A0A087YPI6_POEFO Loading...

Melan-A

AlphaFold DB , UniProt , Accession A0A087YPI6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 120 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
1M42.8Very low54.4Low256 Ų256156.4 Ų156.4100%1.26185%0.845SS**  0111.90-97.5169.3162.900108.1
2L51.2Low54.8Low161 Ų161146.7 Ų146.784%0.84381%0.809SS**  trans-101.2124.9174.8-158.697.8000106.7
3C48.9Very low55Low125 Ų125147.2 Ų147.285%0.84581%0.81SS**  trans-175.593160-94.60000108.1
4N61.6Low55.3Low143 Ų143149.1 Ų149.177%0.76581%0.807SS**  52.297.392.3-100.9-40.7000116
5R54.9Low55.3Low240 Ų240149.3 Ų149.391%0.90681%0.807SS**  trans-169.481.6133.5-119.8177.4-174.8145.40.4109.7A7R5-A7 PolarHBondContact O-N 3.36Å
6T54.4Low55.4Low140 Ų140145.1 Ų145.186%0.85979%0.788SS**  trans-6389.5150.631.40000106.8G8T6-G8 PolarHBondContact O-N 3.31Å
7A57.8Low55.4Low90 Ų90149.9 Ų149.974%0.74479%0.794SS**  trans-66.483.2167.300000107.2R5 M9R5-A7 PolarHBondContact O-N 3.36Å; A7-M9 VanDerWaalsContact C-N 3.33Å; A7-M9 PolarHBondContact O-N 2.89Å
8G60.2Low55Low65 Ų65151.1 Ų151.167%0.6779%0.791SS**  trans-60.899.716300000108.2T6T6-G8 PolarHBondContact O-N 3.31Å
9M51.6Low54.7Low162 Ų162149 Ų14980%0.79880%0.798SS**  trans-118.9109.6140.1-111.4103.5135.100105.4A7 R11A7-M9 VanDerWaalsContact C-N 3.33Å; A7-M9 PolarHBondContact O-N 2.89Å; M9-R11 PolarHBondContact O-N 3.02Å
10P57.2Low54.9Low121 Ų121147 Ų14779%0.78680%0.796SS**  trans-62.2101.8148.228.2-26.8000104G12P10-G12 PolarHBondContact O-N 3.38Å
11R57.9Low54.9Low217 Ų217142.9 Ų142.982%0.81979%0.788SS**  trans-56.7100.3156.6-81.3-174.1149.891.30.5103.1M9 D13M9-R11 PolarHBondContact O-N 3.02Å; R11-D13 PolarHBondContact O-N 2.94Å
12G58.8Low55.4Low40 Ų40142.5 Ų142.541%0.41277%0.773SS.*  trans-56.2102.9172.700000105P10 F14P10-G12 PolarHBondContact O-N 3.38Å; G12-F14 WeakPolarHBondContact O-CD2 3.2Å; G12-F14 PolarHBondContact O-N 3.02Å
13D57.9Low55.3Low154 Ų154143.7 Ų143.782%0.82477%0.766SS**  trans-67.773.3162.1-66.7-41.3000105.2R11 N15R11-D13 PolarHBondContact O-N 2.94Å; D13-N15 PolarHBondContact O-N 3.32Å
14F59.7Low55.6Low174 Ų174141 Ų14176%0.76376%0.76SS**  trans-67.382.8157.3-52.8-74.3000103.7G12 V16G12-F14 WeakPolarHBondContact O-CD2 3.2Å; G12-F14 PolarHBondContact O-N 3.02Å; F14-V16 HydrophobicContact CB-CG2 3.99Å; F14-V16 WeakPolarHBondContact O-CG2 3.47Å; F14-V16 PolarHBondContact O-N 2.98Å
15N55.4Low55.1Low151 Ų151141.5 Ų141.581%0.80775%0.752SS**  trans-67.577.7165-164.3-0.5000105.4D13 Y17D13-N15 PolarHBondContact O-N 3.32Å; N15-Y17 VanDerWaalsContact C-N 3.32Å; N15-Y17 PolarHBondContact O-N 3.27Å
16V55.8Low55Low83 Ų83135 Ų13550%0.50374%0.739SS.*  trans-65.4100.5176.8-178.30000105.1F14 F18F14-V16 HydrophobicContact CB-CG2 3.99Å; F14-V16 WeakPolarHBondContact O-CG2 3.47Å; F14-V16 PolarHBondContact O-N 2.98Å; V16-F18 HydrophobicContact CB-CD2 4.1Å; V16-F18 HydrophobicContact CB-CE2 4.2Å; V16-F18 HydrophobicContact CG1-CD2 3.58Å; V16-F18 HydrophobicContact CG1-CE2 3.32Å; V16-F18 HydrophobicContact CG1-CZ 4.22Å; V16-F18 WeakPolarHBondContact O-CD2 3.39Å; V16-F18 PolarHBondContact O-N 2.74Å
17Y55.5Low55.3Low226 Ų226138.1 Ų138.189%0.88674%0.735SS**SBendtrans8.857.7138.1-92.8-93.1000116.5N15N15-Y17 VanDerWaalsContact C-N 3.32Å; N15-Y17 PolarHBondContact O-N 3.27Å
18F47.9Very low55.3Low171 Ų171138 Ų13875%0.7573%0.734SS**  trans-128.649167.5-69.6-67.4000109.4V16 S20V16-F18 HydrophobicContact CB-CD2 4.1Å; V16-F18 HydrophobicContact CB-CE2 4.2Å; V16-F18 HydrophobicContact CG1-CD2 3.58Å; V16-F18 HydrophobicContact CG1-CE2 3.32Å; V16-F18 HydrophobicContact CG1-CZ 4.22Å; V16-F18 WeakPolarHBondContact O-CD2 3.39Å; V16-F18 PolarHBondContact O-N 2.74Å; F18-S20 PolarHBondContact O-N 2.82Å
