A0A087XT14_POEFO Loading...

Paired like homeobox 2A

AlphaFold DB , UniProt , Accession A0A087XT14, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 301 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M41.5Very low53.1Low240 Ų240160.3 Ų160.3100%1.18277%0.77SS**  091.20-126.2150.282.500107.5
2Y44.3Very low53.1Low241 Ų241160 Ų16095%0.94576%0.757SS**  trans-82.3119.1178.2-85.8-88.2000108.6
3K49.6Very low53.3Low193 Ų193156.8 Ų156.884%0.83975%0.747SS**  trans-83.6114167-82.1172.5171.8175.90107.1
4M58.1Low54Low166 Ų166151.4 Ų151.482%0.81874%0.735SS**  trans-81.6117.8165.2-94.6-73.5-166.900107.3Y6M4-Y6 WeakPolarHBondContact O-CD2 3.37Å; M4-Y6 PolarHBondContact O-N 3.18Å
5D56.2Low54.1Low137 Ų137146.3 Ų146.373%0.73372%0.719SS**  trans-73.1111.8175.4-70.5-45.8000109.5S7D5-S7 PolarHBondContact O-N 3.31Å
6Y54.7Low54.9Low184 Ų184144.7 Ų144.772%0.72271%0.712SS**THydrogen-bonded Turntrans-74.925.2-176-96.8-93.5000114.3M4 Y8 L9M4-Y6 WeakPolarHBondContact O-CD2 3.37Å; M4-Y6 PolarHBondContact O-N 3.18Å; Y6-Y8 VanDerWaalsContact C-N 3.32Å; Y6-Y8 PolarHBondContact O-N 3.33Å; Y6-L9 HydrophobicContact CD1-CD1 3.73Å; Y6-L9 HydrophobicContact CE1-CD1 3.74Å
7S58.8Low55.2Low93 Ų93139.1 Ų139.165%0.6569%0.694SS**Hα-helixtrans-74.7-18.4-175.3520000114D5D5-S7 PolarHBondContact O-N 3.31Å
8Y54.4Low55.3Low192 Ų192134.6 Ų134.675%0.75368%0.682SS**Hα-helixtrans-77.4-24.6-178.6-163.8-102.5000113.8Y6Y6-Y8 VanDerWaalsContact C-N 3.32Å; Y6-Y8 PolarHBondContact O-N 3.33Å
9L55.3Low55.7Low110 Ų110135.2 Ų135.258%0.57668%0.684SS**Hα-helixtrans-75.2-27.6179.7-94.5163.3000113.2Y6 D13Y6-L9 HydrophobicContact CD1-CD1 3.73Å; Y6-L9 HydrophobicContact CE1-CD1 3.74Å; L9-D13 PolarHBondContact O-N 3.15Å
10N53.8Low55.8Low119 Ų119135.2 Ų135.264%0.63668%0.681SS**Hα-helixtrans-73.4-28.9-178-93.9-0.9000114.1S14N10-S14 WeakPolarHBondContact O-CB 3.43Å; N10-S14 PolarHBondContact O-N 3.3Å; N10-S14 VanDerWaalsContact O-N 3.13Å; N10-S14 PolarHBondContact O-OG 3.06Å; N10-S14 VanDerWaalsContact O-OG 3.07Å
11S57.9Low55.7Low88 Ų88131.9 Ų131.962%0.61568%0.675SS**Hα-helixtrans-75.6-30.2-179.5-168.90000112.4C15S11-C15 WeakPolarHBondContact O-CB 3.36Å; S11-C15 PolarHBondContact O-N 3.3Å
12Y52.4Low56.3Low157 Ų157125.4 Ų125.462%0.61665%0.653SS**Hα-helixtrans-77.5-39.7178.7-140.9-90.2000111.1C15 M16Y12-C15 PolarHBondContact O-N 3.49Å; Y12-M16 HydrophobicContact CD1-CG 4.39Å; Y12-M16 HydrophobicContact CD1-SD 4.25Å; Y12-M16 HydrophobicContact CE1-SD 4.26Å; Y12-M16 PolarHBondContact O-N 3.15Å
13D56.4Low56.6Low118 Ų118117.7 Ų117.763%0.63164%0.639SS**Hα-helixtrans-64.7-41.3176-151.8-98.8000111.6L9 C15 M16 A17L9-D13 PolarHBondContact O-N 3.15Å; D13-C15 PolarHBondContact O-N 3.2Å; D13-M16 PolarHBondContact O-N 3.13Å; D13-A17 WeakPolarHBondContact O-CB 3.43Å; D13-A17 PolarHBondContact O-N 2.94Å
14S62.5Low56.6Low82 Ų82116.9 Ų116.957%0.57363%0.632SS**Hα-helixtrans-67-34.3175.6-67.90000113.6N10 A18N10-S14 WeakPolarHBondContact O-CB 3.43Å; N10-S14 PolarHBondContact O-N 3.3Å; N10-S14 VanDerWaalsContact O-N 3.13Å; N10-S14 PolarHBondContact O-OG 3.06Å; N10-S14 VanDerWaalsContact O-OG 3.07Å; S14-A18 WeakPolarHBondContact O-CB 3.43Å; S14-A18 PolarHBondContact O-N 3.36Å; S14-A18 VanDerWaalsContact O-N 3.09Å
15C56.1Low56.1Low74 Ų74113.1 Ų113.150%0.563%0.628SS.*Hα-helixtrans-70.2-42.7176.2177.40000111.6S11 Y12 D13 A18 M19S11-C15 WeakPolarHBondContact O-CB 3.36Å; S11-C15 PolarHBondContact O-N 3.3Å; Y12-C15 PolarHBondContact O-N 3.49Å; D13-C15 PolarHBondContact O-N 3.2Å; C15-A18 PolarHBondContact O-N 3.24Å; C15-M19 PolarHBondContact O-N 3.25Å
16M67.1Low55.9Low121 Ų121114.2 Ų114.260%0.59663%0.633SS**Hα-helixtrans-68.5-39.4175.3-70.6-165.495.900111.9Y12 D13 A18 M19 E20Y12-M16 HydrophobicContact CD1-CG 4.39Å; Y12-M16 HydrophobicContact CD1-SD 4.25Å; Y12-M16 HydrophobicContact CE1-SD 4.26Å; Y12-M16 PolarHBondContact O-N 3.15Å; D13-M16 PolarHBondContact O-N 3.13Å; M16-A18 VanDerWaalsContact C-N 3.34Å; M16-A18 PolarHBondContact O-N 2.96Å; M16-M19 PolarHBondContact O-N 3.25Å; M16-E20 PolarHBondContact O-N 3.4Å
17A59.6Low55.4Low50 Ų50113.5 Ų113.541%0.41364%0.635SS.*Hα-helixtrans-63.7-36.3176.200000112.9D13 A21D13-A17 WeakPolarHBondContact O-CB 3.43Å; D13-A17 PolarHBondContact O-N 2.94Å; A17-A21 WeakPolarHBondContact O-CB 3.25Å; A17-A21 PolarHBondContact O-N 3.14Å
18A56.2Low54.9Low58 Ų58114.9 Ų114.948%0.47964%0.644SS.*Hα-helixtrans-70.3-34.3175.600000112.9S14 C15 M16 S22S14-A18 WeakPolarHBondContact O-CB 3.43Å; S14-A18 PolarHBondContact O-N 3.36Å; S14-A18 VanDerWaalsContact O-N 3.09Å; C15-A18 PolarHBondContact O-N 3.24Å; M16-A18 VanDerWaalsContact C-N 3.34Å; M16-A18 PolarHBondContact O-N 2.96Å; A18-S22 PolarHBondContact O-N 3.44Å; A18-S22 PolarHBondContact O-OG 3.22Å
19M63.7Low54.3Low146 Ų146111.5 Ų111.572%0.71965%0.648SS**Hα-helixtrans-70.4-38173.6-82.9-170.1175.300112.3C15 M16C15-M19 PolarHBondContact O-N 3.25Å; M16-M19 PolarHBondContact O-N 3.25Å
20E56.4Low53.5Low134 Ų134111.1 Ų111.163%0.62665%0.654SS**Hα-helixtrans-71.3-36.9175.2-85.3-174.1146.800113M16 S22 A23 Y24M16-E20 PolarHBondContact O-N 3.4Å; E20-S22 PolarHBondContact O-N 2.9Å; E20-A23 PolarHBondContact O-N 2.96Å; E20-A23 VanDerWaalsContact O-N 3.13Å; E20-Y24 PolarHBondContact O-N 3.26Å
21A54.5Low53.6Low67 Ų67110.8 Ų110.855%0.55466%0.661SS**Hα-helixtrans-63-30.6176.400000112.9A17 A23A17-A21 WeakPolarHBondContact O-CB 3.25Å; A17-A21 PolarHBondContact O-N 3.14Å; A21-A23 VanDerWaalsContact C-N 3.34Å
22S53.3Low52.8Low103 Ų103115.8 Ų115.872%0.7267%0.674SS**Hα-helixtrans-76.8-20.8177.6-55.20000113A18 E20A18-S22 PolarHBondContact O-N 3.44Å; A18-S22 PolarHBondContact O-OG 3.22Å; E20-S22 PolarHBondContact O-N 2.9Å
23A52.3Low52.8Low79 Ų79112.9 Ų112.965%0.65368%0.683SS**Hα-helixtrans-89.2-15.1179.600000113.6E20 A21E20-A23 PolarHBondContact O-N 2.96Å; E20-A23 VanDerWaalsContact O-N 3.13Å; A21-A23 VanDerWaalsContact C-N 3.34Å
24Y47.8Very low52Low176 Ų176111.6 Ų111.669%0.6968%0.683SS**Hα-helixtrans-108.3-5.6-176.8-86.4-81.8000115.3E20 D26E20-Y24 PolarHBondContact O-N 3.26Å; Y24-D26 PolarHBondContact O-N 2.91Å
25A49.3Very low51.6Low88 Ų88112.7 Ų112.773%0.72769%0.691SS**THydrogen-bonded Turntrans-72.9-5.3-178.800000114.8
26D50.7Low50.6Low159 Ų159118.6 Ų118.685%0.8571%0.709SS**THydrogen-bonded Turntrans-115.820.9-174.7-117.7-35.7000115.1Y24Y24-D26 PolarHBondContact O-N 2.91Å
27F44.8Very low49.2Very low170 Ų170121.5 Ų121.575%0.74672%0.721SS**  trans-141.664.8169.9-145.9-92.9000112.5
28S48.6Very low48.3Very low122 Ų122129.5 Ų129.585%0.85374%0.742SS**  trans-142.773164.7-870000111.1
29S41.9Very low47.4Very low120 Ų120133.5 Ų133.584%0.83976%0.755SS**SBendtrans-162.868.1149.1-170.20000112
30C38.8Very low47.3Very low102 Ų102130.9 Ų130.969%0.68975%0.749SS**  trans-157.951.6155.3690000112.7
31S55.6Low46.8Very low112 Ų112132 Ų13278%0.78376%0.757SS**  trans-93.3103157.153.10000108.5
32Q40.1Very low45.9Very low193 Ų193139.9 Ų139.990%0.90277%0.773SS**  trans-159.4103.5147-110.8173.9102.400109.5
33A52.8Low45.3Very low97 Ų97140 Ų14080%0.80277%0.774SS**  trans-74.8122.8158.300000107.6
34S39.8Very low44.6Very low91 Ų91139.8 Ų139.864%0.63678%0.779SS**  trans-171.8122.5148-80.30000110F36S34-F36 WeakPolarHBondContact O-CD2 3.43Å
35S54.1Low45.1Very low104 Ų104136.3 Ų136.373%0.72778%0.778SS**  trans-20.9130.7155.648.30000115.7
36F34.3Very low44.4Very low199 Ų199141.7 Ų141.787%0.87379%0.785SS**  trans-132.5106.9155.1-80.5-77.4000111.6S34S34-F36 WeakPolarHBondContact O-CD2 3.43Å
37Q39.2Very low44.4Very low182 Ų182139.3 Ų139.385%0.8578%0.781SS**  trans-62.4144.4158.6-74.9167.1-73.100110.1
38Y40.4Very low44.3Very low218 Ų218138.7 Ų138.786%0.85579%0.786SS**  trans8.2134.4155.2-78.9-96.4000118.9
39N36.1Very low44.2Very low141 Ų141138.6 Ų138.675%0.75478%0.782SS**  172.5-174.984.4-135.45.7000110.9
40P63.1Low43.8Very low91 Ų91136.5 Ų136.559%0.59178%0.78SS**  -129.4-179-114.943-22.9000116.4
41I45.2Very low43.9Very low157 Ų157137.9 Ų137.981%0.80579%0.789SS**  trans71.1109.1159.2-48.7-179.7000118.2
42R35.6Very low43.9Very low233 Ų233138.9 Ų138.988%0.87979%0.79SS**  -164.4127.3115.7-139.2164.5-176.3-97.33.4113.7
43S39.9Very low44.3Very low106 Ų106135.4 Ų135.474%0.74179%0.785SS**  trans-33.1144.6169.431.60000120.5
44G38.3Very low43.6Very low74 Ų74139.5 Ų139.576%0.76379%0.792SS**  trans139.3144140.300000115.7
45P58.1Low43.7Very low103 Ų103140.2 Ų140.267%0.66980%0.797SS**  trans-105.6160.5-135.737.7-29.6000112.9
46F34.8Very low43.7Very low201 Ų201142 Ų14288%0.88280%0.804SS**  -178.7143.1120.5-85.3-63.4000109.2
47S51.6Low44Very low110 Ų110137 Ų13777%0.76980%0.799SS**  trans-58.2138.5-162-49.40000115.9
48N42.1Very low44.1Very low157 Ų157133.4 Ų133.484%0.8479%0.794SS**  trans-153.8143.8142.7-96.2-26.5000110.7
49P46.1Very low43.9Very low120 Ų120129.3 Ų129.378%0.77980%0.796SS**PPolyproline II helixtrans-73.9129-170.629.7-32.8000111.3
50G35Very low44.5Very low76 Ų76128.7 Ų128.778%0.78480%0.797SS**PPolyproline II helixtrans-73.2131.6-178.600000113
51C40.7Very low44Very low131 Ų131133.1 Ų133.189%0.88582%0.815SS**PPolyproline II helixtrans-81.1124.4151.9-650000108.1
