A0A096NE70_PAPAN Loading...

Transmembrane protein 183A

AlphaFold DB (Q8IXX5), UniProt , Accession A0A096NE70, Species PAPAN (Papio anubis, Olive baboon), Gene TMEM183A, Length 376 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M40.9Very low44.7Very low240 Ų240145.5 Ų145.5100%1.18286%0.858SS**  0133.90-71.5-164.9-172.800108.4
2A44.3Very low44.5Very low99 Ų99153.3 Ų153.382%0.81886%0.862SS**  trans43.3140.1154.800000120
3R42.9Very low44.9Very low243 Ų243150.7 Ų150.792%0.91786%0.855SS**  cis-177.4145.2-11.8-117.8-178.6178.2-177.4-0.2101.8
4G43.1Very low44.5Very low71 Ų71150 Ų15073%0.73285%0.848SS**  trans-69.2-140179.600000113.8
5P52.8Low43.9Very low137 Ų137150.1 Ų150.189%0.8985%0.853SS**  cis-143.5-173.5-7.538.6-18.1000113.8
6G44.3Very low43.8Very low70 Ų70149.1 Ų149.172%0.72285%0.851SS**  trans134.8106.9142.300000117.8
7P48.5Very low43.3Very low128 Ų128145.2 Ų145.283%0.83184%0.841SS**  trans-101.6140.6165.634.6-23.9000112.1
8L50.2Low42.8Very low183 Ų183145.4 Ų145.496%0.95884%0.835SS**  trans-127.9131.4167.7-64.6166.6000105.4
9G36.7Very low42.6Very low70 Ų70144.3 Ų144.372%0.72283%0.833SS**  cis134.312114.900000108.6
10R46.1Very low42.2Very low245 Ų245145.7 Ų145.793%0.92583%0.829SS**  trans88.7157.5157.9-67.8-170.2171.7-168.3-1.3120.6
11P42.3Very low41.8Very low114 Ų114150.9 Ų150.974%0.7484%0.835SS**  cis-139.2168.2-36.836.4-18.4000114.6
12R42.2Very low41.5Very low240 Ų240143 Ų14391%0.90682%0.816SS**  trans-69.8153.1165.4-84.1-179.3171.2175.4-2.7111.4
13P49.6Very low41.3Very low119 Ų119147.9 Ų147.977%0.77382%0.819SS**  trans-111.4110.2155.532.6-19.3000111.9
14D39.5Very low40.9Very low141 Ų141148 Ų14875%0.75482%0.819SS**  33.7116.9127.1-58.6-31.6000121.8V16D14-V16 PolarHBondContact O-N 3.38Å
15T35.1Very low40.8Very low152 Ų152151.7 Ų151.793%0.93382%0.821SS**  trans-58.6113.1155-33.20000110.4
16V43.1Very low40.1Very low134 Ų134154.6 Ų154.681%0.81282%0.82SS**  trans-110.5121.9171.3179.20000110D14D14-V16 PolarHBondContact O-N 3.38Å
17A34.4Very low39.8Very low82 Ų82160.7 Ų160.768%0.67883%0.827SS**  trans-97.3153.8173.300000111.8
18M33.8Very low39.4Very low149 Ų149166.1 Ų166.173%0.73483%0.831SS**  trans79.1152.1163.4-68.6-85152.200117.2K20M18-K20 HydrophobicContact SD-CG 4.43Å
19P38.9Very low38.7Very low124 Ų124162.2 Ų162.281%0.80583%0.825SS**  cis-136.7168.824.237.7-16.9000118
20K35.3Very low38.7Very low172 Ų172167.5 Ų167.575%0.74883%0.83SS**  trans-68.4142.7175.4-64169.9177.8172.60112.2M18M18-K20 HydrophobicContact SD-CG 4.43Å
21R33.7Very low38.2Very low255 Ų255163.8 Ų163.896%0.96283%0.829SS**SBendtrans47.3118.6151.9-75.3-175.1171.8-165.8-2.2119.1
22G34.4Very low37.9Very low75 Ų75163.3 Ų163.377%0.77383%0.834SS**  trans101.296.9130.200000116.5
23K40.1Very low37.8Very low202 Ų202157.7 Ų157.788%0.87883%0.83SS**  trans-154.9116.7148.4-107.9166-171.7-178.20110.2L25K23-L25 PolarHBondContact O-N 3.37Å
24R34.4Very low37.4Very low244 Ų244157.7 Ų157.792%0.92183%0.834SS**  trans-71.2108.4178.4-179.7177.9171-171.5-1.7108.7
25L41.8Very low37.4Very low149 Ų149155.1 Ų155.178%0.7884%0.84SS**PPolyproline II helixtrans-80.4127.2171.7-10287.2000110.2K23K23-L25 PolarHBondContact O-N 3.37Å
26K38.5Very low37.8Very low199 Ų199158.5 Ų158.587%0.86584%0.836SS**PPolyproline II helixtrans-82.5123.4170.2-63-178.6178.1-179.10108.1
27F37.7Very low38.4Very low197 Ų197157.2 Ų157.286%0.86483%0.828SS**PPolyproline II helixtrans-94.4128.2170.8-111.2-91.7000110
28R39.1Very low39.9Very low243 Ų243156.8 Ų156.892%0.91782%0.817SS**PPolyproline II helixtrans-84.9137.3169.9-86.5-178.6169.6175.1-3.7108.9H30R28-H30 PolarHBondContact O-N 3.35Å
29A35.2Very low40.9Very low100 Ų100154.6 Ų154.683%0.82681%0.811SS**  trans-82.3100.717900000110.6
30H37.2Very low41.7Very low182 Ų182152 Ų15284%0.84380%0.801SS**  trans-164.574.7156.4-128.4-78.8000108.9R28R28-H30 PolarHBondContact O-N 3.35Å
31D36.9Very low43.2Very low166 Ų166148.7 Ų148.789%0.88879%0.791SS**  trans-166.677.6157.4-98.2-22.5000107.7
32A35.9Very low44.5Very low104 Ų104144 Ų14486%0.8678%0.775SS**  trans-86.6103.1172.700000108.6
33C38.7Very low45.2Very low122 Ų122145.5 Ų145.582%0.82478%0.78SS**  trans-139.8112.9169.1-91.80000110.7
34S42.6Very low46Very low120 Ų120143.6 Ų143.684%0.83978%0.779SS**SBendtrans50.694158.8-71.20000120.2R36S34-R36 PolarHBondContact O-N 2.86Å
35G37.9Very low46.7Very low86 Ų86134.1 Ų134.189%0.88775%0.75SS**  66.240.7117.400000118.6
36R44.8Very low47Very low224 Ų224131.7 Ų131.785%0.84574%0.738SS**  trans-11398166.7-73.4-169.5179-169.71.2110.6S34 T38S34-R36 PolarHBondContact O-N 2.86Å; R36-T38 PolarHBondContact O-N 3.46Å
37V55.5Low47.5Very low106 Ų106126.5 Ų126.564%0.64273%0.725SS**  trans-59116158.8-179.50000106.9D41 Y42V37-D41 WeakPolarHBondContact CA-OD2 3.5Å; V37-D41 HydrophobicContact CG1-CB 4.13Å; V37-Y42 HydrophobicContact CG1-CE2 3.73Å
38T65.1Low48.1Very low73 Ų73120.7 Ų120.745%0.44871%0.713SS.*  trans-97.2159.1173.567.20000109.4R36 A40 D41R36-T38 PolarHBondContact O-N 3.46Å; T38-A40 PolarHBondContact O-N 3.38Å; T38-D41 PolarHBondContact N-OD2 3.14Å; T38-D41 WeakPolarHBondContact O-CB 3.43Å; T38-D41 PolarHBondContact O-N 3.03Å; T38-D41 PolarHBondContact OG1-OD2 3.22Å
39V54.9Low48.7Very low103 Ų103114.5 Ų114.562%0.62470%0.702SS**G310 helixtrans-56.2-19.4177.9176.80000112.3D41 S45V39-D41 VanDerWaalsContact C-N 3.27Å; V39-D41 PolarHBondContact O-N 3.11Å; V39-S45 WeakPolarHBondContact O-CB 3.18Å; V39-S45 PolarHBondContact O-OG 2.9Å
40A55.9Low49.5Very low70 Ų70114.9 Ų114.958%0.57969%0.693SS**G310 helixtrans-74.5-9.7175.700000114.5T38T38-A40 PolarHBondContact O-N 3.38Å
41D67.3Low49.9Very low102 Ų102117 Ų11755%0.54569%0.694SS.*G310 helixtrans-90.12.4-175-58.7-36.9000113.6V37 T38 V39V37-D41 WeakPolarHBondContact CA-OD2 3.5Å; V37-D41 HydrophobicContact CG1-CB 4.13Å; T38-D41 PolarHBondContact N-OD2 3.14Å; T38-D41 WeakPolarHBondContact O-CB 3.43Å; T38-D41 PolarHBondContact O-N 3.03Å; T38-D41 PolarHBondContact OG1-OD2 3.22Å; V39-D41 VanDerWaalsContact C-N 3.27Å; V39-D41 PolarHBondContact O-N 3.11Å
42Y61.3Low50.2Low158 Ų158112.9 Ų112.962%0.6268%0.678SS**SBendtrans-106139.4175.5-67.5-85.1000111.4V37 N44 S45V37-Y42 HydrophobicContact CG1-CE2 3.73Å; Y42-N44 PolarHBondContact O-N 3.03Å; Y42-S45 PolarHBondContact O-N 2.71Å; Y42-S45 VanDerWaalsContact O-N 3.16Å
43A48.6Very low50.9Low106 Ų106112.5 Ų112.588%0.87669%0.685SS**THydrogen-bonded Turntrans-62.23.2-163.700000117.5
44N56.7Low51.3Low162 Ų162116.8 Ų116.887%0.86668%0.683SS**THydrogen-bonded Turntrans-131.113178.9-77.2-16.3000114.3Y42 D46Y42-N44 PolarHBondContact O-N 3.03Å; N44-D46 PolarHBondContact O-N 2.62Å
45S48.6Very low52Low44 Ų44116 Ų11631%0.30867%0.673SS.*  trans-86.690.7-178.9-64.40000111.4V39 Y42 P47V39-S45 WeakPolarHBondContact O-CB 3.18Å; V39-S45 PolarHBondContact O-OG 2.9Å; Y42-S45 PolarHBondContact O-N 2.71Å; Y42-S45 VanDerWaalsContact O-N 3.16Å; S45-P47 WeakPolarHBondContact O-CD 3.44Å; S45-P47 VanDerWaalsContact O-N 3.16Å
46D48Very low53.3Low98 Ų98119.5 Ų119.552%0.52466%0.664SS.*  trans-59.4114.8165.9-178.1-5.6000109.4N44 A48 V49N44-D46 PolarHBondContact O-N 2.62Å; D46-A48 PolarHBondContact O-N 3.11Å; D46-A48 WeakPolarHBondContact OD1-CB 3.5Å; D46-A48 PolarHBondContact OD1-N 3.46Å; D46-V49 PolarHBondContact O-N 3.1Å
47P49.9Very low54.6Low91 Ų91116.8 Ų116.859%0.59166%0.658SS**THydrogen-bonded Turntrans-61.7-11.3179.7-18.831.7000113.8S45S45-P47 WeakPolarHBondContact O-CD 3.44Å; S45-P47 VanDerWaalsContact O-N 3.16Å
48A50.3Low55.3Low74 Ų74115.2 Ų115.261%0.61266%0.657SS**THydrogen-bonded Turntrans-74.6-21.4179.900000114.1D46D46-A48 PolarHBondContact O-N 3.11Å; D46-A48 WeakPolarHBondContact OD1-CB 3.5Å; D46-A48 PolarHBondContact OD1-N 3.46Å
49V52.1Low55.2Low114 Ų114115.6 Ų115.669%0.69166%0.658SS**SBendtrans-83.9-24.2-177-177.30000112.4D46 R51D46-V49 PolarHBondContact O-N 3.1Å; V49-R51 PolarHBondContact O-N 2.89Å
50V50.2Low55.7Low107 Ų107112.9 Ų112.965%0.64865%0.647SS**THydrogen-bonded Turntrans-87.6-6.7-169.8-169.40000113.3S52V50-S52 PolarHBondContact O-N 3.36Å
51R46.9Very low56.4Low228 Ų228113.3 Ų113.386%0.8664%0.639SS**THydrogen-bonded Turntrans-87.3-1.2-172.4-72-163.1176.1178.31116.6V49V49-R51 PolarHBondContact O-N 2.89Å
52S43.6Very low56.5Low78 Ų78110.7 Ų110.755%0.54563%0.632SS.*  trans-136.7110167.866.50000109.6V50 R54V50-S52 PolarHBondContact O-N 3.36Å; S52-R54 PolarHBondContact O-N 3.21Å
53G50.5Low56.6Low97 Ų97107 Ų107100%163%0.626SS**SBendtrans-63.827.1175.500000115
54R46.1Very low57.4Low212 Ų212106.1 Ų106.180%0.860%0.604SS**  trans-121.497.4175.9-162.2177.9-154.2176.86.9108.1S52 K56S52-R54 PolarHBondContact O-N 3.21Å; R54-K56 PolarHBondContact O-N 3.24Å; R54-K56 VanDerWaalsContact O-N 3.08Å
55V57.9Low57.9Low104 Ų104104.4 Ų104.463%0.6359%0.59SS**  trans-57116.4168.4-1790000107.3K57 V59 A60V55-K57 PolarHBondContact O-N 3.23Å; V55-V59 HydrophobicContact CG1-CB 3.92Å; V55-V59 HydrophobicContact CG1-CG1 4.03Å; V55-A60 HydrophobicContact CG1-CB 4.09Å
56K64.7Low58.5Low158 Ų158108.3 Ų108.369%0.68760%0.604SS**  trans-61.4137.4175.9-73.4-179.7179.6173.40107.9R54 A58 V59 A60R54-K56 PolarHBondContact O-N 3.24Å; R54-K56 VanDerWaalsContact O-N 3.08Å; K56-A58 PolarHBondContact O-N 3.34Å; K56-V59 HydrophobicContact CB-CG2 4.44Å; K56-V59 WeakPolarHBondContact O-CA 3.33Å; K56-V59 WeakPolarHBondContact O-CB 3.48Å; K56-V59 PolarHBondContact O-N 3.14Å; K56-A60 PolarHBondContact O-N 3.47Å
57K71.7Confident58.9Low168 Ų168107.2 Ų107.273%0.7360%0.6SS**Hα-helixtrans-48.6-32.3179.9-172.2176.7-179.2-1800113.2V55 N61V55-K57 PolarHBondContact O-N 3.23Å; K57-N61 VanDerWaalsContact O-CB 3.29Å; K57-N61 WeakPolarHBondContact O-CB 3.47Å; K57-N61 VanDerWaalsContact O-CG 3.22Å; K57-N61 PolarHBondContact O-N 3.05Å
58A71.2Confident59.5Low73 Ų73107.9 Ų107.960%0.60359%0.594SS**Hα-helixtrans-63.8-40.8174.800000113.3K56 N61 A62K56-A58 PolarHBondContact O-N 3.34Å; A58-N61 PolarHBondContact O-N 3.24Å; A58-A62 WeakPolarHBondContact O-CB 3.32Å; A58-A62 PolarHBondContact O-N 2.9Å
59V62.1Low59.7Low80 Ų80107.5 Ų107.549%0.48559%0.587SS.*Hα-helixtrans-70.5-43.2177.4179.60000110.4V55 K56 N61 A62 V63V55-V59 HydrophobicContact CG1-CB 3.92Å; V55-V59 HydrophobicContact CG1-CG1 4.03Å; K56-V59 HydrophobicContact CB-CG2 4.44Å; K56-V59 WeakPolarHBondContact O-CA 3.33Å; K56-V59 WeakPolarHBondContact O-CB 3.48Å; K56-V59 PolarHBondContact O-N 3.14Å; V59-N61 VanDerWaalsContact C-N 3.3Å; V59-N61 PolarHBondContact O-N 2.95Å; V59-A62 PolarHBondContact O-N 3.09Å; V59-V63 HydrophobicContact CG1-CG2 4.5Å; V59-V63 WeakPolarHBondContact O-CG2 3.4Å; V59-V63 PolarHBondContact O-N 3.07Å
60A66.8Low59.8Low47 Ų47108.2 Ų108.239%0.38859%0.586SS.*Hα-helixtrans-61-4017400000112V55 K56 Q64V55-A60 HydrophobicContact CG1-CB 4.09Å; K56-A60 PolarHBondContact O-N 3.47Å; A60-Q64 VanDerWaalsContact O-CB 3.26Å; A60-Q64 WeakPolarHBondContact O-CB 3.35Å; A60-Q64 PolarHBondContact O-N 2.97Å
61N70.1Confident59.7Low78 Ų78106.4 Ų106.442%0.41758%0.577SS.*Hα-helixtrans-68.5-37.4174.7-78-11.8000112.4K57 A58 V59 Q64 Q65K57-N61 VanDerWaalsContact O-CB 3.29Å; K57-N61 WeakPolarHBondContact O-CB 3.47Å; K57-N61 VanDerWaalsContact O-CG 3.22Å; K57-N61 PolarHBondContact O-N 3.05Å; A58-N61 PolarHBondContact O-N 3.24Å; V59-N61 VanDerWaalsContact C-N 3.3Å; V59-N61 PolarHBondContact O-N 2.95Å; N61-Q64 PolarHBondContact O-N 3.34Å; N61-Q65 WeakPolarHBondContact O-CB 3.43Å; N61-Q65 VanDerWaalsContact O-CG 3.23Å; N61-Q65 WeakPolarHBondContact O-CG 3.5Å; N61-Q65 PolarHBondContact O-N 3.46Å
62A69Low59.5Low48 Ų4898.4 Ų98.440%0.39757%0.566SS.*Hα-helixtrans-65.3-48.7176.900000110.9A58 V59 Q64 Q65 E66A58-A62 WeakPolarHBondContact O-CB 3.32Å; A58-A62 PolarHBondContact O-N 2.9Å; V59-A62 PolarHBondContact O-N 3.09Å; A62-Q64 VanDerWaalsContact C-N 3.28Å; A62-Q64 PolarHBondContact O-N 3.01Å; A62-Q65 PolarHBondContact O-N 3.42Å; A62-E66 PolarHBondContact O-N 2.92Å
63V64.4Low59.1Low79 Ų79100.4 Ų100.448%0.47957%0.57SS.*Hα-helixtrans-58.9-41.4173.4174.70000110.7V59 Q65 E66 V67V59-V63 HydrophobicContact CG1-CG2 4.5Å; V59-V63 WeakPolarHBondContact O-CG2 3.4Å; V59-V63 PolarHBondContact O-N 3.07Å; V63-Q65 VanDerWaalsContact C-N 3.34Å; V63-Q65 PolarHBondContact O-N 3.25Å; V63-E66 PolarHBondContact O-N 2.9Å; V63-V67 HydrophobicContact CG1-CG2 4.32Å; V63-V67 WeakPolarHBondContact O-CB 3.2Å; V63-V67 WeakPolarHBondContact O-CG2 3.42Å; V63-V67 PolarHBondContact O-N 3.36Å
64Q65.5Low58.3Low89 Ų89104.3 Ų104.342%0.41656%0.563SS.*Hα-helixtrans-65.5-34.9175.9-171.2-179.1-0.100112.8A60 N61 A62 K68A60-Q64 VanDerWaalsContact O-CB 3.26Å; A60-Q64 WeakPolarHBondContact O-CB 3.35Å; A60-Q64 PolarHBondContact O-N 2.97Å; N61-Q64 PolarHBondContact O-N 3.34Å; A62-Q64 VanDerWaalsContact C-N 3.28Å; A62-Q64 PolarHBondContact O-N 3.01Å; Q64-K68 WeakPolarHBondContact O-CB 3.34Å; Q64-K68 VanDerWaalsContact O-CG 3.23Å; Q64-K68 WeakPolarHBondContact O-CG 3.43Å; Q64-K68 PolarHBondContact O-N 3.4Å
65Q67.4Low57.7Low125 Ų12599.5 Ų99.558%0.58457%0.568SS**Hα-helixtrans-72.9-41.2176.2-74.4-71.91.900111.5N61 A62 V63 K68 S69N61-Q65 WeakPolarHBondContact O-CB 3.43Å; N61-Q65 VanDerWaalsContact O-CG 3.23Å; N61-Q65 WeakPolarHBondContact O-CG 3.5Å; N61-Q65 PolarHBondContact O-N 3.46Å; A62-Q65 PolarHBondContact O-N 3.42Å; V63-Q65 VanDerWaalsContact C-N 3.34Å; V63-Q65 PolarHBondContact O-N 3.25Å; Q65-K68 PolarHBondContact O-N 2.98Å; Q65-S69 WeakPolarHBondContact O-CB 3.27Å; Q65-S69 PolarHBondContact O-N 3.38Å
66E59.5Low56.4Low126 Ų12699.6 Ų99.659%0.58957%0.573SS**Hα-helixtrans-63.3-44.3173.9-76.3177.7174.600111.3A62 V63 K68 S69 L70A62-E66 PolarHBondContact O-N 2.92Å; V63-E66 PolarHBondContact O-N 2.9Å; E66-K68 VanDerWaalsContact C-N 3.31Å; E66-K68 PolarHBondContact O-N 3.11Å; E66-S69 WeakPolarHBondContact O-CB 3.29Å; E66-S69 PolarHBondContact O-N 2.94Å; E66-L70 WeakPolarHBondContact O-CB 3.37Å; E66-L70 VanDerWaalsContact O-CG 3.3Å; E66-L70 WeakPolarHBondContact O-CG 3.47Å; E66-L70 PolarHBondContact O-N 2.59Å
67V58.1Low54.7Low75 Ų75100.6 Ų100.646%0.45558%0.58SS.*Hα-helixtrans-60.8-41174.1171.30000110.9V63 C71V63-V67 HydrophobicContact CG1-CG2 4.32Å; V63-V67 WeakPolarHBondContact O-CB 3.2Å; V63-V67 WeakPolarHBondContact O-CG2 3.42Å; V63-V67 PolarHBondContact O-N 3.36Å; V67-C71 VanDerWaalsContact O-CB 3.31Å; V67-C71 WeakPolarHBondContact O-CB 2.98Å; V67-C71 PolarHBondContact O-N 3.4Å; V67-C71 PolarHBondContact O-SG 2.71Å
68K62.3Low52.9Low105 Ų10599 Ų9946%0.45759%0.585SS.*Hα-helixtrans-66.4-38.8175-78.7174.2-179.8179.50112.9Q64 Q65 E66 G72Q64-K68 WeakPolarHBondContact O-CB 3.34Å; Q64-K68 VanDerWaalsContact O-CG 3.23Å; Q64-K68 WeakPolarHBondContact O-CG 3.43Å; Q64-K68 PolarHBondContact O-N 3.4Å; Q65-K68 PolarHBondContact O-N 2.98Å; E66-K68 VanDerWaalsContact C-N 3.31Å; E66-K68 PolarHBondContact O-N 3.11Å; K68-G72 PolarHBondContact O-N 3.27Å
69S54.8Low50.9Low66 Ų66101.1 Ų101.146%0.46259%0.592SS.*Hα-helixtrans-65.5-43.9177.2-1740000111.2Q65 E66 G72Q65-S69 WeakPolarHBondContact O-CB 3.27Å; Q65-S69 PolarHBondContact O-N 3.38Å; E66-S69 WeakPolarHBondContact O-CB 3.29Å; E66-S69 PolarHBondContact O-N 2.94Å; S69-G72 PolarHBondContact O-N 2.89Å
70L52.7Low49.5Very low129 Ų129101.9 Ų101.968%0.67561%0.607SS**Hα-helixtrans-74.7-26.1-178.3-71.2165000113.3E66E66-L70 WeakPolarHBondContact O-CB 3.37Å; E66-L70 VanDerWaalsContact O-CG 3.3Å; E66-L70 WeakPolarHBondContact O-CG 3.47Å; E66-L70 PolarHBondContact O-N 2.59Å
71C47.6Very low48.2Very low69 Ų69107.9 Ų107.947%0.46663%0.627SS.*THydrogen-bonded Turntrans-88.4-6.5177.4-62.10000113.9V67 L275V67-C71 VanDerWaalsContact O-CB 3.31Å; V67-C71 WeakPolarHBondContact O-CB 2.98Å; V67-C71 PolarHBondContact O-N 3.4Å; V67-C71 PolarHBondContact O-SG 2.71Å; C71-L275 WeakPolarHBondContact SG-CD2 3.09Å
72G44.7Very low46.4Very low61 Ų61112.8 Ų112.863%0.62965%0.647SS**SBendtrans-118.83.7-17200000115.5K68 S69K68-G72 PolarHBondContact O-N 3.27Å; S69-G72 PolarHBondContact O-N 2.89Å
73L33.2Very low44.9Very low120 Ų120114.7 Ų114.763%0.62866%0.663SS**SBendtrans-129123.6-178.3-72.3164.4000109.1
74E34.3Very low43.7Very low179 Ų179118.5 Ų118.584%0.83668%0.679SS**SBendtrans80.576.8171.1-48.6-150.7166.900118.3
75A33.6Very low42.1Very low110 Ų110119.7 Ų119.791%0.90970%0.698SS**SBendtrans-158.725.8150.600000113.2
76S30Very low40.6Very low106 Ų106117.4 Ų117.474%0.74171%0.708SS**SBendtrans-143.280.2179.3162.50000108.3
77Q29.7Very low39.5Very low179 Ų179116.5 Ų116.584%0.83672%0.722SS**  trans170.398.3151.6-96.6173.772.800109
78V33.3Very low38.4Very low136 Ų136116.8 Ų116.882%0.82474%0.74SS**  trans-131.3109.8151.6-179.30000105.5
79P30Very low37.3Very low117 Ų117121 Ų12176%0.7676%0.761SS**  trans-77.9120.6163.7-0.918.9000107.7
80A32.6Very low36.3Very low96 Ų96122.9 Ų122.979%0.79377%0.772SS**  trans-112.698.7164.500000107.3
81E38.7Very low35.8Very low173 Ų173123.2 Ų123.281%0.80878%0.784SS**  trans-75.7138.4164.7-86-172.6162.200110.6
82E33.1Very low35.3Very low181 Ų181126.3 Ų126.385%0.84680%0.796SS**  trans57.5107.1148.1-61.5-170.6164.300120.7
83A37.7Very low35.4Very low88 Ų88131.8 Ų131.873%0.72781%0.809SS**  -165.1117.9129.500000112.1
84L38.8Very low36.2Very low158 Ų158132.7 Ų132.783%0.82781%0.813SS**  trans8388.6140.8-59.3162.8000120.3
85S32.5Very low36.6Very low114 Ų114131.2 Ų131.280%0.79781%0.811SS**  31.6125.4117.960.70000121.6
86G35.3Very low37.1Very low77 Ų77130.3 Ų130.379%0.79480%0.798SS**  trans148.986.815500000112.1
87A35.6Very low37.9Very low108 Ų108129.8 Ų129.889%0.89379%0.794SS**  93.8118.183.200000114.2
88G35.6Very low38.7Very low81 Ų81127.6 Ų127.684%0.83579%0.788SS**  trans94.6126.216500000114.7
89E39.6Very low39.4Very low192 Ų192128.2 Ų128.290%0.89778%0.782SS**  cis-170.6143.68.1-150.8175.9-163.400106.1
90P34.6Very low40.5Very low107 Ų107129.2 Ų129.270%0.69578%0.778SS**  trans-101.5153.9-174.436.8-28.9000113
91C42Very low41.1Very low136 Ų136130.9 Ų130.992%0.91977%0.774SS**  trans-134.9118.9159.3-92.40000110.2
92D36.4Very low41.4Very low133 Ų133125.6 Ų125.671%0.71176%0.76SS**  trans-61.3154178.1-55-62.1000113
93I46.6Very low41.8Very low176 Ų176125.3 Ų125.390%0.90376%0.759SS**  -158.3134.8128.7-88.7144.2000108.4
94I50.3Low41.7Very low140 Ų140128.6 Ų128.672%0.71876%0.759SS**  trans-86171-159.7-70.2154.7000113.3
95D42.3Very low41.5Very low148 Ų148129.3 Ų129.379%0.79176%0.758SS**  trans103.4130.4155.1-92.6-5.2000115.9
96S44.7Very low41.7Very low91 Ų91128.8 Ų128.864%0.63675%0.754SS**  cis177.4145.1-0.51730000108.8
97S47.4Very low41.9Very low95 Ų95132.2 Ų132.266%0.66475%0.753SS**  trans63.1134.6137.9177.70000118.4
98D44.8Very low41.8Very low133 Ų133135.2 Ų135.271%0.71175%0.748SS**  cis-177.6163.44.7-114.3-27.9000111.2
99E49.3Very low41.8Very low148 Ų148139.3 Ų139.369%0.69275%0.746SS**  trans91.8111.2145.6-60.1-105.1133.400122.5
100M53.7Low41.6Very low139 Ų139140.3 Ų140.369%0.68574%0.741SS**  70.5137.6127.8-63.1-165.583.400119.1
101D45Very low41.9Very low130 Ų130142.2 Ų142.270%0.69575%0.751SS**  cis-166.1154.31.9-141.6-9.7000110.4
102A45.2Very low41.5Very low63 Ų63141.8 Ų141.852%0.52174%0.744SS.*  trans46118.8142.300000124.2
103Q40.2Very low41.9Very low175 Ų175141 Ų14182%0.81875%0.749SS**  66.1153.1122.2-69.9-175.8-61.700120.4
104E36.9Very low41.5Very low157 Ų157143.9 Ų143.973%0.73475%0.748SS**  cis-177.8161.6-26.4-159.3170.9-174.700102.9
105E33.6Very low41.2Very low172 Ų172147.1 Ų147.180%0.80476%0.757SS**  trans-53.2148.9-169.9-56.4171.7146.100116.7
106S36.2Very low41.5Very low104 Ų104149.8 Ų149.873%0.72776%0.762SS**  172.8117.5129.153.10000111.5
107I39.3Very low41Very low149 Ų149155.5 Ų155.576%0.76478%0.775SS**  77.2113.8102.9-61.4165000114.9
108H33.8Very low41.1Very low171 Ų171155.6 Ų155.679%0.79278%0.776SS**  trans41.7123.2150.1-61.1-25000120.2
109E37Very low40.9Very low167 Ų167159 Ų15978%0.7878%0.784SS**  -177.7130.797.2-97-169.7147.700114.2
110R34.9Very low40.9Very low213 Ų213162.6 Ų162.680%0.80479%0.791SS**  trans6.1123.2149.4-68.2166.6172.2155.8-2.5118.3
111T40.1Very low40.3Very low146 Ų146164 Ų16490%0.89680%0.796SS**  trans-137.5115.7132.819.80000111.8
112V34Very low40.2Very low127 Ų127167.1 Ų167.177%0.7780%0.803SS**  trans-72.9125.7174172.30000108.7
113S45.3Very low40Very low118 Ų118171.6 Ų171.683%0.82581%0.814SS**  trans-133.6112.9155.559.20000111.4K115S113-K115 PolarHBondContact O-N 2.88Å
114R37.6Very low39.8Very low236 Ų236170.7 Ų170.789%0.89181%0.809SS**  trans-58.6123.1179.7-71.3166.4161.7163.1-6111.2
115K45.4Very low40.4Very low207 Ų207171 Ų17190%0.982%0.815SS**  trans-141.297.4151.6-103.1176.4-174.9173.50112.4S113S113-K115 PolarHBondContact O-N 2.88Å
116K46.5Very low40.8Very low204 Ų204169.8 Ų169.889%0.88781%0.814SS**  trans53.297.5139-140.8167.1-175.1175.30118.1S118K116-S118 PolarHBondContact O-N 3.45Å
117K35.6Very low41Very low212 Ų212167.3 Ų167.392%0.92281%0.805SS**  trans-35.6113.3157.3-86.9175170.3173.60112
118S48.3Very low41.5Very low96 Ų96165.1 Ų165.167%0.67181%0.809SS**  trans-115.699.8146.9-175.10000106.6K116 R120K116-S118 PolarHBondContact O-N 3.45Å; S118-R120 PolarHBondContact O-N 3.33Å
119K42.3Very low42.8Very low206 Ų206160.5 Ų160.590%0.89681%0.808SS**  trans-71.774.1171.6-169.9-179.9-177.3-177.40106.9H121K119-H121 PolarHBondContact O-N 2.78Å
120R47.4Very low44.4Very low222 Ų222156.1 Ų156.184%0.83881%0.807SS**  trans-73.2117.5160.8-81.1-172.6176.9-175.2-1.2105.8S118 K122S118-R120 PolarHBondContact O-N 3.33Å; R120-K122 PolarHBondContact O-N 3.1Å
121H41.5Very low46.5Very low168 Ų168153.5 Ų153.578%0.77880%0.804SS**  trans-34.6110.9166.6-127.8-94.7000108.7K119 E123K119-H121 PolarHBondContact O-N 2.78Å; H121-E123 PolarHBondContact O-N 2.79Å
122K43.6Very low48.6Very low197 Ų197153.9 Ų153.986%0.85780%0.796SS**  trans-70.488156.6-173175.4-178.9-175.40102.5R120 E124R120-K122 PolarHBondContact O-N 3.1Å; K122-E124 PolarHBondContact O-N 3.23Å