19A49.5Very low55.4Low112 Ų112142.7 Ų142.793%0.92674%0.739SS**  trans-75.654.6149.300000109G21A19-G21 PolarHBondContact O-N 2.77Å
20S59.2Low55.8Low109 Ų109138 Ų13876%0.76272%0.715SS**  trans-74.5102.8162.7163.80000107.1F18F18-S20 PolarHBondContact O-N 2.82Å
21G55.9Low56.5Low61 Ų61135.4 Ų135.463%0.62970%0.703SS**SBendtrans99.5124.5151.100000115.7A19A19-G21 PolarHBondContact O-N 2.77Å
22R52.5Low57.6Low248 Ų248130 Ų13094%0.93669%0.694SS**  trans70.964.9153.1-56.5-177.1-177.5-138.91.8117.1
23R48.7Very low58.9Low186 Ų186129.9 Ų129.970%0.70269%0.693SS**  trans-156.9116.4140-116.1164.5169.9168.8-5.1108.4Y25R23-Y25 VanDerWaalsContact C-N 3.28Å; R23-Y25 HydrophobicContact CB-CD2 3.51Å; R23-Y25 HydrophobicContact CB-CE2 3.24Å; R23-Y25 HydrophobicContact CB-CG 4.28Å; R23-Y25 WeakPolarHBondContact CD-OH 3.22Å; R23-Y25 HydrophobicContact CG-CE2 4.14Å; R23-Y25 VanDerWaalsContact O-CD2 3.23Å; R23-Y25 WeakPolarHBondContact O-CD2 3.1Å; R23-Y25 PolarHBondContact O-N 3.43Å
24G54.4Low60.3Low69 Ų69127.4 Ų127.471%0.71168%0.679SS**  trans-58.699.7161.500000106.9V26G24-V26 VanDerWaalsContact C-N 3.31Å; G24-V26 PolarHBondContact O-N 3.42Å
25Y51.6Low61.7Low152 Ų152120.9 Ų120.960%0.59666%0.66SS**  trans-97.970.4179.6-86.3-73000105.8R23 R27 E30R23-Y25 VanDerWaalsContact C-N 3.28Å; R23-Y25 HydrophobicContact CB-CD2 3.51Å; R23-Y25 HydrophobicContact CB-CE2 3.24Å; R23-Y25 HydrophobicContact CB-CG 4.28Å; R23-Y25 WeakPolarHBondContact CD-OH 3.22Å; R23-Y25 HydrophobicContact CG-CE2 4.14Å; R23-Y25 VanDerWaalsContact O-CD2 3.23Å; R23-Y25 WeakPolarHBondContact O-CD2 3.1Å; R23-Y25 PolarHBondContact O-N 3.43Å; Y25-R27 PolarHBondContact O-N 3.37Å; Y25-E30 WeakPolarHBondContact CA-OE1 3.25Å; Y25-E30 PolarHBondContact N-OE1 2.65Å; Y25-E30 VanDerWaalsContact O-CG 3.24Å; Y25-E30 WeakPolarHBondContact O-CG 3.2Å
26V53.9Low63.4Low105 Ų105119.1 Ų119.164%0.63665%0.65SS**  trans-7162.7175-163.60000109.7G24 E30G24-V26 VanDerWaalsContact C-N 3.31Å; G24-V26 PolarHBondContact O-N 3.42Å; V26-E30 VanDerWaalsContact CA-CD 3.43Å; V26-E30 WeakPolarHBondContact CA-OE2 3.05Å; V26-E30 HydrophobicContact CB-CB 4.06Å; V26-E30 HydrophobicContact CB-CG 4.45Å; V26-E30 WeakPolarHBondContact CB-OE2 3.49Å; V26-E30 HydrophobicContact CG1-CB 3.69Å; V26-E30 HydrophobicContact CG2-CB 4.37Å; V26-E30 WeakPolarHBondContact CG2-OE2 3.32Å; V26-E30 PolarHBondContact N-OE2 2.81Å; V26-E30 VanDerWaalsContact N-OE2 3.12Å
27R59.8Low65.1Low205 Ų205119.8 Ų119.877%0.77465%0.65SS**SBendtrans-70156.2149.2-100.8-173.5168.1-153.2-1.9106.8Y25 E29 E30Y25-R27 PolarHBondContact O-N 3.37Å; R27-E29 PolarHBondContact O-N 2.97Å; R27-E30 PolarHBondContact O-N 3.37Å
28A59Low66.9Low88 Ų88113.2 Ų113.273%0.72763%0.633SS**THydrogen-bonded Turntrans-43.2-21.8-173.100000116.9E30A28-E30 VanDerWaalsContact C-N 3.34Å; A28-E30 PolarHBondContact O-N 2.75Å
29E60.5Low69.2Low163 Ų163110 Ų11076%0.76263%0.628SS**Hα-helixtrans-61.8-29.9170.2-63.9-176128.300114.6R27 V32 G33R27-E29 PolarHBondContact O-N 2.97Å; E29-V32 PolarHBondContact O-N 3.28Å; E29-G33 PolarHBondContact O-N 3.45Å
30E60.9Low71.4Confident63 Ų63108.2 Ų108.229%0.29461%0.605SS.*Hα-helixtrans-76.6-28.7-179.6-71-160.7176.100112.8Y25 V26 R27 A28 G33 I34Y25-E30 WeakPolarHBondContact CA-OE1 3.25Å; Y25-E30 PolarHBondContact N-OE1 2.65Å; Y25-E30 VanDerWaalsContact O-CG 3.24Å; Y25-E30 WeakPolarHBondContact O-CG 3.2Å; V26-E30 VanDerWaalsContact CA-CD 3.43Å; V26-E30 WeakPolarHBondContact CA-OE2 3.05Å; V26-E30 HydrophobicContact CB-CB 4.06Å; V26-E30 HydrophobicContact CB-CG 4.45Å; V26-E30 WeakPolarHBondContact CB-OE2 3.49Å; V26-E30 HydrophobicContact CG1-CB 3.69Å; V26-E30 HydrophobicContact CG2-CB 4.37Å; V26-E30 WeakPolarHBondContact CG2-OE2 3.32Å; V26-E30 PolarHBondContact N-OE2 2.81Å; V26-E30 VanDerWaalsContact N-OE2 3.12Å; R27-E30 PolarHBondContact O-N 3.37Å; A28-E30 VanDerWaalsContact C-N 3.34Å; A28-E30 PolarHBondContact O-N 2.75Å; E30-G33 PolarHBondContact O-N 3.24Å; E30-I34 WeakPolarHBondContact O-CB 3.4Å; E30-I34 WeakPolarHBondContact O-CD1 3.31Å; E30-I34 WeakPolarHBondContact O-CG1 2.94Å; E30-I34 PolarHBondContact O-N 2.87Å
