W206 HydrophobicContact CG-CZ2 3.74Å; G147-W206 PolarHBondContact O-N 2.92Å; I196-W206 HydrophobicContact CG2-CE3 4.2Å; I196-W206 HydrophobicContact CG2-CH2 3.65Å; I196-W206 HydrophobicContact CG2-CZ2 4.48Å; I196-W206 HydrophobicContact CG2-CZ3 3.48Å; I196-W206 VanDerWaalsContact CG2-CZ3 3.48Å; I197-W206 HydrophobicContact CG2-CE3 3.94Å; I197-W206 HydrophobicContact CG2-CZ3 4.34Å; W206-L209 HydrophobicContact CH2-CD2 4.17Å; W206-L209 HydrophobicContact CH2-CG 4.28Å; W206-L209 HydrophobicContact CZ2-CG 4.37Å
207I87.8Confident83.9Confident83 Ų8383 Ų8343%0.42644%0.435SS..  trans-95.3-49.7172.2-57.6172.6000108.7N195 I196 I197N195-I207 WeakPolarHBondContact O-CD1 3.4Å; N195-I207 VanDerWaalsContact OD1-CD1 3.31Å; N195-I207 WeakPolarHBondContact OD1-CD1 3.32Å; I196-I207 WeakPolarHBondContact O-CB 3.39Å; I196-I207 PolarHBondContact O-N 3.15Å; I197-I207 VanDerWaalsContact C-CD1 3.48Å
208G80.6Confident83.6Confident18 Ų1888.4 Ų88.419%0.18646%0.46CS..  trans136.5156.1-172.600000110.8I196I196-G208 VanDerWaalsContact CA-O 3.28Å; I196-G208 WeakPolarHBondContact CA-O 3.46Å; I196-G208 PolarHBondContact O-N 2.99Å
209L82.1Confident83.4Confident100 Ų10090 Ų9052%0.52446%0.464SS..  trans-63.7140.9167.9-62174.3000108.7I196 W206 T211I196-L209 HydrophobicContact CD1-CD2 4.14Å; I196-L209 HydrophobicContact CG1-CD2 4.27Å; I196-L209 HydrophobicContact CG2-CD2 4.02Å; W206-L209 HydrophobicContact CH2-CD2 4.17Å; W206-L209 HydrophobicContact CH2-CG 4.28Å; W206-L209 HydrophobicContact CZ2-CG 4.37Å; L209-T211 VanDerWaalsContact C-N 3.3Å; L209-T211 PolarHBondContact O-N 3.5Å; L209-T211 PolarHBondContact O-OG1 3.49Å
210P67.2Low83.4Confident83 Ų8390.4 Ų90.454%0.53947%0.471SS..  trans-53.389.4170.5-31.235.2000112.3M194 I196 N212M194-P210 WeakPolarHBondContact O-CG 3.07Å; I196-P210 VanDerWaalsContact CG1-CD 3.44Å; I196-P210 HydrophobicContact CG1-CG 4.25Å; P210-N212 VanDerWaalsContact C-N 3.29Å; P210-N212 PolarHBondContact O-N 3.32Å
211T62.8Low83.4Confident92 Ų9289.6 Ų89.656%0.56447%0.467SS*.  trans-80.480.6-17826.40000109.6L209 S213 A214L209-T211 VanDerWaalsContact C-N 3.3Å; L209-T211 PolarHBondContact O-N 3.5Å; L209-T211 PolarHBondContact O-OG1 3.49Å; T211-S213 PolarHBondContact O-N 3.3Å; T211-S213 VanDerWaalsContact O-N 3.17Å; T211-A214 PolarHBondContact O-N 2.94Å; T211-A214 VanDerWaalsContact O-N 3.1Å
212N60.7Low83.7Confident114 Ų11485.5 Ų85.561%0.6145%0.453SS*.Hα-helixtrans-44.9-41.7162.2-171.312.4000110P210 A214 Q215 E216P210-N212 VanDerWaalsContact C-N 3.29Å; P210-N212 PolarHBondContact O-N 3.32Å; N212-A214 PolarHBondContact O-N 3.44Å; N212-Q215 PolarHBondContact O-N 3.27Å; N212-E216 WeakPolarHBondContact O-CB 3.44Å; N212-E216 PolarHBondContact O-N 3.36Å
213S70.4Confident83.9Confident69 Ų6978.7 Ų78.748%0.48342%0.424SS..Hα-helixtrans-49.4-33178.159.10000116T211 C217T211-S213 PolarHBondContact O-N 3.3Å; T211-S213 VanDerWaalsContact O-N 3.17Å; S213-C217 WeakPolarHBondContact O-CB 3.32Å; S213-C217 PolarHBondContact O-N 2.84Å
214A77.7Confident84Confident57 Ų5779.8 Ų79.847%0.47143%0.428SS..Hα-helixtrans-75.4-43.5179.300000111.8T211 N212 Q218T211-A214 PolarHBondContact O-N 2.94Å; T211-A214 VanDerWaalsContact O-N 3.1Å; N212-A214 PolarHBondContact O-N 3.44Å; A214-Q218 WeakPolarHBondContact O-CG 3.42Å; A214-Q218 PolarHBondContact O-N 2.93Å
215Q78.8Confident84Confident103 Ų10385 Ų8548%0.48145%0.452SS..Hα-helixtrans-71.5-38.7175.6-173.560.757.400111.3N212 Q218 N219N212-Q215 PolarHBondContact O-N 3.27Å; Q215-Q218 PolarHBondContact O-N 3.02Å; Q215-N219 PolarHBondContact NE2-OD1 2.96Å; Q215-N219 WeakPolarHBondContact O-CB 3.3Å; Q215-N219 PolarHBondContact O-N 3.41Å; Q215-N219 PolarHBondContact O-ND2 3.23Å; Q215-N219 PolarHBondContact O-OD1 3.46Å
216E81Confident84.3Confident94 Ų9488.4 Ų88.444%0.43946%0.463SS..Hα-helixtrans-60.7-45.5173.7-176.4177.3-163.600111.1N212 Q218 N219 L220N212-E216 WeakPolarHBondContact O-CB 3.44Å; N212-E216 PolarHBondContact O-N 3.36Å; E216-Q218 VanDerWaalsContact C-N 3.34Å; E216-Q218 PolarHBondContact O-N 3.48Å; E216-N219 PolarHBondContact O-N 3Å; E216-N219 VanDerWaalsContact O-N 3.17Å; E216-L220 HydrophobicContact CG-CD1 4.08Å; E216-L220 HydrophobicContact CG-CG 4.46Å; E216-L220 WeakPolarHBondContact O-CB 3.24Å; E216-L220 VanDerWaalsContact O-CG 3.26Å; E216-L220 WeakPolarHBondContact O-CG 3.32Å; E216-L220 PolarHBondContact O-N 3.27Å
217C85.6Confident84.5Confident81 Ų8192.5 Ų92.555%0.54748%0.478SS..Hα-helixtrans-60.8-41.1175.4-169.30000112.1S213 L220 E221S213-C217 WeakPolarHBondContact O-CB 3.32Å; S213-C217 PolarHBondContact O-N 2.84Å; C217-L220 PolarHBondContact O-N 2.94Å; C217-E221 PolarHBondContact O-N 3.42Å
218Q85.7Confident84.9Confident116 Ų11692.1 Ų92.154%0.54248%0.476SS..Hα-helixtrans-63-44.4172.6-70.8-179-1.900112.3A214 Q215 E216 L220 E221 I222A214-Q218 WeakPolarHBondContact O-CG 3.42Å; A214-Q218 PolarHBondContact O-N 2.93Å; Q215-Q218 PolarHBondContact O-N 3.02Å; E216-Q218 VanDerWaalsContact C-N 3.34Å; E216-Q218 PolarHBondContact O-N 3.48Å; Q218-L220 VanDerWaalsContact C-N 3.33Å; Q218-L220 PolarHBondContact O-N 2.95Å; Q218-E221 PolarHBondContact O-N 2.95Å; Q218-I222 WeakPolarHBondContact O-CG1 3.14Å; Q218-I222 PolarHBondContact O-N 3.47Å
219N88.3Confident85.6Confident87 Ų8794.6 Ų94.647%0.46548%0.483SS..Hα-helixtrans-63.2-39.8177.8-67.3-10.6000111.6Q215 E216 I222 E223Q215-N219 PolarHBondContact NE2-OD1 2.96Å; Q215-N219 WeakPolarHBondContact O-CB 3.3Å; Q215-N219 PolarHBondContact O-N 3.41Å; Q215-N219 PolarHBondContact O-ND2 3.23Å; Q215-N219 PolarHBondContact O-OD1 3.46Å; E216-N219 PolarHBondContact O-N 3Å; E216-N219 VanDerWaalsContact O-N 3.17Å; N219-I222 PolarHBondContact O-N 2.92Å; N219-E223 PolarHBondContact O-N 3.18Å
220L93.3Very high86.4Confident109 Ų10995 Ų9557%0.57148%0.478SS*.Hα-helixtrans-65.9-40175.8-73.7171.3000112E216 C217 Q218 E223 K224E216-L220 HydrophobicContact CG-CD1 4.08Å; E216-L220 HydrophobicContact CG-CG 4.46Å; E216-L220 WeakPolarHBondContact O-CB 3.24Å; E216-L220 VanDerWaalsContact O-CG 3.26Å; E216-L220 WeakPolarHBondContact O-CG 3.32Å; E216-L220 PolarHBondContact O-N 3.27Å; C217-L220 PolarHBondContact O-N 2.94Å; Q218-L220 VanDerWaalsContact C-N 3.33Å; Q218-L220 PolarHBondContact O-N 2.95Å; L220-E223 PolarHBondContact O-N 3Å; L220-K224 WeakPolarHBondContact O-CB 3.44Å; L220-K224 PolarHBondContact O-N 3.3Å
221E93.6Very high87.8Confident92 Ų9295.3 Ų95.343%0.4347%0.474SS..Hα-helixtrans-66.2-38.2175.6-169.459.6-143.700111.6C217 Q218 K224 Q225C217-E221 PolarHBondContact O-N 3.42Å; Q218-E221 PolarHBondContact O-N 2.95Å; E221-K224 PolarHBondContact O-N 3.33Å; E221-K224 WeakPolarHBondContact OE1-CE 3.47Å; E221-K224 IonicContact OE1-NZ 2.68Å; E221-K224 PolarHBondContact OE1-NZ 3.2Å; E221-K224 WeakPolarHBondContact OE2-CD 3.36Å; E221-K224 IonicContact OE2-NZ 3.96Å; E221-K224 PolarHBondContact OE2-NZ 3.4Å; E221-Q225 WeakPolarHBondContact O-CB 3.48Å; E221-Q225 PolarHBondContact O-N 3.24Å
222I95.1Very high89.3Confident103 Ų10396.4 Ų96.453%0.52847%0.471SS..Hα-helixtrans-63.3-45.8173.2-67.7165.6000111.2Q218 N219 Q225 R226Q218-I222 WeakPolarHBondContact O-CG1 3.14Å; Q218-I222 PolarHBondContact O-N 3.47Å; N219-I222 PolarHBondContact O-N 2.92Å; I222-Q225 PolarHBondContact O-N 3.02Å; I222-R226 WeakPolarHBondContact O-CB 3.47Å; I222-R226 PolarHBondContact O-N 3.03Å
223E95.4Very high91.1Very high41 Ų4195.8 Ų95.819%0.19246%0.464CS..Hα-helixtrans-69.1-36.7178.1176.255.6-158.700112.1N219 L220 R226 R227 R230N219-E223 PolarHBondContact O-N 3.18Å; L220-E223 PolarHBondContact O-N 3Å; E223-R226 WeakPolarHBondContact O-CB 3.3Å; E223-R226 PolarHBondContact O-N 3.27Å; E223-R226 WeakPolarHBondContact OE2-CD 3.44Å; E223-R226 IonicContact OE2-CZ 2.66Å; E223-R226 IonicContact OE2-NE 3.9Å; E223-R226 IonicContact OE2-NH1 2.76Å; E223-R226 PolarHBondContact OE2-NH1 3.07Å; E223-R227 HydrophobicContact CG-CG 4.5Å; E223-R227 WeakPolarHBondContact O-CB 3.45Å; E223-R227 VanDerWaalsContact O-CG 3.27Å; E223-R227 WeakPolarHBondContact O-CG 3.41Å; E223-R227 PolarHBondContact O-N 2.63Å; E223-R227 WeakPolarHBondContact OE1-CG 3.41Å; E223-R227 IonicContact OE1-CZ 2.71Å; E223-R227 IonicContact OE1-NE 3.78Å; E223-R227 PolarHBondContact OE1-NE 2.78Å; E223-R227 IonicContact OE1-NH2 3.58Å; E223-R230 IonicContact OE1-NH1 2.92Å
224K96.1Very high92.3Very high102 Ų10298.8 Ų98.844%0.44347%0.469SS..Hα-helixtrans-57.4-48.5169.8169.3-176.1160.9-145.10110.8L220 E221 R226 R227 I228L220-K224 WeakPolarHBondContact O-CB 3.44Å; L220-K224 PolarHBondContact O-N 3.3Å; E221-K224 PolarHBondContact O-N 3.33Å; E221-K224 WeakPolarHBondContact OE1-CE 3.47Å; E221-K224 IonicContact OE1-NZ 2.68Å; E221-K224 PolarHBondContact OE1-NZ 3.2Å; E221-K224 WeakPolarHBondContact OE2-CD 3.36Å; E221-K224 IonicContact OE2-NZ 3.96Å; E221-K224 PolarHBondContact OE2-NZ 3.4Å; K224-R226 VanDerWaalsContact C-N 3.34Å; K224-R226 PolarHBondContact O-N 2.97Å; K224-R227 WeakPolarHBondContact O-CB 3.33Å; K224-R227 PolarHBondContact O-N 3.38Å; K224-R227 VanDerWaalsContact O-N 3.16Å; K224-I228 HydrophobicContact CG-CD1 3.91Å; K224-I228 VanDerWaalsContact O-CG1 3.31Å; K224-I228 WeakPolarHBondContact O-CG1 3.19Å; K224-I228 PolarHBondContact O-N 3.16Å
225Q96.4Very high93Very high111 Ų111100.8 Ų100.852%0.51946%0.464SS..Hα-helixtrans-62.9-39.9177.6-172.160.314.900112.1E221 I222 I228 E229E221-Q225 WeakPolarHBondContact O-CB 3.48Å; E221-Q225 PolarHBondContact O-N 3.24Å; I222-Q225 PolarHBondContact O-N 3.02Å; Q225-I228 PolarHBondContact O-N 3.1Å; Q225-E229 PolarHBondContact O-N 3.38Å; Q225-E229 VanDerWaalsContact O-N 3.15Å
226R97.8Very high93.7Very high144 Ų14498.4 Ų98.454%0.54346%0.462SS..Hα-helixtrans-61.5-41.6173-170.5-173-67.6149-12.2112I222 E223 K224 R230I222-R226 WeakPolarHBondContact O-CB 3.47Å; I222-R226 PolarHBondContact O-N 3.03Å; E223-R226 WeakPolarHBondContact O-CB 3.3Å; E223-R226 PolarHBondContact O-N 3.27Å; E223-R226 WeakPolarHBondContact OE2-CD 3.44Å; E223-R226 IonicContact OE2-CZ 2.66Å; E223-R226 IonicContact OE2-NE 3.9Å; E223-R226 IonicContact OE2-NH1 2.76Å; E223-R226 PolarHBondContact OE2-NH1 3.07Å; K224-R226 VanDerWaalsContact C-N 3.34Å; K224-R226 PolarHBondContact O-N 2.97Å; R226-R230 WeakPolarHBondContact O-CB 3.34Å; R226-R230 PolarHBondContact O-N 2.72Å; R226-R230 VanDerWaalsContact O-N 3.1Å
227R97.4Very high94.4Very high143 Ų14399.6 Ų99.654%0.5447%0.468SS..Hα-helixtrans-66-41.9175.9-73.2172.5-175.1-161.34.2111.8E223 K224 R230 I231E223-R227 HydrophobicContact CG-CG 4.5Å; E223-R227 WeakPolarHBondContact O-CB 3.45Å; E223-R227 VanDerWaalsContact O-CG 3.27Å; E223-R227 WeakPolarHBondContact O-CG 3.41Å; E223-R227 PolarHBondContact O-N 2.63Å; E223-R227 WeakPolarHBondContact OE1-CG 3.41Å; E223-R227 IonicContact OE1-CZ 2.71Å; E223-R227 IonicContact OE1-NE 3.78Å; E223-R227 PolarHBondContact OE1-NE 2.78Å; E223-R227 IonicContact OE1-NH2 3.58Å; K224-R227 WeakPolarHBondContact O-CB 3.33Å; K224-R227 PolarHBondContact O-N 3.38Å; K224-R227 VanDerWaalsContact O-N 3.16Å; R227-R230 PolarHBondContact O-N 3.48Å; R227-I231 WeakPolarHBondContact O-CB 3.5Å; R227-I231 WeakPolarHBondContact O-CD1 3.2Å; R227-I231 VanDerWaalsContact O-CG1 3.23Å; R227-I231 WeakPolarHBondContact O-CG1 3.27Å; R227-I231 PolarHBondContact O-N 3.5Å
228I96.6Very high94.8Very high76 Ų7698.2 Ų98.239%0.3945%0.454SS..Hα-helixtrans-59.1-49.3177.5-72.1165.1000111.1K224 Q225 R230 I231 K232K224-I228 HydrophobicContact CG-CD1 3.91Å; K224-I228 VanDerWaalsContact O-CG1 3.31Å; K224-I228 WeakPolarHBondContact O-CG1 3.19Å; K224-I228 PolarHBondContact O-N 3.16Å; Q225-I228 PolarHBondContact O-N 3.1Å; I228-R230 PolarHBondContact O-N 2.89Å; I228-I231 PolarHBondContact O-N 3.49Å; I228-K232 WeakPolarHBondContact O-CB 3.44Å; I228-K232 PolarHBondContact O-N 2.71Å