52T54.6Low43.8Very low132 Ų132129.2 Ų129.281%0.8181%0.813SS**PPolyproline II helixtrans-78.4141.6173.247.80000110.5
53P48.6Very low44Very low121 Ų121122.7 Ų122.779%0.78681%0.809SS**PPolyproline II helixtrans-79.7137174.230.7-31.9000111.2S55P53-S55 PolarHBondContact O-N 3.47Å
54L39.2Very low44.6Very low182 Ų182126 Ų12695%0.95382%0.818SS**  trans-62.4113174.5-127.875000109.8
55S41.8Very low45Very low107 Ų107133.8 Ų133.875%0.74882%0.824SS**  trans-84.5142.7165.8-173.20000110P53 A57P53-S55 PolarHBondContact O-N 3.47Å; S55-A57 PolarHBondContact O-N 3.45Å
56T53.8Low44.2Very low141 Ų141136.7 Ų136.787%0.86583%0.829SS**  trans-45.3108.6177-44.90000112.4
57A39.7Very low44.8Very low93 Ų93135.8 Ų135.877%0.76983%0.827SS**  trans-98.4113.1173.200000110.7S55S55-A57 PolarHBondContact O-N 3.45Å
58S42.8Very low44.3Very low107 Ų107137.8 Ų137.875%0.74882%0.824SS**  trans-61135.6165-169.90000110.6T60S58-T60 PolarHBondContact O-N 3.07Å
59C35.7Very low44.8Very low133 Ų133135.8 Ų135.890%0.89982%0.819SS**  trans-79.794.3179.4-54.30000110.4
60T49.1Very low45.1Very low127 Ų127136.3 Ų136.378%0.77982%0.821SS**  trans-98.9122.8162.745.40000110S58 G62S58-T60 PolarHBondContact O-N 3.07Å; T60-G62 PolarHBondContact O-N 3.08Å
61L52Low46.1Very low185 Ų185138.7 Ų138.797%0.96982%0.822SS**  trans-53.3112.8171.5-98.8131.9000110.5
62G40.8Very low46.4Very low74 Ų74142.9 Ų142.976%0.76382%0.821SS**  trans-81.6133.2172.600000111.7T60T60-G62 PolarHBondContact O-N 3.08Å
63A40.4Very low46.1Very low96 Ų96141.9 Ų141.979%0.79382%0.819SS**  trans-64.5152.5-172.600000115.5R65A63-R65 PolarHBondContact O-N 3.33Å
64L51.1Low46.6Very low176 Ų176140.5 Ų140.592%0.92181%0.813SS**  trans-18.6116.8153.8-96.9158.1000114
65R47.8Very low47.7Very low237 Ų237137.7 Ų137.789%0.89480%0.803SS**  trans-108.8114.4157.3-173.6169.9170177.9-3.9108.7A63A63-R65 PolarHBondContact O-N 3.33Å
66E40.1Very low48.3Very low164 Ų164137.9 Ų137.977%0.76680%0.801SS**  trans-45.9133.2177.1-161-155.1160.600113.7
67H47.9Very low48.1Very low182 Ų182141.2 Ų141.284%0.84380%0.8SS**  trans-82116.4172.4-91.4-85.4000110.6
68Q41.3Very low49.1Very low153 Ų153145.3 Ų145.372%0.71580%0.8SS**  trans-74.1132.3159.3-91.6-78.7-17.100110T70Q68-T70 PolarHBondContact O-N 3.37Å
69P51.4Low49.5Very low114 Ų114148.4 Ų148.474%0.7480%0.8SS**  trans-83115179.931.1-31000111.4
70T53Low49.9Very low131 Ų131150.6 Ų150.680%0.80480%0.795SS**  trans-80135.4166.753.40000110.2Q68Q68-T70 PolarHBondContact O-N 3.37Å
71P55.7Low50.2Low126 Ų126150.4 Ų150.482%0.81880%0.799SS**  trans-71.9134.3-176.328.5-32.6000111.9
72Y48.3Very low50Low220 Ų220147.8 Ų147.886%0.86379%0.786SS**  trans-33.6124.7170.2-122.1-112000114.3
73S47.8Very low50.8Low110 Ų110149.9 Ų149.977%0.76979%0.786SS**  trans-10896.8151.3-168.90000107.3V75S73-V75 PolarHBondContact O-N 3.4Å; S73-V75 VanDerWaalsContact O-N 3.13Å
74S58Low51.3Low92 Ų92150 Ų15064%0.64378%0.781SS**  trans-69.398.3173.250.20000109.4
75V62.4Low51.4Low124 Ų124145.3 Ų145.375%0.75278%0.775SS**  trans-77.6130.7158.9-73.10000108.9S73 Y77S73-V75 PolarHBondContact O-N 3.4Å; S73-V75 VanDerWaalsContact O-N 3.13Å; V75-Y77 PolarHBondContact O-N 3.17Å; V75-Y77 VanDerWaalsContact O-N 3.15Å
76P55.6Low51.7Low110 Ų110141.1 Ų141.171%0.71477%0.77SS**  trans-73.1110.3-172.828.6-32.3000110.1K78P76-K78 VanDerWaalsContact C-N 3.34Å; P76-K78 HydrophobicContact CB-CG 4.5Å; P76-K78 PolarHBondContact O-N 2.93Å
77Y49.2Very low52.1Low212 Ų212140.9 Ų140.983%0.83177%0.774SS**  trans-67.793.5167.6-164.3-95.9000108.5V75V75-Y77 PolarHBondContact O-N 3.17Å; V75-Y77 VanDerWaalsContact O-N 3.15Å
78K61.3Low52.5Low179 Ų179139.9 Ų139.978%0.77877%0.769SS**  trans-114.1111.4165.2-58.5-62.6-177.6-1760107.9P76P76-K78 VanDerWaalsContact C-N 3.34Å; P76-K78 HydrophobicContact CB-CG 4.5Å; P76-K78 PolarHBondContact O-N 2.93Å
79F49.6Very low53.2Low171 Ų171142 Ų14275%0.7578%0.776SS**  trans75.288.7136.6-148-90.2000116.9
80F45.9Very low53.5Low179 Ų179147.2 Ų147.279%0.78578%0.781SS**  trans-155.985.5134.4-83.1-68.5000109.1
81S55.3Low54Low124 Ų124150.6 Ų150.687%0.86779%0.785SS**  trans-76.4109.3147.5-69.50000106.5
82D47.3Very low55Low129 Ų129151.4 Ų151.469%0.6978%0.777SS**  trans-135.2113.2157.7-162.2-12.7000109.4S84D82-S84 PolarHBondContact O-N 2.97Å
83P57.6Low56.7Low118 Ų118151.4 Ų151.477%0.76678%0.776SS**  trans-86.380.5-178.734.8-33.6000110.6
84S51.6Low58.4Low99 Ų99157 Ų15769%0.69278%0.78SS**  trans-159.591170.3-79.50000114.3D82 L86D82-S84 PolarHBondContact O-N 2.97Å; S84-L86 PolarHBondContact O-N 2.73Å
85G52.2Low59.8Low77 Ų77159.4 Ų159.479%0.79478%0.784SS**  78.712.3121.700000122.7
86L54.6Low61.2Low149 Ų149164 Ų16478%0.7879%0.788SS**  trans-112.430.3-175.5-60.9-175.2000116.7S84S84-L86 PolarHBondContact O-N 2.73Å
87N48.9Very low63Low159 Ų159161 Ų16185%0.8577%0.768SS**  trans-96.216.7176.7-68.1-43000114.9K89N87-K89 VanDerWaalsContact C-N 3.27Å; N87-K89 PolarHBondContact O-N 2.93Å
88E56.1Low65.2Low161 Ų161156.7 Ų156.775%0.75276%0.764SS**THydrogen-bonded Turntrans-87.324.8-178.7-146.966.4-133.100114
89K55Low66.9Low198 Ų198151.2 Ų151.286%0.86174%0.74SS**THydrogen-bonded Turntrans-97.59.7176.8-69.1174-179.21710113.3N87 K91N87-K89 VanDerWaalsContact C-N 3.27Å; N87-K89 PolarHBondContact O-N 2.93Å; K89-K91 PolarHBondContact O-N 2.78Å; K89-K91 VanDerWaalsContact O-N 3.16Å
90R59Low69.2Low224 Ų224146.7 Ų146.785%0.84573%0.727SS**SBendtrans-83.784.7170.2-174.1177.9-77.7152.5-4.3108.9Q92R90-Q92 PolarHBondContact O-N 3.23Å
91K63.2Low71.7Confident201 Ų201142.2 Ų142.287%0.87472%0.717SS**  trans4.283.9167.1-78.6164.8176.6171.70113.8K89 R93K89-K91 PolarHBondContact O-N 2.78Å; K89-K91 VanDerWaalsContact O-N 3.16Å; K91-R93 PolarHBondContact O-N 2.84Å
92Q76.3Confident73.7Confident143 Ų143140.6 Ų140.667%0.66871%0.706SS**  trans-61.9113.3175.2-175.462.98.800108.1R90 R94R90-Q92 PolarHBondContact O-N 3.23Å; Q92-R94 PolarHBondContact O-N 3.15Å
93R83.1Confident76.1Confident221 Ų221135.9 Ų135.983%0.83468%0.68SS**PPolyproline II helixtrans-62.4130.8178.3-169175.1-178.7-1344.1107.9K91 I95K91-R93 PolarHBondContact O-N 2.84Å; R93-I95 PolarHBondContact O-N 3.23Å
94R83.4Confident78.1Confident228 Ų228133 Ų13386%0.8666%0.658SS**PPolyproline II helixtrans-53.8129.4178-68.6-173.2-170.8-161.43.4109.3Q92 R96Q92-R94 PolarHBondContact O-N 3.15Å; R94-R96 PolarHBondContact O-N 3.09Å
95I88.2Confident80.3Confident141 Ų141135 Ų13572%0.72365%0.654SS**PPolyproline II helixtrans-61.4133.2178.4-56.3-59.9000108.8R93R93-I95 PolarHBondContact O-N 3.23Å
96R92.3Very high82.5Confident222 Ų222132.9 Ų132.984%0.83862%0.623SS**PPolyproline II helixtrans-81.9133.2179.3-175.1178.4178.7-169.50109.3R94R94-R96 PolarHBondContact O-N 3.09Å
97T92.6Very high84.6Confident46 Ų46125.8 Ų125.828%0.28259%0.586SS.*PPolyproline II helixtrans-71.4130.1170.9-47.20000110F99 L131 R135T97-F99 HydrophobicContact CG2-CD1 4.35Å; T97-F99 HydrophobicContact CG2-CE1 3.95Å; T97-F99 HydrophobicContact CG2-CZ 4.41Å; T97-L131 HydrophobicContact CG2-CD2 4.07Å; T97-R135 VanDerWaalsContact OG1-CD 3.23Å; T97-R135 WeakPolarHBondContact OG1-CD 3.41Å
98T95.3Very high86.9Confident122 Ų122122.4 Ų122.475%0.74857%0.565SS**  trans-105.4126.4169.8520000108.6
99F97.3Very high88.9Confident64 Ų64119.8 Ų119.828%0.28155%0.548SS..  trans-88138.7179.8-55-68.9000110.5T97 L104 L131 W139T97-F99 HydrophobicContact CG2-CD1 4.35Å; T97-F99 HydrophobicContact CG2-CE1 3.95Å; T97-F99 HydrophobicContact CG2-CZ 4.41Å; F99-L104 HydrophobicContact CB-CD1 4.49Å; F99-L104 HydrophobicContact CB-CD2 3.72Å; F99-L104 HydrophobicContact CB-CG 3.86Å; F99-L104 HydrophobicContact CD2-CD2 4.23Å; F99-L104 HydrophobicContact CG-CD2 4.18Å; F99-L131 HydrophobicContact CD1-CD1 3.6Å; F99-L131 HydrophobicContact CD1-CD2 4.41Å; F99-L131 HydrophobicContact CE1-CD1 3.53Å; F99-L131 HydrophobicContact CE1-CD2 4.34Å; F99-W139 AromaticContact CD2-CD1 3.82Å; F99-W139 AromaticContact CE2-CD1 3.55Å; F99-W139 HydrophobicContact CE2-CG 4.48Å; F99-W139 HydrophobicContact CZ-CB 4.35Å; F99-W139 AromaticContact CZ-CD1 3.96Å
100T98.3Very high91Very high76 Ų76110.5 Ų110.547%0.46651%0.508SS..  trans-74.8162.5171.276.30000110.5S102 Q103 L104T100-S102 VanDerWaalsContact C-N 3.29Å; T100-S102 PolarHBondContact O-N 2.8Å; T100-Q103 PolarHBondContact O-N 2.86Å; T100-Q103 VanDerWaalsContact OG1-CG 3.27Å; T100-Q103 WeakPolarHBondContact OG1-CG 3.41Å; T100-Q103 PolarHBondContact OG1-N 3.37Å; T100-L104 WeakPolarHBondContact O-CG 3.35Å; T100-L104 PolarHBondContact O-N 2.93Å; T100-L104 VanDerWaalsContact O-N 3.08Å
101S97.8Very high92.8Very high84 Ų84100.4 Ų100.459%0.58747%0.471SS*.Hα-helixtrans-59-40.5177.8-1780000112.3Q103 L104 K105S101-Q103 PolarHBondContact O-N 3.03Å; S101-L104 PolarHBondContact O-N 3.16Å; S101-K105 WeakPolarHBondContact O-CG 3.47Å; S101-K105 PolarHBondContact O-N 3.27Å
102S97.8Very high94.5Very high91 Ų9194.9 Ų94.964%0.63646%0.463SS*.Hα-helixtrans-62-44.6177.6-169.50000112.1T100 L104 K105 E106T100-S102 VanDerWaalsContact C-N 3.29Å; T100-S102 PolarHBondContact O-N 2.8Å; S102-L104 VanDerWaalsContact C-N 3.34Å; S102-L104 PolarHBondContact O-N 3.02Å; S102-K105 PolarHBondContact O-N 3.19Å; S102-E106 PolarHBondContact O-N 3.41Å