31A70.6Confident73.2Confident66 Ų66108 Ų10855%0.54560%0.595SS.*Hα-helixtrans-66.9-41.8171.900000111G33 G35A31-G33 VanDerWaalsContact C-N 3.34Å; A31-G35 PolarHBondContact O-N 2.75Å
32V82.8Confident75.1Confident104 Ų104107.4 Ų107.463%0.6358%0.584SS**Hα-helixtrans-65.8-39.1172.3177.70000110.6E29 G35 L36E29-V32 PolarHBondContact O-N 3.28Å; V32-G35 PolarHBondContact O-N 3.25Å; V32-L36 VanDerWaalsContact O-CB 3.3Å; V32-L36 WeakPolarHBondContact O-CB 3.15Å; V32-L36 PolarHBondContact O-N 2.81Å
33G84.6Confident77.2Confident37 Ų3797.5 Ų97.538%0.38156%0.559SS.*Hα-helixtrans-63.5-45.6177.300000113.1E29 E30 A31 L36 L37E29-G33 PolarHBondContact O-N 3.45Å; E30-G33 PolarHBondContact O-N 3.24Å; A31-G33 VanDerWaalsContact C-N 3.34Å; G33-L36 PolarHBondContact O-N 3.46Å; G33-L37 VanDerWaalsContact O-CB 3.29Å; G33-L37 WeakPolarHBondContact O-CB 3.23Å; G33-L37 PolarHBondContact O-N 2.92Å
34I87.3Confident79.4Confident103 Ų10394 Ų9453%0.52855%0.554SS.*Hα-helixtrans-64.9-44.2174.8-64.8160.1000109.9E30 L36 L37 V38E30-I34 WeakPolarHBondContact O-CB 3.4Å; E30-I34 WeakPolarHBondContact O-CD1 3.31Å; E30-I34 WeakPolarHBondContact O-CG1 2.94Å; E30-I34 PolarHBondContact O-N 2.87Å; I34-L36 PolarHBondContact O-N 3.42Å; I34-L37 PolarHBondContact O-N 2.73Å; I34-V38 HydrophobicContact CG2-CG2 4.41Å; I34-V38 VanDerWaalsContact O-CG2 3.31Å; I34-V38 WeakPolarHBondContact O-CG2 3.2Å; I34-V38 PolarHBondContact O-N 2.75Å
35G89.3Confident81.1Confident36 Ų3697.7 Ų97.737%0.37155%0.55SS.*Hα-helixtrans-57.5-47.9176.100000112.3A31 V32 L37 V38 V39A31-G35 PolarHBondContact O-N 2.75Å; V32-G35 PolarHBondContact O-N 3.25Å; G35-L37 PolarHBondContact O-N 3.48Å; G35-V38 PolarHBondContact O-N 3.48Å; G35-V39 VanDerWaalsContact O-CG2 3.31Å; G35-V39 WeakPolarHBondContact O-CG2 3.13Å; G35-V39 PolarHBondContact O-N 2.88Å
36L90.9Very high83.1Confident114 Ų11496.1 Ų96.160%0.59755%0.551SS**Hα-helixtrans-63.7-40.8177-172.6146.6000111.7V32 G33 I34 V38 V39 V40V32-L36 VanDerWaalsContact O-CB 3.3Å; V32-L36 WeakPolarHBondContact O-CB 3.15Å; V32-L36 PolarHBondContact O-N 2.81Å; G33-L36 PolarHBondContact O-N 3.46Å; I34-L36 PolarHBondContact O-N 3.42Å; L36-V38 PolarHBondContact O-N 3.23Å; L36-V39 PolarHBondContact O-N 3.42Å; L36-V40 HydrophobicContact CD2-CG2 4.14Å; L36-V40 WeakPolarHBondContact O-CG2 3.5Å; L36-V40 PolarHBondContact O-N 2.97Å
37L91.4Very high84.9Confident98 Ų9895.9 Ų95.951%0.51355%0.546SS..Hα-helixtrans-61.1-44.7176.3-174.6151000111.4G33 I34 G35 V40 L41G33-L37 VanDerWaalsContact O-CB 3.29Å; G33-L37 WeakPolarHBondContact O-CB 3.23Å; G33-L37 PolarHBondContact O-N 2.92Å; I34-L37 PolarHBondContact O-N 2.73Å; G35-L37 PolarHBondContact O-N 3.48Å; L37-V40 PolarHBondContact O-N 2.97Å; L37-L41 HydrophobicContact CD2-CD1 3.83Å; L37-L41 HydrophobicContact CG-CD1 4.2Å; L37-L41 WeakPolarHBondContact O-CD1 3.48Å; L37-L41 PolarHBondContact O-N 3.33Å
38V94.9Very high86.2Confident87 Ų8787.4 Ų87.453%0.52752%0.522SS..Hα-helixtrans-63-42.7177.11730000111.1I34 G35 L36 L41 A42I34-V38 HydrophobicContact CG2-CG2 4.41Å; I34-V38 VanDerWaalsContact O-CG2 3.31Å; I34-V38 WeakPolarHBondContact O-CG2 3.2Å; I34-V38 PolarHBondContact O-N 2.75Å; G35-V38 PolarHBondContact O-N 3.48Å; L36-V38 PolarHBondContact O-N 3.23Å; V38-L41 PolarHBondContact O-N 3.38Å; V38-A42 WeakPolarHBondContact O-CB 3.36Å; V38-A42 PolarHBondContact O-N 2.95Å
