A0A087XZ65_POEFO Loading...

MRG/MORF4L binding protein

AlphaFold DB , UniProt , Accession A0A087XZ65, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 142 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M41.1Very low42.4Very low256 Ų256148.3 Ų148.3100%1.26186%0.86SS**  0115.90-64-174.9178.700106.1
2G46.2Very low42.3Very low76 Ų76151.7 Ų151.778%0.78486%0.862SS**  cis-153.7132.8-16.100000104.1
3E46.8Very low42.8Very low204 Ų204153.1 Ų153.195%0.95386%0.857SS**  trans-102.7137.7177-59.2-137.4109.600108.7
4A46Very low42.7Very low96 Ų96154.4 Ų154.479%0.79385%0.849SS**  trans-86.1159.4-174.600000111.9
5D41Very low42.9Very low155 Ų155150 Ų15083%0.82983%0.831SS**  trans96154.5149.4-141.8-89.7000119.3
6V40.8Very low43.1Very low109 Ų109148.6 Ų148.666%0.66183%0.831SS**  trans92.486176.1-165.70000115.3
7T38.7Very low42.8Very low145 Ų145147.2 Ų147.289%0.8982%0.821SS**  trans-120100.9138.847.60000109.4
8L45.3Very low43.3Very low161 Ų161144.7 Ų144.784%0.84382%0.815SS**  trans-84.6121.8166.6-167.8106.1000108.5
9S37.8Very low43.1Very low103 Ų103140.9 Ų140.972%0.7280%0.804SS**  trans-167.5137.9161.4-50.30000107.5
10Q39.5Very low43.4Very low187 Ų187141.8 Ų141.887%0.87481%0.805SS**  cis-161.4144.5-8.4-107.1174.621.700104.2
11T43.2Very low43.2Very low139 Ų139139.7 Ų139.785%0.85380%0.795SS**  trans-60.3126.7168.9-41.40000109.9
12E41.2Very low43.4Very low189 Ų189133.8 Ų133.888%0.88378%0.776SS**  trans-133.5105.5155.9-159.5157.288.400108.8K14E12-K14 PolarHBondContact O-N 3.36Å
13E48.9Very low43.3Very low170 Ų170132.8 Ų132.879%0.79477%0.766SS**  trans-67.4112.5169.2-176.2-145.9122.800108.1
14K42Very low43.4Very low171 Ų171129.1 Ų129.174%0.74375%0.748SS**  trans-103.2127.8167.6-173.3175174.2175.90107.6E12E12-K14 PolarHBondContact O-N 3.36Å
15P45.6Very low44.1Very low89 Ų89128.1 Ų128.158%0.57873%0.73SS**  trans-61.1156.2-178.526.6-34.1000110D17P15-D17 PolarHBondContact O-N 2.95Å
16P46.3Very low45.6Very low128 Ų128125.3 Ų125.383%0.83172%0.722SS**  trans-67.190.3169.129.4-31.6000107.6S18P16-S18 VanDerWaalsContact C-N 3.35Å; P16-S18 PolarHBondContact O-N 2.72Å
17D38.2Very low47.8Very low124 Ų124120.9 Ų120.966%0.66370%0.695SS**  trans-54.6106.9158.5-165.6-26.3000105.3P15 A19P15-D17 PolarHBondContact O-N 2.95Å; D17-A19 PolarHBondContact O-N 3.36Å
18S50.6Low50.3Low103 Ų103119.6 Ų119.672%0.7269%0.687SS**  trans-65.874.9169.5-177.20000106.4P16 L20P16-S18 VanDerWaalsContact C-N 3.35Å; P16-S18 PolarHBondContact O-N 2.72Å; S18-L20 PolarHBondContact O-N 2.96Å
19A40.4Very low52.6Low73 Ų73115 Ų11560%0.60366%0.659SS**  trans-61.392.5168.500000106.2D17 V21D17-A19 PolarHBondContact O-N 3.36Å; A19-V21 WeakPolarHBondContact O-CG2 3.43Å; A19-V21 PolarHBondContact O-N 2.78Å
20L48Very low55.3Low157 Ų157112.3 Ų112.382%0.82264%0.64SS**  trans-57.595.2157.9-81.1160.4000105.9S18 P22S18-L20 PolarHBondContact O-N 2.96Å; L20-P22 VanDerWaalsContact O-CD 3.28Å; L20-P22 WeakPolarHBondContact O-CD 3.5Å
21V40.3Very low57.9Low99 Ų99110.9 Ų110.960%0.663%0.633SS**  trans-63.3120.4171.9-164.60000106.1A19 G23A19-V21 WeakPolarHBondContact O-CG2 3.43Å; A19-V21 PolarHBondContact O-N 2.78Å; V21-G23 PolarHBondContact O-N 2.94Å
22P44.3Very low60.3Low131 Ų131111.8 Ų111.885%0.85163%0.627SS**THydrogen-bonded Turntrans-7227-179.7-15.330.4000113.9L20L20-P22 VanDerWaalsContact O-CD 3.28Å; L20-P22 WeakPolarHBondContact O-CD 3.5Å
23G45.2Very low62.9Low56 Ų56104.2 Ų104.258%0.57759%0.594SS**THydrogen-bonded Turntrans-119.3-5.2-172.800000114.9V21V21-G23 PolarHBondContact O-N 2.94Å
24E48.9Very low65.1Low126 Ų12697.9 Ų97.959%0.58956%0.564SS**SBendtrans-96.64.6-174.5-105.3-16382.700115.3R68E24-R68 PolarHBondContact O-NH2 3.02Å; E24-R68 IonicContact OE1-NE 3.27Å; E24-R68 IonicContact OE1-NH2 3.57Å
25D59.6Low67.6Low76 Ų7694.4 Ų94.441%0.40656%0.557SS.*  trans-88.5-1179.5-71.7-76.2000114.1V27 S71 V74D25-V27 PolarHBondContact O-N 3.47Å; D25-S71 VanDerWaalsContact OD1-CB 3.24Å; D25-S71 WeakPolarHBondContact OD1-CB 3.49Å; D25-S71 PolarHBondContact OD1-OG 3.2Å; D25-V74 HydrophobicContact CB-CG2 4.06Å; D25-V74 WeakPolarHBondContact O-CG2 3.22Å
26S74Confident70Confident95 Ų9592 Ų9266%0.66454%0.542SS*.  trans-74.6102.1176.9-163.60000109.9R68S26-R68 PolarHBondContact O-NH1 2.97Å
27V86.9Confident72.4Confident16 Ų1685.9 Ų85.910%0.09750%0.502CS..  trans-88.3125.9170.2176.50000108.2D25 W29 V33 F62 V70 V74D25-V27 PolarHBondContact O-N 3.47Å; V27-W29 HydrophobicContact CB-CZ2 4.45Å; V27-W29 HydrophobicContact CG1-CD2 4.16Å; V27-W29 HydrophobicContact CG1-CE3 4.38Å; V27-W29 HydrophobicContact CG1-CH2 4.45Å; V27-W29 HydrophobicContact CG1-CZ2 4.23Å; V27-W29 PolarHBondContact O-N 3.39Å; V27-V33 HydrophobicContact CG1-CG1 3.98Å; V27-F62 HydrophobicContact CG1-CZ 4.45Å; V27-V70 HydrophobicContact CG2-CB 4.37Å; V27-V70 HydrophobicContact CG2-CG1 3.72Å; V27-V70 HydrophobicContact CG2-CG2 3.7Å; V27-V74 HydrophobicContact CB-CG1 4.06Å; V27-V74 HydrophobicContact CG2-CG1 3.91Å
28V90.9Very high75.1Confident118 Ų11883.5 Ų83.572%0.71549%0.486SS*.  trans-80.7109.4171.7179.60000108.1S30V28-S30 VanDerWaalsContact C-N 3.32Å; V28-S30 PolarHBondContact O-N 3.1Å
29W93.1Very high77.3Confident66 Ų6684.3 Ų84.325%0.2548%0.478CS..  trans-77.479.7178.8-64.5108.7000111.3V27 V33 E34 L37 F62 V74 H78V27-W29 HydrophobicContact CB-CZ2 4.45Å; V27-W29 HydrophobicContact CG1-CD2 4.16Å; V27-W29 HydrophobicContact CG1-CE3 4.38Å; V27-W29 HydrophobicContact CG1-CH2 4.45Å; V27-W29 HydrophobicContact CG1-CZ2 4.23Å; V27-W29 PolarHBondContact O-N 3.39Å; W29-V33 HydrophobicContact CE3-CG1 3.88Å; W29-V33 HydrophobicContact CZ3-CG1 4.01Å; W29-E34 HydrophobicContact CE3-CG 4.04Å; W29-L37 HydrophobicContact CH2-CD2 3.86Å; W29-L37 HydrophobicContact CZ3-CB 4.23Å; W29-L37 HydrophobicContact CZ3-CD2 3.7Å; W29-F62 HydrophobicContact CH2-CE1 4.14Å; W29-F62 AromaticContact CH2-CZ 3.91Å; W29-F62 HydrophobicContact CH2-CZ 3.91Å; W29-F62 HydrophobicContact CZ3-CE1 4.46Å; W29-F62 HydrophobicContact CZ3-CE2 4.36Å; W29-F62 AromaticContact CZ3-CZ 3.77Å; W29-F62 HydrophobicContact CZ3-CZ 3.77Å; W29-V74 HydrophobicContact CZ2-CG1 3.95Å; W29-H78 AromaticContact CD1-CE1 3.81Å; W29-H78 AromaticContact CD1-CG 3.88Å; W29-H78 AromaticContact CD1-ND1 3.43Å; W29-H78 HydrophobicContact CD2-CB 4.13Å; W29-H78 AromaticContact CD2-CD2 3.36Å; W29-H78 AromaticContact CD2-CE1 3.68Å; W29-H78 AromaticContact CD2-CG 3.42Å; W29-H78 VanDerWaalsContact CD2-CG 3.42Å; W29-H78 AromaticContact CD2-ND1 3.64Å; W29-H78 AromaticContact CD2-NE2 3.52Å; W29-H78 AromaticContact CE2-CD2 3.58Å; W29-H78 AromaticContact CE2-CG 3.21Å; W29-H78 AromaticContact CE2-ND1 3.66Å; W29-H78 AromaticContact CE3-CD2 3.35Å; W29-H78 AromaticContact CE3-CG 3.9Å; W29-H78 AromaticContact CE3-NE2 3.55Å; W29-H78 AromaticContact CG-CE1 3.44Å; W29-H78 VanDerWaalsContact CG-CE1 3.44Å; W29-H78 AromaticContact CG-CG 3.85Å; W29-H78 AromaticContact CG-ND1 3.51Å; W29-H78 AromaticContact CG-NE2 3.75Å; W29-H78 HydrophobicContact CH2-CB 3.96Å; W29-H78 AromaticContact CH2-CD2 3.77Å; W29-H78 HydrophobicContact CZ2-CB 3.28Å; W29-H78 AromaticContact CZ2-CD2 3.77Å; W29-H78 AromaticContact CZ2-CG 3.53Å; W29-H78 AromaticContact CZ3-CD2 3.56Å; W29-H78 AromaticContact NE1-CG 3.51Å; W29-H78 AromaticContact NE1-ND1 3.51Å
