A0A087XJ61_POEFO Loading...

Calcium/calmodulin-dependent protein kinase II inhibitor 2

AlphaFold DB (A0A3B3V4A6), UniProt , Accession A0A087XJ61, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 79 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
1M43.1Very low57.9Low247 Ų247160.3 Ų160.3100%1.21784%0.837SS**  096.20-74.6161.8160.900106.8
2S58.9Low57.5Low115 Ų115162.3 Ų162.380%0.80484%0.842SS**  trans-94.8115.3175.4530000108.1V4S2-V4 PolarHBondContact O-N 3.48Å
3E55.8Low56.9Low187 Ų187158.5 Ų158.587%0.87484%0.839SS**PPolyproline II helixtrans-65.5121.1176-68.2-173.9156.200109.9
4V63.1Low56.6Low131 Ų131152.4 Ų152.479%0.79483%0.832SS**PPolyproline II helixtrans-79.6118.3169.7169.30000107.1S2S2-V4 PolarHBondContact O-N 3.48Å
5L61.5Low56Low145 Ų145157.7 Ų157.776%0.75984%0.837SS**PPolyproline II helixtrans-72130.2167.7-70.5174.4000109Y7L5-Y7 PolarHBondContact O-N 3.03Å; L5-Y7 VanDerWaalsContact O-N 3.15Å
6P59.9Low55.1Low112 Ų112152.4 Ų152.473%0.72783%0.832SS**  trans-71.4113179.527.3-30.8000108.9N8P6-N8 PolarHBondContact O-N 2.88Å
7Y57.1Low54.8Low228 Ų228150.1 Ų150.189%0.89484%0.838SS**  trans-53.5117.3156.8-82.6-88.7000107.1L5 E9L5-Y7 PolarHBondContact O-N 3.03Å; L5-Y7 VanDerWaalsContact O-N 3.15Å; Y7-E9 PolarHBondContact O-N 3.04Å; Y7-E9 VanDerWaalsContact O-N 3.11Å
8N59.5Low54.3Low148 Ų148149.2 Ų149.279%0.79183%0.831SS**  trans-68.8105.4-171.9-164.7-38000109P6 G10P6-N8 PolarHBondContact O-N 2.88Å; N8-G10 PolarHBondContact O-N 3.23Å; N8-G10 PolarHBondContact OD1-N 3.44Å
9E59Low54.3Low195 Ų195147.1 Ų147.191%0.91183%0.827SS**G310 helixtrans-64.79.7175.4-69.3-158.2147.600113.7Y7 K11Y7-E9 PolarHBondContact O-N 3.04Å; Y7-E9 VanDerWaalsContact O-N 3.11Å; E9-K11 PolarHBondContact O-N 3.29Å
10G59.5Low54.2Low54 Ų54148.1 Ų148.156%0.55783%0.825SS**G310 helixtrans-82-5.8-169.300000117.1N8N8-G10 PolarHBondContact O-N 3.23Å; N8-G10 PolarHBondContact OD1-N 3.44Å
11K59.4Low54Low201 Ų201147.2 Ų147.287%0.87482%0.823SS**G310 helixtrans-144.658.2-178-65.2-156.9-176.6-167.40114.6E9E9-K11 PolarHBondContact O-N 3.29Å
12M53.2Low54.6Low184 Ų184140 Ų14091%0.90680%0.798SS**  trans-120.684.4152.3-13110085.600107.7G14M12-G14 PolarHBondContact O-N 2.66Å; M12-G14 VanDerWaalsContact O-N 3.07Å
13S49.3Very low54.5Low114 Ų114142.8 Ų142.880%0.79780%0.797SS**  trans-67.5107.2168.7-159.80000106.6Y15S13-Y15 PolarHBondContact O-N 3.15Å