103Q98.1Very high95.5Very high29 Ų2994.3 Ų94.314%0.13646%0.46CS..Hα-helixtrans-61.7-42.3177.7-65172.9-31.200111.6T100 S101 E106 L107 I129T100-Q103 PolarHBondContact O-N 2.86Å; T100-Q103 VanDerWaalsContact OG1-CG 3.27Å; T100-Q103 WeakPolarHBondContact OG1-CG 3.41Å; T100-Q103 PolarHBondContact OG1-N 3.37Å; S101-Q103 PolarHBondContact O-N 3.03Å; Q103-E106 PolarHBondContact O-N 3.15Å; Q103-L107 WeakPolarHBondContact O-CB 3.25Å; Q103-L107 WeakPolarHBondContact O-CD1 3.44Å; Q103-L107 VanDerWaalsContact O-CG 3.24Å; Q103-L107 WeakPolarHBondContact O-CG 3.46Å; Q103-L107 PolarHBondContact O-N 3.07Å; Q103-I129 HydrophobicContact CB-CB 4.41Å; Q103-I129 HydrophobicContact CG-CB 4.08Å; Q103-I129 PolarHBondContact NE2-O 2.82Å
104L98.3Very high96.2Very high57 Ų5786.5 Ų86.530%0.29844%0.437SS..Hα-helixtrans-63.4-40.7177.5-68.8175.4000112.1F99 T100 S101 S102 E106 L107 E108 W139F99-L104 HydrophobicContact CB-CD1 4.49Å; F99-L104 HydrophobicContact CB-CD2 3.72Å; F99-L104 HydrophobicContact CB-CG 3.86Å; F99-L104 HydrophobicContact CD2-CD2 4.23Å; F99-L104 HydrophobicContact CG-CD2 4.18Å; T100-L104 WeakPolarHBondContact O-CG 3.35Å; T100-L104 PolarHBondContact O-N 2.93Å; T100-L104 VanDerWaalsContact O-N 3.08Å; S101-L104 PolarHBondContact O-N 3.16Å; S102-L104 VanDerWaalsContact C-N 3.34Å; S102-L104 PolarHBondContact O-N 3.02Å; L104-E106 PolarHBondContact O-N 3.02Å; L104-L107 PolarHBondContact O-N 3.48Å; L104-E108 WeakPolarHBondContact O-CB 3.47Å; L104-E108 VanDerWaalsContact O-CG 3.31Å; L104-E108 WeakPolarHBondContact O-CG 3.22Å; L104-E108 PolarHBondContact O-N 3.45Å; L104-W139 HydrophobicContact CD2-CZ2 4.37Å; L104-W139 VanDerWaalsContact CD2-NE1 3.32Å
105K98.3Very high96.9Very high142 Ų14278.9 Ų78.962%0.61741%0.411SS*.Hα-helixtrans-59.3-45.6177.3-73.2176.4-178.4-176.80112S101 S102 E108 R109S101-K105 WeakPolarHBondContact O-CG 3.47Å; S101-K105 PolarHBondContact O-N 3.27Å; S102-K105 PolarHBondContact O-N 3.19Å; K105-E108 PolarHBondContact O-N 3.05Å; K105-R109 WeakPolarHBondContact O-CB 3.27Å; K105-R109 PolarHBondContact O-N 3.4Å
106E98.1Very high97.3Very high33 Ų3379.8 Ų79.815%0.15441%0.406CS..Hα-helixtrans-67.3-40.9179.6-169.163.5-153.700111.8S102 Q103 L104 E108 R109 V110 L125 K128 I129S102-E106 PolarHBondContact O-N 3.41Å; Q103-E106 PolarHBondContact O-N 3.15Å; L104-E106 PolarHBondContact O-N 3.02Å; E106-E108 VanDerWaalsContact C-N 3.34Å; E106-E108 PolarHBondContact O-N 3.12Å; E106-R109 WeakPolarHBondContact O-CB 3.34Å; E106-R109 PolarHBondContact O-N 2.79Å; E106-R109 IonicContact OE1-CZ 3.31Å; E106-R109 VanDerWaalsContact OE1-CZ 3.25Å; E106-R109 IonicContact OE1-NE 2.78Å; E106-R109 PolarHBondContact OE1-NE 2.92Å; E106-R109 IonicContact OE1-NH2 2.93Å; E106-R109 PolarHBondContact OE1-NH2 3.04Å; E106-R109 IonicContact OE2-NE 3.49Å; E106-V110 PolarHBondContact O-N 3.14Å; E106-L125 HydrophobicContact CG-CD2 3.78Å; E106-K128 HydrophobicContact CG-CD 4.13Å; E106-K128 WeakPolarHBondContact OE1-CE 3.27Å; E106-K128 IonicContact OE1-NZ 3.37Å; E106-K128 PolarHBondContact OE1-NZ 2.81Å; E106-K128 IonicContact OE2-NZ 2.63Å; E106-K128 PolarHBondContact OE2-NZ 2.94Å; E106-I129 HydrophobicContact CB-CG2 3.8Å; E106-I129 HydrophobicContact CG-CG2 3.76Å
107L98.4Very high97.6Very high0 Ų069.5 Ų69.50%037%0.368CS..Hα-helixtrans-62.3-41174.9-72166.4000112Q103 L104 F111 I129 V136 W139 F140Q103-L107 WeakPolarHBondContact O-CB 3.25Å; Q103-L107 WeakPolarHBondContact O-CD1 3.44Å; Q103-L107 VanDerWaalsContact O-CG 3.24Å; Q103-L107 WeakPolarHBondContact O-CG 3.46Å; Q103-L107 PolarHBondContact O-N 3.07Å; L104-L107 PolarHBondContact O-N 3.48Å; L107-F111 WeakPolarHBondContact O-CB 3.38Å; L107-F111 PolarHBondContact O-N 3.39Å; L107-I129 HydrophobicContact CD1-CD1 4.08Å; L107-I129 HydrophobicContact CD2-CD1 3.69Å; L107-I129 HydrophobicContact CG-CD1 3.74Å; L107-V136 HydrophobicContact CD2-CG1 3.96Å; L107-V136 HydrophobicContact CD2-CG2 4.43Å; L107-W139 HydrophobicContact CB-CD2 4.11Å; L107-W139 HydrophobicContact CB-CE3 3.99Å; L107-W139 HydrophobicContact CB-CH2 3.68Å; L107-W139 HydrophobicContact CB-CZ2 3.78Å; L107-W139 HydrophobicContact CB-CZ3 3.79Å; L107-W139 HydrophobicContact CD1-CD2 3.88Å; L107-W139 HydrophobicContact CD1-CE3 4.45Å; L107-W139 HydrophobicContact CD1-CG 3.92Å; L107-W139 HydrophobicContact CD1-CZ2 4.49Å; L107-W139 HydrophobicContact CD2-CD2 4.42Å; L107-W139 HydrophobicContact CD2-CE3 4.23Å; L107-W139 HydrophobicContact CG-CD2 4.37Å; L107-W139 HydrophobicContact CG-CE3 4.46Å; L107-F140 HydrophobicContact CD2-CD2 4.49Å; L107-F140 HydrophobicContact CD2-CE2 3.87Å
108E98.3Very high97.9Very high87 Ų8771.8 Ų71.841%0.40738%0.379SS..Hα-helixtrans-70.6-35.6176.9-73.5-177.8165.100112.3L104 K105 E106 F111 A112 W139 R143L104-E108 WeakPolarHBondContact O-CB 3.47Å; L104-E108 VanDerWaalsContact O-CG 3.31Å; L104-E108 WeakPolarHBondContact O-CG 3.22Å; L104-E108 PolarHBondContact O-N 3.45Å; K105-E108 PolarHBondContact O-N 3.05Å; E106-E108 VanDerWaalsContact C-N 3.34Å; E106-E108 PolarHBondContact O-N 3.12Å; E108-F111 PolarHBondContact O-N 3.34Å; E108-A112 PolarHBondContact O-N 3.41Å; E108-W139 HydrophobicContact CG-CH2 3.85Å; E108-W139 HydrophobicContact CG-CZ2 3.97Å; E108-R143 IonicContact OE1-NH1 3.57Å
109R98.2Very high98Very high106 Ų10668.7 Ų68.740%0.436%0.357SS..Hα-helixtrans-56.5-52173.2-173.5-16867.274.3-0.7110.9K105 E106 F111 A112 E113K105-R109 WeakPolarHBondContact O-CB 3.27Å; K105-R109 PolarHBondContact O-N 3.4Å; E106-R109 WeakPolarHBondContact O-CB 3.34Å; E106-R109 PolarHBondContact O-N 2.79Å; E106-R109 IonicContact OE1-CZ 3.31Å; E106-R109 VanDerWaalsContact OE1-CZ 3.25Å; E106-R109 IonicContact OE1-NE 2.78Å; E106-R109 PolarHBondContact OE1-NE 2.92Å; E106-R109 IonicContact OE1-NH2 2.93Å; E106-R109 PolarHBondContact OE1-NH2 3.04Å; E106-R109 IonicContact OE2-NE 3.49Å; R109-F111 VanDerWaalsContact C-N 3.33Å; R109-F111 PolarHBondContact O-N 3.1Å; R109-A112 WeakPolarHBondContact O-CB 3.38Å; R109-A112 PolarHBondContact O-N 3.44Å; R109-E113 IonicContact CZ-OE1 2.75Å; R109-E113 IonicContact NH1-OE1 3.69Å; R109-E113 PolarHBondContact NH1-OE1 3.49Å; R109-E113 IonicContact NH1-OE2 2.92Å; R109-E113 PolarHBondContact NH1-OE2 2.63Å; R109-E113 PolarHBondContact O-N 3.24Å
110V97.9Very high98Very high3 Ų373.6 Ų73.62%0.01838%0.375CS..Hα-helixtrans-69.4-32.6178.8176.50000111.9E106 A112 E113 T114 P117 T121 L125 F140E106-V110 PolarHBondContact O-N 3.14Å; V110-A112 PolarHBondContact O-N 3.36Å; V110-E113 WeakPolarHBondContact O-CB 3.46Å; V110-E113 PolarHBondContact O-N 3.49Å; V110-E113 VanDerWaalsContact O-N 3.09Å; V110-T114 HydrophobicContact CG1-CG2 4.4Å; V110-T114 PolarHBondContact O-N 2.72Å; V110-P117 HydrophobicContact CG1-CB 4.42Å; V110-T121 HydrophobicContact CG1-CG2 4.22Å; V110-L125 HydrophobicContact CB-CD1 3.88Å; V110-L125 HydrophobicContact CG1-CD1 3.87Å; V110-L125 HydrophobicContact CG2-CD1 3.84Å; V110-L125 HydrophobicContact CG2-CD2 3.75Å; V110-L125 HydrophobicContact CG2-CG 4.14Å; V110-F140 HydrophobicContact CB-CZ 4.27Å; V110-F140 HydrophobicContact CG1-CZ 4.09Å
111F98.3Very high98Very high13 Ų1372.4 Ų72.46%0.05737%0.368CS..Hα-helixtrans-61.3-34.6174.2-171.7-95.6000112.5L107 E108 R109 E113 T114 H115 W139 F140 R143 R144 F147L107-F111 WeakPolarHBondContact O-CB 3.38Å; L107-F111 PolarHBondContact O-N 3.39Å; E108-F111 PolarHBondContact O-N 3.34Å; R109-F111 VanDerWaalsContact C-N 3.33Å; R109-F111 PolarHBondContact O-N 3.1Å; F111-E113 VanDerWaalsContact C-N 3.3Å; F111-T114 CarbonylContact O-C 3.45Å; F111-H115 AromaticContact CD1-CD2 3.57Å; F111-H115 AromaticContact CD1-NE2 3.92Å; F111-H115 AromaticContact CD2-CD2 3.89Å; F111-H115 AromaticContact CE1-CD2 3.16Å; F111-H115 WeakPolarHBondContact CE1-CD2 3.5Å; F111-H115 AromaticContact CE1-NE2 3.37Å; F111-H115 WeakPolarHBondContact CE1-NE2 3.46Å; F111-H115 HydrophobicContact CE2-CB 4.09Å; F111-H115 AromaticContact CE2-CD2 3.51Å; F111-H115 AromaticContact CG-CD2 3.92Å; F111-H115 HydrophobicContact CZ-CB 4.35Å; F111-H115 AromaticContact CZ-CD2 3.13Å; F111-H115 WeakPolarHBondContact CZ-CD2 3.43Å; F111-H115 AromaticContact CZ-CG 3.89Å; F111-H115 AromaticContact CZ-NE2 3.71Å; F111-H115 PolarHBondContact O-CD2 2.92Å; F111-W139 HydrophobicContact CB-CH2 4.5Å; F111-W139 HydrophobicContact CB-CZ3 4.33Å; F111-W139 HydrophobicContact CD2-CZ3 4.46Å; F111-F140 HydrophobicContact CB-CE1 4Å; F111-F140 AromaticContact CD2-CD1 3.82Å; F111-F140 HydrophobicContact CD2-CD1 3.82Å; F111-F140 AromaticContact CD2-CE1 3.8Å; F111-F140 HydrophobicContact CD2-CE1 3.8Å; F111-F140 HydrophobicContact CG-CE1 4.41Å; F111-R143 HydrophobicContact CD1-CG 4.05Å; F111-R143 HydrophobicContact CD2-CB 4.25Å; F111-R143 HydrophobicContact CD2-CG 3.56Å; F111-R143 HydrophobicContact CE1-CG 3.92Å; F111-R143 HydrophobicContact CE2-CB 4.03Å; F111-R143 HydrophobicContact CE2-CG 3.42Å; F111-R143 VanDerWaalsContact CE2-CG 3.42Å; F111-R143 HydrophobicContact CG-CG 3.88Å; F111-R143 HydrophobicContact CZ-CG 3.61Å; F111-R144 HydrophobicContact CE2-CG 3.86Å; F111-R144 HydrophobicContact CZ-CG 4.43Å; F111-F147 HydrophobicContact CE1-CD2 4.42Å; F111-F147 HydrophobicContact CZ-CB 4.34Å