229E96.3Very high95.2Very high70 Ų7095.9 Ų95.933%0.32744%0.444SS..Hα-helixtrans-66.5-38.4178.9-177.754.7-142.100111.6Q225 I231 K232 Q233Q225-E229 PolarHBondContact O-N 3.38Å; Q225-E229 VanDerWaalsContact O-N 3.15Å; E229-I231 PolarHBondContact O-N 3.23Å; E229-K232 WeakPolarHBondContact O-CB 3.4Å; E229-K232 PolarHBondContact O-N 3.29Å; E229-K232 IonicContact OE1-NZ 3.18Å; E229-K232 WeakPolarHBondContact OE2-CD 3.36Å; E229-K232 IonicContact OE2-NZ 2.85Å; E229-K232 PolarHBondContact OE2-NZ 3.16Å; E229-Q233 WeakPolarHBondContact O-CG 3.43Å; E229-Q233 PolarHBondContact O-N 2.83Å; E229-Q233 PolarHBondContact OE1-NE2 3.1Å
230R97.8Very high95.4Very high109 Ų10995.3 Ų95.341%0.41144%0.438SS..Hα-helixtrans-61.5-40.3172.6-168-170.4-64.6133.5-3.2112.4E223 R226 R227 I228 K234E223-R230 IonicContact OE1-NH1 2.92Å; R226-R230 WeakPolarHBondContact O-CB 3.34Å; R226-R230 PolarHBondContact O-N 2.72Å; R226-R230 VanDerWaalsContact O-N 3.1Å; R227-R230 PolarHBondContact O-N 3.48Å; I228-R230 PolarHBondContact O-N 2.89Å; R230-K234 WeakPolarHBondContact O-CG 3.47Å; R230-K234 PolarHBondContact O-N 3.06Å
231I96.8Very high95.5Very high89 Ų8995.1 Ų95.146%0.45644%0.437SS..Hα-helixtrans-65.4-44176.2-73.8163.3000110.6R227 I228 E229 Q233 K234 R235R227-I231 WeakPolarHBondContact O-CB 3.5Å; R227-I231 WeakPolarHBondContact O-CD1 3.2Å; R227-I231 VanDerWaalsContact O-CG1 3.23Å; R227-I231 WeakPolarHBondContact O-CG1 3.27Å; R227-I231 PolarHBondContact O-N 3.5Å; I228-I231 PolarHBondContact O-N 3.49Å; E229-I231 PolarHBondContact O-N 3.23Å; I231-Q233 PolarHBondContact O-N 3.37Å; I231-K234 PolarHBondContact O-N 2.96Å; I231-R235 HydrophobicContact CG2-CG 4.41Å; I231-R235 WeakPolarHBondContact O-CB 3.35Å; I231-R235 WeakPolarHBondContact O-CG 3.49Å; I231-R235 PolarHBondContact O-N 2.92Å
232K95.4Very high95.5Very high114 Ų11491 Ų9150%0.49642%0.418SS..Hα-helixtrans-59.9-44.6176.5178.3-175.3162-155.80112.1I228 E229 R235 A236I228-K232 WeakPolarHBondContact O-CB 3.44Å; I228-K232 PolarHBondContact O-N 2.71Å; E229-K232 WeakPolarHBondContact O-CB 3.4Å; E229-K232 PolarHBondContact O-N 3.29Å; E229-K232 IonicContact OE1-NZ 3.18Å; E229-K232 WeakPolarHBondContact OE2-CD 3.36Å; E229-K232 IonicContact OE2-NZ 2.85Å; E229-K232 PolarHBondContact OE2-NZ 3.16Å; K232-R235 PolarHBondContact O-N 3.46Å; K232-A236 PolarHBondContact O-N 2.87Å
233Q96.6Very high95.4Very high101 Ų10186.7 Ų86.747%0.47240%0.396SS..Hα-helixtrans-63.8-46.6175.8-69.4171.313.600112.1E229 I231 R235 A236 Q237E229-Q233 WeakPolarHBondContact O-CG 3.43Å; E229-Q233 PolarHBondContact O-N 2.83Å; E229-Q233 PolarHBondContact OE1-NE2 3.1Å; I231-Q233 PolarHBondContact O-N 3.37Å; Q233-R235 VanDerWaalsContact C-N 3.31Å; Q233-R235 PolarHBondContact O-N 3.36Å; Q233-A236 PolarHBondContact O-N 3.16Å; Q233-Q237 WeakPolarHBondContact O-CG 3.23Å; Q233-Q237 PolarHBondContact O-N 2.98Å
234K96.9Very high95.4Very high133 Ų13388.5 Ų88.558%0.57840%0.404SS*.Hα-helixtrans-62.6-35.7175.5-75.2-174174.5-168.70112.7R230 I231 Q237 L238R230-K234 WeakPolarHBondContact O-CG 3.47Å; R230-K234 PolarHBondContact O-N 3.06Å; I231-K234 PolarHBondContact O-N 2.96Å; K234-Q237 PolarHBondContact O-N 3.43Å; K234-L238 WeakPolarHBondContact O-CB 3.43Å; K234-L238 PolarHBondContact O-N 3.35Å
235R92.9Very high95.3Very high98 Ų9887.4 Ų87.437%0.3740%0.401SS..Hα-helixtrans-63.5-46.9173.4-80.5177168.2-179.9-5.5111.5I231 K232 Q233 Q237 L238 Q239I231-R235 HydrophobicContact CG2-CG 4.41Å; I231-R235 WeakPolarHBondContact O-CB 3.35Å; I231-R235 WeakPolarHBondContact O-CG 3.49Å; I231-R235 PolarHBondContact O-N 2.92Å; K232-R235 PolarHBondContact O-N 3.46Å; Q233-R235 VanDerWaalsContact C-N 3.31Å; Q233-R235 PolarHBondContact O-N 3.36Å; R235-Q237 VanDerWaalsContact C-N 3.35Å; R235-Q237 PolarHBondContact O-N 2.85Å; R235-L238 PolarHBondContact O-N 2.71Å; R235-Q239 VanDerWaalsContact O-CG 3.32Å; R235-Q239 WeakPolarHBondContact O-CG 3.45Å; R235-Q239 PolarHBondContact O-N 3.47Å
236A92.6Very high95.2Very high53 Ų5382.1 Ų82.144%0.43838%0.376SS..Hα-helixtrans-61.2-42176.200000112.3K232 Q233 Q239 E240K232-A236 PolarHBondContact O-N 2.87Å; Q233-A236 PolarHBondContact O-N 3.16Å; A236-Q239 PolarHBondContact O-N 3.24Å; A236-E240 PolarHBondContact O-N 3.28Å
237Q95.8Very high95.1Very high120 Ų12075.3 Ų75.356%0.56135%0.35SS*.Hα-helixtrans-61.6-43.3174-71171.2-600112.3Q233 K234 R235 E240 L241Q233-Q237 WeakPolarHBondContact O-CG 3.23Å; Q233-Q237 PolarHBondContact O-N 2.98Å; K234-Q237 PolarHBondContact O-N 3.43Å; R235-Q237 VanDerWaalsContact C-N 3.35Å; R235-Q237 PolarHBondContact O-N 2.85Å; Q237-E240 PolarHBondContact O-N 3.15Å; Q237-L241 WeakPolarHBondContact O-CG 3.31Å; Q237-L241 PolarHBondContact O-N 2.73Å
238L95.1Very high95.1Very high52 Ų5273.3 Ų73.327%0.27235%0.346SS..Hα-helixtrans-63.3-40.9176.1178.162.6000111.9K234 R235 L241 L242 Y348K234-L238 WeakPolarHBondContact O-CB 3.43Å; K234-L238 PolarHBondContact O-N 3.35Å; R235-L238 PolarHBondContact O-N 2.71Å; L238-L241 PolarHBondContact O-N 2.89Å; L238-L242 HydrophobicContact CD1-CD1 4.42Å; L238-L242 HydrophobicContact CD1-CG 4.35Å; L238-L242 HydrophobicContact CG-CD1 4.19Å; L238-L242 WeakPolarHBondContact O-CB 3.35Å; L238-L242 VanDerWaalsContact O-CG 3.3Å; L238-L242 WeakPolarHBondContact O-CG 3.25Å; L238-L242 PolarHBondContact O-N 3.24Å; L238-Y348 HydrophobicContact CD2-CD1 4.22Å; L238-Y348 HydrophobicContact CD2-CD2 4.18Å; L238-Y348 HydrophobicContact CD2-CE1 4.08Å; L238-Y348 HydrophobicContact CD2-CE2 4.07Å; L238-Y348 HydrophobicContact CD2-CG 4.27Å
239Q92.3Very high95Very high67 Ų6773.5 Ų73.531%0.31334%0.344SS..Hα-helixtrans-61.2-45176-70.6175.9-44.900111.2R235 A236 L242 L243 I352R235-Q239 VanDerWaalsContact O-CG 3.32Å; R235-Q239 WeakPolarHBondContact O-CG 3.45Å; R235-Q239 PolarHBondContact O-N 3.47Å; A236-Q239 PolarHBondContact O-N 3.24Å; Q239-L242 PolarHBondContact O-N 3.23Å; Q239-L243 WeakPolarHBondContact O-CG 3.43Å; Q239-L243 PolarHBondContact O-N 3.23Å; Q239-I352 HydrophobicContact CB-CD1 4.1Å; Q239-I352 HydrophobicContact CB-CG1 4.31Å; Q239-I352 HydrophobicContact CG-CD1 3.9Å; Q239-I352 HydrophobicContact CG-CG1 3.78Å
240E92.7Very high95Very high75 Ų7571.2 Ų71.235%0.3533%0.334SS..Hα-helixtrans-62.2-45.1177-174.855.8-146.700112.3A236 Q237 L242 L243 Q244 K316A236-E240 PolarHBondContact O-N 3.28Å; Q237-E240 PolarHBondContact O-N 3.15Å; E240-L242 VanDerWaalsContact C-N 3.32Å; E240-L242 PolarHBondContact O-N 3.41Å; E240-L243 PolarHBondContact O-N 3.37Å; E240-Q244 PolarHBondContact O-N 3.48Å; E240-K316 WeakPolarHBondContact OE1-CE 3.23Å; E240-K316 IonicContact OE1-NZ 3.25Å; E240-K316 PolarHBondContact OE1-NZ 3.2Å; E240-K316 IonicContact OE2-NZ 2.66Å; E240-K316 PolarHBondContact OE2-NZ 3.48Å
241L95.6Very high94.9Very high105 Ų10566.8 Ų66.855%0.5532%0.319SS..Hα-helixtrans-62.4-36.6175.5-70.6170.9000112.7Q237 L238 Q245Q237-L241 WeakPolarHBondContact O-CG 3.31Å; Q237-L241 PolarHBondContact O-N 2.73Å; L238-L241 PolarHBondContact O-N 2.89Å; L241-Q245 WeakPolarHBondContact O-CB 3.48Å; L241-Q245 PolarHBondContact O-N 3.16Å
242L94.2Very high94.8Very high6 Ų665.3 Ų65.33%0.03131%0.313CS..Hα-helixtrans-66.4-43.6174.5-76.9173.3000111.7L238 Q239 E240 Q245 I246 V341 L345 Y348 I352L238-L242 HydrophobicContact CD1-CD1 4.42Å; L238-L242 HydrophobicContact CD1-CG 4.35Å; L238-L242 HydrophobicContact CG-CD1 4.19Å; L238-L242 WeakPolarHBondContact O-CB 3.35Å; L238-L242 VanDerWaalsContact O-CG 3.3Å; L238-L242 WeakPolarHBondContact O-CG 3.25Å; L238-L242 PolarHBondContact O-N 3.24Å; Q239-L242 PolarHBondContact O-N 3.23Å; E240-L242 VanDerWaalsContact C-N 3.32Å; E240-L242 PolarHBondContact O-N 3.41Å; L242-Q245 PolarHBondContact O-N 3.37Å; L242-I246 WeakPolarHBondContact O-CB 3.44Å; L242-I246 WeakPolarHBondContact O-CD1 3.13Å; L242-I246 VanDerWaalsContact O-CG1 3.24Å; L242-I246 WeakPolarHBondContact O-CG1 3.38Å; L242-I246 PolarHBondContact O-N 3.49Å; L242-V341 HydrophobicContact CD2-CG1 3.58Å; L242-V341 HydrophobicContact CD2-CG2 4.27Å; L242-L345 HydrophobicContact CD2-CB 4.13Å; L242-L345 HydrophobicContact CD2-CD1 3.97Å; L242-Y348 HydrophobicContact CD1-CG 4.46Å; L242-I352 HydrophobicContact CD1-CD1 4.4Å
243L92.9Very high94.8Very high11 Ų1163.9 Ų63.96%0.05831%0.308CS..Hα-helixtrans-61.3-43.9175.3-68.6169.7000111.3Q239 E240 I246 A247 L324 E325Q239-L243 WeakPolarHBondContact O-CG 3.43Å; Q239-L243 PolarHBondContact O-N 3.23Å; E240-L243 PolarHBondContact O-N 3.37Å; L243-I246 PolarHBondContact O-N 3.03Å; L243-A247 VanDerWaalsContact O-CB 3.24Å; L243-A247 WeakPolarHBondContact O-CB 3.43Å; L243-A247 PolarHBondContact O-N 3.15Å; L243-L324 HydrophobicContact CD2-CB 3.5Å; L243-L324 VanDerWaalsContact CD2-CB 3.5Å; L243-L324 HydrophobicContact CD2-CD1 4.4Å; L243-E325 HydrophobicContact CD1-CB 3.94Å; L243-E325 HydrophobicContact CD2-CB 4.47Å
244Q94.3Very high94.7Very high80 Ų8062.8 Ų62.837%0.37430%0.3SS..Hα-helixtrans-60.4-46.7174.7-178.1178.320.600112E240 I246 A247 F248 I312E240-Q244 PolarHBondContact O-N 3.48Å; Q244-I246 PolarHBondContact O-N 3.23Å; Q244-A247 PolarHBondContact O-N 3.04Å; Q244-F248 WeakPolarHBondContact O-CB 3.5Å; Q244-F248 PolarHBondContact O-N 3.15Å; Q244-I312 HydrophobicContact CG-CD1 4.35Å; Q244-I312 HydrophobicContact CG-CG1 4.11Å
245Q94.8Very high94.6Very high78 Ų7859.4 Ų59.436%0.36429%0.288SS..Hα-helixtrans-61.2-43.2178.717871.1-2000112.3L241 L242 K249 V341L241-Q245 WeakPolarHBondContact O-CB 3.48Å; L241-Q245 PolarHBondContact O-N 3.16Å; L242-Q245 PolarHBondContact O-N 3.37Å; Q245-K249 WeakPolarHBondContact O-CB 3.37Å; Q245-K249 WeakPolarHBondContact O-CG 3.38Å; Q245-K249 PolarHBondContact O-N 2.97Å; Q245-K249 VanDerWaalsContact O-N 3.15Å; Q245-V341 HydrophobicContact CG-CG2 4.47Å
246I94.8Very high94.6Very high0 Ų061.8 Ų61.80%030%0.297CS..Hα-helixtrans-63.2-52.2175.7-70.5163.1000109.6L242 L243 Q244 F248 K249 N250 F322 L324 A337 L340 V341 I349L242-I246 WeakPolarHBondContact O-CB 3.44Å; L242-I246 WeakPolarHBondContact O-CD1 3.13Å; L242-I246 VanDerWaalsContact O-CG1 3.24Å; L242-I246 WeakPolarHBondContact O-CG1 3.38Å; L242-I246 PolarHBondContact O-N 3.49Å; L243-I246 PolarHBondContact O-N 3.03Å; Q244-I246 PolarHBondContact O-N 3.23Å; I246-F248 PolarHBondContact O-N 2.63Å; I246-K249 PolarHBondContact O-N 3.26Å; I246-N250 WeakPolarHBondContact O-CB 3.42Å; I246-N250 PolarHBondContact O-N 3.08Å; I246-F322 HydrophobicContact CG2-CD2 3.69Å; I246-F322 HydrophobicContact CG2-CE2 3.91Å; I246-L324 HydrophobicContact CD1-CD1 3.79Å; I246-A337 HydrophobicContact CD1-CB 4.21Å; I246-A337 HydrophobicContact CG2-CB 4.32Å; I246-L340 HydrophobicContact CG2-CD1 4.25Å; I246-V341 HydrophobicContact CD1-CG2 4.04Å; I246-V341 HydrophobicContact CG1-CG2 3.56Å; I246-I349 HydrophobicContact CD1-CD1 4.11Å; I246-I349 HydrophobicContact CD1-CG1 4.31Å
247A95.6Very high94.6Very high1 Ų163.4 Ų63.41%0.00830%0.296CS..Hα-helixtrans-61.1-44-17700000112.8L243 Q244 L251 L315 M320L243-A247 VanDerWaalsContact O-CB 3.24Å; L243-A247 WeakPolarHBondContact O-CB 3.43Å; L243-A247 PolarHBondContact O-N 3.15Å; Q244-A247 PolarHBondContact O-N 3.04Å; A247-L251 WeakPolarHBondContact O-CB 3.49Å; A247-L251 PolarHBondContact O-N 3.48Å; A247-L315 HydrophobicContact CB-CB 4.22Å; A247-L315 HydrophobicContact CB-CD2 4.22Å; A247-M320 WeakPolarHBondContact CA-O 3.39Å; A247-M320 HydrophobicContact CB-CB 3.89Å
248F96.2Very high94.5Very high102 Ų10261 Ų6145%0.44729%0.287SS..Hα-helixtrans-65.2-47.9178.4-173.8-97.4000111.9Q244 I246 N250 L251 V252 L274Q244-F248 WeakPolarHBondContact O-CB 3.5Å; Q244-F248 PolarHBondContact O-N 3.15Å; I246-F248 PolarHBondContact O-N 2.63Å; F248-N250 PolarHBondContact O-N 3.04Å; F248-L251 PolarHBondContact O-N 3.03Å; F248-V252 HydrophobicContact CD1-CG2 4.3Å; F248-V252 HydrophobicContact CE1-CG2 3.95Å; F248-V252 HydrophobicContact CZ-CG2 4.14Å; F248-V252 WeakPolarHBondContact O-CG2 3.48Å; F248-V252 PolarHBondContact O-N 2.81Å; F248-L274 HydrophobicContact CD2-CD2 4.25Å; F248-L274 HydrophobicContact CE2-CD2 4.38Å