30S93.8Very high79.9Confident45 Ų4580.9 Ų80.932%0.31545%0.45SS..  trans-81.715716473.50000110V28 E32 V33 E34V28-S30 VanDerWaalsContact C-N 3.32Å; V28-S30 PolarHBondContact O-N 3.1Å; S30-E32 PolarHBondContact O-N 2.96Å; S30-E32 VanDerWaalsContact O-N 3.1Å; S30-V33 WeakPolarHBondContact O-CB 3.35Å; S30-V33 PolarHBondContact O-N 3.47Å; S30-V33 WeakPolarHBondContact OG-CG2 3.46Å; S30-V33 PolarHBondContact OG-N 3.34Å; S30-E34 PolarHBondContact O-N 3.15Å
31H94.4Very high82.2Confident158 Ų15875 Ų7573%0.73142%0.418SS*.Hα-helixtrans-53.2-33.6175.6-54.689.1000112.5E34 V35H31-E34 PolarHBondContact O-N 3.1Å; H31-V35 VanDerWaalsContact O-CG2 3.22Å; H31-V35 WeakPolarHBondContact O-CG2 3.45Å; H31-V35 PolarHBondContact O-N 2.8Å
32E94.7Very high84.7Confident157 Ų15775.6 Ų75.673%0.73442%0.417SS*.Hα-helixtrans-66.6-43177-62175.9177.100111.7S30 V35 C36S30-E32 PolarHBondContact O-N 2.96Å; S30-E32 VanDerWaalsContact O-N 3.1Å; E32-V35 PolarHBondContact O-N 3.02Å; E32-C36 PolarHBondContact O-N 2.69Å; E32-C36 VanDerWaalsContact O-N 3.1Å; E32-C36 PolarHBondContact O-SG 3.27Å
33V94.6Very high87Confident30 Ų3073 Ų7318%0.18241%0.414CS..Hα-helixtrans-66.6-40.4176.3174.30000110.7V27 W29 S30 V35 C36 L37 F62 I66V27-V33 HydrophobicContact CG1-CG1 3.98Å; W29-V33 HydrophobicContact CE3-CG1 3.88Å; W29-V33 HydrophobicContact CZ3-CG1 4.01Å; S30-V33 WeakPolarHBondContact O-CB 3.35Å; S30-V33 PolarHBondContact O-N 3.47Å; S30-V33 WeakPolarHBondContact OG-CG2 3.46Å; S30-V33 PolarHBondContact OG-N 3.34Å; V33-V35 VanDerWaalsContact C-N 3.34Å; V33-V35 PolarHBondContact O-N 3.47Å; V33-C36 WeakPolarHBondContact O-CB 3.38Å; V33-C36 PolarHBondContact O-N 2.99Å; V33-C36 VanDerWaalsContact O-N 3.15Å; V33-L37 PolarHBondContact O-N 3.48Å; V33-F62 HydrophobicContact CG1-CE2 3.84Å; V33-F62 HydrophobicContact CG1-CZ 3.54Å; V33-F62 WeakPolarHBondContact O-CE2 3.4Å; V33-I66 HydrophobicContact CG1-CG2 4.46Å
34E95.1Very high89.4Confident37 Ų3772 Ų7217%0.17340%0.395CS..Hα-helixtrans-62.9-40.3175-68.3-174143.200112W29 S30 H31 C36 L37 F38 H78W29-E34 HydrophobicContact CE3-CG 4.04Å; S30-E34 PolarHBondContact O-N 3.15Å; H31-E34 PolarHBondContact O-N 3.1Å; E34-C36 VanDerWaalsContact C-N 3.28Å; E34-C36 PolarHBondContact O-N 3.37Å; E34-L37 WeakPolarHBondContact O-CA 3.4Å; E34-L37 WeakPolarHBondContact O-CB 3.48Å; E34-L37 PolarHBondContact O-N 3.39Å; E34-L37 VanDerWaalsContact O-N 3.08Å; E34-F38 HydrophobicContact CB-CD2 4.42Å; E34-F38 HydrophobicContact CB-CE2 3.87Å; E34-F38 HydrophobicContact CB-CZ 4.39Å; E34-F38 WeakPolarHBondContact O-CD2 3.45Å; E34-F38 VanDerWaalsContact O-CG 3.31Å; E34-F38 WeakPolarHBondContact O-CG 3.09Å; E34-F38 PolarHBondContact O-N 3.41Å; E34-H78 IonicContact OE1-CE1 2.78Å; E34-H78 PolarHBondContact OE1-CE1 2.9Å; E34-H78 VanDerWaalsContact OE1-CE1 3.27Å; E34-H78 IonicContact OE1-NE2 3.9Å; E34-H78 PolarHBondContact OE1-NE2 2.94Å
35V95.8Very high91.5Very high99 Ų9971 Ų7160%0.639%0.388SS*.Hα-helixtrans-58.7-42.2172.9169.20000110.8H31 E32 V33 L37 F38 H39H31-V35 VanDerWaalsContact O-CG2 3.22Å; H31-V35 WeakPolarHBondContact O-CG2 3.45Å; H31-V35 PolarHBondContact O-N 2.8Å; E32-V35 PolarHBondContact O-N 3.02Å; V33-V35 VanDerWaalsContact C-N 3.34Å; V33-V35 PolarHBondContact O-N 3.47Å; V35-L37 VanDerWaalsContact C-N 3.33Å; V35-L37 PolarHBondContact O-N 3.4Å; V35-F38 PolarHBondContact O-N 3.08Å; V35-H39 WeakPolarHBondContact O-CB 3.43Å; V35-H39 PolarHBondContact O-N 3.21Å
36C95.8Very high93.1Very high38 Ų3868.2 Ų68.226%0.25737%0.374SS..Hα-helixtrans-62.5-38.4173.8-69.20000112.8E32 V33 E34 A40 F62 N65 I66E32-C36 PolarHBondContact O-N 2.69Å; E32-C36 VanDerWaalsContact O-N 3.1Å; E32-C36 PolarHBondContact O-SG 3.27Å; V33-C36 WeakPolarHBondContact O-CB 3.38Å; V33-C36 PolarHBondContact O-N 2.99Å; V33-C36 VanDerWaalsContact O-N 3.15Å; E34-C36 VanDerWaalsContact C-N 3.28Å; E34-C36 PolarHBondContact O-N 3.37Å; C36-A40 WeakPolarHBondContact O-CB 3.48Å; C36-A40 PolarHBondContact O-N 3.19Å; C36-F62 HydrophobicContact CB-CD2 4.36Å; C36-F62 HydrophobicContact CB-CE2 4.25Å; C36-N65 HydrophobicContact CB-CB 4.03Å; C36-N65 PolarHBondContact O-ND2 3.3Å; C36-I66 HydrophobicContact CB-CG2 4.19Å
37L95.5Very high94Very high0 Ų064.6 Ų64.60%035%0.348CS..Hα-helixtrans-64.1-50.8175174.163.6000111W29 V33 E34 V35 H39 A40 M41 I58 F62 I75 L79W29-L37 HydrophobicContact CH2-CD2 3.86Å; W29-L37 HydrophobicContact CZ3-CB 4.23Å; W29-L37 HydrophobicContact CZ3-CD2 3.7Å; V33-L37 PolarHBondContact O-N 3.48Å; E34-L37 WeakPolarHBondContact O-CA 3.4Å; E34-L37 WeakPolarHBondContact O-CB 3.48Å; E34-L37 PolarHBondContact O-N 3.39Å; E34-L37 VanDerWaalsContact O-N 3.08Å; V35-L37 VanDerWaalsContact C-N 3.33Å; V35-L37 PolarHBondContact O-N 3.4Å; L37-H39 VanDerWaalsContact C-N 3.25Å; L37-H39 PolarHBondContact O-N 3.09Å; L37-A40 CarbonylContact O-C 3.6Å; L37-A40 WeakPolarHBondContact O-CA 3.47Å; L37-A40 WeakPolarHBondContact O-CB 3.21Å; L37-A40 PolarHBondContact O-N 3.02Å; L37-M41 HydrophobicContact CD1-CG 4.24Å; L37-M41 HydrophobicContact CD1-SD 4.14Å; L37-M41 HydrophobicContact CD2-SD 4.45Å; L37-M41 HydrophobicContact CG-CG 4.47Å; L37-M41 HydrophobicContact CG-SD 3.93Å; L37-M41 WeakPolarHBondContact O-CG 3.06Å; L37-M41 PolarHBondContact O-N 2.84Å; L37-I58 HydrophobicContact CD1-CG2 3.94Å; L37-F62 HydrophobicContact CB-CD2 3.89Å; L37-F62 HydrophobicContact CB-CE2 3.75Å; L37-F62 HydrophobicContact CD1-CD2 4.27Å; L37-F62 HydrophobicContact CD1-CG 4.36Å; L37-I75 HydrophobicContact CD1-CG2 3.67Å; L37-L79 HydrophobicContact CD2-CD2 4.25Å
38F95.4Very high94.2Very high74 Ų7464 Ų6433%0.32535%0.345SS..Hα-helixtrans-61.8-36.6-179.9-61.2-44.2000111.8E34 V35 M41 I42 M82 Y83E34-F38 HydrophobicContact CB-CD2 4.42Å; E34-F38 HydrophobicContact CB-CE2 3.87Å; E34-F38 HydrophobicContact CB-CZ 4.39Å; E34-F38 WeakPolarHBondContact O-CD2 3.45Å; E34-F38 VanDerWaalsContact O-CG 3.31Å; E34-F38 WeakPolarHBondContact O-CG 3.09Å; E34-F38 PolarHBondContact O-N 3.41Å; V35-F38 PolarHBondContact O-N 3.08Å; F38-M41 HydrophobicContact CD1-SD 4.26Å; F38-M41 PolarHBondContact O-N 3.05Å; F38-I42 WeakPolarHBondContact O-CG1 3.31Å; F38-I42 PolarHBondContact O-N 3.46Å; F38-M82 HydrophobicContact CE1-CE 4.02Å; F38-M82 HydrophobicContact CZ-CE 3.88Å; F38-M82 HydrophobicContact CZ-SD 4.15Å; F38-Y83 HydrophobicContact CE1-CE2 4.47Å
39H95.9Very high94.1Very high120 Ų12061.7 Ų61.756%0.55633%0.331SS*.Hα-helixtrans-63-42.5172.9-164.381.4000112.1V35 L37 M41 I42V35-H39 WeakPolarHBondContact O-CB 3.43Å; V35-H39 PolarHBondContact O-N 3.21Å; L37-H39 VanDerWaalsContact C-N 3.25Å; L37-H39 PolarHBondContact O-N 3.09Å; H39-M41 VanDerWaalsContact C-N 3.26Å; H39-M41 PolarHBondContact O-N 3.35Å; H39-I42 PolarHBondContact O-N 3.08Å
40A96.1Very high94.1Very high0 Ų062.2 Ų62.20%034%0.339CS..Hα-helixtrans-65.1-29.2175.500000112.9C36 L37 I42 H44 I58 K61 F62C36-A40 WeakPolarHBondContact O-CB 3.48Å; C36-A40 PolarHBondContact O-N 3.19Å; L37-A40 CarbonylContact O-C 3.6Å; L37-A40 WeakPolarHBondContact O-CA 3.47Å; L37-A40 WeakPolarHBondContact O-CB 3.21Å; L37-A40 PolarHBondContact O-N 3.02Å; A40-I42 VanDerWaalsContact C-N 3.34Å; A40-H44 PolarHBondContact O-CD2 3.47Å; A40-I58 HydrophobicContact CB-CG2 4.44Å; A40-K61 HydrophobicContact CB-CB 3.72Å; A40-F62 HydrophobicContact CB-CB 4.08Å