14G53.8Low54.7Low72 Ų72140.5 Ų140.574%0.74279%0.788SS**  trans-60122.2-175.900000111M12M12-G14 PolarHBondContact O-N 2.66Å; M12-G14 VanDerWaalsContact O-N 3.07Å
15Y47.1Very low54.6Low233 Ų233138.8 Ų138.891%0.91478%0.782SS**  trans-84.6120.4164.5-88.5-87.5000109.1S13S13-Y15 PolarHBondContact O-N 3.15Å
16G41.6Very low54.3Low73 Ų73140.2 Ų140.275%0.75378%0.783SS**  trans85.6110.6141.900000116.1D18G16-D18 PolarHBondContact O-N 3Å
17A49.5Very low54.3Low112 Ų112140.1 Ų140.193%0.92679%0.785SS**  trans-51.4111.9164.900000112.3
18D45.6Very low54.4Low134 Ų134134.9 Ų134.972%0.71778%0.78SS**  trans-156.1117.3134.7-159.6-108.5000108.8G16 E20G16-D18 PolarHBondContact O-N 3Å; D18-E20 PolarHBondContact O-N 2.81Å
19S54.3Low54.4Low109 Ų109130.8 Ų130.876%0.76277%0.773SS**  trans-91.944.7-165.7-179.80000111.8
20E52.9Low54.5Low168 Ų168129.7 Ų129.779%0.78577%0.772SS**  trans-148.128.9-174.3-65-66.6151.900115D18D18-E20 PolarHBondContact O-N 2.81Å
21V50.1Low54.9Low129 Ų129135.4 Ų135.478%0.78278%0.784SS**SBendtrans-108.893.1167.1-164.90000108.7Q23V21-Q23 PolarHBondContact O-N 2.62Å
22S56.4Low55Low97 Ų97131.9 Ų131.968%0.67878%0.775SS**  trans-27.3105.3166.6174.40000110.5M24S22-M24 VanDerWaalsContact C-N 3.31Å; S22-M24 PolarHBondContact O-N 2.82Å
23Q56.9Low55.3Low172 Ų172126.9 Ų126.980%0.80476%0.755SS**  trans-53.195.6175-179.9-180-5.800108.1V21 S25V21-Q23 PolarHBondContact O-N 2.62Å; Q23-S25 VanDerWaalsContact C-N 3.28Å; Q23-S25 PolarHBondContact O-N 3.34Å
24M58.4Low55.9Low139 Ų139124.5 Ų124.569%0.68574%0.739SS**  trans-71.392.5176.4-67.5-170-17000107S22 F26S22-M24 VanDerWaalsContact C-N 3.31Å; S22-M24 PolarHBondContact O-N 2.82Å; M24-F26 HydrophobicContact CB-CE2 4Å; M24-F26 HydrophobicContact CB-CZ 4.09Å; M24-F26 VanDerWaalsContact O-CD2 3.23Å; M24-F26 WeakPolarHBondContact O-CD2 3.03Å; M24-F26 PolarHBondContact O-N 2.95Å; M24-F26 HydrophobicContact SD-CZ 4.44Å
25S61.4Low56.2Low95 Ų95124.5 Ų124.566%0.66473%0.732SS**  trans-64.698.3168.4-65.80000108Q23 S27Q23-S25 VanDerWaalsContact C-N 3.28Å; Q23-S25 PolarHBondContact O-N 3.34Å; S25-S27 PolarHBondContact O-N 3.31Å
26F55.3Low56.7Low176 Ų176121.3 Ų121.377%0.77272%0.722SS**  trans-73.577.5169.3-63-81.9000108.7M24 C28M24-F26 HydrophobicContact CB-CE2 4Å; M24-F26 HydrophobicContact CB-CZ 4.09Å; M24-F26 VanDerWaalsContact O-CD2 3.23Å; M24-F26 WeakPolarHBondContact O-CD2 3.03Å; M24-F26 PolarHBondContact O-N 2.95Å; M24-F26 HydrophobicContact SD-CZ 4.44Å; F26-C28 PolarHBondContact O-N 2.95Å