249K95.5Very high94.4Very high80 Ų8062.6 Ų62.635%0.34829%0.293SS..Hα-helixtrans-64.5-40177.9-77.3-176.1168.8-170.70112.8Q245 I246 V252 Q253 L340Q245-K249 WeakPolarHBondContact O-CB 3.37Å; Q245-K249 WeakPolarHBondContact O-CG 3.38Å; Q245-K249 PolarHBondContact O-N 2.97Å; Q245-K249 VanDerWaalsContact O-N 3.15Å; I246-K249 PolarHBondContact O-N 3.26Å; K249-V252 PolarHBondContact O-N 3.19Å; K249-Q253 WeakPolarHBondContact O-CB 3.49Å; K249-Q253 PolarHBondContact O-N 3.5Å; K249-L340 HydrophobicContact CB-CB 4.45Å; K249-L340 HydrophobicContact CB-CD1 4.38Å; K249-L340 HydrophobicContact CB-CD2 4.13Å; K249-L340 HydrophobicContact CD-CB 4.19Å; K249-L340 WeakPolarHBondContact CD-O 3.26Å; K249-L340 WeakPolarHBondContact CE-O 3.21Å; K249-L340 PolarHBondContact NZ-O 2.92Å
250N95.7Very high94.4Very high22 Ų2266 Ų6612%0.11831%0.308CS..Hα-helixtrans-62.9-45.7177-170.114.7000110.9I246 F248 V252 Q253 R254 M320 F322 L340I246-N250 WeakPolarHBondContact O-CB 3.42Å; I246-N250 PolarHBondContact O-N 3.08Å; F248-N250 PolarHBondContact O-N 3.04Å; N250-V252 PolarHBondContact O-N 3.32Å; N250-Q253 PolarHBondContact O-N 3.32Å; N250-R254 WeakPolarHBondContact O-CB 3.39Å; N250-R254 PolarHBondContact O-N 3.34Å; N250-M320 WeakPolarHBondContact CB-O 3.19Å; N250-M320 PolarHBondContact ND2-O 2.85Å; N250-F322 HydrophobicContact CB-CE2 4.3Å; N250-F322 HydrophobicContact CB-CZ 4.37Å; N250-F322 VanDerWaalsContact CG-CZ 3.49Å; N250-F322 WeakPolarHBondContact ND2-CE1 3.39Å; N250-F322 WeakPolarHBondContact ND2-CE2 3.41Å; N250-F322 WeakPolarHBondContact ND2-CZ 3.34Å; N250-L340 HydrophobicContact CB-CD1 4.01Å
251L96.1Very high94.4Very high16 Ų1669.2 Ų69.28%0.08432%0.324CS..Hα-helixtrans-57.4-48.1174.2178.762.5000111.9A247 F248 Q253 R254 N255 L274 L315 M320A247-L251 WeakPolarHBondContact O-CB 3.49Å; A247-L251 PolarHBondContact O-N 3.48Å; F248-L251 PolarHBondContact O-N 3.03Å; L251-Q253 PolarHBondContact O-N 2.9Å; L251-R254 VanDerWaalsContact CD1-NH2 3.3Å; L251-R254 PolarHBondContact O-N 2.96Å; L251-N255 VanDerWaalsContact O-CB 3.3Å; L251-N255 WeakPolarHBondContact O-CB 3.45Å; L251-N255 PolarHBondContact O-N 3.03Å; L251-N255 PolarHBondContact O-OD1 3.32Å; L251-L274 HydrophobicContact CD2-CD1 4.11Å; L251-L315 HydrophobicContact CD2-CD1 3.97Å; L251-L315 HydrophobicContact CD2-CD2 3.89Å; L251-L315 HydrophobicContact CD2-CG 4.02Å; L251-M320 HydrophobicContact CB-CG 4.38Å; L251-M320 HydrophobicContact CB-SD 4.11Å; L251-M320 HydrophobicContact CD1-SD 4.11Å
252V95.1Very high94Very high57 Ų5770 Ų7035%0.34533%0.328SS..Hα-helixtrans-62.4-42177.9170.70000111.6F248 K249 N250 R256F248-V252 HydrophobicContact CD1-CG2 4.3Å; F248-V252 HydrophobicContact CE1-CG2 3.95Å; F248-V252 HydrophobicContact CZ-CG2 4.14Å; F248-V252 WeakPolarHBondContact O-CG2 3.48Å; F248-V252 PolarHBondContact O-N 2.81Å; K249-V252 PolarHBondContact O-N 3.19Å; N250-V252 PolarHBondContact O-N 3.32Å; V252-R256 VanDerWaalsContact O-CB 3.29Å; V252-R256 WeakPolarHBondContact O-CB 3.2Å; V252-R256 PolarHBondContact O-N 2.96Å
253Q94.4Very high93.5Very high84 Ų8478.6 Ų78.639%0.39337%0.368SS..Hα-helixtrans-65.1-47.2178.1179.4172.1-19.400111.9K249 N250 L251 R256 Q257K249-Q253 WeakPolarHBondContact O-CB 3.49Å; K249-Q253 PolarHBondContact O-N 3.5Å; N250-Q253 PolarHBondContact O-N 3.32Å; L251-Q253 PolarHBondContact O-N 2.9Å; Q253-R256 PolarHBondContact O-N 3.47Å; Q253-Q257 WeakPolarHBondContact O-CG 3.31Å; Q253-Q257 PolarHBondContact O-N 3.41Å
254R94.8Very high93.1Very high78 Ų7879.4 Ų79.429%0.29438%0.379SS..Hα-helixtrans-62.3-45.2177.4-172.8-168.269.7166.11.3111.7N250 L251 Q257 N258N250-R254 WeakPolarHBondContact O-CB 3.39Å; N250-R254 PolarHBondContact O-N 3.34Å; L251-R254 VanDerWaalsContact CD1-NH2 3.3Å; L251-R254 PolarHBondContact O-N 2.96Å; R254-Q257 PolarHBondContact O-N 3.4Å; R254-N258 PolarHBondContact O-N 3.17Å
255N94.5Very high92.8Very high62 Ų6280.7 Ų80.733%0.33240%0.395SS..Hα-helixtrans-64.3-43.6179-68.92.9000110.8L251 Q257 N258 E259L251-N255 VanDerWaalsContact O-CB 3.3Å; L251-N255 WeakPolarHBondContact O-CB 3.45Å; L251-N255 PolarHBondContact O-N 3.03Å; L251-N255 PolarHBondContact O-OD1 3.32Å; N255-Q257 VanDerWaalsContact C-N 3.32Å; N255-Q257 PolarHBondContact O-N 2.78Å; N255-N258 PolarHBondContact O-N 3.23Å; N255-N258 VanDerWaalsContact O-N 3.11Å; N255-E259 WeakPolarHBondContact O-CG 3.12Å; N255-E259 PolarHBondContact O-N 3.42Å
256R93.9Very high92.5Very high148 Ų14880.3 Ų80.356%0.55840%0.399SS*.Hα-helixtrans-58.2-40.7174.1-178.5-177.6-65167.40.5112.7V252 Q253 Q260V252-R256 VanDerWaalsContact O-CB 3.29Å; V252-R256 WeakPolarHBondContact O-CB 3.2Å; V252-R256 PolarHBondContact O-N 2.96Å; Q253-R256 PolarHBondContact O-N 3.47Å; R256-Q260 VanDerWaalsContact O-CG 3.26Å; R256-Q260 WeakPolarHBondContact O-CG 3.32Å; R256-Q260 PolarHBondContact O-N 2.85Å; R256-Q260 VanDerWaalsContact O-N 3.13Å
257Q93.1Very high92.2Very high88 Ų8882.9 Ų82.941%0.41142%0.42SS..Hα-helixtrans-65.3-41.6175.2-72.7172.6-13.300111.6Q253 R254 N255 Q260 Q261Q253-Q257 WeakPolarHBondContact O-CG 3.31Å; Q253-Q257 PolarHBondContact O-N 3.41Å; R254-Q257 PolarHBondContact O-N 3.4Å; N255-Q257 VanDerWaalsContact C-N 3.32Å; N255-Q257 PolarHBondContact O-N 2.78Å; Q257-Q260 PolarHBondContact O-N 2.72Å; Q257-Q261 WeakPolarHBondContact O-CG 2.77Å; Q257-Q261 PolarHBondContact O-N 2.8Å
258N92.7Very high91.9Very high70 Ų7089.2 Ų89.237%0.37446%0.458SS..Hα-helixtrans-65.7-38.5176.7-72.8-1.9000112.5R254 N255 Q260 Q261 N262R254-N258 PolarHBondContact O-N 3.17Å; N255-N258 PolarHBondContact O-N 3.23Å; N255-N258 VanDerWaalsContact O-N 3.11Å; N258-Q260 VanDerWaalsContact C-N 3.35Å; N258-Q261 PolarHBondContact O-N 2.8Å; N258-N262 WeakPolarHBondContact O-CB 3.43Å; N258-N262 PolarHBondContact O-N 3.04Å; N258-N262 PolarHBondContact O-ND2 3.08Å
259E93.3Very high91.7Very high84 Ų8491.4 Ų91.439%0.39348%0.475SS..Hα-helixtrans-64.6-39175.2-70.6173.2178.800111.8N255 Q263 G264N255-E259 WeakPolarHBondContact O-CG 3.12Å; N255-E259 PolarHBondContact O-N 3.42Å; E259-Q263 PolarHBondContact O-N 3.25Å; E259-G264 WeakPolarHBondContact CA-O 3.23Å; E259-G264 PolarHBondContact O-N 3.5Å
260Q92.3Very high91.5Very high138 Ų13891.6 Ų91.665%0.64549%0.486SS*.Hα-helixtrans-65.7-41.1175-72.1169.93.700112.2R256 Q257 N258R256-Q260 VanDerWaalsContact O-CG 3.26Å; R256-Q260 WeakPolarHBondContact O-CG 3.32Å; R256-Q260 PolarHBondContact O-N 2.85Å; R256-Q260 VanDerWaalsContact O-N 3.13Å; Q257-Q260 PolarHBondContact O-N 2.72Å; N258-Q260 VanDerWaalsContact C-N 3.35Å
261Q92.3Very high91.4Very high143 Ų14393 Ų9367%0.66850%0.496SS*.Hα-helixtrans-70.8-40.6178-71.1176.73100112.6Q257 N258 Q263Q257-Q261 WeakPolarHBondContact O-CG 2.77Å; Q257-Q261 PolarHBondContact O-N 2.8Å; N258-Q261 PolarHBondContact O-N 2.8Å; Q261-Q263 VanDerWaalsContact C-N 3.31Å; Q261-Q263 PolarHBondContact O-N 3.43Å
262N88.3Confident91.3Very high122 Ų12297.7 Ų97.765%0.65252%0.52SS*.THydrogen-bonded Turntrans-89.89-178-62.8-65.3000113.7N258 G264N258-N262 WeakPolarHBondContact O-CB 3.43Å; N258-N262 PolarHBondContact O-N 3.04Å; N258-N262 PolarHBondContact O-ND2 3.08Å; N262-G264 VanDerWaalsContact C-N 3.28Å; N262-G264 PolarHBondContact O-N 3.44Å
263Q83Confident91.3Very high186 Ų186102.1 Ų102.187%0.86954%0.537SS*.THydrogen-bonded Turntrans56.433.2176.7-55.6-175.113.600115E259 Q261E259-Q263 PolarHBondContact O-N 3.25Å; Q261-Q263 VanDerWaalsContact C-N 3.31Å; Q261-Q263 PolarHBondContact O-N 3.43Å
264G85.4Confident91.3Very high28 Ų28100.9 Ų100.929%0.28953%0.532SS..SBendtrans161.7172175.400000114.6E259 N262E259-G264 WeakPolarHBondContact CA-O 3.23Å; E259-G264 PolarHBondContact O-N 3.5Å; N262-G264 VanDerWaalsContact C-N 3.28Å; N262-G264 PolarHBondContact O-N 3.44Å
265P87.3Confident91.3Very high108 Ų108102.9 Ų102.970%0.70156%0.556SS**PPolyproline II helixtrans-67.3146.8172.129.6-34.4000111
266P89.3Confident91.4Very high69 Ų69101.8 Ų101.845%0.44855%0.548SS..PPolyproline II helixtrans-63.7161.8172.829.4-37.9000112.3T271P266-T271 HydrophobicContact CB-CG2 3.88Å; P266-T271 HydrophobicContact CG-CG2 3.36Å
267A88.5Confident91.5Very high54 Ų5499 Ų9945%0.44654%0.543SS..PPolyproline II helixtrans-62.2142.8178.200000112.1N269 S270A267-N269 WeakPolarHBondContact CB-OD1 3.5Å; A267-N269 PolarHBondContact O-N 2.89Å; A267-N269 VanDerWaalsContact O-N 3.12Å; A267-S270 PolarHBondContact O-N 2.84Å; A267-S270 PolarHBondContact O-OG 2.83Å
268V87.8Confident91.7Very high134 Ų13497.6 Ų97.681%0.81254%0.538SS*.G310 helixtrans-59.7-29.2-174.7-64.10000113.6
269N91.5Very high91.8Very high148 Ų14896.8 Ų96.879%0.79153%0.533SS*.G310 helixtrans-84.9-6.9177.966.2-38.9000114.2A267A267-N269 WeakPolarHBondContact CB-OD1 3.5Å; A267-N269 PolarHBondContact O-N 2.89Å; A267-N269 VanDerWaalsContact O-N 3.12Å
270S92.3Very high91.9Very high84 Ų8495.4 Ų95.459%0.58753%0.529SS*.G310 helixtrans-103.68.4175.766.80000113.5A267A267-S270 PolarHBondContact O-N 2.84Å; A267-S270 PolarHBondContact O-OG 2.83Å
271T92.8Very high92.1Very high53 Ų5390.9 Ų90.933%0.32551%0.51SS..  trans-127.7152.317958.10000112.9P266P266-T271 HydrophobicContact CB-CG2 3.88Å; P266-T271 HydrophobicContact CG-CG2 3.36Å
272I95.1Very high92.3Very high113 Ų11387 Ų8758%0.57950%0.499SS*.  trans-123.4124.8170.8-56.5176.2000105.9F276I272-F276 HydrophobicContact CG2-CB 4Å; I272-F276 HydrophobicContact CG2-CD1 3.59Å; I272-F276 HydrophobicContact CG2-CD2 4.45Å; I272-F276 HydrophobicContact CG2-CE1 4.16Å; I272-F276 HydrophobicContact CG2-CG 3.76Å
273Q93.9Very high92.7Very high150 Ų15093.6 Ų93.670%0.70152%0.515SS*.PPolyproline II helixtrans-89146.8178.7-62.8-66-2100109.9
274L94.4Very high93.3Very high58 Ų5893.6 Ų93.630%0.30451%0.512SS..SBendtrans-77.7148.4172.2-74.475.5000110.1F248 L251 F276 D311 L315F248-L274 HydrophobicContact CD2-CD2 4.25Å; F248-L274 HydrophobicContact CE2-CD2 4.38Å; L251-L274 HydrophobicContact CD2-CD1 4.11Å; L274-F276 HydrophobicContact CD1-CD1 4.34Å; L274-F276 HydrophobicContact CD1-CE1 3.82Å; L274-F276 HydrophobicContact CG-CD1 4.15Å; L274-F276 HydrophobicContact CG-CE1 3.92Å; L274-D311 HydrophobicContact CD2-CB 4.19Å; L274-D311 WeakPolarHBondContact CD2-OD2 3.24Å; L274-D311 HydrophobicContact CG-CB 4.13Å; L274-D311 WeakPolarHBondContact CG-OD2 3.24Å; L274-L315 HydrophobicContact CD2-CD1 4.27Å; L274-L315 HydrophobicContact CD2-CD2 4.2Å
275P96.2Very high93.8Very high120 Ų12093 Ų9378%0.77950%0.503SS*.SBendcis-83.9148.6-1.134.1-34.6000113.3D311P275-D311 VanDerWaalsContact CA-OD2 3.25Å; P275-D311 WeakPolarHBondContact CA-OD2 3.25Å
276F95.9Very high94.2Very high39 Ų3992.6 Ų92.617%0.17150%0.498CS..  trans-147.2161.1174.965.3-98.6000111.8I272 L274 I278 D311 V314I272-F276 HydrophobicContact CG2-CB 4Å; I272-F276 HydrophobicContact CG2-CD1 3.59Å; I272-F276 HydrophobicContact CG2-CD2 4.45Å; I272-F276 HydrophobicContact CG2-CE1 4.16Å; I272-F276 HydrophobicContact CG2-CG 3.76Å; L274-F276 HydrophobicContact CD1-CD1 4.34Å; L274-F276 HydrophobicContact CD1-CE1 3.82Å; L274-F276 HydrophobicContact CG-CD1 4.15Å; L274-F276 HydrophobicContact CG-CE1 3.92Å; F276-I278 HydrophobicContact CD2-CD1 3.83Å; F276-I278 HydrophobicContact CD2-CG1 3.79Å; F276-I278 HydrophobicContact CE2-CD1 3.93Å; F276-I278 HydrophobicContact CE2-CG1 3.63Å; F276-D311 HydrophobicContact CD1-CB 4.06Å; F276-D311 HydrophobicContact CD2-CB 4.18Å; F276-D311 HydrophobicContact CE1-CB 3.91Å; F276-D311 HydrophobicContact CE2-CB 4.02Å; F276-D311 HydrophobicContact CG-CB 4.2Å; F276-D311 HydrophobicContact CZ-CB 3.88Å; F276-D311 WeakPolarHBondContact O-CB 3.48Å; F276-D311 PolarHBondContact O-N 2.94Å; F276-V314 HydrophobicContact CE2-CB 4.32Å; F276-V314 HydrophobicContact CE2-CG1 4.38Å; F276-V314 HydrophobicContact CE2-CG2 4.23Å; F276-V314 HydrophobicContact CZ-CB 4.44Å; F276-V314 HydrophobicContact CZ-CG1 4.3Å
277I96.6Very high94.5Very high89 Ų8993.4 Ų93.446%0.45650%0.497SS..EExtended strand (participates in β ladder)trans-118.5146.7166.260.4172.4000109.4I64I64-I277 HydrophobicContact CD1-CD1 4.2Å
278I96.2Very high94.8Very high59 Ų5994.9 Ų94.930%0.30350%0.498SS..EExtended strand (participates in β ladder)trans-112.3127175-61.9-61.1000109.2F276 I308 H309 V314F276-I278 HydrophobicContact CD2-CD1 3.83Å; F276-I278 HydrophobicContact CD2-CG1 3.79Å; F276-I278 HydrophobicContact CE2-CD1 3.93Å; F276-I278 HydrophobicContact CE2-CG1 3.63Å; I278-I308 CarbonylContact O-C 3.54Å; I278-I308 WeakPolarHBondContact O-CA 3.35Å; I278-H309 PolarHBondContact N-O 3.02Å; I278-H309 PolarHBondContact O-N 3.31Å; I278-V314 HydrophobicContact CB-CG2 4.41Å; I278-V314 HydrophobicContact CG1-CG2 4Å