41M95.3Very high94.1Very high33 Ų3364.2 Ų64.216%0.16334%0.339CS..Hα-helixtrans-77.5-12.6177.8-69.5175.362.600114.3L37 F38 H39 G43 H44 P46 I58 L79L37-M41 HydrophobicContact CD1-CG 4.24Å; L37-M41 HydrophobicContact CD1-SD 4.14Å; L37-M41 HydrophobicContact CD2-SD 4.45Å; L37-M41 HydrophobicContact CG-CG 4.47Å; L37-M41 HydrophobicContact CG-SD 3.93Å; L37-M41 WeakPolarHBondContact O-CG 3.06Å; L37-M41 PolarHBondContact O-N 2.84Å; F38-M41 HydrophobicContact CD1-SD 4.26Å; F38-M41 PolarHBondContact O-N 3.05Å; H39-M41 VanDerWaalsContact C-N 3.26Å; H39-M41 PolarHBondContact O-N 3.35Å; M41-G43 PolarHBondContact O-N 2.96Å; M41-H44 PolarHBondContact O-N 3.06Å; M41-P46 HydrophobicContact CE-CG 3.81Å; M41-I58 HydrophobicContact CG-CD1 4.08Å; M41-I58 HydrophobicContact CG-CG1 4.24Å; M41-I58 HydrophobicContact CG-CG2 3.88Å; M41-L79 HydrophobicContact CE-CD1 4.25Å; M41-L79 HydrophobicContact CE-CD2 3.87Å; M41-L79 HydrophobicContact SD-CD1 4.3Å; M41-L79 HydrophobicContact SD-CD2 3.74Å
42I94.2Very high94.2Very high112 Ų11261.6 Ų61.657%0.57433%0.327SS*.THydrogen-bonded Turntrans-59.5118.6178.3-61.7174.3000109.5F38 H39 A40 H44F38-I42 WeakPolarHBondContact O-CG1 3.31Å; F38-I42 PolarHBondContact O-N 3.46Å; H39-I42 PolarHBondContact O-N 3.08Å; A40-I42 VanDerWaalsContact C-N 3.34Å; I42-H44 VanDerWaalsContact C-N 3.32Å; I42-H44 PolarHBondContact O-CD2 2.98Å
43G92.1Very high94.2Very high76 Ų7660.9 Ų60.978%0.78432%0.322SS*.THydrogen-bonded Turntrans81.52.9-178.700000115.3M41M41-G43 PolarHBondContact O-N 2.96Å
44H95.1Very high94.3Very high37 Ų3761.9 Ų61.917%0.17132%0.324CS..  trans-121.2134.1176.3-59.8-82.2000110.5A40 M41 I42 H54 C57 I58 K61A40-H44 PolarHBondContact O-CD2 3.47Å; M41-H44 PolarHBondContact O-N 3.06Å; I42-H44 VanDerWaalsContact C-N 3.32Å; I42-H44 PolarHBondContact O-CD2 2.98Å; H44-H54 HydrophobicContact CB-CB 4.33Å; H44-H54 AromaticContact ND1-ND1 3.8Å; H44-C57 WeakPolarHBondContact CE1-CB 3.43Å; H44-C57 WeakPolarHBondContact ND1-CB 3.27Å; H44-I58 HydrophobicContact CB-CD1 3.71Å; H44-I58 HydrophobicContact CB-CG1 3.49Å; H44-I58 VanDerWaalsContact CB-CG1 3.49Å; H44-K61 PolarHBondContact NE2-NZ 3.36Å
45K93.1Very high94.3Very high105 Ų10560.1 Ų60.146%0.45732%0.316SS..  trans-102.5115.9177.1-73.2-179.6175.1173.30110.2V47 H54 E92K45-V47 PolarHBondContact O-N 3.32Å; K45-V47 VanDerWaalsContact O-N 3.17Å; K45-H54 WeakPolarHBondContact O-CB 3.42Å; K45-H54 PolarHBondContact O-CD2 2.7Å; K45-E92 WeakPolarHBondContact CD-OE1 2.97Å; K45-E92 IonicContact NZ-OE1 2.81Å; K45-E92 PolarHBondContact NZ-OE1 3.29Å
46P92.3Very high94.3Very high17 Ų1758.8 Ų58.811%0.1131%0.305CS..SBendtrans-73.6-0.8179.833.4-39000113.7M41 R51 M55 I58 W76 L79 M85M41-P46 HydrophobicContact CE-CG 3.81Å; P46-R51 WeakPolarHBondContact O-CB 3.39Å; P46-M55 HydrophobicContact CB-CE 3.89Å; P46-I58 HydrophobicContact CB-CD1 4.1Å; P46-W76 PolarHBondContact O-NE1 3.25Å; P46-L79 HydrophobicContact CB-CD1 3.77Å; P46-L79 HydrophobicContact CG-CD1 4Å; P46-M85 HydrophobicContact CB-CE 4.22Å; P46-M85 HydrophobicContact CG-CE 4.3Å
47V93.4Very high94.3Very high19 Ų1959.5 Ų59.512%0.11531%0.31CS..SBendtrans-122172.8177.8-65.20000110.3K45 M85 L88 H89 E92K45-V47 PolarHBondContact O-N 3.32Å; K45-V47 VanDerWaalsContact O-N 3.17Å; V47-M85 HydrophobicContact CG1-CE 3.42Å; V47-M85 VanDerWaalsContact CG1-CE 3.42Å; V47-M85 HydrophobicContact CG1-SD 4.11Å; V47-L88 HydrophobicContact CG1-CB 4.06Å; V47-L88 HydrophobicContact CG2-CB 4.18Å; V47-H89 HydrophobicContact CB-CB 4.25Å; V47-H89 HydrophobicContact CG1-CB 4.44Å; V47-E92 VanDerWaalsContact C-OE2 3.25Å; V47-E92 VanDerWaalsContact O-OE2 3.06Å
48G91.1Very high94.4Very high4 Ų459.5 Ų59.54%0.04131%0.31CS..SBendtrans99.4-175.2177.900000115.4N50 R51 H89 E92G48-N50 PolarHBondContact O-N 3.4Å; G48-R51 WeakPolarHBondContact O-CB 3.49Å; G48-R51 VanDerWaalsContact O-CG 3.3Å; G48-R51 WeakPolarHBondContact O-CG 3.39Å; G48-R51 PolarHBondContact O-N 2.8Å; G48-H89 WeakPolarHBondContact CA-ND1 3.02Å; G48-H89 PolarHBondContact N-ND1 3.29Å; G48-H89 VanDerWaalsContact N-ND1 3.12Å; G48-H89 PolarHBondContact O-CE1 2.81Å; G48-E92 WeakPolarHBondContact CA-OE2 3.5Å; G48-E92 PolarHBondContact N-OE2 3.35Å
49V89.8Confident94.4Very high68 Ų6859.2 Ų59.241%0.41231%0.307SS..THydrogen-bonded Turntrans-56.3-36.7176.1-86.10000112.8L94 F96V49-L94 HydrophobicContact CB-CD2 4.29Å; V49-L94 HydrophobicContact CG1-CD2 3.31Å; V49-L94 HydrophobicContact CG2-CD2 3.98Å; V49-F96 HydrophobicContact CG1-CZ 4.41Å; V49-F96 HydrophobicContact CG2-CE1 4.5Å
50N92.5Very high94.4Very high77 Ų7756.2 Ų56.241%0.41230%0.295SS..THydrogen-bonded Turntrans-101.118.8-177.7-66-32.3000113.4G48 H52 F53 H54G48-N50 PolarHBondContact O-N 3.4Å; N50-H52 PolarHBondContact O-N 2.72Å; N50-H52 VanDerWaalsContact O-N 3.08Å; N50-F53 HydrophobicContact CB-CD2 4.38Å; N50-F53 PolarHBondContact O-N 3.41Å; N50-H54 PolarHBondContact O-CD2 3.02Å; N50-H54 VanDerWaalsContact O-CD2 3.29Å; N50-H54 PolarHBondContact O-N 2.86Å
51R94.1Very high94.4Very high88 Ų8860.3 Ų60.333%0.33231%0.313SS..Hα-helixtrans-50.1-39.1-174.660.5-175.3-97.1-153.3-5.3114.1P46 G48 M55P46-R51 WeakPolarHBondContact O-CB 3.39Å; G48-R51 WeakPolarHBondContact O-CB 3.49Å; G48-R51 VanDerWaalsContact O-CG 3.3Å; G48-R51 WeakPolarHBondContact O-CG 3.39Å; G48-R51 PolarHBondContact O-N 2.8Å; R51-M55 WeakPolarHBondContact O-CB 3.23Å; R51-M55 PolarHBondContact O-N 3.19Å
52H96.1Very high94.4Very high103 Ų10358.8 Ų58.848%0.47731%0.305SS..Hα-helixtrans-70.5-41.7-177.9-63.3-72.5000112N50 M55 I56 W76N50-H52 PolarHBondContact O-N 2.72Å; N50-H52 VanDerWaalsContact O-N 3.08Å; H52-M55 PolarHBondContact O-N 2.87Å; H52-I56 WeakPolarHBondContact O-CG1 3.28Å; H52-I56 PolarHBondContact O-N 2.94Å; H52-W76 AromaticContact CE1-CH2 3.95Å; H52-W76 AromaticContact ND1-CH2 3.29Å; H52-W76 VanDerWaalsContact ND1-CH2 3.29Å; H52-W76 WeakPolarHBondContact ND1-CH2 3.48Å; H52-W76 AromaticContact ND1-CZ2 3.92Å
53F95.8Very high94.4Very high142 Ų14253.8 Ų53.862%0.62328%0.28SS*.Hα-helixtrans-66.3-45.4177.1-63.3-67.6000111.5N50 M55 I56 C57N50-F53 HydrophobicContact CB-CD2 4.38Å; N50-F53 PolarHBondContact O-N 3.41Å; F53-M55 VanDerWaalsContact C-N 3.29Å; F53-M55 PolarHBondContact O-N 2.84Å; F53-I56 PolarHBondContact O-N 3.44Å; F53-C57 PolarHBondContact O-N 3.13Å; F53-C57 PolarHBondContact O-SG 3.28Å; F53-C57 VanDerWaalsContact O-SG 3.39Å
54H95.7Very high94.5Very high50 Ų5057.2 Ų57.223%0.23128%0.276CS..Hα-helixtrans-61.9-39.5174.9-73.5-64000111.7H44 K45 N50 I56 C57 I58H44-H54 HydrophobicContact CB-CB 4.33Å; H44-H54 AromaticContact ND1-ND1 3.8Å; K45-H54 WeakPolarHBondContact O-CB 3.42Å; K45-H54 PolarHBondContact O-CD2 2.7Å; N50-H54 PolarHBondContact O-CD2 3.02Å; N50-H54 VanDerWaalsContact O-CD2 3.29Å; N50-H54 PolarHBondContact O-N 2.86Å; H54-I56 VanDerWaalsContact C-N 3.33Å; H54-I56 PolarHBondContact O-N 3.03Å; H54-C57 WeakPolarHBondContact O-CB 3.19Å; H54-C57 PolarHBondContact O-N 3.12Å; H54-I58 VanDerWaalsContact O-CG1 3.26Å; H54-I58 WeakPolarHBondContact O-CG1 3.1Å; H54-I58 PolarHBondContact O-N 3.41Å
55M96.3Very high94.4Very high0 Ų059.2 Ų59.20%029%0.287CS..Hα-helixtrans-64.6-35.8177.3-175.553.273.100112.7P46 R51 H52 F53 C57 I58 R59 I75 W76 L79P46-M55 HydrophobicContact CB-CE 3.89Å; R51-M55 WeakPolarHBondContact O-CB 3.23Å; R51-M55 PolarHBondContact O-N 3.19Å; H52-M55 PolarHBondContact O-N 2.87Å; F53-M55 VanDerWaalsContact C-N 3.29Å; F53-M55 PolarHBondContact O-N 2.84Å; M55-C57 VanDerWaalsContact C-N 3.34Å; M55-I58 PolarHBondContact O-N 3.37Å; M55-I58 HydrophobicContact SD-CB 4.35Å; M55-I58 HydrophobicContact SD-CG2 4.47Å; M55-R59 VanDerWaalsContact O-CB 3.24Å; M55-R59 WeakPolarHBondContact O-CB 3.24Å; M55-R59 PolarHBondContact O-N 3.2Å; M55-I75 HydrophobicContact CE-CB 4.36Å; M55-I75 HydrophobicContact CE-CG2 3.85Å; M55-I75 HydrophobicContact SD-CB 3.95Å; M55-I75 HydrophobicContact SD-CD1 4.31Å; M55-I75 HydrophobicContact SD-CG2 3.72Å; M55-W76 HydrophobicContact CB-CH2 3.6Å; M55-W76 HydrophobicContact CB-CZ2 3.37Å; M55-W76 HydrophobicContact CB-CZ3 4.38Å; M55-W76 VanDerWaalsContact CE-CD1 3.41Å; M55-W76 HydrophobicContact CE-CD2 3.76Å; M55-W76 HydrophobicContact CE-CG 3.7Å; M55-W76 HydrophobicContact CE-CZ2 4.19Å; M55-W76 VanDerWaalsContact CE-NE1 3.28Å; M55-W76 HydrophobicContact CG-CD2 4.02Å; M55-W76 HydrophobicContact CG-CE3 4.06Å; M55-W76 HydrophobicContact CG-CH2 3.58Å; M55-W76 HydrophobicContact CG-CZ2 3.56Å; M55-W76 HydrophobicContact CG-CZ3 3.85Å; M55-L79 HydrophobicContact CE-CD1 4.09Å