112A97.9Very high98.1Very high85 Ų8570.6 Ų70.670%0.70235%0.348SS*.Hα-helixtrans-67.9-29.6175.100000112.8E108 R109 V110E108-A112 PolarHBondContact O-N 3.41Å; R109-A112 WeakPolarHBondContact O-CB 3.38Å; R109-A112 PolarHBondContact O-N 3.44Å; V110-A112 PolarHBondContact O-N 3.36Å
113E97.5Very high98.1Very high131 Ų13170.6 Ų70.661%0.61234%0.338SS*.Hα-helixtrans-78.3-47.4175-68.3168.8-167.400111.5R109 V110 F111R109-E113 IonicContact CZ-OE1 2.75Å; R109-E113 IonicContact NH1-OE1 3.69Å; R109-E113 PolarHBondContact NH1-OE1 3.49Å; R109-E113 IonicContact NH1-OE2 2.92Å; R109-E113 PolarHBondContact NH1-OE2 2.63Å; R109-E113 PolarHBondContact O-N 3.24Å; V110-E113 WeakPolarHBondContact O-CB 3.46Å; V110-E113 PolarHBondContact O-N 3.49Å; V110-E113 VanDerWaalsContact O-N 3.09Å; F111-E113 VanDerWaalsContact C-N 3.3Å
114T97.5Very high98.1Very high56 Ų5675.9 Ų75.934%0.34436%0.362SS..  trans-149.4130.3177178.30000112.1V110 F111 Y116 P117V110-T114 HydrophobicContact CG1-CG2 4.4Å; V110-T114 PolarHBondContact O-N 2.72Å; F111-T114 CarbonylContact O-C 3.45Å; T114-Y116 PolarHBondContact O-N 2.92Å; T114-Y116 PolarHBondContact OG1-N 2.75Å; T114-Y116 VanDerWaalsContact OG1-N 3.15Å; T114-Y116 PolarHBondContact OG1-O 3.4Å; T114-P117 HydrophobicContact CG2-CB 4.11Å
115H97.8Very high98.1Very high69 Ų6973.4 Ų73.432%0.31935%0.35SS..SBendtrans-72.2-19.1173.1-60.5142.9000112.9F111 R144F111-H115 AromaticContact CD1-CD2 3.57Å; F111-H115 AromaticContact CD1-NE2 3.92Å; F111-H115 AromaticContact CD2-CD2 3.89Å; F111-H115 AromaticContact CE1-CD2 3.16Å; F111-H115 WeakPolarHBondContact CE1-CD2 3.5Å; F111-H115 AromaticContact CE1-NE2 3.37Å; F111-H115 WeakPolarHBondContact CE1-NE2 3.46Å; F111-H115 HydrophobicContact CE2-CB 4.09Å; F111-H115 AromaticContact CE2-CD2 3.51Å; F111-H115 AromaticContact CG-CD2 3.92Å; F111-H115 HydrophobicContact CZ-CB 4.35Å; F111-H115 AromaticContact CZ-CD2 3.13Å; F111-H115 WeakPolarHBondContact CZ-CD2 3.43Å; F111-H115 AromaticContact CZ-CG 3.89Å; F111-H115 AromaticContact CZ-NE2 3.71Å; F111-H115 PolarHBondContact O-CD2 2.92Å; H115-R144 HydrophobicContact CB-CG 4.45Å; H115-R144 VanDerWaalsContact O-CD 3.27Å; H115-R144 WeakPolarHBondContact O-CD 3.36Å; H115-R144 PolarHBondContact O-NH1 3.37Å
116Y98.2Very high98.1Very high159 Ų15967 Ų6762%0.62432%0.323SS*.SBendtrans-127.472.2-176.8-64.3-89.1000110.3T114T114-Y116 PolarHBondContact O-N 2.92Å; T114-Y116 PolarHBondContact OG1-N 2.75Å; T114-Y116 VanDerWaalsContact OG1-N 3.15Å; T114-Y116 PolarHBondContact OG1-O 3.4Å
117P97.6Very high98.1Very high7 Ų772.2 Ų72.25%0.04535%0.351CS..  trans-66.1141.5177.628.8-36.5000110.9V110 T114 T121 R122 F140V110-P117 HydrophobicContact CG1-CB 4.42Å; T114-P117 HydrophobicContact CG2-CB 4.11Å; P117-T121 HydrophobicContact CB-CG2 4.11Å; P117-R122 HydrophobicContact CB-CG 4.04Å; P117-R122 HydrophobicContact CG-CG 3.83Å; P117-R122 PolarHBondContact O-NH1 2.86Å; P117-F140 HydrophobicContact CG-CD1 3.64Å; P117-F140 HydrophobicContact CG-CD2 4.07Å; P117-F140 HydrophobicContact CG-CE1 3.56Å; P117-F140 HydrophobicContact CG-CE2 4.01Å; P117-F140 HydrophobicContact CG-CG 3.91Å; P117-F140 HydrophobicContact CG-CZ 3.77Å
118D98.3Very high98Very high94 Ų9478 Ų7850%0.50338%0.377SS..  trans-72.2167177.4-169.522.3000112.1Y120 T121 R122D118-Y120 VanDerWaalsContact C-N 3.31Å; D118-Y120 PolarHBondContact O-N 3.43Å; D118-T121 PolarHBondContact O-N 3.25Å; D118-R122 WeakPolarHBondContact O-CG 3.23Å; D118-R122 PolarHBondContact O-N 3.34Å
119I97.9Very high98Very high57 Ų5774.5 Ų74.529%0.29236%0.36SS..Hα-helixtrans-52-48179.7-174.261.2000111.8T121 R122 E123 E133I119-T121 PolarHBondContact O-N 3.02Å; I119-R122 VanDerWaalsContact CD1-NH2 3.33Å; I119-R122 PolarHBondContact O-N 3.18Å; I119-R122 VanDerWaalsContact O-N 3.14Å; I119-E123 HydrophobicContact CD1-CG 4.38Å; I119-E123 HydrophobicContact CG1-CG 4.48Å; I119-E123 WeakPolarHBondContact O-CG 3.45Å; I119-E123 PolarHBondContact O-N 3.09Å; I119-E133 HydrophobicContact CD1-CG 4Å; I119-E133 WeakPolarHBondContact CD1-OE1 3.49Å
120Y98.3Very high98Very high167 Ų16776.4 Ų76.466%0.65538%0.378SS*.Hα-helixtrans-63-43.7-179.2-60.1-66.8000112.3D118 R122 E123 E124D118-Y120 VanDerWaalsContact C-N 3.31Å; D118-Y120 PolarHBondContact O-N 3.43Å; Y120-R122 VanDerWaalsContact C-N 3.3Å; Y120-R122 PolarHBondContact O-N 3.23Å; Y120-E123 PolarHBondContact O-N 3.13Å; Y120-E124 PolarHBondContact O-N 3.47Å
121T97.9Very high97.9Very high51 Ų5177.8 Ų77.831%0.31339%0.385SS..Hα-helixtrans-63.7-36.9176.4-48.20000111.6V110 P117 D118 I119 L125V110-T121 HydrophobicContact CG1-CG2 4.22Å; P117-T121 HydrophobicContact CB-CG2 4.11Å; D118-T121 PolarHBondContact O-N 3.25Å; I119-T121 PolarHBondContact O-N 3.02Å; T121-L125 WeakPolarHBondContact O-CB 3.44Å; T121-L125 WeakPolarHBondContact O-CG 3.45Å; T121-L125 PolarHBondContact O-N 3.33Å
122R98.5Very high97.9Very high46 Ų4681.2 Ų81.217%0.17441%0.407CS..Hα-helixtrans-70.2-37.5176.5-67.2-167.9-50.6-87.6-1112P117 D118 I119 Y120 A126 E133 V136P117-R122 HydrophobicContact CB-CG 4.04Å; P117-R122 HydrophobicContact CG-CG 3.83Å; P117-R122 PolarHBondContact O-NH1 2.86Å; D118-R122 WeakPolarHBondContact O-CG 3.23Å; D118-R122 PolarHBondContact O-N 3.34Å; I119-R122 VanDerWaalsContact CD1-NH2 3.33Å; I119-R122 PolarHBondContact O-N 3.18Å; I119-R122 VanDerWaalsContact O-N 3.14Å; Y120-R122 VanDerWaalsContact C-N 3.3Å; Y120-R122 PolarHBondContact O-N 3.23Å; R122-A126 VanDerWaalsContact O-CB 3.25Å; R122-A126 WeakPolarHBondContact O-CB 3.13Å; R122-A126 PolarHBondContact O-N 3.46Å; R122-E133 HydrophobicContact CB-CG 4.05Å; R122-E133 IonicContact CZ-OE1 3.86Å; R122-E133 VanDerWaalsContact CZ-OE1 3.31Å; R122-E133 IonicContact NE-OE1 2.72Å; R122-E133 PolarHBondContact NE-OE1 3Å; R122-E133 IonicContact NH2-OE1 3.25Å; R122-E133 PolarHBondContact NH2-OE1 2.88Å; R122-V136 HydrophobicContact CB-CG1 4.24Å; R122-V136 HydrophobicContact CG-CG1 4.22Å
123E98.5Very high97.9Very high91 Ų9179.3 Ų79.343%0.42538%0.384SS..Hα-helixtrans-65-45.9175.6-73.1177.5164.500111.5I119 Y120 L125 A126 L127 E133I119-E123 HydrophobicContact CD1-CG 4.38Å; I119-E123 HydrophobicContact CG1-CG 4.48Å; I119-E123 WeakPolarHBondContact O-CG 3.45Å; I119-E123 PolarHBondContact O-N 3.09Å; Y120-E123 PolarHBondContact O-N 3.13Å; E123-L125 VanDerWaalsContact C-N 3.35Å; E123-L125 PolarHBondContact O-N 3.48Å; E123-A126 WeakPolarHBondContact O-CB 3.16Å; E123-A126 PolarHBondContact O-N 3.22Å; E123-L127 WeakPolarHBondContact O-CG 3.39Å; E123-L127 PolarHBondContact O-N 3.34Å; E123-L127 VanDerWaalsContact O-N 3.08Å; E123-E133 HydrophobicContact CG-CB 4.45Å; E123-E133 HydrophobicContact CG-CG 4.05Å
124E98.1Very high97.9Very high139 Ų13974.9 Ų74.965%0.6537%0.37SS*.Hα-helixtrans-59.7-45.5175.3-173.4-174.1174.900111.6Y120 A126 L127 K128Y120-E124 PolarHBondContact O-N 3.47Å; E124-A126 PolarHBondContact O-N 3.42Å; E124-L127 PolarHBondContact O-N 3.38Å; E124-K128 WeakPolarHBondContact O-CB 3.49Å; E124-K128 PolarHBondContact O-N 3.07Å
125L98Very high97.9Very high6 Ų676.6 Ų76.63%0.03137%0.37CS..Hα-helixtrans-60.6-44.5175.2-85.6176000112.4E106 V110 T121 E123 L127 K128 I129 V136 F140E106-L125 HydrophobicContact CG-CD2 3.78Å; V110-L125 HydrophobicContact CB-CD1 3.88Å; V110-L125 HydrophobicContact CG1-CD1 3.87Å; V110-L125 HydrophobicContact CG2-CD1 3.84Å; V110-L125 HydrophobicContact CG2-CD2 3.75Å; V110-L125 HydrophobicContact CG2-CG 4.14Å; T121-L125 WeakPolarHBondContact O-CB 3.44Å; T121-L125 WeakPolarHBondContact O-CG 3.45Å; T121-L125 PolarHBondContact O-N 3.33Å; E123-L125 VanDerWaalsContact C-N 3.35Å; E123-L125 PolarHBondContact O-N 3.48Å; L125-L127 VanDerWaalsContact C-N 3.28Å; L125-L127 PolarHBondContact O-N 3.39Å; L125-K128 PolarHBondContact O-N 3.46Å; L125-K128 VanDerWaalsContact O-N 3.12Å; L125-I129 VanDerWaalsContact O-CG1 3.22Å; L125-I129 WeakPolarHBondContact O-CG1 3.24Å; L125-I129 PolarHBondContact O-N 3.38Å; L125-V136 HydrophobicContact CD1-CG1 4.45Å; L125-F140 HydrophobicContact CD1-CE2 4.15Å; L125-F140 HydrophobicContact CD1-CZ 4.33Å
126A98.3Very high97.9Very high7 Ų773.3 Ų73.36%0.05836%0.355CS..Hα-helixtrans-57.8-43.4-179.600000111.1R122 E123 E124 D130 L131 E133 V136R122-A126 VanDerWaalsContact O-CB 3.25Å; R122-A126 WeakPolarHBondContact O-CB 3.13Å; R122-A126 PolarHBondContact O-N 3.46Å; E123-A126 WeakPolarHBondContact O-CB 3.16Å; E123-A126 PolarHBondContact O-N 3.22Å; E124-A126 PolarHBondContact O-N 3.42Å; A126-D130 PolarHBondContact O-N 3.5Å; A126-D130 VanDerWaalsContact O-N 3.17Å; A126-L131 CarbonylContact C-O 3.57Å; A126-L131 WeakPolarHBondContact CB-O 3.47Å; A126-L131 PolarHBondContact O-N 3.27Å; A126-L131 VanDerWaalsContact O-O 3.04Å; A126-E133 HydrophobicContact CB-CB 4.43Å; A126-V136 HydrophobicContact CB-CG2 4.03Å
127L98.1Very high97.9Very high142 Ų14269.6 Ų69.674%0.74334%0.343SS*.Hα-helixtrans-64.7-44.5173.5-65.2172.3000111.9E123 E124 L125 I129E123-L127 WeakPolarHBondContact O-CG 3.39Å; E123-L127 PolarHBondContact O-N 3.34Å; E123-L127 VanDerWaalsContact O-N 3.08Å; E124-L127 PolarHBondContact O-N 3.38Å; L125-L127 VanDerWaalsContact C-N 3.28Å; L125-L127 PolarHBondContact O-N 3.39Å; L127-I129 VanDerWaalsContact C-N 3.3Å; L127-I129 PolarHBondContact O-N 3.03Å