279I96.1Very high95.2Very high53 Ų5391.1 Ų91.127%0.27248%0.477SS..EExtended strand (participates in β ladder)trans-102.4118.9168.5-55.3162.5000106.8M62 I64 F302 F306 E307 I308M62-I279 HydrophobicContact CE-CD1 3.54Å; M62-I279 HydrophobicContact SD-CD1 4.17Å; I64-I279 HydrophobicContact CD1-CD1 4.37Å; I279-F302 HydrophobicContact CG2-CE1 4.31Å; I279-F302 HydrophobicContact CG2-CZ 3.91Å; I279-F306 HydrophobicContact CG2-CB 4.1Å; I279-F306 HydrophobicContact CG2-CD2 3.9Å; I279-F306 HydrophobicContact CG2-CG 4.22Å; I279-E307 WeakPolarHBondContact CA-O 3.29Å; I279-I308 HydrophobicContact CG1-CG1 4.37Å
280N95.7Very high95.4Very high56 Ų5687.1 Ų87.130%0.29946%0.46SS..EExtended strand (participates in β ladder)trans-109.1143.4174.869-34.2000110.8F306 E307 H309N280-F306 CarbonylContact O-C 3.03Å; N280-F306 WeakPolarHBondContact O-CA 3.49Å; N280-F306 WeakPolarHBondContact O-CB 3.36Å; N280-E307 PolarHBondContact N-O 3.28Å; N280-E307 PolarHBondContact ND2-OE2 3.05Å; N280-E307 PolarHBondContact O-N 2.93Å; N280-E307 VanDerWaalsContact OD1-C 3.31Å; N280-E307 WeakPolarHBondContact OD1-CA 3.28Å; N280-E307 WeakPolarHBondContact OD1-CB 3.37Å; N280-E307 VanDerWaalsContact OD1-CG 3.31Å; N280-E307 WeakPolarHBondContact OD1-CG 3.38Å; N280-E307 PolarHBondContact OD1-N 3.32Å; N280-E307 PolarHBondContact OD1-O 3.39Å; N280-E307 PolarHBondContact OD1-OE2 2.94Å; N280-H309 VanDerWaalsContact CG-NE2 3.26Å; N280-H309 PolarHBondContact ND2-NE2 2.78Å; N280-H309 PolarHBondContact OD1-CD2 3.06Å; N280-H309 PolarHBondContact OD1-NE2 3.04Å
281T96.4Very high95.6Very high43 Ų4387.5 Ų87.526%0.26446%0.455SS..EExtended strand (participates in β ladder)trans-149.3174.3171.6-172.30000109.3T285 I287 F302 T305T281-T285 HydrophobicContact CG2-CG2 3.95Å; T281-T285 WeakPolarHBondContact OG1-CB 3.47Å; T281-T285 WeakPolarHBondContact OG1-CG2 3.36Å; T281-T285 PolarHBondContact OG1-OG1 3.17Å; T281-I287 HydrophobicContact CG2-CD1 3.91Å; T281-I287 HydrophobicContact CG2-CG1 4.45Å; T281-F302 HydrophobicContact CG2-CD1 4.31Å; T281-F302 HydrophobicContact CG2-CE1 4.35Å; T281-T305 PolarHBondContact OG1-O 3.43Å
282S96.7Very high95.8Very high61 Ų6186.5 Ų86.543%0.42745%0.45SS..  trans-61.5145.1176.3-178.50000111.4K284 T285S282-K284 PolarHBondContact O-N 3.15Å; S282-K284 PolarHBondContact OG-N 3.42Å; S282-T285 WeakPolarHBondContact CB-OG1 3.32Å; S282-T285 PolarHBondContact N-OG1 2.93Å; S282-T285 WeakPolarHBondContact O-CB 3.44Å; S282-T285 PolarHBondContact O-N 3.1Å; S282-T285 PolarHBondContact O-OG1 3.46Å; S282-T285 VanDerWaalsContact O-OG1 3.11Å
283R95.3Very high95.8Very high260 Ų26087.3 Ų87.398%0.98147%0.466SS*.THydrogen-bonded Turntrans-63.2-7.1172.8-61.6-173.5-178.5-147.80.8113.9
284K96.3Very high95.9Very high187 Ų18784.7 Ų84.781%0.81346%0.457SS*.THydrogen-bonded Turntrans-100-10.7176.5-60.1-176.9-179.4-179.10113.2S282S282-K284 PolarHBondContact O-N 3.15Å; S282-K284 PolarHBondContact OG-N 3.42Å
285T96.1Very high96Very high16 Ų1688.5 Ų88.510%0.09847%0.471CS..  trans-67.2129.2-179.2-54.70000109.5T281 S282 I287 F302 D303 N304T281-T285 HydrophobicContact CG2-CG2 3.95Å; T281-T285 WeakPolarHBondContact OG1-CB 3.47Å; T281-T285 WeakPolarHBondContact OG1-CG2 3.36Å; T281-T285 PolarHBondContact OG1-OG1 3.17Å; S282-T285 WeakPolarHBondContact CB-OG1 3.32Å; S282-T285 PolarHBondContact N-OG1 2.93Å; S282-T285 WeakPolarHBondContact O-CB 3.44Å; S282-T285 PolarHBondContact O-N 3.1Å; S282-T285 PolarHBondContact O-OG1 3.46Å; S282-T285 VanDerWaalsContact O-OG1 3.11Å; T285-I287 HydrophobicContact CG2-CG1 4.27Å; T285-F302 HydrophobicContact CG2-CB 4.2Å; T285-F302 HydrophobicContact CG2-CD1 4.14Å; T285-D303 WeakPolarHBondContact CA-OD1 3.41Å; T285-D303 WeakPolarHBondContact CG2-OD1 3.38Å; T285-N304 HydrophobicContact CG2-CB 3.96Å
286V95.4Very high95.9Very high98 Ų9886.5 Ų86.559%0.59445%0.45SS*.  trans-81.6127.1168-177.80000108.3D303V286-D303 HydrophobicContact CB-CB 4.41Å; V286-D303 WeakPolarHBondContact CB-OD2 3.45Å; V286-D303 WeakPolarHBondContact CG2-OD2 3.22Å; V286-D303 PolarHBondContact N-OD1 3.49Å; V286-D303 PolarHBondContact N-OD2 3.46Å; V286-D303 PolarHBondContact O-N 3.44Å
287I95.8Very high95.9Very high86 Ų8689.7 Ų89.744%0.44147%0.465SS..EExtended strand (participates in β ladder)trans-116.7118.2179.8-48.6175.2000107.6T281 T285 F300 N301 F302T281-I287 HydrophobicContact CG2-CD1 3.91Å; T281-I287 HydrophobicContact CG2-CG1 4.45Å; T285-I287 HydrophobicContact CG2-CG1 4.27Å; I287-F300 HydrophobicContact CG2-CD1 4.17Å; I287-N301 WeakPolarHBondContact CA-O 3.47Å; I287-F302 HydrophobicContact CD1-CD1 4.25Å; I287-F302 HydrophobicContact CD1-CE1 3.92Å; I287-F302 HydrophobicContact CG1-CD1 3.85Å; I287-F302 HydrophobicContact CG1-CE1 3.97Å; I287-F302 HydrophobicContact CG2-CD1 4.16Å; I287-F302 HydrophobicContact CG2-CE1 3.9Å; I287-F302 HydrophobicContact CG2-CZ 4.39Å
288D95.5Very high95.8Very high86 Ų8688.8 Ų88.846%0.4646%0.457SS..EExtended strand (participates in β ladder)trans-101.3135.5167.1165.550.7000109F300 N301D288-F300 WeakPolarHBondContact O-CA 3.39Å; D288-N301 HydrophobicContact CB-CB 4.13Å; D288-N301 PolarHBondContact N-O 3.01Å; D288-N301 PolarHBondContact O-N 3.21Å; D288-N301 PolarHBondContact OD2-ND2 2.93Å
289C94.9Very high95.8Very high54 Ų5488.3 Ų88.337%0.36545%0.454SS..EExtended strand (participates in β ladder)trans-135.4113.1-171-179.30000110.1L299 F300C289-L299 WeakPolarHBondContact CA-O 3.26Å; C289-F300 HydrophobicContact CB-CD1 4.02Å; C289-F300 HydrophobicContact CB-CE1 4.12Å; C289-F300 WeakPolarHBondContact SG-CE1 3.33Å
290S95.4Very high95.8Very high64 Ų6487.9 Ų87.945%0.44845%0.451SS..EExtended strand (participates in β ladder)trans-103.9125.1173.1-70.40000109.4L299S290-L299 PolarHBondContact N-O 3Å; S290-L299 PolarHBondContact O-N 2.83Å
291I96.9Very high95.8Very high92 Ų9287 Ų8747%0.47245%0.446SS..EExtended strand (participates in β ladder)trans-118.4132.1-176.2-47.5174.2000108.3K295 Y298I291-K295 HydrophobicContact CG2-CG 4.23Å; I291-Y298 HydrophobicContact CB-CD1 4.3Å; I291-Y298 HydrophobicContact CB-CE1 4.3Å; I291-Y298 HydrophobicContact CD1-CD1 4.14Å; I291-Y298 HydrophobicContact CD1-CE1 3.8Å; I291-Y298 HydrophobicContact CG1-CD1 3.74Å; I291-Y298 HydrophobicContact CG1-CE1 3.84Å; I291-Y298 HydrophobicContact CG2-CD1 3.84Å; I291-Y298 HydrophobicContact CG2-CE1 3.52Å; I291-Y298 HydrophobicContact CG2-CE2 4.33Å; I291-Y298 HydrophobicContact CG2-CG 4.37Å
292S96.5Very high95.8Very high33 Ų3385.5 Ų85.523%0.23144%0.436CS..  trans-63.5152.3172.666.20000111.5D294 K295 F296 E297S292-D294 WeakPolarHBondContact CB-OD1 3.28Å; S292-D294 PolarHBondContact O-N 3.3Å; S292-D294 PolarHBondContact OG-OD1 3.36Å; S292-K295 PolarHBondContact O-N 2.93Å; S292-K295 PolarHBondContact OG-N 2.86Å; S292-F296 PolarHBondContact OG-N 3.5Å; S292-E297 PolarHBondContact N-O 3.4Å; S292-E297 PolarHBondContact OG-N 2.85Å; S292-E297 PolarHBondContact OG-O 2.96Å
293S95.9Very high95.7Very high129 Ų12987.4 Ų87.490%0.90244%0.441SS*.THydrogen-bonded Turntrans-60.6-28.8-178.551.60000113.7
294D96.3Very high95.7Very high95 Ų9578.8 Ų78.851%0.50842%0.415SS..THydrogen-bonded Turntrans-90-5.2178.3633.9000113.4S292 F296S292-D294 WeakPolarHBondContact CB-OD1 3.28Å; S292-D294 PolarHBondContact O-N 3.3Å; S292-D294 PolarHBondContact OG-OD1 3.36Å; D294-F296 HydrophobicContact CB-CD2 3.8Å; D294-F296 HydrophobicContact CB-CE2 4.35Å; D294-F296 WeakPolarHBondContact O-CD2 3.46Å; D294-F296 PolarHBondContact O-N 2.84Å; D294-F296 PolarHBondContact OD1-N 3.44Å; D294-F296 VanDerWaalsContact OD1-N 3.11Å
295K95.6Very high95.7Very high138 Ų13875.1 Ų75.160%0.641%0.408SS*.SBendtrans58.222.6-177.1-53.8179.6-178.3178.50114.7I291 S292 Y298I291-K295 HydrophobicContact CG2-CG 4.23Å; S292-K295 PolarHBondContact O-N 2.93Å; S292-K295 PolarHBondContact OG-N 2.86Å; K295-Y298 HydrophobicContact CB-CE2 4.42Å; K295-Y298 VanDerWaalsContact O-CE2 3.28Å; K295-Y298 WeakPolarHBondContact O-CE2 3.19Å
296F95.1Very high95.8Very high79 Ų7976.9 Ų76.935%0.34642%0.415SS..SBendtrans-81.8-25.8171.1-76-78.4000112.6S65 T66 Q68 S292 D294S65-F296 CarbonylContact C-O 3.53Å; S65-F296 VanDerWaalsContact CA-O 3.3Å; S65-F296 WeakPolarHBondContact CA-O 3.35Å; T66-F296 PolarHBondContact N-O 3.4Å; T66-F296 WeakPolarHBondContact OG1-CD1 3.35Å; T66-F296 PolarHBondContact OG1-O 3.11Å; Q68-F296 HydrophobicContact CG-CE1 4.42Å; S292-F296 PolarHBondContact OG-N 3.5Å; D294-F296 HydrophobicContact CB-CD2 3.8Å; D294-F296 HydrophobicContact CB-CE2 4.35Å; D294-F296 WeakPolarHBondContact O-CD2 3.46Å; D294-F296 PolarHBondContact O-N 2.84Å; D294-F296 PolarHBondContact OD1-N 3.44Å; D294-F296 VanDerWaalsContact OD1-N 3.11Å
297E94.9Very high95.8Very high106 Ų10677.3 Ų77.350%0.49541%0.41SS..EExtended strand (participates in β ladder)trans-122.9134.2-179.3-55.6-161.4129.300112.7I64 S65 S292I64-E297 WeakPolarHBondContact O-CA 3.38Å; S65-E297 PolarHBondContact OG-OE1 2.73Å; S65-E297 VanDerWaalsContact OG-OE1 3.05Å; S292-E297 PolarHBondContact N-O 3.4Å; S292-E297 PolarHBondContact OG-N 2.85Å; S292-E297 PolarHBondContact OG-O 2.96Å
298Y95.1Very high95.8Very high69 Ų6977.3 Ų77.327%0.27141%0.41SS..EExtended strand (participates in β ladder)trans-127.2125.1174.3-66.9-106.7000109.4I63 I64 I291 K295 F300I63-Y298 CarbonylContact C-O 3.59Å; I63-Y298 WeakPolarHBondContact CA-O 3.43Å; I64-Y298 PolarHBondContact N-O 2.78Å; I64-Y298 PolarHBondContact O-N 2.85Å; I291-Y298 HydrophobicContact CB-CD1 4.3Å; I291-Y298 HydrophobicContact CB-CE1 4.3Å; I291-Y298 HydrophobicContact CD1-CD1 4.14Å; I291-Y298 HydrophobicContact CD1-CE1 3.8Å; I291-Y298 HydrophobicContact CG1-CD1 3.74Å; I291-Y298 HydrophobicContact CG1-CE1 3.84Å; I291-Y298 HydrophobicContact CG2-CD1 3.84Å; I291-Y298 HydrophobicContact CG2-CE1 3.52Å; I291-Y298 HydrophobicContact CG2-CE2 4.33Å; I291-Y298 HydrophobicContact CG2-CG 4.37Å; K295-Y298 HydrophobicContact CB-CE2 4.42Å; K295-Y298 VanDerWaalsContact O-CE2 3.28Å; K295-Y298 WeakPolarHBondContact O-CE2 3.19Å; Y298-F300 HydrophobicContact CD1-CE2 4.26Å; Y298-F300 HydrophobicContact CD1-CZ 4.14Å; Y298-F300 HydrophobicContact CG-CE2 4.26Å
299L96.2Very high95.9Very high49 Ų4973.8 Ų73.826%0.25739%0.391SS..EExtended strand (participates in β ladder)trans-107119170.2172.768.8000108.8Q61 M62 I63 C289 S290Q61-L299 HydrophobicContact CB-CD1 4.24Å; M62-L299 WeakPolarHBondContact O-CA 3.45Å; I63-L299 HydrophobicContact CG1-CD1 3.73Å; C289-L299 WeakPolarHBondContact CA-O 3.26Å; S290-L299 PolarHBondContact N-O 3Å; S290-L299 PolarHBondContact O-N 2.83Å
300F96.1Very high95.9Very high44 Ų4475.3 Ų75.319%0.19340%0.395CS..EExtended strand (participates in β ladder)trans-109.4126.7173.2-63.4-93.6000110.2M62 I64 I287 D288 C289 Y298 F302M62-F300 HydrophobicContact CE-CB 4.11Å; M62-F300 HydrophobicContact CE-CD2 3.39Å; M62-F300 HydrophobicContact CE-CE2 4.04Å; M62-F300 HydrophobicContact CE-CG 4.02Å; M62-F300 PolarHBondContact N-O 3.18Å; M62-F300 PolarHBondContact O-N 3.17Å; I64-F300 HydrophobicContact CD1-CE2 4.41Å; I287-F300 HydrophobicContact CG2-CD1 4.17Å; D288-F300 WeakPolarHBondContact O-CA 3.39Å; C289-F300 HydrophobicContact CB-CD1 4.02Å; C289-F300 HydrophobicContact CB-CE1 4.12Å; C289-F300 WeakPolarHBondContact SG-CE1 3.33Å; Y298-F300 HydrophobicContact CD1-CE2 4.26Å; Y298-F300 HydrophobicContact CD1-CZ 4.14Å; Y298-F300 HydrophobicContact CG-CE2 4.26Å; F300-F302 HydrophobicContact CB-CD2 4.21Å; F300-F302 HydrophobicContact CB-CE2 3.43Å; F300-F302 VanDerWaalsContact CB-CE2 3.43Å; F300-F302 HydrophobicContact CB-CZ 3.83Å; F300-F302 HydrophobicContact CD1-CZ 4.45Å; F300-F302 HydrophobicContact CG-CE2 4.36Å; F300-F302 HydrophobicContact CG-CZ 4.34Å
