A0A087XPH5_POEFO Loading...

Transcription factor 15

AlphaFold DB , UniProt , Accession A0A087XPH5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 180 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M50.1Low54.7Low226 Ų226154.1 Ų154.1100%1.11385%0.846SS**  0103.50-70.8168.916400107.7F3M1-F3 HydrophobicContact CB-CE2 4.43Å
2T45.2Very low54.6Low146 Ų146154.1 Ų154.190%0.89684%0.835SS**  trans-89.9113.2-178.447.20000109.3
3F49.1Very low54.8Low194 Ų194155.7 Ų155.785%0.85184%0.841SS**  trans-87.5115.7175.2-80.7-89.2000109.7M1M1-F3 HydrophobicContact CB-CE2 4.43Å
4A58Low54.8Low83 Ų83154.1 Ų154.169%0.68683%0.83SS**  trans-66.7127.2175.300000110.5L6A4-L6 HydrophobicContact CB-CD1 4.37Å; A4-L6 PolarHBondContact O-N 3.32Å; A4-L6 VanDerWaalsContact O-N 3.15Å
5M58.8Low53.6Low189 Ų189156.6 Ų156.693%0.93183%0.825SS**  trans-72.597.3169.6-70.3-74.5-130.700109.2R7M5-R7 PolarHBondContact O-N 3.04Å
6L60.2Low53.6Low158 Ų158153.8 Ų153.883%0.82782%0.822SS**PPolyproline II helixtrans-76120.9164.3-97.171.4000108.9A4A4-L6 HydrophobicContact CB-CD1 4.37Å; A4-L6 PolarHBondContact O-N 3.32Å; A4-L6 VanDerWaalsContact O-N 3.15Å
7R59.8Low53.2Low230 Ų230153.5 Ų153.587%0.86882%0.82SS**PPolyproline II helixtrans-58.6138.7174.3-79.8-179.7145.595.2-1.8111.2M5 V9M5-R7 PolarHBondContact O-N 3.04Å; R7-V9 PolarHBondContact O-N 3.41Å
8P56.2Low52.6Low128 Ų128155.2 Ų155.283%0.83182%0.82SS**PPolyproline II helixtrans-72122.3164.1-7.924.4000109.3
9V53.5Low52.6Low123 Ų123153.9 Ų153.975%0.74582%0.819SS**PPolyproline II helixtrans-72.8122.6164.1162.70000107.5R7 T11R7-V9 PolarHBondContact O-N 3.41Å; V9-T11 HydrophobicContact CG1-CG2 4.42Å; V9-T11 PolarHBondContact O-N 3.34Å; V9-T11 VanDerWaalsContact O-N 3.16Å
10A53.7Low52.2Low105 Ų105153.2 Ų153.287%0.86882%0.82SS**  trans-64.4111.4174.300000109.6
11T56.7Low51.6Low113 Ų113151.4 Ų151.469%0.69382%0.815SS**  trans-109139.4166.551.30000109.1V9V9-T11 HydrophobicContact CG1-CG2 4.42Å; V9-T11 PolarHBondContact O-N 3.34Å; V9-T11 VanDerWaalsContact O-N 3.16Å
12H53.7Low51.4Low154 Ų154148.5 Ų148.571%0.71380%0.804SS**  trans94.364.3169.7-76.6-90.3000118.6I14H12-I14 PolarHBondContact O-N 2.78Å
13L56.9Low51.4Low175 Ų175145.9 Ų145.992%0.91679%0.791SS**  trans-66.869.3132.5-77167.1000110.7
14I55.7Low51.7Low133 Ų133145.4 Ų145.468%0.68279%0.792SS**  trans-152.375.2161.6-50.8-176000108.6H12H12-I14 PolarHBondContact O-N 2.78Å
15Y36.4Very low51.2Low192 Ų192148 Ų14875%0.75379%0.794SS**  trans-178.479141-154.6-101.1000109F18Y15-F18 HydrophobicContact CE1-CB 4.14Å
16S54.2Low51Low111 Ų111146.9 Ų146.978%0.77679%0.792SS**  trans-99.3101.7161.5-61.50000105.9
17D46Very low50.6Low149 Ų149146.8 Ų146.880%0.79779%0.787SS**SBendtrans165.551149.5-88.2-35.3000115.5
18F43Very low50.3Low184 Ų184142.3 Ų142.381%0.80778%0.781SS**SBendtrans-150.536.4158.5-156.8-101.3000114.8Y15Y15-F18 HydrophobicContact CE1-CB 4.14Å
19T52.7Low49.8Very low131 Ų131145.7 Ų145.780%0.80478%0.777SS**  trans-137.3131.217254.40000109.1
20V43.2Very low49.8Very low139 Ų139144.9 Ų144.984%0.84278%0.777SS**  trans9593.5-167.1-174.50000109.7
21T41.4Very low49.6Very low116 Ų116146.9 Ų146.971%0.71277%0.768SS**  -146.4101.155.953.40000112
22N45.1Very low49.3Very low166 Ų166147.5 Ų147.589%0.88878%0.777SS**  trans-9289.3149-89.22.2000105.3
23S45.1Very low48.9Very low90 Ų90147.1 Ų147.163%0.62978%0.781SS**  trans-85.8115.516353.90000107.4D25S23-D25 PolarHBondContact O-N 3.17Å
24E55.5Low48.4Very low184 Ų184142.3 Ų142.386%0.8677%0.773SS**  trans-72.6110.5170.9-57.9165.6125.200107.1
25D48.2Very low48.1Very low137 Ų137141.3 Ų141.373%0.73378%0.778SS**  trans-129.495.3168.2-70.6-61000108.8S23 E27S23-D25 PolarHBondContact O-N 3.17Å; D25-E27 PolarHBondContact O-N 2.92Å
26D53.5Low48.7Very low167 Ų167137 Ų13789%0.89378%0.776SS**  trans-87.379.1175.9-134.4-56.1000108.2
27E53.2Low48Very low155 Ų155140.1 Ų140.172%0.72478%0.778SS**  trans-100.495.5177.8-75.3-80.9116.500110.6D25 R29D25-E27 PolarHBondContact O-N 2.92Å; E27-R29 PolarHBondContact O-N 3.26Å; E27-R29 VanDerWaalsContact O-N 3.12Å
28N52.7Low48.1Very low137 Ų137142.4 Ų142.473%0.73378%0.784SS**  trans-54.9103.6163168.156.7000111
29R45.6Very low48.2Very low198 Ų198138.1 Ų138.175%0.74778%0.777SS**  trans-10889.6165.8-76.7-174.3175.2-161.52.7110.9E27 E31E27-R29 PolarHBondContact O-N 3.26Å; E27-R29 VanDerWaalsContact O-N 3.12Å; R29-E31 WeakPolarHBondContact CD-OE1 3.27Å; R29-E31 IonicContact NE-OE1 3.99Å
30S53.4Low47.6Very low107 Ų107142.9 Ų142.975%0.74878%0.782SS**  trans-88.6106.3152.8-73.90000108.3
31E49.5Very low47.2Very low146 Ų146142.4 Ų142.468%0.68278%0.783SS**  trans-131.5107.3165.345.8-157.3121.400108.7R29R29-E31 WeakPolarHBondContact CD-OE1 3.27Å; R29-E31 IonicContact NE-OE1 3.99Å
32S49.9Very low47.3Very low127 Ų127140.4 Ų140.489%0.88879%0.785SS**  trans-84.6113.4168.2175.50000106.8
33D45.4Very low47.1Very low146 Ų146137.8 Ų137.878%0.78178%0.78SS**  trans-110.3113.1160.9178.9-4.7000107.7
34G46.8Very low47.4Very low73 Ų73140 Ų14075%0.75379%0.79SS**  trans-94.4117164.500000109.1
35S49.1Very low47.3Very low112 Ų112140.2 Ų140.278%0.78379%0.791SS**  trans-120.9109.6157.4-162.60000110
36S49.3Very low47.3Very low102 Ų102143.4 Ų143.471%0.71380%0.799SS**  trans-55.5152.7148.5-128.10000107.8
37E40.5Very low47.4Very low176 Ų176145.1 Ų145.182%0.82279%0.792SS**  cis-160.7144.525.8-54.6-174104.500108
38Q46.8Very low47.6Very low197 Ų197148.7 Ų148.792%0.92180%0.799SS**  trans-165.2106.3133.1-156110.660.600109.4
39S44.7Very low47.7Very low94 Ų94151.9 Ų151.966%0.65780%0.801SS**  trans-59.3135.9170.3171.60000112
40Y40Very low48.4Very low232 Ų232149.2 Ų149.291%0.9180%0.8SS**  -168.6101.5120.6-93.8-74.4000108.8
41C36.4Very low48.1Very low128 Ų128149.8 Ų149.887%0.86580%0.802SS**  trans-146.2105.9155.556.30000109.9
42G42.9Very low48.6Very low74 Ų74154.3 Ų154.376%0.76381%0.812SS**  trans-80.5123.5163.900000109.3
43S40.9Very low48.6Very low112 Ų112157.1 Ų157.178%0.78381%0.809SS**  trans177.6112.8137.4-81.30000110.9
44T51.3Low49Very low137 Ų137157.9 Ų157.984%0.8481%0.812SS**  trans43.112214356.30000120.4
45E52.6Low49.4Very low188 Ų188161.9 Ų161.988%0.87981%0.811SS**  trans-48.2134.7171.3-58.9166.9118.700113.9
46K49.4Very low49.8Very low204 Ų204159.1 Ų159.189%0.88780%0.8SS**  trans-16398.2136.8-104.7158.1-166.8178.40110.9R48K46-R48 PolarHBondContact O-N 3.01Å
47R54.9Low50.4Low202 Ų202160.4 Ų160.476%0.76280%0.799SS**  trans-61.8102.9171-171.6-178-166.3-132.911.9110.4R49R47-R49 VanDerWaalsContact NH2-NH2 3.1Å
48R57.6Low51.9Low231 Ų231155.1 Ų155.187%0.87278%0.782SS**  trans-121.3103.2154.7-71.9-170.9179.6178.20.7108.1K46 I50K46-R48 PolarHBondContact O-N 3.01Å; R48-I50 PolarHBondContact O-N 3.22Å; R48-I50 VanDerWaalsContact O-N 3.15Å
49R54.5Low53.4Low203 Ų203148.7 Ų148.777%0.76676%0.762SS**  trans-67.8105175.4-72.3-176.2170.7-176.4-5.3108.5R47R47-R49 VanDerWaalsContact NH2-NH2 3.1Å
50I60.6Low55.1Low143 Ų143148.7 Ų148.773%0.73376%0.758SS**  trans-80.6130.4169-58.3169.8000107.4R48 R52R48-I50 PolarHBondContact O-N 3.22Å; R48-I50 VanDerWaalsContact O-N 3.15Å; I50-R52 PolarHBondContact O-N 3.18Å
51P48Very low57.2Low119 Ų119141.4 Ų141.477%0.77374%0.737SS**  trans-67.2106.2177.1-10.424.9000109.8K53P51-K53 VanDerWaalsContact C-N 3.3Å; P51-K53 PolarHBondContact O-N 3.24Å
52R58.1Low59.6Low241 Ų241139.5 Ų139.591%0.90972%0.717SS**  trans-77.175.8173.3-66.7-171.8-175.2-158.41.9110.4I50I50-R52 PolarHBondContact O-N 3.18Å