27S59.7Low57.5Low110 Ų110124.6 Ų124.677%0.76972%0.716SS**  trans-73.382.516260.20000107.6S25 G29S25-S27 PolarHBondContact O-N 3.31Å; S27-G29 PolarHBondContact O-N 2.96Å
28C58.4Low57.8Low118 Ų118123.4 Ų123.480%0.79771%0.706SS**  trans-71.589.6164.264.50000107F26 L30F26-C28 PolarHBondContact O-N 2.95Å; C28-L30 PolarHBondContact O-N 3.04Å
29G60.4Low58.2Low61 Ų61120.5 Ų120.563%0.62970%0.701SS**  trans-55.4117.3167.600000107.4S27 Q31S27-G29 PolarHBondContact O-N 2.96Å; G29-Q31 VanDerWaalsContact C-N 3.27Å; G29-Q31 PolarHBondContact O-N 2.76Å
30L61.5Low58.4Low172 Ų172120.4 Ų120.490%0.90170%0.701SS**  trans-61.996173.6-165.588.6000106.3C28 D32C28-L30 PolarHBondContact O-N 3.04Å; L30-D32 PolarHBondContact O-N 2.96Å
31Q67.1Low58.7Low175 Ų175120 Ų12082%0.81870%0.699SS**  trans-60.4137.8177.8-69.5-168.8-4.900108.3G29 T33G29-Q31 VanDerWaalsContact C-N 3.27Å; G29-Q31 PolarHBondContact O-N 2.76Å; Q31-T33 PolarHBondContact O-N 2.87Å
32D62.2Low59.1Low126 Ų126118.9 Ų118.967%0.67470%0.702SS**  trans-53113.6176.7-179.712000109.8L30 S34L30-D32 PolarHBondContact O-N 2.96Å; D32-S34 PolarHBondContact O-N 2.89Å; D32-S34 WeakPolarHBondContact OD1-CB 3.45Å; D32-S34 PolarHBondContact OD1-N 2.92Å; D32-S34 PolarHBondContact OD1-OG 3.4Å; D32-S34 WeakPolarHBondContact OD2-CB 3.17Å; D32-S34 PolarHBondContact OD2-OG 2.82Å
33T60.3Low59.6Low80 Ų80123.4 Ų123.449%0.49171%0.71SS.*THydrogen-bonded Turntrans-77.91-178.755.90000112.2Q31 A35 F36 F37Q31-T33 PolarHBondContact O-N 2.87Å; T33-A35 PolarHBondContact O-N 3.28Å; T33-F36 WeakPolarHBondContact O-CB 3.33Å; T33-F36 PolarHBondContact O-N 3.34Å; T33-F37 WeakPolarHBondContact O-CD2 3.47Å; T33-F37 PolarHBondContact O-N 3.45Å
34S60.1Low60.7Low64 Ų64125.4 Ų125.445%0.44871%0.71SS.*Hα-helixtrans-53.2-39.4175.869.80000112.1D32 A38D32-S34 PolarHBondContact O-N 2.89Å; D32-S34 WeakPolarHBondContact OD1-CB 3.45Å; D32-S34 PolarHBondContact OD1-N 2.92Å; D32-S34 PolarHBondContact OD1-OG 3.4Å; D32-S34 WeakPolarHBondContact OD2-CB 3.17Å; D32-S34 PolarHBondContact OD2-OG 2.82Å; S34-A38 WeakPolarHBondContact O-CB 3.23Å; S34-A38 PolarHBondContact O-N 3.31Å
35A60.2Low61.9Low72 Ų72124 Ų12460%0.59571%0.711SS**Hα-helixtrans-74.6-23.7177.100000113.9T33T33-A35 PolarHBondContact O-N 3.28Å