128K97.2Very high98Very high123 Ų12372.4 Ų72.454%0.53536%0.36SS..Hα-helixtrans-63.8-31.8-177.5-175173.9-178.7-178.60113.8E106 E124 L125E106-K128 HydrophobicContact CG-CD 4.13Å; E106-K128 WeakPolarHBondContact OE1-CE 3.27Å; E106-K128 IonicContact OE1-NZ 3.37Å; E106-K128 PolarHBondContact OE1-NZ 2.81Å; E106-K128 IonicContact OE2-NZ 2.63Å; E106-K128 PolarHBondContact OE2-NZ 2.94Å; E124-K128 WeakPolarHBondContact O-CB 3.49Å; E124-K128 PolarHBondContact O-N 3.07Å; L125-K128 PolarHBondContact O-N 3.46Å; L125-K128 VanDerWaalsContact O-N 3.12Å
129I97.4Very high98Very high13 Ų1369 Ų697%0.06734%0.341CS..THydrogen-bonded Turntrans-112.411.1-173.375.7-169.1000113.4Q103 E106 L107 L125 L127 L131 V136Q103-I129 HydrophobicContact CB-CB 4.41Å; Q103-I129 HydrophobicContact CG-CB 4.08Å; Q103-I129 PolarHBondContact NE2-O 2.82Å; E106-I129 HydrophobicContact CB-CG2 3.8Å; E106-I129 HydrophobicContact CG-CG2 3.76Å; L107-I129 HydrophobicContact CD1-CD1 4.08Å; L107-I129 HydrophobicContact CD2-CD1 3.69Å; L107-I129 HydrophobicContact CG-CD1 3.74Å; L125-I129 VanDerWaalsContact O-CG1 3.22Å; L125-I129 WeakPolarHBondContact O-CG1 3.24Å; L125-I129 PolarHBondContact O-N 3.38Å; L127-I129 VanDerWaalsContact C-N 3.3Å; L127-I129 PolarHBondContact O-N 3.03Å; I129-L131 HydrophobicContact CD1-CD1 3.7Å; I129-L131 HydrophobicContact CD1-CG 4.43Å; I129-L131 HydrophobicContact CG1-CB 4.11Å; I129-L131 HydrophobicContact CG1-CD1 3.72Å; I129-L131 HydrophobicContact CG1-CG 3.91Å; I129-V136 HydrophobicContact CD1-CG2 4.22Å
130D97.8Very high98Very high146 Ų14666.4 Ų66.478%0.78133%0.327SS*.THydrogen-bonded Turntrans54.249.8-179.8-62.4-48000114A126A126-D130 PolarHBondContact O-N 3.5Å; A126-D130 VanDerWaalsContact O-N 3.17Å
131L96.9Very high98Very high31 Ų3162.7 Ų62.716%0.16232%0.316CS..  trans-127.7168.1176-65.8176.4000110.7T97 F99 A126 I129 R135 V136T97-L131 HydrophobicContact CG2-CD2 4.07Å; F99-L131 HydrophobicContact CD1-CD1 3.6Å; F99-L131 HydrophobicContact CD1-CD2 4.41Å; F99-L131 HydrophobicContact CE1-CD1 3.53Å; F99-L131 HydrophobicContact CE1-CD2 4.34Å; A126-L131 CarbonylContact C-O 3.57Å; A126-L131 WeakPolarHBondContact CB-O 3.47Å; A126-L131 PolarHBondContact O-N 3.27Å; A126-L131 VanDerWaalsContact O-O 3.04Å; I129-L131 HydrophobicContact CD1-CD1 3.7Å; I129-L131 HydrophobicContact CD1-CG 4.43Å; I129-L131 HydrophobicContact CG1-CB 4.11Å; I129-L131 HydrophobicContact CG1-CD1 3.72Å; I129-L131 HydrophobicContact CG1-CG 3.91Å; L131-R135 HydrophobicContact CB-CB 4.38Å; L131-V136 HydrophobicContact CB-CG2 4.47Å
132T97.9Very high98Very high85 Ų8565 Ų6552%0.52133%0.326SS..  trans-84.5148.7169.273.40000110.7A134 R135 V136T132-A134 PolarHBondContact O-N 3.48Å; T132-A134 VanDerWaalsContact O-N 3.15Å; T132-R135 WeakPolarHBondContact O-CA 3.4Å; T132-R135 WeakPolarHBondContact O-CB 3.5Å; T132-R135 PolarHBondContact O-N 3.17Å; T132-R135 WeakPolarHBondContact OG1-CG 3.4Å; T132-V136 PolarHBondContact O-N 2.98Å
133E98.1Very high98Very high45 Ų4566.9 Ų66.921%0.2133%0.333CS..Hα-helixtrans-49.7-42.5175.9-176.1-79.2160.300111I119 R122 E123 A126 R135 V136 Q137I119-E133 HydrophobicContact CD1-CG 4Å; I119-E133 WeakPolarHBondContact CD1-OE1 3.49Å; R122-E133 HydrophobicContact CB-CG 4.05Å; R122-E133 IonicContact CZ-OE1 3.86Å; R122-E133 VanDerWaalsContact CZ-OE1 3.31Å; R122-E133 IonicContact NE-OE1 2.72Å; R122-E133 PolarHBondContact NE-OE1 3Å; R122-E133 IonicContact NH2-OE1 3.25Å; R122-E133 PolarHBondContact NH2-OE1 2.88Å; E123-E133 HydrophobicContact CG-CB 4.45Å; E123-E133 HydrophobicContact CG-CG 4.05Å; A126-E133 HydrophobicContact CB-CB 4.43Å; E133-R135 VanDerWaalsContact C-N 3.27Å; E133-R135 PolarHBondContact O-N 2.86Å; E133-V136 CarbonylContact O-C 3.43Å; E133-V136 WeakPolarHBondContact O-CA 3.36Å; E133-V136 WeakPolarHBondContact O-CB 3.11Å; E133-V136 PolarHBondContact O-N 3.36Å; E133-Q137 PolarHBondContact O-N 3.07Å
134A97.6Very high98Very high39 Ų3964.8 Ų64.832%0.32232%0.322SS..Hα-helixtrans-59.9-34.1177.600000113.2T132 V138T132-A134 PolarHBondContact O-N 3.48Å; T132-A134 VanDerWaalsContact O-N 3.15Å; A134-V138 VanDerWaalsContact O-CG2 3.25Å; A134-V138 WeakPolarHBondContact O-CG2 3.46Å; A134-V138 PolarHBondContact O-N 3.38Å; A134-V138 VanDerWaalsContact O-N 3.09Å
135R97.8Very high98Very high92 Ų9260.4 Ų60.435%0.34731%0.309SS..Hα-helixtrans-68.4-42.8174.1-63.5-57.895.3155.27.2111T97 L131 T132 E133 V138 W139T97-R135 VanDerWaalsContact OG1-CD 3.23Å; T97-R135 WeakPolarHBondContact OG1-CD 3.41Å; L131-R135 HydrophobicContact CB-CB 4.38Å; T132-R135 WeakPolarHBondContact O-CA 3.4Å; T132-R135 WeakPolarHBondContact O-CB 3.5Å; T132-R135 PolarHBondContact O-N 3.17Å; T132-R135 WeakPolarHBondContact OG1-CG 3.4Å; E133-R135 VanDerWaalsContact C-N 3.27Å; E133-R135 PolarHBondContact O-N 2.86Å; R135-V138 PolarHBondContact O-N 3.06Å; R135-W139 WeakPolarHBondContact O-CB 3.45Å; R135-W139 PolarHBondContact O-N 3.37Å
136V98.1Very high97.9Very high0 Ų067 Ų670%034%0.337CS..Hα-helixtrans-61.1-47.9176.1179.40000109.8L107 R122 L125 A126 I129 L131 T132 E133 V138 W139 F140L107-V136 HydrophobicContact CD2-CG1 3.96Å; L107-V136 HydrophobicContact CD2-CG2 4.43Å; R122-V136 HydrophobicContact CB-CG1 4.24Å; R122-V136 HydrophobicContact CG-CG1 4.22Å; L125-V136 HydrophobicContact CD1-CG1 4.45Å; A126-V136 HydrophobicContact CB-CG2 4.03Å; I129-V136 HydrophobicContact CD1-CG2 4.22Å; L131-V136 HydrophobicContact CB-CG2 4.47Å; T132-V136 PolarHBondContact O-N 2.98Å; E133-V136 CarbonylContact O-C 3.43Å; E133-V136 WeakPolarHBondContact O-CA 3.36Å; E133-V136 WeakPolarHBondContact O-CB 3.11Å; E133-V136 PolarHBondContact O-N 3.36Å; V136-V138 PolarHBondContact O-N 3.42Å; V136-W139 WeakPolarHBondContact O-CB 3.37Å; V136-W139 PolarHBondContact O-N 3.23Å; V136-W139 VanDerWaalsContact O-N 3.1Å; V136-F140 HydrophobicContact CG1-CD2 3.72Å; V136-F140 HydrophobicContact CG1-CE2 3.74Å; V136-F140 WeakPolarHBondContact O-CD2 3.36Å; V136-F140 PolarHBondContact O-N 3.5Å
137Q98.3Very high97.8Very high80 Ų8070.1 Ų70.137%0.37435%0.35SS..Hα-helixtrans-56-47.2176.8-168.1-161.5-18.400112.1E133 W139 F140 Q141E133-Q137 PolarHBondContact O-N 3.07Å; Q137-W139 VanDerWaalsContact C-N 3.34Å; Q137-F140 PolarHBondContact O-N 3.14Å; Q137-Q141 WeakPolarHBondContact O-CG 3.44Å; Q137-Q141 PolarHBondContact O-N 3.26Å; Q137-Q141 PolarHBondContact O-NE2 3.25Å
138V98.2Very high97.7Very high67 Ų6769.9 Ų69.941%0.40634%0.339SS..Hα-helixtrans-66-38177.71710000111.2A134 R135 V136 Q141 N142A134-V138 VanDerWaalsContact O-CG2 3.25Å; A134-V138 WeakPolarHBondContact O-CG2 3.46Å; A134-V138 PolarHBondContact O-N 3.38Å; A134-V138 VanDerWaalsContact O-N 3.09Å; R135-V138 PolarHBondContact O-N 3.06Å; V136-V138 PolarHBondContact O-N 3.42Å; V138-Q141 PolarHBondContact O-N 3.05Å; V138-N142 WeakPolarHBondContact O-CB 3.31Å; V138-N142 PolarHBondContact O-N 3.33Å; V138-N142 PolarHBondContact O-ND2 3.08Å; V138-N142 VanDerWaalsContact O-ND2 3.14Å
139W98.1Very high97.6Very high23 Ų2371.7 Ų71.79%0.08735%0.347CS..Hα-helixtrans-61.5-48.8175.7-172.7100.7000111.4F99 L104 L107 E108 F111 R135 V136 Q137 Q141 N142 R143F99-W139 AromaticContact CD2-CD1 3.82Å; F99-W139 AromaticContact CE2-CD1 3.55Å; F99-W139 HydrophobicContact CE2-CG 4.48Å; F99-W139 HydrophobicContact CZ-CB 4.35Å; F99-W139 AromaticContact CZ-CD1 3.96Å; L104-W139 HydrophobicContact CD2-CZ2 4.37Å; L104-W139 VanDerWaalsContact CD2-NE1 3.32Å; L107-W139 HydrophobicContact CB-CD2 4.11Å; L107-W139 HydrophobicContact CB-CE3 3.99Å; L107-W139 HydrophobicContact CB-CH2 3.68Å; L107-W139 HydrophobicContact CB-CZ2 3.78Å; L107-W139 HydrophobicContact CB-CZ3 3.79Å; L107-W139 HydrophobicContact CD1-CD2 3.88Å; L107-W139 HydrophobicContact CD1-CE3 4.45Å; L107-W139 HydrophobicContact CD1-CG 3.92Å; L107-W139 HydrophobicContact CD1-CZ2 4.49Å; L107-W139 HydrophobicContact CD2-CD2 4.42Å; L107-W139 HydrophobicContact CD2-CE3 4.23Å; L107-W139 HydrophobicContact CG-CD2 4.37Å; L107-W139 HydrophobicContact CG-CE3 4.46Å; E108-W139 HydrophobicContact CG-CH2 3.85Å; E108-W139 HydrophobicContact CG-CZ2 3.97Å; F111-W139 HydrophobicContact CB-CH2 4.5Å; F111-W139 HydrophobicContact CB-CZ3 4.33Å; F111-W139 HydrophobicContact CD2-CZ3 4.46Å; R135-W139 WeakPolarHBondContact O-CB 3.45Å; R135-W139 PolarHBondContact O-N 3.37Å; V136-W139 WeakPolarHBondContact O-CB 3.37Å; V136-W139 PolarHBondContact O-N 3.23Å; V136-W139 VanDerWaalsContact O-N 3.1Å; Q137-W139 VanDerWaalsContact C-N 3.34Å; W139-Q141 VanDerWaalsContact C-N 3.34Å; W139-Q141 PolarHBondContact O-N 2.98Å; W139-N142 PolarHBondContact O-N 3.5Å; W139-R143 HydrophobicContact CE3-CB 4.03Å; W139-R143 HydrophobicContact CH2-CB 4.11Å; W139-R143 HydrophobicContact CH2-CG 3.8Å; W139-R143 HydrophobicContact CZ2-CG 4.47Å; W139-R143 HydrophobicContact CZ3-CB 3.81Å; W139-R143 HydrophobicContact CZ3-CG 3.84Å; W139-R143 WeakPolarHBondContact O-CB 3.47Å; W139-R143 PolarHBondContact O-N 3.42Å