301N95.5Very high95.9Very high38 Ų3873 Ų7320%0.20338%0.378CS..EExtended strand (participates in β ladder)trans-106.6121.7171.2-63.4-48.4000108.3Q61 I287 D288Q61-N301 WeakPolarHBondContact CG-OD1 3.21Å; Q61-N301 PolarHBondContact NE2-OD1 2.81Å; I287-N301 WeakPolarHBondContact CA-O 3.47Å; D288-N301 HydrophobicContact CB-CB 4.13Å; D288-N301 PolarHBondContact N-O 3.01Å; D288-N301 PolarHBondContact O-N 3.21Å; D288-N301 PolarHBondContact OD2-ND2 2.93Å
302F96.3Very high95.7Very high12 Ų1270.1 Ų70.15%0.05336%0.363CS..EExtended strand (participates in β ladder)trans-111.8135.7175.9-58.3-96.4000109.8P60 I279 T281 T285 I287 F300 N304 F306P60-F302 HydrophobicContact CG-CB 4.5Å; I279-F302 HydrophobicContact CG2-CE1 4.31Å; I279-F302 HydrophobicContact CG2-CZ 3.91Å; T281-F302 HydrophobicContact CG2-CD1 4.31Å; T281-F302 HydrophobicContact CG2-CE1 4.35Å; T285-F302 HydrophobicContact CG2-CB 4.2Å; T285-F302 HydrophobicContact CG2-CD1 4.14Å; I287-F302 HydrophobicContact CD1-CD1 4.25Å; I287-F302 HydrophobicContact CD1-CE1 3.92Å; I287-F302 HydrophobicContact CG1-CD1 3.85Å; I287-F302 HydrophobicContact CG1-CE1 3.97Å; I287-F302 HydrophobicContact CG2-CD1 4.16Å; I287-F302 HydrophobicContact CG2-CE1 3.9Å; I287-F302 HydrophobicContact CG2-CZ 4.39Å; F300-F302 HydrophobicContact CB-CD2 4.21Å; F300-F302 HydrophobicContact CB-CE2 3.43Å; F300-F302 VanDerWaalsContact CB-CE2 3.43Å; F300-F302 HydrophobicContact CB-CZ 3.83Å; F300-F302 HydrophobicContact CD1-CZ 4.45Å; F300-F302 HydrophobicContact CG-CE2 4.36Å; F300-F302 HydrophobicContact CG-CZ 4.34Å; F302-N304 WeakPolarHBondContact CB-O 3.24Å; F302-N304 PolarHBondContact O-N 2.92Å; F302-F306 HydrophobicContact CB-CD1 4.01Å; F302-F306 HydrophobicContact CB-CE1 4.49Å; F302-F306 HydrophobicContact CD1-CB 4.38Å; F302-F306 HydrophobicContact CD1-CD1 4.12Å; F302-F306 AromaticContact CD2-CD1 3.34Å; F302-F306 HydrophobicContact CD2-CD1 3.34Å; F302-F306 AromaticContact CD2-CE1 3.39Å; F302-F306 HydrophobicContact CD2-CE1 3.39Å; F302-F306 HydrophobicContact CD2-CG 4.2Å; F302-F306 HydrophobicContact CD2-CZ 4.3Å; F302-F306 HydrophobicContact CE1-CB 4.4Å; F302-F306 HydrophobicContact CE1-CD1 4.45Å; F302-F306 AromaticContact CE2-CD1 3.72Å; F302-F306 HydrophobicContact CE2-CD1 3.72Å; F302-F306 AromaticContact CE2-CE1 3.74Å; F302-F306 HydrophobicContact CE2-CE1 3.74Å; F302-F306 HydrophobicContact CE2-CG 4.18Å; F302-F306 HydrophobicContact CE2-CZ 4.24Å; F302-F306 AromaticContact CG-CD1 3.57Å; F302-F306 HydrophobicContact CG-CD1 3.57Å; F302-F306 HydrophobicContact CG-CE1 4.07Å; F302-F306 HydrophobicContact CG-CG 4.37Å; F302-F306 HydrophobicContact CZ-CD1 4.27Å; F302-F306 HydrophobicContact CZ-CG 4.36Å
303D95.4Very high95.6Very high100 Ų10072.4 Ų72.454%0.53537%0.37SS..SBendtrans-78-4.1172.974-13.5000113.6T285 V286T285-D303 WeakPolarHBondContact CA-OD1 3.41Å; T285-D303 WeakPolarHBondContact CG2-OD1 3.38Å; V286-D303 HydrophobicContact CB-CB 4.41Å; V286-D303 WeakPolarHBondContact CB-OD2 3.45Å; V286-D303 WeakPolarHBondContact CG2-OD2 3.22Å; V286-D303 PolarHBondContact N-OD1 3.49Å; V286-D303 PolarHBondContact N-OD2 3.46Å; V286-D303 PolarHBondContact O-N 3.44Å
304N95.7Very high95.6Very high79 Ų7967.8 Ų67.842%0.42234%0.336SS..SBendtrans-150176.4-175.8-153.6-15.4000111.3T285 F302T285-N304 HydrophobicContact CG2-CB 3.96Å; F302-N304 WeakPolarHBondContact CB-O 3.24Å; F302-N304 PolarHBondContact O-N 2.92Å
305T96.3Very high95.5Very high111 Ų11163.6 Ų63.668%0.68131%0.314SS*.  trans-63.8148.6178.357.50000112.8T281T281-T305 PolarHBondContact OG1-O 3.43Å
306F96.5Very high95.4Very high53 Ų5358.9 Ų58.923%0.23229%0.293CS..EExtended strand (participates in β ladder)trans-136.2162.7170.762.8-93.8000109P60 M62 I279 N280 F302 I308P60-F306 HydrophobicContact CB-CE1 4.13Å; M62-F306 HydrophobicContact CB-CZ 4.23Å; M62-F306 HydrophobicContact SD-CE2 4.35Å; I279-F306 HydrophobicContact CG2-CB 4.1Å; I279-F306 HydrophobicContact CG2-CD2 3.9Å; I279-F306 HydrophobicContact CG2-CG 4.22Å; N280-F306 CarbonylContact O-C 3.03Å; N280-F306 WeakPolarHBondContact O-CA 3.49Å; N280-F306 WeakPolarHBondContact O-CB 3.36Å; F302-F306 HydrophobicContact CB-CD1 4.01Å; F302-F306 HydrophobicContact CB-CE1 4.49Å; F302-F306 HydrophobicContact CD1-CB 4.38Å; F302-F306 HydrophobicContact CD1-CD1 4.12Å; F302-F306 AromaticContact CD2-CD1 3.34Å; F302-F306 HydrophobicContact CD2-CD1 3.34Å; F302-F306 AromaticContact CD2-CE1 3.39Å; F302-F306 HydrophobicContact CD2-CE1 3.39Å; F302-F306 HydrophobicContact CD2-CG 4.2Å; F302-F306 HydrophobicContact CD2-CZ 4.3Å; F302-F306 HydrophobicContact CE1-CB 4.4Å; F302-F306 HydrophobicContact CE1-CD1 4.45Å; F302-F306 AromaticContact CE2-CD1 3.72Å; F302-F306 HydrophobicContact CE2-CD1 3.72Å; F302-F306 AromaticContact CE2-CE1 3.74Å; F302-F306 HydrophobicContact CE2-CE1 3.74Å; F302-F306 HydrophobicContact CE2-CG 4.18Å; F302-F306 HydrophobicContact CE2-CZ 4.24Å; F302-F306 AromaticContact CG-CD1 3.57Å; F302-F306 HydrophobicContact CG-CD1 3.57Å; F302-F306 HydrophobicContact CG-CE1 4.07Å; F302-F306 HydrophobicContact CG-CG 4.37Å; F302-F306 HydrophobicContact CZ-CD1 4.27Å; F302-F306 HydrophobicContact CZ-CG 4.36Å; F306-I308 HydrophobicContact CD2-CG1 4.11Å; F306-I308 HydrophobicContact CE2-CD1 4.08Å; F306-I308 HydrophobicContact CE2-CG1 4.01Å
307E96.3Very high95.3Very high106 Ų10662.1 Ų62.150%0.49530%0.303SS..EExtended strand (participates in β ladder)trans-123.8159.5170.6-15.4168.7127.100109I279 N280 H309I279-E307 WeakPolarHBondContact CA-O 3.29Å; N280-E307 PolarHBondContact N-O 3.28Å; N280-E307 PolarHBondContact ND2-OE2 3.05Å; N280-E307 PolarHBondContact O-N 2.93Å; N280-E307 VanDerWaalsContact OD1-C 3.31Å; N280-E307 WeakPolarHBondContact OD1-CA 3.28Å; N280-E307 WeakPolarHBondContact OD1-CB 3.37Å; N280-E307 VanDerWaalsContact OD1-CG 3.31Å; N280-E307 WeakPolarHBondContact OD1-CG 3.38Å; N280-E307 PolarHBondContact OD1-N 3.32Å; N280-E307 PolarHBondContact OD1-O 3.39Å; N280-E307 PolarHBondContact OD1-OE2 2.94Å; E307-H309 IonicContact OE2-CE1 3.82Å; E307-H309 PolarHBondContact OE2-CE1 3.42Å; E307-H309 IonicContact OE2-NE2 3.66Å; E307-H309 PolarHBondContact OE2-NE2 3.27Å
308I96.3Very high95.2Very high86 Ų8661.3 Ų61.344%0.44130%0.301SS..EExtended strand (participates in β ladder)trans-123.2128.3177.9-51.3-178.4000107.8M62 I278 I279 F306M62-I308 HydrophobicContact SD-CD1 3.89Å; I278-I308 CarbonylContact O-C 3.54Å; I278-I308 WeakPolarHBondContact O-CA 3.35Å; I279-I308 HydrophobicContact CG1-CG1 4.37Å; F306-I308 HydrophobicContact CD2-CG1 4.11Å; F306-I308 HydrophobicContact CE2-CD1 4.08Å; F306-I308 HydrophobicContact CE2-CG1 4.01Å
309H96.2Very high95Very high13 Ų1359.7 Ų59.76%0.0631%0.305CS..EExtended strand (participates in β ladder)trans-121.9131.5177.3-47.2-74.8000109.1I278 N280 E307 V314 R317I278-H309 PolarHBondContact N-O 3.02Å; I278-H309 PolarHBondContact O-N 3.31Å; N280-H309 VanDerWaalsContact CG-NE2 3.26Å; N280-H309 PolarHBondContact ND2-NE2 2.78Å; N280-H309 PolarHBondContact OD1-CD2 3.06Å; N280-H309 PolarHBondContact OD1-NE2 3.04Å; E307-H309 IonicContact OE2-CE1 3.82Å; E307-H309 PolarHBondContact OE2-CE1 3.42Å; E307-H309 IonicContact OE2-NE2 3.66Å; E307-H309 PolarHBondContact OE2-NE2 3.27Å; H309-V314 HydrophobicContact CB-CG2 4.05Å; H309-R317 PolarHBondContact CE1-NH1 3.44Å; H309-R317 PolarHBondContact CE1-NH2 3.47Å; H309-R317 VanDerWaalsContact ND1-CZ 3.29Å; H309-R317 PolarHBondContact ND1-NH1 3Å; H309-R317 VanDerWaalsContact ND1-NH1 3.18Å; H309-R317 PolarHBondContact ND1-NH2 3.03Å
310D95.9Very high94.9Very high85 Ų8558 Ų5846%0.45530%0.296SS..EExtended strand (participates in β ladder)trans-78.6161.6174-157.98000110.9I312 E313 V314D310-I312 VanDerWaalsContact C-N 3.29Å; D310-I312 PolarHBondContact O-N 3.2Å; D310-E313 PolarHBondContact O-N 2.97Å; D310-V314 PolarHBondContact O-N 3.39Å; D310-V314 VanDerWaalsContact O-N 3.08Å
311D95.2Very high94.6Very high15 Ų1555.9 Ų55.98%0.0829%0.287CS..Hα-helixtrans-57-40.9-176.561.511000112.8L274 P275 F276 E313 V314 L315L274-D311 HydrophobicContact CD2-CB 4.19Å; L274-D311 WeakPolarHBondContact CD2-OD2 3.24Å; L274-D311 HydrophobicContact CG-CB 4.13Å; L274-D311 WeakPolarHBondContact CG-OD2 3.24Å; P275-D311 VanDerWaalsContact CA-OD2 3.25Å; P275-D311 WeakPolarHBondContact CA-OD2 3.25Å; F276-D311 HydrophobicContact CD1-CB 4.06Å; F276-D311 HydrophobicContact CD2-CB 4.18Å; F276-D311 HydrophobicContact CE1-CB 3.91Å; F276-D311 HydrophobicContact CE2-CB 4.02Å; F276-D311 HydrophobicContact CG-CB 4.2Å; F276-D311 HydrophobicContact CZ-CB 3.88Å; F276-D311 WeakPolarHBondContact O-CB 3.48Å; F276-D311 PolarHBondContact O-N 2.94Å; D311-E313 VanDerWaalsContact C-N 3.31Å; D311-E313 PolarHBondContact O-N 3.23Å; D311-V314 PolarHBondContact O-N 2.94Å; D311-L315 WeakPolarHBondContact O-CB 3.2Å; D311-L315 WeakPolarHBondContact O-CD1 3.17Å; D311-L315 PolarHBondContact O-N 2.58Å
312I93.4Very high94.3Very high32 Ų3255.3 Ų55.316%0.16428%0.283CS..Hα-helixtrans-57.8-41.7175.8-64152.8000111.5Q244 D310 L315 K316Q244-I312 HydrophobicContact CG-CD1 4.35Å; Q244-I312 HydrophobicContact CG-CG1 4.11Å; D310-I312 VanDerWaalsContact C-N 3.29Å; D310-I312 PolarHBondContact O-N 3.2Å; I312-L315 PolarHBondContact O-N 3.48Å; I312-K316 HydrophobicContact CG2-CD 4.44Å; I312-K316 WeakPolarHBondContact O-CG 3.3Å; I312-K316 PolarHBondContact O-N 3.18Å
313E93.6Very high93.8Very high81 Ų8155.4 Ų55.438%0.37929%0.287SS..Hα-helixtrans-71.6-38179.3-179.8158.7-17200111.6D310 D311 L315 K316 R317D310-E313 PolarHBondContact O-N 2.97Å; D311-E313 VanDerWaalsContact C-N 3.31Å; D311-E313 PolarHBondContact O-N 3.23Å; E313-L315 VanDerWaalsContact C-N 3.33Å; E313-L315 PolarHBondContact O-N 2.98Å; E313-K316 PolarHBondContact O-N 2.69Å; E313-R317 WeakPolarHBondContact O-CG 3.33Å; E313-R317 PolarHBondContact O-N 3.46Å; E313-R317 IonicContact OE1-CZ 3.04Å; E313-R317 IonicContact OE1-NE 3.33Å; E313-R317 PolarHBondContact OE1-NE 3.44Å; E313-R317 IonicContact OE1-NH2 3.14Å; E313-R317 PolarHBondContact OE1-NH2 2.86Å
314V95.6Very high93.4Very high32 Ų3250.8 Ų50.819%0.19426%0.262CS..Hα-helixtrans-60.6-44.6171.3176.40000110.5F276 I278 H309 D310 D311 K316 R317 M318F276-V314 HydrophobicContact CE2-CB 4.32Å; F276-V314 HydrophobicContact CE2-CG1 4.38Å; F276-V314 HydrophobicContact CE2-CG2 4.23Å; F276-V314 HydrophobicContact CZ-CB 4.44Å; F276-V314 HydrophobicContact CZ-CG1 4.3Å; I278-V314 HydrophobicContact CB-CG2 4.41Å; I278-V314 HydrophobicContact CG1-CG2 4Å; H309-V314 HydrophobicContact CB-CG2 4.05Å; D310-V314 PolarHBondContact O-N 3.39Å; D310-V314 VanDerWaalsContact O-N 3.08Å; D311-V314 PolarHBondContact O-N 2.94Å; V314-K316 PolarHBondContact O-N 3.14Å; V314-R317 PolarHBondContact O-N 3.49Å; V314-M318 HydrophobicContact CG1-CG 4.46Å; V314-M318 HydrophobicContact CG1-SD 4.05Å; V314-M318 WeakPolarHBondContact O-CB 3.33Å; V314-M318 VanDerWaalsContact O-CG 3.27Å; V314-M318 WeakPolarHBondContact O-CG 3.22Å; V314-M318 PolarHBondContact O-N 3.49Å
315L95.1Very high92.9Very high8 Ų850.9 Ų50.94%0.04226%0.26CS..Hα-helixtrans-60.6-42.2176.1-96.765.8000112.5A247 L251 L274 D311 I312 E313 M318 G319 M320A247-L315 HydrophobicContact CB-CB 4.22Å; A247-L315 HydrophobicContact CB-CD2 4.22Å; L251-L315 HydrophobicContact CD2-CD1 3.97Å; L251-L315 HydrophobicContact CD2-CD2 3.89Å; L251-L315 HydrophobicContact CD2-CG 4.02Å; L274-L315 HydrophobicContact CD2-CD1 4.27Å; L274-L315 HydrophobicContact CD2-CD2 4.2Å; D311-L315 WeakPolarHBondContact O-CB 3.2Å; D311-L315 WeakPolarHBondContact O-CD1 3.17Å; D311-L315 PolarHBondContact O-N 2.58Å; I312-L315 PolarHBondContact O-N 3.48Å; E313-L315 VanDerWaalsContact C-N 3.33Å; E313-L315 PolarHBondContact O-N 2.98Å; L315-M318 PolarHBondContact O-N 2.8Å; L315-G319 PolarHBondContact O-N 2.67Å; L315-M320 HydrophobicContact CB-CB 4.4Å; L315-M320 HydrophobicContact CB-CG 4.44Å; L315-M320 HydrophobicContact CG-CG 4.31Å; L315-M320 VanDerWaalsContact O-CB 3.27Å; L315-M320 WeakPolarHBondContact O-CB 3.3Å; L315-M320 WeakPolarHBondContact O-CG 3.44Å; L315-M320 PolarHBondContact O-N 3.18Å