36F58.8Low63Low165 Ų165123.6 Ų123.672%0.72471%0.706SS**Hα-helixtrans-71-36.1177.3-171.7-98000111.6T33T33-F36 WeakPolarHBondContact O-CB 3.33Å; T33-F36 PolarHBondContact O-N 3.34Å
37F58.4Low64.6Low143 Ų143122.3 Ų122.363%0.62770%0.701SS**Hα-helixtrans-98.9-23.6179.4-63.8-77.4000114T33 A39 S40T33-F37 WeakPolarHBondContact O-CD2 3.47Å; T33-F37 PolarHBondContact O-N 3.45Å; F37-A39 VanDerWaalsContact C-N 3.3Å; F37-A39 PolarHBondContact O-N 2.84Å; F37-S40 PolarHBondContact O-N 3.08Å
38A55.1Low65.9Low86 Ų86123.2 Ų123.271%0.71170%0.696SS**Hα-helixtrans-72.5-22.4176.800000113.1S34 S40S34-A38 WeakPolarHBondContact O-CB 3.23Å; S34-A38 PolarHBondContact O-N 3.31Å; A38-S40 PolarHBondContact O-N 3.37Å
39A54.9Low67.3Low73 Ų73121.2 Ų121.260%0.60370%0.695SS**  trans-81.247.2165.900000111.2F37 Q41F37-A39 VanDerWaalsContact C-N 3.3Å; F37-A39 PolarHBondContact O-N 2.84Å; A39-Q41 PolarHBondContact O-N 3.37Å
40S58.2Low68.7Low108 Ų108125 Ų12576%0.75570%0.697SS**  trans-72.863.9168-170.50000110.2F37 A38F37-S40 PolarHBondContact O-N 3.08Å; A38-S40 PolarHBondContact O-N 3.37Å
41Q58.8Low69.8Low160 Ų160121.3 Ų121.375%0.74868%0.677SS**SBendtrans-107.5115.8139.4-68.4-136.5-24.300104.5A39 K43A39-Q41 PolarHBondContact O-N 3.37Å; Q41-K43 PolarHBondContact O-N 3.19Å
42A58.2Low70.7Confident104 Ų104116.3 Ų116.386%0.8667%0.672SS**  trans-52.681.4173.800000110.1R44A42-R44 PolarHBondContact O-N 3.45Å
43K67.3Low72Confident193 Ų193119.3 Ų119.384%0.83967%0.674SS**  trans-73.491172.6-70.7-155.9-177.6-176.30104.8Q41Q41-K43 PolarHBondContact O-N 3.19Å
44R79Confident73.3Confident213 Ų213120.3 Ų120.380%0.80469%0.69SS**  trans-40.5135.1169.9-147.7178.2-177.592.21.3107.8A42A42-R44 PolarHBondContact O-N 3.45Å
45P84.3Confident74.7Confident109 Ų109126.5 Ų126.571%0.70871%0.709SS**PPolyproline II helixtrans-47.6139.2177.2-28.734.4000110.6K47P45-K47 PolarHBondContact O-N 3.11Å
46P83.8Confident75.9Confident87 Ų87131.6 Ų131.657%0.56572%0.72SS**PPolyproline II helixtrans-57.6135.2-175.323.7-33.3000110Q50 I51P46-Q50 HydrophobicContact CB-CB 4.41Å; P46-I51 HydrophobicContact CB-CG1 4.46Å
47K89.8Confident77.3Confident149 Ų149129.9 Ų129.965%0.64872%0.723SS**PPolyproline II helixtrans-69.3156.2174.5-65.3-178.9-179.2172.70109.5P45 G49 Q50P45-K47 PolarHBondContact O-N 3.11Å; K47-G49 PolarHBondContact O-N 3.07Å; K47-G49 VanDerWaalsContact O-N 3.08Å; K47-Q50 HydrophobicContact CB-CG 4.46Å; K47-Q50 WeakPolarHBondContact O-CB 3.43Å; K47-Q50 PolarHBondContact O-N 3.15Å