56I95.4Very high94.2Very high71 Ų7156.7 Ų56.736%0.36428%0.278SS..Hα-helixtrans-60.6-46.7172.4-67.6161.4000110H52 F53 H54 I58 R59 D60H52-I56 WeakPolarHBondContact O-CG1 3.28Å; H52-I56 PolarHBondContact O-N 2.94Å; F53-I56 PolarHBondContact O-N 3.44Å; H54-I56 VanDerWaalsContact C-N 3.33Å; H54-I56 PolarHBondContact O-N 3.03Å; I56-I58 PolarHBondContact O-N 2.81Å; I56-R59 PolarHBondContact O-N 3.08Å; I56-D60 WeakPolarHBondContact O-CB 3.49Å; I56-D60 VanDerWaalsContact O-CG 3.27Å; I56-D60 PolarHBondContact O-N 3.23Å
57C95.9Very high94Very high53 Ų5359.2 Ų59.236%0.35831%0.308SS..Hα-helixtrans-62.8-41.7177.5-58.90000113H44 F53 H54 M55 K61H44-C57 WeakPolarHBondContact CE1-CB 3.43Å; H44-C57 WeakPolarHBondContact ND1-CB 3.27Å; F53-C57 PolarHBondContact O-N 3.13Å; F53-C57 PolarHBondContact O-SG 3.28Å; F53-C57 VanDerWaalsContact O-SG 3.39Å; H54-C57 WeakPolarHBondContact O-CB 3.19Å; H54-C57 PolarHBondContact O-N 3.12Å; M55-C57 VanDerWaalsContact C-N 3.34Å; C57-K61 WeakPolarHBondContact O-CB 3.34Å; C57-K61 PolarHBondContact O-N 2.94Å; C57-K61 VanDerWaalsContact O-N 3.09Å
58I96.1Very high93.9Very high0 Ų062.5 Ų62.50%032%0.318CS..Hα-helixtrans-63.6-49.1177.6-67.4162.1000109.6L37 A40 M41 H44 P46 H54 M55 I56 D60 K61 F62 I75L37-I58 HydrophobicContact CD1-CG2 3.94Å; A40-I58 HydrophobicContact CB-CG2 4.44Å; M41-I58 HydrophobicContact CG-CD1 4.08Å; M41-I58 HydrophobicContact CG-CG1 4.24Å; M41-I58 HydrophobicContact CG-CG2 3.88Å; H44-I58 HydrophobicContact CB-CD1 3.71Å; H44-I58 HydrophobicContact CB-CG1 3.49Å; H44-I58 VanDerWaalsContact CB-CG1 3.49Å; P46-I58 HydrophobicContact CB-CD1 4.1Å; H54-I58 VanDerWaalsContact O-CG1 3.26Å; H54-I58 WeakPolarHBondContact O-CG1 3.1Å; H54-I58 PolarHBondContact O-N 3.41Å; M55-I58 PolarHBondContact O-N 3.37Å; M55-I58 HydrophobicContact SD-CB 4.35Å; M55-I58 HydrophobicContact SD-CG2 4.47Å; I56-I58 PolarHBondContact O-N 2.81Å; I58-D60 PolarHBondContact O-N 3.41Å; I58-K61 PolarHBondContact O-N 3.29Å; I58-F62 WeakPolarHBondContact O-CB 3.33Å; I58-F62 PolarHBondContact O-N 3.26Å; I58-I75 HydrophobicContact CG2-CG2 4.38Å
59R96Very high93.9Very high68 Ų6869.1 Ų69.126%0.25735%0.348SS..Hα-helixtrans-55.3-51.1177.2-177.9-157.765.7-155.26.4110.8M55 I56 K61 F62 S63 V70 S72 I75M55-R59 VanDerWaalsContact O-CB 3.24Å; M55-R59 WeakPolarHBondContact O-CB 3.24Å; M55-R59 PolarHBondContact O-N 3.2Å; I56-R59 PolarHBondContact O-N 3.08Å; R59-K61 VanDerWaalsContact C-N 3.35Å; R59-K61 PolarHBondContact O-N 3.2Å; R59-F62 PolarHBondContact O-N 2.8Å; R59-S63 WeakPolarHBondContact O-CB 3.48Å; R59-S63 PolarHBondContact O-N 3.24Å; R59-S63 PolarHBondContact O-OG 3.09Å; R59-S63 VanDerWaalsContact O-OG 3.08Å; R59-V70 WeakPolarHBondContact CD-O 3.44Å; R59-V70 WeakPolarHBondContact CG-O 3.3Å; R59-S72 WeakPolarHBondContact CD-OG 3.29Å; R59-I75 HydrophobicContact CB-CD1 3.96Å; R59-I75 HydrophobicContact CG-CD1 4.23Å
60D95.5Very high94Very high57 Ų5766.1 Ų66.131%0.30533%0.33SS..Hα-helixtrans-63.7-41.4-175.7-69.9-11000111.8I56 I58 Q64I56-D60 WeakPolarHBondContact O-CB 3.49Å; I56-D60 VanDerWaalsContact O-CG 3.27Å; I56-D60 PolarHBondContact O-N 3.23Å; I58-D60 PolarHBondContact O-N 3.41Å; D60-Q64 VanDerWaalsContact O-CG 3.23Å; D60-Q64 WeakPolarHBondContact O-CG 3.18Å; D60-Q64 PolarHBondContact O-N 3.31Å; D60-Q64 PolarHBondContact O-NE2 3.03Å; D60-Q64 VanDerWaalsContact O-NE2 3.14Å
61K95.9Very high94Very high87 Ų8763.9 Ų63.938%0.37832%0.32SS..Hα-helixtrans-66.2-43.6173.5-80.7-178.4172.7175.90112.4A40 H44 C57 I58 R59 Q64 N65A40-K61 HydrophobicContact CB-CB 3.72Å; H44-K61 PolarHBondContact NE2-NZ 3.36Å; C57-K61 WeakPolarHBondContact O-CB 3.34Å; C57-K61 PolarHBondContact O-N 2.94Å; C57-K61 VanDerWaalsContact O-N 3.09Å; I58-K61 PolarHBondContact O-N 3.29Å; R59-K61 VanDerWaalsContact C-N 3.35Å; R59-K61 PolarHBondContact O-N 3.2Å; K61-Q64 PolarHBondContact O-N 2.8Å; K61-N65 VanDerWaalsContact O-CG 3.26Å; K61-N65 PolarHBondContact O-N 3.19Å
62F96Very high94Very high0 Ų060.8 Ų60.80%031%0.312CS..Hα-helixtrans-64.2-46-179.8178.9-115.8000111.2V27 W29 V33 C36 L37 A40 I58 R59 Q64 N65 I66 V70 I75V27-F62 HydrophobicContact CG1-CZ 4.45Å; W29-F62 HydrophobicContact CH2-CE1 4.14Å; W29-F62 AromaticContact CH2-CZ 3.91Å; W29-F62 HydrophobicContact CH2-CZ 3.91Å; W29-F62 HydrophobicContact CZ3-CE1 4.46Å; W29-F62 HydrophobicContact CZ3-CE2 4.36Å; W29-F62 AromaticContact CZ3-CZ 3.77Å; W29-F62 HydrophobicContact CZ3-CZ 3.77Å; V33-F62 HydrophobicContact CG1-CE2 3.84Å; V33-F62 HydrophobicContact CG1-CZ 3.54Å; V33-F62 WeakPolarHBondContact O-CE2 3.4Å; C36-F62 HydrophobicContact CB-CD2 4.36Å; C36-F62 HydrophobicContact CB-CE2 4.25Å; L37-F62 HydrophobicContact CB-CD2 3.89Å; L37-F62 HydrophobicContact CB-CE2 3.75Å; L37-F62 HydrophobicContact CD1-CD2 4.27Å; L37-F62 HydrophobicContact CD1-CG 4.36Å; A40-F62 HydrophobicContact CB-CB 4.08Å; I58-F62 WeakPolarHBondContact O-CB 3.33Å; I58-F62 PolarHBondContact O-N 3.26Å; R59-F62 PolarHBondContact O-N 2.8Å; F62-Q64 VanDerWaalsContact C-N 3.26Å; F62-Q64 PolarHBondContact O-N 3.39Å; F62-N65 PolarHBondContact O-N 3.34Å; F62-N65 VanDerWaalsContact O-N 3.08Å; F62-I66 HydrophobicContact CD1-CD1 4.35Å; F62-I66 HydrophobicContact CD2-CG2 4.22Å; F62-I66 HydrophobicContact CE1-CD1 3.86Å; F62-I66 HydrophobicContact CE2-CG2 3.77Å; F62-I66 HydrophobicContact CZ-CD1 4.03Å; F62-I66 HydrophobicContact CZ-CG2 4.08Å; F62-I66 WeakPolarHBondContact O-CG1 3.5Å; F62-I66 PolarHBondContact O-N 3.29Å; F62-V70 HydrophobicContact CD1-CB 4.18Å; F62-V70 HydrophobicContact CD1-CG1 4.34Å; F62-V70 HydrophobicContact CD1-CG2 4.15Å; F62-V70 HydrophobicContact CE1-CB 4.2Å; F62-V70 HydrophobicContact CE1-CG1 4.1Å; F62-V70 HydrophobicContact CE1-CG2 3.88Å; F62-I75 HydrophobicContact CB-CD1 4.46Å; F62-I75 HydrophobicContact CD1-CD1 3.9Å; F62-I75 HydrophobicContact CD1-CG1 4.24Å; F62-I75 HydrophobicContact CG-CD1 4.49Å
63S94.1Very high93.9Very high8 Ų858.9 Ų58.96%0.05631%0.31CS..Hα-helixtrans-57.8-38.8175.6-67.90000112.2R59 G67 R68 Q69 V70R59-S63 WeakPolarHBondContact O-CB 3.48Å; R59-S63 PolarHBondContact O-N 3.24Å; R59-S63 PolarHBondContact O-OG 3.09Å; R59-S63 VanDerWaalsContact O-OG 3.08Å; S63-G67 WeakPolarHBondContact O-CA 3.23Å; S63-G67 PolarHBondContact O-N 3.32Å; S63-R68 CarbonylContact C-O 3.57Å; S63-R68 WeakPolarHBondContact CA-O 3.46Å; S63-R68 WeakPolarHBondContact CB-O 3.46Å; S63-R68 PolarHBondContact O-N 2.98Å; S63-R68 VanDerWaalsContact O-N 3.09Å; S63-R68 PolarHBondContact OG-O 2.75Å; S63-Q69 PolarHBondContact OG-OE1 3.14Å; S63-V70 PolarHBondContact OG-N 3.17Å