316K92.5Very high92.2Very high38 Ų3848.7 Ų48.717%0.16525%0.249CC..Hα-helixtrans-60.8-50173.6-73170.9-179.6176.60111.4E240 I312 E313 V314 M318 G319 S321 E325E240-K316 WeakPolarHBondContact OE1-CE 3.23Å; E240-K316 IonicContact OE1-NZ 3.25Å; E240-K316 PolarHBondContact OE1-NZ 3.2Å; E240-K316 IonicContact OE2-NZ 2.66Å; E240-K316 PolarHBondContact OE2-NZ 3.48Å; I312-K316 HydrophobicContact CG2-CD 4.44Å; I312-K316 WeakPolarHBondContact O-CG 3.3Å; I312-K316 PolarHBondContact O-N 3.18Å; E313-K316 PolarHBondContact O-N 2.69Å; V314-K316 PolarHBondContact O-N 3.14Å; K316-M318 PolarHBondContact O-N 3.36Å; K316-G319 WeakPolarHBondContact O-CA 3.36Å; K316-G319 PolarHBondContact O-N 3.41Å; K316-S321 WeakPolarHBondContact CA-OG 3.39Å; K316-E325 HydrophobicContact CD-CG 4.44Å
317R92.6Very high91.4Very high147 Ų14748.3 Ų48.356%0.55526%0.26SS*.Hα-helixtrans-63.7-26.4178.1-68.4178.4-173.8-174.47.8113.4H309 E313 V314 G319H309-R317 PolarHBondContact CE1-NH1 3.44Å; H309-R317 PolarHBondContact CE1-NH2 3.47Å; H309-R317 VanDerWaalsContact ND1-CZ 3.29Å; H309-R317 PolarHBondContact ND1-NH1 3Å; H309-R317 VanDerWaalsContact ND1-NH1 3.18Å; H309-R317 PolarHBondContact ND1-NH2 3.03Å; E313-R317 WeakPolarHBondContact O-CG 3.33Å; E313-R317 PolarHBondContact O-N 3.46Å; E313-R317 IonicContact OE1-CZ 3.04Å; E313-R317 IonicContact OE1-NE 3.33Å; E313-R317 PolarHBondContact OE1-NE 3.44Å; E313-R317 IonicContact OE1-NH2 3.14Å; E313-R317 PolarHBondContact OE1-NH2 2.86Å; V314-R317 PolarHBondContact O-N 3.49Å; R317-G319 PolarHBondContact O-N 3.41Å
318M93Very high90.7Very high90 Ų9051.3 Ų51.344%0.44327%0.271SS..THydrogen-bonded Turntrans-75-0.7169.9-72.6178.268.400113.9V314 L315 K316 M320V314-M318 HydrophobicContact CG1-CG 4.46Å; V314-M318 HydrophobicContact CG1-SD 4.05Å; V314-M318 WeakPolarHBondContact O-CB 3.33Å; V314-M318 VanDerWaalsContact O-CG 3.27Å; V314-M318 WeakPolarHBondContact O-CG 3.22Å; V314-M318 PolarHBondContact O-N 3.49Å; L315-M318 PolarHBondContact O-N 2.8Å; K316-M318 PolarHBondContact O-N 3.36Å; M318-M320 VanDerWaalsContact C-N 3.33Å; M318-M320 HydrophobicContact CB-CE 4.48Å; M318-M320 HydrophobicContact CB-CG 4.12Å; M318-M320 VanDerWaalsContact O-CE 3.26Å; M318-M320 WeakPolarHBondContact O-CE 3.19Å
319G92.1Very high90.2Very high35 Ų3548.5 Ų48.536%0.36126%0.26SS..THydrogen-bonded Turntrans7811.4-178.400000114.3L315 K316 R317 S321 F322L315-G319 PolarHBondContact O-N 2.67Å; K316-G319 WeakPolarHBondContact O-CA 3.36Å; K316-G319 PolarHBondContact O-N 3.41Å; R317-G319 PolarHBondContact O-N 3.41Å; G319-S321 PolarHBondContact O-N 3.11Å; G319-F322 PolarHBondContact O-N 2.96Å
320M93.3Very high89.7Confident13 Ų1349.9 Ų49.96%0.06427%0.271CS..THydrogen-bonded Turntrans-67.6-24.2-176.4-57.6-66.792.600112.5A247 N250 L251 L315 M318 F322A247-M320 WeakPolarHBondContact CA-O 3.39Å; A247-M320 HydrophobicContact CB-CB 3.89Å; N250-M320 WeakPolarHBondContact CB-O 3.19Å; N250-M320 PolarHBondContact ND2-O 2.85Å; L251-M320 HydrophobicContact CB-CG 4.38Å; L251-M320 HydrophobicContact CB-SD 4.11Å; L251-M320 HydrophobicContact CD1-SD 4.11Å; L315-M320 HydrophobicContact CB-CB 4.4Å; L315-M320 HydrophobicContact CB-CG 4.44Å; L315-M320 HydrophobicContact CG-CG 4.31Å; L315-M320 VanDerWaalsContact O-CB 3.27Å; L315-M320 WeakPolarHBondContact O-CB 3.3Å; L315-M320 WeakPolarHBondContact O-CG 3.44Å; L315-M320 PolarHBondContact O-N 3.18Å; M318-M320 VanDerWaalsContact C-N 3.33Å; M318-M320 HydrophobicContact CB-CE 4.48Å; M318-M320 HydrophobicContact CB-CG 4.12Å; M318-M320 VanDerWaalsContact O-CE 3.26Å; M318-M320 WeakPolarHBondContact O-CE 3.19Å; M320-F322 VanDerWaalsContact C-N 3.32Å
321S90.7Very high89.3Confident0 Ų052.3 Ų52.30%028%0.283CS..THydrogen-bonded Turntrans-86.68.3172.451.10000114.2K316 G319 G323 L324 E325K316-S321 WeakPolarHBondContact CA-OG 3.39Å; G319-S321 PolarHBondContact O-N 3.11Å; S321-G323 PolarHBondContact O-N 2.79Å; S321-L324 WeakPolarHBondContact O-CB 3.44Å; S321-L324 WeakPolarHBondContact O-CG 3.4Å; S321-L324 PolarHBondContact O-N 3.25Å; S321-E325 VanDerWaalsContact CB-OE2 3.26Å; S321-E325 WeakPolarHBondContact CB-OE2 3.03Å; S321-E325 PolarHBondContact OG-OE2 3.28Å
322F89.1Confident89Confident26 Ų2657.9 Ų57.911%0.11431%0.308CS..THydrogen-bonded Turntrans57.924.9178.3-59.9-71000115.4I246 N250 G319 M320 L324 C329 D333 I336 A337 L340I246-F322 HydrophobicContact CG2-CD2 3.69Å; I246-F322 HydrophobicContact CG2-CE2 3.91Å; N250-F322 HydrophobicContact CB-CE2 4.3Å; N250-F322 HydrophobicContact CB-CZ 4.37Å; N250-F322 VanDerWaalsContact CG-CZ 3.49Å; N250-F322 WeakPolarHBondContact ND2-CE1 3.39Å; N250-F322 WeakPolarHBondContact ND2-CE2 3.41Å; N250-F322 WeakPolarHBondContact ND2-CZ 3.34Å; G319-F322 PolarHBondContact O-N 2.96Å; M320-F322 VanDerWaalsContact C-N 3.32Å; F322-L324 PolarHBondContact O-N 3.19Å; F322-C329 WeakPolarHBondContact O-CA 3.44Å; F322-C329 WeakPolarHBondContact O-CB 3.3Å; F322-C329 PolarHBondContact O-SG 2.7Å; F322-D333 HydrophobicContact CB-CB 3.87Å; F322-D333 HydrophobicContact CD1-CB 3.55Å; F322-D333 WeakPolarHBondContact CD1-OD1 3.36Å; F322-D333 HydrophobicContact CE1-CB 4.28Å; F322-D333 HydrophobicContact CG-CB 3.88Å; F322-I336 HydrophobicContact CE1-CG2 4.38Å; F322-I336 HydrophobicContact CE2-CB 4.48Å; F322-I336 HydrophobicContact CE2-CG2 4Å; F322-I336 HydrophobicContact CZ-CB 4.09Å; F322-I336 HydrophobicContact CZ-CG2 3.52Å; F322-A337 HydrophobicContact CD2-CB 3.93Å; F322-A337 HydrophobicContact CE2-CB 4.35Å; F322-L340 HydrophobicContact CE2-CD1 4Å
323G85.1Confident88.9Confident14 Ų1458.9 Ų58.914%0.14431%0.314CS..THydrogen-bonded Turntrans70.88.8-178.700000114.4S321 E325 S326 G327 K328S321-G323 PolarHBondContact O-N 2.79Å; G323-E325 WeakPolarHBondContact CA-OE1 3.25Å; G323-E325 PolarHBondContact O-N 3.26Å; G323-S326 PolarHBondContact O-N 2.99Å; G323-S326 PolarHBondContact O-OG 2.68Å; G323-G327 PolarHBondContact O-N 2.91Å; G323-G327 VanDerWaalsContact O-N 3.16Å; G323-K328 PolarHBondContact O-N 3.49Å; G323-K328 VanDerWaalsContact O-N 3.07Å
324L86.8Confident88.7Confident3 Ų356.2 Ų56.22%0.01630%0.302CS..G310 helixtrans-59.7-33.3179.2-75169.2000112L243 I246 S321 F322 S326 G327 C329 L334 A337 I349 I352L243-L324 HydrophobicContact CD2-CB 3.5Å; L243-L324 VanDerWaalsContact CD2-CB 3.5Å; L243-L324 HydrophobicContact CD2-CD1 4.4Å; I246-L324 HydrophobicContact CD1-CD1 3.79Å; S321-L324 WeakPolarHBondContact O-CB 3.44Å; S321-L324 WeakPolarHBondContact O-CG 3.4Å; S321-L324 PolarHBondContact O-N 3.25Å; F322-L324 PolarHBondContact O-N 3.19Å; L324-S326 PolarHBondContact O-N 2.94Å; L324-G327 PolarHBondContact O-N 2.66Å; L324-C329 HydrophobicContact CD2-CB 3.68Å; L324-C329 HydrophobicContact CG-CB 4.11Å; L324-L334 HydrophobicContact CD2-CD1 3.98Å; L324-A337 HydrophobicContact CD1-CB 3.83Å; L324-I349 HydrophobicContact CD1-CG2 4.19Å; L324-I349 HydrophobicContact CD2-CG2 4.34Å; L324-I352 HydrophobicContact CB-CG2 3.96Å; L324-I352 HydrophobicContact CD2-CG2 4.35Å; L324-I352 WeakPolarHBondContact O-CG2 3.49Å
325E84.9Confident88.6Confident81 Ų8162.5 Ų62.538%0.37933%0.327SS..G310 helixtrans-64.9-17.1175.773.2-65.615200114.1L243 K316 S321 G323L243-E325 HydrophobicContact CD1-CB 3.94Å; L243-E325 HydrophobicContact CD2-CB 4.47Å; K316-E325 HydrophobicContact CD-CG 4.44Å; S321-E325 VanDerWaalsContact CB-OE2 3.26Å; S321-E325 WeakPolarHBondContact CB-OE2 3.03Å; S321-E325 PolarHBondContact OG-OE2 3.28Å; G323-E325 WeakPolarHBondContact CA-OE1 3.25Å; G323-E325 PolarHBondContact O-N 3.26Å
326S82.8Confident88.4Confident64 Ų6465.3 Ų65.345%0.44834%0.341SS..G310 helixtrans-118.95.4178.965.50000114.1G323 L324 K328G323-S326 PolarHBondContact O-N 2.99Å; G323-S326 PolarHBondContact O-OG 2.68Å; L324-S326 PolarHBondContact O-N 2.94Å; S326-K328 VanDerWaalsContact C-N 3.27Å; S326-K328 PolarHBondContact O-N 3.05Å
327G79.9Confident88.4Confident45 Ų4563.5 Ų63.546%0.46433%0.333SS..THydrogen-bonded Turntrans6919.3-177.200000114.5G323 L324G323-G327 PolarHBondContact O-N 2.91Å; G323-G327 VanDerWaalsContact O-N 3.16Å; L324-G327 PolarHBondContact O-N 2.66Å
328K81.3Confident88.4Confident169 Ų16958.9 Ų58.974%0.73532%0.317SS*.  trans-106.726.4-174-63.7178.8-175.1174.20113.6G323 S326G323-K328 PolarHBondContact O-N 3.49Å; G323-K328 VanDerWaalsContact O-N 3.07Å; S326-K328 VanDerWaalsContact C-N 3.27Å; S326-K328 PolarHBondContact O-N 3.05Å
329C84.5Confident88.5Confident28 Ų2858.8 Ų58.819%0.18933%0.325CS..  trans-77.8135.4-176-168.40000111.5F322 L324 L334F322-C329 WeakPolarHBondContact O-CA 3.44Å; F322-C329 WeakPolarHBondContact O-CB 3.3Å; F322-C329 PolarHBondContact O-SG 2.7Å; L324-C329 HydrophobicContact CD2-CB 3.68Å; L324-C329 HydrophobicContact CG-CB 4.11Å; C329-L334 PolarHBondContact SG-N 3.12Å; C329-L334 VanDerWaalsContact SG-N 3.42Å
330S87.3Confident88.5Confident42 Ų4257.7 Ų57.729%0.29431%0.312SS..  trans-74.7165.3172.777.20000111.4E332 D333 L334S330-E332 VanDerWaalsContact C-N 3.31Å; S330-E332 PolarHBondContact O-N 3.27Å; S330-D333 WeakPolarHBondContact CB-OD2 3.35Å; S330-D333 PolarHBondContact O-N 3.12Å; S330-D333 VanDerWaalsContact OG-CB 3.25Å; S330-D333 WeakPolarHBondContact OG-CB 3.42Å; S330-D333 PolarHBondContact OG-N 2.93Å; S330-D333 PolarHBondContact OG-OD2 2.96Å; S330-L334 WeakPolarHBondContact O-CB 3.43Å; S330-L334 PolarHBondContact O-N 3.03Å
331L86.3Confident88.6Confident136 Ų13657.6 Ų57.671%0.71231%0.311SS*.Hα-helixtrans-68.3-34.9178.9-66.7176.9000111.8K335L331-K335 PolarHBondContact O-N 3.22Å; L331-K335 VanDerWaalsContact O-N 3.16Å
332E89.3Confident88.8Confident131 Ų13161.2 Ų61.261%0.61234%0.335SS*.Hα-helixtrans-66.4-49.5175.9-66.963-140.800110.4S330 L334 K335 I336S330-E332 VanDerWaalsContact C-N 3.31Å; S330-E332 PolarHBondContact O-N 3.27Å; E332-L334 VanDerWaalsContact C-N 3.34Å; E332-L334 PolarHBondContact O-N 3.44Å; E332-K335 WeakPolarHBondContact O-CB 3.3Å; E332-K335 PolarHBondContact O-N 3.28Å; E332-I336 WeakPolarHBondContact O-CG1 3.18Å; E332-I336 PolarHBondContact O-N 3.22Å; E332-I336 VanDerWaalsContact O-N 3.1Å
333D90.4Very high88.9Confident54 Ų5468.5 Ų68.529%0.28937%0.367SS..Hα-helixtrans-65.4-37.9177.9-66.8-44.7000111.8F322 S330 K335 I336 A337F322-D333 HydrophobicContact CB-CB 3.87Å; F322-D333 HydrophobicContact CD1-CB 3.55Å; F322-D333 WeakPolarHBondContact CD1-OD1 3.36Å; F322-D333 HydrophobicContact CE1-CB 4.28Å; F322-D333 HydrophobicContact CG-CB 3.88Å; S330-D333 WeakPolarHBondContact CB-OD2 3.35Å; S330-D333 PolarHBondContact O-N 3.12Å; S330-D333 VanDerWaalsContact OG-CB 3.25Å; S330-D333 WeakPolarHBondContact OG-CB 3.42Å; S330-D333 PolarHBondContact OG-N 2.93Å; S330-D333 PolarHBondContact OG-OD2 2.96Å; D333-K335 VanDerWaalsContact C-N 3.28Å; D333-K335 PolarHBondContact O-N 2.79Å; D333-I336 PolarHBondContact O-N 3.06Å; D333-I336 VanDerWaalsContact O-N 3.16Å; D333-A337 WeakPolarHBondContact O-CB 3.49Å; D333-A337 PolarHBondContact O-N 2.98Å
334L90.6Very high89.3Confident24 Ų2472.2 Ų72.213%0.12640%0.396CS..Hα-helixtrans-61.3-38.2175.5-175.564.9000111.6L324 C329 S330 E332 K338 I349L324-L334 HydrophobicContact CD2-CD1 3.98Å; C329-L334 PolarHBondContact SG-N 3.12Å; C329-L334 VanDerWaalsContact SG-N 3.42Å; S330-L334 WeakPolarHBondContact O-CB 3.43Å; S330-L334 PolarHBondContact O-N 3.03Å; E332-L334 VanDerWaalsContact C-N 3.34Å; E332-L334 PolarHBondContact O-N 3.44Å; L334-K338 WeakPolarHBondContact O-CG 3.42Å; L334-K338 PolarHBondContact O-N 3.42Å; L334-I349 HydrophobicContact CD1-CG2 3.72Å
335K92.1Very high89.6Confident164 Ų16474.4 Ų74.471%0.71341%0.407SS*.Hα-helixtrans-66.5-40.8174.7-175.8179.7178.7-179.10111.6L331 E332 D333 S339L331-K335 PolarHBondContact O-N 3.22Å; L331-K335 VanDerWaalsContact O-N 3.16Å; E332-K335 WeakPolarHBondContact O-CB 3.3Å; E332-K335 PolarHBondContact O-N 3.28Å; D333-K335 VanDerWaalsContact C-N 3.28Å; D333-K335 PolarHBondContact O-N 2.79Å; K335-S339 PolarHBondContact O-N 3.47Å