123E41.3Very low51.2Low157 Ų157154 Ų15473%0.73478%0.783SS**  trans-56101.9154.4-80.8176.7167.400104H121 L125H121-E123 PolarHBondContact O-N 2.79Å; E123-L125 VanDerWaalsContact C-N 3.26Å; E123-L125 PolarHBondContact O-N 3.2Å
124E35.9Very low53.3Low156 Ų156152.3 Ų152.373%0.72977%0.77SS**  trans-48103.8154.8-152.7159.6-143.200104.4K122 D126K122-E124 PolarHBondContact O-N 3.23Å; E124-D126 HydrophobicContact CG-CB 4.19Å; E124-D126 PolarHBondContact O-N 3.28Å
125L49.5Very low55.7Low162 Ų162144.6 Ų144.685%0.84875%0.745SS**  trans-7060.5168.2-91.2159.9000107.3E123 G127E123-L125 VanDerWaalsContact C-N 3.26Å; E123-L125 PolarHBondContact O-N 3.2Å; L125-G127 PolarHBondContact O-N 2.82Å; L125-G127 VanDerWaalsContact O-N 3.11Å
126D41.9Very low57.9Low147 Ų147140.4 Ų140.479%0.78673%0.732SS**  trans-84.251.1168.6-120.116.7000107.7E124E124-D126 HydrophobicContact CG-CB 4.19Å; E124-D126 PolarHBondContact O-N 3.28Å
127G39.7Very low60.1Low53 Ų53134 Ų13455%0.54671%0.707SS.*SBendtrans-14982-160.800000112.8L125L125-G127 PolarHBondContact O-N 2.82Å; L125-G127 VanDerWaalsContact O-N 3.11Å
128A50.4Low63Low103 Ų103125.4 Ų125.485%0.85167%0.669SS**  trans61.562.2159.800000116.6G130A128-G130 PolarHBondContact O-N 3.28Å
129G61.5Low65.1Low73 Ų73122 Ų12275%0.75364%0.643SS**PPolyproline II helixtrans-59.6124.4152.100000108.5
130G69Low67.5Low75 Ų75117 Ų11777%0.77363%0.625SS**PPolyproline II helixtrans-60146.9176.500000110.9A128 E132A128-G130 PolarHBondContact O-N 3.28Å; G130-E132 PolarHBondContact O-N 2.72Å
131E79.8Confident69.8Low158 Ų158110.4 Ų110.474%0.73861%0.607SS**PPolyproline II helixtrans-58.1127.8177.1-63.3-62.1154.200110.9Y133E131-Y133 HydrophobicContact CB-CE2 4.19Å; E131-Y133 PolarHBondContact O-N 2.92Å
132E84.4Confident72.4Confident155 Ų155102.7 Ų102.772%0.72457%0.572SS**  trans-8299.1173.2-172.3169.6-171.900109.7G130 N159G130-E132 PolarHBondContact O-N 2.72Å; E132-N159 WeakPolarHBondContact CG-ND2 3.49Å; E132-N159 PolarHBondContact OE1-ND2 3.31Å
133Y87.8Confident74.7Confident128 Ų12895.5 Ų95.550%0.50255%0.546SS..  trans-69.9140.2174-68-84.7000111.2E131 I137 W138 N159E131-Y133 HydrophobicContact CB-CE2 4.19Å; E131-Y133 PolarHBondContact O-N 2.92Å; Y133-I137 HydrophobicContact CD1-CG2 4.35Å; Y133-I137 HydrophobicContact CG-CG2 4.44Å; Y133-W138 PolarHBondContact O-NE1 2.95Å; Y133-N159 PolarHBondContact O-ND2 3Å
134P90.1Very high77.2Confident84 Ų8496.5 Ų96.555%0.54555%0.545SS..  trans-54.1151.9173.6-25.533.3000112.7D136 I137P134-D136 PolarHBondContact O-N 3.42Å; P134-D136 VanDerWaalsContact O-N 3.11Å; P134-I137 WeakPolarHBondContact O-CB 3.22Å; P134-I137 PolarHBondContact O-N 3.16Å
135M88Confident80.1Confident73 Ų7391 Ų9136%0.3652%0.52SS..Hα-helixtrans-57.3-30.7-178.3-164.7173.3-6300113.1I137 W138 L139 T162 V163M135-I137 VanDerWaalsContact C-N 3.3Å; M135-I137 PolarHBondContact O-N 3.4Å; M135-W138 WeakPolarHBondContact O-CB 3.32Å; M135-W138 PolarHBondContact O-N 3.2Å; M135-W138 VanDerWaalsContact O-N 3.14Å; M135-L139 PolarHBondContact O-N 3.49Å; M135-T162 HydrophobicContact CE-CG2 3.74Å; M135-T162 HydrophobicContact SD-CG2 4.23Å; M135-V163 HydrophobicContact CG-CG2 3.83Å
136D90.5Very high82.4Confident120 Ų12089.5 Ų89.564%0.64250%0.503SS*.Hα-helixtrans-61.8-35.7177.6-65.3-30.8000113P134 L139 L140P134-D136 PolarHBondContact O-N 3.42Å; P134-D136 VanDerWaalsContact O-N 3.11Å; D136-L139 PolarHBondContact O-N 2.93Å; D136-L140 WeakPolarHBondContact O-CB 3.45Å; D136-L140 PolarHBondContact O-N 2.67Å
137I94Very high85Confident70 Ų7083 Ų8336%0.35947%0.468SS..Hα-helixtrans-65.2-44.7174.8-59-60.1000109.7Y133 P134 M135 L139 L140 L141Y133-I137 HydrophobicContact CD1-CG2 4.35Å; Y133-I137 HydrophobicContact CG-CG2 4.44Å; P134-I137 WeakPolarHBondContact O-CB 3.22Å; P134-I137 PolarHBondContact O-N 3.16Å; M135-I137 VanDerWaalsContact C-N 3.3Å; M135-I137 PolarHBondContact O-N 3.4Å; I137-L139 VanDerWaalsContact C-N 3.34Å; I137-L139 PolarHBondContact O-N 3.2Å; I137-L140 WeakPolarHBondContact O-CB 3.37Å; I137-L140 PolarHBondContact O-N 3.36Å; I137-L141 HydrophobicContact CG2-CD1 4.17Å; I137-L141 HydrophobicContact CG2-CG 4.46Å; I137-L141 VanDerWaalsContact O-CG 3.32Å; I137-L141 WeakPolarHBondContact O-CG 3.48Å; I137-L141 PolarHBondContact O-N 3.1Å
138W95Very high87.7Confident31 Ų3182.9 Ų82.912%0.11745%0.454CS..Hα-helixtrans-64.7-37.8176.5-65.3101.8000112.2Y133 M135 L140 L141 A142 F153 I156 C157 N159 A160 V163Y133-W138 PolarHBondContact O-NE1 2.95Å; M135-W138 WeakPolarHBondContact O-CB 3.32Å; M135-W138 PolarHBondContact O-N 3.2Å; M135-W138 VanDerWaalsContact O-N 3.14Å; W138-L140 VanDerWaalsContact C-N 3.34Å; W138-L141 HydrophobicContact CE3-CD1 4.17Å; W138-L141 HydrophobicContact CZ3-CD1 4.36Å; W138-L141 PolarHBondContact O-N 2.87Å; W138-A142 VanDerWaalsContact O-CB 3.22Å; W138-A142 WeakPolarHBondContact O-CB 3.16Å; W138-A142 PolarHBondContact O-N 3.26Å; W138-F153 HydrophobicContact CE3-CE2 4.06Å; W138-F153 HydrophobicContact CE3-CZ 4.15Å; W138-F153 HydrophobicContact CZ3-CE2 4.46Å; W138-I156 HydrophobicContact CH2-CG2 3.69Å; W138-I156 HydrophobicContact CZ3-CB 4.42Å; W138-I156 HydrophobicContact CZ3-CD1 4.47Å; W138-I156 HydrophobicContact CZ3-CG2 3.85Å; W138-C157 VanDerWaalsContact CH2-SG 3.54Å; W138-C157 WeakPolarHBondContact CZ2-SG 3.32Å; W138-N159 VanDerWaalsContact CD1-CB 3.42Å; W138-N159 HydrophobicContact CD2-CB 4.39Å; W138-N159 HydrophobicContact CG-CB 3.97Å; W138-A160 HydrophobicContact CD2-CB 4.29Å; W138-A160 HydrophobicContact CE3-CB 3.66Å; W138-A160 HydrophobicContact CZ3-CB 3.88Å; W138-V163 HydrophobicContact CB-CB 4.48Å; W138-V163 HydrophobicContact CB-CG2 3.6Å
139L92.4Very high89.9Confident25 Ų2580 Ų8013%0.13142%0.424CS..Hα-helixtrans-64.5-36.8173.4-82.2166.8000112.5M135 D136 I137 V163 A168M135-L139 PolarHBondContact O-N 3.49Å; D136-L139 PolarHBondContact O-N 2.93Å; I137-L139 VanDerWaalsContact C-N 3.34Å; I137-L139 PolarHBondContact O-N 3.2Å; L139-V163 HydrophobicContact CD2-CG1 3.79Å; L139-V163 HydrophobicContact CD2-CG2 4.22Å; L139-V163 HydrophobicContact CG-CG1 4.23Å; L139-V163 HydrophobicContact CG-CG2 3.88Å; L139-A168 HydrophobicContact CD2-CB 4.45Å
140L93.9Very high91.6Very high100 Ų10077.6 Ų77.652%0.52439%0.394SS..Hα-helixtrans-68-49.5174.9-178.465.3000110.7D136 I137 W138 A142 S143 Y144D136-L140 WeakPolarHBondContact O-CB 3.45Å; D136-L140 PolarHBondContact O-N 2.67Å; I137-L140 WeakPolarHBondContact O-CB 3.37Å; I137-L140 PolarHBondContact O-N 3.36Å; W138-L140 VanDerWaalsContact C-N 3.34Å; L140-A142 VanDerWaalsContact C-N 3.29Å; L140-A142 PolarHBondContact O-N 2.71Å; L140-S143 WeakPolarHBondContact O-CB 3.14Å; L140-S143 PolarHBondContact O-N 2.9Å; L140-S143 VanDerWaalsContact O-N 3.11Å; L140-S143 PolarHBondContact O-OG 2.8Å; L140-Y144 WeakPolarHBondContact O-CD2 3.17Å
141L95.4Very high92.8Very high84 Ų8478.6 Ų78.644%0.4439%0.385SS..Hα-helixtrans-58.6-42.3177.1-70.1174.4000111.6I137 W138 S143 Y144 F153I137-L141 HydrophobicContact CG2-CD1 4.17Å; I137-L141 HydrophobicContact CG2-CG 4.46Å; I137-L141 VanDerWaalsContact O-CG 3.32Å; I137-L141 WeakPolarHBondContact O-CG 3.48Å; I137-L141 PolarHBondContact O-N 3.1Å; W138-L141 HydrophobicContact CE3-CD1 4.17Å; W138-L141 HydrophobicContact CZ3-CD1 4.36Å; W138-L141 PolarHBondContact O-N 2.87Å; L141-S143 PolarHBondContact O-N 3.22Å; L141-S143 VanDerWaalsContact O-N 3.1Å; L141-Y144 PolarHBondContact O-N 3.04Å; L141-F153 HydrophobicContact CB-CE2 4.26Å
142A95.2Very high93.6Very high6 Ų675.9 Ų75.95%0.0538%0.375CS..Hα-helixtrans-57.5-26.5178.800000113.5W138 L140 Y144 I145 F153 V163 F169W138-A142 VanDerWaalsContact O-CB 3.22Å; W138-A142 WeakPolarHBondContact O-CB 3.16Å; W138-A142 PolarHBondContact O-N 3.26Å; L140-A142 VanDerWaalsContact C-N 3.29Å; L140-A142 PolarHBondContact O-N 2.71Å; A142-Y144 PolarHBondContact O-N 3.41Å; A142-I145 PolarHBondContact O-N 3.44Å; A142-F153 HydrophobicContact CB-CE1 3.84Å; A142-F153 HydrophobicContact CB-CZ 3.75Å; A142-V163 HydrophobicContact CB-CG1 3.7Å; A142-F169 HydrophobicContact CB-CD2 3.78Å; A142-F169 HydrophobicContact CB-CE2 3.95Å
143S92.7Very high94.2Very high46 Ų4668.8 Ų68.832%0.32234%0.342SS..THydrogen-bonded Turntrans-66.3-16.5177.776.30000114.1L140 L141 R176L140-S143 WeakPolarHBondContact O-CB 3.14Å; L140-S143 PolarHBondContact O-N 2.9Å; L140-S143 VanDerWaalsContact O-N 3.11Å; L140-S143 PolarHBondContact O-OG 2.8Å; L141-S143 PolarHBondContact O-N 3.22Å; L141-S143 VanDerWaalsContact O-N 3.1Å; S143-R176 WeakPolarHBondContact O-CD 3.28Å; S143-R176 PolarHBondContact O-NH1 2.7Å
144Y94.9Very high94.6Very high178 Ų17863.8 Ų63.870%0.69833%0.326SS*.THydrogen-bonded Turntrans-103.7-10.5178.7-62.6-82.8000113.4L140 L141 A142 R146L140-Y144 WeakPolarHBondContact O-CD2 3.17Å; L141-Y144 PolarHBondContact O-N 3.04Å; A142-Y144 PolarHBondContact O-N 3.41Å; Y144-R146 PolarHBondContact O-N 3.15Å
145I96.3Very high94.8Very high40 Ų4066.2 Ų66.221%0.20533%0.333CS..  trans-71.6129.3-178.5-59.1-59.8000109.9A142 D149 I150 F153 R176A142-I145 PolarHBondContact O-N 3.44Å; I145-D149 HydrophobicContact CG2-CB 3.9Å; I145-I150 HydrophobicContact CG2-CG1 4.47Å; I145-F153 HydrophobicContact CD1-CB 4.2Å; I145-F153 HydrophobicContact CD1-CD2 3.61Å; I145-F153 HydrophobicContact CD1-CE2 4.3Å; I145-F153 HydrophobicContact CD1-CG 4.12Å; I145-F153 HydrophobicContact CG1-CB 4.09Å; I145-F153 HydrophobicContact CG1-CD1 4.45Å; I145-F153 HydrophobicContact CG1-CD2 3.55Å; I145-F153 HydrophobicContact CG1-CE2 4.06Å; I145-F153 HydrophobicContact CG1-CG 3.77Å; I145-F153 HydrophobicContact CG2-CB 3.87Å; I145-F153 HydrophobicContact CG2-CG 4.36Å; I145-R176 VanDerWaalsContact O-CZ 3.25Å; I145-R176 PolarHBondContact O-NH1 2.84Å; I145-R176 PolarHBondContact O-NH2 3.02Å
146R96.7Very high95Very high131 Ų13167.7 Ų67.749%0.49434%0.342SS..  trans-70.7150.3176.2-60.4-179.4-62168.71.5110.8Y144 E148 D149 I150Y144-R146 PolarHBondContact O-N 3.15Å; R146-E148 HydrophobicContact CB-CG 4.21Å; R146-E148 WeakPolarHBondContact CB-OE2 3.16Å; R146-E148 VanDerWaalsContact CD-OE1 3.32Å; R146-E148 WeakPolarHBondContact CD-OE1 3.42Å; R146-E148 IonicContact CZ-OE1 3.16Å; R146-E148 IonicContact NE-OE1 3.23Å; R146-E148 PolarHBondContact NE-OE1 2.97Å; R146-E148 IonicContact NH1-OE1 3.1Å; R146-E148 PolarHBondContact NH1-OE1 2.84Å; R146-E148 VanDerWaalsContact NH1-OE1 3.1Å; R146-E148 IonicContact NH2-OE1 3.43Å; R146-E148 PolarHBondContact O-N 3.22Å; R146-E148 VanDerWaalsContact O-N 3.13Å; R146-D149 IonicContact CZ-OD2 3.2Å; R146-D149 IonicContact NE-OD2 2.79Å; R146-D149 PolarHBondContact NE-OD2 3.22Å; R146-D149 IonicContact NH2-OD1 3.58Å; R146-D149 IonicContact NH2-OD2 2.72Å; R146-D149 PolarHBondContact NH2-OD2 3.38Å; R146-D149 PolarHBondContact O-N 3.42Å; R146-I150 PolarHBondContact O-N 3.33Å
147P97.2Very high95.1Very high9 Ų964.2 Ų64.26%0.05833%0.326CS..G310 helixtrans-49.1-37.8177.1-30.736.8000115.5D149 I150 L173 L207 Y211 F214P147-D149 VanDerWaalsContact C-N 3.28Å; P147-D149 PolarHBondContact O-N 3.02Å; P147-I150 WeakPolarHBondContact O-CD1 3.33Å; P147-I150 WeakPolarHBondContact O-CG1 3.18Å; P147-L173 HydrophobicContact CG-CD1 4.24Å; P147-L207 HydrophobicContact CB-CD1 4.14Å; P147-L207 HydrophobicContact CG-CD1 4.4Å; P147-L207 HydrophobicContact CG-CD2 4.09Å; P147-Y211 HydrophobicContact CB-CD1 3.88Å; P147-Y211 HydrophobicContact CB-CE1 3.72Å; P147-Y211 HydrophobicContact CG-CD1 3.7Å; P147-Y211 HydrophobicContact CG-CD2 4.2Å; P147-Y211 HydrophobicContact CG-CE1 3.59Å; P147-Y211 HydrophobicContact CG-CE2 4.11Å; P147-Y211 HydrophobicContact CG-CG 4.01Å; P147-F214 HydrophobicContact CB-CE1 4.27Å; P147-F214 HydrophobicContact CB-CE2 3.78Å; P147-F214 HydrophobicContact CB-CZ 3.51Å
148E96.2Very high94.9Very high52 Ų5267.2 Ų67.224%0.24334%0.337CS..G310 helixtrans-69.3-21.517760.5-91-148.600114.4R146 Y211 F214R146-E148 HydrophobicContact CB-CG 4.21Å; R146-E148 WeakPolarHBondContact CB-OE2 3.16Å; R146-E148 VanDerWaalsContact CD-OE1 3.32Å; R146-E148 WeakPolarHBondContact CD-OE1 3.42Å; R146-E148 IonicContact CZ-OE1 3.16Å; R146-E148 IonicContact NE-OE1 3.23Å; R146-E148 PolarHBondContact NE-OE1 2.97Å; R146-E148 IonicContact NH1-OE1 3.1Å; R146-E148 PolarHBondContact NH1-OE1 2.84Å; R146-E148 VanDerWaalsContact NH1-OE1 3.1Å; R146-E148 IonicContact NH2-OE1 3.43Å; R146-E148 PolarHBondContact O-N 3.22Å; R146-E148 VanDerWaalsContact O-N 3.13Å; E148-Y211 VanDerWaalsContact CD-OH 3.3Å; E148-Y211 PolarHBondContact OE1-OH 3.34Å; E148-Y211 WeakPolarHBondContact OE2-CE1 3.37Å; E148-Y211 VanDerWaalsContact OE2-CZ 3.3Å; E148-Y211 PolarHBondContact OE2-OH 3.5Å; E148-F214 HydrophobicContact CB-CE1 4.26Å
149D97.3Very high94.8Very high43 Ų4366.8 Ų66.823%0.2334%0.336CS..G310 helixtrans-99.50.8-173.7-66-43.7000112.9I145 R146 P147 V151 N152 F153I145-D149 HydrophobicContact CG2-CB 3.9Å; R146-D149 IonicContact CZ-OD2 3.2Å; R146-D149 IonicContact NE-OD2 2.79Å; R146-D149 PolarHBondContact NE-OD2 3.22Å; R146-D149 IonicContact NH2-OD1 3.58Å; R146-D149 IonicContact NH2-OD2 2.72Å; R146-D149 PolarHBondContact NH2-OD2 3.38Å; R146-D149 PolarHBondContact O-N 3.42Å; P147-D149 VanDerWaalsContact C-N 3.28Å; P147-D149 PolarHBondContact O-N 3.02Å; D149-V151 VanDerWaalsContact C-N 3.26Å; D149-V151 PolarHBondContact O-N 3.29Å; D149-N152 WeakPolarHBondContact O-CB 3.44Å; D149-N152 PolarHBondContact O-N 2.91Å; D149-N152 VanDerWaalsContact O-N 3.08Å; D149-F153 PolarHBondContact O-N 3.02Å
150I96.9Very high94.9Very high22 Ų2265.6 Ų65.611%0.11333%0.33CS..Hα-helixtrans-56.7-40.9-177.9-63.6175.2000111.7I145 R146 P147 F153 S154 T164 F169 W170 L173I145-I150 HydrophobicContact CG2-CG1 4.47Å; R146-I150 PolarHBondContact O-N 3.33Å; P147-I150 WeakPolarHBondContact O-CD1 3.33Å; P147-I150 WeakPolarHBondContact O-CG1 3.18Å; I150-F153 PolarHBondContact O-N 3.31Å; I150-S154 WeakPolarHBondContact O-CB 3.36Å; I150-S154 PolarHBondContact O-N 2.84Å; I150-S154 PolarHBondContact O-OG 3.42Å; I150-T164 HydrophobicContact CG2-CG2 4.07Å; I150-F169 HydrophobicContact CD1-CE1 4.29Å; I150-F169 HydrophobicContact CD1-CZ 3.92Å; I150-F169 HydrophobicContact CG1-CZ 3.95Å; I150-F169 HydrophobicContact CG2-CE1 4.15Å; I150-F169 HydrophobicContact CG2-CZ 3.83Å; I150-W170 HydrophobicContact CD1-CH2 4.39Å; I150-W170 HydrophobicContact CD1-CZ3 4.33Å; I150-L173 HydrophobicContact CD1-CD2 3.5Å; I150-L173 VanDerWaalsContact CD1-CD2 3.5Å
151V94.7Very high94.9Very high96 Ų9663.3 Ų63.358%0.58232%0.315SS*.Hα-helixtrans-64.7-47.4177.9177.50000110.1D149 F153 S154 L155D149-V151 VanDerWaalsContact C-N 3.26Å; D149-V151 PolarHBondContact O-N 3.29Å; V151-F153 VanDerWaalsContact C-N 3.31Å; V151-F153 PolarHBondContact O-N 3.16Å; V151-S154 PolarHBondContact O-N 3.24Å; V151-S154 PolarHBondContact O-OG 3.32Å; V151-L155 HydrophobicContact CG1-CD1 4Å; V151-L155 VanDerWaalsContact O-CG 3.29Å; V151-L155 WeakPolarHBondContact O-CG 3.46Å; V151-L155 PolarHBondContact O-N 3.49Å; V151-L155 VanDerWaalsContact O-N 3.14Å
152N96.9Very high94.8Very high100 Ų10060.2 Ų60.254%0.53530%0.299SS..Hα-helixtrans-59.6-43.9178.2-63.7-32.8000111.1D149 L155D149-N152 WeakPolarHBondContact O-CB 3.44Å; D149-N152 PolarHBondContact O-N 2.91Å; D149-N152 VanDerWaalsContact O-N 3.08Å; N152-L155 PolarHBondContact O-N 2.68Å
153F97Very high94.8Very high7 Ų759.9 Ų59.93%0.03130%0.297CS..Hα-helixtrans-60.6-46.9175.4175.5-101000112.2W138 L141 A142 I145 D149 I150 V151 L155 I156 A160 V163 T164W138-F153 HydrophobicContact CE3-CE2 4.06Å; W138-F153 HydrophobicContact CE3-CZ 4.15Å; W138-F153 HydrophobicContact CZ3-CE2 4.46Å; L141-F153 HydrophobicContact CB-CE2 4.26Å; A142-F153 HydrophobicContact CB-CE1 3.84Å; A142-F153 HydrophobicContact CB-CZ 3.75Å; I145-F153 HydrophobicContact CD1-CB 4.2Å; I145-F153 HydrophobicContact CD1-CD2 3.61Å; I145-F153 HydrophobicContact CD1-CE2 4.3Å; I145-F153 HydrophobicContact CD1-CG 4.12Å; I145-F153 HydrophobicContact CG1-CB 4.09Å; I145-F153 HydrophobicContact CG1-CD1 4.45Å; I145-F153 HydrophobicContact CG1-CD2 3.55Å; I145-F153 HydrophobicContact CG1-CE2 4.06Å; I145-F153 HydrophobicContact CG1-CG 3.77Å; I145-F153 HydrophobicContact CG2-CB 3.87Å; I145-F153 HydrophobicContact CG2-CG 4.36Å; D149-F153 PolarHBondContact O-N 3.02Å; I150-F153 PolarHBondContact O-N 3.31Å; V151-F153 VanDerWaalsContact C-N 3.31Å; V151-F153 PolarHBondContact O-N 3.16Å; F153-L155 PolarHBondContact O-N 2.84Å; F153-L155 VanDerWaalsContact O-N 3.15Å; F153-I156 HydrophobicContact CD2-CD1 3.88Å; F153-I156 WeakPolarHBondContact O-CB 3.48Å; F153-I156 WeakPolarHBondContact O-CG1 3.42Å; F153-I156 PolarHBondContact O-N 3.3Å; F153-I156 VanDerWaalsContact O-N 3.13Å; F153-A160 HydrophobicContact CD1-CB 4.42Å; F153-A160 HydrophobicContact CE1-CB 4.08Å; F153-A160 HydrophobicContact CE2-CB 4.35Å; F153-A160 HydrophobicContact CZ-CB 4.04Å; F153-A160 VanDerWaalsContact O-CB 3.23Å; F153-A160 WeakPolarHBondContact O-CB 3.34Å; F153-V163 HydrophobicContact CE1-CB 4.44Å; F153-V163 HydrophobicContact CE1-CG1 4.17Å; F153-T164 HydrophobicContact CD1-CG2 3.64Å; F153-T164 HydrophobicContact CE1-CG2 3.97Å
154S95.1Very high95Very high23 Ų2358.3 Ų58.316%0.16129%0.285CS..Hα-helixtrans-62.3-22.6178.773.10000113.4I150 V151 W161I150-S154 WeakPolarHBondContact O-CB 3.36Å; I150-S154 PolarHBondContact O-N 2.84Å; I150-S154 PolarHBondContact O-OG 3.42Å; V151-S154 PolarHBondContact O-N 3.24Å; V151-S154 PolarHBondContact O-OG 3.32Å; S154-W161 WeakPolarHBondContact O-CB 3.11Å
155L94.2Very high95Very high135 Ų13550 Ų5071%0.70725%0.253SS*.THydrogen-bonded Turntrans-87.5-3.2-179.2-68.7172.3000113.5V151 N152 F153V151-L155 HydrophobicContact CG1-CD1 4Å; V151-L155 VanDerWaalsContact O-CG 3.29Å; V151-L155 WeakPolarHBondContact O-CG 3.46Å; V151-L155 PolarHBondContact O-N 3.49Å; V151-L155 VanDerWaalsContact O-N 3.14Å; N152-L155 PolarHBondContact O-N 2.68Å; F153-L155 PolarHBondContact O-N 2.84Å; F153-L155 VanDerWaalsContact O-N 3.15Å
156I93.1Very high94.9Very high104 Ų10448.5 Ų48.553%0.53325%0.246SC..SBendtrans-66.3-51.1-179.7-64.6171000111W138 F153 A160W138-I156 HydrophobicContact CH2-CG2 3.69Å; W138-I156 HydrophobicContact CZ3-CB 4.42Å; W138-I156 HydrophobicContact CZ3-CD1 4.47Å; W138-I156 HydrophobicContact CZ3-CG2 3.85Å; F153-I156 HydrophobicContact CD2-CD1 3.88Å; F153-I156 WeakPolarHBondContact O-CB 3.48Å; F153-I156 WeakPolarHBondContact O-CG1 3.42Å; F153-I156 PolarHBondContact O-N 3.3Å; F153-I156 VanDerWaalsContact O-N 3.13Å; I156-A160 HydrophobicContact CB-CB 4.17Å
157C91.5Very high94.9Very high47 Ų4743.2 Ų43.232%0.31823%0.23SC..  trans-162.8175.1-179.571.70000111.5W138 N159 A160 W161W138-C157 VanDerWaalsContact CH2-SG 3.54Å; W138-C157 WeakPolarHBondContact CZ2-SG 3.32Å; C157-N159 VanDerWaalsContact C-N 3.34Å; C157-N159 PolarHBondContact O-N 2.96Å; C157-A160 PolarHBondContact O-N 3.35Å; C157-A160 PolarHBondContact SG-N 3.32Å; C157-A160 VanDerWaalsContact SG-N 3.35Å; C157-W161 PolarHBondContact O-N 3.4Å
158K90.7Very high94.7Very high133 Ų13344.8 Ų44.858%0.57824%0.244SC*.Hα-helixtrans-56.5-44.5177.3-172178.4178.6-178.30112.1W161 T162K158-W161 WeakPolarHBondContact O-CB 3.49Å; K158-W161 PolarHBondContact O-N 3.49Å; K158-T162 WeakPolarHBondContact O-CB 3.5Å; K158-T162 PolarHBondContact O-N 2.65Å; K158-T162 PolarHBondContact O-OG1 3.5Å
159N92.4Very high94.7Very high21 Ų2142.8 Ų42.811%0.11223%0.234CC..Hα-helixtrans-67.1-40.4-179.1-68.5-14.1000112.1E132 Y133 W138 C157 T162 V163E132-N159 WeakPolarHBondContact CG-ND2 3.49Å; E132-N159 PolarHBondContact OE1-ND2 3.31Å; Y133-N159 PolarHBondContact O-ND2 3Å; W138-N159 VanDerWaalsContact CD1-CB 3.42Å; W138-N159 HydrophobicContact CD2-CB 4.39Å; W138-N159 HydrophobicContact CG-CB 3.97Å; C157-N159 VanDerWaalsContact C-N 3.34Å; C157-N159 PolarHBondContact O-N 2.96Å; N159-T162 PolarHBondContact O-N 3.19Å; N159-V163 WeakPolarHBondContact O-CG2 3.4Å; N159-V163 PolarHBondContact O-N 3.42Å
160A94.3Very high94.7Very high0 Ų041 Ų410%023%0.225CC..Hα-helixtrans-62.4-43.817400000111.7W138 F153 I156 C157 V163 T164W138-A160 HydrophobicContact CD2-CB 4.29Å; W138-A160 HydrophobicContact CE3-CB 3.66Å; W138-A160 HydrophobicContact CZ3-CB 3.88Å; F153-A160 HydrophobicContact CD1-CB 4.42Å; F153-A160 HydrophobicContact CE1-CB 4.08Å; F153-A160 HydrophobicContact CE2-CB 4.35Å; F153-A160 HydrophobicContact CZ-CB 4.04Å; F153-A160 VanDerWaalsContact O-CB 3.23Å; F153-A160 WeakPolarHBondContact O-CB 3.34Å; I156-A160 HydrophobicContact CB-CB 4.17Å; C157-A160 PolarHBondContact O-N 3.35Å; C157-A160 PolarHBondContact SG-N 3.32Å; C157-A160 VanDerWaalsContact SG-N 3.35Å; A160-V163 PolarHBondContact O-N 2.89Å; A160-T164 PolarHBondContact O-N 3.44Å
161W94.3Very high94.7Very high53 Ų5341.1 Ų41.120%0.20123%0.226CC..Hα-helixtrans-58.9-51172.9175.477.5000111.7S154 C157 K158 V163 T164 C165 L275 Q276 P278S154-W161 WeakPolarHBondContact O-CB 3.11Å; C157-W161 PolarHBondContact O-N 3.4Å; K158-W161 WeakPolarHBondContact O-CB 3.49Å; K158-W161 PolarHBondContact O-N 3.49Å; W161-V163 VanDerWaalsContact C-N 3.28Å; W161-V163 PolarHBondContact O-N 3.13Å; W161-T164 PolarHBondContact O-N 2.87Å; W161-T164 PolarHBondContact O-OG1 3.02Å; W161-C165 PolarHBondContact O-N 3.08Å; W161-C165 PolarHBondContact O-SG 2.93Å; W161-L275 HydrophobicContact CZ2-CB 4.03Å; W161-Q276 WeakPolarHBondContact CH2-O 3.29Å; W161-Q276 WeakPolarHBondContact CZ2-O 3.45Å; W161-P278 HydrophobicContact CH2-CG 4.26Å; W161-P278 HydrophobicContact CZ3-CG 4.18Å
162T93.7Very high94.7Very high18 Ų1842.6 Ų42.611%0.1122%0.221CC..Hα-helixtrans-57.5-40.1178.6-61.30000111.8M135 K158 N159 T164 C165 T166M135-T162 HydrophobicContact CE-CG2 3.74Å; M135-T162 HydrophobicContact SD-CG2 4.23Å; K158-T162 WeakPolarHBondContact O-CB 3.5Å; K158-T162 PolarHBondContact O-N 2.65Å; K158-T162 PolarHBondContact O-OG1 3.5Å; N159-T162 PolarHBondContact O-N 3.19Å; T162-T164 VanDerWaalsContact C-N 3.34Å; T162-T164 PolarHBondContact O-N 3.39Å; T162-C165 WeakPolarHBondContact O-CA 3.27Å; T162-C165 VanDerWaalsContact O-CB 3.29Å; T162-C165 WeakPolarHBondContact O-CB 3.47Å; T162-C165 PolarHBondContact O-N 3.25Å; T162-T166 WeakPolarHBondContact O-CG2 3.45Å; T162-T166 PolarHBondContact O-N 3.15Å