48L86.7Confident78.9Confident129 Ų129129.2 Ų129.268%0.67573%0.73SS**G310 helixtrans-52-36.1179.1-175.460.8000113.4Q50 I51L48-Q50 VanDerWaalsContact C-N 3.27Å; L48-Q50 PolarHBondContact O-N 3.22Å; L48-I51 PolarHBondContact O-N 2.88Å
49G87.8Confident80.6Confident76 Ų76129.8 Ų129.878%0.78472%0.721SS**G310 helixtrans-73.2-10.7177.100000115.6K47K47-G49 PolarHBondContact O-N 3.07Å; K47-G49 VanDerWaalsContact O-N 3.08Å
50Q89.6Confident82.4Confident142 Ų142135.6 Ų135.666%0.66474%0.735SS**G310 helixtrans-97.4-8.8177.1-62.7177.7-50.600112.4P46 K47 L48P46-Q50 HydrophobicContact CB-CB 4.41Å; K47-Q50 HydrophobicContact CB-CG 4.46Å; K47-Q50 WeakPolarHBondContact O-CB 3.43Å; K47-Q50 PolarHBondContact O-N 3.15Å; L48-Q50 VanDerWaalsContact C-N 3.27Å; L48-Q50 PolarHBondContact O-N 3.22Å
51I86.3Confident84.1Confident93 Ų93133.3 Ų133.348%0.47772%0.715SS.*SBendtrans-83.2124.8178.8-57.4174.5000108.3P46 L48P46-I51 HydrophobicContact CB-CG1 4.46Å; L48-I51 PolarHBondContact O-N 2.88Å
52G85.9Confident85.5Confident70 Ų70133.1 Ų133.172%0.72272%0.719SS**  trans-65.9143.9177.600000112.2
53R88.5Confident87.2Confident190 Ų190136.4 Ų136.472%0.71771%0.709SS**  trans-106.618.8179.6-58.9178.2-175.2-95.4-0.1113K55R53-K55 PolarHBondContact O-N 3.31Å
54A88.6Confident88.3Confident100 Ų100129.3 Ų129.383%0.82668%0.68SS**  trans-70.8-17.6-172.900000114
55K87.9Confident88.6Confident194 Ų194124.7 Ų124.784%0.84367%0.671SS**SBendtrans-114.3131.5176.9-65-173.8179.9-176.70109.2R53R53-K55 PolarHBondContact O-N 3.31Å
56H86.1Confident88.9Confident179 Ų179127.1 Ų127.183%0.82967%0.673SS**  trans-95.2148169.3-67.5-88.5000109.4
57V88.9Confident89Confident130 Ų130127.4 Ų127.479%0.78867%0.673SS**  trans-107.8131.8174.5-177.90000107.1
58V90.5Very high88.8Confident128 Ų128123.7 Ų123.778%0.77666%0.66SS**  trans-84.6131.9171.4179.20000107.7E60V58-E60 HydrophobicContact CG1-CG 4.44Å
59I92Very high88.8Confident98 Ų98125.6 Ų125.650%0.50366%0.663SS.*  trans-109.8113.2176.8-57.4173.5000107.2D61 I64I59-D61 HydrophobicContact CG2-CB 4.15Å; I59-D61 PolarHBondContact O-N 3.07Å; I59-D61 VanDerWaalsContact O-N 3.13Å; I59-I64 HydrophobicContact CB-CG1 4.45Å; I59-I64 HydrophobicContact CB-CG2 4.43Å; I59-I64 HydrophobicContact CD1-CD1 4.31Å; I59-I64 HydrophobicContact CD1-CG1 3.98Å; I59-I64 HydrophobicContact CG2-CB 4.24Å; I59-I64 HydrophobicContact CG2-CG1 4.13Å; I59-I64 HydrophobicContact CG2-CG2 4.36Å