39V96.1Very high87.3Confident105 Ų10585.8 Ų85.864%0.63651%0.505SS*.Hα-helixtrans-61.8-44.8177.51710000111.4G35 L36 A42 G43G35-V39 VanDerWaalsContact O-CG2 3.31Å; G35-V39 WeakPolarHBondContact O-CG2 3.13Å; G35-V39 PolarHBondContact O-N 2.88Å; L36-V39 PolarHBondContact O-N 3.42Å; V39-A42 PolarHBondContact O-N 3.34Å; V39-G43 PolarHBondContact O-N 3.38Å
40V95.7Very high88.6Confident74 Ų7485.9 Ų85.945%0.44850%0.498SS..Hα-helixtrans-64.2-44.9177.3171.80000111.1L36 L37 A42 G43 L44L36-V40 HydrophobicContact CD2-CG2 4.14Å; L36-V40 WeakPolarHBondContact O-CG2 3.5Å; L36-V40 PolarHBondContact O-N 2.97Å; L37-V40 PolarHBondContact O-N 2.97Å; V40-A42 PolarHBondContact O-N 3.36Å; V40-G43 PolarHBondContact O-N 3.48Å; V40-L44 HydrophobicContact CG1-CD1 3.83Å; V40-L44 HydrophobicContact CG1-CG 4.46Å; V40-L44 WeakPolarHBondContact O-CB 3.39Å; V40-L44 WeakPolarHBondContact O-CG 3.45Å; V40-L44 PolarHBondContact O-N 3.43Å
41L95.9Very high89.7Confident105 Ų10589.2 Ų89.255%0.5551%0.509SS..Hα-helixtrans-60.8-43.8175.8-103.276.6000111.8L37 V38 L44 F45L37-L41 HydrophobicContact CD2-CD1 3.83Å; L37-L41 HydrophobicContact CG-CD1 4.2Å; L37-L41 WeakPolarHBondContact O-CD1 3.48Å; L37-L41 PolarHBondContact O-N 3.33Å; V38-L41 PolarHBondContact O-N 3.38Å; L41-L44 PolarHBondContact O-N 3.13Å; L41-F45 VanDerWaalsContact O-CB 3.23Å; L41-F45 WeakPolarHBondContact O-CB 3.47Å; L41-F45 PolarHBondContact O-N 3.44Å
42A96Very high89.6Confident47 Ų4791 Ų9139%0.38851%0.509SS..Hα-helixtrans-62.2-44.5178.200000111.5V38 V39 V40 F45 I46V38-A42 WeakPolarHBondContact O-CB 3.36Å; V38-A42 PolarHBondContact O-N 2.95Å; V39-A42 PolarHBondContact O-N 3.34Å; V40-A42 PolarHBondContact O-N 3.36Å; A42-F45 PolarHBondContact O-N 2.83Å; A42-I46 WeakPolarHBondContact O-CB 3.33Å; A42-I46 VanDerWaalsContact O-CG1 3.23Å; A42-I46 WeakPolarHBondContact O-CG1 3.3Å; A42-I46 PolarHBondContact O-N 3.45Å
43G96.2Very high89.1Confident40 Ų4094.1 Ų94.141%0.41251%0.514SS..Hα-helixtrans-62.3-47176.400000112.8V39 V40 F45 I46 L47V39-G43 PolarHBondContact O-N 3.38Å; V40-G43 PolarHBondContact O-N 3.48Å; G43-F45 VanDerWaalsContact C-N 3.32Å; G43-F45 PolarHBondContact O-N 2.85Å; G43-I46 PolarHBondContact O-N 2.83Å; G43-L47 WeakPolarHBondContact O-CB 3.42Å; G43-L47 PolarHBondContact O-N 3.33Å
44L94.6Very high88.5Confident114 Ų114100.2 Ų100.260%0.59753%0.53SS*.Hα-helixtrans-62.4-38.5175.5-75167.3000112V40 L41 G48V40-L44 HydrophobicContact CG1-CD1 3.83Å; V40-L44 HydrophobicContact CG1-CG 4.46Å; V40-L44 WeakPolarHBondContact O-CB 3.39Å; V40-L44 WeakPolarHBondContact O-CG 3.45Å; V40-L44 PolarHBondContact O-N 3.43Å; L41-L44 PolarHBondContact O-N 3.13Å; L44-G48 WeakPolarHBondContact O-CA 3.31Å; L44-G48 PolarHBondContact O-N 3.49Å
45F91.8Very high87.5Confident146 Ų146103.3 Ų103.364%0.6454%0.535SS*.Hα-helixtrans-68.8-45.7178-172.3-102000111.4L41 A42 G43 L47 G48 C49L41-F45 VanDerWaalsContact O-CB 3.23Å; L41-F45 WeakPolarHBondContact O-CB 3.47Å; L41-F45 PolarHBondContact O-N 3.44Å; A42-F45 PolarHBondContact O-N 2.83Å; G43-F45 VanDerWaalsContact C-N 3.32Å; G43-F45 PolarHBondContact O-N 2.85Å; F45-L47 PolarHBondContact O-N 3.3Å; F45-G48 PolarHBondContact O-N 3.33Å; F45-C49 WeakPolarHBondContact CE1-SG 3.33Å; F45-C49 WeakPolarHBondContact CZ-SG 3.29Å; F45-C49 WeakPolarHBondContact O-CB 3.23Å; F45-C49 PolarHBondContact O-N 2.91Å; F45-C49 PolarHBondContact O-SG 3.46Å
46I92.9Very high85.8Confident118 Ų118103.5 Ų103.561%0.60553%0.531SS*.Hα-helixtrans-62-45.3176.5-67164.8000110.4A42 G43 C49 W50A42-I46 WeakPolarHBondContact O-CB 3.33Å; A42-I46 VanDerWaalsContact O-CG1 3.23Å; A42-I46 WeakPolarHBondContact O-CG1 3.3Å; A42-I46 PolarHBondContact O-N 3.45Å; G43-I46 PolarHBondContact O-N 2.83Å; I46-C49 PolarHBondContact O-N 2.92Å; I46-W50 VanDerWaalsContact O-CB 3.25Å; I46-W50 WeakPolarHBondContact O-CB 3.31Å; I46-W50 PolarHBondContact O-N 3.49Å