163V95Very high94.7Very high0 Ų038.2 Ų38.20%020%0.198CC..Hα-helixtrans-57.8-45.5174.5164.40000111.6M135 W138 L139 A142 F153 N159 A160 W161 C165 T166 F169M135-V163 HydrophobicContact CG-CG2 3.83Å; W138-V163 HydrophobicContact CB-CB 4.48Å; W138-V163 HydrophobicContact CB-CG2 3.6Å; L139-V163 HydrophobicContact CD2-CG1 3.79Å; L139-V163 HydrophobicContact CD2-CG2 4.22Å; L139-V163 HydrophobicContact CG-CG1 4.23Å; L139-V163 HydrophobicContact CG-CG2 3.88Å; A142-V163 HydrophobicContact CB-CG1 3.7Å; F153-V163 HydrophobicContact CE1-CB 4.44Å; F153-V163 HydrophobicContact CE1-CG1 4.17Å; N159-V163 WeakPolarHBondContact O-CG2 3.4Å; N159-V163 PolarHBondContact O-N 3.42Å; A160-V163 PolarHBondContact O-N 2.89Å; W161-V163 VanDerWaalsContact C-N 3.28Å; W161-V163 PolarHBondContact O-N 3.13Å; V163-C165 PolarHBondContact O-N 3.13Å; V163-C165 VanDerWaalsContact O-N 3.15Å; V163-T166 PolarHBondContact O-N 3.23Å; V163-T166 PolarHBondContact O-OG1 2.96Å; V163-F169 HydrophobicContact CG1-CB 4.38Å; V163-F169 HydrophobicContact CG1-CD2 4.13Å; V163-F169 WeakPolarHBondContact O-CB 3.23Å
164T95.9Very high94.7Very high13 Ų1338.1 Ų38.18%0.0820%0.197CC..Hα-helixtrans-66.2-14.1176.368.30000113.9I150 F153 A160 W161 T162 F169 W170I150-T164 HydrophobicContact CG2-CG2 4.07Å; F153-T164 HydrophobicContact CD1-CG2 3.64Å; F153-T164 HydrophobicContact CE1-CG2 3.97Å; A160-T164 PolarHBondContact O-N 3.44Å; W161-T164 PolarHBondContact O-N 2.87Å; W161-T164 PolarHBondContact O-OG1 3.02Å; T162-T164 VanDerWaalsContact C-N 3.34Å; T162-T164 PolarHBondContact O-N 3.39Å; T164-F169 HydrophobicContact CG2-CE1 4.37Å; T164-F169 HydrophobicContact CG2-CE2 4.3Å; T164-F169 HydrophobicContact CG2-CZ 4.13Å; T164-W170 PolarHBondContact O-NE1 2.9Å
165C95.2Very high94.7Very high4 Ų445.4 Ų45.43%0.02722%0.221CC..Hα-helixtrans-81.9-21.5172.9-62.60000113.4W161 T162 V163 P277 Y281 H285W161-C165 PolarHBondContact O-N 3.08Å; W161-C165 PolarHBondContact O-SG 2.93Å; T162-C165 WeakPolarHBondContact O-CA 3.27Å; T162-C165 VanDerWaalsContact O-CB 3.29Å; T162-C165 WeakPolarHBondContact O-CB 3.47Å; T162-C165 PolarHBondContact O-N 3.25Å; V163-C165 PolarHBondContact O-N 3.13Å; V163-C165 VanDerWaalsContact O-N 3.15Å; C165-P277 HydrophobicContact CB-CB 4.47Å; C165-Y281 HydrophobicContact CB-CD2 3.81Å; C165-Y281 HydrophobicContact CB-CE2 4.43Å; C165-Y281 HydrophobicContact CB-CG 4.43Å; C165-Y281 WeakPolarHBondContact O-CB 3.44Å; C165-H285 WeakPolarHBondContact CA-NE2 3.45Å; C165-H285 PolarHBondContact O-NE2 3.21Å
166T94.9Very high94.7Very high7 Ų743.5 Ų43.54%0.04321%0.205CC..SBendtrans-75.3150.4-171.469.80000113.6T162 V163 A168 F169 Y281T162-T166 WeakPolarHBondContact O-CG2 3.45Å; T162-T166 PolarHBondContact O-N 3.15Å; V163-T166 PolarHBondContact O-N 3.23Å; V163-T166 PolarHBondContact O-OG1 2.96Å; T166-A168 VanDerWaalsContact C-N 3.31Å; T166-A168 PolarHBondContact O-N 3.28Å; T166-F169 PolarHBondContact O-N 3.11Å; T166-F169 WeakPolarHBondContact OG1-CB 3.46Å; T166-F169 PolarHBondContact OG1-N 2.98Å; T166-F169 VanDerWaalsContact OG1-N 3.11Å; T166-Y281 HydrophobicContact CG2-CE1 4.14Å; T166-Y281 HydrophobicContact CG2-CE2 4.01Å; T166-Y281 WeakPolarHBondContact CG2-OH 3.34Å
167A95.6Very high94.8Very high21 Ų2140.4 Ų40.417%0.17419%0.188CC..Hα-helixtrans-60.9-41.1169.700000111.9F169 W170 T171 L196 L199 V284A167-F169 VanDerWaalsContact C-N 3.27Å; A167-F169 PolarHBondContact O-N 2.83Å; A167-W170 PolarHBondContact O-N 2.77Å; A167-W170 VanDerWaalsContact O-N 3.1Å; A167-T171 WeakPolarHBondContact O-CB 3.17Å; A167-T171 PolarHBondContact O-N 2.91Å; A167-T171 PolarHBondContact O-OG1 2.89Å; A167-T171 VanDerWaalsContact O-OG1 3.09Å; A167-L196 HydrophobicContact CB-CD2 3.58Å; A167-L199 HydrophobicContact CB-CD2 3.84Å; A167-V284 HydrophobicContact CB-CG2 3.84Å
168A94.5Very high94.9Very high42 Ų4241.3 Ų41.335%0.34719%0.185SC..Hα-helixtrans-54.9-42.3179.900000112.4L139 T166 R172L139-A168 HydrophobicContact CD2-CB 4.45Å; T166-A168 VanDerWaalsContact C-N 3.31Å; T166-A168 PolarHBondContact O-N 3.28Å; A168-R172 VanDerWaalsContact O-CB 3.27Å; A168-R172 WeakPolarHBondContact O-CB 3.48Å; A168-R172 WeakPolarHBondContact O-CG 3.42Å; A168-R172 PolarHBondContact O-N 3.22Å
169F96Very high94.9Very high9 Ų938.2 Ų38.24%0.03918%0.177CC..Hα-helixtrans-58.9-53.6174.6170.2-97.3000112.1A142 I150 V163 T164 T166 A167 R172 L173A142-F169 HydrophobicContact CB-CD2 3.78Å; A142-F169 HydrophobicContact CB-CE2 3.95Å; I150-F169 HydrophobicContact CD1-CE1 4.29Å; I150-F169 HydrophobicContact CD1-CZ 3.92Å; I150-F169 HydrophobicContact CG1-CZ 3.95Å; I150-F169 HydrophobicContact CG2-CE1 4.15Å; I150-F169 HydrophobicContact CG2-CZ 3.83Å; V163-F169 HydrophobicContact CG1-CB 4.38Å; V163-F169 HydrophobicContact CG1-CD2 4.13Å; V163-F169 WeakPolarHBondContact O-CB 3.23Å; T164-F169 HydrophobicContact CG2-CE1 4.37Å; T164-F169 HydrophobicContact CG2-CE2 4.3Å; T164-F169 HydrophobicContact CG2-CZ 4.13Å; T166-F169 PolarHBondContact O-N 3.11Å; T166-F169 WeakPolarHBondContact OG1-CB 3.46Å; T166-F169 PolarHBondContact OG1-N 2.98Å; T166-F169 VanDerWaalsContact OG1-N 3.11Å; A167-F169 VanDerWaalsContact C-N 3.27Å; A167-F169 PolarHBondContact O-N 2.83Å; F169-R172 PolarHBondContact O-N 3.22Å; F169-L173 HydrophobicContact CE1-CD2 4.24Å; F169-L173 HydrophobicContact CZ-CD2 4.31Å; F169-L173 VanDerWaalsContact O-CB 3.29Å; F169-L173 WeakPolarHBondContact O-CB 3.49Å; F169-L173 PolarHBondContact O-N 3.34Å
170W97Very high94.7Very high7 Ų745 Ų453%0.02721%0.213CC..Hα-helixtrans-66.4-41.4-177-67.4105.4000112.3I150 T164 A167 L173 Y174 L199 R200 V203 I204 V284I150-W170 HydrophobicContact CD1-CH2 4.39Å; I150-W170 HydrophobicContact CD1-CZ3 4.33Å; T164-W170 PolarHBondContact O-NE1 2.9Å; A167-W170 PolarHBondContact O-N 2.77Å; A167-W170 VanDerWaalsContact O-N 3.1Å; W170-L173 HydrophobicContact CE3-CD2 3.94Å; W170-L173 HydrophobicContact CZ3-CD2 3.91Å; W170-L173 PolarHBondContact O-N 3.31Å; W170-Y174 WeakPolarHBondContact O-CB 3.27Å; W170-Y174 PolarHBondContact O-N 2.93Å; W170-L199 HydrophobicContact CB-CD2 4.02Å; W170-L199 HydrophobicContact CB-CG 3.95Å; W170-R200 HydrophobicContact CD2-CB 3.97Å; W170-R200 HydrophobicContact CD2-CG 3.94Å; W170-R200 HydrophobicContact CE3-CB 4.49Å; W170-R200 HydrophobicContact CE3-CG 4.19Å; W170-R200 HydrophobicContact CG-CB 4.27Å; W170-R200 HydrophobicContact CH2-CG 3.76Å; W170-R200 HydrophobicContact CZ2-CB 4.29Å; W170-R200 HydrophobicContact CZ2-CG 3.48Å; W170-R200 VanDerWaalsContact CZ2-CG 3.48Å; W170-R200 HydrophobicContact CZ3-CG 4.1Å; W170-V203 HydrophobicContact CB-CG2 4.14Å; W170-V203 HydrophobicContact CE3-CB 4.02Å; W170-V203 HydrophobicContact CE3-CG1 3.89Å; W170-I204 HydrophobicContact CH2-CD1 4.21Å; W170-I204 HydrophobicContact CH2-CG1 4.28Å; W170-I204 HydrophobicContact CZ3-CD1 4.28Å; W170-I204 HydrophobicContact CZ3-CG1 3.87Å; W170-V284 HydrophobicContact CG-CG1 4.49Å
171T95.8Very high94.4Very high24 Ų2451.7 Ų51.715%0.14725%0.249CC..Hα-helixtrans-63.7-43.7176.2-56.30000111.7A167 Y174 R175A167-T171 WeakPolarHBondContact O-CB 3.17Å; A167-T171 PolarHBondContact O-N 2.91Å; A167-T171 PolarHBondContact O-OG1 2.89Å; A167-T171 VanDerWaalsContact O-OG1 3.09Å; T171-Y174 PolarHBondContact O-N 3.49Å; T171-R175 VanDerWaalsContact CG2-CZ 3.47Å; T171-R175 WeakPolarHBondContact O-CG 3.28Å; T171-R175 PolarHBondContact O-N 2.84Å
172R95.7Very high94.1Very high126 Ų12650.2 Ų50.248%0.47525%0.248SC..Hα-helixtrans-64.4-42.6175.7-74.1175-173.8178.93.2111.4A168 F169 Y174 R175 R176A168-R172 VanDerWaalsContact O-CB 3.27Å; A168-R172 WeakPolarHBondContact O-CB 3.48Å; A168-R172 WeakPolarHBondContact O-CG 3.42Å; A168-R172 PolarHBondContact O-N 3.22Å; F169-R172 PolarHBondContact O-N 3.22Å; R172-Y174 VanDerWaalsContact C-N 3.34Å; R172-Y174 PolarHBondContact O-N 3.06Å; R172-R175 PolarHBondContact O-N 3Å; R172-R176 WeakPolarHBondContact O-CB 3.34Å; R172-R176 PolarHBondContact O-N 3.29Å
173L96.6Very high93.9Very high9 Ų954.6 Ų54.65%0.04728%0.279CS..Hα-helixtrans-59.5-44.5177178.862.6000111.8P147 I150 F169 W170 H177 V203 L207P147-L173 HydrophobicContact CG-CD1 4.24Å; I150-L173 HydrophobicContact CD1-CD2 3.5Å; I150-L173 VanDerWaalsContact CD1-CD2 3.5Å; F169-L173 HydrophobicContact CE1-CD2 4.24Å; F169-L173 HydrophobicContact CZ-CD2 4.31Å; F169-L173 VanDerWaalsContact O-CB 3.29Å; F169-L173 WeakPolarHBondContact O-CB 3.49Å; F169-L173 PolarHBondContact O-N 3.34Å; W170-L173 HydrophobicContact CE3-CD2 3.94Å; W170-L173 HydrophobicContact CZ3-CD2 3.91Å; W170-L173 PolarHBondContact O-N 3.31Å; L173-H177 PolarHBondContact O-CD2 3.43Å; L173-V203 HydrophobicContact CD2-CG1 4.14Å; L173-V203 HydrophobicContact CG-CG1 4.28Å; L173-L207 HydrophobicContact CD2-CD1 4.07Å; L173-L207 HydrophobicContact CG-CD1 4.42Å
174Y96.5Very high93.7Very high4 Ų455.2 Ų55.22%0.01628%0.282CS..Hα-helixtrans-59.7-54.1174.7177.5-90.1000111.3W170 T171 R172 R176 H177 Y178 L188 R189 P190 M193 V203 M210W170-Y174 WeakPolarHBondContact O-CB 3.27Å; W170-Y174 PolarHBondContact O-N 2.93Å; T171-Y174 PolarHBondContact O-N 3.49Å; R172-Y174 VanDerWaalsContact C-N 3.34Å; R172-Y174 PolarHBondContact O-N 3.06Å; Y174-R176 VanDerWaalsContact C-N 3.26Å; Y174-R176 PolarHBondContact O-N 3.27Å; Y174-H177 PolarHBondContact O-N 3.2Å; Y174-H177 VanDerWaalsContact O-N 3.07Å; Y174-Y178 AromaticContact CE1-CD2 3.95Å; Y174-Y178 HydrophobicContact CE1-CD2 3.95Å; Y174-Y178 AromaticContact CE1-CG 3.93Å; Y174-Y178 HydrophobicContact CE1-CG 3.93Å; Y174-Y178 AromaticContact CZ-CD2 3.7Å; Y174-Y178 WeakPolarHBondContact O-CB 3.31Å; Y174-Y178 PolarHBondContact O-N 3.01Å; Y174-Y178 WeakPolarHBondContact OH-CD2 3.19Å; Y174-L188 WeakPolarHBondContact CE2-O 3.2Å; Y174-L188 PolarHBondContact OH-O 3.37Å; Y174-R189 VanDerWaalsContact OH-C 3.23Å; Y174-P190 HydrophobicContact CE1-CB 4.32Å; Y174-P190 HydrophobicContact CE1-CG 4.17Å; Y174-P190 WeakPolarHBondContact OH-CD 3.48Å; Y174-P190 VanDerWaalsContact OH-N 3.12Å; Y174-M193 HydrophobicContact CD1-CB 4.4Å; Y174-M193 HydrophobicContact CD1-CG 3.81Å; Y174-M193 HydrophobicContact CD2-CE 4.48Å; Y174-M193 HydrophobicContact CD2-CG 3.74Å; Y174-M193 HydrophobicContact CD2-SD 3.73Å; Y174-M193 HydrophobicContact CE1-CB 4.48Å; Y174-M193 HydrophobicContact CE1-CG 3.69Å; Y174-M193 HydrophobicContact CE2-CE 4.02Å; Y174-M193 HydrophobicContact CE2-CG 3.59Å; Y174-M193 HydrophobicContact CE2-SD 3.81Å; Y174-M193 HydrophobicContact CG-CG 3.84Å; Y174-M193 HydrophobicContact CG-SD 4.23Å; Y174-V203 HydrophobicContact CD2-CG2 4.33Å; Y174-V203 HydrophobicContact CG-CG2 4.49Å; Y174-M210 HydrophobicContact CD2-CE 4.31Å; Y174-M210 HydrophobicContact CE2-CE 4Å
175R95.1Very high93.6Very high177 Ų17756.7 Ų56.767%0.66829%0.292SS*.Hα-helixtrans-59.8-35.2-177.2-72.2177-174.1162.82.5112.7T171 R172 H177T171-R175 VanDerWaalsContact CG2-CZ 3.47Å; T171-R175 WeakPolarHBondContact O-CG 3.28Å; T171-R175 PolarHBondContact O-N 2.84Å; R172-R175 PolarHBondContact O-N 3Å; R175-H177 VanDerWaalsContact C-N 3.26Å; R175-H177 PolarHBondContact O-N 3.09Å
176R95.1Very high93.4Very high95 Ų9562.3 Ų62.336%0.35832%0.322SS..Hα-helixtrans-62.9-31.5177.8-173.9179.864.8172.9-0.6113.1S143 I145 R172 Y174S143-R176 WeakPolarHBondContact O-CD 3.28Å; S143-R176 PolarHBondContact O-NH1 2.7Å; I145-R176 VanDerWaalsContact O-CZ 3.25Å; I145-R176 PolarHBondContact O-NH1 2.84Å; I145-R176 PolarHBondContact O-NH2 3.02Å; R172-R176 WeakPolarHBondContact O-CB 3.34Å; R172-R176 PolarHBondContact O-N 3.29Å; Y174-R176 VanDerWaalsContact C-N 3.26Å; Y174-R176 PolarHBondContact O-N 3.27Å
177H94.4Very high93.2Very high39 Ų3966.2 Ų66.218%0.18134%0.335CS..Hα-helixtrans-109.8-5.7-175.4-70.3-69.6000113.6L173 Y174 R175 L207 Y211L173-H177 PolarHBondContact O-CD2 3.43Å; Y174-H177 PolarHBondContact O-N 3.2Å; Y174-H177 VanDerWaalsContact O-N 3.07Å; R175-H177 VanDerWaalsContact C-N 3.26Å; R175-H177 PolarHBondContact O-N 3.09Å; H177-L207 HydrophobicContact CB-CD2 4.01Å; H177-Y211 AromaticContact CE1-CD2 3.45Å; H177-Y211 VanDerWaalsContact CE1-CD2 3.45Å; H177-Y211 WeakPolarHBondContact CE1-CD2 3.2Å; H177-Y211 AromaticContact CE1-CE2 3.55Å; H177-Y211 AromaticContact ND1-CD2 3.52Å
178Y94.8Very high93.1Very high65 Ų6565.2 Ų65.226%0.25533%0.327SS..  trans-75.5130.6177.7178.1-100.2000110.7Y174 L180 L184 P190 M210Y174-Y178 AromaticContact CE1-CD2 3.95Å; Y174-Y178 HydrophobicContact CE1-CD2 3.95Å; Y174-Y178 AromaticContact CE1-CG 3.93Å; Y174-Y178 HydrophobicContact CE1-CG 3.93Å; Y174-Y178 AromaticContact CZ-CD2 3.7Å; Y174-Y178 WeakPolarHBondContact O-CB 3.31Å; Y174-Y178 PolarHBondContact O-N 3.01Å; Y174-Y178 WeakPolarHBondContact OH-CD2 3.19Å; Y178-L180 HydrophobicContact CE1-CD2 4.22Å; Y178-L184 HydrophobicContact CD2-CD1 3.95Å; Y178-L184 HydrophobicContact CE2-CD1 3.8Å; Y178-P190 HydrophobicContact CD1-CG 4.08Å; Y178-P190 HydrophobicContact CD2-CG 4.2Å; Y178-P190 HydrophobicContact CE1-CG 3.55Å; Y178-P190 HydrophobicContact CE2-CG 3.73Å; Y178-P190 HydrophobicContact CG-CG 4.38Å; Y178-M210 HydrophobicContact CD2-CE 4.18Å; Y178-M210 HydrophobicContact CD2-SD 3.62Å; Y178-M210 HydrophobicContact CE2-SD 4.39Å; Y178-M210 HydrophobicContact CG-SD 4.38Å
179T90.5Very high93.1Very high68 Ų6868.5 Ų68.542%0.41733%0.331SS..  trans-120.9145.8172.365.60000109.4D181 A182T179-D181 WeakPolarHBondContact CB-OD1 3.32Å; T179-D181 PolarHBondContact O-N 2.87Å; T179-D181 PolarHBondContact OG1-OD1 3.22Å; T179-A182 WeakPolarHBondContact O-CB 3.49Å; T179-A182 PolarHBondContact O-N 3.34Å
180L88.3Confident93Very high163 Ų16370 Ų7085%0.85334%0.341SS*.THydrogen-bonded Turntrans-64.1-25.3-176.5-73.9166.6000112.9Y178 A182Y178-L180 HydrophobicContact CE1-CD2 4.22Å; L180-A182 VanDerWaalsContact C-N 3.33Å
181D88.4Confident92.7Very high141 Ų14175.6 Ų75.675%0.75437%0.368SS*.THydrogen-bonded Turntrans-84.9-2.7176.964.5-28000113.5T179 S183T179-D181 WeakPolarHBondContact CB-OD1 3.32Å; T179-D181 PolarHBondContact O-N 2.87Å; T179-D181 PolarHBondContact OG1-OD1 3.22Å; D181-S183 PolarHBondContact O-N 2.92Å
182A87.3Confident92.5Very high23 Ų2375.9 Ų75.919%0.1937%0.371CS..  trans-65.8118.9179.600000111.9T179 L180 L184 M210T179-A182 WeakPolarHBondContact O-CB 3.49Å; T179-A182 PolarHBondContact O-N 3.34Å; L180-A182 VanDerWaalsContact C-N 3.33Å; A182-L184 VanDerWaalsContact C-N 3.35Å; A182-L184 HydrophobicContact CB-CG 4.13Å; A182-L184 PolarHBondContact O-N 3Å; A182-M210 HydrophobicContact CB-CG 3.67Å; A182-M210 HydrophobicContact CB-SD 3.53Å; A182-M210 VanDerWaalsContact CB-SD 3.53Å
183S88.9Confident92.4Very high109 Ų10970.3 Ų70.376%0.76235%0.35SS*.  trans-74.983.8174.965.20000111.2D181D181-S183 PolarHBondContact O-N 2.92Å
184L92.1Very high92.1Very high13 Ų1377.5 Ų77.57%0.06838%0.383CS..  trans-101.5140.2179.8-64.2-177.6000113Y178 A182 L188 R189 H209 M210Y178-L184 HydrophobicContact CD2-CD1 3.95Å; Y178-L184 HydrophobicContact CE2-CD1 3.8Å; A182-L184 VanDerWaalsContact C-N 3.35Å; A182-L184 HydrophobicContact CB-CG 4.13Å; A182-L184 PolarHBondContact O-N 3Å; L184-L188 HydrophobicContact CB-CB 4.21Å; L184-L188 HydrophobicContact CD1-CB 4.36Å; L184-L188 WeakPolarHBondContact CD1-O 3.3Å; L184-L188 HydrophobicContact CD2-CB 4.48Å; L184-R189 HydrophobicContact CB-CG 4.33Å; L184-H209 HydrophobicContact CD2-CB 3.36Å; L184-M210 HydrophobicContact CD1-CE 4.15Å; L184-M210 HydrophobicContact CD1-SD 3.65Å; L184-M210 HydrophobicContact CD2-CG 3.98Å; L184-M210 HydrophobicContact CD2-SD 4.08Å; L184-M210 HydrophobicContact CG-SD 4.14Å
185P92.5Very high91.9Very high44 Ų4484 Ų8429%0.28641%0.412SS..  trans-52.9148.3163-23.433000111.3R187 L188 F372P185-R187 PolarHBondContact O-N 3.24Å; P185-L188 HydrophobicContact CG-CD1 4.38Å; P185-L188 PolarHBondContact O-N 3.3Å; P185-F372 HydrophobicContact CB-CE2 3.69Å; P185-F372 HydrophobicContact CB-CZ 4.1Å; P185-F372 HydrophobicContact CG-CE2 3.95Å; P185-F372 HydrophobicContact CG-CZ 4.27Å
186L90.7Very high91.8Very high123 Ų12380.1 Ų80.164%0.64440%0.404SS*.G310 helixtrans-47.5-40.3-177.2-71.9167.7000113.6L188 R189 S192L186-L188 PolarHBondContact O-N 3.05Å; L186-R189 VanDerWaalsContact CD2-CZ 3.49Å; L186-R189 PolarHBondContact O-N 2.96Å; L186-S192 PolarHBondContact O-OG 3.14Å
187R90.9Very high91.7Very high88 Ų8881.1 Ų81.133%0.33241%0.408SS..G310 helixtrans-73.3-8.9-178.8-62-172.2-178.6-161.83.2115.1P185 S192 F372 S373P185-R187 PolarHBondContact O-N 3.24Å; R187-S192 WeakPolarHBondContact O-CB 3.35Å; R187-F372 HydrophobicContact CB-CD1 4.11Å; R187-F372 HydrophobicContact CB-CE1 4.08Å; R187-F372 HydrophobicContact CB-CG 4.48Å; R187-F372 HydrophobicContact CB-CZ 4.44Å; R187-S373 PolarHBondContact NH1-O 3.17Å
188L93.9Very high91.6Very high0 Ų079.3 Ų79.30%040%0.399CS..G310 helixtrans-109.81.4178.6-62.8-171.8000112.7Y174 L184 P185 L186 M193 C202 R205 F372Y174-L188 WeakPolarHBondContact CE2-O 3.2Å; Y174-L188 PolarHBondContact OH-O 3.37Å; L184-L188 HydrophobicContact CB-CB 4.21Å; L184-L188 HydrophobicContact CD1-CB 4.36Å; L184-L188 WeakPolarHBondContact CD1-O 3.3Å; L184-L188 HydrophobicContact CD2-CB 4.48Å; P185-L188 HydrophobicContact CG-CD1 4.38Å; P185-L188 PolarHBondContact O-N 3.3Å; L186-L188 PolarHBondContact O-N 3.05Å; L188-M193 HydrophobicContact CB-CE 4.47Å; L188-M193 HydrophobicContact CD2-CE 4.26Å; L188-C202 HydrophobicContact CD2-CB 4.1Å; L188-C202 WeakPolarHBondContact CD2-O 3.37Å; L188-R205 HydrophobicContact CD1-CB 4Å; L188-R205 HydrophobicContact CD2-CB 4.13Å; L188-F372 HydrophobicContact CD1-CE1 4.31Å; L188-F372 HydrophobicContact CD1-CZ 3.7Å; L188-F372 HydrophobicContact CD2-CE1 3.66Å; L188-F372 HydrophobicContact CD2-CZ 3.87Å; L188-F372 HydrophobicContact CG-CE1 3.85Å; L188-F372 HydrophobicContact CG-CZ 3.51Å
189R94Very high91.6Very high112 Ų11276.3 Ų76.342%0.42339%0.388SS..SBendtrans-73162.2176.8-63.8-174.3-179-179.4-2.3111.5Y174 L184 L186 E191 S192Y174-R189 VanDerWaalsContact OH-C 3.23Å; L184-R189 HydrophobicContact CB-CG 4.33Å; L186-R189 VanDerWaalsContact CD2-CZ 3.49Å; L186-R189 PolarHBondContact O-N 2.96Å; R189-E191 WeakPolarHBondContact CB-OE2 3.46Å; R189-E191 PolarHBondContact O-N 2.89Å; R189-E191 VanDerWaalsContact O-N 3.14Å; R189-S192 WeakPolarHBondContact O-CB 3.32Å; R189-S192 PolarHBondContact O-N 3.41Å
190P94.2Very high91.9Very high41 Ų4176.6 Ų76.627%0.26638%0.381SS..G310 helixtrans-53.3-37.1-174.8-29.437.1000114Y174 Y178 S192 M193Y174-P190 HydrophobicContact CE1-CB 4.32Å; Y174-P190 HydrophobicContact CE1-CG 4.17Å; Y174-P190 WeakPolarHBondContact OH-CD 3.48Å; Y174-P190 VanDerWaalsContact OH-N 3.12Å; Y178-P190 HydrophobicContact CD1-CG 4.08Å; Y178-P190 HydrophobicContact CD2-CG 4.2Å; Y178-P190 HydrophobicContact CE1-CG 3.55Å; Y178-P190 HydrophobicContact CE2-CG 3.73Å; Y178-P190 HydrophobicContact CG-CG 4.38Å; P190-S192 PolarHBondContact O-N 2.9Å; P190-M193 WeakPolarHBondContact O-CB 3.4Å; P190-M193 PolarHBondContact O-N 3.27Å
191E92.2Very high92.2Very high123 Ų12369.1 Ų69.158%0.57534%0.343SS*.G310 helixtrans-63.2-27.1-179.8-53.276.3-163.300111.9R189R189-E191 WeakPolarHBondContact CB-OE2 3.46Å; R189-E191 PolarHBondContact O-N 2.89Å; R189-E191 VanDerWaalsContact O-N 3.14Å
192S91.1Very high92.6Very high31 Ų3163.3 Ų63.322%0.21731%0.313CS..G310 helixtrans-80.7-19176.1-62.80000113L186 R187 R189 P190 E194L186-S192 PolarHBondContact O-OG 3.14Å; R187-S192 WeakPolarHBondContact O-CB 3.35Å; R189-S192 WeakPolarHBondContact O-CB 3.32Å; R189-S192 PolarHBondContact O-N 3.41Å; P190-S192 PolarHBondContact O-N 2.9Å; S192-E194 VanDerWaalsContact C-N 3.28Å; S192-E194 PolarHBondContact O-N 3.46Å
193M93Very high93Very high9 Ų962.2 Ų62.24%0.04430%0.304CS..G310 helixtrans-82.3-5-179.2-58.5-61.9128.900113.5Y174 L188 P190 K195 L199 C202 V203Y174-M193 HydrophobicContact CD1-CB 4.4Å; Y174-M193 HydrophobicContact CD1-CG 3.81Å; Y174-M193 HydrophobicContact CD2-CE 4.48Å; Y174-M193 HydrophobicContact CD2-CG 3.74Å; Y174-M193 HydrophobicContact CD2-SD 3.73Å; Y174-M193 HydrophobicContact CE1-CB 4.48Å; Y174-M193 HydrophobicContact CE1-CG 3.69Å; Y174-M193 HydrophobicContact CE2-CE 4.02Å; Y174-M193 HydrophobicContact CE2-CG 3.59Å; Y174-M193 HydrophobicContact CE2-SD 3.81Å; Y174-M193 HydrophobicContact CG-CG 3.84Å; Y174-M193 HydrophobicContact CG-SD 4.23Å; L188-M193 HydrophobicContact CB-CE 4.47Å; L188-M193 HydrophobicContact CD2-CE 4.26Å; P190-M193 WeakPolarHBondContact O-CB 3.4Å; P190-M193 PolarHBondContact O-N 3.27Å; M193-K195 VanDerWaalsContact C-N 3.26Å; M193-L199 HydrophobicContact CB-CD1 4.27Å; M193-L199 WeakPolarHBondContact O-CD1 3.16Å; M193-L199 HydrophobicContact SD-CD1 4.15Å; M193-C202 HydrophobicContact CE-CB 3.68Å; M193-C202 HydrophobicContact SD-CB 4.01Å; M193-V203 HydrophobicContact SD-CG2 3.9Å
194E90.8Very high93.3Very high159 Ų15958.2 Ų58.274%0.74327%0.274SS*.G310 helixtrans-75.7-20173-61.3-178.2172.700111.9S192S192-E194 VanDerWaalsContact C-N 3.28Å; S192-E194 PolarHBondContact O-N 3.46Å
195K91.8Very high93.5Very high142 Ų14258 Ų5862%0.61727%0.272SS*.  trans-80129.6177.6-60.1177.5-176.41770109.8M193M193-K195 VanDerWaalsContact C-N 3.26Å
196L92.9Very high93.6Very high95 Ų9555.9 Ų55.950%0.49726%0.258SS..  trans-67.2-41.4175.5-64-179.3000111.6A167 C198 L199 D283 V284A167-L196 HydrophobicContact CB-CD2 3.58Å; L196-C198 PolarHBondContact O-N 3.37Å; L196-L199 WeakPolarHBondContact O-CB 3.25Å; L196-L199 PolarHBondContact O-N 3.38Å; L196-D283 HydrophobicContact CB-CB 4.14Å; L196-D283 CarbonylContact O-C 3.57Å; L196-V284 HydrophobicContact CD2-CG2 4.42Å; L196-V284 VanDerWaalsContact O-CA 3.28Å; L196-V284 WeakPolarHBondContact O-CA 3.48Å; L196-V284 PolarHBondContact O-N 3.01Å
197R92.5Very high93.9Very high115 Ų11550.2 Ų50.243%0.43423%0.228SC..THydrogen-bonded Turntrans-59.8124.8-176.4-170.3161.4178.8-93.7-3111.2L199 D283 R375R197-L199 PolarHBondContact O-N 2.96Å; R197-D283 CarbonylContact C-O 3.56Å; R197-D283 VanDerWaalsContact CA-O 3.28Å; R197-D283 WeakPolarHBondContact CA-O 3.35Å; R197-R375 PolarHBondContact NH1-O 2.96Å; R197-R375 PolarHBondContact NH2-O 2.81Å