53K51.4Low61.7Low186 Ų186143.6 Ų143.681%0.80971%0.714SS**  trans-146.242.7175.5-146.2-173.9-179.8-163.50114.5P51P51-K53 VanDerWaalsContact C-N 3.3Å; P51-K53 PolarHBondContact O-N 3.24Å
54L53.8Low64Low162 Ų162144.5 Ų144.585%0.84871%0.705SS**SBendtrans-155.28.7164.6-100120.2000114.3
55E55Low66.1Low156 Ų156145 Ų14573%0.72969%0.692SS**Hα-helixtrans-92-18.3-174.8-67.7-80131.700113.7A59E55-A59 WeakPolarHBondContact O-CB 3.25Å; E55-A59 PolarHBondContact O-N 3.22Å
56G57.8Low68.2Low54 Ų54139 Ų13956%0.55767%0.67SS**Hα-helixtrans-71.1-38.1-174.600000113.7V60G56-V60 VanDerWaalsContact O-CG2 3.31Å; G56-V60 WeakPolarHBondContact O-CG2 3.27Å; G56-V60 PolarHBondContact O-N 3.05Å
57D62.1Low70.3Confident130 Ų130131 Ų13170%0.69564%0.643SS**Hα-helixtrans-72.7-41-177.9-156.934.3000111.2A59 V60 V61D57-A59 PolarHBondContact O-N 3.16Å; D57-V60 PolarHBondContact O-N 2.97Å; D57-V61 VanDerWaalsContact O-CG2 3.24Å; D57-V61 WeakPolarHBondContact O-CG2 3.49Å; D57-V61 PolarHBondContact O-N 3.18Å
58S72.1Confident72.3Confident65 Ų65123.2 Ų123.246%0.45562%0.621SS.*Hα-helixtrans-63.2-42.2174.7-170.70000112.1V60 V61 M62S58-V60 PolarHBondContact O-N 3.44Å; S58-V61 PolarHBondContact O-N 3.34Å; S58-M62 WeakPolarHBondContact O-CB 3.45Å; S58-M62 WeakPolarHBondContact O-CG 3.45Å; S58-M62 PolarHBondContact O-N 3.15Å
59A77.6Confident74.2Confident62 Ų62116 Ų11651%0.51260%0.6SS.*Hα-helixtrans-65.2-39.3178.600000113.1E55 D57 M62 K63E55-A59 WeakPolarHBondContact O-CB 3.25Å; E55-A59 PolarHBondContact O-N 3.22Å; D57-A59 PolarHBondContact O-N 3.16Å; A59-M62 PolarHBondContact O-N 3.38Å; A59-K63 PolarHBondContact O-N 3.47Å
60V80Confident76.3Confident94 Ų94108.6 Ų108.657%0.5758%0.583SS**Hα-helixtrans-65.7-45.7175.5173.30000110.7G56 D57 S58 M62 K63 Q64G56-V60 VanDerWaalsContact O-CG2 3.31Å; G56-V60 WeakPolarHBondContact O-CG2 3.27Å; G56-V60 PolarHBondContact O-N 3.05Å; D57-V60 PolarHBondContact O-N 2.97Å; S58-V60 PolarHBondContact O-N 3.44Å; V60-M62 VanDerWaalsContact C-N 3.32Å; V60-M62 PolarHBondContact O-N 3.35Å; V60-K63 PolarHBondContact O-N 3.26Å; V60-Q64 PolarHBondContact O-N 2.97Å
61V84.5Confident78Confident78 Ų78109.5 Ų109.547%0.47358%0.577SS.*Hα-helixtrans-60.5-40.6175.4172.50000111.3D57 S58 Q64 R65D57-V61 VanDerWaalsContact O-CG2 3.24Å; D57-V61 WeakPolarHBondContact O-CG2 3.49Å; D57-V61 PolarHBondContact O-N 3.18Å; S58-V61 PolarHBondContact O-N 3.34Å; V61-Q64 PolarHBondContact O-N 3.1Å; V61-R65 WeakPolarHBondContact O-CB 3.42Å; V61-R65 PolarHBondContact O-N 3.4Å
62M86.6Confident80.4Confident88 Ų88108 Ų10843%0.43356%0.559SS.*Hα-helixtrans-64.3-40.7176.1-70.1-67.2175.700112.6S58 A59 V60 R65 S66S58-M62 WeakPolarHBondContact O-CB 3.45Å; S58-M62 WeakPolarHBondContact O-CG 3.45Å; S58-M62 PolarHBondContact O-N 3.15Å; A59-M62 PolarHBondContact O-N 3.38Å; V60-M62 VanDerWaalsContact C-N 3.32Å; V60-M62 PolarHBondContact O-N 3.35Å; M62-R65 PolarHBondContact O-N 3.16Å; M62-R65 PolarHBondContact SD-NH2 3.43Å; M62-S66 WeakPolarHBondContact O-CB 3.28Å; M62-S66 PolarHBondContact O-N 3.47Å; M62-S66 PolarHBondContact O-OG 3.44Å
63K86.9Confident82.4Confident161 Ų161104.1 Ų104.170%0.755%0.545SS*.Hα-helixtrans-67.9-39.4175.9-172.4178.4179.9-177.80111.9A59 V60 S66 A67A59-K63 PolarHBondContact O-N 3.47Å; V60-K63 PolarHBondContact O-N 3.26Å; K63-S66 PolarHBondContact O-N 2.81Å; K63-S66 PolarHBondContact O-OG 3.14Å; K63-A67 WeakPolarHBondContact O-CB 3.27Å; K63-A67 PolarHBondContact O-N 2.94Å
64Q90.3Very high84.6Confident131 Ų13197.3 Ų97.361%0.61253%0.528SS*.Hα-helixtrans-65.1-41.9175-171.4178.36.400111.3V60 V61 A67 A68V60-Q64 PolarHBondContact O-N 2.97Å; V61-Q64 PolarHBondContact O-N 3.1Å; Q64-A67 PolarHBondContact O-N 3.33Å; Q64-A68 WeakPolarHBondContact O-CB 3.42Å; Q64-A68 PolarHBondContact O-N 3.34Å
65R95.3Very high86.7Confident146 Ų14696.3 Ų96.355%0.55151%0.513SS*.Hα-helixtrans-63.4-43.3174.9-172.2178.170.3172.65.9111.9V61 M62 A68 N69V61-R65 WeakPolarHBondContact O-CB 3.42Å; V61-R65 PolarHBondContact O-N 3.4Å; M62-R65 PolarHBondContact O-N 3.16Å; M62-R65 PolarHBondContact SD-NH2 3.43Å; R65-A68 PolarHBondContact O-N 2.98Å; R65-N69 WeakPolarHBondContact O-CB 3.44Å; R65-N69 PolarHBondContact O-N 3.29Å; R65-N69 PolarHBondContact O-OD1 3.19Å
66S95Very high88.8Confident62 Ų6291.3 Ų91.343%0.43449%0.493SS..Hα-helixtrans-65.3-40.3177.971.20000111.8M62 K63 N69 A70M62-S66 WeakPolarHBondContact O-CB 3.28Å; M62-S66 PolarHBondContact O-N 3.47Å; M62-S66 PolarHBondContact O-OG 3.44Å; K63-S66 PolarHBondContact O-N 2.81Å; K63-S66 PolarHBondContact O-OG 3.14Å; S66-N69 PolarHBondContact O-N 3.04Å; S66-A70 WeakPolarHBondContact O-CB 3.47Å; S66-A70 PolarHBondContact O-N 3.12Å
67A94.6Very high90.7Very high38 Ų3894.4 Ų94.431%0.31449%0.493SS..Hα-helixtrans-63.3-43173.600000112K63 Q64 A70 R71K63-A67 WeakPolarHBondContact O-CB 3.27Å; K63-A67 PolarHBondContact O-N 2.94Å; Q64-A67 PolarHBondContact O-N 3.33Å; A67-A70 PolarHBondContact O-N 3.35Å; A67-R71 WeakPolarHBondContact O-CG 3.48Å; A67-R71 PolarHBondContact O-N 3.28Å
68A96.3Very high92.5Very high37 Ų3792.1 Ų92.131%0.30649%0.487SS..Hα-helixtrans-61.5-45174.400000112Q64 R65 A70 R71 E72Q64-A68 WeakPolarHBondContact O-CB 3.42Å; Q64-A68 PolarHBondContact O-N 3.34Å; R65-A68 PolarHBondContact O-N 2.98Å; A68-A70 VanDerWaalsContact C-N 3.3Å; A68-A70 PolarHBondContact O-N 2.93Å; A68-R71 PolarHBondContact O-N 3.49Å; A68-E72 PolarHBondContact O-N 3.27Å
69N98.1Very high93.7Very high79 Ų7991.9 Ų91.942%0.42248%0.483SS..Hα-helixtrans-63.2-36.1176.4-70.2-10.1000112.2R65 S66 E72 R73R65-N69 WeakPolarHBondContact O-CB 3.44Å; R65-N69 PolarHBondContact O-N 3.29Å; R65-N69 PolarHBondContact O-OD1 3.19Å; S66-N69 PolarHBondContact O-N 3.04Å; N69-E72 PolarHBondContact O-N 3.35Å; N69-R73 WeakPolarHBondContact O-CG 3.44Å; N69-R73 PolarHBondContact O-N 3.18Å
70A97.6Very high94.7Very high49 Ų4991.2 Ų91.241%0.40547%0.471SS..Hα-helixtrans-64.5-44175.200000111.6S66 A67 A68 E72 R73 G74S66-A70 WeakPolarHBondContact O-CB 3.47Å; S66-A70 PolarHBondContact O-N 3.12Å; A67-A70 PolarHBondContact O-N 3.35Å; A68-A70 VanDerWaalsContact C-N 3.3Å; A68-A70 PolarHBondContact O-N 2.93Å; A70-E72 PolarHBondContact O-N 3.17Å; A70-R73 PolarHBondContact O-N 3.43Å; A70-G74 PolarHBondContact O-N 3.26Å
71R98.1Very high95.5Very high162 Ų16290.6 Ų90.661%0.61147%0.467SS*.Hα-helixtrans-60.7-44.2174.6-68.8-173.3-63.7-99.34.7112A67 A68 R73 G74 R75A67-R71 WeakPolarHBondContact O-CG 3.48Å; A67-R71 PolarHBondContact O-N 3.28Å; A68-R71 PolarHBondContact O-N 3.49Å; R71-R73 VanDerWaalsContact C-N 3.33Å; R71-R73 PolarHBondContact O-N 2.97Å; R71-G74 WeakPolarHBondContact O-CA 3.4Å; R71-G74 PolarHBondContact O-N 3.1Å; R71-G74 VanDerWaalsContact O-N 3.11Å; R71-R75 PolarHBondContact O-N 3.05Å
72E98.3Very high96.2Very high86 Ų8689.9 Ų89.940%0.40247%0.469SS..Hα-helixtrans-65.5-36.3179.6178.453-157.800112.7A68 N69 A70 R75 T76A68-E72 PolarHBondContact O-N 3.27Å; N69-E72 PolarHBondContact O-N 3.35Å; A70-E72 PolarHBondContact O-N 3.17Å; E72-R75 PolarHBondContact O-N 3.1Å; E72-R75 IonicContact OE1-CZ 3.39Å; E72-R75 IonicContact OE1-NE 3.32Å; E72-R75 PolarHBondContact OE1-NE 3.48Å; E72-R75 IonicContact OE1-NH2 2.66Å; E72-R75 PolarHBondContact OE1-NH2 3.01Å; E72-R75 IonicContact OE2-CZ 3.64Å; E72-R75 IonicContact OE2-NE 2.78Å; E72-R75 PolarHBondContact OE2-NE 3.39Å; E72-R75 IonicContact OE2-NH2 3.64Å; E72-T76 WeakPolarHBondContact O-CB 3.17Å; E72-T76 PolarHBondContact O-N 3.24Å; E72-T76 PolarHBondContact O-OG1 3.36Å; E72-T76 PolarHBondContact OE1-OG1 3.42Å