64Q93.6Very high93.9Very high148 Ų14853.2 Ų53.269%0.69229%0.287SS*.Hα-helixtrans-66.8-43.1174.4-73.2167.546.500112.2D60 K61 F62 I66 G67D60-Q64 VanDerWaalsContact O-CG 3.23Å; D60-Q64 WeakPolarHBondContact O-CG 3.18Å; D60-Q64 PolarHBondContact O-N 3.31Å; D60-Q64 PolarHBondContact O-NE2 3.03Å; D60-Q64 VanDerWaalsContact O-NE2 3.14Å; K61-Q64 PolarHBondContact O-N 2.8Å; F62-Q64 VanDerWaalsContact C-N 3.26Å; F62-Q64 PolarHBondContact O-N 3.39Å; Q64-I66 PolarHBondContact O-N 2.94Å; Q64-G67 PolarHBondContact O-N 3.37Å
65N92.9Very high93.8Very high78 Ų7850.8 Ų50.842%0.41728%0.276SS..Hα-helixtrans-64.5-38.6-178.3-72.5-14000112.7C36 K61 F62C36-N65 HydrophobicContact CB-CB 4.03Å; C36-N65 PolarHBondContact O-ND2 3.3Å; K61-N65 VanDerWaalsContact O-CG 3.26Å; K61-N65 PolarHBondContact O-N 3.19Å; F62-N65 PolarHBondContact O-N 3.34Å; F62-N65 VanDerWaalsContact O-N 3.08Å
66I89.9Confident93.8Very high52 Ų5253.4 Ų53.427%0.26729%0.286SS..Hα-helixtrans-93.1-6.2-179.972.5172.9000113.2V33 C36 F62 Q64 R68 V70V33-I66 HydrophobicContact CG1-CG2 4.46Å; C36-I66 HydrophobicContact CB-CG2 4.19Å; F62-I66 HydrophobicContact CD1-CD1 4.35Å; F62-I66 HydrophobicContact CD2-CG2 4.22Å; F62-I66 HydrophobicContact CE1-CD1 3.86Å; F62-I66 HydrophobicContact CE2-CG2 3.77Å; F62-I66 HydrophobicContact CZ-CD1 4.03Å; F62-I66 HydrophobicContact CZ-CG2 4.08Å; F62-I66 WeakPolarHBondContact O-CG1 3.5Å; F62-I66 PolarHBondContact O-N 3.29Å; Q64-I66 PolarHBondContact O-N 2.94Å; I66-R68 VanDerWaalsContact C-N 3.28Å; I66-R68 HydrophobicContact CD1-CB 4.06Å; I66-R68 HydrophobicContact CG1-CB 4Å; I66-R68 PolarHBondContact O-N 3.06Å; I66-V70 HydrophobicContact CD1-CG2 3.44Å; I66-V70 VanDerWaalsContact CD1-CG2 3.44Å
67G88.9Confident93.8Very high71 Ų7155.3 Ų55.373%0.73230%0.297SS*.THydrogen-bonded Turntrans67.921.8-178.500000114.7S63 Q64S63-G67 WeakPolarHBondContact O-CA 3.23Å; S63-G67 PolarHBondContact O-N 3.32Å; Q64-G67 PolarHBondContact O-N 3.37Å
68R90.4Very high93.8Very high87 Ų8753.7 Ų53.733%0.32828%0.284SS..SBendtrans-140.2141.5-176-171.4-168.2-170-167.57.8109.9E24 S26 S63 I66E24-R68 PolarHBondContact O-NH2 3.02Å; E24-R68 IonicContact OE1-NE 3.27Å; E24-R68 IonicContact OE1-NH2 3.57Å; S26-R68 PolarHBondContact O-NH1 2.97Å; S63-R68 CarbonylContact C-O 3.57Å; S63-R68 WeakPolarHBondContact CA-O 3.46Å; S63-R68 WeakPolarHBondContact CB-O 3.46Å; S63-R68 PolarHBondContact O-N 2.98Å; S63-R68 VanDerWaalsContact O-N 3.09Å; S63-R68 PolarHBondContact OG-O 2.75Å; I66-R68 VanDerWaalsContact C-N 3.28Å; I66-R68 HydrophobicContact CD1-CB 4.06Å; I66-R68 HydrophobicContact CG1-CB 4Å; I66-R68 PolarHBondContact O-N 3.06Å
69Q90.5Very high93.8Very high144 Ų14453.7 Ų53.767%0.67328%0.284SS*.  trans-70.8133.1170.8-75.3-67.54.100111.4S63S63-Q69 PolarHBondContact OG-OE1 3.14Å
70V91.7Very high93.7Very high5 Ų552.6 Ų52.63%0.0329%0.294CS..  trans-127.6138.7177.5179.20000109V27 R59 F62 S63 I66 V74 I75V27-V70 HydrophobicContact CG2-CB 4.37Å; V27-V70 HydrophobicContact CG2-CG1 3.72Å; V27-V70 HydrophobicContact CG2-CG2 3.7Å; R59-V70 WeakPolarHBondContact CD-O 3.44Å; R59-V70 WeakPolarHBondContact CG-O 3.3Å; F62-V70 HydrophobicContact CD1-CB 4.18Å; F62-V70 HydrophobicContact CD1-CG1 4.34Å; F62-V70 HydrophobicContact CD1-CG2 4.15Å; F62-V70 HydrophobicContact CE1-CB 4.2Å; F62-V70 HydrophobicContact CE1-CG1 4.1Å; F62-V70 HydrophobicContact CE1-CG2 3.88Å; S63-V70 PolarHBondContact OG-N 3.17Å; I66-V70 HydrophobicContact CD1-CG2 3.44Å; I66-V70 VanDerWaalsContact CD1-CG2 3.44Å; V70-V74 HydrophobicContact CG1-CB 4.12Å; V70-V74 HydrophobicContact CG1-CG1 4.19Å; V70-I75 HydrophobicContact CG1-CG1 4.14Å
71S93.9Very high93.7Very high30 Ų3055 Ų5521%0.2131%0.31CS..  trans-72.2146.117449.90000112.1D25 S73 V74D25-S71 VanDerWaalsContact OD1-CB 3.24Å; D25-S71 WeakPolarHBondContact OD1-CB 3.49Å; D25-S71 PolarHBondContact OD1-OG 3.2Å; S71-S73 PolarHBondContact O-N 3.39Å; S71-S73 PolarHBondContact OG-OG 2.98Å; S71-V74 PolarHBondContact O-N 3.17Å; S71-V74 VanDerWaalsContact OG-CG2 3.23Å; S71-V74 WeakPolarHBondContact OG-CG2 3.45Å
72S94.4Very high93.6Very high22 Ų2254.1 Ų54.115%0.15431%0.309CS..Hα-helixtrans-61.8-29177.9-62.30000113R59 I75 W76R59-S72 WeakPolarHBondContact CD-OG 3.29Å; S72-I75 PolarHBondContact O-N 2.83Å; S72-W76 PolarHBondContact O-N 3.38Å; S72-W76 VanDerWaalsContact O-N 3.12Å
73S93.9Very high93.5Very high63 Ų6359.1 Ų59.144%0.44133%0.328SS..Hα-helixtrans-62.2-44.8177.446.10000111.6S71 I75 W76 D77S71-S73 PolarHBondContact O-N 3.39Å; S71-S73 PolarHBondContact OG-OG 2.98Å; S73-I75 VanDerWaalsContact C-N 3.26Å; S73-I75 PolarHBondContact O-N 3.08Å; S73-W76 PolarHBondContact O-N 3.02Å; S73-W76 VanDerWaalsContact O-N 3.13Å; S73-D77 WeakPolarHBondContact O-CB 3.26Å; S73-D77 PolarHBondContact O-N 3.45Å
74V94.5Very high93.6Very high23 Ų2363.8 Ų63.814%0.13935%0.353CS..Hα-helixtrans-60.9-37.2-179.7172.90000111.7D25 V27 W29 V70 S71 H78D25-V74 HydrophobicContact CB-CG2 4.06Å; D25-V74 WeakPolarHBondContact O-CG2 3.22Å; V27-V74 HydrophobicContact CB-CG1 4.06Å; V27-V74 HydrophobicContact CG2-CG1 3.91Å; W29-V74 HydrophobicContact CZ2-CG1 3.95Å; V70-V74 HydrophobicContact CG1-CB 4.12Å; V70-V74 HydrophobicContact CG1-CG1 4.19Å; S71-V74 PolarHBondContact O-N 3.17Å; S71-V74 VanDerWaalsContact OG-CG2 3.23Å; S71-V74 WeakPolarHBondContact OG-CG2 3.45Å; V74-H78 WeakPolarHBondContact O-CB 3.46Å; V74-H78 PolarHBondContact O-N 3.38Å
75I94.9Very high93.6Very high0 Ų058.6 Ų58.60%033%0.329CS..Hα-helixtrans-68.6-45.9176.4-58.5174.3000110.6L37 M55 I58 R59 F62 V70 S72 S73 H78 L79L37-I75 HydrophobicContact CD1-CG2 3.67Å; M55-I75 HydrophobicContact CE-CB 4.36Å; M55-I75 HydrophobicContact CE-CG2 3.85Å; M55-I75 HydrophobicContact SD-CB 3.95Å; M55-I75 HydrophobicContact SD-CD1 4.31Å; M55-I75 HydrophobicContact SD-CG2 3.72Å; I58-I75 HydrophobicContact CG2-CG2 4.38Å; R59-I75 HydrophobicContact CB-CD1 3.96Å; R59-I75 HydrophobicContact CG-CD1 4.23Å; F62-I75 HydrophobicContact CB-CD1 4.46Å; F62-I75 HydrophobicContact CD1-CD1 3.9Å; F62-I75 HydrophobicContact CD1-CG1 4.24Å; F62-I75 HydrophobicContact CG-CD1 4.49Å; V70-I75 HydrophobicContact CG1-CG1 4.14Å; S72-I75 PolarHBondContact O-N 2.83Å; S73-I75 VanDerWaalsContact C-N 3.26Å; S73-I75 PolarHBondContact O-N 3.08Å; I75-H78 PolarHBondContact O-N 3.33Å; I75-L79 HydrophobicContact CG2-CD1 4.02Å; I75-L79 HydrophobicContact CG2-CG 4.42Å; I75-L79 WeakPolarHBondContact O-CB 3.24Å; I75-L79 VanDerWaalsContact O-CG 3.27Å; I75-L79 WeakPolarHBondContact O-CG 3.21Å; I75-L79 PolarHBondContact O-N 2.93Å
76W95.8Very high93.6Very high54 Ų5460.1 Ų60.121%0.20533%0.334CS..Hα-helixtrans-62.9-42.4176.6-92.1-47.8000112.5P46 H52 M55 S72 S73 H78 L79 G80P46-W76 PolarHBondContact O-NE1 3.25Å; H52-W76 AromaticContact CE1-CH2 3.95Å; H52-W76 AromaticContact ND1-CH2 3.29Å; H52-W76 VanDerWaalsContact ND1-CH2 3.29Å; H52-W76 WeakPolarHBondContact ND1-CH2 3.48Å; H52-W76 AromaticContact ND1-CZ2 3.92Å; M55-W76 HydrophobicContact CB-CH2 3.6Å; M55-W76 HydrophobicContact CB-CZ2 3.37Å; M55-W76 HydrophobicContact CB-CZ3 4.38Å; M55-W76 VanDerWaalsContact CE-CD1 3.41Å; M55-W76 HydrophobicContact CE-CD2 3.76Å; M55-W76 HydrophobicContact CE-CG 3.7Å; M55-W76 HydrophobicContact CE-CZ2 4.19Å; M55-W76 VanDerWaalsContact CE-NE1 3.28Å; M55-W76 HydrophobicContact CG-CD2 4.02Å; M55-W76 HydrophobicContact CG-CE3 4.06Å; M55-W76 HydrophobicContact CG-CH2 3.58Å; M55-W76 HydrophobicContact CG-CZ2 3.56Å; M55-W76 HydrophobicContact CG-CZ3 3.85Å; S72-W76 PolarHBondContact O-N 3.38Å; S72-W76 VanDerWaalsContact O-N 3.12Å; S73-W76 PolarHBondContact O-N 3.02Å; S73-W76 VanDerWaalsContact O-N 3.13Å; W76-H78 VanDerWaalsContact C-N 3.35Å; W76-L79 PolarHBondContact O-N 3.44Å; W76-G80 PolarHBondContact O-N 2.88Å