198C92.9Very high94Very high1 Ų147.5 Ų47.51%0.00722%0.218CC..THydrogen-bonded Turntrans64.211.9-178.2-48.70000115.7L196 R200 A201 C202 D283 T286 A376L196-C198 PolarHBondContact O-N 3.37Å; C198-R200 VanDerWaalsContact C-N 3.32Å; C198-R200 PolarHBondContact O-N 3.41Å; C198-A201 WeakPolarHBondContact O-CB 3.24Å; C198-A201 PolarHBondContact O-N 3.37Å; C198-C202 PolarHBondContact O-N 3.17Å; C198-C202 PolarHBondContact O-SG 3.28Å; C198-D283 PolarHBondContact N-O 2.66Å; C198-T286 WeakPolarHBondContact CA-O 3.27Å; C198-T286 PolarHBondContact SG-O 2.73Å; C198-T286 VanDerWaalsContact SG-O 3.39Å; C198-A376 PolarHBondContact SG-OXT 3.16Å
199L95.6Very high94Very high2 Ų250.2 Ų50.21%0.0123%0.231CC..Hα-helixtrans-51.6-49.8-175.2176.461.8000112A167 W170 M193 L196 R197 A201 C202 V203 V284A167-L199 HydrophobicContact CB-CD2 3.84Å; W170-L199 HydrophobicContact CB-CD2 4.02Å; W170-L199 HydrophobicContact CB-CG 3.95Å; M193-L199 HydrophobicContact CB-CD1 4.27Å; M193-L199 WeakPolarHBondContact O-CD1 3.16Å; M193-L199 HydrophobicContact SD-CD1 4.15Å; L196-L199 WeakPolarHBondContact O-CB 3.25Å; L196-L199 PolarHBondContact O-N 3.38Å; R197-L199 PolarHBondContact O-N 2.96Å; L199-A201 VanDerWaalsContact C-N 3.33Å; L199-A201 PolarHBondContact O-N 3.49Å; L199-C202 PolarHBondContact O-N 3.37Å; L199-V203 HydrophobicContact CD1-CG2 3.91Å; L199-V203 HydrophobicContact CG-CG2 4.38Å; L199-V203 VanDerWaalsContact O-CG2 3.32Å; L199-V203 WeakPolarHBondContact O-CG2 3.33Å; L199-V203 PolarHBondContact O-N 3.11Å; L199-V284 HydrophobicContact CB-CG1 4.31Å; L199-V284 HydrophobicContact CD2-CG1 4.41Å
200R96Very high93.9Very high75 Ų7546.5 Ų46.528%0.28322%0.219SC..Hα-helixtrans-56.4-47.1178.2173.1172.3-179.9-84.5-1112.1W170 C198 C202 V203 I204 V284 H285W170-R200 HydrophobicContact CD2-CB 3.97Å; W170-R200 HydrophobicContact CD2-CG 3.94Å; W170-R200 HydrophobicContact CE3-CB 4.49Å; W170-R200 HydrophobicContact CE3-CG 4.19Å; W170-R200 HydrophobicContact CG-CB 4.27Å; W170-R200 HydrophobicContact CH2-CG 3.76Å; W170-R200 HydrophobicContact CZ2-CB 4.29Å; W170-R200 HydrophobicContact CZ2-CG 3.48Å; W170-R200 VanDerWaalsContact CZ2-CG 3.48Å; W170-R200 HydrophobicContact CZ3-CG 4.1Å; C198-R200 VanDerWaalsContact C-N 3.32Å; C198-R200 PolarHBondContact O-N 3.41Å; R200-C202 VanDerWaalsContact C-N 3.34Å; R200-V203 PolarHBondContact O-N 3.18Å; R200-I204 HydrophobicContact CG-CD1 3.75Å; R200-I204 HydrophobicContact CG-CG1 4.5Å; R200-I204 WeakPolarHBondContact O-CB 3.27Å; R200-I204 VanDerWaalsContact O-CG1 3.25Å; R200-I204 WeakPolarHBondContact O-CG1 3.34Å; R200-I204 PolarHBondContact O-N 3.47Å; R200-V284 HydrophobicContact CB-CG1 4.41Å; R200-V284 WeakPolarHBondContact CB-O 3.44Å; R200-V284 PolarHBondContact N-O 2.91Å; R200-H285 VanDerWaalsContact CD-ND1 3.27Å; R200-H285 WeakPolarHBondContact CD-ND1 3.45Å
201A95.2Very high94Very high5 Ų545.9 Ų45.94%0.04121%0.211CC..Hα-helixtrans-64.1-41.8-17900000111.4C198 L199 R205 N287 W365C198-A201 WeakPolarHBondContact O-CB 3.24Å; C198-A201 PolarHBondContact O-N 3.37Å; L199-A201 VanDerWaalsContact C-N 3.33Å; L199-A201 PolarHBondContact O-N 3.49Å; A201-R205 WeakPolarHBondContact O-CB 3.38Å; A201-R205 WeakPolarHBondContact O-CG 3.3Å; A201-R205 PolarHBondContact O-N 3.1Å; A201-N287 HydrophobicContact CB-CB 4.11Å; A201-W365 HydrophobicContact CB-CH2 4.17Å; A201-W365 HydrophobicContact CB-CZ3 3.72Å
202C95.3Very high94Very high19 Ų1946.2 Ų46.213%0.12821%0.213CC..Hα-helixtrans-63.9-44.7176.3-70.70000112L188 M193 C198 L199 R200 R205 S206L188-C202 HydrophobicContact CD2-CB 4.1Å; L188-C202 WeakPolarHBondContact CD2-O 3.37Å; M193-C202 HydrophobicContact CE-CB 3.68Å; M193-C202 HydrophobicContact SD-CB 4.01Å; C198-C202 PolarHBondContact O-N 3.17Å; C198-C202 PolarHBondContact O-SG 3.28Å; L199-C202 PolarHBondContact O-N 3.37Å; R200-C202 VanDerWaalsContact C-N 3.34Å; C202-R205 PolarHBondContact O-N 3.14Å; C202-S206 WeakPolarHBondContact O-CB 3.26Å; C202-S206 PolarHBondContact O-N 3Å; C202-S206 PolarHBondContact O-OG 2.69Å
203V96.4Very high94.2Very high0 Ų046.5 Ų46.50%021%0.214CC..Hα-helixtrans-63.9-46.1177175.70000111.1W170 L173 Y174 M193 L199 R200 R205 S206 L207W170-V203 HydrophobicContact CB-CG2 4.14Å; W170-V203 HydrophobicContact CE3-CB 4.02Å; W170-V203 HydrophobicContact CE3-CG1 3.89Å; L173-V203 HydrophobicContact CD2-CG1 4.14Å; L173-V203 HydrophobicContact CG-CG1 4.28Å; Y174-V203 HydrophobicContact CD2-CG2 4.33Å; Y174-V203 HydrophobicContact CG-CG2 4.49Å; M193-V203 HydrophobicContact SD-CG2 3.9Å; L199-V203 HydrophobicContact CD1-CG2 3.91Å; L199-V203 HydrophobicContact CG-CG2 4.38Å; L199-V203 VanDerWaalsContact O-CG2 3.32Å; L199-V203 WeakPolarHBondContact O-CG2 3.33Å; L199-V203 PolarHBondContact O-N 3.11Å; R200-V203 PolarHBondContact O-N 3.18Å; V203-R205 VanDerWaalsContact C-N 3.32Å; V203-R205 PolarHBondContact O-N 3.17Å; V203-S206 WeakPolarHBondContact O-CB 3.17Å; V203-S206 PolarHBondContact O-N 3.39Å; V203-S206 VanDerWaalsContact O-N 3.14Å; V203-L207 HydrophobicContact CG1-CD1 4.24Å; V203-L207 HydrophobicContact CG1-CG 4.47Å; V203-L207 WeakPolarHBondContact O-CG 3.29Å; V203-L207 PolarHBondContact O-N 3.26Å
204I96Very high94.2Very high25 Ų2546.9 Ų46.913%0.12822%0.216CC..Hα-helixtrans-56.3-48.1176.4-70.7167.8000110.7W170 R200 S206 L207 Y208 W365 W366W170-I204 HydrophobicContact CH2-CD1 4.21Å; W170-I204 HydrophobicContact CH2-CG1 4.28Å; W170-I204 HydrophobicContact CZ3-CD1 4.28Å; W170-I204 HydrophobicContact CZ3-CG1 3.87Å; R200-I204 HydrophobicContact CG-CD1 3.75Å; R200-I204 HydrophobicContact CG-CG1 4.5Å; R200-I204 WeakPolarHBondContact O-CB 3.27Å; R200-I204 VanDerWaalsContact O-CG1 3.25Å; R200-I204 WeakPolarHBondContact O-CG1 3.34Å; R200-I204 PolarHBondContact O-N 3.47Å; I204-S206 VanDerWaalsContact C-N 3.34Å; I204-S206 PolarHBondContact O-N 3.49Å; I204-L207 PolarHBondContact O-N 3.5Å; I204-Y208 HydrophobicContact CG2-CE2 4.16Å; I204-Y208 VanDerWaalsContact O-CD2 3.27Å; I204-Y208 WeakPolarHBondContact O-CD2 3.39Å; I204-W365 HydrophobicContact CB-CH2 4.17Å; I204-W365 HydrophobicContact CD1-CH2 4.02Å; I204-W365 HydrophobicContact CG2-CH2 3.96Å; I204-W365 HydrophobicContact CG2-CZ3 4.49Å; I204-W366 HydrophobicContact CG2-CB 3.81Å
205R95.1Very high94.3Very high9 Ų941 Ų413%0.03419%0.194CC..Hα-helixtrans-60.7-43177.1-74.9175.863102.25.7112.1L188 A201 C202 V203 L207 Y208 H209 W365 W366 Y370 F372L188-R205 HydrophobicContact CD1-CB 4Å; L188-R205 HydrophobicContact CD2-CB 4.13Å; A201-R205 WeakPolarHBondContact O-CB 3.38Å; A201-R205 WeakPolarHBondContact O-CG 3.3Å; A201-R205 PolarHBondContact O-N 3.1Å; C202-R205 PolarHBondContact O-N 3.14Å; V203-R205 VanDerWaalsContact C-N 3.32Å; V203-R205 PolarHBondContact O-N 3.17Å; R205-L207 VanDerWaalsContact C-N 3.31Å; R205-L207 PolarHBondContact O-N 2.72Å; R205-Y208 PolarHBondContact O-N 3.2Å; R205-Y208 VanDerWaalsContact O-N 3.17Å; R205-H209 PolarHBondContact O-CD2 2.9Å; R205-W365 HydrophobicContact CG-CE3 4.45Å; R205-W365 HydrophobicContact CG-CZ3 4.21Å; R205-W365 PolarHBondContact NH1-O 2.87Å; R205-W366 HydrophobicContact CG-CB 4.42Å; R205-Y370 PolarHBondContact NH1-O 3.2Å; R205-Y370 PolarHBondContact NH2-O 2.98Å; R205-F372 VanDerWaalsContact NE-CE1 3.26Å
206S95.5Very high94.3Very high0 Ų035.4 Ų35.40%018%0.175CC..Hα-helixtrans-62.4-37.6179.3-53.70000112.2C202 V203 I204 Y208 H209 M210C202-S206 WeakPolarHBondContact O-CB 3.26Å; C202-S206 PolarHBondContact O-N 3Å; C202-S206 PolarHBondContact O-OG 2.69Å; V203-S206 WeakPolarHBondContact O-CB 3.17Å; V203-S206 PolarHBondContact O-N 3.39Å; V203-S206 VanDerWaalsContact O-N 3.14Å; I204-S206 VanDerWaalsContact C-N 3.34Å; I204-S206 PolarHBondContact O-N 3.49Å; S206-Y208 VanDerWaalsContact C-N 3.25Å; S206-Y208 PolarHBondContact O-N 3.49Å; S206-H209 WeakPolarHBondContact O-CB 3.47Å; S206-H209 PolarHBondContact O-N 3.07Å; S206-M210 PolarHBondContact O-N 2.72Å; S206-M210 VanDerWaalsContact O-N 3.16Å
207L95.9Very high94.1Very high3 Ų337.6 Ų37.62%0.01618%0.176CC..Hα-helixtrans-61.2-33.2176.4-69.3166.4000112.2P147 L173 H177 V203 I204 R205 H209 M210 Y211 F214P147-L207 HydrophobicContact CB-CD1 4.14Å; P147-L207 HydrophobicContact CG-CD1 4.4Å; P147-L207 HydrophobicContact CG-CD2 4.09Å; L173-L207 HydrophobicContact CD2-CD1 4.07Å; L173-L207 HydrophobicContact CG-CD1 4.42Å; H177-L207 HydrophobicContact CB-CD2 4.01Å; V203-L207 HydrophobicContact CG1-CD1 4.24Å; V203-L207 HydrophobicContact CG1-CG 4.47Å; V203-L207 WeakPolarHBondContact O-CG 3.29Å; V203-L207 PolarHBondContact O-N 3.26Å; I204-L207 PolarHBondContact O-N 3.5Å; R205-L207 VanDerWaalsContact C-N 3.31Å; R205-L207 PolarHBondContact O-N 2.72Å; L207-H209 PolarHBondContact O-N 2.92Å; L207-M210 PolarHBondContact O-N 2.7Å; L207-Y211 WeakPolarHBondContact O-CA 3.22Å; L207-Y211 VanDerWaalsContact O-CB 3.27Å; L207-Y211 WeakPolarHBondContact O-CB 3.23Å; L207-Y211 PolarHBondContact O-N 3.39Å; L207-F214 HydrophobicContact CB-CD2 3.78Å; L207-F214 HydrophobicContact CB-CE2 4.08Å; L207-F214 HydrophobicContact CD1-CE2 4.28Å
208Y94.3Very high93.9Very high31 Ų3133.7 Ų33.712%0.12216%0.164CC..Hα-helixtrans-71.3-9.3174.6-77.2-81000114.3I204 R205 S206 F214 I218 W366I204-Y208 HydrophobicContact CG2-CE2 4.16Å; I204-Y208 VanDerWaalsContact O-CD2 3.27Å; I204-Y208 WeakPolarHBondContact O-CD2 3.39Å; R205-Y208 PolarHBondContact O-N 3.2Å; R205-Y208 VanDerWaalsContact O-N 3.17Å; S206-Y208 VanDerWaalsContact C-N 3.25Å; S206-Y208 PolarHBondContact O-N 3.49Å; Y208-F214 HydrophobicContact CD1-CB 3.63Å; Y208-F214 HydrophobicContact CD1-CD2 4.41Å; Y208-F214 HydrophobicContact CD1-CG 4.29Å; Y208-F214 HydrophobicContact CD2-CD2 4.26Å; Y208-F214 HydrophobicContact CE1-CB 3.84Å; Y208-F214 HydrophobicContact CE1-CD2 4.27Å; Y208-F214 HydrophobicContact CE1-CG 4.1Å; Y208-F214 HydrophobicContact CE2-CD2 4.08Å; Y208-F214 HydrophobicContact CG-CB 4.17Å; Y208-F214 HydrophobicContact CG-CD2 4.42Å; Y208-I218 HydrophobicContact CD1-CD1 3.35Å; Y208-I218 HydrophobicContact CD1-CG1 4.05Å; Y208-I218 HydrophobicContact CE1-CD1 4.24Å; Y208-I218 HydrophobicContact CG-CD1 3.98Å; Y208-W366 AromaticContact CD1-CE3 3.84Å; Y208-W366 HydrophobicContact CD1-CE3 3.84Å; Y208-W366 AromaticContact CD1-CZ3 3.67Å; Y208-W366 HydrophobicContact CD1-CZ3 3.67Å; Y208-W366 HydrophobicContact CD2-CB 4.37Å; Y208-W366 HydrophobicContact CD2-CD2 4.25Å; Y208-W366 AromaticContact CD2-CE3 3.54Å; Y208-W366 HydrophobicContact CD2-CE3 3.54Å; Y208-W366 HydrophobicContact CD2-CZ3 4.24Å; Y208-W366 HydrophobicContact CE1-CD2 4.45Å; Y208-W366 AromaticContact CE1-CE3 3.49Å; Y208-W366 HydrophobicContact CE1-CE3 3.49Å; Y208-W366 VanDerWaalsContact CE1-CE3 3.49Å; Y208-W366 AromaticContact CE1-CH2 3.91Å; Y208-W366 HydrophobicContact CE1-CH2 3.91Å; Y208-W366 AromaticContact CE1-CZ3 3.17Å; Y208-W366 HydrophobicContact CE1-CZ3 3.17Å; Y208-W366 HydrophobicContact CE2-CB 4.14Å; Y208-W366 AromaticContact CE2-CD2 3.61Å; Y208-W366 HydrophobicContact CE2-CD2 3.61Å; Y208-W366 AromaticContact CE2-CE3 3.19Å; Y208-W366 HydrophobicContact CE2-CE3 3.19Å; Y208-W366 HydrophobicContact CE2-CG 4.03Å; Y208-W366 AromaticContact CE2-CZ3 3.84Å; Y208-W366 HydrophobicContact CE2-CZ3 3.84Å; Y208-W366 AromaticContact CG-CE3 3.85Å; Y208-W366 HydrophobicContact CG-CE3 3.85Å; Y208-W366 HydrophobicContact CG-CZ3 4.17Å; Y208-W366 AromaticContact CZ-CD2 3.71Å; Y208-W366 AromaticContact CZ-CE3 3.15Å; Y208-W366 AromaticContact CZ-CH2 3.89Å; Y208-W366 AromaticContact CZ-CZ3 3.26Å
209H93.1Very high93.4Very high57 Ų5738.3 Ų38.326%0.26420%0.196SC..Hα-helixtrans-94.8-34.2169.7-71.8-92.6000112.9L184 R205 S206 L207L184-H209 HydrophobicContact CD2-CB 3.36Å; R205-H209 PolarHBondContact O-CD2 2.9Å; S206-H209 WeakPolarHBondContact O-CB 3.47Å; S206-H209 PolarHBondContact O-N 3.07Å; L207-H209 PolarHBondContact O-N 2.92Å
210M93.4Very high92.7Very high34 Ų3446.1 Ų46.117%0.16723%0.229CC..Hα-helixtrans-115.1-28-165.6-56.2-176.5-63.900114.4Y174 Y178 A182 L184 S206 L207 E212Y174-M210 HydrophobicContact CD2-CE 4.31Å; Y174-M210 HydrophobicContact CE2-CE 4Å; Y178-M210 HydrophobicContact CD2-CE 4.18Å; Y178-M210 HydrophobicContact CD2-SD 3.62Å; Y178-M210 HydrophobicContact CE2-SD 4.39Å; Y178-M210 HydrophobicContact CG-SD 4.38Å; A182-M210 HydrophobicContact CB-CG 3.67Å; A182-M210 HydrophobicContact CB-SD 3.53Å; A182-M210 VanDerWaalsContact CB-SD 3.53Å; L184-M210 HydrophobicContact CD1-CE 4.15Å; L184-M210 HydrophobicContact CD1-SD 3.65Å; L184-M210 HydrophobicContact CD2-CG 3.98Å; L184-M210 HydrophobicContact CD2-SD 4.08Å; L184-M210 HydrophobicContact CG-SD 4.14Å; S206-M210 PolarHBondContact O-N 2.72Å; S206-M210 VanDerWaalsContact O-N 3.16Å; L207-M210 PolarHBondContact O-N 2.7Å; M210-E212 PolarHBondContact O-N 3.35Å
211Y94.6Very high91.9Very high28 Ų2847.4 Ų47.411%0.1124%0.242CC..  trans-91.3109.5-177.2-175.4-122.3000110.1P147 E148 H177 L207 P213 F214 A215P147-Y211 HydrophobicContact CB-CD1 3.88Å; P147-Y211 HydrophobicContact CB-CE1 3.72Å; P147-Y211 HydrophobicContact CG-CD1 3.7Å; P147-Y211 HydrophobicContact CG-CD2 4.2Å; P147-Y211 HydrophobicContact CG-CE1 3.59Å; P147-Y211 HydrophobicContact CG-CE2 4.11Å; P147-Y211 HydrophobicContact CG-CG 4.01Å; E148-Y211 VanDerWaalsContact CD-OH 3.3Å; E148-Y211 PolarHBondContact OE1-OH 3.34Å; E148-Y211 WeakPolarHBondContact OE2-CE1 3.37Å; E148-Y211 VanDerWaalsContact OE2-CZ 3.3Å; E148-Y211 PolarHBondContact OE2-OH 3.5Å; H177-Y211 AromaticContact CE1-CD2 3.45Å; H177-Y211 VanDerWaalsContact CE1-CD2 3.45Å; H177-Y211 WeakPolarHBondContact CE1-CD2 3.2Å; H177-Y211 AromaticContact CE1-CE2 3.55Å; H177-Y211 AromaticContact ND1-CD2 3.52Å; L207-Y211 WeakPolarHBondContact O-CA 3.22Å; L207-Y211 VanDerWaalsContact O-CB 3.27Å; L207-Y211 WeakPolarHBondContact O-CB 3.23Å; L207-Y211 PolarHBondContact O-N 3.39Å; Y211-P213 HydrophobicContact CD1-CB 4.25Å; Y211-P213 HydrophobicContact CD1-CG 4.26Å; Y211-P213 HydrophobicContact CE1-CB 3.75Å; Y211-P213 HydrophobicContact CE1-CG 3.66Å; Y211-P213 HydrophobicContact CE2-CG 4.01Å; Y211-F214 HydrophobicContact CD1-CB 4.21Å; Y211-F214 AromaticContact CD1-CD1 3.73Å; Y211-F214 HydrophobicContact CD1-CD1 3.73Å; Y211-F214 HydrophobicContact CD1-CD2 4.02Å; Y211-F214 HydrophobicContact CD1-CE1 4.03Å; Y211-F214 HydrophobicContact CD1-CE2 4.3Å; Y211-F214 AromaticContact CD1-CG 3.73Å; Y211-F214 HydrophobicContact CD1-CG 3.73Å; Y211-F214 HydrophobicContact CD1-CZ 4.31Å; Y211-F214 AromaticContact CE1-CD1 3.98Å; Y211-F214 HydrophobicContact CE1-CD1 3.98Å; Y211-F214 AromaticContact CE1-CE1 3.97Å; Y211-F214 HydrophobicContact CE1-CE1 3.97Å; Y211-F214 HydrophobicContact CE1-CG 4.44Å; Y211-F214 HydrophobicContact CE1-CZ 4.41Å; Y211-F214 WeakPolarHBondContact O-CB 3.31Å; Y211-F214 PolarHBondContact O-N 3.15Å; Y211-A215 PolarHBondContact O-N 2.86Å
212E93.2Very high91.4Very high131 Ų13150.5 Ų50.561%0.61226%0.262SS*.Hα-helixtrans-48.5-46.3-172.3-176.4-78161.700113.6M210 F214 A215 A216M210-E212 PolarHBondContact O-N 3.35Å; E212-F214 PolarHBondContact O-N 2.91Å; E212-F214 VanDerWaalsContact O-N 3.1Å; E212-A215 PolarHBondContact O-N 3.02Å; E212-A216 VanDerWaalsContact O-CB 3.27Å; E212-A216 WeakPolarHBondContact O-CB 3.49Å; E212-A216 PolarHBondContact O-N 3.1Å
213P94.3Very high90.9Very high37 Ų3751.9 Ų51.924%0.2427%0.274CS..Hα-helixtrans-62.9-24.9-178.8-28.638.1000113.9Y211 R217Y211-P213 HydrophobicContact CD1-CB 4.25Å; Y211-P213 HydrophobicContact CD1-CG 4.26Å; Y211-P213 HydrophobicContact CE1-CB 3.75Å; Y211-P213 HydrophobicContact CE1-CG 3.66Å; Y211-P213 HydrophobicContact CE2-CG 4.01Å; P213-R217 WeakPolarHBondContact O-CD 3.3Å; P213-R217 VanDerWaalsContact O-CG 3.26Å; P213-R217 WeakPolarHBondContact O-CG 3.23Å; P213-R217 PolarHBondContact O-NE 3.16Å
214F94.4Very high90.2Very high17 Ų1753.5 Ų53.58%0.07528%0.283CS..Hα-helixtrans-86.8-43.3176.6-74.39.5000111P147 E148 L207 Y208 Y211 E212 A216 R217P147-F214 HydrophobicContact CB-CE1 4.27Å; P147-F214 HydrophobicContact CB-CE2 3.78Å; P147-F214 HydrophobicContact CB-CZ 3.51Å; E148-F214 HydrophobicContact CB-CE1 4.26Å; L207-F214 HydrophobicContact CB-CD2 3.78Å; L207-F214 HydrophobicContact CB-CE2 4.08Å; L207-F214 HydrophobicContact CD1-CE2 4.28Å; Y208-F214 HydrophobicContact CD1-CB 3.63Å; Y208-F214 HydrophobicContact CD1-CD2 4.41Å; Y208-F214 HydrophobicContact CD1-CG 4.29Å; Y208-F214 HydrophobicContact CD2-CD2 4.26Å; Y208-F214 HydrophobicContact CE1-CB 3.84Å; Y208-F214 HydrophobicContact CE1-CD2 4.27Å; Y208-F214 HydrophobicContact CE1-CG 4.1Å; Y208-F214 HydrophobicContact CE2-CD2 4.08Å; Y208-F214 HydrophobicContact CG-CB 4.17Å; Y208-F214 HydrophobicContact CG-CD2 4.42Å; Y211-F214 HydrophobicContact CD1-CB 4.21Å; Y211-F214 AromaticContact CD1-CD1 3.73Å; Y211-F214 HydrophobicContact CD1-CD1 3.73Å; Y211-F214 HydrophobicContact CD1-CD2 4.02Å; Y211-F214 HydrophobicContact CD1-CE1 4.03Å; Y211-F214 HydrophobicContact CD1-CE2 4.3Å; Y211-F214 AromaticContact CD1-CG 3.73Å; Y211-F214 HydrophobicContact CD1-CG 3.73Å; Y211-F214 HydrophobicContact CD1-CZ 4.31Å; Y211-F214 AromaticContact CE1-CD1 3.98Å; Y211-F214 HydrophobicContact CE1-CD1 3.98Å; Y211-F214 AromaticContact CE1-CE1 3.97Å; Y211-F214 HydrophobicContact CE1-CE1 3.97Å; Y211-F214 HydrophobicContact CE1-CG 4.44Å; Y211-F214 HydrophobicContact CE1-CZ 4.41Å; Y211-F214 WeakPolarHBondContact O-CB 3.31Å; Y211-F214 PolarHBondContact O-N 3.15Å; E212-F214 PolarHBondContact O-N 2.91Å; E212-F214 VanDerWaalsContact O-N 3.1Å; F214-A216 PolarHBondContact O-N 2.98Å; F214-R217 PolarHBondContact O-N 3.03Å
215A91.6Very high89.6Confident35 Ų3554 Ų5429%0.28929%0.288SS..Hα-helixtrans-60.6-43.5176.100000111.9Y211 E212 R217 I218 S219Y211-A215 PolarHBondContact O-N 2.86Å; E212-A215 PolarHBondContact O-N 3.02Å; A215-R217 VanDerWaalsContact C-N 3.25Å; A215-R217 PolarHBondContact O-N 3.04Å; A215-I218 PolarHBondContact O-N 2.86Å; A215-I218 VanDerWaalsContact O-N 3.11Å; A215-S219 PolarHBondContact O-N 3.04Å
216A91.8Very high88.7Confident25 Ų2562.9 Ų62.921%0.20733%0.329CS..Hα-helixtrans-66.2-22.6179.200000113.9E212 F214 S219E212-A216 VanDerWaalsContact O-CB 3.27Å; E212-A216 WeakPolarHBondContact O-CB 3.49Å; E212-A216 PolarHBondContact O-N 3.1Å; F214-A216 PolarHBondContact O-N 2.98Å; A216-S219 PolarHBondContact O-OG 3.4Å
217R90.2Very high87.7Confident140 Ų14067.1 Ų67.153%0.52836%0.359SS..Hα-helixtrans-73-32.6173.6-72.6171-164.4-176.62.7111.8P213 F214 A215P213-R217 WeakPolarHBondContact O-CD 3.3Å; P213-R217 VanDerWaalsContact O-CG 3.26Å; P213-R217 WeakPolarHBondContact O-CG 3.23Å; P213-R217 PolarHBondContact O-NE 3.16Å; F214-R217 PolarHBondContact O-N 3.03Å; A215-R217 VanDerWaalsContact C-N 3.25Å; A215-R217 PolarHBondContact O-N 3.04Å
218I87.1Confident86.9Confident34 Ų3469.7 Ų69.717%0.17438%0.375CS..Hα-helixtrans-76-39-178-67.4165.7000111.5Y208 A215 K220 N221 W366 H367 P368Y208-I218 HydrophobicContact CD1-CD1 3.35Å; Y208-I218 HydrophobicContact CD1-CG1 4.05Å; Y208-I218 HydrophobicContact CE1-CD1 4.24Å; Y208-I218 HydrophobicContact CG-CD1 3.98Å; A215-I218 PolarHBondContact O-N 2.86Å; A215-I218 VanDerWaalsContact O-N 3.11Å; I218-K220 PolarHBondContact O-N 3.26Å; I218-K220 VanDerWaalsContact O-N 3.13Å; I218-N221 PolarHBondContact O-N 2.81Å; I218-W366 HydrophobicContact CD1-CZ3 4.49Å; I218-H367 WeakPolarHBondContact CG2-NE2 3.45Å; I218-P368 HydrophobicContact CD1-CG 3.67Å
219S82.9Confident86Confident97 Ų9769.3 Ų69.368%0.67838%0.377SS*.THydrogen-bonded Turntrans-63.9-19.6-174.861.70000114.3A215 A216A215-S219 PolarHBondContact O-N 3.04Å; A216-S219 PolarHBondContact O-OG 3.4Å
220K81.3Confident85.3Confident166 Ų16671.3 Ų71.372%0.72240%0.397SS*.THydrogen-bonded Turntrans-85.2-3.6-177.9-63.7179.1-176-179.60114.2I218I218-K220 PolarHBondContact O-N 3.26Å; I218-K220 VanDerWaalsContact O-N 3.13Å
221N79Confident84.8Confident102 Ų10273.5 Ų73.555%0.54541%0.412SS..  trans-74.2122.7-176.1-72.8-23.1000111.2I218I218-N221 PolarHBondContact O-N 2.81Å
222P84.7Confident84.3Confident70 Ų7072.2 Ų72.246%0.45541%0.407SS..  trans-65.6155178.329-35.4000111.1I224P222-I224 WeakPolarHBondContact CB-O 3.28Å; P222-I224 WeakPolarHBondContact CG-O 3.17Å; P222-I224 PolarHBondContact O-N 3.19Å
223A84Confident83.9Confident48 Ų4872.5 Ų72.540%0.39741%0.407SS..SBendtrans-64.7-24.2-179.500000113.4S359 V360A223-S359 CarbonylContact O-C 3.56Å; A223-S359 WeakPolarHBondContact O-CA 3.19Å; A223-S359 VanDerWaalsContact O-CB 3.31Å; A223-S359 WeakPolarHBondContact O-CB 3.44Å; A223-V360 CarbonylContact O-C 3.53Å; A223-V360 PolarHBondContact O-N 3.46Å
224I82.7Confident83.6Confident35 Ų3573.6 Ų73.618%0.17941%0.41CS..SBendtrans-131.6128.6173-60.3177.9000105.9P222 I318 H327P222-I224 WeakPolarHBondContact CB-O 3.28Å; P222-I224 WeakPolarHBondContact CG-O 3.17Å; P222-I224 PolarHBondContact O-N 3.19Å; I224-I318 HydrophobicContact CG2-CD1 4.34Å; I224-I318 HydrophobicContact CG2-CG2 4.36Å; I224-H327 HydrophobicContact CD1-CB 4.25Å; I224-H327 WeakPolarHBondContact CD1-ND1 3.36Å
225P82.9Confident83.5Confident35 Ų3572.9 Ų72.923%0.22741%0.407CS..  trans-67.2138.4179.629.6-34.3000109.9S227 P229 I318 V360P225-S227 WeakPolarHBondContact CB-O 3.35Å; P225-S227 PolarHBondContact O-N 2.88Å; P225-S227 VanDerWaalsContact O-N 3.15Å; P225-P229 HydrophobicContact CB-CG 4.4Å; P225-P229 HydrophobicContact CG-CG 4.03Å; P225-I318 HydrophobicContact CG-CD1 3.71Å; P225-V360 WeakPolarHBondContact CD-O 3.3Å; P225-V360 HydrophobicContact CG-CG1 4.33Å
226E76Confident83.6Confident195 Ų19575.6 Ų75.691%0.91141%0.413SS*.SBendtrans-61-24.3-179.4-64.1179.4173.700113
227S74.9Confident83.8Confident89 Ų8974.4 Ų74.462%0.62240%0.403SS*.SBendtrans-132.215217661.70000110.3P225 P229P225-S227 WeakPolarHBondContact CB-O 3.35Å; P225-S227 PolarHBondContact O-N 2.88Å; P225-S227 VanDerWaalsContact O-N 3.15Å; S227-P229 WeakPolarHBondContact O-CD 3.35Å