140F98.6Very high97.3Very high2 Ų277.7 Ų77.71%0.00938%0.375CS..Hα-helixtrans-63-38.1178.9-89.2-89.5000112.4L107 V110 F111 P117 L125 V136 Q137 R143 R144L107-F140 HydrophobicContact CD2-CD2 4.49Å; L107-F140 HydrophobicContact CD2-CE2 3.87Å; V110-F140 HydrophobicContact CB-CZ 4.27Å; V110-F140 HydrophobicContact CG1-CZ 4.09Å; F111-F140 HydrophobicContact CB-CE1 4Å; F111-F140 AromaticContact CD2-CD1 3.82Å; F111-F140 HydrophobicContact CD2-CD1 3.82Å; F111-F140 AromaticContact CD2-CE1 3.8Å; F111-F140 HydrophobicContact CD2-CE1 3.8Å; F111-F140 HydrophobicContact CG-CE1 4.41Å; P117-F140 HydrophobicContact CG-CD1 3.64Å; P117-F140 HydrophobicContact CG-CD2 4.07Å; P117-F140 HydrophobicContact CG-CE1 3.56Å; P117-F140 HydrophobicContact CG-CE2 4.01Å; P117-F140 HydrophobicContact CG-CG 3.91Å; P117-F140 HydrophobicContact CG-CZ 3.77Å; L125-F140 HydrophobicContact CD1-CE2 4.15Å; L125-F140 HydrophobicContact CD1-CZ 4.33Å; V136-F140 HydrophobicContact CG1-CD2 3.72Å; V136-F140 HydrophobicContact CG1-CE2 3.74Å; V136-F140 WeakPolarHBondContact O-CD2 3.36Å; V136-F140 PolarHBondContact O-N 3.5Å; Q137-F140 PolarHBondContact O-N 3.14Å; F140-R143 PolarHBondContact O-N 2.97Å; F140-R144 WeakPolarHBondContact O-CB 3.34Å; F140-R144 WeakPolarHBondContact O-CG 3.47Å; F140-R144 PolarHBondContact O-N 3.33Å
141Q98.4Very high96.8Very high89 Ų8975.8 Ų75.842%0.41636%0.361SS..Hα-helixtrans-59.9-48.3172.7-75.717570.100111.9Q137 V138 W139 R143 R144 A145Q137-Q141 WeakPolarHBondContact O-CG 3.44Å; Q137-Q141 PolarHBondContact O-N 3.26Å; Q137-Q141 PolarHBondContact O-NE2 3.25Å; V138-Q141 PolarHBondContact O-N 3.05Å; W139-Q141 VanDerWaalsContact C-N 3.34Å; W139-Q141 PolarHBondContact O-N 2.98Å; Q141-R143 VanDerWaalsContact C-N 3.33Å; Q141-R143 PolarHBondContact O-N 3.39Å; Q141-R144 PolarHBondContact O-N 2.95Å; Q141-A145 WeakPolarHBondContact O-CB 3.45Å; Q141-A145 PolarHBondContact O-N 3.07Å
142N98.1Very high96.3Very high100 Ų10083.3 Ų83.354%0.53539%0.387SS..Hα-helixtrans-64.9-38.6178.3-73.3-34.3000112V138 W139 A145 K146V138-N142 WeakPolarHBondContact O-CB 3.31Å; V138-N142 PolarHBondContact O-N 3.33Å; V138-N142 PolarHBondContact O-ND2 3.08Å; V138-N142 VanDerWaalsContact O-ND2 3.14Å; W139-N142 PolarHBondContact O-N 3.5Å; N142-A145 PolarHBondContact O-N 3.13Å; N142-K146 PolarHBondContact O-N 3.24Å
143R98.1Very high95.6Very high84 Ų8482 Ų8232%0.31738%0.384SS..Hα-helixtrans-64-47.8177.8-174.467.7-167.7178.35.1111.1E108 F111 W139 F140 Q141 A145 K146 F147E108-R143 IonicContact OE1-NH1 3.57Å; F111-R143 HydrophobicContact CD1-CG 4.05Å; F111-R143 HydrophobicContact CD2-CB 4.25Å; F111-R143 HydrophobicContact CD2-CG 3.56Å; F111-R143 HydrophobicContact CE1-CG 3.92Å; F111-R143 HydrophobicContact CE2-CB 4.03Å; F111-R143 HydrophobicContact CE2-CG 3.42Å; F111-R143 VanDerWaalsContact CE2-CG 3.42Å; F111-R143 HydrophobicContact CG-CG 3.88Å; F111-R143 HydrophobicContact CZ-CG 3.61Å; W139-R143 HydrophobicContact CE3-CB 4.03Å; W139-R143 HydrophobicContact CH2-CB 4.11Å; W139-R143 HydrophobicContact CH2-CG 3.8Å; W139-R143 HydrophobicContact CZ2-CG 4.47Å; W139-R143 HydrophobicContact CZ3-CB 3.81Å; W139-R143 HydrophobicContact CZ3-CG 3.84Å; W139-R143 WeakPolarHBondContact O-CB 3.47Å; W139-R143 PolarHBondContact O-N 3.42Å; F140-R143 PolarHBondContact O-N 2.97Å; Q141-R143 VanDerWaalsContact C-N 3.33Å; Q141-R143 PolarHBondContact O-N 3.39Å; R143-A145 VanDerWaalsContact C-N 3.33Å; R143-A145 PolarHBondContact O-N 3.14Å; R143-K146 PolarHBondContact O-N 3.12Å; R143-F147 PolarHBondContact O-N 3.34Å
144R97.9Very high94.7Very high48 Ų4882.8 Ų82.818%0.18140%0.399CS..Hα-helixtrans-62.4-36.4174.3-72.1-166-63.2-92.64.4113F111 H115 F140 Q141 F147 R148F111-R144 HydrophobicContact CE2-CG 3.86Å; F111-R144 HydrophobicContact CZ-CG 4.43Å; H115-R144 HydrophobicContact CB-CG 4.45Å; H115-R144 VanDerWaalsContact O-CD 3.27Å; H115-R144 WeakPolarHBondContact O-CD 3.36Å; H115-R144 PolarHBondContact O-NH1 3.37Å; F140-R144 WeakPolarHBondContact O-CB 3.34Å; F140-R144 WeakPolarHBondContact O-CG 3.47Å; F140-R144 PolarHBondContact O-N 3.33Å; Q141-R144 PolarHBondContact O-N 2.95Å; R144-F147 PolarHBondContact O-N 3.39Å; R144-R148 WeakPolarHBondContact O-CG 3.37Å; R144-R148 PolarHBondContact O-N 3.28Å
145A97.8Very high93.6Very high46 Ų4687 Ų8738%0.3842%0.416SS..Hα-helixtrans-62.5-43.8175.800000111.6Q141 N142 R143 K149Q141-A145 WeakPolarHBondContact O-CB 3.45Å; Q141-A145 PolarHBondContact O-N 3.07Å; N142-A145 PolarHBondContact O-N 3.13Å; R143-A145 VanDerWaalsContact C-N 3.33Å; R143-A145 PolarHBondContact O-N 3.14Å; A145-K149 PolarHBondContact O-N 2.99Å; A145-K149 VanDerWaalsContact O-N 3.12Å
146K96.9Very high92.5Very high146 Ų14685.3 Ų85.364%0.63542%0.422SS*.Hα-helixtrans-63.5-44.3174.3-74.1-176.4177.4-175.80112.2N142 R143 R148 K149 Q150N142-K146 PolarHBondContact O-N 3.24Å; R143-K146 PolarHBondContact O-N 3.12Å; K146-R148 PolarHBondContact O-N 2.85Å; K146-K149 WeakPolarHBondContact O-CB 3.34Å; K146-K149 PolarHBondContact O-N 3.24Å; K146-K149 VanDerWaalsContact O-N 3.14Å; K146-Q150 PolarHBondContact O-N 3.46Å
147F96.1Very high91Very high71 Ų7193.1 Ų93.131%0.31146%0.456SS..Hα-helixtrans-56.3-52.6178.5-176.3-94.1000111.7F111 R143 R144 K149 Q150 E151F111-F147 HydrophobicContact CE1-CD2 4.42Å; F111-F147 HydrophobicContact CZ-CB 4.34Å; R143-F147 PolarHBondContact O-N 3.34Å; R144-F147 PolarHBondContact O-N 3.39Å; F147-K149 VanDerWaalsContact C-N 3.27Å; F147-K149 PolarHBondContact O-N 3.09Å; F147-Q150 WeakPolarHBondContact O-CB 3.42Å; F147-Q150 PolarHBondContact O-N 3.41Å; F147-E151 VanDerWaalsContact CE1-CD 3.43Å; F147-E151 HydrophobicContact CE1-CG 4.24Å; F147-E151 WeakPolarHBondContact CE1-OE1 3.41Å; F147-E151 HydrophobicContact CZ-CG 4.48Å; F147-E151 WeakPolarHBondContact CZ-OE1 3.21Å; F147-E151 PolarHBondContact O-N 3.02Å; F147-E151 VanDerWaalsContact O-N 3.14Å
148R96.3Very high89.3Confident138 Ų13892.7 Ų92.752%0.52147%0.466SS..Hα-helixtrans-60.9-33.4176.3-69.3-173-65.8160.6-1.9113.3R144 K146 R152R144-R148 WeakPolarHBondContact O-CG 3.37Å; R144-R148 PolarHBondContact O-N 3.28Å; K146-R148 PolarHBondContact O-N 2.85Å; R148-R152 WeakPolarHBondContact O-CG 3.5Å; R148-R152 PolarHBondContact O-N 3.43Å
149K94.6Very high87.2Confident160 Ų16096.3 Ų96.370%0.69648%0.483SS*.Hα-helixtrans-68.3-38175.8-173.5176.7179.9179.80111.4A145 K146 F147 A153A145-K149 PolarHBondContact O-N 2.99Å; A145-K149 VanDerWaalsContact O-N 3.12Å; K146-K149 WeakPolarHBondContact O-CB 3.34Å; K146-K149 PolarHBondContact O-N 3.24Å; K146-K149 VanDerWaalsContact O-N 3.14Å; F147-K149 VanDerWaalsContact C-N 3.27Å; F147-K149 PolarHBondContact O-N 3.09Å; K149-A153 PolarHBondContact O-N 3.22Å; K149-A153 VanDerWaalsContact O-N 3.12Å
150Q91.8Very high85.3Confident140 Ų14099.2 Ų99.265%0.65451%0.507SS*.Hα-helixtrans-68-42.7-179.6-169.4170.612.700111.8K146 F147 R152 A153 A154K146-Q150 PolarHBondContact O-N 3.46Å; F147-Q150 WeakPolarHBondContact O-CB 3.42Å; F147-Q150 PolarHBondContact O-N 3.41Å; Q150-R152 PolarHBondContact O-N 3Å; Q150-A153 PolarHBondContact O-N 3.4Å; Q150-A154 PolarHBondContact O-N 3Å
151E87.4Confident83.1Confident106 Ų106104.2 Ų104.250%0.49554%0.542SS..Hα-helixtrans-60.6-44175.2-70.1179.9147.700112.2F147 A153 A154 N155F147-E151 VanDerWaalsContact CE1-CD 3.43Å; F147-E151 HydrophobicContact CE1-CG 4.24Å; F147-E151 WeakPolarHBondContact CE1-OE1 3.41Å; F147-E151 HydrophobicContact CZ-CG 4.48Å; F147-E151 WeakPolarHBondContact CZ-OE1 3.21Å; F147-E151 PolarHBondContact O-N 3.02Å; F147-E151 VanDerWaalsContact O-N 3.14Å; E151-A153 VanDerWaalsContact C-N 3.32Å; E151-A153 PolarHBondContact O-N 3.29Å; E151-A154 PolarHBondContact O-N 3.39Å; E151-N155 PolarHBondContact O-N 3.13Å
152R85.4Confident80.7Confident189 Ų189104 Ų10471%0.71356%0.564SS**Hα-helixtrans-62.9-38.2177.2-71175.9-177-155.2-2.2112.7R148 Q150 A156R148-R152 WeakPolarHBondContact O-CG 3.5Å; R148-R152 PolarHBondContact O-N 3.43Å; Q150-R152 PolarHBondContact O-N 3Å; R152-A156 WeakPolarHBondContact O-CB 3.48Å; R152-A156 PolarHBondContact O-N 3.03Å
153A83.1Confident78Confident56 Ų56102.2 Ų102.246%0.46357%0.569SS.*Hα-helixtrans-70.5-33.2177.300000112.4K149 Q150 E151 K157K149-A153 PolarHBondContact O-N 3.22Å; K149-A153 VanDerWaalsContact O-N 3.12Å; Q150-A153 PolarHBondContact O-N 3.4Å; E151-A153 VanDerWaalsContact C-N 3.32Å; E151-A153 PolarHBondContact O-N 3.29Å; A153-K157 PolarHBondContact O-N 3.21Å
154A80.6Confident75.5Confident63 Ų63105.7 Ų105.752%0.52159%0.594SS.*Hα-helixtrans-66.7-46.3174.400000111.4Q150 E151 A156 K157 A158Q150-A154 PolarHBondContact O-N 3Å; E151-A154 PolarHBondContact O-N 3.39Å; A154-A156 PolarHBondContact O-N 3.01Å; A154-K157 PolarHBondContact O-N 3.18Å; A154-A158 PolarHBondContact O-N 3.27Å; A154-A158 VanDerWaalsContact O-N 3.14Å
155N73.9Confident73Confident127 Ų127109.3 Ų109.368%0.67962%0.621SS**Hα-helixtrans-65.6-36.8176.2-103.536.7000113.1E151 K157 A158 N159E151-N155 PolarHBondContact O-N 3.13Å; N155-K157 VanDerWaalsContact C-N 3.31Å; N155-K157 PolarHBondContact O-N 3.27Å; N155-A158 PolarHBondContact O-N 3.12Å; N155-N159 PolarHBondContact O-N 3.47Å; N155-N159 VanDerWaalsContact O-N 3.12Å
156A75.6Confident70.4Confident56 Ų56110.3 Ų110.346%0.46364%0.636SS.*Hα-helixtrans-65.5-33.7176.700000112.5R152 A154 S160R152-A156 WeakPolarHBondContact O-CB 3.48Å; R152-A156 PolarHBondContact O-N 3.03Å; A154-A156 PolarHBondContact O-N 3.01Å; A156-S160 WeakPolarHBondContact O-CB 3.46Å; A156-S160 PolarHBondContact O-N 3.21Å; A156-S160 PolarHBondContact O-OG 3.19Å