336I92.2Very high90Very high67 Ų6773.8 Ų73.834%0.34441%0.405SS..Hα-helixtrans-64.9-50174.7-62.1166.4000109.9F322 E332 D333 K338 S339 L340F322-I336 HydrophobicContact CE1-CG2 4.38Å; F322-I336 HydrophobicContact CE2-CB 4.48Å; F322-I336 HydrophobicContact CE2-CG2 4Å; F322-I336 HydrophobicContact CZ-CB 4.09Å; F322-I336 HydrophobicContact CZ-CG2 3.52Å; E332-I336 WeakPolarHBondContact O-CG1 3.18Å; E332-I336 PolarHBondContact O-N 3.22Å; E332-I336 VanDerWaalsContact O-N 3.1Å; D333-I336 PolarHBondContact O-N 3.06Å; D333-I336 VanDerWaalsContact O-N 3.16Å; I336-K338 VanDerWaalsContact C-N 3.3Å; I336-K338 PolarHBondContact O-N 2.81Å; I336-S339 WeakPolarHBondContact O-CB 3.37Å; I336-S339 PolarHBondContact O-N 3.32Å; I336-S339 PolarHBondContact O-OG 3.21Å; I336-L340 HydrophobicContact CG2-CD1 4.41Å; I336-L340 WeakPolarHBondContact O-CG 3.35Å; I336-L340 PolarHBondContact O-N 2.96Å
337A92.3Very high90.3Very high0 Ų072.9 Ų72.90%041%0.405CS..Hα-helixtrans-53.1-44.7177.400000112.8I246 F322 L324 D333 S339 L340 I349I246-A337 HydrophobicContact CD1-CB 4.21Å; I246-A337 HydrophobicContact CG2-CB 4.32Å; F322-A337 HydrophobicContact CD2-CB 3.93Å; F322-A337 HydrophobicContact CE2-CB 4.35Å; L324-A337 HydrophobicContact CD1-CB 3.83Å; D333-A337 WeakPolarHBondContact O-CB 3.49Å; D333-A337 PolarHBondContact O-N 2.98Å; A337-S339 PolarHBondContact O-N 2.62Å; A337-L340 PolarHBondContact O-N 2.96Å; A337-I349 HydrophobicContact CB-CG2 4.26Å
338K93.1Very high90.7Very high50 Ų5075 Ų7522%0.21740%0.4CS..Hα-helixtrans-57.8-45.7173.8-76.8176.9177.9-1730112.5L334 I336 L340 V341 E346 I349 T350L334-K338 WeakPolarHBondContact O-CG 3.42Å; L334-K338 PolarHBondContact O-N 3.42Å; I336-K338 VanDerWaalsContact C-N 3.3Å; I336-K338 PolarHBondContact O-N 2.81Å; K338-L340 PolarHBondContact O-N 2.92Å; K338-V341 PolarHBondContact O-N 2.85Å; K338-V341 VanDerWaalsContact O-N 3.15Å; K338-E346 HydrophobicContact CB-CG 4.11Å; K338-E346 HydrophobicContact CG-CB 4.3Å; K338-E346 HydrophobicContact CG-CG 4.28Å; K338-I349 HydrophobicContact CG-CB 4.31Å; K338-I349 HydrophobicContact CG-CD1 4.28Å; K338-I349 HydrophobicContact CG-CG2 4.14Å; K338-T350 WeakPolarHBondContact CE-OG1 3.4Å; K338-T350 PolarHBondContact NZ-OG1 2.66Å
339S94.3Very high91.2Very high88 Ų8867 Ų6762%0.61537%0.365SS*.Hα-helixtrans-64.9-20.5178.275.40000115K335 I336 A337 V341K335-S339 PolarHBondContact O-N 3.47Å; I336-S339 WeakPolarHBondContact O-CB 3.37Å; I336-S339 PolarHBondContact O-N 3.32Å; I336-S339 PolarHBondContact O-OG 3.21Å; A337-S339 PolarHBondContact O-N 2.62Å; S339-V341 VanDerWaalsContact C-N 3.3Å
340L93.1Very high91.4Very high13 Ų1367.9 Ų67.97%0.06837%0.369CS..THydrogen-bonded Turntrans-81.4-11.2177.7-63.3178.6000112.5I246 K249 N250 F322 I336 A337 K338I246-L340 HydrophobicContact CG2-CD1 4.25Å; K249-L340 HydrophobicContact CB-CB 4.45Å; K249-L340 HydrophobicContact CB-CD1 4.38Å; K249-L340 HydrophobicContact CB-CD2 4.13Å; K249-L340 HydrophobicContact CD-CB 4.19Å; K249-L340 WeakPolarHBondContact CD-O 3.26Å; K249-L340 WeakPolarHBondContact CE-O 3.21Å; K249-L340 PolarHBondContact NZ-O 2.92Å; N250-L340 HydrophobicContact CB-CD1 4.01Å; F322-L340 HydrophobicContact CE2-CD1 4Å; I336-L340 HydrophobicContact CG2-CD1 4.41Å; I336-L340 WeakPolarHBondContact O-CG 3.35Å; I336-L340 PolarHBondContact O-N 2.96Å; A337-L340 PolarHBondContact O-N 2.96Å; K338-L340 PolarHBondContact O-N 2.92Å
341V93.9Very high91.3Very high10 Ų1067.9 Ų67.96%0.06137%0.366CS..SBendtrans-119.3151.7-171.6173.10000110.5L242 Q245 I246 K338 S339 L345 I349L242-V341 HydrophobicContact CD2-CG1 3.58Å; L242-V341 HydrophobicContact CD2-CG2 4.27Å; Q245-V341 HydrophobicContact CG-CG2 4.47Å; I246-V341 HydrophobicContact CD1-CG2 4.04Å; I246-V341 HydrophobicContact CG1-CG2 3.56Å; K338-V341 PolarHBondContact O-N 2.85Å; K338-V341 VanDerWaalsContact O-N 3.15Å; S339-V341 VanDerWaalsContact C-N 3.3Å; V341-L345 HydrophobicContact CG1-CB 3.63Å; V341-L345 HydrophobicContact CG1-CD1 4.32Å; V341-I349 HydrophobicContact CB-CD1 3.67Å; V341-I349 HydrophobicContact CG1-CD1 3.93Å; V341-I349 HydrophobicContact CG2-CD1 3.73Å
342P94.8Very high91.3Very high76 Ų7662.3 Ų62.349%0.49434%0.337SS..  trans-59.3142.2175-25.135.7000112.9A344 L345P342-A344 PolarHBondContact O-N 3.32Å; P342-L345 PolarHBondContact O-N 2.65Å
343K92Very high91Very high180 Ų18057.1 Ų57.178%0.78332%0.315SS*.G310 helixtrans-48.6-39.5-175.2-62.7-170.8175.4-176.50114.8L345 E346K343-L345 PolarHBondContact O-N 2.69Å; K343-L345 VanDerWaalsContact O-N 3.08Å; K343-E346 WeakPolarHBondContact CA-OE1 3.39Å; K343-E346 PolarHBondContact O-N 3.18Å
344A94Very high90.4Very high92 Ų9259.6 Ų59.676%0.7633%0.332SS*.G310 helixtrans-61.5-15.9178.900000114.3P342P342-A344 PolarHBondContact O-N 3.32Å
345L93Very high89.3Confident49 Ų4959.9 Ų59.926%0.25734%0.341SS..G310 helixtrans-111.5-0.3-177.4-55.3174.7000113.5L242 V341 P342 K343 G347 Y348 I349L242-L345 HydrophobicContact CD2-CB 4.13Å; L242-L345 HydrophobicContact CD2-CD1 3.97Å; V341-L345 HydrophobicContact CG1-CB 3.63Å; V341-L345 HydrophobicContact CG1-CD1 4.32Å; P342-L345 PolarHBondContact O-N 2.65Å; K343-L345 PolarHBondContact O-N 2.69Å; K343-L345 VanDerWaalsContact O-N 3.08Å; L345-G347 PolarHBondContact O-N 2.96Å; L345-Y348 HydrophobicContact CB-CD2 4.31Å; L345-Y348 HydrophobicContact CD2-CD2 3.77Å; L345-Y348 HydrophobicContact CD2-CE2 3.78Å; L345-Y348 PolarHBondContact O-N 3.17Å; L345-Y348 VanDerWaalsContact O-N 3.16Å; L345-I349 PolarHBondContact O-N 2.82Å
346E91.7Very high87.7Confident68 Ų6854.5 Ų54.532%0.31832%0.323SS..Hα-helixtrans-60.8-28.3176.9-70.3179.6-145.600113.2K338 K343 I349 T350K338-E346 HydrophobicContact CB-CG 4.11Å; K338-E346 HydrophobicContact CG-CB 4.3Å; K338-E346 HydrophobicContact CG-CG 4.28Å; K343-E346 WeakPolarHBondContact CA-OE1 3.39Å; K343-E346 PolarHBondContact O-N 3.18Å; E346-I349 PolarHBondContact O-N 2.77Å; E346-T350 PolarHBondContact O-N 2.68Å; E346-T350 PolarHBondContact O-OG1 2.86Å
347G89.3Confident85.6Confident44 Ų4454 Ų5445%0.45433%0.326SS..Hα-helixtrans-59.6-49.5173.300000111.9L345 I349 T350 D351L345-G347 PolarHBondContact O-N 2.96Å; G347-I349 VanDerWaalsContact C-N 3.28Å; G347-I349 PolarHBondContact O-N 2.95Å; G347-T350 WeakPolarHBondContact O-CA 3.44Å; G347-T350 VanDerWaalsContact O-CB 3.25Å; G347-T350 WeakPolarHBondContact O-CB 3.47Å; G347-T350 PolarHBondContact O-N 3.06Å; G347-D351 PolarHBondContact O-N 3.29Å
348Y89.6Confident83.8Confident91 Ų9159.2 Ų59.236%0.35735%0.345SS..Hα-helixtrans-61.8-33.6179.3-63.7-73.7000112.9L238 L242 L345 T350 D351 I352L238-Y348 HydrophobicContact CD2-CD1 4.22Å; L238-Y348 HydrophobicContact CD2-CD2 4.18Å; L238-Y348 HydrophobicContact CD2-CE1 4.08Å; L238-Y348 HydrophobicContact CD2-CE2 4.07Å; L238-Y348 HydrophobicContact CD2-CG 4.27Å; L242-Y348 HydrophobicContact CD1-CG 4.46Å; L345-Y348 HydrophobicContact CB-CD2 4.31Å; L345-Y348 HydrophobicContact CD2-CD2 3.77Å; L345-Y348 HydrophobicContact CD2-CE2 3.78Å; L345-Y348 PolarHBondContact O-N 3.17Å; L345-Y348 VanDerWaalsContact O-N 3.16Å; Y348-T350 VanDerWaalsContact C-N 3.29Å; Y348-T350 PolarHBondContact O-N 3.38Å; Y348-D351 PolarHBondContact O-N 3.42Å; Y348-I352 WeakPolarHBondContact O-CD1 3.24Å; Y348-I352 WeakPolarHBondContact O-CG1 3.44Å; Y348-I352 PolarHBondContact O-N 2.87Å
349I90.6Very high81.7Confident0 Ų061.6 Ų61.60%036%0.36CS..Hα-helixtrans-65.4-37.2174.7-59.9171.7000110.7I246 L324 L334 A337 K338 V341 L345 E346 G347 I352 S353I246-I349 HydrophobicContact CD1-CD1 4.11Å; I246-I349 HydrophobicContact CD1-CG1 4.31Å; L324-I349 HydrophobicContact CD1-CG2 4.19Å; L324-I349 HydrophobicContact CD2-CG2 4.34Å; L334-I349 HydrophobicContact CD1-CG2 3.72Å; A337-I349 HydrophobicContact CB-CG2 4.26Å; K338-I349 HydrophobicContact CG-CB 4.31Å; K338-I349 HydrophobicContact CG-CD1 4.28Å; K338-I349 HydrophobicContact CG-CG2 4.14Å; V341-I349 HydrophobicContact CB-CD1 3.67Å; V341-I349 HydrophobicContact CG1-CD1 3.93Å; V341-I349 HydrophobicContact CG2-CD1 3.73Å; L345-I349 PolarHBondContact O-N 2.82Å; E346-I349 PolarHBondContact O-N 2.77Å; G347-I349 VanDerWaalsContact C-N 3.28Å; G347-I349 PolarHBondContact O-N 2.95Å; I349-I352 PolarHBondContact O-N 3.48Å; I349-S353 PolarHBondContact O-N 2.66Å; I349-S353 PolarHBondContact O-OG 3.49Å
350T88.7Confident79.4Confident46 Ų4662 Ų6228%0.28236%0.355SS..Hα-helixtrans-63.4-50.5174.3-44.40000110.2K338 E346 G347 Y348 I352 S353 T354K338-T350 WeakPolarHBondContact CE-OG1 3.4Å; K338-T350 PolarHBondContact NZ-OG1 2.66Å; E346-T350 PolarHBondContact O-N 2.68Å; E346-T350 PolarHBondContact O-OG1 2.86Å; G347-T350 WeakPolarHBondContact O-CA 3.44Å; G347-T350 VanDerWaalsContact O-CB 3.25Å; G347-T350 WeakPolarHBondContact O-CB 3.47Å; G347-T350 PolarHBondContact O-N 3.06Å; Y348-T350 VanDerWaalsContact C-N 3.29Å; Y348-T350 PolarHBondContact O-N 3.38Å; T350-I352 VanDerWaalsContact C-N 3.29Å; T350-I352 PolarHBondContact O-N 3.02Å; T350-S353 PolarHBondContact O-N 3.44Å; T350-S353 PolarHBondContact O-OG 3.02Å; T350-T354 PolarHBondContact O-N 3.21Å; T350-T354 PolarHBondContact O-OG1 3.02Å; T350-T354 VanDerWaalsContact O-OG1 3.07Å
351D86.9Confident77.1Confident42 Ų4268.3 Ų68.323%0.22538%0.384CS..Hα-helixtrans-59.8-32.5176-75.6-44.2000113.7G347 Y348 G355 S357G347-D351 PolarHBondContact O-N 3.29Å; Y348-D351 PolarHBondContact O-N 3.42Å; D351-G355 CarbonylContact O-C 3.54Å; D351-G355 VanDerWaalsContact O-CA 3.3Å; D351-G355 WeakPolarHBondContact O-CA 3.24Å; D351-G355 PolarHBondContact O-N 2.91Å; D351-G355 VanDerWaalsContact O-O 3.06Å; D351-S357 WeakPolarHBondContact OD1-CB 3.2Å; D351-S357 PolarHBondContact OD1-N 3.4Å; D351-S357 PolarHBondContact OD1-OG 3.4Å
352I85.8Confident74.4Confident20 Ų2070.9 Ų70.910%0.10341%0.413CS..Hα-helixtrans-66.9-44.8172.5-68.8160.7000110Q239 L242 L324 Y348 I349 T350Q239-I352 HydrophobicContact CB-CD1 4.1Å; Q239-I352 HydrophobicContact CB-CG1 4.31Å; Q239-I352 HydrophobicContact CG-CD1 3.9Å; Q239-I352 HydrophobicContact CG-CG1 3.78Å; L242-I352 HydrophobicContact CD1-CD1 4.4Å; L324-I352 HydrophobicContact CB-CG2 3.96Å; L324-I352 HydrophobicContact CD2-CG2 4.35Å; L324-I352 WeakPolarHBondContact O-CG2 3.49Å; Y348-I352 WeakPolarHBondContact O-CD1 3.24Å; Y348-I352 WeakPolarHBondContact O-CG1 3.44Å; Y348-I352 PolarHBondContact O-N 2.87Å; I349-I352 PolarHBondContact O-N 3.48Å; T350-I352 VanDerWaalsContact C-N 3.29Å; T350-I352 PolarHBondContact O-N 3.02Å
353S82.6Confident71.8Confident22 Ų2274 Ų7415%0.15442%0.424CS..Hα-helixtrans-71.4-38-175.9680000114.7I349 T350I349-S353 PolarHBondContact O-N 2.66Å; I349-S353 PolarHBondContact O-OG 3.49Å; T350-S353 PolarHBondContact O-N 3.44Å; T350-S353 PolarHBondContact O-OG 3.02Å
354T78.1Confident69.1Low105 Ų10571.1 Ų71.164%0.64442%0.417SS*.Hα-helixtrans-95.2-3-17856.10000113.6T350T350-T354 PolarHBondContact O-N 3.21Å; T350-T354 PolarHBondContact O-OG1 3.02Å; T350-T354 VanDerWaalsContact O-OG1 3.07Å
355G66.9Low66.3Low30 Ų3074 Ų7431%0.30942%0.419SS..  trans75.1163.9-161.600000112.5D351 S357D351-G355 CarbonylContact O-C 3.54Å; D351-G355 VanDerWaalsContact O-CA 3.3Å; D351-G355 WeakPolarHBondContact O-CA 3.24Å; D351-G355 PolarHBondContact O-N 2.91Å; D351-G355 VanDerWaalsContact O-O 3.06Å; G355-S357 PolarHBondContact O-N 3.04Å
356P58.5Low63.5Low51 Ų5179.2 Ų79.233%0.33145%0.447SS..  trans-71.2107-165-11.125000112W358 L359P356-W358 VanDerWaalsContact CB-NE1 3.29Å; P356-W358 PolarHBondContact O-N 3.09Å; P356-W358 VanDerWaalsContact O-N 3.15Å; P356-L359 HydrophobicContact CB-CD1 4.33Å; P356-L359 HydrophobicContact CG-CD1 4.22Å; P356-L359 PolarHBondContact O-N 2.75Å; P356-L359 VanDerWaalsContact O-N 3.15Å
357S49.6Very low60.5Low58 Ų5880.2 Ų80.241%0.40646%0.462SS..THydrogen-bonded Turntrans-56.3-33.1-17860.60000113.3D351 G355 L359 N360D351-S357 WeakPolarHBondContact OD1-CB 3.2Å; D351-S357 PolarHBondContact OD1-N 3.4Å; D351-S357 PolarHBondContact OD1-OG 3.4Å; G355-S357 PolarHBondContact O-N 3.04Å; S357-L359 VanDerWaalsContact C-N 3.26Å; S357-L359 PolarHBondContact O-N 2.94Å; S357-N360 WeakPolarHBondContact O-CB 3.29Å; S357-N360 PolarHBondContact O-N 3.3Å