73R98.4Very high96.7Very high160 Ų16087.3 Ų87.360%0.60446%0.456SS*.Hα-helixtrans-61.3-43.9169.9-76.5-171.9-68.3-983111.7N69 A70 R71 T76 Q77N69-R73 WeakPolarHBondContact O-CG 3.44Å; N69-R73 PolarHBondContact O-N 3.18Å; A70-R73 PolarHBondContact O-N 3.43Å; R71-R73 VanDerWaalsContact C-N 3.33Å; R71-R73 PolarHBondContact O-N 2.97Å; R73-T76 PolarHBondContact O-N 3.49Å; R73-Q77 WeakPolarHBondContact O-CB 3.26Å; R73-Q77 PolarHBondContact O-N 3.3Å
74G98.4Very high97.2Very high44 Ų4483.4 Ų83.445%0.45445%0.446SS..Hα-helixtrans-60-45.4175.500000112.7A70 R71 T76 Q77 S78A70-G74 PolarHBondContact O-N 3.26Å; R71-G74 WeakPolarHBondContact O-CA 3.4Å; R71-G74 PolarHBondContact O-N 3.1Å; R71-G74 VanDerWaalsContact O-N 3.11Å; G74-T76 PolarHBondContact O-N 3.03Å; G74-Q77 PolarHBondContact O-N 2.97Å; G74-S78 PolarHBondContact O-N 3.42Å
75R98.5Very high97.5Very high140 Ų14079.8 Ų79.853%0.52844%0.438SS..Hα-helixtrans-59.2-46.8174.9-166.9-166.869.676.41.3111.6R71 E72 Q77 S78 V79R71-R75 PolarHBondContact O-N 3.05Å; E72-R75 PolarHBondContact O-N 3.1Å; E72-R75 IonicContact OE1-CZ 3.39Å; E72-R75 IonicContact OE1-NE 3.32Å; E72-R75 PolarHBondContact OE1-NE 3.48Å; E72-R75 IonicContact OE1-NH2 2.66Å; E72-R75 PolarHBondContact OE1-NH2 3.01Å; E72-R75 IonicContact OE2-CZ 3.64Å; E72-R75 IonicContact OE2-NE 2.78Å; E72-R75 PolarHBondContact OE2-NE 3.39Å; E72-R75 IonicContact OE2-NH2 3.64Å; R75-Q77 VanDerWaalsContact C-N 3.34Å; R75-Q77 PolarHBondContact O-N 3.47Å; R75-S78 WeakPolarHBondContact O-CB 3.49Å; R75-S78 PolarHBondContact O-N 3.48Å; R75-V79 WeakPolarHBondContact O-CG2 2.96Å; R75-V79 PolarHBondContact O-N 3.31Å; R75-V79 VanDerWaalsContact O-N 3.16Å
76T98.4Very high97.5Very high52 Ų5275.4 Ų75.432%0.31943%0.425SS..Hα-helixtrans-64.8-38.2178.3-62.90000111.9E72 R73 G74 V79 N80E72-T76 WeakPolarHBondContact O-CB 3.17Å; E72-T76 PolarHBondContact O-N 3.24Å; E72-T76 PolarHBondContact O-OG1 3.36Å; E72-T76 PolarHBondContact OE1-OG1 3.42Å; R73-T76 PolarHBondContact O-N 3.49Å; G74-T76 PolarHBondContact O-N 3.03Å; T76-V79 PolarHBondContact O-N 3.47Å; T76-N80 VanDerWaalsContact O-CG 3.28Å; T76-N80 PolarHBondContact O-N 3.37Å; T76-N80 PolarHBondContact O-ND2 3.15Å
77Q98.4Very high97.5Very high119 Ų11975.7 Ų75.756%0.55642%0.417SS*.Hα-helixtrans-62.8-44.6175.7-175.661.320.500111.3R73 G74 R75 V79 N80 T81R73-Q77 WeakPolarHBondContact O-CB 3.26Å; R73-Q77 PolarHBondContact O-N 3.3Å; G74-Q77 PolarHBondContact O-N 2.97Å; R75-Q77 VanDerWaalsContact C-N 3.34Å; R75-Q77 PolarHBondContact O-N 3.47Å; Q77-V79 VanDerWaalsContact C-N 3.34Å; Q77-V79 PolarHBondContact O-N 3.11Å; Q77-N80 PolarHBondContact O-N 3.42Å; Q77-N80 VanDerWaalsContact O-N 3.14Å; Q77-T81 PolarHBondContact O-N 3.39Å; Q77-T81 PolarHBondContact O-OG1 3.47Å; Q77-T81 VanDerWaalsContact O-OG1 3.07Å
78S98.4Very high97.4Very high82 Ų8279.3 Ų79.357%0.57344%0.435SS*.Hα-helixtrans-56.3-46.8174.9176.90000112G74 R75 N80 T81 A82G74-S78 PolarHBondContact O-N 3.42Å; R75-S78 WeakPolarHBondContact O-CB 3.49Å; R75-S78 PolarHBondContact O-N 3.48Å; S78-N80 VanDerWaalsContact C-N 3.35Å; S78-N80 PolarHBondContact O-N 3.14Å; S78-T81 PolarHBondContact O-N 3.2Å; S78-A82 PolarHBondContact O-N 3.03Å
79V98.3Very high97.3Very high59 Ų5983.3 Ų83.336%0.35845%0.45SS..Hα-helixtrans-61.2-42.6175.8173.80000111.7R75 T76 Q77 A82 F83R75-V79 WeakPolarHBondContact O-CG2 2.96Å; R75-V79 PolarHBondContact O-N 3.31Å; R75-V79 VanDerWaalsContact O-N 3.16Å; T76-V79 PolarHBondContact O-N 3.47Å; Q77-V79 VanDerWaalsContact C-N 3.34Å; Q77-V79 PolarHBondContact O-N 3.11Å; V79-A82 PolarHBondContact O-N 2.91Å; V79-F83 HydrophobicContact CG1-CD2 3.97Å; V79-F83 HydrophobicContact CG1-CE2 4.22Å; V79-F83 PolarHBondContact O-N 3.42Å
80N98Very high97.1Very high49 Ų4980 Ų8026%0.26243%0.433SS..Hα-helixtrans-67-37.1179.3-70.5-27.8000112T76 Q77 S78 F83 T84 K101T76-N80 VanDerWaalsContact O-CG 3.28Å; T76-N80 PolarHBondContact O-N 3.37Å; T76-N80 PolarHBondContact O-ND2 3.15Å; Q77-N80 PolarHBondContact O-N 3.42Å; Q77-N80 VanDerWaalsContact O-N 3.14Å; S78-N80 VanDerWaalsContact C-N 3.35Å; S78-N80 PolarHBondContact O-N 3.14Å; N80-F83 WeakPolarHBondContact O-CB 3.42Å; N80-F83 PolarHBondContact O-N 2.85Å; N80-T84 PolarHBondContact O-N 2.99Å; N80-T84 PolarHBondContact O-OG1 3.36Å; N80-T84 VanDerWaalsContact O-OG1 3.11Å; N80-K101 PolarHBondContact OD1-NZ 2.83Å; N80-K101 VanDerWaalsContact OD1-NZ 3.11Å
81T98.1Very high96.6Very high81 Ų8179.6 Ų79.650%0.49743%0.426SS..Hα-helixtrans-60.7-46.8173.2-59.10000111Q77 S78 F83 T84 A85Q77-T81 PolarHBondContact O-N 3.39Å; Q77-T81 PolarHBondContact O-OG1 3.47Å; Q77-T81 VanDerWaalsContact O-OG1 3.07Å; S78-T81 PolarHBondContact O-N 3.2Å; T81-F83 VanDerWaalsContact C-N 3.33Å; T81-F83 PolarHBondContact O-N 3.13Å; T81-T84 PolarHBondContact O-N 3.15Å; T81-T84 VanDerWaalsContact O-N 3.12Å; T81-A85 PolarHBondContact O-N 3.21Å
82A98.1Very high96.1Very high62 Ų6272.4 Ų72.451%0.51240%0.4SS..Hα-helixtrans-60.9-40.5175.200000112.3S78 V79 T84 A85 L86S78-A82 PolarHBondContact O-N 3.03Å; V79-A82 PolarHBondContact O-N 2.91Å; A82-T84 VanDerWaalsContact C-N 3.32Å; A82-T84 PolarHBondContact O-N 3.21Å; A82-A85 PolarHBondContact O-N 3.28Å; A82-L86 WeakPolarHBondContact O-CB 3.33Å; A82-L86 PolarHBondContact O-N 3.34Å
83F97.9Very high95.4Very high34 Ų3472.8 Ų72.815%0.14940%0.402CS..Hα-helixtrans-62-37.5173.8-103.7-81.8000112.6V79 N80 T81 L86 R87 K101 T104 L105V79-F83 HydrophobicContact CG1-CD2 3.97Å; V79-F83 HydrophobicContact CG1-CE2 4.22Å; V79-F83 PolarHBondContact O-N 3.42Å; N80-F83 WeakPolarHBondContact O-CB 3.42Å; N80-F83 PolarHBondContact O-N 2.85Å; T81-F83 VanDerWaalsContact C-N 3.33Å; T81-F83 PolarHBondContact O-N 3.13Å; F83-L86 PolarHBondContact O-N 3.02Å; F83-R87 WeakPolarHBondContact O-CG 3.35Å; F83-R87 PolarHBondContact O-N 3.22Å; F83-R87 VanDerWaalsContact O-N 3.13Å; F83-R87 PolarHBondContact O-NH1 3.29Å; F83-K101 HydrophobicContact CD1-CB 4.49Å; F83-K101 HydrophobicContact CD1-CG 4.2Å; F83-K101 HydrophobicContact CE1-CB 3.88Å; F83-K101 HydrophobicContact CE1-CG 4.02Å; F83-K101 HydrophobicContact CZ-CB 4.18Å; F83-K101 HydrophobicContact CZ-CG 4.3Å; F83-T104 HydrophobicContact CD1-CG2 4.16Å; F83-T104 HydrophobicContact CE1-CG2 4.39Å; F83-L105 HydrophobicContact CE1-CD2 4.12Å; F83-L105 HydrophobicContact CE1-CG 4.09Å; F83-L105 HydrophobicContact CZ-CD1 4.22Å; F83-L105 HydrophobicContact CZ-CD2 3.98Å; F83-L105 HydrophobicContact CZ-CG 4.08Å
84T96.1Very high94.6Very high80 Ų8068.4 Ų68.449%0.49139%0.394SS..Hα-helixtrans-68-44.3176.6-60.10000111.3N80 T81 A82 L86 R87 T88N80-T84 PolarHBondContact O-N 2.99Å; N80-T84 PolarHBondContact O-OG1 3.36Å; N80-T84 VanDerWaalsContact O-OG1 3.11Å; T81-T84 PolarHBondContact O-N 3.15Å; T81-T84 VanDerWaalsContact O-N 3.12Å; A82-T84 VanDerWaalsContact C-N 3.32Å; A82-T84 PolarHBondContact O-N 3.21Å; T84-L86 VanDerWaalsContact C-N 3.31Å; T84-L86 PolarHBondContact O-N 2.04Å; T84-R87 WeakPolarHBondContact O-CB 3.38Å; T84-R87 PolarHBondContact O-N 3.18Å; T84-R87 VanDerWaalsContact O-N 3.15Å; T84-T88 PolarHBondContact O-N 3.44Å
85A96.4Very high93.6Very high54 Ų5472.6 Ų72.645%0.44641%0.411SS..Hα-helixtrans-60.2-40.1173.500000112T81 A82 R87 T88T81-A85 PolarHBondContact O-N 3.21Å; A82-A85 PolarHBondContact O-N 3.28Å; A85-R87 VanDerWaalsContact C-N 3.31Å; A85-R87 PolarHBondContact O-N 2.83Å; A85-T88 PolarHBondContact O-N 3.39Å; A85-T88 PolarHBondContact O-OG1 3.22Å