47L90.6Very high84.3Confident101 Ų101100.7 Ų100.753%0.52953%0.529SS..Hα-helixtrans-66.7-41.5177.6-174.860.2000111.6G43 F45 W50 Y51G43-L47 WeakPolarHBondContact O-CB 3.42Å; G43-L47 PolarHBondContact O-N 3.33Å; F45-L47 PolarHBondContact O-N 3.3Å; L47-W50 HydrophobicContact CD1-CE3 4.07Å; L47-W50 PolarHBondContact O-N 3.02Å; L47-Y51 WeakPolarHBondContact O-CB 3.47Å; L47-Y51 PolarHBondContact O-N 3.24Å
48G87.8Confident82.5Confident27 Ų27105.8 Ų105.828%0.27854%0.543SS..Hα-helixtrans-62.4-46.817500000111.8L44 F45 Y51 L52L44-G48 WeakPolarHBondContact O-CA 3.31Å; L44-G48 PolarHBondContact O-N 3.49Å; F45-G48 PolarHBondContact O-N 3.33Å; G48-Y51 PolarHBondContact O-N 2.89Å; G48-L52 WeakPolarHBondContact O-CB 3.24Å; G48-L52 WeakPolarHBondContact O-CG 3.19Å; G48-L52 PolarHBondContact O-N 3.36Å
49C83.2Confident80.5Confident54 Ų54108.5 Ų108.537%0.36555%0.547SS..Hα-helixtrans-63.3-41.2174.2-74.20000111.8F45 I46 K53F45-C49 WeakPolarHBondContact CE1-SG 3.33Å; F45-C49 WeakPolarHBondContact CZ-SG 3.29Å; F45-C49 WeakPolarHBondContact O-CB 3.23Å; F45-C49 PolarHBondContact O-N 2.91Å; F45-C49 PolarHBondContact O-SG 3.46Å; I46-C49 PolarHBondContact O-N 2.92Å; C49-K53 WeakPolarHBondContact O-CA 3.48Å; C49-K53 WeakPolarHBondContact O-CB 3.42Å; C49-K53 PolarHBondContact O-N 3.08Å
50W87.6Confident78.5Confident164 Ų164109.9 Ų109.962%0.62155%0.55SS*.Hα-helixtrans-69.2-41.7177.7-174.538.9000111.7I46 L47 K53 K54I46-W50 VanDerWaalsContact O-CB 3.25Å; I46-W50 WeakPolarHBondContact O-CB 3.31Å; I46-W50 PolarHBondContact O-N 3.49Å; L47-W50 HydrophobicContact CD1-CE3 4.07Å; L47-W50 PolarHBondContact O-N 3.02Å; W50-K53 PolarHBondContact O-N 2.73Å; W50-K54 WeakPolarHBondContact O-CB 3.23Å; W50-K54 PolarHBondContact O-N 3.31Å
51Y84Confident76.5Confident133 Ų133113.2 Ų113.252%0.52256%0.563SS.*Hα-helixtrans-66.5-45.2176.5-176.4-106.4000111.6L47 G48 K54 R55L47-Y51 WeakPolarHBondContact O-CB 3.47Å; L47-Y51 PolarHBondContact O-N 3.24Å; G48-Y51 PolarHBondContact O-N 2.89Å; Y51-K54 PolarHBondContact O-N 2.78Å; Y51-R55 WeakPolarHBondContact O-CB 3.44Å; Y51-R55 PolarHBondContact O-N 3.37Å
52L68.1Low74.3Confident104 Ų104119.2 Ų119.255%0.54558%0.579SS.*Hα-helixtrans-65.5-39.1173.1-70.9173.3000111G48 R55 S56G48-L52 WeakPolarHBondContact O-CB 3.24Å; G48-L52 WeakPolarHBondContact O-CG 3.19Å; G48-L52 PolarHBondContact O-N 3.36Å; L52-R55 CarbonylContact O-C 3.59Å; L52-R55 PolarHBondContact O-N 3.47Å; L52-S56 VanDerWaalsContact O-CA 3.31Å; L52-S56 WeakPolarHBondContact O-CA 3.42Å; L52-S56 WeakPolarHBondContact O-CB 3.19Å; L52-S56 PolarHBondContact O-N 3.48Å; L52-S56 PolarHBondContact O-OG 3.22Å
53K71.8Confident72Confident170 Ų170120.1 Ų120.174%0.73958%0.582SS**Hα-helixtrans-64.3-45.2174.7-178.3173-178.4175.40111.4C49 W50 R55C49-K53 WeakPolarHBondContact O-CA 3.48Å; C49-K53 WeakPolarHBondContact O-CB 3.42Å; C49-K53 PolarHBondContact O-N 3.08Å; W50-K53 PolarHBondContact O-N 2.73Å; K53-R55 VanDerWaalsContact C-N 3.27Å; K53-R55 PolarHBondContact O-N 2.99Å
54K73Confident69.8Low164 Ų164124.8 Ų124.871%0.71360%0.603SS**Hα-helixtrans-65.2-29.5177.5-168174.3-177.1-178.50112.2W50 Y51W50-K54 WeakPolarHBondContact O-CB 3.23Å; W50-K54 PolarHBondContact O-N 3.31Å; Y51-K54 PolarHBondContact O-N 2.78Å
55R64.9Low67.7Low169 Ų169123.2 Ų123.264%0.63861%0.613SS**Hα-helixtrans-97.2-23.4179.2-156178.7-174.9-172.13.5114.4Y51 L52 K53 G57Y51-R55 WeakPolarHBondContact O-CB 3.44Å; Y51-R55 PolarHBondContact O-N 3.37Å; L52-R55 CarbonylContact O-C 3.59Å; L52-R55 PolarHBondContact O-N 3.47Å; K53-R55 VanDerWaalsContact C-N 3.27Å; K53-R55 PolarHBondContact O-N 2.99Å; R55-G57 VanDerWaalsContact C-N 3.33Å