60E92.6Very high88.4Confident196 Ų196125.2 Ų125.292%0.91666%0.659SS**  trans-86.951.8179.5-59-178.3154.200111V58V58-E60 HydrophobicContact CG1-CG 4.44Å
61D93.5Very high87.6Confident59 Ų59123.3 Ų123.332%0.31665%0.651SS.*  trans-130.5109171.7-172.7-27000107.9I59 R63 I64I59-D61 HydrophobicContact CG2-CB 4.15Å; I59-D61 PolarHBondContact O-N 3.07Å; I59-D61 VanDerWaalsContact O-N 3.13Å; D61-R63 PolarHBondContact O-N 3.16Å; D61-R63 WeakPolarHBondContact OD1-CB 3.37Å; D61-R63 WeakPolarHBondContact OD1-CG 3.31Å; D61-R63 IonicContact OD1-CZ 3.74Å; D61-R63 PolarHBondContact OD1-N 3.23Å; D61-R63 IonicContact OD1-NE 2.94Å; D61-R63 PolarHBondContact OD1-NE 2.91Å; D61-R63 IonicContact OD1-NH2 3.64Å; D61-R63 IonicContact OD2-CZ 3.56Å; D61-R63 IonicContact OD2-NE 3.51Å; D61-R63 IonicContact OD2-NH2 2.76Å; D61-R63 PolarHBondContact OD2-NH2 3.24Å; D61-I64 VanDerWaalsContact O-CB 3.28Å; D61-I64 WeakPolarHBondContact O-CB 3.27Å; D61-I64 WeakPolarHBondContact O-CG2 3Å; D61-I64 PolarHBondContact O-N 3.13Å
62D89.4Confident86.6Confident156 Ų156124.4 Ų124.483%0.83466%0.662SS**THydrogen-bonded Turntrans-59.6-18-175.2-61.5-26.6000113.5I64D62-I64 VanDerWaalsContact C-N 3.3Å
63R92.3Very high85.4Confident173 Ų173128 Ų12865%0.65367%0.665SS**THydrogen-bonded Turntrans-79.9-13.4178-55.9171.4-63.8175.24.4112.5D61 D65 E66 V67D61-R63 PolarHBondContact O-N 3.16Å; D61-R63 WeakPolarHBondContact OD1-CB 3.37Å; D61-R63 WeakPolarHBondContact OD1-CG 3.31Å; D61-R63 IonicContact OD1-CZ 3.74Å; D61-R63 PolarHBondContact OD1-N 3.23Å; D61-R63 IonicContact OD1-NE 2.94Å; D61-R63 PolarHBondContact OD1-NE 2.91Å; D61-R63 IonicContact OD1-NH2 3.64Å; D61-R63 IonicContact OD2-CZ 3.56Å; D61-R63 IonicContact OD2-NE 3.51Å; D61-R63 IonicContact OD2-NH2 2.76Å; D61-R63 PolarHBondContact OD2-NH2 3.24Å; R63-D65 VanDerWaalsContact C-N 3.3Å; R63-D65 PolarHBondContact O-N 3.33Å; R63-E66 PolarHBondContact O-N 3.49Å; R63-V67 PolarHBondContact O-N 2.97Å
64I90.2Very high84.3Confident45 Ų45127.6 Ų127.623%0.23167%0.668CS.