86L96.3Very high92.7Very high54 Ų5471.8 Ų71.828%0.28342%0.417SS..Hα-helixtrans-61.4-39.4175.6-178.458.5000112A82 F83 T84 T88 L89 I90 T104 L105 A108A82-L86 WeakPolarHBondContact O-CB 3.33Å; A82-L86 PolarHBondContact O-N 3.34Å; F83-L86 PolarHBondContact O-N 3.02Å; T84-L86 VanDerWaalsContact C-N 3.31Å; T84-L86 PolarHBondContact O-N 2.04Å; L86-T88 VanDerWaalsContact C-N 3.31Å; L86-T88 PolarHBondContact O-N 3.21Å; L86-L89 PolarHBondContact O-N 3.42Å; L86-I90 HydrophobicContact CG-CD1 4.39Å; L86-I90 WeakPolarHBondContact O-CG1 3.46Å; L86-T104 HydrophobicContact CB-CG2 4.29Å; L86-T104 HydrophobicContact CD2-CG2 3.7Å; L86-T104 HydrophobicContact CG-CG2 3.78Å; L86-L105 HydrophobicContact CD2-CD2 4.5Å; L86-A108 HydrophobicContact CD1-CB 4.03Å; L86-A108 HydrophobicContact CD2-CB 4.24Å; L86-A108 HydrophobicContact CG-CB 4.42Å
87R95Very high92.2Very high69 Ų6971.9 Ų71.926%0.2641%0.411SS..Hα-helixtrans-62.3-36.6178.6-72.2-178.8-16694.4-2.6112.9F83 T84 A85 L89 I90 L99 T104F83-R87 WeakPolarHBondContact O-CG 3.35Å; F83-R87 PolarHBondContact O-N 3.22Å; F83-R87 VanDerWaalsContact O-N 3.13Å; F83-R87 PolarHBondContact O-NH1 3.29Å; T84-R87 WeakPolarHBondContact O-CB 3.38Å; T84-R87 PolarHBondContact O-N 3.18Å; T84-R87 VanDerWaalsContact O-N 3.15Å; A85-R87 VanDerWaalsContact C-N 3.31Å; A85-R87 PolarHBondContact O-N 2.83Å; R87-L89 PolarHBondContact O-N 3.05Å; R87-I90 PolarHBondContact O-N 3.27Å; R87-L99 HydrophobicContact CG-CB 4.37Å; R87-L99 PolarHBondContact NE-O 3.13Å; R87-T104 HydrophobicContact CG-CG2 3.84Å
88T93Very high91.7Very high113 Ų11375.7 Ų75.769%0.69343%0.426SS*.Hα-helixtrans-69.5-18.5-179.2630000112.8T84 A85 L86T84-T88 PolarHBondContact O-N 3.44Å; A85-T88 PolarHBondContact O-N 3.39Å; A85-T88 PolarHBondContact O-OG1 3.22Å; L86-T88 VanDerWaalsContact C-N 3.31Å; L86-T88 PolarHBondContact O-N 3.21Å
89L93.7Very high91.3Very high121 Ų12172.3 Ų72.363%0.63440%0.401SS*.THydrogen-bonded Turntrans-89.9-11.5177.2-60.1175.8000113L86 R87 P91L86-L89 PolarHBondContact O-N 3.42Å; R87-L89 PolarHBondContact O-N 3.05Å; L89-P91 WeakPolarHBondContact O-CD 3.12Å
90I92.5Very high91.1Very high10 Ų1071.8 Ų71.85%0.05140%0.4CS..SBendtrans-88.9119-178.1-64.8170.1000109.3L86 R87 T92 L99 T104 L107 A108L86-I90 HydrophobicContact CG-CD1 4.39Å; L86-I90 WeakPolarHBondContact O-CG1 3.46Å; R87-I90 PolarHBondContact O-N 3.27Å; I90-T92 HydrophobicContact CG2-CG2 4.09Å; I90-T92 PolarHBondContact O-N 3.04Å; I90-L99 HydrophobicContact CB-CD1 4.24Å; I90-L99 HydrophobicContact CD1-CD1 4.04Å; I90-L99 HydrophobicContact CG2-CD1 3.99Å; I90-T104 HydrophobicContact CD1-CG2 3.59Å; I90-T104 WeakPolarHBondContact CD1-O 3.39Å; I90-L107 HydrophobicContact CD1-CB 4.25Å; I90-L107 HydrophobicContact CG2-CB 3.78Å; I90-L107 HydrophobicContact CG2-CD1 4.04Å; I90-A108 HydrophobicContact CD1-CB 4.2Å
91P89Confident90.9Very high40 Ų4074.4 Ų74.426%0.2641%0.409SS..  trans-70.3117.2178.5-20.835000112.5L89 Y111 C150 T151L89-P91 WeakPolarHBondContact O-CD 3.12Å; P91-Y111 HydrophobicContact CG-CD2 4.38Å; P91-Y111 HydrophobicContact CG-CE1 4.14Å; P91-Y111 HydrophobicContact CG-CE2 3.91Å; P91-C150 WeakPolarHBondContact O-CA 3.47Å; P91-C150 PolarHBondContact O-SG 3.25Å; P91-T151 WeakPolarHBondContact CB-OG1 3.41Å; P91-T151 PolarHBondContact O-N 3.34Å
92T87.6Confident90.8Very high12 Ų1275 Ų757%0.07441%0.408CS..BIsolated β-bridgetrans-131.1154.9177.161.40000112.9I90 P94 V95 L99I90-T92 HydrophobicContact CG2-CG2 4.09Å; I90-T92 PolarHBondContact O-N 3.04Å; T92-P94 CarbonylContact C-O 3.35Å; T92-P94 CarbonylContact O-C 3.31Å; T92-P94 VanDerWaalsContact O-C 3.31Å; T92-P94 PolarHBondContact OG1-O 3.1Å; T92-V95 WeakPolarHBondContact O-CA 3.34Å; T92-V95 PolarHBondContact O-N 3.3Å; T92-L99 HydrophobicContact CG2-CD1 4.1Å; T92-L99 HydrophobicContact CG2-CD2 4.33Å
93E81.8Confident90.4Very high94 Ų9475.1 Ų75.144%0.43940%0.399SS..SBendtrans-119.7114.9170.4-163.9130.9-14400108.8T151 L154E93-T151 HydrophobicContact CB-CG2 3.78Å; E93-L154 HydrophobicContact CB-CD2 4.31Å; E93-L154 HydrophobicContact CG-CD2 4.45Å
94P82.3Confident90.2Very high67 Ų6773.5 Ų73.544%0.43539%0.392SS..SBendcis-70.8162.5-4.634.4-38.3000113T92 D96 R97T92-P94 CarbonylContact C-O 3.35Å; T92-P94 CarbonylContact O-C 3.31Å; T92-P94 VanDerWaalsContact O-C 3.31Å; T92-P94 PolarHBondContact OG1-O 3.1Å; P94-D96 VanDerWaalsContact C-N 3.25Å; P94-D96 WeakPolarHBondContact CB-OD1 3.38Å; P94-D96 PolarHBondContact O-N 3.36Å; P94-R97 WeakPolarHBondContact O-CB 3.37Å; P94-R97 PolarHBondContact O-N 3.42Å
95V77.1Confident90.2Very high132 Ų13273.8 Ų73.880%0.839%0.389SS*.THydrogen-bonded Turntrans-65.3-27.3-173.9660000113.2T92 R97T92-V95 WeakPolarHBondContact O-CA 3.34Å; T92-V95 PolarHBondContact O-N 3.3Å; V95-R97 VanDerWaalsContact C-N 3.3Å; V95-R97 PolarHBondContact O-N 3.07Å
96D81.1Confident89.9Confident123 Ų12377.9 Ų77.966%0.65839%0.393SS*.THydrogen-bonded Turntrans-91.915.3-179.563.4-41.8000113P94 K98P94-D96 VanDerWaalsContact C-N 3.25Å; P94-D96 WeakPolarHBondContact CB-OD1 3.38Å; P94-D96 PolarHBondContact O-N 3.36Å; D96-K98 PolarHBondContact O-N 3.12Å
97R86.2Confident89.6Confident55 Ų5576.5 Ų76.521%0.20839%0.386CS..  trans-58123.5176.5178.6-175.3165.1-178.1-0.5110.7P94 V95 L99 E103 T148P94-R97 WeakPolarHBondContact O-CB 3.37Å; P94-R97 PolarHBondContact O-N 3.42Å; V95-R97 VanDerWaalsContact C-N 3.3Å; V95-R97 PolarHBondContact O-N 3.07Å; R97-L99 HydrophobicContact CG-CD2 4.2Å; R97-L99 PolarHBondContact O-N 2.88Å; R97-E103 IonicContact CZ-OE1 3.98Å; R97-E103 IonicContact NH2-OE1 2.81Å; R97-E103 PolarHBondContact NH2-OE1 2.95Å; R97-T148 PolarHBondContact NH1-O 3.11Å
98K88.1Confident89.5Confident199 Ų19973.9 Ų73.987%0.86538%0.379SS*.  trans-73.5109.6172.4-63.2-177.4-178.7176.50110.4D96D96-K98 PolarHBondContact O-N 3.12Å
99L90.1Very high89.5Confident10 Ų1072.2 Ų72.25%0.05237%0.372CS..  trans-92.5132.2175.7-61.5173.9000111.4R87 I90 T92 R97 E103 T104 L107R87-L99 HydrophobicContact CG-CB 4.37Å; R87-L99 PolarHBondContact NE-O 3.13Å; I90-L99 HydrophobicContact CB-CD1 4.24Å; I90-L99 HydrophobicContact CD1-CD1 4.04Å; I90-L99 HydrophobicContact CG2-CD1 3.99Å; T92-L99 HydrophobicContact CG2-CD1 4.1Å; T92-L99 HydrophobicContact CG2-CD2 4.33Å; R97-L99 HydrophobicContact CG-CD2 4.2Å; R97-L99 PolarHBondContact O-N 2.88Å; L99-E103 HydrophobicContact CD2-CB 4.39Å; L99-T104 WeakPolarHBondContact CB-OG1 3.39Å; L99-L107 HydrophobicContact CD1-CD1 3.9Å; L99-L107 HydrophobicContact CD2-CD1 3.65Å; L99-L107 HydrophobicContact CG-CD1 4.43Å
100S94.5Very high89.2Confident48 Ų4867 Ų6734%0.33635%0.346SS..  trans-65.3164.8168.268.50000111.5I102 E103 T104S100-I102 VanDerWaalsContact C-N 3.31Å; S100-I102 PolarHBondContact O-N 3.41Å; S100-I102 WeakPolarHBondContact OG-CG2 3.17Å; S100-E103 VanDerWaalsContact CB-OE2 3.22Å; S100-E103 WeakPolarHBondContact CB-OE2 3.37Å; S100-E103 PolarHBondContact N-OE2 3.29Å; S100-E103 PolarHBondContact O-N 3.43Å; S100-E103 WeakPolarHBondContact OG-CB 3.46Å; S100-E103 WeakPolarHBondContact OG-CG 3.34Å; S100-E103 PolarHBondContact OG-N 3.28Å; S100-E103 PolarHBondContact OG-OE2 2.96Å; S100-T104 WeakPolarHBondContact O-CB 3.42Å; S100-T104 PolarHBondContact O-N 3.27Å; S100-T104 PolarHBondContact O-OG1 3.42Å
101K95Very high89.1Confident104 Ų10470 Ų7045%0.45236%0.357SS..Hα-helixtrans-57.2-45.1179-71-173.8175.7-174.10111.6N80 F83 T104 L105N80-K101 PolarHBondContact OD1-NZ 2.83Å; N80-K101 VanDerWaalsContact OD1-NZ 3.11Å; F83-K101 HydrophobicContact CD1-CB 4.49Å; F83-K101 HydrophobicContact CD1-CG 4.2Å; F83-K101 HydrophobicContact CE1-CB 3.88Å; F83-K101 HydrophobicContact CE1-CG 4.02Å; F83-K101 HydrophobicContact CZ-CB 4.18Å; F83-K101 HydrophobicContact CZ-CG 4.3Å; K101-T104 PolarHBondContact O-N 2.92Å; K101-L105 WeakPolarHBondContact O-CG 3.16Å; K101-L105 PolarHBondContact O-N 2.9Å