56S55.3Low65.6Low40 Ų40121.3 Ų121.328%0.2862%0.618SS.*Hα-helixtrans-85.8-0.3-180-73.10000113.6L52 Y58 K59L52-S56 VanDerWaalsContact O-CA 3.31Å; L52-S56 WeakPolarHBondContact O-CA 3.42Å; L52-S56 WeakPolarHBondContact O-CB 3.19Å; L52-S56 PolarHBondContact O-N 3.48Å; L52-S56 PolarHBondContact O-OG 3.22Å; S56-Y58 PolarHBondContact O-N 2.82Å; S56-K59 PolarHBondContact O-N 2.98Å
57G58.6Low63.4Low54 Ų54119.7 Ų119.756%0.55763%0.631SS**THydrogen-bonded Turntrans-52.5-16.6165.600000114R55R55-G57 VanDerWaalsContact C-N 3.33Å
58Y53.8Low61Low206 Ų206119.7 Ų119.781%0.80864%0.639SS**THydrogen-bonded Turntrans-115.7-0.4176.2-60.2-78.5000115.1S56S56-Y58 PolarHBondContact O-N 2.82Å
59K52Low59.2Low144 Ų144123.3 Ų123.363%0.62667%0.666SS**THydrogen-bonded Turntrans-103.2-3.7-178.2-79.5-174.475.4-178.40114.9S56 I61 R62S56-K59 PolarHBondContact O-N 2.98Å; K59-I61 PolarHBondContact O-N 3.22Å; K59-R62 PolarHBondContact O-N 3.1Å
60I55.5Low57.2Low134 Ų134123.5 Ų123.569%0.68768%0.678SS**G310 helixtrans-68.6-17.8175-59.2162.5000111.2R62I60-R62 VanDerWaalsContact C-N 3.31Å; I60-R62 PolarHBondContact O-N 2.71Å
61I53.9Low55.1Low143 Ų143122.9 Ų122.973%0.73368%0.68SS**G310 helixtrans-82.5-5.2178.3-35.6179.6000112.3K59K59-I61 PolarHBondContact O-N 3.22Å
62R47.8Very low53.2Low232 Ų232121.2 Ų121.288%0.87568%0.683SS**G310 helixtrans-100.35.3-177-139.7-175.5-162.4-173.56.1115.7K59 I60K59-R62 PolarHBondContact O-N 3.1Å; I60-R62 VanDerWaalsContact C-N 3.31Å; I60-R62 PolarHBondContact O-N 2.71Å
63S47.8Very low52.2Low65 Ų65120.2 Ų120.246%0.45570%0.699SS.*  trans-116.545.4170.263.60000111.7G65S63-G65 VanDerWaalsContact C-N 3.31Å; S63-G65 PolarHBondContact O-N 3.49Å
64V50.1Low51Low139 Ų139114.4 Ų114.484%0.84269%0.687SS**SBendtrans-88.677.3155.4177.30000106.6
65G50.4Low49.7Very low80 Ų80115 Ų11583%0.82569%0.692SS**SBendtrans171.7-4.8179.600000116.9S63S63-G65 VanDerWaalsContact C-N 3.31Å; S63-G65 PolarHBondContact O-N 3.49Å
66S48.5Very low48.2Very low106 Ų106115.6 Ų115.674%0.74170%0.696SS**SBendtrans-148.3111.1166-168.50000106.7S68S66-S68 PolarHBondContact O-N 2.81Å; S66-S68 VanDerWaalsContact O-N 3.13Å
67G47.1Very low47.5Very low84 Ų84119.3 Ų119.387%0.86672%0.722SS**SBendtrans-58.2111.3-160.100000113.9
68S40.5Very low46.7Very low102 Ų102125.3 Ų125.371%0.71374%0.735SS**  trans-176.786.5136.2-172.20000107.6S66S66-S68 PolarHBondContact O-N 2.81Å; S66-S68 VanDerWaalsContact O-N 3.13Å
69A50.3Low46.6Very low102 Ų102120.6 Ų120.684%0.84373%0.73SS**  trans-96104.5165.200000107.2
70G41.1Very low45.8Very low59 Ų59117 Ų11761%0.60873%0.734SS**  trans147.8116.1162.200000114.4
71F42.9Very low44.9Very low150 Ų150117 Ų11766%0.65874%0.74SS**  trans75.5106.2146.6-128.8-108.3000115.2Y76F71-Y76 HydrophobicContact CD1-CE2 4.05Å; F71-Y76 HydrophobicContact CE1-CE2 4.34Å
72T43.6Very low44.7Very low98 Ų98115.8 Ų115.860%0.60174%0.744SS**  -161.572.89228.80000110.5G74 Y76T72-G74 VanDerWaalsContact C-N 3.33Å; T72-G74 PolarHBondContact O-N 2.76Å; T72-Y76 HydrophobicContact CG2-CD2 3.4Å; T72-Y76 HydrophobicContact CG2-CE2 3.26Å
73G46.8Very low44.5Very low84 Ų84108.7 Ų108.787%0.86674%0.736SS**SBendtrans-8580.4157.200000108.8
74G46.2Very low44Very low48 Ų48112.7 Ų112.750%0.49575%0.752SS.*SBendtrans102.6128.3173.500000114.2T72T72-G74 VanDerWaalsContact C-N 3.33Å; T72-G74 PolarHBondContact O-N 2.76Å
75Q47.6Very low44.3Very low175 Ų175113.7 Ų113.782%0.81875%0.752SS**  trans77.2109.9177.6-49.2-1538.100115.5