*Hα-helixtrans-63.1-38.3-174.5-163.759.9000111.8I59 D61 D62 E66 V67 L68I59-I64 HydrophobicContact CB-CG1 4.45Å; I59-I64 HydrophobicContact CB-CG2 4.43Å; I59-I64 HydrophobicContact CD1-CD1 4.31Å; I59-I64 HydrophobicContact CD1-CG1 3.98Å; I59-I64 HydrophobicContact CG2-CB 4.24Å; I59-I64 HydrophobicContact CG2-CG1 4.13Å; I59-I64 HydrophobicContact CG2-CG2 4.36Å; D61-I64 VanDerWaalsContact O-CB 3.28Å; D61-I64 WeakPolarHBondContact O-CB 3.27Å; D61-I64 WeakPolarHBondContact O-CG2 3Å; D61-I64 PolarHBondContact O-N 3.13Å; D62-I64 VanDerWaalsContact C-N 3.3Å; I64-E66 VanDerWaalsContact C-N 3.31Å; I64-E66 PolarHBondContact O-N 3.21Å; I64-V67 PolarHBondContact O-N 3.43Å; I64-L68 HydrophobicContact CD1-CG 4.35Å; I64-L68 HydrophobicContact CG1-CD1 3.84Å; I64-L68 HydrophobicContact CG1-CG 4.06Å; I64-L68 WeakPolarHBondContact O-CB 3.46Å; I64-L68 VanDerWaalsContact O-CG 3.27Å; I64-L68 WeakPolarHBondContact O-CG 3.28Å; I64-L68 PolarHBondContact O-N 2.91Å
65D86.7Confident83.1Confident116 Ų116128 Ų12862%0.6267%0.665SS**Hα-helixtrans-63.1-38.4-177.5-69.6-29.2000112R63 L68 K69R63-D65 VanDerWaalsContact C-N 3.3Å; R63-D65 PolarHBondContact O-N 3.33Å; D65-L68 PolarHBondContact O-N 3.37Å; D65-K69 VanDerWaalsContact O-CB 3.31Å; D65-K69 WeakPolarHBondContact O-CB 3.5Å; D65-K69 PolarHBondContact O-N 3.37Å
66E89.9Confident81.9Confident159 Ų159123.6 Ų123.674%0.74366%0.658SS**Hα-helixtrans-64.5-42.5177.1-172.5177.9177.700111.6R63 I64R63-E66 PolarHBondContact O-N 3.49Å; I64-E66 VanDerWaalsContact C-N 3.31Å; I64-E66 PolarHBondContact O-N 3.21Å
67V86.9Confident80.8Confident93 Ų93120.6 Ų120.656%0.56466%0.655SS**Hα-helixtrans-67.8-41.3177.61790000111.2R63 I64 M71R63-V67 PolarHBondContact O-N 2.97Å; I64-V67 PolarHBondContact O-N 3.43Å; V67-M71 HydrophobicContact CG1-CE 4.17Å
68L84.9Confident79.4Confident72 Ų72117.7 Ų117.738%0.37765%0.652SS.*Hα-helixtrans-72.5-27-178.9-67.9-178.9000113.1I64 D65 G70 M71I64-L68 HydrophobicContact CD1-CG 4.35Å; I64-L68 HydrophobicContact CG1-CD1 3.84Å; I64-L68 HydrophobicContact CG1-CG 4.06Å; I64-L68 WeakPolarHBondContact O-CB 3.46Å; I64-L68 VanDerWaalsContact O-CG 3.27Å; I64-L68 WeakPolarHBondContact O-CG 3.28Å; I64-L68 PolarHBondContact O-N 2.91Å; D65-L68 PolarHBondContact O-N 3.37Å; L68-G70 VanDerWaalsContact C-N 3.28Å; L68-G70 PolarHBondContact O-N 2.93Å; L68-M71 HydrophobicContact CD2-CE 3.74Å; L68-M71 HydrophobicContact CD2-CG 4.36Å; L68-M71 HydrophobicContact CD2-SD 3.37Å; L68-M71 WeakPolarHBondContact CD2-SD 3.32Å; L68-M71 WeakPolarHBondContact O-CG 3.08Å; L68-M71 PolarHBondContact O-N 2.99Å
69K86.3Confident77.3Confident169 Ų169121.8 Ų121.874%0.73568%0.676SS**Hα-helixtrans-60.7-34.2-178.9-175.1169.2172.2-1780113.2D65 M71D65-K69 VanDerWaalsContact O-CB 3.31Å; D65-K69 WeakPolarHBondContact O-CB 3.5Å; D65-K69 PolarHBondContact O-N 3.37Å; K69-M71 PolarHBondContact O-N 3.38Å