358W53.1Low57.7Low109 Ų10985 Ų8541%0.41348%0.482SS..Hα-helixtrans-64.6-20-179.469.4-87.3000115P356 N360 Q361P356-W358 VanDerWaalsContact CB-NE1 3.29Å; P356-W358 PolarHBondContact O-N 3.09Å; P356-W358 VanDerWaalsContact O-N 3.15Å; W358-N360 VanDerWaalsContact C-N 3.27Å; W358-N360 PolarHBondContact O-N 3.11Å; W358-Q361 PolarHBondContact O-N 3.47Å
359L49.4Very low54.9Low100 Ų10089.3 Ų89.352%0.52451%0.506SS..Hα-helixtrans-66.9-31.2171.4-79.6166.8000111.8P356 S357P356-L359 HydrophobicContact CB-CD1 4.33Å; P356-L359 HydrophobicContact CG-CD1 4.22Å; P356-L359 PolarHBondContact O-N 2.75Å; P356-L359 VanDerWaalsContact O-N 3.15Å; S357-L359 VanDerWaalsContact C-N 3.26Å; S357-L359 PolarHBondContact O-N 2.94Å
360N45.3Very low51.8Low97 Ų9794.6 Ų94.652%0.51954%0.542SS..Hα-helixtrans-78-28.3175.6-71.6-67000112.5S357 W358 G362 L363 L364S357-N360 WeakPolarHBondContact O-CB 3.29Å; S357-N360 PolarHBondContact O-N 3.3Å; W358-N360 VanDerWaalsContact C-N 3.27Å; W358-N360 PolarHBondContact O-N 3.11Å; N360-G362 VanDerWaalsContact C-N 3.25Å; N360-G362 PolarHBondContact O-N 3.13Å; N360-L363 PolarHBondContact O-N 3.47Å; N360-L363 VanDerWaalsContact O-N 3.08Å; N360-L364 HydrophobicContact CB-CD1 4.14Å; N360-L364 WeakPolarHBondContact O-CB 3.22Å; N360-L364 WeakPolarHBondContact O-CG 3.38Å; N360-L364 PolarHBondContact O-N 3.16Å
361Q44.7Very low49Very low144 Ų14498.2 Ų98.267%0.67356%0.564SS**Hα-helixtrans-66.1-25.3175.3-84.6179.5-16.500113.5W358 L363W358-Q361 PolarHBondContact O-N 3.47Å; Q361-L363 VanDerWaalsContact C-N 3.31Å
362G38.5Very low46.2Very low65 Ų65101.3 Ų101.367%0.6759%0.589SS**THydrogen-bonded Turntrans-75.8-14.5171.700000114.9N360N360-G362 VanDerWaalsContact C-N 3.25Å; N360-G362 PolarHBondContact O-N 3.13Å
363L39.1Very low43.4Very low140 Ų140107.8 Ų107.873%0.73362%0.624SS**THydrogen-bonded Turntrans-110-20.2-178.7-77.2162.7000113.2N360 Q361N360-L363 PolarHBondContact O-N 3.47Å; N360-L363 VanDerWaalsContact O-N 3.08Å; Q361-L363 VanDerWaalsContact C-N 3.31Å
364L35.8Very low41Very low121 Ų121114.6 Ų114.663%0.63466%0.658SS**G310 helixtrans-87.96.5-177.1-78.4167000115.3N360N360-L364 HydrophobicContact CB-CD1 4.14Å; N360-L364 WeakPolarHBondContact O-CB 3.22Å; N360-L364 WeakPolarHBondContact O-CG 3.38Å; N360-L364 PolarHBondContact O-N 3.16Å
365L35.6Very low38.5Very low151 Ų151116.4 Ų116.479%0.79166%0.663SS**G310 helixtrans-83.4-10.1172.7-83156.5000113.8
366N33.8Very low37.7Very low160 Ų160119.2 Ų119.286%0.85668%0.676SS**G310 helixtrans-111.339.6178.1-80.31.6000113.5
367S27.7Very low36.1Very low89 Ų89123.1 Ų123.162%0.62270%0.699SS**  trans-136.973.4174-174.20000112
368T30.5Very low35Very low143 Ų143126.9 Ų126.988%0.87772%0.72SS**  trans-60.9138.5165.1370000110.8S370T368-S370 PolarHBondContact O-N 2.7Å
369Q31.1Very low33.7Very low183 Ų183125.2 Ų125.286%0.85574%0.737SS**  trans-67.5124.7-170.4-62.9162.6-4.400112.1
370S26.5Very low32.7Very low110 Ų110124.9 Ų124.977%0.76975%0.749SS**  trans-90.3111.4153.958.70000109T368 S372T368-S370 PolarHBondContact O-N 2.7Å; S370-S372 PolarHBondContact O-N 3.27Å
371V30.6Very low31.9Very low123 Ų123127.3 Ų127.375%0.74577%0.767SS**  trans-62.5133.1176.8-179.90000109.9
372S27.6Very low31.2Very low106 Ų106126.6 Ų126.674%0.74177%0.772SS**  trans-127.7112.7172.4-640000110.2S370S370-S372 PolarHBondContact O-N 3.27Å
373N27.3Very low31.2Very low157 Ų157129.7 Ų129.784%0.8478%0.78SS**  trans-83.6152.1163.7-77.9-34.2000109.7
374L30.8Very low30.6Very low164 Ų164131.9 Ų131.986%0.85979%0.787SS**  trans-66.9160167.3-56.5139000109.1
375D26.9Very low30.2Very low143 Ų143131.6 Ų131.677%0.76580%0.795SS**  cis-152.4-148.613.3-157.511.2000110.7
376P48.5Very low29.8Very low90 Ų90129.8 Ų129.858%0.58480%0.795SS**  -120.4161.2-126.739.5-21.1000116.5
377T25.6Very low29.5Very low132 Ų132128.7 Ų128.781%0.8179%0.794SS**  trans177.7141.7131.921.90000115.3
378T27.6Very low29.5Very low137 Ų137131.2 Ų131.284%0.8480%0.801SS**  trans26.9130149.459.70000122.8
379G25.2Very low29.4Very low74 Ų74133.6 Ų133.676%0.76380%0.801SS**  trans126.2100.5131.300000119.2
380A29Very low29.2Very low94 Ų94128.3 Ų128.378%0.77780%0.796SS**  trans44.5157.9140.200000124.5
381T27.3Very low29.5Very low147 Ų147131.1 Ų131.190%0.90280%0.802SS**  trans84.2138.6157.827.90000121.8
382V30.9Very low29.4Very low129 Ų129131.5 Ų131.578%0.78281%0.808SS**  trans-109.7142179.9164.10000107.1
383P37.6Very low29.8Very low130 Ų130133.5 Ų133.584%0.84481%0.81SS**  -152.5-176.710437.6-16.1000117.3
384Q27.6Very low30.1Very low187 Ų187134 Ų13487%0.87481%0.813SS**  trans-91156.3-164.1-49165.1-66.700116.1
385S25.8Very low30.4Very low115 Ų115130.9 Ų130.980%0.80481%0.811SS**  trans-177.7128.3133.748.30000108.2
386S27.3Very low30.8Very low112 Ų112133.3 Ų133.378%0.78382%0.817SS**  68.7108.764.4-164.70000115
387V28.2Very low30.6Very low138 Ų138136 Ų13684%0.83683%0.832SS**  163.6141.1129.1159.70000110.3
388N27.8Very low31Very low142 Ų142134.2 Ų134.276%0.75983%0.831SS**  trans-84.9152.6-179.3-58.3-56.9000112.7
389Q28.5Very low31.5Very low192 Ų192136.5 Ų136.590%0.89784%0.837SS**  160.3127.8114.5-88.6170.4100114.1
390G27.5Very low32.1Very low72 Ų72137.5 Ų137.574%0.74284%0.838SS**  79.6140.8122.600000121.4
391L31.9Very low32.3Very low170 Ų170140.1 Ų140.189%0.8984%0.844SS**  trans7697.2158.8-50.5176.7000117.2
392C28.7Very low32.4Very low131 Ų131136.6 Ų136.689%0.88584%0.837SS**  trans-95.5129.1153.7-171.80000108
393L35.8Very low32.3Very low148 Ų148139.8 Ų139.878%0.77584%0.843SS**  trans-117.7141.5173.2-84.6164.2000108.6
394D34.3Very low32Very low168 Ų168141.6 Ų141.690%0.89885%0.845SS**  trans-59.2139.9-175.9-60.2-74.5000113.5
395A36.3Very low32.3Very low98 Ų98138.8 Ų138.881%0.8184%0.843SS**  trans-131.247-178.400000112.9
396E36.3Very low32.4Very low193 Ų193137.8 Ų137.890%0.90284%0.841SS**  trans-118.346.4172.4-74.9-154.313400113.5
397V42.8Very low32.4Very low147 Ų147138.3 Ų138.389%0.89185%0.845SS**  trans-140.764.5169.9-165.70000111.6
398A34.6Very low32.3Very low95 Ų95139.4 Ų139.479%0.78585%0.846SS**  trans-155.233.2-17900000117.5
399L38Very low32.3Very low185 Ų185136.6 Ų136.697%0.96984%0.838SS**  trans-135.165.6171.6-77.8178.6000113.2
400A37.3Very low32.4Very low95 Ų95135.6 Ų135.679%0.78583%0.833SS**SBendtrans-148.233.717500000115.1
401T33.6Very low32.5Very low149 Ų149140.5 Ų140.591%0.91484%0.836SS**  trans-159.113016110.30000109.7
402G29Very low32.2Very low72 Ų72138.5 Ų138.574%0.74284%0.837SS**  trans-97.6155.2-177.100000113.7
403Q30Very low32.3Very low197 Ų197137.8 Ų137.892%0.92183%0.833SS**  trans-158.7126.6156.3-111.1156.14.200110.5
404L30.6Very low32Very low168 Ų168136.3 Ų136.388%0.8884%0.835SS**  trans-78.2156.8168.9-68.2167.6000109.9
405P33.6Very low31.7Very low127 Ų127133 Ų13383%0.82583%0.832SS**  -128.6154.9121.635.3-28.2000113.2
406A29Very low31.3Very low94 Ų94132.9 Ų132.978%0.77783%0.83SS**  trans-86166.4-173.200000113.9
407S27Very low30.9Very low124 Ų124129 Ų12987%0.86783%0.825SS**  trans-151.4140.9156.6-78.30000111.8
408N25.3Very low30.2Very low160 Ų160129.8 Ų129.886%0.85682%0.818SS**  trans-65.6171.2172.8-64.2-31.8000111.1
409S28.9Very low29.9Very low84 Ų84133.9 Ų133.959%0.58782%0.819SS**  cis-161.2160.72.722.30000106.9
410H30.2Very low29.6Very low171 Ų171130.4 Ų130.479%0.79281%0.81SS**  -177.4168.979.1-90.7-78000112.2
411Q29.1Very low29.2Very low174 Ų174134.7 Ų134.781%0.81381%0.814SS**  trans-71150.4-169.7-59145.5-35.900115.4
412S26.8Very low29.1Very low129 Ų129133.2 Ų133.290%0.90281%0.809SS**  -176.5151.6116.4-80.10000113.9
413S29.5Very low29.5Very low116 Ų116141 Ų14181%0.81182%0.816SS**  trans-114.7158.2176.462.50000109.9
414S29.4Very low29.6Very low117 Ų117135 Ų13582%0.81881%0.808SS**  cis-149.9-165.414.3550000108.7
415A28.6Very low29.7Very low99 Ų99136.3 Ų136.382%0.81881%0.809SS**  cis-151.2-147.512.900000112.4
416A27.1Very low29.7Very low95 Ų95136.6 Ų136.679%0.78581%0.809SS**  trans-102.3150-168.600000115.7
417S28Very low30Very low112 Ų112137.8 Ų137.878%0.78381%0.809SS**  trans-152.1111.6135.453.30000112.9
418H28.4Very low30.1Very low163 Ų163138.2 Ų138.276%0.75581%0.811SS**  trans45.5127.3139.5-73.7-70000124.9
419F28.4Very low30.4Very low180 Ų180135.9 Ų135.979%0.78981%0.807SS**  trans69.3101.4137.6-82.9-67.7000120.6
420S31.2Very low30.4Very low112 Ų112140 Ų14078%0.78381%0.814SS**  154.6122.294.9-80.60000112.3
421E30Very low30.6Very low186 Ų186138 Ų13887%0.86981%0.81SS**  trans-89.8131.2174.8-173174.9-169.100109.7
422S31.5Very low30.9Very low118 Ų118135.3 Ų135.383%0.82580%0.801SS**  trans-144.8117.5170-171.10000110.7
423R36.8Very low31.5Very low234 Ų234137.4 Ų137.488%0.88380%0.796SS**  trans-79.3139.9168.8-80172.9155.5144.4-8.8109.6
424G32Very low32Very low73 Ų73139.1 Ų139.175%0.75380%0.796SS**  trans-160.4114.7167.900000109.7
425E33.4Very low32.6Very low194 Ų194142.1 Ų142.191%0.90780%0.797SS**  trans-80.7152.7-177.5-62.8165.3144.500111.1
426T33.3Very low33.1Very low133 Ų133146.2 Ų146.282%0.81680%0.8SS**  trans-122112.5173.1-35.40000109.4
427P35.1Very low33.6Very low120 Ų120148.7 Ų148.778%0.77980%0.8SS**PPolyproline II helixtrans-78.2129.9174.8-12.829000111.4
428C29.2Very low34.3Very low133 Ų133152.5 Ų152.590%0.89981%0.805SS**PPolyproline II helixtrans-82121.9164.6-62.80000109.1
429S30.8Very low34.9Very low111 Ų111153 Ų15378%0.77681%0.808SS**PPolyproline II helixtrans-95.9121.6166.4-162.20000108.9
430F30.1Very low35.5Very low170 Ų170153.5 Ų153.575%0.74681%0.812SS**PPolyproline II helixtrans-101118173.6-156.8-104000106.1D432F430-D432 VanDerWaalsContact CD1-OD2 3.25Å; F430-D432 WeakPolarHBondContact CD1-OD2 3.39Å; F430-D432 WeakPolarHBondContact CE1-OD1 3.49Å; F430-D432 VanDerWaalsContact CE1-OD2 3.24Å; F430-D432 WeakPolarHBondContact CE1-OD2 3.32Å
431N33.8Very low36.1Very low129 Ų129155.9 Ų155.969%0.6982%0.817SS**  trans-101.7103.4169.3-85.434.2000107
432D36.5Very low37.1Very low117 Ų117152.2 Ų152.263%0.62681%0.809SS**  trans-82.3126.7153.4-67.1-53.4000106.8F430F430-D432 VanDerWaalsContact CD1-OD2 3.25Å; F430-D432 WeakPolarHBondContact CD1-OD2 3.39Å; F430-D432 WeakPolarHBondContact CE1-OD1 3.49Å; F430-D432 VanDerWaalsContact CE1-OD2 3.24Å; F430-D432 WeakPolarHBondContact CE1-OD2 3.32Å
433E39.4Very low37.8Very low173 Ų173151.6 Ų151.681%0.80880%0.804SS**  trans-106.5108165.9-72.6-177.6156.300106.6E435E433-E435 PolarHBondContact O-N 2.76Å
434D39.5Very low38Very low152 Ų152145.9 Ų145.981%0.81380%0.8SS**  trans-73.7116.8172.2-64.6-61.1000108.9
435E41.3Very low39.1Very low180 Ų180148 Ų14884%0.84180%0.801SS**  trans-94.8111.8164.9-75.5-173.3145.600109.1E433 D437E433-E435 PolarHBondContact O-N 2.76Å; E435-D437 PolarHBondContact O-N 3.33Å
436E39.3Very low39.2Very low186 Ų186151.6 Ų151.687%0.86982%0.818SS**  trans-82.9100.2170.5-67.6-178.6144.700109.6
437D38.7Very low39.5Very low147 Ų147152.6 Ų152.679%0.78682%0.818SS**  trans-86104.6169.1-81.9-35.3000110.6E435 E439E435-D437 PolarHBondContact O-N 3.33Å; D437-E439 PolarHBondContact O-N 3.46Å
438E41.1Very low39.7Very low192 Ų192154.3 Ų154.390%0.89782%0.82SS**  trans-78.8103.6164.9-70.7-172.1142.700110.3
439E42.3Very low40.3Very low173 Ų173155.4 Ų155.481%0.80882%0.815SS**  trans-100.2105.2169.9-77.9-82.9-177.600110.4D437D437-E439 PolarHBondContact O-N 3.46Å
440E40.9Very low40.9Very low190 Ų190158.1 Ų158.189%0.88882%0.818SS**  trans-78.9115167.2-71.5-168.5144.300110.5
441D43.7Very low41.6Very low163 Ų163157.3 Ų157.387%0.87282%0.822SS**  trans-107.2139.3175.6-14816.3000110.9
442P50.3Low42.1Very low108 Ų108159.2 Ų159.270%0.70183%0.831SS**  trans-99.9159.6-162.637.2-34.2000116.4
443S46.1Very low42.5Very low105 Ų105162.2 Ų162.273%0.73485%0.846SS**  trans79.9103.9149.4174.10000121.4
444S40.8Very low42.7Very low114 Ų114161.4 Ų161.480%0.79785%0.849SS**  trans63.3163.3130.9-59.70000120
445P56.6Low43Very low117 Ų117162.2 Ų162.276%0.7685%0.852SS**  cis-135.716211.542.2-25.5000117.6
446E34.8Very low43.1Very low271 Ų271160.5 Ų160.5100%1.26685%0.853SS**  -1670123-108.5-171.7159.900110.6

Retrieved 446 of 446 residues in 111.3 ms (Link to these results)