228T77.7Confident84Confident58 Ų5870.8 Ų70.836%0.35639%0.394SS..  trans-64.6118.4176.8-670000110.3S230 F316 I318T228-S230 PolarHBondContact O-N 3.45Å; T228-S230 VanDerWaalsContact O-N 3.16Å; T228-F316 HydrophobicContact CG2-CB 3.72Å; T228-F316 HydrophobicContact CG2-CD1 4.03Å; T228-F316 HydrophobicContact CG2-CG 3.92Å; T228-F316 WeakPolarHBondContact CG2-O 3.45Å; T228-I318 PolarHBondContact OG1-N 2.98Å
229P77.3Confident84.3Confident23 Ų2373.4 Ų73.415%0.14941%0.408CS..  trans-59.5115.7177-24.833000112.7P225 S227 T231 F316 L362P225-P229 HydrophobicContact CB-CG 4.4Å; P225-P229 HydrophobicContact CG-CG 4.03Å; S227-P229 WeakPolarHBondContact O-CD 3.35Å; P229-T231 VanDerWaalsContact C-N 3.34Å; P229-F316 HydrophobicContact CB-CD1 4.07Å; P229-F316 HydrophobicContact CB-CE1 4.18Å; P229-F316 HydrophobicContact CG-CD1 4.03Å; P229-F316 HydrophobicContact CG-CE1 3.7Å; P229-L362 HydrophobicContact CB-CD2 4.03Å
230S78.2Confident84.9Confident99 Ų9971 Ų7169%0.69239%0.385SS*.  trans-85.9-8.7173.959.40000113.3T228 L232 K233T228-S230 PolarHBondContact O-N 3.45Å; T228-S230 VanDerWaalsContact O-N 3.16Å; S230-L232 PolarHBondContact O-N 2.83Å; S230-K233 WeakPolarHBondContact O-CB 3.47Å; S230-K233 PolarHBondContact O-N 3.13Å
231T81.2Confident85.5Confident80 Ų8067.2 Ų67.249%0.49137%0.366SS..THydrogen-bonded Turntrans-64.4-20.1-174.351.90000114.5P229 L362P229-T231 VanDerWaalsContact C-N 3.34Å; T231-L362 VanDerWaalsContact OG1-CD2 3.31Å; T231-L362 WeakPolarHBondContact OG1-CD2 3.4Å
232L85.1Confident86.3Confident0 Ų065 Ų650%036%0.358CS..THydrogen-bonded Turntrans-86-12.5179.2-68.5-178.1000113.7S230 N234 S235 F260 C293 L295 F313 L362S230-L232 PolarHBondContact O-N 2.83Å; L232-N234 PolarHBondContact O-N 3.45Å; L232-S235 WeakPolarHBondContact O-CB 3.42Å; L232-S235 PolarHBondContact O-N 3.26Å; L232-S235 PolarHBondContact O-OG 3.39Å; L232-F260 HydrophobicContact CD1-CD2 3.97Å; L232-F260 HydrophobicContact CD1-CE2 3.93Å; L232-F260 HydrophobicContact CD2-CB 4.1Å; L232-F260 HydrophobicContact CD2-CD2 3.81Å; L232-F260 HydrophobicContact CD2-CG 4.15Å; L232-F260 HydrophobicContact CG-CD2 4.48Å; L232-C293 HydrophobicContact CD2-CB 4.4Å; L232-C293 WeakPolarHBondContact CD2-SG 3.45Å; L232-L295 HydrophobicContact CD1-CB 4.26Å; L232-L295 HydrophobicContact CD1-CD2 4.28Å; L232-F313 HydrophobicContact CB-CD1 3.52Å; L232-F313 HydrophobicContact CB-CE1 3.52Å; L232-F313 HydrophobicContact CD1-CE1 4.18Å; L232-F313 HydrophobicContact CD1-CZ 4.48Å; L232-F313 WeakPolarHBondContact O-CD1 3.5Å; L232-L362 HydrophobicContact CD1-CD1 4.06Å; L232-L362 HydrophobicContact CD2-CD1 3.84Å; L232-L362 HydrophobicContact CG-CD1 4.12Å; L232-L362 HydrophobicContact CG-CD2 4.41Å
233K84.9Confident86.8Confident138 Ų13868.3 Ų68.360%0.636%0.362SS*.THydrogen-bonded Turntrans-57134.3-172.4-170.9174.4-176.2176.80111.5S230 S235S230-K233 WeakPolarHBondContact O-CB 3.47Å; S230-K233 PolarHBondContact O-N 3.13Å; K233-S235 PolarHBondContact O-N 3.35Å
234N87.2Confident87.4Confident59 Ų5971.4 Ų71.432%0.31637%0.366SS..THydrogen-bonded Turntrans6421.6-175.6-57.2-28.5000114.8L232 Q263 F313L232-N234 PolarHBondContact O-N 3.45Å; N234-Q263 WeakPolarHBondContact O-CG 3.49Å; N234-F313 WeakPolarHBondContact CA-O 3.31Å; N234-F313 PolarHBondContact N-O 2.97Å
235S92.2Very high87.9Confident2 Ų272.1 Ų72.11%0.01437%0.37CS..EExtended strand (participates in β ladder)trans-87.3145173-54.60000111.1L232 K233 K261 F313L232-S235 WeakPolarHBondContact O-CB 3.42Å; L232-S235 PolarHBondContact O-N 3.26Å; L232-S235 PolarHBondContact O-OG 3.39Å; K233-S235 PolarHBondContact O-N 3.35Å; S235-K261 CarbonylContact C-O 3.6Å; S235-K261 WeakPolarHBondContact CA-O 3.29Å; S235-K261 WeakPolarHBondContact CB-O 3.48Å; S235-F313 WeakPolarHBondContact O-CB 3.47Å; S235-F313 PolarHBondContact O-N 3.36Å
236K94.3Very high88Confident93 Ų9376.6 Ų76.640%0.40440%0.396SS..EExtended strand (participates in β ladder)trans-83.7129.5175.7-174.5172.7179.2172.20110L238 F260 K261 G310 I312K236-L238 HydrophobicContact CD-CD2 4.49Å; K236-L238 HydrophobicContact CG-CD2 4.41Å; K236-L238 PolarHBondContact O-N 2.91Å; K236-F260 CarbonylContact O-C 3.5Å; K236-F260 VanDerWaalsContact O-CA 3.31Å; K236-F260 WeakPolarHBondContact O-CA 3.43Å; K236-K261 PolarHBondContact N-O 2.81Å; K236-K261 PolarHBondContact O-N 3.21Å; K236-G310 WeakPolarHBondContact CE-O 3.31Å; K236-I312 HydrophobicContact CB-CD1 3.86Å; K236-I312 HydrophobicContact CG-CD1 4.16Å
237C95.6Very high88Confident0 Ų069.5 Ų69.50%038%0.375CS..EExtended strand (participates in β ladder)trans-71.3113.4169.2-171.10000108.7F260 V308 G310 M311 F333C237-F260 HydrophobicContact CB-CD1 4.12Å; C237-F260 HydrophobicContact CB-CE1 3.85Å; C237-V308 WeakPolarHBondContact CB-O 3.31Å; C237-G310 WeakPolarHBondContact O-CA 3.32Å; C237-G310 PolarHBondContact O-N 2.75Å; C237-M311 PolarHBondContact N-O 2.94Å; C237-F333 HydrophobicContact CB-CD1 4.34Å; C237-F333 HydrophobicContact CB-CE1 3.95Å
238L94.5Very high88.1Confident64 Ų6473.9 Ų73.934%0.33539%0.392SS..EExtended strand (participates in β ladder)trans-85.2-45.9179.8-63.9-172.6000111.5K236 K259 K261K236-L238 HydrophobicContact CD-CD2 4.49Å; K236-L238 HydrophobicContact CG-CD2 4.41Å; K236-L238 PolarHBondContact O-N 2.91Å; L238-K259 HydrophobicContact CB-CG 4.44Å; L238-K259 HydrophobicContact CD1-CG 4.5Å; L238-K259 PolarHBondContact N-O 2.85Å; L238-K261 HydrophobicContact CD1-CB 3.79Å; L238-K261 HydrophobicContact CD1-CD 4.35Å; L238-K261 HydrophobicContact CD2-CB 4.07Å; L238-K261 HydrophobicContact CG-CB 3.9Å
239L94.2Very high88.1Confident89 Ų8978 Ų7847%0.46640%0.401SS..EExtended strand (participates in β ladder)trans-146.8145.6-173.5-79145.8000108W241 K259L239-W241 HydrophobicContact CB-CE3 4.38Å; L239-W241 HydrophobicContact CB-CZ3 4.27Å; L239-K259 HydrophobicContact CB-CB 4.27Å; L239-K259 HydrophobicContact CD1-CD 4.37Å; L239-K259 PolarHBondContact O-N 3.25Å
240F94.6Very high88Confident47 Ų4786.6 Ų86.621%0.20644%0.439CS..EExtended strand (participates in β ladder)trans-131.6152.3159.383.1-89.2000109.6N257 F258 I305 I307 V308 M309F240-N257 CarbonylContact C-O 3.56Å; F240-N257 WeakPolarHBondContact CA-O 3.23Å; F240-N257 WeakPolarHBondContact CB-O 3.41Å; F240-F258 HydrophobicContact CB-CD1 3.66Å; F240-F258 HydrophobicContact CB-CE1 3.97Å; F240-F258 HydrophobicContact CB-CG 4.39Å; F240-F258 HydrophobicContact CG-CE1 4.45Å; F240-I305 HydrophobicContact CD2-CD1 3.79Å; F240-I305 HydrophobicContact CE2-CD1 3.87Å; F240-I305 HydrophobicContact CE2-CG1 4.17Å; F240-I307 HydrophobicContact CE1-CG2 4.38Å; F240-V308 HydrophobicContact CD1-CG2 4.36Å; F240-M309 HydrophobicContact CD1-CE 4.5Å; F240-M309 HydrophobicContact CD1-CG 3.47Å; F240-M309 VanDerWaalsContact CD1-CG 3.47Å; F240-M309 HydrophobicContact CD1-SD 4.14Å; F240-M309 HydrophobicContact CE1-CE 4.07Å; F240-M309 HydrophobicContact CE1-CG 3.84Å; F240-M309 HydrophobicContact CE1-SD 4.31Å
241W95.4Very high88.1Confident85 Ų8588.2 Ų88.232%0.32244%0.436SS..EExtended strand (participates in β ladder)trans-150.9158.3172.164.397.8000109.4L239 N257 K259 L294 P371L239-W241 HydrophobicContact CB-CE3 4.38Å; L239-W241 HydrophobicContact CB-CZ3 4.27Å; W241-N257 HydrophobicContact CD2-CB 3.53Å; W241-N257 HydrophobicContact CE3-CB 3.96Å; W241-N257 HydrophobicContact CG-CB 4.07Å; W241-N257 HydrophobicContact CH2-CB 3.84Å; W241-N257 HydrophobicContact CZ2-CB 3.38Å; W241-N257 HydrophobicContact CZ3-CB 4.1Å; W241-N257 PolarHBondContact N-O 3.19Å; W241-N257 PolarHBondContact NE1-ND2 3.29Å; W241-N257 VanDerWaalsContact NE1-ND2 3.14Å; W241-N257 PolarHBondContact O-N 2.98Å; W241-K259 HydrophobicContact CZ3-CB 4.14Å; W241-L294 HydrophobicContact CH2-CD1 3.45Å; W241-L294 VanDerWaalsContact CH2-CD1 3.45Å; W241-L294 HydrophobicContact CH2-CD2 4.31Å; W241-L294 HydrophobicContact CZ2-CD1 4.03Å; W241-L294 HydrophobicContact CZ2-CD2 4.33Å; W241-L294 HydrophobicContact CZ3-CD1 4.17Å; W241-P371 HydrophobicContact CH2-CG 4.12Å; W241-P371 HydrophobicContact CZ2-CG 4.2Å
242C95.9Very high88.4Confident57 Ų5787.2 Ų87.239%0.38543%0.43SS..EExtended strand (participates in β ladder)trans-123.1150.517366.10000110.4E255 F256C242-E255 CarbonylContact C-O 3.54Å; C242-E255 WeakPolarHBondContact CA-O 3.26Å; C242-F256 HydrophobicContact CB-CD1 4.09Å; C242-F256 HydrophobicContact CB-CE1 4.12Å
243R94.8Very high88.9Confident138 Ų13888.3 Ų88.352%0.52144%0.436SS..EExtended strand (participates in β ladder)trans-142.2147.3170.763.5174.7179.8171.92.5111E255R243-E255 HydrophobicContact CG-CB 3.89Å; R243-E255 IonicContact CZ-OE1 2.77Å; R243-E255 IonicContact CZ-OE2 3.87Å; R243-E255 PolarHBondContact N-O 3.33Å; R243-E255 VanDerWaalsContact NE-CD 3.27Å; R243-E255 IonicContact NE-OE1 3.21Å; R243-E255 PolarHBondContact NE-OE1 2.89Å; R243-E255 IonicContact NE-OE2 3.52Å; R243-E255 PolarHBondContact NE-OE2 2.72Å; R243-E255 VanDerWaalsContact NH2-CD 3.32Å; R243-E255 IonicContact NH2-OE1 2.61Å; R243-E255 PolarHBondContact NH2-OE1 3.09Å; R243-E255 IonicContact NH2-OE2 3.62Å; R243-E255 PolarHBondContact NH2-OE2 3.35Å; R243-E255 PolarHBondContact O-N 3.4Å
244K95.5Very high89.4Confident113 Ų11384.5 Ų84.549%0.49142%0.418SS..EExtended strand (participates in β ladder)trans-76.2125.8168.3-168.1178-177.1-178.80108.5P252 W254K244-P252 HydrophobicContact CD-CB 4.42Å; K244-P252 HydrophobicContact CG-CB 4.33Å; K244-W254 HydrophobicContact CB-CD2 4.34Å; K244-W254 HydrophobicContact CB-CE3 3.96Å; K244-W254 HydrophobicContact CB-CH2 3.89Å; K244-W254 HydrophobicContact CB-CZ2 4.21Å; K244-W254 HydrophobicContact CB-CZ3 3.74Å; K244-W254 HydrophobicContact CD-CH2 4.18Å; K244-W254 HydrophobicContact CD-CZ2 3.99Å; K244-W254 HydrophobicContact CG-CD2 4.41Å; K244-W254 HydrophobicContact CG-CH2 4.16Å; K244-W254 HydrophobicContact CG-CZ2 3.99Å; K244-W254 HydrophobicContact CG-CZ3 4.41Å
245I92.8Very high89.9Confident50 Ų5082 Ų8226%0.25640%0.404SS..EExtended strand (participates in β ladder)trans-88111.8170.7-58.4177000107M253 E255 T298I245-M253 HydrophobicContact CB-CB 4.23Å; I245-M253 HydrophobicContact CD1-CB 4.5Å; I245-M253 PolarHBondContact N-O 2.9Å; I245-M253 PolarHBondContact O-N 2.61Å; I245-E255 HydrophobicContact CD1-CB 3.91Å; I245-E255 HydrophobicContact CD1-CG 4.47Å; I245-E255 HydrophobicContact CG1-CB 4.03Å; I245-T298 HydrophobicContact CD1-CG2 3.88Å
246V85.2Confident90.1Very high130 Ų13082 Ų8279%0.78840%0.404SS*.  trans-94.7117.8168.9-173.90000106.9
247G77Confident90.3Very high45 Ų4577.8 Ų77.846%0.46439%0.386SS..  trans-143.6-174.217700000110.3R249G247-R249 PolarHBondContact O-N 3.09Å
248N76.7Confident90.3Very high182 Ų18277.8 Ų77.897%0.97339%0.386SS*.SBendtrans-70.44-176.7-63.3-3000114.3
249R78.5Confident90.4Very high144 Ų14475.7 Ų75.754%0.54337%0.374SS..SBendtrans-81.8145.6174.9-68.8-157.6178.9160.8-8109.8G247 E251 M253 H358G247-R249 PolarHBondContact O-N 3.09Å; R249-E251 PolarHBondContact O-N 3.17Å; R249-M253 HydrophobicContact CB-CE 4.44Å; R249-M253 HydrophobicContact CG-CE 4.16Å; R249-M253 PolarHBondContact NH1-SD 3.05Å; R249-M253 VanDerWaalsContact NH1-SD 3.38Å; R249-H358 PolarHBondContact NH1-CD2 3.06Å; R249-H358 PolarHBondContact NH1-NE2 2.79Å; R249-H358 PolarHBondContact NH2-NE2 2.84Å
250Q73.8Confident90.4Very high204 Ų20471.5 Ų71.595%0.95335%0.352SS*.SBendtrans-60.9-35175.3-75.9-179.4-21.900112
251E81.6Confident90.4Very high132 Ų13274 Ų7462%0.61736%0.363SS*.SBendtrans-97.4132.2-178.6-66.6179.3-179.200112.1R249R249-E251 PolarHBondContact O-N 3.17Å
252P87.7Confident90.2Very high59 Ų5973.1 Ų73.138%0.38336%0.361SS..PPolyproline II helixtrans-70.7132.6176.429.7-33.3000110.6K244K244-P252 HydrophobicContact CD-CB 4.42Å; K244-P252 HydrophobicContact CG-CB 4.33Å
253M94Very high89.5Confident23 Ų2375.1 Ų75.111%0.11337%0.365CS..EExtended strand (participates in β ladder)trans-99.3159.3172.6-75.7176-8000110.9I245 R249 T298 T299 L300I245-M253 HydrophobicContact CB-CB 4.23Å; I245-M253 HydrophobicContact CD1-CB 4.5Å; I245-M253 PolarHBondContact N-O 2.9Å; I245-M253 PolarHBondContact O-N 2.61Å; R249-M253 HydrophobicContact CB-CE 4.44Å; R249-M253 HydrophobicContact CG-CE 4.16Å; R249-M253 PolarHBondContact NH1-SD 3.05Å; R249-M253 VanDerWaalsContact NH1-SD 3.38Å; M253-T298 HydrophobicContact CB-CG2 4.02Å; M253-T298 HydrophobicContact CG-CG2 4.49Å; M253-T298 HydrophobicContact SD-CG2 4.27Å; M253-T299 WeakPolarHBondContact CA-O 3.21Å; M253-L300 HydrophobicContact CG-CD2 4.27Å
254W96.7Very high88.2Confident59 Ų5972.8 Ų72.822%0.22337%0.37CS..EExtended strand (participates in β ladder)trans-123.3135.2179.1-67.285.9000110.7K244 F256 T298 T299 F302K244-W254 HydrophobicContact CB-CD2 4.34Å; K244-W254 HydrophobicContact CB-CE3 3.96Å; K244-W254 HydrophobicContact CB-CH2 3.89Å; K244-W254 HydrophobicContact CB-CZ2 4.21Å; K244-W254 HydrophobicContact CB-CZ3 3.74Å; K244-W254 HydrophobicContact CD-CH2 4.18Å; K244-W254 HydrophobicContact CD-CZ2 3.99Å; K244-W254 HydrophobicContact CG-CD2 4.41Å; K244-W254 HydrophobicContact CG-CH2 4.16Å; K244-W254 HydrophobicContact CG-CZ2 3.99Å; K244-W254 HydrophobicContact CG-CZ3 4.41Å; W254-F256 HydrophobicContact CB-CE2 3.88Å; W254-T298 CarbonylContact O-C 3.45Å; W254-T298 VanDerWaalsContact O-CA 3.26Å; W254-T298 WeakPolarHBondContact O-CA 3.2Å; W254-T299 PolarHBondContact N-O 3.41Å; W254-T299 PolarHBondContact O-N 2.96Å; W254-F302 HydrophobicContact CD2-CB 3.82Å; W254-F302 AromaticContact CD2-CD2 3.76Å; W254-F302 HydrophobicContact CD2-CD2 3.76Å; W254-F302 HydrophobicContact CD2-CG 4.25Å; W254-F302 HydrophobicContact CE3-CB 4.4Å; W254-F302 AromaticContact CE3-CD2 3.5Å; W254-F302 HydrophobicContact CE3-CD2 3.5Å; W254-F302 VanDerWaalsContact CE3-CD2 3.5Å; W254-F302 HydrophobicContact CE3-CE2 4.25Å; W254-F302 HydrophobicContact CE3-CG 4.36Å; W254-F302 HydrophobicContact CG-CB 4.07Å; W254-F302 HydrophobicContact CG-CD2 4.38Å; W254-F302 HydrophobicContact CH2-CB 4.47Å; W254-F302 HydrophobicContact CH2-CD2 4.1Å; W254-F302 HydrophobicContact CH2-CG 4.46Å; W254-F302 HydrophobicContact CZ2-CB 3.94Å; W254-F302 HydrophobicContact CZ2-CD2 4.37Å; W254-F302 HydrophobicContact CZ2-CG 4.4Å; W254-F302 AromaticContact CZ3-CD2 3.67Å; W254-F302 HydrophobicContact CZ3-CD2 3.67Å; W254-F302 HydrophobicContact CZ3-CE2 4.21Å; W254-F302 HydrophobicContact CZ3-CG 4.45Å
255E96.7Very high86.7Confident5 Ų572.6 Ų72.62%0.02338%0.38CS..EExtended strand (participates in β ladder)trans-110.9121.5180-166.1-173.286.700110.3C242 R243 I245 N257 Q296C242-E255 CarbonylContact C-O 3.54Å; C242-E255 WeakPolarHBondContact CA-O 3.26Å; R243-E255 HydrophobicContact CG-CB 3.89Å; R243-E255 IonicContact CZ-OE1 2.77Å; R243-E255 IonicContact CZ-OE2 3.87Å; R243-E255 PolarHBondContact N-O 3.33Å; R243-E255 VanDerWaalsContact NE-CD 3.27Å; R243-E255 IonicContact NE-OE1 3.21Å; R243-E255 PolarHBondContact NE-OE1 2.89Å; R243-E255 IonicContact NE-OE2 3.52Å; R243-E255 PolarHBondContact NE-OE2 2.72Å; R243-E255 VanDerWaalsContact NH2-CD 3.32Å; R243-E255 IonicContact NH2-OE1 2.61Å; R243-E255 PolarHBondContact NH2-OE1 3.09Å; R243-E255 IonicContact NH2-OE2 3.62Å; R243-E255 PolarHBondContact NH2-OE2 3.35Å; R243-E255 PolarHBondContact O-N 3.4Å; I245-E255 HydrophobicContact CD1-CB 3.91Å; I245-E255 HydrophobicContact CD1-CG 4.47Å; I245-E255 HydrophobicContact CG1-CB 4.03Å; E255-N257 PolarHBondContact OE1-ND2 3.2Å; E255-N257 PolarHBondContact OE1-OD1 2.86Å; E255-Q296 HydrophobicContact CG-CG 3.59Å; E255-Q296 PolarHBondContact OE2-NE2 3.46Å
256F97.6Very high84.9Confident2 Ų281.1 Ų81.11%0.00941%0.409CS..EExtended strand (participates in β ladder)trans-105.2121.2175.1-66-93.3000109.2C242 W254 F258 Q296 V297 T299 F302 I303 I305 L354C242-F256 HydrophobicContact CB-CD1 4.09Å; C242-F256 HydrophobicContact CB-CE1 4.12Å; W254-F256 HydrophobicContact CB-CE2 3.88Å; F256-F258 HydrophobicContact CB-CE2 3.84Å; F256-F258 HydrophobicContact CB-CZ 4.38Å; F256-Q296 CarbonylContact O-C 3.56Å; F256-Q296 WeakPolarHBondContact O-CA 3.31Å; F256-V297 PolarHBondContact N-O 3.44Å; F256-V297 PolarHBondContact O-N 2.92Å; F256-T299 HydrophobicContact CD2-CG2 4.24Å; F256-T299 HydrophobicContact CE2-CG2 4.26Å; F256-T299 VanDerWaalsContact CE2-OG1 3.31Å; F256-T299 WeakPolarHBondContact CE2-OG1 3.16Å; F256-F302 HydrophobicContact CZ-CD2 4.27Å; F256-F302 HydrophobicContact CZ-CE2 4.45Å; F256-I303 VanDerWaalsContact CE1-O 3.28Å; F256-I303 WeakPolarHBondContact CE1-O 3.38Å; F256-I303 HydrophobicContact CZ-CB 4.03Å; F256-I303 WeakPolarHBondContact CZ-O 3.1Å; F256-I305 HydrophobicContact CD1-CD1 3.97Å; F256-I305 HydrophobicContact CD1-CG2 4.43Å; F256-I305 HydrophobicContact CE1-CD1 4.38Å; F256-I305 HydrophobicContact CE1-CG2 4.17Å; F256-L354 HydrophobicContact CB-CD1 4.17Å; F256-L354 HydrophobicContact CD1-CD2 4.18Å; F256-L354 HydrophobicContact CD2-CD2 4.05Å; F256-L354 HydrophobicContact CE1-CD2 4.34Å; F256-L354 HydrophobicContact CE2-CD2 4.24Å; F256-L354 HydrophobicContact CG-CD1 4.35Å; F256-L354 HydrophobicContact CG-CD2 4.03Å; F256-L354 HydrophobicContact CZ-CD2 4.37Å
257N97.1Very high83.3Confident5 Ų581.6 Ų81.63%0.02741%0.406CS..EExtended strand (participates in β ladder)trans-116.4131.6-176.4-71.1-78.8000110.1F240 W241 E255 L294 L295F240-N257 CarbonylContact C-O 3.56Å; F240-N257 WeakPolarHBondContact CA-O 3.23Å; F240-N257 WeakPolarHBondContact CB-O 3.41Å; W241-N257 HydrophobicContact CD2-CB 3.53Å; W241-N257 HydrophobicContact CE3-CB 3.96Å; W241-N257 HydrophobicContact CG-CB 4.07Å; W241-N257 HydrophobicContact CH2-CB 3.84Å; W241-N257 HydrophobicContact CZ2-CB 3.38Å; W241-N257 HydrophobicContact CZ3-CB 4.1Å; W241-N257 PolarHBondContact N-O 3.19Å; W241-N257 PolarHBondContact NE1-ND2 3.29Å; W241-N257 VanDerWaalsContact NE1-ND2 3.14Å; W241-N257 PolarHBondContact O-N 2.98Å; E255-N257 PolarHBondContact OE1-ND2 3.2Å; E255-N257 PolarHBondContact OE1-OD1 2.86Å; N257-L294 HydrophobicContact CB-CD1 4.06Å; N257-L295 CarbonylContact C-O 3.56Å; N257-L295 WeakPolarHBondContact CA-O 3.2Å
258F96.5Very high81.9Confident0 Ų090 Ų900%043%0.43CS..EExtended strand (participates in β ladder)trans-128.6113.4177-55.9-94.8000109.4F240 F256 F260 L294 L295 I305 V308 L331 F333 V352 L354F240-F258 HydrophobicContact CB-CD1 3.66Å; F240-F258 HydrophobicContact CB-CE1 3.97Å; F240-F258 HydrophobicContact CB-CG 4.39Å; F240-F258 HydrophobicContact CG-CE1 4.45Å; F256-F258 HydrophobicContact CB-CE2 3.84Å; F256-F258 HydrophobicContact CB-CZ 4.38Å; F258-F260 HydrophobicContact CB-CD2 4.22Å; F258-F260 HydrophobicContact CB-CE2 3.46Å; F258-F260 VanDerWaalsContact CB-CE2 3.46Å; F258-F260 HydrophobicContact CB-CZ 3.66Å; F258-F260 HydrophobicContact CG-CE2 4.46Å; F258-F260 HydrophobicContact CG-CZ 4.37Å; F258-F260 WeakPolarHBondContact O-CD2 3.26Å; F258-L294 WeakPolarHBondContact O-CA 3.32Å; F258-L294 WeakPolarHBondContact O-CD1 3.4Å; F258-L295 HydrophobicContact CB-CB 4.32Å; F258-L295 HydrophobicContact CD2-CD2 4.35Å; F258-L295 PolarHBondContact N-O 3.05Å; F258-L295 PolarHBondContact O-N 2.82Å; F258-I305 HydrophobicContact CE1-CD1 3.87Å; F258-I305 HydrophobicContact CZ-CD1 3.68Å; F258-V308 HydrophobicContact CD1-CG2 4.23Å; F258-V308 HydrophobicContact CE1-CG2 4.02Å; F258-L331 HydrophobicContact CD2-CD1 4.25Å; F258-L331 HydrophobicContact CE1-CD1 4.44Å; F258-L331 HydrophobicContact CE2-CD1 3.88Å; F258-L331 HydrophobicContact CZ-CD1 3.98Å; F258-F333 HydrophobicContact CD1-CZ 4.28Å; F258-F333 HydrophobicContact CE1-CZ 4.42Å; F258-V352 HydrophobicContact CZ-CG1 4.35Å; F258-L354 HydrophobicContact CE2-CD1 4.38Å
259K96Very high80.5Confident21 Ų2184.7 Ų84.79%0.09141%0.407CS..EExtended strand (participates in β ladder)trans-88.1119174.6178.5170.5174161.80109.2L238 L239 W241 D289 L294 Y370L238-K259 HydrophobicContact CB-CG 4.44Å; L238-K259 HydrophobicContact CD1-CG 4.5Å; L238-K259 PolarHBondContact N-O 2.85Å; L239-K259 HydrophobicContact CB-CB 4.27Å; L239-K259 HydrophobicContact CD1-CD 4.37Å; L239-K259 PolarHBondContact O-N 3.25Å; W241-K259 HydrophobicContact CZ3-CB 4.14Å; K259-D289 IonicContact NZ-OD1 3.89Å; K259-D289 PolarHBondContact NZ-OD1 2.87Å; K259-L294 HydrophobicContact CB-CD1 4.42Å; K259-Y370 WeakPolarHBondContact CD-OH 3.43Å; K259-Y370 WeakPolarHBondContact CE-OH 3.23Å; K259-Y370 PolarHBondContact NZ-OH 3.43Å
260F95.5Very high79Confident0 Ų087.6 Ų87.60%042%0.424CS..EExtended strand (participates in β ladder)trans-108.6144178.8-66.1-72.9000111.2L232 K236 C237 F258 C292 C293 L295 F313 F333L232-F260 HydrophobicContact CD1-CD2 3.97Å; L232-F260 HydrophobicContact CD1-CE2 3.93Å; L232-F260 HydrophobicContact CD2-CB 4.1Å; L232-F260 HydrophobicContact CD2-CD2 3.81Å; L232-F260 HydrophobicContact CD2-CG 4.15Å; L232-F260 HydrophobicContact CG-CD2 4.48Å; K236-F260 CarbonylContact O-C 3.5Å; K236-F260 VanDerWaalsContact O-CA 3.31Å; K236-F260 WeakPolarHBondContact O-CA 3.43Å; C237-F260 HydrophobicContact CB-CD1 4.12Å; C237-F260 HydrophobicContact CB-CE1 3.85Å; F258-F260 HydrophobicContact CB-CD2 4.22Å; F258-F260 HydrophobicContact CB-CE2 3.46Å; F258-F260 VanDerWaalsContact CB-CE2 3.46Å; F258-F260 HydrophobicContact CB-CZ 3.66Å; F258-F260 HydrophobicContact CG-CE2 4.46Å; F258-F260 HydrophobicContact CG-CZ 4.37Å; F258-F260 WeakPolarHBondContact O-CD2 3.26Å; F260-C292 CarbonylContact O-C 3.55Å; F260-C292 WeakPolarHBondContact O-CA 3.15Å; F260-C293 PolarHBondContact N-O 2.91Å; F260-C293 PolarHBondContact O-N 3.21Å; F260-L295 HydrophobicContact CD2-CB 4.21Å; F260-L295 HydrophobicContact CE2-CB 3.75Å; F260-L295 HydrophobicContact CE2-CD2 4.08Å; F260-F313 HydrophobicContact CD1-CB 4.1Å; F260-F313 HydrophobicContact CE1-CB 3.68Å; F260-F313 AromaticContact CE1-CD2 3.93Å; F260-F313 HydrophobicContact CE1-CD2 3.93Å; F260-F313 AromaticContact CE1-CG 3.93Å; F260-F313 HydrophobicContact CE1-CG 3.93Å; F260-F313 HydrophobicContact CZ-CB 4.39Å; F260-F313 AromaticContact CZ-CD2 3.83Å; F260-F313 HydrophobicContact CZ-CD2 3.83Å; F260-F313 HydrophobicContact CZ-CE2 4.31Å; F260-F313 HydrophobicContact CZ-CG 4.15Å; F260-F333 AromaticContact CE1-CE1 3.75Å; F260-F333 HydrophobicContact CE1-CE1 3.75Å; F260-F333 HydrophobicContact CE1-CZ 4.38Å; F260-F333 HydrophobicContact CZ-CE1 4Å; F260-F333 HydrophobicContact CZ-CZ 4.17Å