76Y33.5Very low43.9Very low182 Ų182119 Ų11971%0.71475%0.753SS**  -154.3110.1128.1-83.5-66.5000108.9F71 T72F71-Y76 HydrophobicContact CD1-CE2 4.05Å; F71-Y76 HydrophobicContact CE1-CE2 4.34Å; T72-Y76 HydrophobicContact CG2-CD2 3.4Å; T72-Y76 HydrophobicContact CG2-CE2 3.26Å
77S40.2Very low43.9Very low118 Ų118122.5 Ų122.583%0.82576%0.76SS**  trans-71.5132.5148.6-650000107.9
78E40.3Very low43.6Very low180 Ų180122.7 Ų122.784%0.84175%0.747SS**SBendtrans70.5163.4153-112.5-137.4120.200119.4
79P53Low44.2Very low108 Ų108125.6 Ų125.670%0.70175%0.754SS**  -116.1159.9-122.325-0.7000112.2
80G34.1Very low44.2Very low68 Ų68124.3 Ų124.370%0.70174%0.739SS**  trans-176.279.7178.800000114.2
81T37.1Very low44.7Very low134 Ų134127.3 Ų127.382%0.82274%0.741SS**  trans29.8115.6140.452.10000119.5
82S49.3Very low45.1Very low117 Ų117129.1 Ų129.182%0.81875%0.749SS**  trans-21.5130.5145.555.70000116.2
83A45.3Very low45.6Very low84 Ų84128 Ų12869%0.69476%0.757SS**  trans-173.9140.1135.600000112
84D36.1Very low45.7Very low148 Ų148129.1 Ų129.179%0.79175%0.752SS**  trans87.871.8151.3-52.4-32.1000119.8K86D84-K86 PolarHBondContact O-N 2.81Å; D84-K86 VanDerWaalsContact O-N 3.1Å
85N55.6Low46Very low160 Ų160135.5 Ų135.586%0.85677%0.766SS**  -27.6102.3126.3-177.5-40.7000112.6
86K42.6Very low46.3Very low191 Ų191138.3 Ų138.383%0.8377%0.769SS**  trans-143.986.3159.2-151.5174.6-171-178.90109D84 S88D84-K86 PolarHBondContact O-N 2.81Å; D84-K86 VanDerWaalsContact O-N 3.1Å; K86-S88 PolarHBondContact O-N 2.73Å
87M48.4Very low47.2Very low181 Ų181134.9 Ų134.989%0.89277%0.772SS**  trans-50.5103163.8-161.286.9141.900108.4L89M87-L89 PolarHBondContact O-N 2.81Å
88S42.2Very low47.7Very low87 Ų87135.5 Ų135.561%0.60877%0.77SS**  trans-79.6107.8175.659.80000108.7K86 S90K86-S88 PolarHBondContact O-N 2.73Å; S88-S90 PolarHBondContact O-N 2.91Å; S88-S90 PolarHBondContact O-OG 2.98Å; S88-S90 VanDerWaalsContact O-OG 3.08Å; S88-S90 PolarHBondContact OG-OG 2.66Å
89L51.8Low48.2Very low164 Ų164132.5 Ų132.586%0.85976%0.764SS**  trans-50.358.8162.1-174.994.8000112.3M87M87-L89 PolarHBondContact O-N 2.81Å
90S50Low48.5Very low75 Ų75132.7 Ų132.752%0.52477%0.765SS.*  trans-117.2-8-178.940.50000113S88 F92S88-S90 PolarHBondContact O-N 2.91Å; S88-S90 PolarHBondContact O-OG 2.98Å; S88-S90 VanDerWaalsContact O-OG 3.08Å; S88-S90 PolarHBondContact OG-OG 2.66Å; S90-F92 PolarHBondContact O-N 3.25Å
91D51.3Low49.6Very low122 Ų122136.9 Ų136.965%0.65277%0.772SS**THydrogen-bonded Turntrans-87.93.4-175.2-71.5-32.5000115.4F95D91-F95 WeakPolarHBondContact O-CE2 2.83Å
92F53Low50.9Low188 Ų188133.8 Ų133.883%0.82576%0.759SS**THydrogen-bonded Turntrans-96.5-6177.6-78.3-79.9000114.7S90S90-F92 PolarHBondContact O-N 3.25Å
93G52.6Low51.4Low74 Ų74133.7 Ų133.776%0.76376%0.756SS**SBendtrans-93.9-14.1-177.600000115.7
94S49.9Very low52.3Low108 Ų108135.6 Ų135.676%0.75576%0.762SS**  trans-107.513.2-168.1-153.80000114.4R96S94-R96 VanDerWaalsContact C-N 3.34Å; S94-R96 PolarHBondContact O-N 2.89Å
95F52.4Low53.6Low181 Ų181132.4 Ų132.479%0.79476%0.756SS**  trans-97.646.4174-69.8-73.3000112.6D91D91-F95 WeakPolarHBondContact O-CE2 2.83Å
96R53.3Low53.5Low234 Ų234134.8 Ų134.888%0.88375%0.754SS**SBendtrans-117.6111.2158.9-86.1-162.1160.6-170.1-4.2111.1S94S94-R96 VanDerWaalsContact C-N 3.34Å; S94-R96 PolarHBondContact O-N 2.89Å
97S53Low54.2Low110 Ų110133.1 Ų133.177%0.76975%0.749SS**  trans75.880.7142-179.90000116.8
98V50.6Low54.8Low131 Ų131133.4 Ų133.479%0.79475%0.746SS**  trans-140.781.2142.8-170.30000109.3P100V98-P100 HydrophobicContact CG1-CB 4.33Å; V98-P100 WeakPolarHBondContact O-CD 3.36Å
99V51.6Low55.3Low117 Ų117135.5 Ų135.571%0.70975%0.748SS**  trans-79.9112153.4171.70000105.4N101V99-N101 PolarHBondContact O-N 3.38Å