157K65.8Low67.8Low164 Ų164109.3 Ų109.371%0.71365%0.647SS**Hα-helixtrans-72.3-37.7174.4-78.8-169.7176.5-173.90112.7A153 A154 N155 N159 S160 S161A153-K157 PolarHBondContact O-N 3.21Å; A154-K157 PolarHBondContact O-N 3.18Å; N155-K157 VanDerWaalsContact C-N 3.31Å; N155-K157 PolarHBondContact O-N 3.27Å; K157-N159 VanDerWaalsContact C-N 3.33Å; K157-N159 PolarHBondContact O-N 3.44Å; K157-S160 PolarHBondContact O-N 3Å; K157-S161 PolarHBondContact O-OG 3.4Å
158A61.7Low65.5Low71 Ų71113.9 Ų113.959%0.58768%0.675SS**Hα-helixtrans-63.6-38.417600000112A154 N155 S160A154-A158 PolarHBondContact O-N 3.27Å; A154-A158 VanDerWaalsContact O-N 3.14Å; N155-A158 PolarHBondContact O-N 3.12Å; A158-S160 VanDerWaalsContact C-N 3.29Å; A158-S160 PolarHBondContact O-N 3.33Å
159N56.1Low62.8Low143 Ų143112.8 Ų112.877%0.76569%0.689SS**THydrogen-bonded Turntrans-79.7-6.2178.6-133.458.6000114.6N155 K157N155-N159 PolarHBondContact O-N 3.47Å; N155-N159 VanDerWaalsContact O-N 3.12Å; K157-N159 VanDerWaalsContact C-N 3.33Å; K157-N159 PolarHBondContact O-N 3.44Å
160S56.7Low60.2Low84 Ų84111.3 Ų111.359%0.58770%0.698SS**THydrogen-bonded Turntrans-100.7-3.4179.2-55.60000113.1A156 K157 A158 G162A156-S160 WeakPolarHBondContact O-CB 3.46Å; A156-S160 PolarHBondContact O-N 3.21Å; A156-S160 PolarHBondContact O-OG 3.19Å; K157-S160 PolarHBondContact O-N 3Å; A158-S160 VanDerWaalsContact C-N 3.29Å; A158-S160 PolarHBondContact O-N 3.33Å; S160-G162 PolarHBondContact O-N 3.29Å
161S52.7Low57.5Low108 Ų108110.1 Ų110.176%0.75571%0.705SS**THydrogen-bonded Turntrans-82.66.5178.2-59.40000114.2K157K157-S161 PolarHBondContact O-OG 3.4Å
162G48.4Very low55.1Low84 Ų84111.1 Ų111.187%0.86672%0.724SS**THydrogen-bonded Turntrans-98.62.1173.600000115.8S160S160-G162 PolarHBondContact O-N 3.29Å
163G41.3Very low53Low62 Ų62108 Ų10864%0.63973%0.731SS**SBendtrans-136.7109.3-175.200000112.7
164N45.8Very low50.6Low157 Ų157109.3 Ų109.384%0.8475%0.75SS**  trans-65.7153.2-179.7-170.341.7000113.2
165T44.6Very low48.6Very low125 Ų125109.8 Ų109.877%0.76776%0.761SS**  trans102.1103.1156.4-18.80000119.4
166G43.3Very low46.9Very low66 Ų66113 Ų11368%0.6877%0.769SS**  102.896.6125.900000119.4
167S42.4Very low45.2Very low126 Ų126120 Ų12088%0.88179%0.789SS**  170.6129.2116.744.20000113.9
168N47.1Very low43.6Very low167 Ų167116 Ų11689%0.89380%0.795SS**  trans1.5121.7167.5-75.11.4000120.8
169S41.4Very low42.3Very low115 Ų115116.2 Ų116.280%0.80480%0.804SS**  trans-137.4128.1134.454.30000110.2S171S169-S171 PolarHBondContact O-N 3.2Å
170S38.3Very low41.4Very low128 Ų128118 Ų11890%0.89581%0.807SS**  trans-59121.9-177.647.10000112.5
171S36Very low40.6Very low115 Ų115119.8 Ų119.880%0.80482%0.815SS**  trans-115119.2163.149.10000109.2S169S169-S171 PolarHBondContact O-N 3.2Å
172S37.8Very low40Very low127 Ų127125.7 Ų125.789%0.88882%0.821SS**  trans-76.3127.2171.150.90000109.6
173S39.7Very low39.5Very low124 Ų124127.2 Ų127.287%0.86782%0.818SS**  trans-88.3150.4-177.947.20000113.2
174G34Very low39.4Very low83 Ų83129.5 Ų129.586%0.85682%0.824SS**  trans155.4115.9162.800000109.3
175G37.2Very low39Very low73 Ų73127.4 Ų127.475%0.75382%0.822SS**  cis143.8117.74.100000109.1
176K39.7Very low39Very low195 Ų195127.9 Ų127.985%0.84882%0.82SS**  trans115.3121.5148-70.6177.7168.6173.80120
177K38.4Very low39.1Very low202 Ų202132.1 Ų132.188%0.87883%0.827SS**  trans56.9138.5135.1-65.4-173.4172.6-170.70118.2
178G33.4Very low39.3Very low81 Ų81133.4 Ų133.484%0.83582%0.824SS**  cis156.8156.18.900000107.8
179G34.2Very low38.9Very low75 Ų75133.1 Ų133.177%0.77382%0.818SS**  trans117.491.2162.400000118.6
180E36.9Very low39Very low180 Ų180132.1 Ų132.184%0.84181%0.811SS**  trans30.8121.8130.7-52.6179.4119.800123.3
181T40.2Very low39.5Very low123 Ų123135.4 Ų135.476%0.75581%0.808SS**  trans65.3135.1137.164.70000123.2
182R39.1Very low39.8Very low231 Ų231138.2 Ų138.287%0.87281%0.809SS**  trans80.7116143.283.7-171.9171.4173.4-1.1122.4
183S37.6Very low40.1Very low116 Ų116137.8 Ų137.881%0.81181%0.806SS**  trans40.1129.6131.4-66.40000123.5
184S40.3Very low39.9Very low110 Ų110137.5 Ų137.577%0.76980%0.799SS**  65116.8128.1-170.40000119.6
185S37.3Very low39.9Very low114 Ų114138.6 Ų138.680%0.79779%0.793SS**  169.8154.3113.5470000111.1
186D45.1Very low39.9Very low135 Ų135140.5 Ų140.572%0.72280%0.795SS**  trans-72.4173.6-172.7-57.9-93.2000115.7
187D44.4Very low40.6Very low155 Ų155136.8 Ų136.883%0.82979%0.79SS**  trans76.6127.6153.2-54.2-52000120.8
188D46.1Very low41Very low153 Ų153133.3 Ų133.382%0.81879%0.786SS**  158.5100.6114.4-157.7-118.9000113.2
189E40.2Very low42Very low161 Ų161135.5 Ų135.575%0.75279%0.785SS**  trans16130.9135.1-159.1126.585.500122.5
190S42.2Very low42.2Very low94 Ų94138.5 Ų138.566%0.65778%0.784SS**  trans71.2138.8152.765.50000116.8
191K50.2Low42.2Very low196 Ų196135.1 Ų135.185%0.85278%0.78SS**  -159.4145.159.2-40-165178173.50112.6
192E41.8Very low42.1Very low174 Ų174135 Ų13581%0.81378%0.779SS**  trans-51.7143.1165166.2-178.478.300114.5
193S44.8Very low42Very low118 Ų118127.8 Ų127.883%0.82577%0.769SS**  trans-161.588.5154-74.50000111.2
194T34Very low42Very low118 Ų118127.9 Ų127.972%0.72477%0.77SS**  33.1116.9128.2-72.60000121.5
195C34.2Very low42.1Very low107 Ų107130.6 Ų130.672%0.72378%0.775SS**  trans61.3113.5134.8-64.20000123.2
196S37.2Very low42.6Very low113 Ų113131.2 Ų131.279%0.7978%0.776SS**  50.8164.1115.9-56.10000121.5
197P55.6Low42.1Very low117 Ų117128 Ų12876%0.7677%0.774SS**  cis-130.9-178.1-17.328.1-4.5000113.6
198T47.3Very low41.6Very low128 Ų128126.3 Ų126.379%0.78578%0.775SS**  trans-61.9165.4161.748.40000112.8
199P53.9Low41.2Very low127 Ų127123 Ų12383%0.82577%0.769SS**  -142.5156107.635.2-19.8000116.4
200D37.4Very low41.1Very low138 Ų138123.6 Ų123.674%0.73878%0.777SS**  trans-60.1153.5168.5-167.8-81.5000113.5
201S37.2Very low40.7Very low109 Ų109122.4 Ų122.476%0.76278%0.78SS**  trans-175.9107.6140.1-87.10000113.4
202T38.6Very low40.1Very low121 Ų121120 Ų12074%0.74278%0.776SS**  43.3133.1122.9-152.50000123
203A36.5Very low40.1Very low79 Ų79119.3 Ų119.365%0.65378%0.777SS**  trans64.2117.8143.700000121.2
204S37.7Very low39.7Very low119 Ų119117 Ų11783%0.83277%0.772SS**  166.414199.3-720000112.6
205L41.5Very low40.3Very low166 Ų166117.4 Ų117.487%0.86978%0.78SS**  trans-60162.5166.7-62.8161.5000111.2
206P49.1Very low40.9Very low128 Ų128118.2 Ų118.283%0.83178%0.784SS**  -131143.1103.135-28000113.5
207G34Very low41Very low66 Ų66116.7 Ų116.768%0.6878%0.778SS**  trans-88.7146.7165.500000112
208S34.5Very low40.2Very low121 Ų121116.1 Ų116.185%0.84678%0.777SS**  trans179.3104.5143.1-81.40000106.3
209A36.6Very low39.8Very low84 Ų84117.9 Ų117.969%0.69478%0.781SS**  73.997.490.400000112.8
210N38.7Very low39.1Very low172 Ų172117.3 Ų117.392%0.9278%0.78SS**  166.3143.1119.6-89.4-18000113
211G35Very low39.6Very low69 Ų69116.2 Ų116.271%0.71178%0.78SS**  trans9682.4164.900000113.2
212N37.5Very low39.6Very low145 Ų145116.7 Ų116.778%0.77578%0.783SS**  47.9114.284.1-157.853.3000112.2
213L41.1Very low40Very low160 Ų160116.8 Ų116.884%0.83879%0.786SS**  161.2110.1127.7-80161000110.8
214G36.7Very low40.2Very low70 Ų70117.5 Ų117.572%0.72279%0.792SS**  trans47.2101136.100000119.2P216G214-P216 WeakPolarHBondContact O-CD 3.48Å
215S45.5Very low40.7Very low126 Ų126117.7 Ų117.788%0.88179%0.79SS**  trans-62.7143144.2-52.30000109.9
216P47.7Very low40.6Very low124 Ų124116.6 Ų116.681%0.80579%0.791SS**  trans-118.2130135.632.2-26.9000110.5G214G214-P216 WeakPolarHBondContact O-CD 3.48Å
217A39.9Very low40Very low82 Ų82117.6 Ų117.668%0.67879%0.789SS**  trans-66.6162.5167.400000111.5
218S37.7Very low39.9Very low104 Ų104119.6 Ų119.673%0.72779%0.793SS**  trans79.9145.6143.779.60000115.5
219L40Very low39.9Very low165 Ų165116.9 Ų116.986%0.86478%0.784SS**  cis-155.9158.525-71.9161.6000110.3
220S38.3Very low40.2Very low115 Ų115124.2 Ų124.280%0.80480%0.795SS**  trans-104.6141.1159.3-164.10000108.1
221P47.8Very low40.1Very low116 Ų116122.5 Ų122.575%0.75379%0.791SS**  trans-95.5141.617634.5-28.1000111.5
222S37.3Very low40.1Very low118 Ų118127 Ų12783%0.82580%0.799SS**  trans-147.1146.9152.9-91.10000111.2
223P46.9Very low39.9Very low124 Ų124123.6 Ų123.681%0.80579%0.791SS**PPolyproline II helixtrans-86153.7-163.234.2-35.8000113.5
224A41.2Very low39.7Very low93 Ų93121.3 Ų121.377%0.76979%0.789SS**PPolyproline II helixtrans-94.5147.5165.300000110.3
225P48.3Very low39.7Very low123 Ų123123.5 Ų123.580%0.79979%0.793SS**PPolyproline II helixtrans-87.6140.8160.331.7-28.4000111.7
226T38.9Very low39.4Very low143 Ų143123 Ų12388%0.87779%0.789SS**PPolyproline II helixtrans-60.6131.8168.631.80000112.6
227N35.8Very low39.4Very low149 Ų149122.7 Ų122.780%0.79779%0.788SS**  trans-166.9128133.9-154.810.2000110.8
228S32.4Very low39.3Very low108 Ų108125 Ų12576%0.75579%0.793SS**  169.9117.8120.8-72.10000110.3
229G34.7Very low39.7Very low65 Ų65127.9 Ų127.967%0.6780%0.799SS**PPolyproline II helixtrans-73.3166.1166.700000112.9
230Y42.4Very low39.7Very low237 Ų237128.8 Ų128.893%0.92980%0.799SS**PPolyproline II helixtrans-74.4152.6-164.6-58.7-93.3000114.9