261K93.8Very high77.6Confident101 Ų10181 Ų8144%0.43940%0.399SS..EExtended strand (participates in β ladder)trans-110.8117.8166.2-175.1166.8-175.31700109.3S235 K236 L238 Q263S235-K261 CarbonylContact C-O 3.6Å; S235-K261 WeakPolarHBondContact CA-O 3.29Å; S235-K261 WeakPolarHBondContact CB-O 3.48Å; K236-K261 PolarHBondContact N-O 2.81Å; K236-K261 PolarHBondContact O-N 3.21Å; L238-K261 HydrophobicContact CD1-CB 3.79Å; L238-K261 HydrophobicContact CD1-CD 4.35Å; L238-K261 HydrophobicContact CD2-CB 4.07Å; L238-K261 HydrophobicContact CG-CB 3.9Å; K261-Q263 PolarHBondContact O-N 2.96Å
262K90.8Very high75.9Confident66 Ų6681.2 Ų81.229%0.28741%0.41SS..PPolyproline II helixtrans-63.9131.9176.2-65.1171-176.4164.40107.8D291 D364K262-D291 HydrophobicContact CB-CB 4.34Å; K262-D291 WeakPolarHBondContact CB-O 3.49Å; K262-D291 PolarHBondContact N-O 3.04Å; K262-D364 IonicContact NZ-OD1 3.9Å; K262-D364 PolarHBondContact NZ-OD1 3.31Å
263Q81.5Confident74Confident99 Ų9981.4 Ų81.446%0.46342%0.423SS..PPolyproline II helixtrans-76128169.1-68.8-170.5-7.200107.7N234 K261N234-Q263 WeakPolarHBondContact O-CG 3.49Å; K261-Q263 PolarHBondContact O-N 2.96Å
264S67.5Low72.5Confident89 Ų8982.7 Ų82.762%0.62244%0.442SS*.PPolyproline II helixtrans-58.5132.1169.951.90000108R266S264-R266 PolarHBondContact O-N 3.08Å
265P63Low71.2Confident108 Ų10884.9 Ų84.970%0.70146%0.457SS*.PPolyproline II helixtrans-57.4118.7170.923-29.6000105.9L267P265-L267 PolarHBondContact O-N 3.45Å
266R56.8Low70.4Confident229 Ų22991.6 Ų91.686%0.86449%0.489SS*.  trans-59.592.6170.5-69.2-175.1-178.7179.30.4106.3S264 K268S264-R266 PolarHBondContact O-N 3.08Å; R266-K268 PolarHBondContact O-N 3.41Å
267L50.9Low69.7Low141 Ų14193.1 Ų93.174%0.73850%0.499SS*.  trans-59.6110.6173.9-80.5162.2000105.5P265 S269P265-L267 PolarHBondContact O-N 3.45Å; L267-S269 PolarHBondContact O-N 2.78Å
268K48Very low69.2Low221 Ų22194.6 Ų94.696%0.96151%0.509SS*.  trans-70.532.6179.3-69.3-169.8174.4-174.10112.6R266R266-K268 PolarHBondContact O-N 3.41Å
269S46Very low68.9Low71 Ų71100.5 Ų100.550%0.49754%0.544SS..SBendtrans-134.3137.2-174.8-178.90000109.5L267 C271L267-S269 PolarHBondContact O-N 2.78Å; S269-C271 PolarHBondContact O-N 3.39Å
270K48.4Very low68.7Low204 Ų204106.7 Ų106.789%0.88757%0.574SS**SBendtrans-59.319175.5-64.1-177.4174.8-1750114.5T272K270-T272 PolarHBondContact O-N 2.69Å
271C44.7Very low68.5Low65 Ų65108.8 Ų108.844%0.43958%0.582SS.*  trans-86.567.3169.4-61.10000108.5S269S269-C271 PolarHBondContact O-N 3.39Å
272T45Very low68.4Low138 Ų138109.9 Ų109.985%0.84759%0.588SS**  trans-78.6-5.5177.134.70000113.4K270 G274K270-T272 PolarHBondContact O-N 2.69Å; T272-G274 PolarHBondContact O-N 3.49Å
273G47.7Very low68.5Low63 Ų63110.8 Ų110.865%0.64960%0.597SS**  trans-99.468.9179.800000112.7
274G61.9Low69.1Low49 Ų49106.3 Ų106.351%0.50558%0.576SS.*  trans-58.2141.6154.700000108.1T272 Q276T272-G274 PolarHBondContact O-N 3.49Å; G274-Q276 PolarHBondContact O-N 2.73Å
275L70.1Confident70.4Confident106 Ų106104 Ų10456%0.55556%0.555SS**  trans-54.8105.3174.1-78.8170.1000108.6C71 W161C71-L275 WeakPolarHBondContact SG-CD2 3.09Å; W161-L275 HydrophobicContact CZ2-CB 4.03Å
276Q79.8Confident71.8Confident146 Ų146100.9 Ų100.968%0.68253%0.534SS*.PPolyproline II helixtrans-82.6141172.3-67.4-59.9-30.600107.9W161 G274W161-Q276 WeakPolarHBondContact CH2-O 3.29Å; W161-Q276 WeakPolarHBondContact CZ2-O 3.45Å; G274-Q276 PolarHBondContact O-N 2.73Å
277P82.6Confident73.5Confident34 Ų3491 Ų9122%0.22150%0.498CS..PPolyproline II helixtrans-55.4149.8170.526.7-33.5000109.5C165 V279 H285C165-P277 HydrophobicContact CB-CB 4.47Å; P277-V279 PolarHBondContact O-N 3.14Å; P277-H285 HydrophobicContact CG-CB 3.97Å
278P87.3Confident75.4Confident36 Ų3686.4 Ų86.423%0.23448%0.477CS..PPolyproline II helixtrans-51.7138.3173.1-24.633.2000110.8W161 Q280 Y281W161-P278 HydrophobicContact CH2-CG 4.26Å; W161-P278 HydrophobicContact CZ3-CG 4.18Å; P278-Q280 HydrophobicContact CB-CG 4.25Å; P278-Q280 PolarHBondContact O-N 3.09Å; P278-Q280 VanDerWaalsContact O-N 3.09Å; P278-Y281 HydrophobicContact CB-CD2 3.84Å; P278-Y281 HydrophobicContact CB-CE2 4.22Å; P278-Y281 HydrophobicContact CG-CD2 3.93Å; P278-Y281 HydrophobicContact CG-CE2 4.21Å; P278-Y281 PolarHBondContact O-N 2.91Å
279V89.7Confident77.6Confident124 Ų12476.3 Ų76.375%0.75243%0.433SS*.G310 helixtrans-52.1-38.4-172.9177.80000112.2P277 Y281 E282P277-V279 PolarHBondContact O-N 3.14Å; V279-Y281 PolarHBondContact O-N 3.19Å; V279-E282 VanDerWaalsContact O-CB 3.31Å; V279-E282 WeakPolarHBondContact O-CB 3.5Å; V279-E282 PolarHBondContact O-N 3.37Å
280Q90.8Very high79.7Confident151 Ų15176.4 Ų76.471%0.70643%0.426SS*.G310 helixtrans-60.6-12.9177.170.5-168.73300115.2P278P278-Q280 HydrophobicContact CB-CG 4.25Å; P278-Q280 PolarHBondContact O-N 3.09Å; P278-Q280 VanDerWaalsContact O-N 3.09Å
281Y92.1Very high81.7Confident43 Ų4370.2 Ų70.217%0.16940%0.403CS..G310 helixtrans-111.59.6177.2-55.6-53.5000112.9C165 T166 P278 V279 D283 V284 H285C165-Y281 HydrophobicContact CB-CD2 3.81Å; C165-Y281 HydrophobicContact CB-CE2 4.43Å; C165-Y281 HydrophobicContact CB-CG 4.43Å; C165-Y281 WeakPolarHBondContact O-CB 3.44Å; T166-Y281 HydrophobicContact CG2-CE1 4.14Å; T166-Y281 HydrophobicContact CG2-CE2 4.01Å; T166-Y281 WeakPolarHBondContact CG2-OH 3.34Å; P278-Y281 HydrophobicContact CB-CD2 3.84Å; P278-Y281 HydrophobicContact CB-CE2 4.22Å; P278-Y281 HydrophobicContact CG-CD2 3.93Å; P278-Y281 HydrophobicContact CG-CE2 4.21Å; P278-Y281 PolarHBondContact O-N 2.91Å; V279-Y281 PolarHBondContact O-N 3.19Å; Y281-D283 VanDerWaalsContact C-N 3.26Å; Y281-D283 PolarHBondContact O-N 3.47Å; Y281-V284 VanDerWaalsContact O-CB 3.3Å; Y281-V284 WeakPolarHBondContact O-CB 3.19Å; Y281-V284 PolarHBondContact O-N 2.86Å; Y281-H285 PolarHBondContact O-CD2 3.38Å; Y281-H285 VanDerWaalsContact O-CD2 3.27Å; Y281-H285 PolarHBondContact O-N 2.75Å
282E91.9Very high84Confident124 Ų12467.2 Ų67.258%0.57938%0.382SS*.Hα-helixtrans-52.5-43-177.1-176.1171.8-173.700112.8V279 V284 H285 T286V279-E282 VanDerWaalsContact O-CB 3.31Å; V279-E282 WeakPolarHBondContact O-CB 3.5Å; V279-E282 PolarHBondContact O-N 3.37Å; E282-V284 VanDerWaalsContact C-N 3.32Å; E282-V284 PolarHBondContact O-N 2.79Å; E282-H285 PolarHBondContact O-N 3.49Å; E282-T286 PolarHBondContact O-N 2.93Å; E282-T286 PolarHBondContact O-OG1 3.36Å
283D92.6Very high86.3Confident86 Ų8660.6 Ų60.646%0.4634%0.342SS..Hα-helixtrans-60.6-39.9176.8-79.5-30.7000112.7L196 R197 C198 Y281 H285 T286L196-D283 HydrophobicContact CB-CB 4.14Å; L196-D283 CarbonylContact O-C 3.57Å; R197-D283 CarbonylContact C-O 3.56Å; R197-D283 VanDerWaalsContact CA-O 3.28Å; R197-D283 WeakPolarHBondContact CA-O 3.35Å; C198-D283 PolarHBondContact N-O 2.66Å; Y281-D283 VanDerWaalsContact C-N 3.26Å; Y281-D283 PolarHBondContact O-N 3.47Å; D283-H285 PolarHBondContact O-N 2.84Å; D283-T286 PolarHBondContact O-N 2.89Å
284V94.8Very high88.6Confident4 Ų457.8 Ų57.82%0.02431%0.312CS..Hα-helixtrans-59.8-38.2178.2179.40000111.1A167 W170 L196 L199 R200 Y281 E282A167-V284 HydrophobicContact CB-CG2 3.84Å; W170-V284 HydrophobicContact CG-CG1 4.49Å; L196-V284 HydrophobicContact CD2-CG2 4.42Å; L196-V284 VanDerWaalsContact O-CA 3.28Å; L196-V284 WeakPolarHBondContact O-CA 3.48Å; L196-V284 PolarHBondContact O-N 3.01Å; L199-V284 HydrophobicContact CB-CG1 4.31Å; L199-V284 HydrophobicContact CD2-CG1 4.41Å; R200-V284 HydrophobicContact CB-CG1 4.41Å; R200-V284 WeakPolarHBondContact CB-O 3.44Å; R200-V284 PolarHBondContact N-O 2.91Å; Y281-V284 VanDerWaalsContact O-CB 3.3Å; Y281-V284 WeakPolarHBondContact O-CB 3.19Å; Y281-V284 PolarHBondContact O-N 2.86Å; E282-V284 VanDerWaalsContact C-N 3.32Å; E282-V284 PolarHBondContact O-N 2.79Å
285H93.8Very high90.2Very high42 Ų4255.5 Ų55.519%0.19429%0.288CS..Hα-helixtrans-95.5-8.8-175.7-67.3-84.8000114.2C165 R200 P277 Y281 E282 D283 N287C165-H285 WeakPolarHBondContact CA-NE2 3.45Å; C165-H285 PolarHBondContact O-NE2 3.21Å; R200-H285 VanDerWaalsContact CD-ND1 3.27Å; R200-H285 WeakPolarHBondContact CD-ND1 3.45Å; P277-H285 HydrophobicContact CG-CB 3.97Å; Y281-H285 PolarHBondContact O-CD2 3.38Å; Y281-H285 VanDerWaalsContact O-CD2 3.27Å; Y281-H285 PolarHBondContact O-N 2.75Å; E282-H285 PolarHBondContact O-N 3.49Å; D283-H285 PolarHBondContact O-N 2.84Å; H285-N287 PolarHBondContact O-N 3.22Å
286T92.7Very high91.4Very high41 Ų4151.5 Ų51.525%0.25227%0.267SS..  trans-55.9123.8176-69.20000109.9C198 E282 D283C198-T286 WeakPolarHBondContact CA-O 3.27Å; C198-T286 PolarHBondContact SG-O 2.73Å; C198-T286 VanDerWaalsContact SG-O 3.39Å; E282-T286 PolarHBondContact O-N 2.93Å; E282-T286 PolarHBondContact O-OG1 3.36Å; D283-T286 PolarHBondContact O-N 2.89Å
287N92.7Very high92.2Very high22 Ų2244.5 Ų44.512%0.11823%0.234CC..  trans-138.4102.9176.3178.59.8000109.4A201 H285 D289 Q290A201-N287 HydrophobicContact CB-CB 4.11Å; H285-N287 PolarHBondContact O-N 3.22Å; N287-D289 PolarHBondContact O-N 2.83Å; N287-D289 VanDerWaalsContact O-N 3.17Å; N287-D289 PolarHBondContact OD1-N 3.36Å; N287-D289 VanDerWaalsContact OD1-N 3.09Å; N287-Q290 HydrophobicContact CB-CB 4.07Å; N287-Q290 PolarHBondContact ND2-OE1 2.81Å; N287-Q290 VanDerWaalsContact ND2-OE1 3.15Å; N287-Q290 WeakPolarHBondContact O-CB 3.39Å; N287-Q290 PolarHBondContact O-N 3.3Å; N287-Q290 PolarHBondContact OD1-N 2.89Å
288P91.9Very high92.8Very high44 Ų4443.3 Ų43.329%0.28623%0.226SC..THydrogen-bonded Turntrans-64.7-21.3-178.426.4-34.5000113A376P288-A376 HydrophobicContact CG-CB 4.05Å
289D92.9Very high93.2Very high9 Ų941.6 Ų41.65%0.04822%0.215CC..THydrogen-bonded Turntrans-99.411.6178.8-63.7-42.5000112.4K259 N287 D291 C292 W365 Y370 S373K259-D289 IonicContact NZ-OD1 3.89Å; K259-D289 PolarHBondContact NZ-OD1 2.87Å; N287-D289 PolarHBondContact O-N 2.83Å; N287-D289 VanDerWaalsContact O-N 3.17Å; N287-D289 PolarHBondContact OD1-N 3.36Å; N287-D289 VanDerWaalsContact OD1-N 3.09Å; D289-D291 PolarHBondContact O-N 3.42Å; D289-C292 HydrophobicContact CB-CB 4.4Å; D289-C292 WeakPolarHBondContact O-CB 3.17Å; D289-C292 PolarHBondContact O-N 2.98Å; D289-W365 HydrophobicContact CB-CB 3.86Å; D289-W365 VanDerWaalsContact O-CB 3.26Å; D289-W365 WeakPolarHBondContact O-CB 3.27Å; D289-Y370 HydrophobicContact CB-CE1 4.21Å; D289-S373 VanDerWaalsContact OD2-CB 3.31Å; D289-S373 WeakPolarHBondContact OD2-CB 3.42Å
290Q90Very high93.4Very high73 Ų7337.1 Ų37.134%0.34119%0.187SC..THydrogen-bonded Turntrans-53.6134173.6-171.558.542.300110.2N287 C292N287-Q290 HydrophobicContact CB-CB 4.07Å; N287-Q290 PolarHBondContact ND2-OE1 2.81Å; N287-Q290 VanDerWaalsContact ND2-OE1 3.15Å; N287-Q290 WeakPolarHBondContact O-CB 3.39Å; N287-Q290 PolarHBondContact O-N 3.3Å; N287-Q290 PolarHBondContact OD1-N 2.89Å; Q290-C292 PolarHBondContact O-N 2.86Å; Q290-C292 VanDerWaalsContact O-N 3.09Å
291D90.2Very high93.4Very high74 Ų7434.4 Ų34.440%0.39618%0.177SC..THydrogen-bonded Turntrans59.315-176.7-50.1-36.1000115.1K262 D289K262-D291 HydrophobicContact CB-CB 4.34Å; K262-D291 WeakPolarHBondContact CB-O 3.49Å; K262-D291 PolarHBondContact N-O 3.04Å; D289-D291 PolarHBondContact O-N 3.42Å
292C93.5Very high93.6Very high2 Ų236 Ų361%0.01419%0.185CC..EExtended strand (participates in β ladder)trans-91.1153.1173.4-610000112F260 D289 Q290 W365 Y370F260-C292 CarbonylContact O-C 3.55Å; F260-C292 WeakPolarHBondContact O-CA 3.15Å; D289-C292 HydrophobicContact CB-CB 4.4Å; D289-C292 WeakPolarHBondContact O-CB 3.17Å; D289-C292 PolarHBondContact O-N 2.98Å; Q290-C292 PolarHBondContact O-N 2.86Å; Q290-C292 VanDerWaalsContact O-N 3.09Å; C292-W365 PolarHBondContact O-N 3.39Å; C292-Y370 WeakPolarHBondContact CB-OH 3.22Å
293C93.8Very high93.7Very high0 Ų031.5 Ų31.50%017%0.165CC..EExtended strand (participates in β ladder)trans-146.3156.717349.80000109.7L232 F260 L362 F363L232-C293 HydrophobicContact CD2-CB 4.4Å; L232-C293 WeakPolarHBondContact CD2-SG 3.45Å; F260-C293 PolarHBondContact N-O 2.91Å; F260-C293 PolarHBondContact O-N 3.21Å; C293-L362 HydrophobicContact CB-CD1 4.17Å; C293-F363 CarbonylContact C-O 3.43Å; C293-F363 WeakPolarHBondContact CA-O 3.18Å; C293-F363 WeakPolarHBondContact CB-O 3.38Å
294L94.8Very high93.8Very high4 Ų436.2 Ų36.22%0.02118%0.181CC..EExtended strand (participates in β ladder)trans-120.3118.9-177.8178.664.1000108.8W241 N257 F258 K259 L362 F363 Y370 P371W241-L294 HydrophobicContact CH2-CD1 3.45Å; W241-L294 VanDerWaalsContact CH2-CD1 3.45Å; W241-L294 HydrophobicContact CH2-CD2 4.31Å; W241-L294 HydrophobicContact CZ2-CD1 4.03Å; W241-L294 HydrophobicContact CZ2-CD2 4.33Å; W241-L294 HydrophobicContact CZ3-CD1 4.17Å; N257-L294 HydrophobicContact CB-CD1 4.06Å; F258-L294 WeakPolarHBondContact O-CA 3.32Å; F258-L294 WeakPolarHBondContact O-CD1 3.4Å; K259-L294 HydrophobicContact CB-CD1 4.42Å; L294-L362 WeakPolarHBondContact O-CA 3.31Å; L294-F363 HydrophobicContact CB-CB 4.35Å; L294-F363 HydrophobicContact CB-CD2 4.34Å; L294-F363 HydrophobicContact CD2-CD2 4.08Å; L294-F363 HydrophobicContact CG-CD2 4.32Å; L294-F363 PolarHBondContact N-O 3.08Å; L294-F363 PolarHBondContact O-N 2.83Å; L294-Y370 HydrophobicContact CB-CD2 3.68Å; L294-Y370 HydrophobicContact CB-CE2 3.61Å; L294-P371 VanDerWaalsContact CD2-CD 3.46Å; L294-P371 HydrophobicContact CD2-CG 4.14Å
295L95.8Very high93.9Very high0 Ų037.6 Ų37.60%019%0.188CC..EExtended strand (participates in β ladder)trans-90.3120.5166.3177.466.2000108.4L232 N257 F258 F260 V297 F316 L331 V360L232-L295 HydrophobicContact CD1-CB 4.26Å; L232-L295 HydrophobicContact CD1-CD2 4.28Å; N257-L295 CarbonylContact C-O 3.56Å; N257-L295 WeakPolarHBondContact CA-O 3.2Å; F258-L295 HydrophobicContact CB-CB 4.32Å; F258-L295 HydrophobicContact CD2-CD2 4.35Å; F258-L295 PolarHBondContact N-O 3.05Å; F258-L295 PolarHBondContact O-N 2.82Å; F260-L295 HydrophobicContact CD2-CB 4.21Å; F260-L295 HydrophobicContact CE2-CB 3.75Å; F260-L295 HydrophobicContact CE2-CD2 4.08Å; L295-V297 HydrophobicContact CD1-CG2 4.24Å; L295-V297 HydrophobicContact CD2-CG2 4.34Å; L295-V297 HydrophobicContact CG-CG2 4.04Å; L295-F316 HydrophobicContact CD1-CE1 4.13Å; L295-F316 HydrophobicContact CD1-CZ 3.94Å; L295-F316 HydrophobicContact CD2-CZ 4.49Å; L295-L331 HydrophobicContact CD2-CD1 4.12Å; L295-L331 HydrophobicContact CD2-CD2 3.78Å; L295-V360 HydrophobicContact CD1-CG1 4.07Å
296Q96.1Very high93.9Very high22 Ų2238.1 Ų38.110%0.10320%0.195CC..EExtended strand (participates in β ladder)trans-113.4121.1174.8-177.6-163.411.500108.2E255 F256 R361 F363E255-Q296 HydrophobicContact CG-CG 3.59Å; E255-Q296 PolarHBondContact OE2-NE2 3.46Å; F256-Q296 CarbonylContact O-C 3.56Å; F256-Q296 WeakPolarHBondContact O-CA 3.31Å; Q296-R361 HydrophobicContact CB-CB 4.4Å; Q296-R361 PolarHBondContact N-O 2.79Å; Q296-R361 PolarHBondContact O-N 3.31Å; Q296-F363 HydrophobicContact CB-CE2 4.02Å
297V96.5Very high94Very high0 Ų042.3 Ų42.30%022%0.215CC..EExtended strand (participates in β ladder)trans-119.5125.5175.5-175.10000108.4F256 L295 T299 V329 L354 V357 S359 V360F256-V297 PolarHBondContact N-O 3.44Å; F256-V297 PolarHBondContact O-N 2.92Å; L295-V297 HydrophobicContact CD1-CG2 4.24Å; L295-V297 HydrophobicContact CD2-CG2 4.34Å; L295-V297 HydrophobicContact CG-CG2 4.04Å; V297-T299 HydrophobicContact CG1-CG2 4.4Å; V297-V329 HydrophobicContact CG1-CB 4.5Å; V297-V329 HydrophobicContact CG1-CG2 4.29Å; V297-V329 HydrophobicContact CG2-CG1 4.42Å; V297-L354 HydrophobicContact CB-CD1 3.64Å; V297-L354 HydrophobicContact CG1-CB 4.3Å; V297-L354 HydrophobicContact CG1-CD1 3.56Å; V297-L354 HydrophobicContact CG2-CD1 4Å; V297-V357 HydrophobicContact CG1-CG1 3.78Å; V297-V357 HydrophobicContact CG1-CG2 3.92Å; V297-S359 WeakPolarHBondContact CA-O 3.42Å; V297-V360 HydrophobicContact CG1-CG2 4.37Å
298T95.9Very high94.2Very high8 Ų841.3 Ų41.35%0.04921%0.209CC..EExtended strand (participates in β ladder)trans-104129.8176.5-50.80000109.3I245 M253 W254 H358 S359I245-T298 HydrophobicContact CD1-CG2 3.88Å; M253-T298 HydrophobicContact CB-CG2 4.02Å; M253-T298 HydrophobicContact CG-CG2 4.49Å; M253-T298 HydrophobicContact SD-CG2 4.27Å; W254-T298 CarbonylContact O-C 3.45Å; W254-T298 VanDerWaalsContact O-CA 3.26Å; W254-T298 WeakPolarHBondContact O-CA 3.2Å; T298-H358 HydrophobicContact CG2-CB 4.38Å; T298-H358 PolarHBondContact O-N 2.81Å; T298-S359 WeakPolarHBondContact CB-OG 3.18Å; T298-S359 PolarHBondContact N-O 3.14Å; T298-S359 PolarHBondContact O-N 2.85Å; T298-S359 PolarHBondContact OG1-OG 3.4Å
299T95.7Very high94.3Very high0 Ų043.6 Ų43.60%022%0.217CC..EExtended strand (participates in β ladder)trans-121.2160.7178.559.50000110.9M253 W254 F256 V297 N301 I303 L354 P356 V357M253-T299 WeakPolarHBondContact CA-O 3.21Å; W254-T299 PolarHBondContact N-O 3.41Å; W254-T299 PolarHBondContact O-N 2.96Å; F256-T299 HydrophobicContact CD2-CG2 4.24Å; F256-T299 HydrophobicContact CE2-CG2 4.26Å; F256-T299 VanDerWaalsContact CE2-OG1 3.31Å; F256-T299 WeakPolarHBondContact CE2-OG1 3.16Å; V297-T299 HydrophobicContact CG1-CG2 4.4Å; T299-N301 PolarHBondContact OG1-O 2.88Å; T299-I303 HydrophobicContact CG2-CD1 4Å; T299-L354 HydrophobicContact CG2-CB 3.94Å; T299-P356 WeakPolarHBondContact CA-O 3.48Å; T299-P356 VanDerWaalsContact CB-O 3.27Å; T299-P356 WeakPolarHBondContact CB-O 3.48Å; T299-V357 HydrophobicContact CG2-CG2 4.22Å
300L92.6Very high94.4Very high31 Ų3144.9 Ų44.916%0.16223%0.233CC..SBendtrans-78.4-28.7175.6-52.9177.6000112.1M253 H326 P356 H358M253-L300 HydrophobicContact CG-CD2 4.27Å; L300-H326 WeakPolarHBondContact CD1-NE2 3.45Å; L300-P356 HydrophobicContact CB-CG 3.89Å; L300-P356 HydrophobicContact CD1-CB 4.26Å; L300-P356 HydrophobicContact CD1-CG 3.86Å; L300-P356 HydrophobicContact CG-CG 4.01Å; L300-P356 PolarHBondContact N-O 2.9Å; L300-P356 VanDerWaalsContact N-O 3.15Å; L300-H358 HydrophobicContact CD2-CB 4.22Å
301N91.7Very high94.6Very high94 Ų9441.9 Ų41.950%0.50322%0.219SC..SBendtrans-116.7155.7-179.1-63.8-43.2000111.3T299T299-N301 PolarHBondContact OG1-O 2.88Å
302F94.9Very high94.7Very high76 Ų7638.8 Ų38.833%0.33320%0.202SC..  trans-69.7137.9164.6-177.2-106.4000109W254 F256 F304W254-F302 HydrophobicContact CD2-CB 3.82Å; W254-F302 AromaticContact CD2-CD2 3.76Å; W254-F302 HydrophobicContact CD2-CD2 3.76Å; W254-F302 HydrophobicContact CD2-CG 4.25Å; W254-F302 HydrophobicContact CE3-CB 4.4Å; W254-F302 AromaticContact CE3-CD2 3.5Å; W254-F302 HydrophobicContact CE3-CD2 3.5Å; W254-F302 VanDerWaalsContact CE3-CD2 3.5Å; W254-F302 HydrophobicContact CE3-CE2 4.25Å; W254-F302 HydrophobicContact CE3-CG 4.36Å; W254-F302 HydrophobicContact CG-CB 4.07Å; W254-F302 HydrophobicContact CG-CD2 4.38Å; W254-F302 HydrophobicContact CH2-CB 4.47Å; W254-F302 HydrophobicContact CH2-CD2 4.1Å; W254-F302 HydrophobicContact CH2-CG 4.46Å; W254-F302 HydrophobicContact CZ2-CB 3.94Å; W254-F302 HydrophobicContact CZ2-CD2 4.37Å; W254-F302 HydrophobicContact CZ2-CG 4.4Å; W254-F302 AromaticContact CZ3-CD2 3.67Å; W254-F302 HydrophobicContact CZ3-CD2 3.67Å; W254-F302 HydrophobicContact CZ3-CE2 4.21Å; W254-F302 HydrophobicContact CZ3-CG 4.45Å; F256-F302 HydrophobicContact CZ-CD2 4.27Å; F256-F302 HydrophobicContact CZ-CE2 4.45Å; F302-F304 HydrophobicContact CD1-CD2 4.17Å; F302-F304 HydrophobicContact CD1-CE2 4.03Å; F302-F304 HydrophobicContact CD1-CZ 4.33Å; F302-F304 AromaticContact CE1-CD1 3.78Å; F302-F304 HydrophobicContact CE1-CD1 3.78Å; F302-F304 AromaticContact CE1-CD2 3.79Å; F302-F304 HydrophobicContact CE1-CD2 3.79Å; F302-F304 AromaticContact CE1-CE1 3.68Å; F302-F304 HydrophobicContact CE1-CE1 3.68Å; F302-F304 AromaticContact CE1-CE2 3.69Å; F302-F304 HydrophobicContact CE1-CE2 3.69Å; F302-F304 AromaticContact CE1-CG 3.84Å; F302-F304 HydrophobicContact CE1-CG 3.84Å; F302-F304 AromaticContact CE1-CZ 3.64Å; F302-F304 HydrophobicContact CE1-CZ 3.64Å; F302-F304 HydrophobicContact CZ-CD1 4.31Å; F302-F304 HydrophobicContact CZ-CE1 4.32Å
303I95.5Very high94.7Very high30 Ų3038.8 Ų38.815%0.15420%0.202CC..  trans-131.3122.5-178-56.7176.4000107.2F256 T299 I305 L354 D355F256-I303 VanDerWaalsContact CE1-O 3.28Å; F256-I303 WeakPolarHBondContact CE1-O 3.38Å; F256-I303 HydrophobicContact CZ-CB 4.03Å; F256-I303 WeakPolarHBondContact CZ-O 3.1Å; T299-I303 HydrophobicContact CG2-CD1 4Å; I303-I305 HydrophobicContact CG2-CG2 4.29Å; I303-I305 PolarHBondContact O-N 2.69Å; I303-L354 HydrophobicContact CB-CD2 4.26Å; I303-L354 HydrophobicContact CD1-CB 4.31Å; I303-L354 HydrophobicContact CD1-CD2 4.09Å; I303-L354 HydrophobicContact CG2-CD2 4.33Å; I303-D355 VanDerWaalsContact CD1-N 3.27Å; I303-D355 WeakPolarHBondContact CD1-O 3.32Å
304F95.1Very high94.5Very high185 Ų18539.6 Ų39.681%0.81121%0.207SC*.  trans-70.2125.6171.8-75.6-83.2000109.4F302F302-F304 HydrophobicContact CD1-CD2 4.17Å; F302-F304 HydrophobicContact CD1-CE2 4.03Å; F302-F304 HydrophobicContact CD1-CZ 4.33Å; F302-F304 AromaticContact CE1-CD1 3.78Å; F302-F304 HydrophobicContact CE1-CD1 3.78Å; F302-F304 AromaticContact CE1-CD2 3.79Å; F302-F304 HydrophobicContact CE1-CD2 3.79Å; F302-F304 AromaticContact CE1-CE1 3.68Å; F302-F304 HydrophobicContact CE1-CE1 3.68Å; F302-F304 AromaticContact CE1-CE2 3.69Å; F302-F304 HydrophobicContact CE1-CE2 3.69Å; F302-F304 AromaticContact CE1-CG 3.84Å; F302-F304 HydrophobicContact CE1-CG 3.84Å; F302-F304 AromaticContact CE1-CZ 3.64Å; F302-F304 HydrophobicContact CE1-CZ 3.64Å; F302-F304 HydrophobicContact CZ-CD1 4.31Å; F302-F304 HydrophobicContact CZ-CE1 4.32Å