102I95.1Very high89.2Confident93 Ų9373.6 Ų73.648%0.47737%0.373SS..Hα-helixtrans-68.9-41.1-179.4-17360000112.4S100 T104 L105 R106S100-I102 VanDerWaalsContact C-N 3.31Å; S100-I102 PolarHBondContact O-N 3.41Å; S100-I102 WeakPolarHBondContact OG-CG2 3.17Å; I102-T104 VanDerWaalsContact C-N 3.35Å; I102-L105 PolarHBondContact O-N 2.71Å; I102-R106 HydrophobicContact CD1-CG 4.49Å; I102-R106 WeakPolarHBondContact O-CG 3.37Å; I102-R106 PolarHBondContact O-N 2.91Å
103E90.4Very high89.2Confident66 Ų6675.8 Ų75.831%0.30839%0.388SS..Hα-helixtrans-63.7-42.5176-72.1169.2116.700111.5R97 L99 S100 L105 R106 L107R97-E103 IonicContact CZ-OE1 3.98Å; R97-E103 IonicContact NH2-OE1 2.81Å; R97-E103 PolarHBondContact NH2-OE1 2.95Å; L99-E103 HydrophobicContact CD2-CB 4.39Å; S100-E103 VanDerWaalsContact CB-OE2 3.22Å; S100-E103 WeakPolarHBondContact CB-OE2 3.37Å; S100-E103 PolarHBondContact N-OE2 3.29Å; S100-E103 PolarHBondContact O-N 3.43Å; S100-E103 WeakPolarHBondContact OG-CB 3.46Å; S100-E103 WeakPolarHBondContact OG-CG 3.34Å; S100-E103 PolarHBondContact OG-N 3.28Å; S100-E103 PolarHBondContact OG-OE2 2.96Å; E103-L105 VanDerWaalsContact C-N 3.31Å; E103-L105 PolarHBondContact O-N 3.48Å; E103-R106 PolarHBondContact O-N 2.86Å; E103-L107 WeakPolarHBondContact O-CB 3.23Å; E103-L107 WeakPolarHBondContact O-CG 3.48Å; E103-L107 PolarHBondContact O-N 2.81Å
104T93.9Very high89.2Confident0 Ų073.3 Ų73.30%038%0.377CS..Hα-helixtrans-55.8-48.1177.1-55.10000110.3F83 L86 R87 I90 L99 S100 K101 I102 A108F83-T104 HydrophobicContact CD1-CG2 4.16Å; F83-T104 HydrophobicContact CE1-CG2 4.39Å; L86-T104 HydrophobicContact CB-CG2 4.29Å; L86-T104 HydrophobicContact CD2-CG2 3.7Å; L86-T104 HydrophobicContact CG-CG2 3.78Å; R87-T104 HydrophobicContact CG-CG2 3.84Å; I90-T104 HydrophobicContact CD1-CG2 3.59Å; I90-T104 WeakPolarHBondContact CD1-O 3.39Å; L99-T104 WeakPolarHBondContact CB-OG1 3.39Å; S100-T104 WeakPolarHBondContact O-CB 3.42Å; S100-T104 PolarHBondContact O-N 3.27Å; S100-T104 PolarHBondContact O-OG1 3.42Å; K101-T104 PolarHBondContact O-N 2.92Å; I102-T104 VanDerWaalsContact C-N 3.35Å; T104-A108 VanDerWaalsContact O-CB 3.23Å; T104-A108 WeakPolarHBondContact O-CB 3.23Å; T104-A108 PolarHBondContact O-N 3.4Å
105L95.4Very high89.5Confident85 Ų8573.6 Ų73.645%0.44537%0.374SS..Hα-helixtrans-64.1-46.1179-66177.3000112.2F83 L86 K101 I102 E103 L107 A108 S109F83-L105 HydrophobicContact CE1-CD2 4.12Å; F83-L105 HydrophobicContact CE1-CG 4.09Å; F83-L105 HydrophobicContact CZ-CD1 4.22Å; F83-L105 HydrophobicContact CZ-CD2 3.98Å; F83-L105 HydrophobicContact CZ-CG 4.08Å; L86-L105 HydrophobicContact CD2-CD2 4.5Å; K101-L105 WeakPolarHBondContact O-CG 3.16Å; K101-L105 PolarHBondContact O-N 2.9Å; I102-L105 PolarHBondContact O-N 2.71Å; E103-L105 VanDerWaalsContact C-N 3.31Å; E103-L105 PolarHBondContact O-N 3.48Å; L105-L107 PolarHBondContact O-N 2.68Å; L105-A108 PolarHBondContact O-N 3.08Å; L105-S109 PolarHBondContact O-N 3.39Å; L105-S109 PolarHBondContact O-OG 3.33Å
106R89.3Confident89.9Confident141 Ų14169.2 Ų69.253%0.53235%0.352SS..Hα-helixtrans-62-44.6179.5-72.2177.4177.1-173.6-1112.2I102 E103 S110I102-R106 HydrophobicContact CD1-CG 4.49Å; I102-R106 WeakPolarHBondContact O-CG 3.37Å; I102-R106 PolarHBondContact O-N 2.91Å; E103-R106 PolarHBondContact O-N 2.86Å; R106-S110 PolarHBondContact O-N 3.48Å; R106-S110 VanDerWaalsContact O-N 3.1Å
107L90.5Very high89.9Confident24 Ų2466 Ų6613%0.12634%0.335CS..Hα-helixtrans-68.9-40.5179.3-71.4176.9000111.7I90 L99 E103 L105 S110 Y111 C150I90-L107 HydrophobicContact CD1-CB 4.25Å; I90-L107 HydrophobicContact CG2-CB 3.78Å; I90-L107 HydrophobicContact CG2-CD1 4.04Å; L99-L107 HydrophobicContact CD1-CD1 3.9Å; L99-L107 HydrophobicContact CD2-CD1 3.65Å; L99-L107 HydrophobicContact CG-CD1 4.43Å; E103-L107 WeakPolarHBondContact O-CB 3.23Å; E103-L107 WeakPolarHBondContact O-CG 3.48Å; E103-L107 PolarHBondContact O-N 2.81Å; L105-L107 PolarHBondContact O-N 2.68Å; L107-S110 PolarHBondContact O-N 3.16Å; L107-Y111 WeakPolarHBondContact O-CB 3.46Å; L107-Y111 PolarHBondContact O-N 3.36Å; L107-C150 HydrophobicContact CD2-CB 3.93Å
108A94.1Very high89.8Confident14 Ų1465.9 Ų65.912%0.11634%0.34CS..Hα-helixtrans-59.2-48.6175.400000111.7L86 I90 T104 L105 S110 Y111 I112L86-A108 HydrophobicContact CD1-CB 4.03Å; L86-A108 HydrophobicContact CD2-CB 4.24Å; L86-A108 HydrophobicContact CG-CB 4.42Å; I90-A108 HydrophobicContact CD1-CB 4.2Å; T104-A108 VanDerWaalsContact O-CB 3.23Å; T104-A108 WeakPolarHBondContact O-CB 3.23Å; T104-A108 PolarHBondContact O-N 3.4Å; L105-A108 PolarHBondContact O-N 3.08Å; A108-S110 VanDerWaalsContact C-N 3.34Å; A108-S110 PolarHBondContact O-N 3.12Å; A108-Y111 PolarHBondContact O-N 2.83Å; A108-Y111 VanDerWaalsContact O-N 3.14Å; A108-I112 WeakPolarHBondContact O-CG1 3.5Å; A108-I112 PolarHBondContact O-N 2.99Å
109S91.8Very high89.6Confident78 Ų7863.7 Ų63.755%0.54534%0.337SS..Hα-helixtrans-58-46.5175.8-640000111.8L105 Y111 I112 S113L105-S109 PolarHBondContact O-N 3.39Å; L105-S109 PolarHBondContact O-OG 3.33Å; S109-Y111 VanDerWaalsContact C-N 3.28Å; S109-Y111 PolarHBondContact O-N 3.42Å; S109-I112 PolarHBondContact O-N 3.14Å; S109-S113 PolarHBondContact O-N 3.47Å; S109-S113 VanDerWaalsContact O-N 3.11Å; S109-S113 PolarHBondContact O-OG 2.95Å
110S86.9Confident89.1Confident11 Ų1170 Ų708%0.07737%0.37CS..Hα-helixtrans-63.4-34.3177.7-173.50000112.6R106 L107 A108 H114 P130R106-S110 PolarHBondContact O-N 3.48Å; R106-S110 VanDerWaalsContact O-N 3.1Å; L107-S110 PolarHBondContact O-N 3.16Å; A108-S110 VanDerWaalsContact C-N 3.34Å; A108-S110 PolarHBondContact O-N 3.12Å; S110-H114 WeakPolarHBondContact O-CB 3.47Å; S110-H114 PolarHBondContact O-N 3.32Å; S110-P130 WeakPolarHBondContact OG-CB 3.42Å; S110-P130 WeakPolarHBondContact OG-CG 3.22Å
111Y91.4Very high88.2Confident75 Ų7572.6 Ų72.629%0.29438%0.379SS..Hα-helixtrans-71.9-42.7179.9-175.3-137.1000111.5P91 L107 A108 S109 S113 H114 L115P91-Y111 HydrophobicContact CG-CD2 4.38Å; P91-Y111 HydrophobicContact CG-CE1 4.14Å; P91-Y111 HydrophobicContact CG-CE2 3.91Å; L107-Y111 WeakPolarHBondContact O-CB 3.46Å; L107-Y111 PolarHBondContact O-N 3.36Å; A108-Y111 PolarHBondContact O-N 2.83Å; A108-Y111 VanDerWaalsContact O-N 3.14Å; S109-Y111 VanDerWaalsContact C-N 3.28Å; S109-Y111 PolarHBondContact O-N 3.42Å; Y111-S113 PolarHBondContact O-N 3.11Å; Y111-H114 WeakPolarHBondContact O-CB 3.49Å; Y111-H114 PolarHBondContact O-N 3.18Å; Y111-L115 HydrophobicContact CD1-CD1 4.26Å; Y111-L115 HydrophobicContact CD2-CD1 4.39Å; Y111-L115 HydrophobicContact CD2-CG 4.11Å; Y111-L115 HydrophobicContact CE1-CD1 3.85Å; Y111-L115 HydrophobicContact CE2-CD1 3.97Å; Y111-L115 HydrophobicContact CE2-CD2 3.76Å; Y111-L115 HydrophobicContact CE2-CG 3.76Å; Y111-L115 WeakPolarHBondContact O-CG 3.4Å; Y111-L115 PolarHBondContact O-N 3.38Å
112I91.7Very high86.7Confident114 Ų11469.4 Ų69.459%0.58538%0.375SS*.Hα-helixtrans-57.6-49.5173.5-66.1165.5000110.4A108 S109 H114 L115 A116A108-I112 WeakPolarHBondContact O-CG1 3.5Å; A108-I112 PolarHBondContact O-N 2.99Å; S109-I112 PolarHBondContact O-N 3.14Å; I112-H114 VanDerWaalsContact C-N 3.28Å; I112-H114 PolarHBondContact O-N 3.27Å; I112-L115 PolarHBondContact O-N 2.83Å; I112-A116 WeakPolarHBondContact O-CB 3.34Å; I112-A116 PolarHBondContact O-N 3.03Å