231T37.9Very low39.8Very low136 Ų136127.1 Ų127.183%0.83480%0.8SS**PPolyproline II helixtrans-95.6133.5170.451.20000111.9
232N34.3Very low39.2Very low164 Ų164130 Ų13088%0.87781%0.808SS**  trans163148.4132.1-124.8-7.6000108
233A33Very low39.5Very low73 Ų73133.6 Ų133.660%0.60381%0.809SS**  cis-163.1169.16.600000109.1
234S36.9Very low39.4Very low112 Ų112132.9 Ų132.978%0.78380%0.804SS**  trans84130149.163.60000121.8
235S36.3Very low39.6Very low117 Ų117134.6 Ų134.682%0.81881%0.807SS**  trans97.6102156.3-340000117.9
236S40.9Very low39Very low115 Ų115134 Ų13480%0.80481%0.806SS**  trans-60.4161.2153.8-57.40000110.6
237P47.6Very low39Very low118 Ų118139.3 Ų139.377%0.76681%0.81SS**  cis-145.2-172.932.434.1-9.2000116.5
238V37.6Very low39.1Very low129 Ų129138.2 Ų138.278%0.78281%0.814SS**  trans98.3113.5160.3-176.40000117.1
239L44.6Very low39.3Very low166 Ų166138.5 Ų138.587%0.86982%0.816SS**  trans-68.5131.4169.3-68.1168.7000110.8
240Q40Very low39.6Very low184 Ų184144 Ų14486%0.8683%0.83SS**  trans-159.7121.1146.7-106.916330.800110
241G41.7Very low39.2Very low80 Ų80135.8 Ų135.883%0.82582%0.816SS**  trans-72.6142.2178.900000112
242L35.3Very low39.7Very low177 Ų177135.3 Ų135.393%0.92782%0.816SS**  trans-115.5138.8171.8-71.2174.9000111.2
243K42.8Very low39.9Very low193 Ų193133 Ų13384%0.83981%0.812SS**PPolyproline II helixtrans-91.2148.9-167.4177.5160.5172.3161.90110.8
244P45.4Very low40.3Very low109 Ų109137 Ų13771%0.70882%0.823SS**PPolyproline II helixtrans-74161.6170.529.6-33.7000112.7
245P44.2Very low40.9Very low128 Ų128137.2 Ų137.283%0.83182%0.822SS**PPolyproline II helixtrans-75.3145.3-156.128.9-34.8000114.4
246S37.4Very low40.9Very low110 Ų110136 Ų13677%0.76982%0.819SS**PPolyproline II helixtrans-77.9128.2177.660.80000112
247W37.7Very low40.6Very low255 Ų255137.2 Ų137.297%0.96682%0.821SS**PPolyproline II helixtrans-72.3130.8153.7-70.8-47.8000109.5S249W247-S249 PolarHBondContact O-N 3.47Å; W247-S249 VanDerWaalsContact O-N 3.15Å
248S37.2Very low40Very low126 Ų126136.1 Ų136.188%0.88182%0.823SS**  trans-61.8109.5173.6-51.10000109.8
249S38.4Very low39.8Very low114 Ų114138.8 Ų138.880%0.79783%0.826SS**  trans-115114.8167.1-163.10000107.3W247 G251W247-S249 PolarHBondContact O-N 3.47Å; W247-S249 VanDerWaalsContact O-N 3.15Å; S249-G251 PolarHBondContact O-N 3.34Å
250L39.5Very low40Very low182 Ų182136.1 Ų136.195%0.95382%0.819SS**  trans-68.8105.3170.1-69.5165.5000107.4
251G34Very low39.8Very low63 Ų63132 Ų13265%0.64982%0.817SS**  trans-112.7130.316900000109.5S249S249-G251 PolarHBondContact O-N 3.34Å
252P49.3Very low39.8Very low127 Ų127132.5 Ų132.583%0.82581%0.813SS**  trans-76.9140.2178.230.8-30.7000110.7
253S38.6Very low40.2Very low114 Ų114132.7 Ų132.780%0.79781%0.809SS**  trans-62.2135.8168.849.30000111.3
254N41.4Very low40.4Very low157 Ų157130.2 Ų130.284%0.8481%0.81SS**  trans-124.1144163.1-132.316.2000108.4
255P48.9Very low40.7Very low118 Ų118133.2 Ų133.277%0.76682%0.815SS**  trans-132.5134.7131.933.7-21.2000112.9
256A35.7Very low40.8Very low91 Ų91134.7 Ų134.775%0.75281%0.811SS**  trans38.5117.9147.500000120.3
257V35Very low41.3Very low140 Ų140137.3 Ų137.385%0.84881%0.814SS**  -175.9132.9127.4145.10000110
258A35.3Very low41.9Very low96 Ų96133.5 Ų133.579%0.79381%0.812SS**  trans47.2136.4154.900000123.3
259Q33.6Very low42.5Very low184 Ų184135.2 Ų135.286%0.8680%0.803SS**  trans-63.5-177.7165.1-64.2-170.4-15.200113.5
260P49.2Very low42.8Very low110 Ų110134.4 Ų134.471%0.71480%0.804SS**  cis-134176.5-13.121.33.9000115.3
261A35.5Very low43.2Very low98 Ų98138 Ų13881%0.8181%0.805SS**  trans79.6136146.100000122.4
262A41.1Very low43.9Very low90 Ų90143.2 Ų143.274%0.74481%0.812SS**  trans77.7112.115600000119
263Q43.5Very low43.7Very low181 Ų181143.2 Ų143.285%0.84681%0.812SS**  15493120.8-81.4175.95.100111.4Q265Q263-Q265 PolarHBondContact O-N 3.12Å
264T46.7Very low44Very low141 Ų141142.5 Ų142.587%0.86581%0.813SS**  trans-8634.4171.917.20000112.8
265Q51.6Low44.3Very low173 Ų173142.1 Ų142.181%0.80881%0.811SS**  trans-138.561-173.6-69.2-71.3-17.600111.9Q263Q263-Q265 PolarHBondContact O-N 3.12Å
266E47.7Very low44.2Very low158 Ų158142.1 Ų142.174%0.73881%0.814SS**  trans-152.726.7165.2-131.3-166.5172.800116.6
267I47.6Very low44.8Very low165 Ų165146.5 Ų146.585%0.84682%0.821SS**SBendtrans-97.310.9176.4-35.9-178.5000112
268L49.7Very low45.7Very low175 Ų175146.4 Ų146.492%0.91682%0.821SS**SBendtrans-116.119.4-177.2-12283.5000115.1
269K50.4Low46.5Very low162 Ų162144 Ų14470%0.70481%0.805SS**  trans-117.44.6178.5-92.9-176.6177.91770116.3W271K269-W271 VanDerWaalsContact C-N 3.33Å; K269-W271 PolarHBondContact O-N 3.14Å
270A45.1Very low47.7Very low97 Ų97141.3 Ų141.380%0.80280%0.803SS**  trans-8612.3-17600000115.8
271W47Very low47.9Very low259 Ų259145.5 Ų145.598%0.98181%0.811SS**  trans-107.366.6168.6-89.192.3000110.4K269K269-W271 VanDerWaalsContact C-N 3.33Å; K269-W271 PolarHBondContact O-N 3.14Å
272Q48.4Very low48.7Very low172 Ų172145.6 Ų145.680%0.80481%0.812SS**  trans-112.2131.1158.8-71.3-155-8.800109.2A274Q272-A274 PolarHBondContact O-N 2.68Å
273P46.1Very low49.3Very low127 Ų127144.5 Ų144.583%0.82581%0.809SS**PPolyproline II helixtrans-70.6118.6172.827.8-29.2000108.7
274A44.9Very low49.7Very low98 Ų98142.4 Ų142.481%0.8181%0.808SS**PPolyproline II helixtrans-62.7143176.200000111.4Q272Q272-A274 PolarHBondContact O-N 2.68Å
275D46.4Very low49.9Very low150 Ų150143.8 Ų143.880%0.80281%0.809SS**PPolyproline II helixtrans-46.6143.6177.8-68.9-78.3000114.7M277D275-M277 PolarHBondContact O-N 3.37Å
276S47.5Very low49.5Very low117 Ų117141.6 Ų141.682%0.81881%0.813SS**  trans-51.2101.7172.139.80000112.8T278S276-T278 PolarHBondContact O-N 3.48Å
277M48.8Very low49.6Very low184 Ų184138.9 Ų138.991%0.90681%0.811SS**  trans-73.3119.5162.3-87.2-82.1176.500110D275 G279D275-M277 PolarHBondContact O-N 3.37Å; M277-G279 PolarHBondContact O-N 3.18Å
278T53.5Low49.4Very low138 Ų138141.1 Ų141.185%0.84782%0.815SS**  trans-58.5104.6172.535.30000112S276S276-T278 PolarHBondContact O-N 3.48Å
279G51.8Low49.3Very low44 Ų44141.6 Ų141.645%0.45481%0.813SS.*  trans-98.4155.4163.100000111.5M277 F281 A282M277-G279 PolarHBondContact O-N 3.18Å; G279-F281 PolarHBondContact O-N 3.39Å; G279-A282 PolarHBondContact O-N 3.33Å
280P59.8Low49.2Very low128 Ų128145.5 Ų145.583%0.83182%0.823SS**THydrogen-bonded Turntrans-72.318.5-168.329.4-35.8000116.1
281F51.8Low49.5Very low199 Ų199150.4 Ų150.487%0.87383%0.826SS**THydrogen-bonded Turntrans-126.615.1179.6-72.1-79.3000114.2G279 G283G279-F281 PolarHBondContact O-N 3.39Å; F281-G283 VanDerWaalsContact C-N 3.31Å; F281-G283 PolarHBondContact O-N 3.27Å; F281-G283 VanDerWaalsContact O-N 3.07Å
282A52.8Low49.8Very low100 Ų100144 Ų14483%0.82682%0.818SS**  trans-85.371.3174.800000111G279G279-A282 PolarHBondContact O-N 3.33Å
283G53.2Low49.4Very low66 Ų66143.5 Ų143.568%0.6882%0.821SS**  trans-139.721.8-168.300000116.4F281F281-G283 VanDerWaalsContact C-N 3.31Å; F281-G283 PolarHBondContact O-N 3.27Å; F281-G283 VanDerWaalsContact O-N 3.07Å
284V53.3Low49.8Very low138 Ų138142.5 Ų142.584%0.83682%0.815SS**SBendtrans-151.797.2165.8-178.30000108.4
285L51.1Low49.8Very low169 Ų169142 Ų14289%0.88581%0.81SS**  trans169.475.6147.9-89.5170.9000108.6
286S43Very low50Low127 Ų127141.9 Ų141.989%0.88881%0.808SS**  trans-161.288.9160-100.20000110.7
287S48.8Very low50Low101 Ų101144.6 Ų144.671%0.70681%0.805SS**  trans-163.979.3149.2-1600000110.7
288F43.6Very low50.8Low212 Ų212141.8 Ų141.893%0.9380%0.798SS**  trans-136.572.5149.4-76.7-69.6000108.4R290F288-R290 PolarHBondContact O-N 3.38Å
289H47.3Very low50.6Low186 Ų186142.4 Ų142.486%0.86180%0.796SS**  trans-61110.7157.6-98.348.2000108.3K291H289-K291 PolarHBondContact O-N 3.48Å
290R49.4Very low50.5Low244 Ų244147.8 Ų147.892%0.92181%0.814SS**  trans-68.2113.6163.1-75.4-173.9-170.1-137.22.1108.2F288F288-R290 PolarHBondContact O-N 3.38Å
291K50.7Low50.4Low200 Ų200155.2 Ų155.287%0.8783%0.834SS**  trans-82.5126.2163-118.1161.6176.2167.10108.2H289H289-K291 PolarHBondContact O-N 3.48Å
292P53.9Low50.3Low124 Ų124153 Ų15381%0.80583%0.832SS**  trans-82131.7160.232.1-26.3000107.9
293N38.8Very low50.2Low161 Ų161155.8 Ų155.886%0.86183%0.832SS**  trans-127.9138.4162.5-149.119.7000109
294P54.7Low50Low107 Ų107160.8 Ų160.870%0.69584%0.84SS**  trans-97.5152.8-164.538.2-30.2000112.6
295A46.3Very low49.8Very low86 Ų86162.1 Ų162.171%0.71184%0.841SS**  trans82.7139.9139.600000121.1
296I50.9Low49.7Very low148 Ų148161.7 Ų161.776%0.75984%0.838SS**  trans72.4127.8151.1-7.5-176.7000116.2
297K47.5Very low50.2Low174 Ų174164 Ų16476%0.75783%0.834SS**  cis-152.8140.433.8-75.6166.5-179.9177.70112.8
298T64.1Low50.3Low125 Ų125168.5 Ų168.577%0.76784%0.844SS**  trans-60136.415249.70000110.5
299N49.6Very low50.8Low151 Ų151165.2 Ų165.281%0.80784%0.837SS**  trans-145.6102.7147-86.5-58.5000108.1
300L49.9Very low51.1Low157 Ų157163.4 Ų163.482%0.82284%0.835SS**  trans-70.1129145.1-92.273000106.7
301F57Low51.2Low284 Ų284156.1 Ų156.1100%1.24683%0.827SS**  -161.40127-109.5-76000108.2

Retrieved 301 of 301 residues in 108.4 ms (Link to these results)