100P58.1Low55.9Low113 Ų113133.3 Ų133.373%0.73475%0.747SS**THydrogen-bonded Turntrans-8634-164.635.1-35.5000113.6V98V98-P100 HydrophobicContact CG1-CB 4.33Å; V98-P100 WeakPolarHBondContact O-CD 3.36Å
101N58.4Low56.3Low156 Ų156135.2 Ų135.283%0.83476%0.76SS**THydrogen-bonded Turntrans-172.552.3167.9-132.3-52.8000113.2V99V99-N101 PolarHBondContact O-N 3.38Å
102A64.2Low56.9Low68 Ų68132.4 Ų132.456%0.56276%0.76SS**PPolyproline II helixtrans-100.1133.4161.500000107.7
103P58.2Low57.4Low115 Ų115129.8 Ų129.875%0.74776%0.762SS**PPolyproline II helixtrans-56.1139.8173.922.9-31000108.9A105P103-A105 PolarHBondContact O-N 3.12Å
104P64.7Low58Low125 Ų125134.1 Ų134.181%0.81277%0.767SS**PPolyproline II helixtrans-53.4116.6-176.821.1-31.6000108.5Y106P104-Y106 PolarHBondContact O-N 2.69Å
105A64.5Low59.2Low81 Ų81133.8 Ų133.867%0.66976%0.762SS**PPolyproline II helixtrans-57.1131.3171.400000106.4P103 E107P103-A105 PolarHBondContact O-N 3.12Å; A105-E107 VanDerWaalsContact C-N 3.28Å; A105-E107 WeakPolarHBondContact O-CG 3.18Å; A105-E107 PolarHBondContact O-N 2.93Å
106Y53.3Low60.2Low209 Ų209129.3 Ų129.382%0.8275%0.751SS**  trans-63.591.9-175.1-152-86.7000108.8P104 K108P104-Y106 PolarHBondContact O-N 2.69Å; Y106-K108 HydrophobicContact CD1-CG 3.99Å; Y106-K108 HydrophobicContact CE1-CG 4.2Å; Y106-K108 PolarHBondContact O-N 2.81Å
107E57.8Low61.2Low156 Ų156124.1 Ų124.173%0.72975%0.748SS**  trans-67.986.2175.7-59.8-168.5-157.200107.5A105 I109A105-E107 VanDerWaalsContact C-N 3.28Å; A105-E107 WeakPolarHBondContact O-CG 3.18Å; A105-E107 PolarHBondContact O-N 2.93Å; E107-I109 HydrophobicContact CB-CD1 3.95Å; E107-I109 HydrophobicContact CB-CG1 4.03Å; E107-I109 PolarHBondContact O-N 2.98Å; E107-I109 WeakPolarHBondContact OE2-CD1 3.37Å
108K60.5Low61.7Low188 Ų188128.8 Ų128.882%0.81775%0.75SS**  trans-70.969.3161.7-91.4-179.5-177.8-176.80108Y106Y106-K108 HydrophobicContact CD1-CG 3.99Å; Y106-K108 HydrophobicContact CE1-CG 4.2Å; Y106-K108 PolarHBondContact O-N 2.81Å
109I52.8Low62.3Low130 Ų130127.8 Ų127.867%0.66775%0.749SS**  trans-98.5105.7167.5-47.1164.9000106.1E107 S111E107-I109 HydrophobicContact CB-CD1 3.95Å; E107-I109 HydrophobicContact CB-CG1 4.03Å; E107-I109 PolarHBondContact O-N 2.98Å; E107-I109 WeakPolarHBondContact OE2-CD1 3.37Å; I109-S111 PolarHBondContact O-N 2.92Å
110S63.1Low62.9Low118 Ų118131.8 Ų131.883%0.82578%0.777SS**  trans-56.6110.6175.5165.10000111.8
111S59.7Low63.1Low115 Ų115132.8 Ų132.880%0.80478%0.78SS**  trans-174.765.9143.262.30000111.2I109I109-S111 PolarHBondContact O-N 2.92Å
112G64.2Low63.4Low63 Ų63131.5 Ų131.565%0.64978%0.777SS**SBendtrans-104.2147.8161.200000109.2L114G112-L114 PolarHBondContact O-N 2.8Å
113P62.5Low63.4Low134 Ų134135.1 Ų135.187%0.8779%0.789SS**PPolyproline II helixtrans-52131.8-175.6-21.330.5000111
114L66Low63.7Low164 Ų164136.2 Ų136.286%0.85979%0.791SS**PPolyproline II helixtrans-47.6132.3173.5-75.8151.8000109.2G112G112-L114 PolarHBondContact O-N 2.8Å
115P73.4Confident63.6Low102 Ų102136.9 Ų136.966%0.66279%0.79SS**PPolyproline II helixtrans-60.5145.517726.4-33.2000109.5
116P74.8Confident63.5Low87 Ų87140.7 Ų140.757%0.56580%0.798SS**PPolyproline II helixtrans-59.8146.1-17824.4-33000110.9Y118P116-Y118 PolarHBondContact O-N 2.88Å
117P74.8Confident64.3Low125 Ų125135.8 Ų135.881%0.81280%0.796SS**PPolyproline II helixtrans-61.8127.3176.9-14.927.5000109.7
118Y62.3Low64.8Low208 Ų208134.2 Ų134.282%0.81680%0.802SS**  trans-90.6108.4167.9-65.4-76.9000108.4P116P116-Y118 PolarHBondContact O-N 2.88Å
119S64.1Low65.1Low109 Ų109129.8 Ų129.876%0.76280%0.8SS**  trans-94154153.6-69.30000107.9
120P63.8Low66.2Low202 Ų202129.7 Ų129.7100%1.31281%0.812SS**  cis-106.1016.838.2-32.9000116.4

Retrieved 120 of 120 residues in 35.9 ms (Link to these results)