305I95.3Very high94.2Very high32 Ų3241.3 Ų41.316%0.16422%0.216CC..  trans-119.2144.8179.764.6170.3000110.2F240 F256 F258 I303 V352 L354F240-I305 HydrophobicContact CD2-CD1 3.79Å; F240-I305 HydrophobicContact CE2-CD1 3.87Å; F240-I305 HydrophobicContact CE2-CG1 4.17Å; F256-I305 HydrophobicContact CD1-CD1 3.97Å; F256-I305 HydrophobicContact CD1-CG2 4.43Å; F256-I305 HydrophobicContact CE1-CD1 4.38Å; F256-I305 HydrophobicContact CE1-CG2 4.17Å; F258-I305 HydrophobicContact CE1-CD1 3.87Å; F258-I305 HydrophobicContact CZ-CD1 3.68Å; I303-I305 HydrophobicContact CG2-CG2 4.29Å; I303-I305 PolarHBondContact O-N 2.69Å; I305-V352 HydrophobicContact CB-CG1 3.9Å; I305-V352 HydrophobicContact CB-CG2 4.44Å; I305-V352 HydrophobicContact CG2-CG1 3.52Å; I305-L354 HydrophobicContact CG2-CD2 3.93Å
306P95.4Very high94.1Very high54 Ų5441.9 Ų41.935%0.35122%0.218SC..  trans-63.9157172.827-35.8000111.7V308 V350 V352P306-V308 HydrophobicContact CG-CG1 4.44Å; P306-V308 PolarHBondContact O-N 2.82Å; P306-V350 HydrophobicContact CB-CG1 3.71Å; P306-V350 HydrophobicContact CG-CG1 3.38Å; P306-V352 HydrophobicContact CG-CG2 3.91Å
307I94.7Very high93.9Very high129 Ų12942.2 Ų42.266%0.66222%0.222SC*.  trans-70.4119173.9-60.7173.9000108.6F240 M309F240-I307 HydrophobicContact CE1-CG2 4.38Å; I307-M309 HydrophobicContact CG2-CE 4.25Å
308V95.1Very high93.7Very high0 Ų043.5 Ų43.50%023%0.229CC..  trans-120.16.9-178.6-64.80000113.3C237 F240 F258 P306 G310 M311 F333 V350 V352C237-V308 WeakPolarHBondContact CB-O 3.31Å; F240-V308 HydrophobicContact CD1-CG2 4.36Å; F258-V308 HydrophobicContact CD1-CG2 4.23Å; F258-V308 HydrophobicContact CE1-CG2 4.02Å; P306-V308 HydrophobicContact CG-CG1 4.44Å; P306-V308 PolarHBondContact O-N 2.82Å; V308-G310 PolarHBondContact O-N 2.99Å; V308-M311 HydrophobicContact CB-SD 4.11Å; V308-M311 HydrophobicContact CG1-SD 4.09Å; V308-M311 WeakPolarHBondContact O-CB 3.39Å; V308-M311 PolarHBondContact O-N 2.79Å; V308-F333 HydrophobicContact CB-CB 4.4Å; V308-F333 HydrophobicContact CB-CD1 3.81Å; V308-F333 HydrophobicContact CB-CD2 3.97Å; V308-F333 HydrophobicContact CB-CE1 3.93Å; V308-F333 HydrophobicContact CB-CE2 4.12Å; V308-F333 HydrophobicContact CB-CG 3.82Å; V308-F333 HydrophobicContact CB-CZ 4.1Å; V308-F333 HydrophobicContact CG1-CB 4.21Å; V308-F333 HydrophobicContact CG1-CD1 4.31Å; V308-F333 HydrophobicContact CG1-CD2 3.58Å; V308-F333 HydrophobicContact CG1-CE2 3.91Å; V308-F333 HydrophobicContact CG1-CG 3.8Å; V308-F333 HydrophobicContact CG1-CZ 4.4Å; V308-F333 HydrophobicContact CG2-CD1 4.27Å; V308-F333 HydrophobicContact CG2-CD2 4.42Å; V308-F333 HydrophobicContact CG2-CE1 3.85Å; V308-F333 HydrophobicContact CG2-CE2 4.05Å; V308-F333 HydrophobicContact CG2-CZ 3.75Å; V308-V350 HydrophobicContact CG1-CG1 3.87Å; V308-V352 HydrophobicContact CG1-CG2 3.84Å
309M95.2Very high93.6Very high92 Ų9247.3 Ų47.345%0.45325%0.249SC..THydrogen-bonded Turntrans-61.9134.6176.9-63.8-171.3-76.900110.1F240 I307 M311F240-M309 HydrophobicContact CD1-CE 4.5Å; F240-M309 HydrophobicContact CD1-CG 3.47Å; F240-M309 VanDerWaalsContact CD1-CG 3.47Å; F240-M309 HydrophobicContact CD1-SD 4.14Å; F240-M309 HydrophobicContact CE1-CE 4.07Å; F240-M309 HydrophobicContact CE1-CG 3.84Å; F240-M309 HydrophobicContact CE1-SD 4.31Å; I307-M309 HydrophobicContact CG2-CE 4.25Å; M309-M311 VanDerWaalsContact C-N 3.27Å; M309-M311 PolarHBondContact O-N 2.84Å
310G94Very high93.4Very high36 Ų3651.2 Ų51.237%0.37127%0.272SS..THydrogen-bonded Turntrans87.8-18.7-177.300000114.6K236 C237 V308K236-G310 WeakPolarHBondContact CE-O 3.31Å; C237-G310 WeakPolarHBondContact O-CA 3.32Å; C237-G310 PolarHBondContact O-N 2.75Å; V308-G310 PolarHBondContact O-N 2.99Å
311M94.8Very high93.4Very high11 Ų1150 Ų505%0.05427%0.266CS..PPolyproline II helixtrans-78.7159.9-178.6-55.6-177.184.800112.6C237 V308 M309 F333 D335 V350C237-M311 PolarHBondContact N-O 2.94Å; V308-M311 HydrophobicContact CB-SD 4.11Å; V308-M311 HydrophobicContact CG1-SD 4.09Å; V308-M311 WeakPolarHBondContact O-CB 3.39Å; V308-M311 PolarHBondContact O-N 2.79Å; M309-M311 VanDerWaalsContact C-N 3.27Å; M309-M311 PolarHBondContact O-N 2.84Å; M311-F333 HydrophobicContact CB-CB 3.82Å; M311-F333 HydrophobicContact CB-CD1 4.24Å; M311-F333 HydrophobicContact CB-CG 4.48Å; M311-F333 HydrophobicContact CE-CB 3.98Å; M311-F333 HydrophobicContact CG-CB 4.46Å; M311-F333 HydrophobicContact SD-CB 3.73Å; M311-D335 VanDerWaalsContact CE-OD1 3.22Å; M311-D335 WeakPolarHBondContact CE-OD1 3.48Å; M311-V350 HydrophobicContact CE-CB 3.84Å; M311-V350 HydrophobicContact CE-CG2 3.5Å; M311-V350 VanDerWaalsContact CE-CG2 3.5Å; M311-V350 HydrophobicContact SD-CB 4.08Å; M311-V350 HydrophobicContact SD-CG2 4.03Å
312I93.2Very high93.3Very high8 Ų851.3 Ų51.34%0.04128%0.278CS..EExtended strand (participates in β ladder)trans-92.1127.2176.2-55.1-55.4000110.3K236 T314 F333 Q334 P337K236-I312 HydrophobicContact CB-CD1 3.86Å; K236-I312 HydrophobicContact CG-CD1 4.16Å; I312-T314 HydrophobicContact CG2-CG2 4.47Å; I312-F333 CarbonylContact O-C 3.53Å; I312-F333 VanDerWaalsContact O-CA 3.29Å; I312-F333 WeakPolarHBondContact O-CA 3.14Å; I312-Q334 PolarHBondContact N-O 2.93Å; I312-Q334 PolarHBondContact O-N 2.84Å; I312-P337 HydrophobicContact CG1-CB 4.31Å
313F92.7Very high93Very high2 Ų250.9 Ų50.91%0.00928%0.279CS..EExtended strand (participates in β ladder)trans-76.3123.5175.6-173.6-103.5000111.4L232 N234 S235 F260 L315 F316 L331 F333L232-F313 HydrophobicContact CB-CD1 3.52Å; L232-F313 HydrophobicContact CB-CE1 3.52Å; L232-F313 HydrophobicContact CD1-CE1 4.18Å; L232-F313 HydrophobicContact CD1-CZ 4.48Å; L232-F313 WeakPolarHBondContact O-CD1 3.5Å; N234-F313 WeakPolarHBondContact CA-O 3.31Å; N234-F313 PolarHBondContact N-O 2.97Å; S235-F313 WeakPolarHBondContact O-CB 3.47Å; S235-F313 PolarHBondContact O-N 3.36Å; F260-F313 HydrophobicContact CD1-CB 4.1Å; F260-F313 HydrophobicContact CE1-CB 3.68Å; F260-F313 AromaticContact CE1-CD2 3.93Å; F260-F313 HydrophobicContact CE1-CD2 3.93Å; F260-F313 AromaticContact CE1-CG 3.93Å; F260-F313 HydrophobicContact CE1-CG 3.93Å; F260-F313 HydrophobicContact CZ-CB 4.39Å; F260-F313 AromaticContact CZ-CD2 3.83Å; F260-F313 HydrophobicContact CZ-CD2 3.83Å; F260-F313 HydrophobicContact CZ-CE2 4.31Å; F260-F313 HydrophobicContact CZ-CG 4.15Å; F313-L315 VanDerWaalsContact CE2-O 3.3Å; F313-L315 WeakPolarHBondContact CE2-O 3.26Å; F313-L315 VanDerWaalsContact CZ-C 3.5Å; F313-L315 WeakPolarHBondContact CZ-O 3.45Å; F313-F316 HydrophobicContact CE1-CB 3.84Å; F313-F316 HydrophobicContact CZ-CB 3.51Å; F313-F316 HydrophobicContact CZ-CD2 4.5Å; F313-F316 HydrophobicContact CZ-CG 4.06Å; F313-L331 HydrophobicContact CE2-CB 3.86Å; F313-L331 HydrophobicContact CE2-CD2 3.61Å; F313-L331 HydrophobicContact CE2-CG 4.24Å; F313-L331 HydrophobicContact CZ-CD2 3.83Å; F313-F333 HydrophobicContact CD2-CD1 4.29Å; F313-F333 AromaticContact CD2-CE1 3.89Å; F313-F333 HydrophobicContact CD2-CE1 3.89Å; F313-F333 HydrophobicContact CD2-CE2 4.47Å; F313-F333 AromaticContact CD2-CZ 3.98Å; F313-F333 HydrophobicContact CD2-CZ 3.98Å; F313-F333 HydrophobicContact CE2-CZ 4.43Å
314T89.3Confident92.8Very high17 Ų1756.4 Ų56.410%0.10431%0.306CS..EExtended strand (participates in β ladder)trans-118.3-30.9-173.5590000114.1I312 V332 Q334 V338I312-T314 HydrophobicContact CG2-CG2 4.47Å; T314-V332 PolarHBondContact N-O 3.42Å; T314-V332 PolarHBondContact OG1-O 2.85Å; T314-Q334 HydrophobicContact CG2-CB 4.13Å; T314-Q334 HydrophobicContact CG2-CG 3.89Å; T314-V338 HydrophobicContact CG2-CG2 4.15Å
315L89.7Confident92.5Very high41 Ų4157.8 Ų57.822%0.21531%0.306CS..EExtended strand (participates in β ladder)trans-139.6132.3-179.1-17469.4000110.9F313 T317 L331 V332F313-L315 VanDerWaalsContact CE2-O 3.3Å; F313-L315 WeakPolarHBondContact CE2-O 3.26Å; F313-L315 VanDerWaalsContact CZ-C 3.5Å; F313-L315 WeakPolarHBondContact CZ-O 3.45Å; L315-T317 HydrophobicContact CD1-CG2 3.98Å; L315-T317 HydrophobicContact CD2-CG2 4.12Å; L315-T317 HydrophobicContact CG-CG2 4Å; L315-L331 WeakPolarHBondContact O-CA 3.1Å; L315-V332 HydrophobicContact CB-CB 3.81Å; L315-V332 HydrophobicContact CB-CG2 3.83Å; L315-V332 HydrophobicContact CD2-CG2 3.85Å; L315-V332 HydrophobicContact CG-CG2 4.36Å; L315-V332 PolarHBondContact O-N 2.7Å
316F92.3Very high92.3Very high11 Ų1158.8 Ų58.85%0.04831%0.31CS..EExtended strand (participates in β ladder)trans-113138.8160-164.2-171.6000107.2T228 P229 L295 F313 I318 V329 L331 V360T228-F316 HydrophobicContact CG2-CB 3.72Å; T228-F316 HydrophobicContact CG2-CD1 4.03Å; T228-F316 HydrophobicContact CG2-CG 3.92Å; T228-F316 WeakPolarHBondContact CG2-O 3.45Å; P229-F316 HydrophobicContact CB-CD1 4.07Å; P229-F316 HydrophobicContact CB-CE1 4.18Å; P229-F316 HydrophobicContact CG-CD1 4.03Å; P229-F316 HydrophobicContact CG-CE1 3.7Å; L295-F316 HydrophobicContact CD1-CE1 4.13Å; L295-F316 HydrophobicContact CD1-CZ 3.94Å; L295-F316 HydrophobicContact CD2-CZ 4.49Å; F313-F316 HydrophobicContact CE1-CB 3.84Å; F313-F316 HydrophobicContact CZ-CB 3.51Å; F313-F316 HydrophobicContact CZ-CD2 4.5Å; F313-F316 HydrophobicContact CZ-CG 4.06Å; F316-I318 HydrophobicContact CE1-CD1 4.49Å; F316-I318 HydrophobicContact CE2-CG1 4Å; F316-I318 HydrophobicContact CZ-CD1 4.05Å; F316-I318 HydrophobicContact CZ-CG1 4.02Å; F316-V329 HydrophobicContact CD2-CG1 4.36Å; F316-V329 HydrophobicContact CE2-CB 4.49Å; F316-V329 HydrophobicContact CE2-CG1 3.68Å; F316-V329 HydrophobicContact CE2-CG2 4.15Å; F316-L331 HydrophobicContact CD2-CD2 3.39Å; F316-L331 HydrophobicContact CE2-CD2 3.67Å; F316-L331 HydrophobicContact CG-CD2 4.24Å; F316-V360 HydrophobicContact CE1-CG1 4.32Å; F316-V360 HydrophobicContact CZ-CG1 3.64Å
317T92.2Very high92.2Very high30 Ų3059.7 Ų59.718%0.18431%0.309CS..EExtended strand (participates in β ladder)trans-144.8140.3163.754.90000110L315 R330L315-T317 HydrophobicContact CD1-CG2 3.98Å; L315-T317 HydrophobicContact CD2-CG2 4.12Å; L315-T317 HydrophobicContact CG-CG2 4Å; T317-R330 PolarHBondContact N-O 2.8Å; T317-R330 PolarHBondContact O-N 2.79Å; T317-R330 WeakPolarHBondContact OG1-CB 3.24Å
318I93.3Very high92.2Very high27 Ų2757.3 Ų57.314%0.13829%0.292CS..EExtended strand (participates in β ladder)trans-113117.2170.7-51.8178.1000107I224 P225 T228 F316 H327 R328 V329 V360I224-I318 HydrophobicContact CG2-CD1 4.34Å; I224-I318 HydrophobicContact CG2-CG2 4.36Å; P225-I318 HydrophobicContact CG-CD1 3.71Å; T228-I318 PolarHBondContact OG1-N 2.98Å; F316-I318 HydrophobicContact CE1-CD1 4.49Å; F316-I318 HydrophobicContact CE2-CG1 4Å; F316-I318 HydrophobicContact CZ-CD1 4.05Å; F316-I318 HydrophobicContact CZ-CG1 4.02Å; I318-H327 HydrophobicContact CG2-CB 4.18Å; I318-R328 WeakPolarHBondContact CA-O 3.41Å; I318-V329 HydrophobicContact CG1-CG2 4.24Å; I318-V360 HydrophobicContact CD1-CB 4.46Å; I318-V360 HydrophobicContact CD1-CG1 4.18Å; I318-V360 HydrophobicContact CD1-CG2 4.35Å
319N92.2Very high92.2Very high88 Ų8857.3 Ų57.347%0.47129%0.292SS..EExtended strand (participates in β ladder)trans-121173.7178.8-64.1-25.7000109.7H327 R328N319-H327 CarbonylContact O-C 3.54Å; N319-H327 WeakPolarHBondContact O-CA 3.38Å; N319-R328 PolarHBondContact N-O 3.21Å; N319-R328 PolarHBondContact O-N 3.42Å
320V92.3Very high92.2Very high81 Ų8155.1 Ų55.149%0.49128%0.279SS..EExtended strand (participates in β ladder)trans-76.4142168.2-174.70000109.3M324V320-M324 HydrophobicContact CB-SD 4.4Å; V320-M324 HydrophobicContact CG1-CB 4.37Å; V320-M324 HydrophobicContact CG1-CE 4.32Å; V320-M324 HydrophobicContact CG1-SD 3.65Å
321S92.4Very high92.2Very high5 Ų553.4 Ų53.44%0.03526%0.261CS..  trans-66.4164.5173.4-178.20000111.5D323 M324 H326 D355S321-D323 WeakPolarHBondContact CB-OD1 3.27Å; S321-D323 PolarHBondContact O-N 3.15Å; S321-D323 PolarHBondContact OG-OD1 2.82Å; S321-M324 PolarHBondContact O-N 2.86Å; S321-M324 VanDerWaalsContact O-N 3.08Å; S321-H326 VanDerWaalsContact CB-O 3.27Å; S321-H326 WeakPolarHBondContact CB-O 3.2Å; S321-H326 PolarHBondContact N-O 3.15Å; S321-D355 WeakPolarHBondContact CB-OD1 3.4Å; S321-D355 PolarHBondContact OG-OD1 2.87Å; S321-D355 PolarHBondContact OG-OD2 3.21Å; S321-D355 VanDerWaalsContact OG-OD2 3.14Å
322T89.5Confident92.2Very high122 Ų12252.9 Ų52.975%0.74826%0.258SS*.THydrogen-bonded Turntrans-63.2-27.5176.951.50000112.9M324T322-M324 PolarHBondContact O-N 3.17Å
323D89.8Confident92.2Very high67 Ų6752.5 Ų52.536%0.35826%0.256SS..THydrogen-bonded Turntrans-78.2-7.6176.372.81000113.7S321 R325 H326S321-D323 WeakPolarHBondContact CB-OD1 3.27Å; S321-D323 PolarHBondContact O-N 3.15Å; S321-D323 PolarHBondContact OG-OD1 2.82Å; D323-R325 PolarHBondContact O-N 3.19Å; D323-R325 VanDerWaalsContact O-N 3.11Å; D323-R325 PolarHBondContact OD1-N 3.16Å; D323-H326 PolarHBondContact OD1-N 2.77Å; D323-H326 VanDerWaalsContact OD1-N 3.11Å; D323-H326 IonicContact OD1-ND1 3.2Å; D323-H326 IonicContact OD2-CE1 2.79Å; D323-H326 PolarHBondContact OD2-CE1 2.8Å; D323-H326 IonicContact OD2-CG 3.39Å; D323-H326 IonicContact OD2-ND1 3.05Å; D323-H326 PolarHBondContact OD2-ND1 3.45Å
324M89.6Confident92.2Very high147 Ų14753 Ų5372%0.72426%0.259SS*.SBendtrans59.911.8-176.2-56.1-69.6-75.500115.1V320 S321 T322V320-M324 HydrophobicContact CB-SD 4.4Å; V320-M324 HydrophobicContact CG1-CB 4.37Å; V320-M324 HydrophobicContact CG1-CE 4.32Å; V320-M324 HydrophobicContact CG1-SD 3.65Å; S321-M324 PolarHBondContact O-N 2.86Å; S321-M324 VanDerWaalsContact O-N 3.08Å; T322-M324 PolarHBondContact O-N 3.17Å
325R89.5Confident92.1Very high213 Ų21359 Ų5980%0.80429%0.29SS*.SBendtrans-106.2-27.4-179.3-65174.6-176.4-153-0.1112D323D323-R325 PolarHBondContact O-N 3.19Å; D323-R325 VanDerWaalsContact O-N 3.11Å; D323-R325 PolarHBondContact OD1-N 3.16Å
326H90.9Very high91.5Very high54 Ų5460.3 Ų60.325%0.2530%0.303CS..SBendtrans-119.3171-176.4-57.899.8000112.4L300 S321 D323 P356L300-H326 WeakPolarHBondContact CD1-NE2 3.45Å; S321-H326 VanDerWaalsContact CB-O 3.27Å; S321-H326 WeakPolarHBondContact CB-O 3.2Å; S321-H326 PolarHBondContact N-O 3.15Å; D323-H326 PolarHBondContact OD1-N 2.77Å; D323-H326 VanDerWaalsContact OD1-N 3.11Å; D323-H326 IonicContact OD1-ND1 3.2Å; D323-H326 IonicContact OD2-CE1 2.79Å; D323-H326 PolarHBondContact OD2-CE1 2.8Å; D323-H326 IonicContact OD2-CG 3.39Å; D323-H326 IonicContact OD2-ND1 3.05Å; D323-H326 PolarHBondContact OD2-ND1 3.45Å; H326-P356 HydrophobicContact CB-CB 3.47Å; H326-P356 VanDerWaalsContact CB-CB 3.47Å; H326-P356 VanDerWaalsContact CG-CB 3.42Å
327H93Very high90.4Very high73 Ų7361.6 Ų61.634%0.33831%0.313SS..EExtended strand (participates in β ladder)trans-91.4154.3168.1-6777000110.1I224 I318 N319 V357I224-H327 HydrophobicContact CD1-CB 4.25Å; I224-H327 WeakPolarHBondContact CD1-ND1 3.36Å; I318-H327 HydrophobicContact CG2-CB 4.18Å; N319-H327 CarbonylContact O-C 3.54Å; N319-H327 WeakPolarHBondContact O-CA 3.38Å; H327-V357 HydrophobicContact CB-CB 4.2Å; H327-V357 VanDerWaalsContact O-CB 3.28Å; H327-V357 WeakPolarHBondContact O-CB 3.37Å; H327-V357 PolarHBondContact O-N 2.92Å
328R94.7Very high89.2Confident78 Ų7862.6 Ų62.629%0.29432%0.319SS..EExtended strand (participates in β ladder)trans-121124.7172.7173.4175178-175.51.7108.8I318 N319 I353 L354 D355I318-R328 WeakPolarHBondContact CA-O 3.41Å; N319-R328 PolarHBondContact N-O 3.21Å; N319-R328 PolarHBondContact O-N 3.42Å; R328-I353 HydrophobicContact CG-CG2 4.2Å; R328-I353 VanDerWaalsContact NE-CG2 3.31Å; R328-I353 VanDerWaalsContact NH2-CD1 3.34Å; R328-L354 WeakPolarHBondContact CA-O 3.4Å; R328-D355 HydrophobicContact CB-CB 4.29Å; R328-D355 WeakPolarHBondContact CD-OD2 3.34Å; R328-D355 HydrophobicContact CG-CB 4.04Å
329V95.3Very high87.6Confident0 Ų068.1 Ų68.10%034%0.343CS..EExtended strand (participates in β ladder)trans-98.8130.4173.8159.40000109.1V297 F316 I318 L331 I353 L354 V357 V360V297-V329 HydrophobicContact CG1-CB 4.5Å; V297-V329 HydrophobicContact CG1-CG2 4.29Å; V297-V329 HydrophobicContact CG2-CG1 4.42Å; F316-V329 HydrophobicContact CD2-CG1 4.36Å; F316-V329 HydrophobicContact CE2-CB 4.49Å; F316-V329 HydrophobicContact CE2-CG1 3.68Å; F316-V329 HydrophobicContact CE2-CG2 4.15Å; I318-V329 HydrophobicContact CG1-CG2 4.24Å; V329-L331 HydrophobicContact CG1-CD2 3.84Å; V329-L331 HydrophobicContact CG1-CG 3.91Å; V329-I353 WeakPolarHBondContact O-CA 3.28Å; V329-L354 HydrophobicContact CB-CB 4.2Å; V329-L354 HydrophobicContact CG1-CD1 4.34Å; V329-L354 PolarHBondContact N-O 2.9Å; V329-L354 PolarHBondContact O-N 2.86Å; V329-V357 HydrophobicContact CB-CG2 3.95Å; V329-V357 HydrophobicContact CG2-CG1 4.26Å; V329-V357 HydrophobicContact CG2-CG2 3.87Å; V329-V360 HydrophobicContact CG2-CG2 3.59Å
330R94.9Very high85.8Confident46 Ų4667.3 Ų67.317%0.17436%0.356CS..EExtended strand (participates in β ladder)trans-119.9128.9169.6177.9-171.5-172.4-164.62.4109.3T317 E347 Q351 V352 I353T317-R330 PolarHBondContact N-O 2.8Å; T317-R330 PolarHBondContact O-N 2.79Å; T317-R330 WeakPolarHBondContact OG1-CB 3.24Å; R330-E347 IonicContact NH1-OE1 2.69Å; R330-Q351 VanDerWaalsContact NH2-CD 3.29Å; R330-V352 WeakPolarHBondContact CA-O 3.39Å; R330-I353 HydrophobicContact CG-CG1 4.4Å
331L95.1Very high84Confident0 Ų067.3 Ų67.30%037%0.372CS..EExtended strand (participates in β ladder)trans-118.7137.5176.8-53.4176.5000108.1F258 L295 F313 L315 F316 V329 F333 Q351 V352F258-L331 HydrophobicContact CD2-CD1 4.25Å; F258-L331 HydrophobicContact CE1-CD1 4.44Å; F258-L331 HydrophobicContact CE2-CD1 3.88Å; F258-L331 HydrophobicContact CZ-CD1 3.98Å; L295-L331 HydrophobicContact CD2-CD1 4.12Å; L295-L331 HydrophobicContact CD2-CD2 3.78Å; F313-L331 HydrophobicContact CE2-CB 3.86Å; F313-L331 HydrophobicContact CE2-CD2 3.61Å; F313-L331 HydrophobicContact CE2-CG 4.24Å; F313-L331 HydrophobicContact CZ-CD2 3.83Å; L315-L331 WeakPolarHBondContact O-CA 3.1Å; F316-L331 HydrophobicContact CD2-CD2 3.39Å; F316-L331 HydrophobicContact CE2-CD2 3.67Å; F316-L331 HydrophobicContact CG-CD2 4.24Å; V329-L331 HydrophobicContact CG1-CD2 3.84Å; V329-L331 HydrophobicContact CG1-CG 3.91Å; L331-F333 HydrophobicContact CB-CD2 4.38Å; L331-F333 HydrophobicContact CB-CE2 3.56Å; L331-F333 HydrophobicContact CB-CZ 4.17Å; L331-F333 HydrophobicContact CD1-CE2 4.28Å; L331-F333 HydrophobicContact CD1-CZ 4.29Å; L331-Q351 WeakPolarHBondContact O-CA 3.35Å; L331-V352 HydrophobicContact CB-CB 4.13Å; L331-V352 HydrophobicContact CD1-CB 4.43Å; L331-V352 HydrophobicContact CD1-CG1 4.4Å; L331-V352 PolarHBondContact N-O 2.88Å; L331-V352 PolarHBondContact O-N 3.42Å
332V94.1Very high82.3Confident0 Ų077.4 Ų77.40%041%0.41CS..EExtended strand (participates in β ladder)trans-123.5132.7175.9-173.30000110T314 L315 Q351T314-V332 PolarHBondContact N-O 3.42Å; T314-V332 PolarHBondContact OG1-O 2.85Å; L315-V332 HydrophobicContact CB-CB 3.81Å; L315-V332 HydrophobicContact CB-CG2 3.83Å; L315-V332 HydrophobicContact CD2-CG2 3.85Å; L315-V332 HydrophobicContact CG-CG2 4.36Å; L315-V332 PolarHBondContact O-N 2.7Å; V332-Q351 HydrophobicContact CG2-CG 4.36Å
333F94.2Very high80.6Confident0 Ų081.1 Ų81.10%042%0.415CS..EExtended strand (participates in β ladder)trans-123.7147-177.2-61-98.7000111.3C237 F258 F260 V308 M311 I312 F313 L331 G349 V350 V352C237-F333 HydrophobicContact CB-CD1 4.34Å; C237-F333 HydrophobicContact CB-CE1 3.95Å; F258-F333 HydrophobicContact CD1-CZ 4.28Å; F258-F333 HydrophobicContact CE1-CZ 4.42Å; F260-F333 AromaticContact CE1-CE1 3.75Å; F260-F333 HydrophobicContact CE1-CE1 3.75Å; F260-F333 HydrophobicContact CE1-CZ 4.38Å; F260-F333 HydrophobicContact CZ-CE1 4Å; F260-F333 HydrophobicContact CZ-CZ 4.17Å; V308-F333 HydrophobicContact CB-CB 4.4Å; V308-F333 HydrophobicContact CB-CD1 3.81Å; V308-F333 HydrophobicContact CB-CD2 3.97Å; V308-F333 HydrophobicContact CB-CE1 3.93Å; V308-F333 HydrophobicContact CB-CE2 4.12Å; V308-F333 HydrophobicContact CB-CG 3.82Å; V308-F333 HydrophobicContact CB-CZ 4.1Å; V308-F333 HydrophobicContact CG1-CB 4.21Å; V308-F333 HydrophobicContact CG1-CD1 4.31Å; V308-F333 HydrophobicContact CG1-CD2 3.58Å; V308-F333 HydrophobicContact CG1-CE2 3.91Å; V308-F333 HydrophobicContact CG1-CG 3.8Å; V308-F333 HydrophobicContact CG1-CZ 4.4Å; V308-F333 HydrophobicContact CG2-CD1 4.27Å; V308-F333 HydrophobicContact CG2-CD2 4.42Å; V308-F333 HydrophobicContact CG2-CE1 3.85Å; V308-F333 HydrophobicContact CG2-CE2 4.05Å; V308-F333 HydrophobicContact CG2-CZ 3.75Å; M311-F333 HydrophobicContact CB-CB 3.82Å; M311-F333 HydrophobicContact CB-CD1 4.24Å; M311-F333 HydrophobicContact CB-CG 4.48Å; M311-F333 HydrophobicContact CE-CB 3.98Å; M311-F333 HydrophobicContact CG-CB 4.46Å; M311-F333 HydrophobicContact SD-CB 3.73Å; I312-F333 CarbonylContact O-C 3.53Å; I312-F333 VanDerWaalsContact O-CA 3.29Å; I312-F333 WeakPolarHBondContact O-CA 3.14Å; F313-F333 HydrophobicContact CD2-CD1 4.29Å; F313-F333 AromaticContact CD2-CE1 3.89Å; F313-F333 HydrophobicContact CD2-CE1 3.89Å; F313-F333 HydrophobicContact CD2-CE2 4.47Å; F313-F333 AromaticContact CD2-CZ 3.98Å; F313-F333 HydrophobicContact CD2-CZ 3.98Å; F313-F333 HydrophobicContact CE2-CZ 4.43Å; L331-F333 HydrophobicContact CB-CD2 4.38Å; L331-F333 HydrophobicContact CB-CE2 3.56Å; L331-F333 HydrophobicContact CB-CZ 4.17Å; L331-F333 HydrophobicContact CD1-CE2 4.28Å; L331-F333 HydrophobicContact CD1-CZ 4.29Å; F333-G349 CarbonylContact O-C 3.45Å; F333-G349 WeakPolarHBondContact O-CA 3.28Å; F333-V350 HydrophobicContact CB-CB 4.49Å; F333-V350 PolarHBondContact N-O 3.43Å; F333-V350 PolarHBondContact O-N 2.81Å; F333-V352 HydrophobicContact CD2-CG2 4.17Å; F333-V352 HydrophobicContact CE2-CB 4.24Å; F333-V352 HydrophobicContact CE2-CG2 3.76Å
334Q91.6Very high79Confident14 Ų1481.8 Ų81.87%0.06542%0.419CS..EExtended strand (participates in β ladder)trans-135.2148-179.9-68.3176.61.700111.1I312 T314 S336 Q348I312-Q334 PolarHBondContact N-O 2.93Å; I312-Q334 PolarHBondContact O-N 2.84Å; T314-Q334 HydrophobicContact CG2-CB 4.13Å; T314-Q334 HydrophobicContact CG2-CG 3.89Å; Q334-S336 VanDerWaalsContact C-N 3.28Å; Q334-S336 PolarHBondContact O-N 2.91Å; Q334-Q348 PolarHBondContact NE2-O 3.11Å