77D95.5Very high93.7Very high112 Ų11260 Ų6060%0.59934%0.34SS*.Hα-helixtrans-60.8-47.4178.5-70.1-15.9000109.9S73 G80 T81S73-D77 WeakPolarHBondContact O-CB 3.26Å; S73-D77 PolarHBondContact O-N 3.45Å; D77-G80 PolarHBondContact O-N 3.17Å; D77-T81 WeakPolarHBondContact O-CG2 3.5Å; D77-T81 PolarHBondContact O-N 3.19Å
78H95.5Very high93.9Very high18 Ų1860 Ų608%0.08332%0.323CS..Hα-helixtrans-62.9-45.7177.2-168.755.3000112.7W29 E34 V74 I75 W76 G80 T81 M82W29-H78 AromaticContact CD1-CE1 3.81Å; W29-H78 AromaticContact CD1-CG 3.88Å; W29-H78 AromaticContact CD1-ND1 3.43Å; W29-H78 HydrophobicContact CD2-CB 4.13Å; W29-H78 AromaticContact CD2-CD2 3.36Å; W29-H78 AromaticContact CD2-CE1 3.68Å; W29-H78 AromaticContact CD2-CG 3.42Å; W29-H78 VanDerWaalsContact CD2-CG 3.42Å; W29-H78 AromaticContact CD2-ND1 3.64Å; W29-H78 AromaticContact CD2-NE2 3.52Å; W29-H78 AromaticContact CE2-CD2 3.58Å; W29-H78 AromaticContact CE2-CG 3.21Å; W29-H78 AromaticContact CE2-ND1 3.66Å; W29-H78 AromaticContact CE3-CD2 3.35Å; W29-H78 AromaticContact CE3-CG 3.9Å; W29-H78 AromaticContact CE3-NE2 3.55Å; W29-H78 AromaticContact CG-CE1 3.44Å; W29-H78 VanDerWaalsContact CG-CE1 3.44Å; W29-H78 AromaticContact CG-CG 3.85Å; W29-H78 AromaticContact CG-ND1 3.51Å; W29-H78 AromaticContact CG-NE2 3.75Å; W29-H78 HydrophobicContact CH2-CB 3.96Å; W29-H78 AromaticContact CH2-CD2 3.77Å; W29-H78 HydrophobicContact CZ2-CB 3.28Å; W29-H78 AromaticContact CZ2-CD2 3.77Å; W29-H78 AromaticContact CZ2-CG 3.53Å; W29-H78 AromaticContact CZ3-CD2 3.56Å; W29-H78 AromaticContact NE1-CG 3.51Å; W29-H78 AromaticContact NE1-ND1 3.51Å; E34-H78 IonicContact OE1-CE1 2.78Å; E34-H78 PolarHBondContact OE1-CE1 2.9Å; E34-H78 VanDerWaalsContact OE1-CE1 3.27Å; E34-H78 IonicContact OE1-NE2 3.9Å; E34-H78 PolarHBondContact OE1-NE2 2.94Å; V74-H78 WeakPolarHBondContact O-CB 3.46Å; V74-H78 PolarHBondContact O-N 3.38Å; I75-H78 PolarHBondContact O-N 3.33Å; W76-H78 VanDerWaalsContact C-N 3.35Å; H78-G80 PolarHBondContact O-N 3.42Å; H78-T81 WeakPolarHBondContact O-CB 3.39Å; H78-T81 PolarHBondContact O-N 3.03Å; H78-T81 PolarHBondContact O-OG1 2.78Å; H78-M82 WeakPolarHBondContact NE2-CE 3.29Å; H78-M82 PolarHBondContact O-N 3.04Å
79L95.3Very high93.9Very high1 Ų158.9 Ų58.91%0.00532%0.321CS..Hα-helixtrans-59.1-36.5175-72.5174000111.9L37 M41 P46 M55 I75 W76 T81 M82 Y83 M85L37-L79 HydrophobicContact CD2-CD2 4.25Å; M41-L79 HydrophobicContact CE-CD1 4.25Å; M41-L79 HydrophobicContact CE-CD2 3.87Å; M41-L79 HydrophobicContact SD-CD1 4.3Å; M41-L79 HydrophobicContact SD-CD2 3.74Å; P46-L79 HydrophobicContact CB-CD1 3.77Å; P46-L79 HydrophobicContact CG-CD1 4Å; M55-L79 HydrophobicContact CE-CD1 4.09Å; I75-L79 HydrophobicContact CG2-CD1 4.02Å; I75-L79 HydrophobicContact CG2-CG 4.42Å; I75-L79 WeakPolarHBondContact O-CB 3.24Å; I75-L79 VanDerWaalsContact O-CG 3.27Å; I75-L79 WeakPolarHBondContact O-CG 3.21Å; I75-L79 PolarHBondContact O-N 2.93Å; W76-L79 PolarHBondContact O-N 3.44Å; L79-T81 PolarHBondContact O-N 3.48Å; L79-M82 HydrophobicContact CD2-CE 4.36Å; L79-M82 PolarHBondContact O-N 3.13Å; L79-Y83 HydrophobicContact CD2-CD2 4.02Å; L79-Y83 HydrophobicContact CD2-CE2 3.99Å; L79-Y83 WeakPolarHBondContact O-CB 3.31Å; L79-Y83 PolarHBondContact O-N 3.46Å; L79-M85 HydrophobicContact CB-CE 4.4Å; L79-M85 HydrophobicContact CB-SD 4.02Å
80G95.4Very high93.8Very high44 Ų4458.8 Ų58.845%0.45432%0.321SS..Hα-helixtrans-66.9-20.9174.900000114.4W76 D77 H78W76-G80 PolarHBondContact O-N 2.88Å; D77-G80 PolarHBondContact O-N 3.17Å; H78-G80 PolarHBondContact O-N 3.42Å
81T95Very high93.6Very high107 Ų10762.4 Ų62.466%0.65635%0.346SS*.Hα-helixtrans-77.7-27.8172.6730000112.9D77 H78 L79D77-T81 WeakPolarHBondContact O-CG2 3.5Å; D77-T81 PolarHBondContact O-N 3.19Å; H78-T81 WeakPolarHBondContact O-CB 3.39Å; H78-T81 PolarHBondContact O-N 3.03Å; H78-T81 PolarHBondContact O-OG1 2.78Å; L79-T81 PolarHBondContact O-N 3.48Å
82M93.5Very high93.4Very high69 Ų6963 Ų6334%0.3435%0.346SS..Hα-helixtrans-100.3-27.9-176.2-65.3-170.3-69.700113.4F38 H78 L79F38-M82 HydrophobicContact CE1-CE 4.02Å; F38-M82 HydrophobicContact CZ-CE 3.88Å; F38-M82 HydrophobicContact CZ-SD 4.15Å; H78-M82 WeakPolarHBondContact NE2-CE 3.29Å; H78-M82 PolarHBondContact O-N 3.04Å; L79-M82 HydrophobicContact CD2-CE 4.36Å; L79-M82 PolarHBondContact O-N 3.13Å
83Y94.5Very high92.8Very high106 Ų10668.7 Ų68.742%0.41637%0.373SS..SBendtrans-131147-173.5-58.1-75.2000112F38 L79 M85 L88F38-Y83 HydrophobicContact CE1-CE2 4.47Å; L79-Y83 HydrophobicContact CD2-CD2 4.02Å; L79-Y83 HydrophobicContact CD2-CE2 3.99Å; L79-Y83 WeakPolarHBondContact O-CB 3.31Å; L79-Y83 PolarHBondContact O-N 3.46Å; Y83-M85 PolarHBondContact O-N 3.36Å; Y83-L88 HydrophobicContact CG-CD1 4.39Å
84D95.3Very high92Very high106 Ų10668.7 Ų68.757%0.56737%0.368SS*.  trans-75.391.4165.2-171.5-20.8000109.7Q86 A87 L88D84-Q86 VanDerWaalsContact C-N 3.27Å; D84-Q86 PolarHBondContact O-N 3.38Å; D84-Q86 PolarHBondContact OD1-N 3.36Å; D84-A87 HydrophobicContact CB-CB 4.09Å; D84-A87 VanDerWaalsContact CG-CB 3.5Å; D84-A87 PolarHBondContact OD1-N 2.81Å; D84-L88 WeakPolarHBondContact O-CB 3.34Å; D84-L88 VanDerWaalsContact O-CG 3.3Å; D84-L88 WeakPolarHBondContact O-CG 3.34Å; D84-L88 PolarHBondContact O-N 3.08Å; D84-L88 VanDerWaalsContact O-N 3.08Å
85M93.5Very high91.2Very high38 Ų3872.6 Ų72.619%0.18739%0.394CS..Hα-helixtrans-65.9-29-177.5-67-62-72.700113P46 V47 L79 Y83 H89P46-M85 HydrophobicContact CB-CE 4.22Å; P46-M85 HydrophobicContact CG-CE 4.3Å; V47-M85 HydrophobicContact CG1-CE 3.42Å; V47-M85 VanDerWaalsContact CG1-CE 3.42Å; V47-M85 HydrophobicContact CG1-SD 4.11Å; L79-M85 HydrophobicContact CB-CE 4.4Å; L79-M85 HydrophobicContact CB-SD 4.02Å; Y83-M85 PolarHBondContact O-N 3.36Å; M85-H89 VanDerWaalsContact O-CB 3.29Å; M85-H89 WeakPolarHBondContact O-CB 3.31Å; M85-H89 PolarHBondContact O-N 2.97Å
86Q92.5Very high90.6Very high111 Ų11177.7 Ų77.752%0.51942%0.416SS..Hα-helixtrans-71.9-50.4179.5-176.764.132.700110D84 L88 H89 E90D84-Q86 VanDerWaalsContact C-N 3.27Å; D84-Q86 PolarHBondContact O-N 3.38Å; D84-Q86 PolarHBondContact OD1-N 3.36Å; Q86-L88 VanDerWaalsContact C-N 3.28Å; Q86-L88 PolarHBondContact O-N 3.42Å; Q86-H89 WeakPolarHBondContact O-CB 3.38Å; Q86-H89 PolarHBondContact O-N 3.44Å; Q86-H89 VanDerWaalsContact O-N 3.13Å; Q86-E90 PolarHBondContact NE2-OE1 3.47Å; Q86-E90 PolarHBondContact O-N 3.39Å
87A93.3Very high89.9Confident48 Ų4881 Ų8140%0.39745%0.445SS..Hα-helixtrans-59.9-41.2177.100000111.5D84 E90 S91D84-A87 HydrophobicContact CB-CB 4.09Å; D84-A87 VanDerWaalsContact CG-CB 3.5Å; D84-A87 PolarHBondContact OD1-N 2.81Å; A87-E90 PolarHBondContact O-N 3.12Å; A87-S91 VanDerWaalsContact O-CB 3.31Å; A87-S91 WeakPolarHBondContact O-CB 2.88Å; A87-S91 PolarHBondContact O-N 3.06Å; A87-S91 PolarHBondContact O-OG 3.21Å
88L93Very high89.3Confident71 Ų7181.1 Ų81.137%0.37245%0.445SS..Hα-helixtrans-63.3-41.2175.6-75172.3000112.3V47 Y83 D84 Q86 S91 E92V47-L88 HydrophobicContact CG1-CB 4.06Å; V47-L88 HydrophobicContact CG2-CB 4.18Å; Y83-L88 HydrophobicContact CG-CD1 4.39Å; D84-L88 WeakPolarHBondContact O-CB 3.34Å; D84-L88 VanDerWaalsContact O-CG 3.3Å; D84-L88 WeakPolarHBondContact O-CG 3.34Å; D84-L88 PolarHBondContact O-N 3.08Å; D84-L88 VanDerWaalsContact O-N 3.08Å; Q86-L88 VanDerWaalsContact C-N 3.28Å; Q86-L88 PolarHBondContact O-N 3.42Å; L88-S91 WeakPolarHBondContact CA-OG 3.3Å; L88-S91 PolarHBondContact O-N 3.39Å; L88-S91 PolarHBondContact O-OG 3.19Å; L88-E92 PolarHBondContact O-N 3.07Å