113S86.9Confident85Confident58 Ų5871.8 Ų71.841%0.40639%0.389SS..Hα-helixtrans-60.6-38.5177.9-60.20000112.4S109 Y111 A116 N117S109-S113 PolarHBondContact O-N 3.47Å; S109-S113 VanDerWaalsContact O-N 3.11Å; S109-S113 PolarHBondContact O-OG 2.95Å; Y111-S113 PolarHBondContact O-N 3.11Å; S113-A116 PolarHBondContact O-N 3.16Å; S113-N117 PolarHBondContact O-N 2.66Å
114H82.5Confident83.3Confident42 Ų4272.9 Ų72.919%0.19441%0.409CS..Hα-helixtrans-63.7-49.9176.2171.650.9000112S110 Y111 I112 A116 N117 V118 F152S110-H114 WeakPolarHBondContact O-CB 3.47Å; S110-H114 PolarHBondContact O-N 3.32Å; Y111-H114 WeakPolarHBondContact O-CB 3.49Å; Y111-H114 PolarHBondContact O-N 3.18Å; I112-H114 VanDerWaalsContact C-N 3.28Å; I112-H114 PolarHBondContact O-N 3.27Å; H114-A116 VanDerWaalsContact C-N 3.26Å; H114-A116 PolarHBondContact O-N 3.38Å; H114-N117 PolarHBondContact O-N 3.29Å; H114-N117 VanDerWaalsContact O-N 3.12Å; H114-V118 WeakPolarHBondContact CE1-CG2 3.5Å; H114-V118 WeakPolarHBondContact O-CG2 3.49Å; H114-V118 PolarHBondContact O-N 2.88Å; H114-F152 HydrophobicContact CB-CD1 4.49Å; H114-F152 HydrophobicContact CB-CE1 4.25Å; H114-F152 AromaticContact CD2-CD2 3.71Å; H114-F152 AromaticContact CD2-CE2 3.9Å; H114-F152 AromaticContact CD2-CG 3.96Å; H114-F152 AromaticContact CE1-CD2 3.48Å; H114-F152 VanDerWaalsContact CE1-CD2 3.48Å; H114-F152 WeakPolarHBondContact CE1-CD2 3.39Å; H114-F152 AromaticContact CE1-CE2 2.96Å; H114-F152 WeakPolarHBondContact CE1-CE2 3.36Å; H114-F152 AromaticContact CE1-CZ 3.44Å; H114-F152 VanDerWaalsContact CE1-CZ 3.44Å; H114-F152 WeakPolarHBondContact CE1-CZ 3.35Å; H114-F152 AromaticContact CG-CE1 3.87Å; H114-F152 AromaticContact CG-CE2 3.83Å; H114-F152 AromaticContact CG-CZ 3.73Å; H114-F152 AromaticContact ND1-CD2 3.89Å; H114-F152 AromaticContact ND1-CE1 3.76Å; H114-F152 AromaticContact ND1-CE2 3.26Å; H114-F152 VanDerWaalsContact ND1-CE2 3.26Å; H114-F152 WeakPolarHBondContact ND1-CE2 3.4Å; H114-F152 AromaticContact ND1-CZ 3.17Å; H114-F152 WeakPolarHBondContact ND1-CZ 3.33Å; H114-F152 AromaticContact NE2-CD2 3.33Å; H114-F152 VanDerWaalsContact NE2-CD2 3.33Å; H114-F152 WeakPolarHBondContact NE2-CD2 3.36Å; H114-F152 AromaticContact NE2-CE2 3.38Å; H114-F152 WeakPolarHBondContact NE2-CE2 2.99Å
115L87Confident81.3Confident73 Ų7373.9 Ų73.938%0.38242%0.42SS..Hα-helixtrans-59.2-40177.5-67.6177.6000111.2Y111 I112 N117 V118 L119Y111-L115 HydrophobicContact CD1-CD1 4.26Å; Y111-L115 HydrophobicContact CD2-CD1 4.39Å; Y111-L115 HydrophobicContact CD2-CG 4.11Å; Y111-L115 HydrophobicContact CE1-CD1 3.85Å; Y111-L115 HydrophobicContact CE2-CD1 3.97Å; Y111-L115 HydrophobicContact CE2-CD2 3.76Å; Y111-L115 HydrophobicContact CE2-CG 3.76Å; Y111-L115 WeakPolarHBondContact O-CG 3.4Å; Y111-L115 PolarHBondContact O-N 3.38Å; I112-L115 PolarHBondContact O-N 2.83Å; L115-N117 PolarHBondContact O-N 3.35Å; L115-V118 PolarHBondContact O-N 3.46Å; L115-L119 VanDerWaalsContact O-CG 3.27Å; L115-L119 WeakPolarHBondContact O-CG 3.37Å; L115-L119 PolarHBondContact O-N 3.21Å
116A86.5Confident79.4Confident40 Ų4072.1 Ų72.133%0.33142%0.418SS..Hα-helixtrans-59.9-44.417500000112I112 S113 H114 L119 L120I112-A116 WeakPolarHBondContact O-CB 3.34Å; I112-A116 PolarHBondContact O-N 3.03Å; S113-A116 PolarHBondContact O-N 3.16Å; H114-A116 VanDerWaalsContact C-N 3.26Å; H114-A116 PolarHBondContact O-N 3.38Å; A116-L119 PolarHBondContact O-N 3.11Å; A116-L120 WeakPolarHBondContact O-CB 3.39Å; A116-L120 VanDerWaalsContact O-CG 3.27Å; A116-L120 WeakPolarHBondContact O-CG 3.36Å; A116-L120 PolarHBondContact O-N 3.11Å
117N81.3Confident77.6Confident55 Ų5573.9 Ų73.929%0.29443%0.432SS..Hα-helixtrans-64.9-41.5177.6-70.8-9000112.4S113 H114 L115 L119 L120 I121S113-N117 PolarHBondContact O-N 2.66Å; H114-N117 PolarHBondContact O-N 3.29Å; H114-N117 VanDerWaalsContact O-N 3.12Å; L115-N117 PolarHBondContact O-N 3.35Å; N117-L119 VanDerWaalsContact C-N 3.28Å; N117-L119 PolarHBondContact O-N 3.12Å; N117-L120 PolarHBondContact O-N 3.44Å; N117-I121 PolarHBondContact O-N 2.92Å
118V82.9Confident76Confident53 Ų5375.6 Ų75.632%0.32146%0.455SS..Hα-helixtrans-59.6-41.2176.2171.70000110.8H114 L115 G122H114-V118 WeakPolarHBondContact CE1-CG2 3.5Å; H114-V118 WeakPolarHBondContact O-CG2 3.49Å; H114-V118 PolarHBondContact O-N 2.88Å; L115-V118 PolarHBondContact O-N 3.46Å; V118-G122 VanDerWaalsContact O-CA 3.25Å; V118-G122 WeakPolarHBondContact O-CA 3.48Å; V118-G122 PolarHBondContact O-N 3.23Å; V118-G122 VanDerWaalsContact O-N 3.17Å
119L84.6Confident74Confident153 Ų15378.3 Ų78.380%0.80147%0.465SS*.Hα-helixtrans-71.6-33.5178.7-67173.2000113.1L115 A116 N117L115-L119 VanDerWaalsContact O-CG 3.27Å; L115-L119 WeakPolarHBondContact O-CG 3.37Å; L115-L119 PolarHBondContact O-N 3.21Å; A116-L119 PolarHBondContact O-N 3.11Å; N117-L119 VanDerWaalsContact C-N 3.28Å; N117-L119 PolarHBondContact O-N 3.12Å
120L80.3Confident72.2Confident144 Ų14477.4 Ų77.475%0.75446%0.458SS*.Hα-helixtrans-86-39.4-175.3-71.8171000114.1A116 N117A116-L120 WeakPolarHBondContact O-CB 3.39Å; A116-L120 VanDerWaalsContact O-CG 3.27Å; A116-L120 WeakPolarHBondContact O-CG 3.36Å; A116-L120 PolarHBondContact O-N 3.11Å; N117-L120 PolarHBondContact O-N 3.44Å
121I75.4Confident70.7Confident102 Ų10277.7 Ų77.752%0.52346%0.459SS..Hα-helixtrans-106.2-10.3-171.5-53.4166.2000110.9N117 G125N117-I121 PolarHBondContact O-N 2.92Å; I121-G125 VanDerWaalsContact CG2-CA 3.46Å
122G63.8Low68.9Low36 Ų3675.8 Ų75.837%0.37145%0.454SS..  trans70.2-178-163.100000111.2V118 A124 G125V118-G122 VanDerWaalsContact O-CA 3.25Å; V118-G122 WeakPolarHBondContact O-CA 3.48Å; V118-G122 PolarHBondContact O-N 3.23Å; V118-G122 VanDerWaalsContact O-N 3.17Å; G122-A124 PolarHBondContact O-N 3.06Å; G122-G125 PolarHBondContact O-N 2.78Å
123D58.9Low67Low143 Ų14373.4 Ų73.477%0.76546%0.458SS*.THydrogen-bonded Turntrans-61.11.9-177.5-162.449000114.6
124A54.6Low65.2Low89 Ų8973.2 Ų73.274%0.73646%0.46SS*.THydrogen-bonded Turntrans-92.9-10.2-177.300000114.8G122 A126G122-A124 PolarHBondContact O-N 3.06Å; A124-A126 PolarHBondContact O-N 3.32Å
125G51.2Low63.6Low22 Ų2275.1 Ų75.123%0.22747%0.474CS..  trans-91.664.5-17400000114.9I121 G122 E127I121-G125 VanDerWaalsContact CG2-CA 3.46Å; G122-G125 PolarHBondContact O-N 2.78Å; G125-E127 VanDerWaalsContact C-N 3.32Å; G125-E127 PolarHBondContact O-N 3.4Å
126A55.1Low61.7Low48 Ų4878 Ų7840%0.39749%0.485SS..  trans-88.741.4-178.800000113.8A124A124-A126 PolarHBondContact O-N 3.32Å
127E53Low59.6Low178 Ų17880.3 Ų80.383%0.83250%0.504SS*.  trans-123.8108.7-175.6-65.2-62.614500110.9G125G125-E127 VanDerWaalsContact C-N 3.32Å; G125-E127 PolarHBondContact O-N 3.4Å
128G56.4Low57.6Low59 Ų5986.1 Ų86.161%0.60853%0.53SS*.  trans117.176.3172.400000113.9P130G128-P130 WeakPolarHBondContact O-CD 3.21Å
129Q51.9Low55.3Low71 Ų7186.8 Ų86.833%0.33255%0.547SS..  trans-75.7107.5-178.1-169.9164-4.500112L132Q129-L132 HydrophobicContact CG-CB 4.48Å; Q129-L132 HydrophobicContact CG-CD1 4.2Å; Q129-L132 HydrophobicContact CG-CG 4.04Å
130P54.1Low53.4Low60 Ų6089.5 Ų89.539%0.3956%0.556SS.*Hα-helixtrans-80.9-23.5-177.7-3.621.4000112.5S110 G128 L132S110-P130 WeakPolarHBondContact OG-CB 3.42Å; S110-P130 WeakPolarHBondContact OG-CG 3.22Å; G128-P130 WeakPolarHBondContact O-CD 3.21Å; P130-L132 PolarHBondContact O-N 2.66Å