70G80.1Confident76.6Confident68 Ų68123 Ų12370%0.70169%0.685SS**THydrogen-bonded Turntrans-81.3-5.5-179.900000115.6L68L68-G70 VanDerWaalsContact C-N 3.28Å; L68-G70 PolarHBondContact O-N 2.93Å
71M72.9Confident75.7Confident102 Ų102119.2 Ų119.250%0.50267%0.673SS.*THydrogen-bonded Turntrans-109.5-8.5-175.556.9170.777.800114.6V67 L68 K69 D73V67-M71 HydrophobicContact CG1-CE 4.17Å; L68-M71 HydrophobicContact CD2-CE 3.74Å; L68-M71 HydrophobicContact CD2-CG 4.36Å; L68-M71 HydrophobicContact CD2-SD 3.37Å; L68-M71 WeakPolarHBondContact CD2-SD 3.32Å; L68-M71 WeakPolarHBondContact O-CG 3.08Å; L68-M71 PolarHBondContact O-N 2.99Å; K69-M71 PolarHBondContact O-N 3.38Å; M71-D73 VanDerWaalsContact C-N 3.28Å; M71-D73 PolarHBondContact O-N 2.76Å
72T64.2Low74.7Confident116 Ų116122.5 Ų122.571%0.71269%0.693SS**THydrogen-bonded Turntrans-65.2-25.7-179-88.60000113.7K74T72-K74 VanDerWaalsContact C-N 3.25Å; T72-K74 PolarHBondContact O-N 3.07Å
73D62.2Low73.9Confident144 Ų144120.5 Ų120.577%0.7769%0.685SS**THydrogen-bonded Turntrans-78.5-2.5-174-59.6-59.3000114.7M71 S75M71-D73 VanDerWaalsContact C-N 3.28Å; M71-D73 PolarHBondContact O-N 2.76Å; D73-S75 PolarHBondContact O-N 2.94Å
74K65.2Low72.7Confident183 Ų183117.3 Ų117.380%0.79669%0.686SS**SBendtrans-83.798.7173.5-65.2-96.7178.3167.10107.4T72 S76T72-K74 VanDerWaalsContact C-N 3.25Å; T72-K74 PolarHBondContact O-N 3.07Å; K74-S76 PolarHBondContact O-N 3.29Å; K74-S76 VanDerWaalsContact O-N 3.16Å
75S62.6Low71.6Confident107 Ų107122.1 Ų122.175%0.74872%0.717SS**  trans-47127.4174.272.30000109.4D73D73-S75 PolarHBondContact O-N 2.94Å
76S62.4Low70.5Confident102 Ų102122.5 Ų122.571%0.71372%0.724SS**  trans-51.6125.6172.3-175.60000108.1K74 G78K74-S76 PolarHBondContact O-N 3.29Å; K74-S76 VanDerWaalsContact O-N 3.16Å; S76-G78 PolarHBondContact O-N 3.47Å
77P62.3Low69Low116 Ų116119.7 Ų119.775%0.75372%0.722SS**  trans-58.6109.6170.1-1426.2000105.8V79P77-V79 PolarHBondContact O-N 3.21Å
78G60.5Low67.5Low70 Ų70121.9 Ų121.972%0.72274%0.736SS**  trans-49.9138.818000000110S76S76-G78 PolarHBondContact O-N 3.47Å
79V46.6Very low65.9Low214 Ų214126.5 Ų126.5100%1.29777%0.768SS**  trans-70.30171.1-176.70000109.2P77P77-V79 PolarHBondContact O-N 3.21Å

Retrieved 79 of 79 residues in 161 ms (Link to these results)