89H90.6Very high88.9Confident65 Ų6584.8 Ų84.830%0.30147%0.469SS..Hα-helixtrans-63.4-41.6178.1-17737.6000112.9V47 G48 M85 Q86V47-H89 HydrophobicContact CB-CB 4.25Å; V47-H89 HydrophobicContact CG1-CB 4.44Å; G48-H89 WeakPolarHBondContact CA-ND1 3.02Å; G48-H89 PolarHBondContact N-ND1 3.29Å; G48-H89 VanDerWaalsContact N-ND1 3.12Å; G48-H89 PolarHBondContact O-CE1 2.81Å; M85-H89 VanDerWaalsContact O-CB 3.29Å; M85-H89 WeakPolarHBondContact O-CB 3.31Å; M85-H89 PolarHBondContact O-N 2.97Å; Q86-H89 WeakPolarHBondContact O-CB 3.38Å; Q86-H89 PolarHBondContact O-N 3.44Å; Q86-H89 VanDerWaalsContact O-N 3.13Å
90E88.6Confident88.5Confident141 Ų14194.3 Ų94.366%0.65951%0.513SS*.Hα-helixtrans-73.2-30.6178.1-69.2177.5-170.200112.7Q86 A87 E92Q86-E90 PolarHBondContact NE2-OE1 3.47Å; Q86-E90 PolarHBondContact O-N 3.39Å; A87-E90 PolarHBondContact O-N 3.12Å; E90-E92 PolarHBondContact O-N 3.29Å
91S87.7Confident88.2Confident82 Ų82100.1 Ų100.157%0.57353%0.526SS*.Hα-helixtrans-72.4-15.3178.675.60000113.9A87 L88 I93A87-S91 VanDerWaalsContact O-CB 3.31Å; A87-S91 WeakPolarHBondContact O-CB 2.88Å; A87-S91 PolarHBondContact O-N 3.06Å; A87-S91 PolarHBondContact O-OG 3.21Å; L88-S91 WeakPolarHBondContact CA-OG 3.3Å; L88-S91 PolarHBondContact O-N 3.39Å; L88-S91 PolarHBondContact O-OG 3.19Å; S91-I93 PolarHBondContact O-N 3.46Å
92E88.1Confident88.1Confident42 Ų42100.4 Ų100.420%0.19653%0.532CS..PPolyproline II helixtrans-73122.1-175.7-176159.9-161.900111.6K45 V47 G48 L88 E90 L94K45-E92 WeakPolarHBondContact CD-OE1 2.97Å; K45-E92 IonicContact NZ-OE1 2.81Å; K45-E92 PolarHBondContact NZ-OE1 3.29Å; V47-E92 VanDerWaalsContact C-OE2 3.25Å; V47-E92 VanDerWaalsContact O-OE2 3.06Å; G48-E92 WeakPolarHBondContact CA-OE2 3.5Å; G48-E92 PolarHBondContact N-OE2 3.35Å; L88-E92 PolarHBondContact O-N 3.07Å; E90-E92 PolarHBondContact O-N 3.29Å; E92-L94 PolarHBondContact O-N 3.42Å
93I81.6Confident88Confident142 Ų142105.9 Ų105.973%0.72856%0.555SS**PPolyproline II helixtrans-67129.4173.758.4169.7000110.5S91S91-I93 PolarHBondContact O-N 3.46Å
94L77.8Confident87.9Confident62 Ų62105.4 Ų105.433%0.32557%0.567SS.*PPolyproline II helixtrans-69.3129.6174-66.5170.5000109V49 E92 F96 N98V49-L94 HydrophobicContact CB-CD2 4.29Å; V49-L94 HydrophobicContact CG1-CD2 3.31Å; V49-L94 HydrophobicContact CG2-CD2 3.98Å; E92-L94 PolarHBondContact O-N 3.42Å; L94-F96 HydrophobicContact CD2-CE1 4.48Å; L94-F96 HydrophobicContact CD2-CZ 4.15Å; L94-F96 PolarHBondContact O-N 3.18Å; L94-N98 HydrophobicContact CB-CB 4.33Å; L94-N98 HydrophobicContact CD1-CB 3.23Å; L94-N98 VanDerWaalsContact CD1-CG 3.41Å; L94-N98 WeakPolarHBondContact CD1-ND2 3.13Å; L94-N98 HydrophobicContact CG-CB 4.39Å
95P78.5Confident87.7Confident106 Ų106103.8 Ų103.869%0.68856%0.558SS**SBendtrans-72.8-6.7-178.629.1-33.6000112.6
96F80.9Confident87.7Confident107 Ų107105.1 Ų105.147%0.46957%0.569SS.*SBendtrans-122.8156.4176.854.5-94.4000110.3V49 L94 N98V49-F96 HydrophobicContact CG1-CZ 4.41Å; V49-F96 HydrophobicContact CG2-CE1 4.5Å; L94-F96 HydrophobicContact CD2-CE1 4.48Å; L94-F96 HydrophobicContact CD2-CZ 4.15Å; L94-F96 PolarHBondContact O-N 3.18Å; F96-N98 HydrophobicContact CD2-CB 4.47Å; F96-N98 HydrophobicContact CE2-CB 4.24Å; F96-N98 PolarHBondContact O-N 3.43Å; F96-N98 VanDerWaalsContact O-N 3.09Å
97P82.1Confident87.7Confident124 Ų124104.5 Ų104.581%0.80557%0.566SS**  trans-62.2114.6177.5-15.928.8000110.4
98N82.7Confident87.5Confident113 Ų113108.7 Ų108.760%0.60458%0.578SS**  trans-115.666.7175.9-171.348.1000110.3L94 F96L94-N98 HydrophobicContact CB-CB 4.33Å; L94-N98 HydrophobicContact CD1-CB 3.23Å; L94-N98 VanDerWaalsContact CD1-CG 3.41Å; L94-N98 WeakPolarHBondContact CD1-ND2 3.13Å; L94-N98 HydrophobicContact CG-CB 4.39Å; F96-N98 HydrophobicContact CD2-CB 4.47Å; F96-N98 HydrophobicContact CE2-CB 4.24Å; F96-N98 PolarHBondContact O-N 3.43Å; F96-N98 VanDerWaalsContact O-N 3.09Å
99T86.8Confident87.4Confident96 Ų96108.8 Ų108.859%0.58958%0.578SS**  trans-80.5133.3172.743.20000109.5K101T99-K101 PolarHBondContact O-N 3.09Å; T99-K101 WeakPolarHBondContact OG1-CE 3.43Å
100E86.8Confident87.5Confident200 Ų200108 Ų10894%0.93558%0.575SS**  trans-63.5130.9173.8-167.7179.7176.200109.7
101K89Confident87.5Confident167 Ų167107 Ų10773%0.72657%0.57SS**  trans-139.9147.5179.9-67.3-178.4-176.5174.40109.4T99 F103T99-K101 PolarHBondContact O-N 3.09Å; T99-K101 WeakPolarHBondContact OG1-CE 3.43Å; K101-F103 PolarHBondContact O-N 3.28Å
102S92.5Very high87.5Confident112 Ų112109.2 Ų109.278%0.78357%0.572SS**  trans-60.4124.8170.2550000109.6S104S102-S104 PolarHBondContact O-N 3.26Å
103F91.7Very high87.4Confident185 Ų185112.7 Ų112.781%0.81160%0.596SS**  trans-65.5121.2174.7179.2-96.5000109.8K101 L105K101-F103 PolarHBondContact O-N 3.28Å; F103-L105 HydrophobicContact CE1-CB 4.43Å; F103-L105 HydrophobicContact CE1-CD1 4.18Å; F103-L105 HydrophobicContact CZ-CD1 3.77Å
104S92.8Very high87.4Confident96 Ų96114.1 Ų114.167%0.67160%0.597SS**  trans-126125.1168.357.70000108S102S102-S104 PolarHBondContact O-N 3.26Å
105L91.5Very high87.3Confident72 Ų72114 Ų11438%0.37761%0.611SS.*  trans-67.6136.6174.3-158.676.6000108.8F103 E107 I109 I110F103-L105 HydrophobicContact CE1-CB 4.43Å; F103-L105 HydrophobicContact CE1-CD1 4.18Å; F103-L105 HydrophobicContact CZ-CD1 3.77Å; L105-E107 PolarHBondContact O-N 3.19Å; L105-I109 HydrophobicContact CD1-CD1 4.28Å; L105-I109 HydrophobicContact CD1-CG2 4.47Å; L105-I109 HydrophobicContact CD2-CB 3.81Å; L105-I109 HydrophobicContact CD2-CG2 3.62Å; L105-I109 HydrophobicContact CG-CB 4.01Å; L105-I109 HydrophobicContact CG-CD1 4.35Å; L105-I109 HydrophobicContact CG-CG2 4.16Å; L105-I110 HydrophobicContact CB-CD1 4.18Å; L105-I110 HydrophobicContact CB-CG1 4.02Å; L105-I110 HydrophobicContact CD2-CG1 3.74Å; L105-I110 HydrophobicContact CG-CG1 4.28Å
106P93.4Very high86.5Confident65 Ų65112.1 Ų112.142%0.42261%0.61SS.*  trans-52.8138.4170.5-2532.7000111.3E108 I109 I110P106-E108 WeakPolarHBondContact CB-OE2 3.46Å; P106-E108 PolarHBondContact O-N 3.28Å; P106-I109 HydrophobicContact CB-CD1 4.43Å; P106-I109 HydrophobicContact CB-CG1 4.34Å; P106-I109 HydrophobicContact CG-CD1 4.15Å; P106-I109 PolarHBondContact O-N 3.09Å; P106-I109 VanDerWaalsContact O-N 3.09Å; P106-I110 PolarHBondContact O-N 3.48Å
107E91.7Very high85.5Confident99 Ų99114.6 Ų114.646%0.46362%0.621SS.*Hα-helixtrans-62.2-28.2-174.5-17462.3-154.400111.4L105 I109 I110 Q111L105-E107 PolarHBondContact O-N 3.19Å; E107-I109 PolarHBondContact O-N 3.24Å; E107-I110 PolarHBondContact O-N 3.45Å; E107-Q111 HydrophobicContact CG-CG 4.34Å; E107-Q111 WeakPolarHBondContact O-CB 3.2Å; E107-Q111 WeakPolarHBondContact O-CG 3.31Å; E107-Q111 PolarHBondContact O-N 3.14Å
108E90.7Very high84.1Confident136 Ų136117 Ų11764%0.63663%0.626SS**Hα-helixtrans-59-45.3175.9-5973.3-157.100111.3P106 Q111 E112P106-E108 WeakPolarHBondContact CB-OE2 3.46Å; P106-E108 PolarHBondContact O-N 3.28Å; E108-Q111 PolarHBondContact O-N 3.47Å; E108-E112 PolarHBondContact O-N 2.77Å