131C54.3Low51.4Low16 Ų1686 Ų8611%0.10855%0.554CS.*Hα-helixtrans-74.9-18.4-171.761.10000115.2C153C131-C153 WeakPolarHBondContact CB-SG 3.45Å; C131-C153 WeakPolarHBondContact SG-CB 3.47Å; C131-C153 CovalentContact SG-SG 2.04Å; C131-C153 PolarHBondContact SG-SG 3.4Å
132L54.5Low50Low36 Ų3686.7 Ų86.719%0.18858%0.576CS.*Hα-helixtrans-96.7-25.9-178.5-66.6-175.7000114.1Q129 P130 A134 V135Q129-L132 HydrophobicContact CG-CB 4.48Å; Q129-L132 HydrophobicContact CG-CD1 4.2Å; Q129-L132 HydrophobicContact CG-CG 4.04Å; P130-L132 PolarHBondContact O-N 2.66Å; L132-A134 PolarHBondContact O-N 3.06Å; L132-A134 VanDerWaalsContact O-N 3.16Å; L132-V135 PolarHBondContact O-N 3.35Å
133G51.3Low48.7Very low64 Ų6487.8 Ų87.866%0.6659%0.587SS**Hα-helixtrans-61.7-27.7-175.600000113.7
134A50.4Low48.1Very low53 Ų5391.1 Ų91.144%0.43860%0.595SS.*THydrogen-bonded Turntrans-88.1-5.3-177.300000114.9L132L132-A134 PolarHBondContact O-N 3.06Å; L132-A134 VanDerWaalsContact O-N 3.16Å
135V47.3Very low47.5Very low83 Ų8394.5 Ų94.550%0.50360%0.595SS.*THydrogen-bonded Turntrans-111.6-17.7-175.1-167.80000112.6L132 A137L132-V135 PolarHBondContact O-N 3.35Å; V135-A137 VanDerWaalsContact C-N 3.3Å; V135-A137 PolarHBondContact O-N 3.01Å
136H47.3Very low47.4Very low132 Ų13298.7 Ų98.761%0.61162%0.619SS**THydrogen-bonded Turntrans-81.61.7-175.6-66.5-176.6000115Q138H136-Q138 VanDerWaalsContact C-N 3.33Å; H136-Q138 PolarHBondContact O-N 3.02Å
137A44.1Very low47.4Very low89 Ų89104.6 Ų104.674%0.73663%0.631SS**THydrogen-bonded Turntrans-877.2179.700000114.6V135V135-A137 VanDerWaalsContact C-N 3.3Å; V135-A137 PolarHBondContact O-N 3.01Å
138Q37.7Very low47.6Very low178 Ų17899.9 Ų99.983%0.83261%0.614SS**SBendtrans-138.9106179.8-67.5-74.9-18.900111H136H136-Q138 VanDerWaalsContact C-N 3.33Å; H136-Q138 PolarHBondContact O-N 3.02Å
139G35.5Very low48.1Very low66 Ų6698.2 Ų98.268%0.6859%0.591SS**  trans95.396149.100000117.5G141G139-G141 PolarHBondContact O-N 3.31Å
140E44.3Very low49Very low210 Ų21095.3 Ų95.398%0.98158%0.578SS**  trans-61.9116.8145.6-64.2-158.9128.900108.4
141G37.5Very low49.7Very low70 Ų7094.3 Ų94.372%0.72257%0.571SS**  trans-174.7102.7-177.400000110.5G139 G143G139-G141 PolarHBondContact O-N 3.31Å; G141-G143 PolarHBondContact O-N 2.91Å; G141-G143 VanDerWaalsContact O-N 3.11Å
142A47.1Very low50.2Low118 Ų11895.7 Ų95.798%0.97558%0.575SS**  trans-55.8110.9175.500000111
143G37.2Very low50.6Low59 Ų5994 Ų9461%0.60857%0.567SS**  trans-166.5108.7173.800000109.1G141 Q145G141-G143 PolarHBondContact O-N 2.91Å; G141-G143 VanDerWaalsContact O-N 3.11Å; G143-Q145 PolarHBondContact O-N 3.34Å
144K44.6Very low51.3Low213 Ų21392.6 Ų92.693%0.92654%0.544SS*.  trans-7076.7-179.3-61.4172-176.9-173.20109.8
145Q41.8Very low51.8Low160 Ų16093 Ų9375%0.74854%0.544SS*.  trans-109.7125.9165.3-63.9-63.4-5.500108.3G143 R147G143-Q145 PolarHBondContact O-N 3.34Å; Q145-R147 PolarHBondContact O-N 3.48Å; Q145-R147 VanDerWaalsContact O-N 3.12Å
146P49.6Very low52.3Low110 Ų11091 Ų9171%0.71453%0.53SS*.  trans-61.8120.1178.825.3-31.3000108.3T148P146-T148 PolarHBondContact O-N 3.37Å; P146-T148 VanDerWaalsContact O-N 3.08Å
147R56.3Low52.9Low172 Ų17289.7 Ų89.765%0.64952%0.524SS*.  trans-65.7112.6177.9-60.8-172.8-179.4-102.30.9107.3Q145 I149Q145-R147 PolarHBondContact O-N 3.48Å; Q145-R147 VanDerWaalsContact O-N 3.12Å; R147-I149 HydrophobicContact CB-CD1 3.58Å; R147-I149 HydrophobicContact CB-CG1 3.68Å; R147-I149 PolarHBondContact O-N 2.89Å; R147-I149 VanDerWaalsContact O-N 3.13Å
148T56.7Low53.5Low78 Ų7891.9 Ų91.948%0.47951%0.513SS..  trans-73.8101.9171.153.90000106.9R97 P146R97-T148 PolarHBondContact NH1-O 3.11Å; P146-T148 PolarHBondContact O-N 3.37Å; P146-T148 VanDerWaalsContact O-N 3.08Å
149I66.3Low54.3Low24 Ų2489 Ų8912%0.12350%0.498CS..  trans-118.3157.6-176-51.1165.3000107.9R147 C153 L154R147-I149 HydrophobicContact CB-CD1 3.58Å; R147-I149 HydrophobicContact CB-CG1 3.68Å; R147-I149 PolarHBondContact O-N 2.89Å; R147-I149 VanDerWaalsContact O-N 3.13Å; I149-C153 HydrophobicContact CB-CB 4.46Å; I149-C153 HydrophobicContact CG2-CB 3.37Å; I149-L154 HydrophobicContact CB-CD1 3.7Å; I149-L154 VanDerWaalsContact O-CD1 3.23Å; I149-L154 WeakPolarHBondContact O-CD1 3.4Å
150C71.8Confident55.1Low10 Ų1088 Ų887%0.06849%0.489CS..BIsolated β-bridgetrans-48.2138.9168.4169.50000110.7P91 L107 F152 C153 L154P91-C150 WeakPolarHBondContact O-CA 3.47Å; P91-C150 PolarHBondContact O-SG 3.25Å; L107-C150 HydrophobicContact CD2-CB 3.93Å; C150-F152 PolarHBondContact O-N 3.46Å; C150-F152 VanDerWaalsContact O-N 3.1Å; C150-C153 PolarHBondContact O-N 3.49Å; C150-L154 WeakPolarHBondContact O-CD1 3.5Å; C150-L154 PolarHBondContact O-N 2.96Å
151T67.6Low55.5Low40 Ų4082.3 Ų82.325%0.24546%0.464CS..Hα-helixtrans-53.4-34.6-176.741.60000112.4P91 E93 C153 L154 S155P91-T151 WeakPolarHBondContact CB-OG1 3.41Å; P91-T151 PolarHBondContact O-N 3.34Å; E93-T151 HydrophobicContact CB-CG2 3.78Å; T151-C153 PolarHBondContact O-N 3.4Å; T151-L154 WeakPolarHBondContact O-CB 3.41Å; T151-L154 PolarHBondContact O-N 3.29Å; T151-S155 PolarHBondContact O-N 2.98Å; T151-S155 PolarHBondContact O-OG 3.4Å
152F65.6Low55.9Low44 Ų4486.1 Ų86.119%0.19346%0.46CS..Hα-helixtrans-61.1-44.4176.4174.2-112.3000112.9H114 C150 L154 S155 N156H114-F152 HydrophobicContact CB-CD1 4.49Å; H114-F152 HydrophobicContact CB-CE1 4.25Å; H114-F152 AromaticContact CD2-CD2 3.71Å; H114-F152 AromaticContact CD2-CE2 3.9Å; H114-F152 AromaticContact CD2-CG 3.96Å; H114-F152 AromaticContact CE1-CD2 3.48Å; H114-F152 VanDerWaalsContact CE1-CD2 3.48Å; H114-F152 WeakPolarHBondContact CE1-CD2 3.39Å; H114-F152 AromaticContact CE1-CE2 2.96Å; H114-F152 WeakPolarHBondContact CE1-CE2 3.36Å; H114-F152 AromaticContact CE1-CZ 3.44Å; H114-F152 VanDerWaalsContact CE1-CZ 3.44Å; H114-F152 WeakPolarHBondContact CE1-CZ 3.35Å; H114-F152 AromaticContact CG-CE1 3.87Å; H114-F152 AromaticContact CG-CE2 3.83Å; H114-F152 AromaticContact CG-CZ 3.73Å; H114-F152 AromaticContact ND1-CD2 3.89Å; H114-F152 AromaticContact ND1-CE1 3.76Å; H114-F152 AromaticContact ND1-CE2 3.26Å; H114-F152 VanDerWaalsContact ND1-CE2 3.26Å; H114-F152 WeakPolarHBondContact ND1-CE2 3.4Å; H114-F152 AromaticContact ND1-CZ 3.17Å; H114-F152 WeakPolarHBondContact ND1-CZ 3.33Å; H114-F152 AromaticContact NE2-CD2 3.33Å; H114-F152 VanDerWaalsContact NE2-CD2 3.33Å; H114-F152 WeakPolarHBondContact NE2-CD2 3.36Å; H114-F152 AromaticContact NE2-CE2 3.38Å; H114-F152 WeakPolarHBondContact NE2-CE2 2.99Å; C150-F152 PolarHBondContact O-N 3.46Å; C150-F152 VanDerWaalsContact O-N 3.1Å; F152-L154 VanDerWaalsContact C-N 3.3Å; F152-L154 PolarHBondContact O-N 2.91Å; F152-S155 WeakPolarHBondContact O-CB 3.49Å; F152-S155 PolarHBondContact O-N 2.9Å; F152-N156 PolarHBondContact O-N 2.92Å; F152-N156 VanDerWaalsContact O-N 3.17Å
153C63.3Low56Low2 Ų285.2 Ų85.21%0.01444%0.439CS..Hα-helixtrans-71.2-28.1179.7-44.20000111.5C131 I149 C150 T151 Q157C131-C153 WeakPolarHBondContact CB-SG 3.45Å; C131-C153 WeakPolarHBondContact SG-CB 3.47Å; C131-C153 CovalentContact SG-SG 2.04Å; C131-C153 PolarHBondContact SG-SG 3.4Å; I149-C153 HydrophobicContact CB-CB 4.46Å; I149-C153 HydrophobicContact CG2-CB 3.37Å; C150-C153 PolarHBondContact O-N 3.49Å; T151-C153 PolarHBondContact O-N 3.4Å; C153-Q157 WeakPolarHBondContact O-CB 3.43Å; C153-Q157 PolarHBondContact O-N 3.42Å; C153-Q157 VanDerWaalsContact O-N 3.1Å