335D87Confident77.6Confident141 Ų14184.1 Ų84.175%0.75442%0.419SS*.SBendtrans-72.3-22.7-178.4-61.6-45.5000113.3M311M311-D335 VanDerWaalsContact CE-OD1 3.22Å; M311-D335 WeakPolarHBondContact CE-OD1 3.48Å
336S77.3Confident76.1Confident69 Ų6977.4 Ų77.448%0.48341%0.405SS..SBendtrans-127146.8178.9620000111.2Q334Q334-S336 VanDerWaalsContact C-N 3.28Å; Q334-S336 PolarHBondContact O-N 2.91Å
337P70.5Confident74.7Confident39 Ų3980.9 Ų80.925%0.25342%0.421SS..  trans-64.3147173.323.9-27.5000109.5I312 H339I312-P337 HydrophobicContact CG1-CB 4.31Å; P337-H339 PolarHBondContact O-N 2.95Å; P337-H339 PolarHBondContact O-ND1 3.43Å
338V65.6Low73.9Confident51 Ų5182.3 Ų82.331%0.30943%0.428SS..  trans-67.596179.6-176.20000109T314 R342T314-V338 HydrophobicContact CG2-CG2 4.15Å; V338-R342 WeakPolarHBondContact CG1-O 3.21Å
339H60.3Low73.5Confident142 Ų14280.5 Ų80.566%0.65743%0.433SS*.  trans-76.9124.8176.9-6788.1000109.8P337P337-H339 PolarHBondContact O-N 2.95Å; P337-H339 PolarHBondContact O-ND1 3.43Å
340G54.4Low73.5Confident72 Ų7282.9 Ų82.974%0.74245%0.448SS*.SBendtrans86.541.5156.700000117.8R342G340-R342 PolarHBondContact O-N 2.72Å
341G55.3Low73.5Confident80 Ų8084.1 Ų84.183%0.82546%0.456SS*.SBendtrans65.7-13.5162.200000116.8K343G341-K343 PolarHBondContact O-N 2.83Å; G341-K343 VanDerWaalsContact O-N 3.16Å
342R56.5Low73.5Confident218 Ų21884.1 Ų84.182%0.82346%0.456SS*.  trans-67.5112.5167.9-73.4-174.6176.3-157.1-0.9106.6V338 G340 L344V338-R342 WeakPolarHBondContact CG1-O 3.21Å; G340-R342 PolarHBondContact O-N 2.72Å; R342-L344 PolarHBondContact O-N 2.58Å
343K54.3Low73.6Confident200 Ų20087.1 Ų87.187%0.8747%0.471SS*.  trans-59.193.6166.8-68.1179.2-179.7178.70106.6G341 R345G341-K343 PolarHBondContact O-N 2.83Å; G341-K343 VanDerWaalsContact O-N 3.16Å; K343-R345 PolarHBondContact O-N 2.75Å
344L55.8Low73.7Confident81 Ų8187.1 Ų87.142%0.42447%0.471SS..  trans-54.3132.4163.6-166.965.2000105.6R342 S346 Q348R342-L344 PolarHBondContact O-N 2.58Å; L344-S346 PolarHBondContact O-N 2.86Å; L344-Q348 HydrophobicContact CG-CB 4.46Å
345R59.6Low73.9Confident196 Ų19688.4 Ų88.474%0.7448%0.478SS*.  trans-48.6121.1-175.2-72.9-173.7178.4-175.80.9106.9K343 E347 Q348K343-R345 PolarHBondContact O-N 2.75Å; R345-E347 PolarHBondContact O-N 3.43Å; R345-Q348 HydrophobicContact CB-CG 4.26Å; R345-Q348 PolarHBondContact O-N 2.8Å
346S58.4Low74.3Confident71 Ų7182.5 Ų82.550%0.49745%0.447SS..THydrogen-bonded Turntrans-56.8-5-169.9-51.70000114.4L344L344-S346 PolarHBondContact O-N 2.86Å
347E60.8Low75.2Confident128 Ų12879.3 Ų79.360%0.59843%0.425SS*.THydrogen-bonded Turntrans-101.8-10.8-179-50.7-162.9132.800114R330 R345 G349 Q351R330-E347 IonicContact NH1-OE1 2.69Å; R345-E347 PolarHBondContact O-N 3.43Å; E347-G349 PolarHBondContact O-N 3.11Å; E347-Q351 PolarHBondContact O-NE2 2.77Å
348Q76.1Confident76.2Confident103 Ų10380.8 Ų80.848%0.48143%0.428SS..  trans-83.8114.4176.6-70.3178.6-23.500109.6Q334 L344 R345Q334-Q348 PolarHBondContact NE2-O 3.11Å; L344-Q348 HydrophobicContact CG-CB 4.46Å; R345-Q348 HydrophobicContact CB-CG 4.26Å; R345-Q348 PolarHBondContact O-N 2.8Å
349G87.7Confident77.5Confident39 Ų3978.8 Ų78.840%0.40242%0.417SS..SBendtrans151.4172.4179.900000112.3F333 E347 Q351F333-G349 CarbonylContact O-C 3.45Å; F333-G349 WeakPolarHBondContact O-CA 3.28Å; E347-G349 PolarHBondContact O-N 3.11Å; G349-Q351 PolarHBondContact O-N 3.3Å
350V94.1Very high79.1Confident51 Ų5172.2 Ų72.231%0.30939%0.387SS..EExtended strand (participates in β ladder)trans-70.7122.8172.3176.60000108.1P306 V308 M311 F333P306-V350 HydrophobicContact CB-CG1 3.71Å; P306-V350 HydrophobicContact CG-CG1 3.38Å; V308-V350 HydrophobicContact CG1-CG1 3.87Å; M311-V350 HydrophobicContact CE-CB 3.84Å; M311-V350 HydrophobicContact CE-CG2 3.5Å; M311-V350 VanDerWaalsContact CE-CG2 3.5Å; M311-V350 HydrophobicContact SD-CB 4.08Å; M311-V350 HydrophobicContact SD-CG2 4.03Å; F333-V350 HydrophobicContact CB-CB 4.49Å; F333-V350 PolarHBondContact N-O 3.43Å; F333-V350 PolarHBondContact O-N 2.81Å
351Q94.7Very high81Confident72 Ų7273.4 Ų73.434%0.33637%0.369SS..EExtended strand (participates in β ladder)trans-101.2133.2-178-56.9-171.74300110.4R330 L331 V332 E347 G349R330-Q351 VanDerWaalsContact NH2-CD 3.29Å; L331-Q351 WeakPolarHBondContact O-CA 3.35Å; V332-Q351 HydrophobicContact CG2-CG 4.36Å; E347-Q351 PolarHBondContact O-NE2 2.77Å; G349-Q351 PolarHBondContact O-N 3.3Å
352V96Very high82.8Confident0 Ų072.2 Ų72.20%034%0.343CS..EExtended strand (participates in β ladder)trans-113.3120.21681780000107.4F258 I305 P306 V308 R330 L331 F333 L354F258-V352 HydrophobicContact CZ-CG1 4.35Å; I305-V352 HydrophobicContact CB-CG1 3.9Å; I305-V352 HydrophobicContact CB-CG2 4.44Å; I305-V352 HydrophobicContact CG2-CG1 3.52Å; P306-V352 HydrophobicContact CG-CG2 3.91Å; V308-V352 HydrophobicContact CG1-CG2 3.84Å; R330-V352 WeakPolarHBondContact CA-O 3.39Å; L331-V352 HydrophobicContact CB-CB 4.13Å; L331-V352 HydrophobicContact CD1-CB 4.43Å; L331-V352 HydrophobicContact CD1-CG1 4.4Å; L331-V352 PolarHBondContact N-O 2.88Å; L331-V352 PolarHBondContact O-N 3.42Å; F333-V352 HydrophobicContact CD2-CG2 4.17Å; F333-V352 HydrophobicContact CE2-CB 4.24Å; F333-V352 HydrophobicContact CE2-CG2 3.76Å; V352-L354 HydrophobicContact CG1-CD2 4.29Å; V352-L354 HydrophobicContact CG1-CG 4.25Å
353I96Very high84.5Confident63 Ų6362.3 Ų62.332%0.32331%0.306SS..EExtended strand (participates in β ladder)trans-113.1124.6178.2-65.7157.8000107.6R328 V329 R330 D355R328-I353 HydrophobicContact CG-CG2 4.2Å; R328-I353 VanDerWaalsContact NE-CG2 3.31Å; R328-I353 VanDerWaalsContact NH2-CD1 3.34Å; V329-I353 WeakPolarHBondContact O-CA 3.28Å; R330-I353 HydrophobicContact CG-CG1 4.4Å; I353-D355 HydrophobicContact CG2-CB 4.45Å
354L96.7Very high86.3Confident0 Ų055.3 Ų55.30%028%0.279CS..EExtended strand (participates in β ladder)trans-116.1119.1175.1-58.9173.3000107.8F256 F258 V297 T299 I303 I305 R328 V329 V352 V357F256-L354 HydrophobicContact CB-CD1 4.17Å; F256-L354 HydrophobicContact CD1-CD2 4.18Å; F256-L354 HydrophobicContact CD2-CD2 4.05Å; F256-L354 HydrophobicContact CE1-CD2 4.34Å; F256-L354 HydrophobicContact CE2-CD2 4.24Å; F256-L354 HydrophobicContact CG-CD1 4.35Å; F256-L354 HydrophobicContact CG-CD2 4.03Å; F256-L354 HydrophobicContact CZ-CD2 4.37Å; F258-L354 HydrophobicContact CE2-CD1 4.38Å; V297-L354 HydrophobicContact CB-CD1 3.64Å; V297-L354 HydrophobicContact CG1-CB 4.3Å; V297-L354 HydrophobicContact CG1-CD1 3.56Å; V297-L354 HydrophobicContact CG2-CD1 4Å; T299-L354 HydrophobicContact CG2-CB 3.94Å; I303-L354 HydrophobicContact CB-CD2 4.26Å; I303-L354 HydrophobicContact CD1-CB 4.31Å; I303-L354 HydrophobicContact CD1-CD2 4.09Å; I303-L354 HydrophobicContact CG2-CD2 4.33Å; I305-L354 HydrophobicContact CG2-CD2 3.93Å; R328-L354 WeakPolarHBondContact CA-O 3.4Å; V329-L354 HydrophobicContact CB-CB 4.2Å; V329-L354 HydrophobicContact CG1-CD1 4.34Å; V329-L354 PolarHBondContact N-O 2.9Å; V329-L354 PolarHBondContact O-N 2.86Å; V352-L354 HydrophobicContact CG1-CD2 4.29Å; V352-L354 HydrophobicContact CG1-CG 4.25Å; L354-V357 HydrophobicContact CB-CG2 4.01Å; L354-V357 WeakPolarHBondContact O-CG2 3.39Å
355D95.7Very high88.1Confident40 Ų4052.7 Ų52.721%0.21426%0.263CS..EExtended strand (participates in β ladder)trans-161.3123.6-174.4-166.1-5.6000108.5I303 S321 R328 I353I303-D355 VanDerWaalsContact CD1-N 3.27Å; I303-D355 WeakPolarHBondContact CD1-O 3.32Å; S321-D355 WeakPolarHBondContact CB-OD1 3.4Å; S321-D355 PolarHBondContact OG-OD1 2.87Å; S321-D355 PolarHBondContact OG-OD2 3.21Å; S321-D355 VanDerWaalsContact OG-OD2 3.14Å; R328-D355 HydrophobicContact CB-CB 4.29Å; R328-D355 WeakPolarHBondContact CD-OD2 3.34Å; R328-D355 HydrophobicContact CG-CB 4.04Å; I353-D355 HydrophobicContact CG2-CB 4.45Å
356P95Very high89.7Confident17 Ų1746.4 Ų46.411%0.1124%0.239CC..EExtended strand (participates in β ladder)cis-85.2134.81.832.7-34.8000113.5T299 L300 H326T299-P356 WeakPolarHBondContact CA-O 3.48Å; T299-P356 VanDerWaalsContact CB-O 3.27Å; T299-P356 WeakPolarHBondContact CB-O 3.48Å; L300-P356 HydrophobicContact CB-CG 3.89Å; L300-P356 HydrophobicContact CD1-CB 4.26Å; L300-P356 HydrophobicContact CD1-CG 3.86Å; L300-P356 HydrophobicContact CG-CG 4.01Å; L300-P356 PolarHBondContact N-O 2.9Å; L300-P356 VanDerWaalsContact N-O 3.15Å; H326-P356 HydrophobicContact CB-CB 3.47Å; H326-P356 VanDerWaalsContact CB-CB 3.47Å; H326-P356 VanDerWaalsContact CG-CB 3.42Å
357V94.9Very high91.4Very high2 Ų243.3 Ų43.31%0.01222%0.217CC..EExtended strand (participates in β ladder)trans-92.8128.7177.91780000110.8V297 T299 H327 V329 L354 V360V297-V357 HydrophobicContact CG1-CG1 3.78Å; V297-V357 HydrophobicContact CG1-CG2 3.92Å; T299-V357 HydrophobicContact CG2-CG2 4.22Å; H327-V357 HydrophobicContact CB-CB 4.2Å; H327-V357 VanDerWaalsContact O-CB 3.28Å; H327-V357 WeakPolarHBondContact O-CB 3.37Å; H327-V357 PolarHBondContact O-N 2.92Å; V329-V357 HydrophobicContact CB-CG2 3.95Å; V329-V357 HydrophobicContact CG2-CG1 4.26Å; V329-V357 HydrophobicContact CG2-CG2 3.87Å; L354-V357 HydrophobicContact CB-CG2 4.01Å; L354-V357 WeakPolarHBondContact O-CG2 3.39Å; V357-V360 HydrophobicContact CG1-CG2 3.63Å
358H91.8Very high92.9Very high70 Ų7038.6 Ų38.632%0.32420%0.197SC..EExtended strand (participates in β ladder)trans-89.5-42.3172.9175.7-88.6000112.2R249 T298 L300R249-H358 PolarHBondContact NH1-CD2 3.06Å; R249-H358 PolarHBondContact NH1-NE2 2.79Å; R249-H358 PolarHBondContact NH2-NE2 2.84Å; T298-H358 HydrophobicContact CG2-CB 4.38Å; T298-H358 PolarHBondContact O-N 2.81Å; L300-H358 HydrophobicContact CD2-CB 4.22Å
359S93.4Very high93.6Very high10 Ų1038.7 Ų38.77%0.0720%0.198CC..EExtended strand (participates in β ladder)trans-154.7153.8179.9520000113A223 V297 T298A223-S359 CarbonylContact O-C 3.56Å; A223-S359 WeakPolarHBondContact O-CA 3.19Å; A223-S359 VanDerWaalsContact O-CB 3.31Å; A223-S359 WeakPolarHBondContact O-CB 3.44Å; V297-S359 WeakPolarHBondContact CA-O 3.42Å; T298-S359 WeakPolarHBondContact CB-OG 3.18Å; T298-S359 PolarHBondContact N-O 3.14Å; T298-S359 PolarHBondContact O-N 2.85Å; T298-S359 PolarHBondContact OG1-OG 3.4Å
360V94.9Very high93.8Very high4 Ų437 Ų372%0.02418%0.179CC..EExtended strand (participates in β ladder)trans-133.7119.4179.1177.70000108.4A223 P225 L295 V297 F316 I318 V329 V357A223-V360 CarbonylContact O-C 3.53Å; A223-V360 PolarHBondContact O-N 3.46Å; P225-V360 WeakPolarHBondContact CD-O 3.3Å; P225-V360 HydrophobicContact CG-CG1 4.33Å; L295-V360 HydrophobicContact CD1-CG1 4.07Å; V297-V360 HydrophobicContact CG1-CG2 4.37Å; F316-V360 HydrophobicContact CE1-CG1 4.32Å; F316-V360 HydrophobicContact CZ-CG1 3.64Å; I318-V360 HydrophobicContact CD1-CB 4.46Å; I318-V360 HydrophobicContact CD1-CG1 4.18Å; I318-V360 HydrophobicContact CD1-CG2 4.35Å; V329-V360 HydrophobicContact CG2-CG2 3.59Å; V357-V360 HydrophobicContact CG1-CG2 3.63Å
361R93.3Very high93.7Very high96 Ų9637.2 Ų37.236%0.36218%0.182SC..EExtended strand (participates in β ladder)trans-126.5140.6178.4-60.5-176.9-178.9-150.5-3.4110.6Q296 F363Q296-R361 HydrophobicContact CB-CB 4.4Å; Q296-R361 PolarHBondContact N-O 2.79Å; Q296-R361 PolarHBondContact O-N 3.31Å; R361-F363 HydrophobicContact CB-CE1 3.8Å; R361-F363 HydrophobicContact CB-CE2 4.12Å; R361-F363 HydrophobicContact CB-CZ 3.57Å; R361-F363 HydrophobicContact CG-CE1 4.47Å; R361-F363 HydrophobicContact CG-CZ 4.21Å
362L92.7Very high93.2Very high56 Ų5636.3 Ų36.329%0.29318%0.177SC..EExtended strand (participates in β ladder)trans-119.5119.7173.2-179.863.1000108.6P229 T231 L232 C293 L294P229-L362 HydrophobicContact CB-CD2 4.03Å; T231-L362 VanDerWaalsContact OG1-CD2 3.31Å; T231-L362 WeakPolarHBondContact OG1-CD2 3.4Å; L232-L362 HydrophobicContact CD1-CD1 4.06Å; L232-L362 HydrophobicContact CD2-CD1 3.84Å; L232-L362 HydrophobicContact CG-CD1 4.12Å; L232-L362 HydrophobicContact CG-CD2 4.41Å; C293-L362 HydrophobicContact CB-CD1 4.17Å; L294-L362 WeakPolarHBondContact O-CA 3.31Å
363F92.4Very high92.2Very high9 Ų937.4 Ų37.44%0.03919%0.185CC..EExtended strand (participates in β ladder)trans-112.4126.5179.5-52.1-54.6000110.4C293 L294 Q296 R361 H367 Q369 Y370C293-F363 CarbonylContact C-O 3.43Å; C293-F363 WeakPolarHBondContact CA-O 3.18Å; C293-F363 WeakPolarHBondContact CB-O 3.38Å; L294-F363 HydrophobicContact CB-CB 4.35Å; L294-F363 HydrophobicContact CB-CD2 4.34Å; L294-F363 HydrophobicContact CD2-CD2 4.08Å; L294-F363 HydrophobicContact CG-CD2 4.32Å; L294-F363 PolarHBondContact N-O 3.08Å; L294-F363 PolarHBondContact O-N 2.83Å; Q296-F363 HydrophobicContact CB-CE2 4.02Å; R361-F363 HydrophobicContact CB-CE1 3.8Å; R361-F363 HydrophobicContact CB-CE2 4.12Å; R361-F363 HydrophobicContact CB-CZ 3.57Å; R361-F363 HydrophobicContact CG-CE1 4.47Å; R361-F363 HydrophobicContact CG-CZ 4.21Å; F363-H367 HydrophobicContact CB-CB 3.87Å; F363-H367 HydrophobicContact CD1-CB 4.37Å; F363-H367 AromaticContact CD1-CD2 3.84Å; F363-H367 AromaticContact CD1-CE1 3.28Å; F363-H367 WeakPolarHBondContact CD1-CE1 3.29Å; F363-H367 AromaticContact CD1-CG 3.6Å; F363-H367 AromaticContact CD1-ND1 3.22Å; F363-H367 WeakPolarHBondContact CD1-ND1 3.48Å; F363-H367 AromaticContact CD1-NE2 3.65Å; F363-H367 AromaticContact CE1-CE1 3.3Å; F363-H367 WeakPolarHBondContact CE1-CE1 3.45Å; F363-H367 AromaticContact CE1-ND1 3.65Å; F363-H367 AromaticContact CE1-NE2 3.84Å; F363-H367 HydrophobicContact CG-CB 4.43Å; F363-H367 AromaticContact CG-ND1 3.76Å; F363-Q369 HydrophobicContact CE1-CB 4.29Å; F363-Q369 HydrophobicContact CE2-CB 4.16Å; F363-Q369 HydrophobicContact CZ-CB 3.99Å; F363-Y370 HydrophobicContact CB-CD2 4.26Å
364D92.4Very high90.9Very high54 Ų5442 Ų4229%0.28921%0.209SC..EExtended strand (participates in β ladder)trans-71.7161.5162.1-71.1-52.4000110.3K262 W366 H367K262-D364 IonicContact NZ-OD1 3.9Å; K262-D364 PolarHBondContact NZ-OD1 3.31Å; D364-W366 HydrophobicContact CB-CD2 4.29Å; D364-W366 HydrophobicContact CB-CG 4.45Å; D364-W366 HydrophobicContact CB-CZ2 4.02Å; D364-W366 PolarHBondContact O-N 3.49Å; D364-H367 VanDerWaalsContact O-CB 3.23Å; D364-H367 WeakPolarHBondContact O-CB 3.34Å; D364-H367 PolarHBondContact O-N 3.45Å
365W93.7Very high89.2Confident25 Ų2551.1 Ų51.110%0.09524%0.243CC..THydrogen-bonded Turntrans-56-23.5-175.668.4-96.3000115A201 I204 R205 D289 C292A201-W365 HydrophobicContact CB-CH2 4.17Å; A201-W365 HydrophobicContact CB-CZ3 3.72Å; I204-W365 HydrophobicContact CB-CH2 4.17Å; I204-W365 HydrophobicContact CD1-CH2 4.02Å; I204-W365 HydrophobicContact CG2-CH2 3.96Å; I204-W365 HydrophobicContact CG2-CZ3 4.49Å; R205-W365 HydrophobicContact CG-CE3 4.45Å; R205-W365 HydrophobicContact CG-CZ3 4.21Å; R205-W365 PolarHBondContact NH1-O 2.87Å; D289-W365 HydrophobicContact CB-CB 3.86Å; D289-W365 VanDerWaalsContact O-CB 3.26Å; D289-W365 WeakPolarHBondContact O-CB 3.27Å; C292-W365 PolarHBondContact O-N 3.39Å
366W93.3Very high87.2Confident64 Ų6451.6 Ų51.624%0.24225%0.252CS..THydrogen-bonded Turntrans-85.4-9.2-179.849.8-102.7000113.4I204 R205 Y208 I218 D364I204-W366 HydrophobicContact CG2-CB 3.81Å; R205-W366 HydrophobicContact CG-CB 4.42Å; Y208-W366 AromaticContact CD1-CE3 3.84Å; Y208-W366 HydrophobicContact CD1-CE3 3.84Å; Y208-W366 AromaticContact CD1-CZ3 3.67Å; Y208-W366 HydrophobicContact CD1-CZ3 3.67Å; Y208-W366 HydrophobicContact CD2-CB 4.37Å; Y208-W366 HydrophobicContact CD2-CD2 4.25Å; Y208-W366 AromaticContact CD2-CE3 3.54Å; Y208-W366 HydrophobicContact CD2-CE3 3.54Å; Y208-W366 HydrophobicContact CD2-CZ3 4.24Å; Y208-W366 HydrophobicContact CE1-CD2 4.45Å; Y208-W366 AromaticContact CE1-CE3 3.49Å; Y208-W366 HydrophobicContact CE1-CE3 3.49Å; Y208-W366 VanDerWaalsContact CE1-CE3 3.49Å; Y208-W366 AromaticContact CE1-CH2 3.91Å; Y208-W366 HydrophobicContact CE1-CH2 3.91Å; Y208-W366 AromaticContact CE1-CZ3 3.17Å; Y208-W366 HydrophobicContact CE1-CZ3 3.17Å; Y208-W366 HydrophobicContact CE2-CB 4.14Å; Y208-W366 AromaticContact CE2-CD2 3.61Å; Y208-W366 HydrophobicContact CE2-CD2 3.61Å; Y208-W366 AromaticContact CE2-CE3 3.19Å; Y208-W366 HydrophobicContact CE2-CE3 3.19Å; Y208-W366 HydrophobicContact CE2-CG 4.03Å; Y208-W366 AromaticContact CE2-CZ3 3.84Å; Y208-W366 HydrophobicContact CE2-CZ3 3.84Å; Y208-W366 AromaticContact CG-CE3 3.85Å; Y208-W366 HydrophobicContact CG-CE3 3.85Å; Y208-W366 HydrophobicContact CG-CZ3 4.17Å; Y208-W366 AromaticContact CZ-CD2 3.71Å; Y208-W366 AromaticContact CZ-CE3 3.15Å; Y208-W366 AromaticContact CZ-CH2 3.89Å; Y208-W366 AromaticContact CZ-CZ3 3.26Å; I218-W366 HydrophobicContact CD1-CZ3 4.49Å; D364-W366 HydrophobicContact CB-CD2 4.29Å; D364-W366 HydrophobicContact CB-CG 4.45Å; D364-W366 HydrophobicContact CB-CZ2 4.02Å; D364-W366 PolarHBondContact O-N 3.49Å
367H93.5Very high86.8Confident6 Ų653.3 Ų53.33%0.02826%0.26CS..SBendtrans-67.3139.6-175-170.7-91.1000111.4I218 F363 D364 Q369 Y370I218-H367 WeakPolarHBondContact CG2-NE2 3.45Å; F363-H367 HydrophobicContact CB-CB 3.87Å; F363-H367 HydrophobicContact CD1-CB 4.37Å; F363-H367 AromaticContact CD1-CD2 3.84Å; F363-H367 AromaticContact CD1-CE1 3.28Å; F363-H367 WeakPolarHBondContact CD1-CE1 3.29Å; F363-H367 AromaticContact CD1-CG 3.6Å; F363-H367 AromaticContact CD1-ND1 3.22Å; F363-H367 WeakPolarHBondContact CD1-ND1 3.48Å; F363-H367 AromaticContact CD1-NE2 3.65Å; F363-H367 AromaticContact CE1-CE1 3.3Å; F363-H367 WeakPolarHBondContact CE1-CE1 3.45Å; F363-H367 AromaticContact CE1-ND1 3.65Å; F363-H367 AromaticContact CE1-NE2 3.84Å; F363-H367 HydrophobicContact CG-CB 4.43Å; F363-H367 AromaticContact CG-ND1 3.76Å; D364-H367 VanDerWaalsContact O-CB 3.23Å; D364-H367 WeakPolarHBondContact O-CB 3.34Å; D364-H367 PolarHBondContact O-N 3.45Å; H367-Q369 VanDerWaalsContact C-N 3.25Å; H367-Q369 WeakPolarHBondContact ND1-CB 3.03Å; H367-Q369 PolarHBondContact ND1-N 2.73Å; H367-Q369 PolarHBondContact O-N 2.89Å; H367-Q369 VanDerWaalsContact O-N 3.16Å; H367-Y370 WeakPolarHBondContact O-CB 3.42Å; H367-Y370 PolarHBondContact O-N 2.85Å
368P92.1Very high86.4Confident29 Ų2956 Ų5619%0.18827%0.273CS..THydrogen-bonded Turntrans-52.2-37.2178.5-34.440.4000115.2I218 Y370I218-P368 HydrophobicContact CD1-CG 3.67Å; P368-Y370 VanDerWaalsContact C-N 3.32Å
369Q91.3Very high86.1Confident105 Ų10555.2 Ų55.249%0.49127%0.27SS..THydrogen-bonded Turntrans-83.2-4.5179.3-56.9-174.2-51.500113.7F363 H367F363-Q369 HydrophobicContact CE1-CB 4.29Å; F363-Q369 HydrophobicContact CE2-CB 4.16Å; F363-Q369 HydrophobicContact CZ-CB 3.99Å; H367-Q369 VanDerWaalsContact C-N 3.25Å; H367-Q369 WeakPolarHBondContact ND1-CB 3.03Å; H367-Q369 PolarHBondContact ND1-N 2.73Å; H367-Q369 PolarHBondContact O-N 2.89Å; H367-Q369 VanDerWaalsContact O-N 3.16Å
370Y92.9Very high85.7Confident3 Ų357.9 Ų57.91%0.01228%0.281CS..SBendtrans-73.3130.9176.5-170.5-80.6000109.8R205 K259 D289 C292 L294 F363 H367 P368R205-Y370 PolarHBondContact NH1-O 3.2Å; R205-Y370 PolarHBondContact NH2-O 2.98Å; K259-Y370 WeakPolarHBondContact CD-OH 3.43Å; K259-Y370 WeakPolarHBondContact CE-OH 3.23Å; K259-Y370 PolarHBondContact NZ-OH 3.43Å; D289-Y370 HydrophobicContact CB-CE1 4.21Å; C292-Y370 WeakPolarHBondContact CB-OH 3.22Å; L294-Y370 HydrophobicContact CB-CD2 3.68Å; L294-Y370 HydrophobicContact CB-CE2 3.61Å; F363-Y370 HydrophobicContact CB-CD2 4.26Å; H367-Y370 WeakPolarHBondContact O-CB 3.42Å; H367-Y370 PolarHBondContact O-N 2.85Å; P368-Y370 VanDerWaalsContact C-N 3.32Å
371P90.4Very high85.1Confident56 Ų5661.3 Ų61.336%0.36430%0.298SS..PPolyproline II helixtrans-69.5144.5-177.328.5-34.9000112.1W241 L294W241-P371 HydrophobicContact CH2-CG 4.12Å; W241-P371 HydrophobicContact CZ2-CG 4.2Å; L294-P371 VanDerWaalsContact CD2-CD 3.46Å; L294-P371 HydrophobicContact CD2-CG 4.14Å
372F84.5Confident84.6Confident54 Ų5458.9 Ų58.924%0.23729%0.293CS..PPolyproline II helixtrans-72.9131.4176.3-68-90.3000111.3P185 R187 L188 R205P185-F372 HydrophobicContact CB-CE2 3.69Å; P185-F372 HydrophobicContact CB-CZ 4.1Å; P185-F372 HydrophobicContact CG-CE2 3.95Å; P185-F372 HydrophobicContact CG-CZ 4.27Å; R187-F372 HydrophobicContact CB-CD1 4.11Å; R187-F372 HydrophobicContact CB-CE1 4.08Å; R187-F372 HydrophobicContact CB-CG 4.48Å; R187-F372 HydrophobicContact CB-CZ 4.44Å; L188-F372 HydrophobicContact CD1-CE1 4.31Å; L188-F372 HydrophobicContact CD1-CZ 3.7Å; L188-F372 HydrophobicContact CD2-CE1 3.66Å; L188-F372 HydrophobicContact CD2-CZ 3.87Å; L188-F372 HydrophobicContact CG-CE1 3.85Å; L188-F372 HydrophobicContact CG-CZ 3.51Å; R205-F372 VanDerWaalsContact NE-CE1 3.26Å
373S75.7Confident84Confident23 Ų2359.1 Ų59.116%0.16129%0.293CS..PPolyproline II helixtrans-63.6135.7169.3-179.80000111R187 D289 R375 A376R187-S373 PolarHBondContact NH1-O 3.17Å; D289-S373 VanDerWaalsContact OD2-CB 3.31Å; D289-S373 WeakPolarHBondContact OD2-CB 3.42Å; S373-R375 PolarHBondContact O-N 3.31Å; S373-R375 VanDerWaalsContact O-N 3.09Å; S373-R375 PolarHBondContact OG-N 2.99Å; S373-A376 WeakPolarHBondContact O-CB 3.18Å; S373-A376 PolarHBondContact O-N 2.69Å; S373-A376 VanDerWaalsContact O-N 3.07Å
374L67.9Low83.3Confident158 Ų15863 Ų6383%0.82731%0.313SS*.THydrogen-bonded Turntrans-58.4-22.5173.9-68.4176000113.1
375R61.5Low82.6Confident193 Ų19363.8 Ų63.873%0.72832%0.315SS*.THydrogen-bonded Turntrans-85.9-3179.7-63.7-174.6-177.2179.7-0.3114.1R197 S373R197-R375 PolarHBondContact NH1-O 2.96Å; R197-R375 PolarHBondContact NH2-O 2.81Å; S373-R375 PolarHBondContact O-N 3.31Å; S373-R375 VanDerWaalsContact O-N 3.09Å; S373-R375 PolarHBondContact OG-N 2.99Å
376A54.4Low81.6Confident49 Ų4967.3 Ų67.341%0.40534%0.335SS..  trans-78.80179.700000111.6C198 P288 S373C198-A376 PolarHBondContact SG-OXT 3.16Å; P288-A376 HydrophobicContact CG-CB 4.05Å; S373-A376 WeakPolarHBondContact O-CB 3.18Å; S373-A376 PolarHBondContact O-N 2.69Å; S373-A376 VanDerWaalsContact O-N 3.07Å

Retrieved 376 of 376 residues in 178.8 ms (Link to these results)