109I90.5Very high82.6Confident73 Ų73114.8 Ų114.837%0.37463%0.63SS.*Hα-helixtrans-70.1-38.3178.8-52.4-179.7000110.2L105 P106 E107 Q111 E112 V113L105-I109 HydrophobicContact CD1-CD1 4.28Å; L105-I109 HydrophobicContact CD1-CG2 4.47Å; L105-I109 HydrophobicContact CD2-CB 3.81Å; L105-I109 HydrophobicContact CD2-CG2 3.62Å; L105-I109 HydrophobicContact CG-CB 4.01Å; L105-I109 HydrophobicContact CG-CD1 4.35Å; L105-I109 HydrophobicContact CG-CG2 4.16Å; P106-I109 HydrophobicContact CB-CD1 4.43Å; P106-I109 HydrophobicContact CB-CG1 4.34Å; P106-I109 HydrophobicContact CG-CD1 4.15Å; P106-I109 PolarHBondContact O-N 3.09Å; P106-I109 VanDerWaalsContact O-N 3.09Å; E107-I109 PolarHBondContact O-N 3.24Å; I109-Q111 VanDerWaalsContact C-N 3.32Å; I109-Q111 PolarHBondContact O-N 3.44Å; I109-E112 PolarHBondContact O-N 3.47Å; I109-V113 WeakPolarHBondContact O-CG2 3.34Å; I109-V113 PolarHBondContact O-N 2.94Å
110I91.9Very high80.4Confident47 Ų47113.8 Ų113.824%0.24163%0.627CS.*Hα-helixtrans-61.2-43.8176.3-62.2176.1000110.3L105 P106 E107 K114L105-I110 HydrophobicContact CB-CD1 4.18Å; L105-I110 HydrophobicContact CB-CG1 4.02Å; L105-I110 HydrophobicContact CD2-CG1 3.74Å; L105-I110 HydrophobicContact CG-CG1 4.28Å; P106-I110 PolarHBondContact O-N 3.48Å; E107-I110 PolarHBondContact O-N 3.45Å; I110-K114 HydrophobicContact CG2-CD 3.92Å; I110-K114 HydrophobicContact CG2-CG 4.43Å; I110-K114 VanDerWaalsContact O-CB 3.31Å; I110-K114 WeakPolarHBondContact O-CB 3.32Å; I110-K114 WeakPolarHBondContact O-CG 3.45Å; I110-K114 PolarHBondContact O-N 3.21Å
111Q89.4Confident78.6Confident120 Ų120113.4 Ų113.456%0.56163%0.625SS**Hα-helixtrans-69.6-37.2-179.7-74.2179.616.300112.8E107 E108 I109 G115E107-Q111 HydrophobicContact CG-CG 4.34Å; E107-Q111 WeakPolarHBondContact O-CB 3.2Å; E107-Q111 WeakPolarHBondContact O-CG 3.31Å; E107-Q111 PolarHBondContact O-N 3.14Å; E108-Q111 PolarHBondContact O-N 3.47Å; I109-Q111 VanDerWaalsContact C-N 3.32Å; I109-Q111 PolarHBondContact O-N 3.44Å; Q111-G115 WeakPolarHBondContact O-CA 3.45Å; Q111-G115 PolarHBondContact O-N 3.16Å
112E87.2Confident76.5Confident129 Ų129112.7 Ų112.760%0.60362%0.624SS**Hα-helixtrans-59.7-47.7174.9-172.4-177.7166.300111.5E108 I109 G116E108-E112 PolarHBondContact O-N 2.77Å; I109-E112 PolarHBondContact O-N 3.47Å; E112-G116 PolarHBondContact O-N 3.45Å
113V85.2Confident74.1Confident115 Ų115115.2 Ų115.270%0.69763%0.629SS**Hα-helixtrans-70.3-44.8179.7177.20000111.6I109 G115 G116I109-V113 WeakPolarHBondContact O-CG2 3.34Å; I109-V113 PolarHBondContact O-N 2.94Å; V113-G115 VanDerWaalsContact C-N 3.31Å; V113-G115 PolarHBondContact O-N 3.45Å; V113-G116 PolarHBondContact O-N 3.44Å
114K82.8Confident71.9Confident172 Ų172112.9 Ų112.975%0.74863%0.631SS**Hα-helixtrans-68-31177.6-80.6-177.5173.2172.40112.9I110 G116I110-K114 HydrophobicContact CG2-CD 3.92Å; I110-K114 HydrophobicContact CG2-CG 4.43Å; I110-K114 VanDerWaalsContact O-CB 3.31Å; I110-K114 WeakPolarHBondContact O-CB 3.32Å; I110-K114 WeakPolarHBondContact O-CG 3.45Å; I110-K114 PolarHBondContact O-N 3.21Å; K114-G116 VanDerWaalsContact C-N 3.26Å; K114-G116 PolarHBondContact O-N 3.3Å
115G76.1Confident69.6Low61 Ų61116.5 Ų116.563%0.62963%0.634SS**THydrogen-bonded Turntrans-76.9-8.2-179.200000114.1Q111 V113 K117Q111-G115 WeakPolarHBondContact O-CA 3.45Å; Q111-G115 PolarHBondContact O-N 3.16Å; V113-G115 VanDerWaalsContact C-N 3.31Å; V113-G115 PolarHBondContact O-N 3.45Å; G115-K117 PolarHBondContact O-N 3.02Å; G115-K117 VanDerWaalsContact O-N 3.16Å
116G60.5Low67.2Low65 Ų65121.6 Ų121.667%0.6766%0.656SS**THydrogen-bonded Turntrans64.219.2173.500000114.7E112 V113 K114 L118E112-G116 PolarHBondContact O-N 3.45Å; V113-G116 PolarHBondContact O-N 3.44Å; K114-G116 VanDerWaalsContact C-N 3.26Å; K114-G116 PolarHBondContact O-N 3.3Å; G116-L118 PolarHBondContact O-N 3.41Å; G116-L118 VanDerWaalsContact O-N 3.14Å
117K60.2Low64.8Low160 Ų160127.7 Ų127.770%0.69668%0.679SS**  trans-90.376.1-178.7-159.6167.9170.7-171.40109.5G115 G119G115-K117 PolarHBondContact O-N 3.02Å; G115-K117 VanDerWaalsContact O-N 3.16Å; K117-G119 PolarHBondContact O-N 2.88Å
118L53.2Low62.4Low173 Ų173130.5 Ų130.591%0.90669%0.69SS**  trans-56.9124.3157.3-145.385.4000106.1G116 S120G116-L118 PolarHBondContact O-N 3.41Å; G116-L118 VanDerWaalsContact O-N 3.14Å; L118-S120 PolarHBondContact O-N 3.39Å
119G50.2Low60.4Low68 Ų68134.8 Ų134.870%0.70170%0.7SS**  trans-41.4131.1-165.300000115K117K117-G119 PolarHBondContact O-N 2.88Å
120S41.6Very low58.5Low74 Ų74139 Ų13952%0.51772%0.72SS.*  trans-77.2127.7154.7-167.30000106.6L118 E122L118-S120 PolarHBondContact O-N 3.39Å; S120-E122 PolarHBondContact O-N 2.82Å; S120-E122 PolarHBondContact OG-OE2 3.29Å
121E48.3Very low56.3Low192 Ų192145 Ų14590%0.89775%0.747SS**THydrogen-bonded Turntrans-65.730.6179.9-62.3178.2101.600114
122E44.2Very low54.4Low152 Ų152149.2 Ų149.271%0.7176%0.758SS**THydrogen-bonded Turntrans-100-4.5-166.1-78.2-174.8103.900116.1S120 T124S120-E122 PolarHBondContact O-N 2.82Å; S120-E122 PolarHBondContact OG-OE2 3.29Å; E122-T124 VanDerWaalsContact C-N 3.28Å; E122-T124 PolarHBondContact O-N 3.48Å
123D42.5Very low52.2Low166 Ų166151.4 Ų151.489%0.88877%0.768SS**THydrogen-bonded Turntrans-84.910.7-178.6-134.8-96.5000114.4
124T45.1Very low50.8Low136 Ų136151.1 Ų151.183%0.83477%0.769SS**THydrogen-bonded Turntrans-99.27.1179.1-31.60000114E122E122-T124 VanDerWaalsContact C-N 3.28Å; E122-T124 PolarHBondContact O-N 3.48Å
125K45.4Very low48.9Very low172 Ų172148.6 Ų148.675%0.74877%0.77SS**SBendtrans-119.7-12.1-170.7-151.9175.6176.6-173.50116.8
126E41.3Very low47.2Very low178 Ų178150.9 Ų150.983%0.83278%0.783SS**SBendtrans-85.9-12.6-176.6-75.5-92.713000114.1
127E43.1Very low46.5Very low193 Ų193153.7 Ų153.790%0.90279%0.787SS**THydrogen-bonded Turntrans-81.4-17.9174.9-79.5-123.6120.100114R129E127-R129 PolarHBondContact O-N 3.47Å
128F40.7Very low45.9Very low158 Ų158154.1 Ų154.169%0.69379%0.791SS**THydrogen-bonded Turntrans-86.4-4.8-173.7-166.6-102.3000114.6
129R49.9Very low45.7Very low226 Ų226153 Ų15385%0.85378%0.781SS**SBendtrans-106.3-14.7-172.2-93.5-170.6176.2-135.30.2116E127E127-R129 PolarHBondContact O-N 3.47Å
130M49.1Very low45.4Very low163 Ų163158 Ų15880%0.80379%0.787SS**SBendtrans-92.9114.1176.3-154.6129.37200109.3
131E45.9Very low45.6Very low173 Ų173157.9 Ų157.981%0.80880%0.797SS**  trans8743.6162.9-43.4-149.1109.700118.1E133E131-E133 PolarHBondContact O-N 2.98Å
132R48.8Very low45.2Very low208 Ų208161.8 Ų161.879%0.78582%0.815SS**  trans-82.890.8146-173.3-173.6-96.8153.4-9.5108.4
133E42.8Very low45.2Very low174 Ų174162.3 Ų162.381%0.81382%0.82SS**PPolyproline II helixtrans-78.4145162.5-79.8-156.5106.600111E131E131-E133 PolarHBondContact O-N 2.98Å
134P54.8Low45.4Very low110 Ų110162.1 Ų162.171%0.71482%0.817SS**PPolyproline II helixtrans-80160.4-166.731.4-35.1000114.7
135P44Very low45.4Very low118 Ų118163.6 Ų163.677%0.76682%0.816SS**PPolyproline II helixtrans-82.4133.9-169.132.7-33.7000112.8
136A40.1Very low45.4Very low109 Ų109163.1 Ų163.190%0.90182%0.82SS**  trans-91.2102.616000000109.2
137T46.1Very low45.6Very low125 Ų125162.1 Ų162.177%0.76782%0.819SS**  trans-81.9127.7166.848.70000110.5
138H46.4Very low45.8Very low168 Ų168160.1 Ų160.178%0.77881%0.813SS**  174.1121.6116.795.3-76.3000106.8
139E48.8Very low46.2Very low149 Ų149160.2 Ų160.270%0.69682%0.822SS**  87.3117.372-167.9-179.19200112.7
140E45.2Very low45.9Very low175 Ų175155.2 Ų155.282%0.81882%0.82SS**  trans61.5140.4155.7-66.6-179.6123.100118.5
141G44.8Very low45.6Very low70 Ų70154.5 Ų154.572%0.72282%0.821SS**  cis120.383.629.400000108.4
142Q39.5Very low45.6Very low275 Ų275152.8 Ų152.8100%1.28582%0.822SS**  trans-1740149.6-111174.7-20.200111.6

Retrieved 142 of 142 residues in 189.2 ms (Link to these results)