154L65.1Low56.3Low34 Ų3484 Ų8418%0.17843%0.427CS..Hα-helixtrans-65.8-40.3170.1-88.479.3000111.4E93 I149 C150 T151 F152 Q157 R158E93-L154 HydrophobicContact CB-CD2 4.31Å; E93-L154 HydrophobicContact CG-CD2 4.45Å; I149-L154 HydrophobicContact CB-CD1 3.7Å; I149-L154 VanDerWaalsContact O-CD1 3.23Å; I149-L154 WeakPolarHBondContact O-CD1 3.4Å; C150-L154 WeakPolarHBondContact O-CD1 3.5Å; C150-L154 PolarHBondContact O-N 2.96Å; T151-L154 WeakPolarHBondContact O-CB 3.41Å; T151-L154 PolarHBondContact O-N 3.29Å; F152-L154 VanDerWaalsContact C-N 3.3Å; F152-L154 PolarHBondContact O-N 2.91Å; L154-Q157 PolarHBondContact O-N 2.9Å; L154-R158 WeakPolarHBondContact O-CB 3.24Å; L154-R158 WeakPolarHBondContact O-CG 3.35Å; L154-R158 PolarHBondContact O-N 3.37Å; L154-R158 PolarHBondContact O-NE 3.48Å
155S61.3Low56.3Low62 Ų6280.3 Ų80.343%0.43441%0.411SS..Hα-helixtrans-63.8-45.6179-62.90000111.9T151 F152 R158 K159T151-S155 PolarHBondContact O-N 2.98Å; T151-S155 PolarHBondContact O-OG 3.4Å; F152-S155 WeakPolarHBondContact O-CB 3.49Å; F152-S155 PolarHBondContact O-N 2.9Å; S155-R158 PolarHBondContact O-N 2.9Å; S155-K159 PolarHBondContact O-N 2.9Å
156N58.4Low56.5Low40 Ų4078.5 Ų78.521%0.21441%0.406CS..Hα-helixtrans-67.1-38.3175.8-87.635000113.1F152 R158 K159 G160F152-N156 PolarHBondContact O-N 2.92Å; F152-N156 VanDerWaalsContact O-N 3.17Å; N156-R158 VanDerWaalsContact C-N 3.35Å; N156-R158 PolarHBondContact O-N 3.45Å; N156-K159 PolarHBondContact O-N 3.46Å; N156-G160 PolarHBondContact O-N 3.39Å
157Q58.8Low56.2Low105 Ų10577.8 Ų77.849%0.49140%0.403SS..Hα-helixtrans-65.4-38.2177-172.217192.100112.2C153 L154 K159 I161C153-Q157 WeakPolarHBondContact O-CB 3.43Å; C153-Q157 PolarHBondContact O-N 3.42Å; C153-Q157 VanDerWaalsContact O-N 3.1Å; L154-Q157 PolarHBondContact O-N 2.9Å; Q157-K159 VanDerWaalsContact C-N 3.34Å; Q157-I161 HydrophobicContact CG-CD1 4.36Å; Q157-I161 WeakPolarHBondContact O-CG1 3.31Å; Q157-I161 PolarHBondContact O-N 3.41Å
158R57.8Low55.7Low135 Ų13576.6 Ų76.651%0.50941%0.409SS..Hα-helixtrans-68.5-32.5174.4-73.4-176.6-75.8-145.61112.5L154 S155 N156 K162L154-R158 WeakPolarHBondContact O-CB 3.24Å; L154-R158 WeakPolarHBondContact O-CG 3.35Å; L154-R158 PolarHBondContact O-N 3.37Å; L154-R158 PolarHBondContact O-NE 3.48Å; S155-R158 PolarHBondContact O-N 2.9Å; N156-R158 VanDerWaalsContact C-N 3.35Å; N156-R158 PolarHBondContact O-N 3.45Å; R158-K162 PolarHBondContact O-N 3Å
159K54.3Low55Low116 Ų11681.6 Ų81.650%0.50442%0.424SS..Hα-helixtrans-67.4-49.8176.3-153.4172.1-176.3-179.50110.9S155 N156 Q157 I161 K162 D163S155-K159 PolarHBondContact O-N 2.9Å; N156-K159 PolarHBondContact O-N 3.46Å; Q157-K159 VanDerWaalsContact C-N 3.34Å; K159-I161 VanDerWaalsContact C-N 3.29Å; K159-I161 PolarHBondContact O-N 3.2Å; K159-K162 WeakPolarHBondContact O-CB 3.47Å; K159-K162 PolarHBondContact O-N 3.02Å; K159-D163 PolarHBondContact O-N 3.41Å; K159-D163 VanDerWaalsContact O-N 3.16Å
160G52.2Low54Low47 Ų4788.4 Ų88.449%0.48546%0.457SS..Hα-helixtrans-62.5-28.1176.400000115.1N156 G164N156-G160 PolarHBondContact O-N 3.39Å; G160-G164 PolarHBondContact O-N 3.41Å; G160-G164 VanDerWaalsContact O-N 3.15Å
161I52.5Low52.8Low89 Ų8998.2 Ų98.246%0.45649%0.492SS..Hα-helixtrans-75.1-28.6173.1-71168.5000112.2Q157 K159 K165Q157-I161 HydrophobicContact CG-CD1 4.36Å; Q157-I161 WeakPolarHBondContact O-CG1 3.31Å; Q157-I161 PolarHBondContact O-N 3.41Å; K159-I161 VanDerWaalsContact C-N 3.29Å; K159-I161 PolarHBondContact O-N 3.2Å; I161-K165 VanDerWaalsContact CG2-CE 3.5Å; I161-K165 WeakPolarHBondContact O-CD 3.42Å; I161-K165 VanDerWaalsContact O-CG 3.28Å; I161-K165 WeakPolarHBondContact O-CG 3.12Å
162K45.7Very low51.7Low150 Ų150100.2 Ų100.265%0.65252%0.521SS*.Hα-helixtrans-71.2-47.3174.7-93.5-180170.3-176.40110.6R158 K159 G164 K165R158-K162 PolarHBondContact O-N 3Å; K159-K162 WeakPolarHBondContact O-CB 3.47Å; K159-K162 PolarHBondContact O-N 3.02Å; K162-G164 VanDerWaalsContact C-N 3.28Å; K162-G164 PolarHBondContact O-N 3.4Å; K162-K165 PolarHBondContact O-N 3.21Å
163D48.5Very low50.7Low99 Ų99105.9 Ų105.953%0.52955%0.553SS.*Hα-helixtrans-69-26.6179.9-55.9-43000112.4K159 C167K159-D163 PolarHBondContact O-N 3.41Å; K159-D163 VanDerWaalsContact O-N 3.16Å; D163-C167 PolarHBondContact O-N 3.49Å
164G44.2Very low49.8Very low34 Ų34108.7 Ų108.735%0.35158%0.582SS.*Hα-helixtrans-72.6-22.4173.900000115.2G160 K162G160-G164 PolarHBondContact O-N 3.41Å; G160-G164 VanDerWaalsContact O-N 3.15Å; K162-G164 VanDerWaalsContact C-N 3.28Å; K162-G164 PolarHBondContact O-N 3.4Å
165K45.3Very low48.8Very low136 Ų136112.8 Ų112.859%0.59161%0.61SS**Hα-helixtrans-78.5-29.9177.8-70.9166.9-173.5-176.80112I161 K162I161-K165 VanDerWaalsContact CG2-CE 3.5Å; I161-K165 WeakPolarHBondContact O-CD 3.42Å; I161-K165 VanDerWaalsContact O-CG 3.28Å; I161-K165 WeakPolarHBondContact O-CG 3.12Å; K162-K165 PolarHBondContact O-N 3.21Å
166D45.1Very low48Very low121 Ų121117.9 Ų117.965%0.64763%0.632SS**Hα-helixtrans-77.8-27.3175.1-67.7-40.2000112.1K169D166-K169 PolarHBondContact O-N 3.21Å
167C42.5Very low47.6Very low95 Ų95127.3 Ų127.364%0.64267%0.665SS**Hα-helixtrans-72.5-25.5173.1-73.10000114.5D163 K169 M170D163-C167 PolarHBondContact O-N 3.49Å; C167-K169 PolarHBondContact O-N 3.05Å; C167-M170 PolarHBondContact O-N 2.88Å
168L46.8Very low46.9Very low148 Ų148129 Ų12978%0.77568%0.682SS**THydrogen-bonded Turntrans-74.5-11.6176.3-99.8151.2000113.3
169K42.1Very low46.1Very low183 Ų183133.9 Ų133.980%0.79670%0.7SS**THydrogen-bonded Turntrans-90.7-5.2177.1-156.5151-177.7170.20114D166 C167D166-K169 PolarHBondContact O-N 3.21Å; C167-K169 PolarHBondContact O-N 3.05Å
170M45.5Very low46.1Very low166 Ų166143.6 Ų143.682%0.81873%0.733SS**SBendtrans-102.66.4179.3-64.1-62-8200114.3C167C167-M170 PolarHBondContact O-N 2.88Å
171R45.6Very low45.8Very low217 Ų217148.4 Ų148.482%0.81975%0.746SS**SBendtrans-106.692.2161.7-69.3-172.1-169.9177.44108.4L173R171-L173 VanDerWaalsContact C-N 3.28Å; R171-L173 PolarHBondContact O-N 3.48Å
172G45.5Very low45.4Very low82 Ų82151.5 Ų151.585%0.84576%0.761SS**  trans-59.585.7173.300000112
173L44.4Very low45.4Very low163 Ų163151.6 Ų151.685%0.85377%0.767SS**  trans-95.4101.3159.7-67.3176.1000106.7R171R171-L173 VanDerWaalsContact C-N 3.28Å; R171-L173 PolarHBondContact O-N 3.48Å
174G44Very low45.2Very low61 Ų61154.7 Ų154.763%0.62978%0.781SS**  trans-58.2147.3172.400000110.7L176G174-L176 PolarHBondContact O-N 3.01Å; G174-L176 VanDerWaalsContact O-N 3.14Å
175P45.2Very low45.3Very low120 Ų120162.3 Ų162.378%0.77981%0.808SS**  trans-69.8113.9177.427.7-31000109.1R177P175-R177 VanDerWaalsContact C-N 3.35Å; P175-R177 PolarHBondContact O-N 3.15Å
176L44.3Very low45.3Very low169 Ų169164 Ų16489%0.88582%0.822SS**  trans-64.3100.8160.8-80.2169.4000107.4G174 V178G174-L176 PolarHBondContact O-N 3.01Å; G174-L176 VanDerWaalsContact O-N 3.14Å; L176-V178 PolarHBondContact O-N 3.05Å; L176-V178 VanDerWaalsContact O-N 3.1Å
177R49.2Very low45.3Very low238 Ų238167.1 Ų167.190%0.89884%0.835SS**  trans-61.2108.7166.4-73.7-173.6-174.8-174.82.2107.8P175 R179P175-R177 VanDerWaalsContact C-N 3.35Å; P175-R177 PolarHBondContact O-N 3.15Å; R177-R179 PolarHBondContact O-N 3.17Å
178V43.4Very low45.5Very low140 Ų140172.6 Ų172.685%0.84885%0.85SS**  trans-71.5114.3159.2177.30000106.6L176L176-V178 PolarHBondContact O-N 3.05Å; L176-V178 VanDerWaalsContact O-N 3.1Å
179R41.7Very low45.4Very low238 Ų238174.7 Ų174.790%0.89886%0.856SS**  trans-86.9139.6167.9-140.9-176.9174-133.5-1.3107.5R177R177-R179 PolarHBondContact O-N 3.17Å
180R54.1Low45.7Very low319 Ų319173.9 Ų173.9100%1.20486%0.862SS**  trans-38.30-174.2-74.1178.5174.7167.9-3.1115.3

Retrieved 180 of 180 residues in 182.3 ms (Link to these results)