A0A5K4F6Q3_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A5K4F6Q3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 60 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
1M47.5Very low55Low222 Ų222142.1 Ų142.1100%1.09470%0.701SS**  0109.20-131.9166.9177.600107.2F3M1-F3 PolarHBondContact O-N 3.48Å
2K56.8Low55.1Low211 Ų211144.2 Ų144.292%0.91771%0.707SS**  trans-75.1112.6169.6-88-178175.2179.40106D4K2-D4 PolarHBondContact O-N 3.37Å
3F57.9Low55.8Low151 Ų151144.2 Ų144.266%0.66271%0.711SS**  trans-65.5120.8169.5-80.6-86.4000107.5M1 Y5M1-F3 PolarHBondContact O-N 3.48Å; F3-Y5 HydrophobicContact CB-CD2 4.26Å; F3-Y5 HydrophobicContact CB-CE2 3.89Å; F3-Y5 WeakPolarHBondContact O-CD2 3.33Å; F3-Y5 PolarHBondContact O-N 2.89Å; F3-Y5 VanDerWaalsContact O-N 3.1Å
4D61.1Low56.3Low118 Ų118144 Ų14463%0.63171%0.712SS**  trans-70.999.6166.7-167.3-12.6000107K2 S6K2-D4 PolarHBondContact O-N 3.37Å; D4-S6 PolarHBondContact O-N 3.36Å; D4-S6 WeakPolarHBondContact OD1-CB 3.28Å; D4-S6 PolarHBondContact OD1-N 3.13Å; D4-S6 VanDerWaalsContact OD1-N 3.13Å; D4-S6 PolarHBondContact OD1-OG 3.15Å; D4-S6 PolarHBondContact OD2-OG 3.11Å
5Y58.1Low57.1Low155 Ų155142.9 Ų142.961%0.60872%0.72SS**THydrogen-bonded Turntrans-72.1-6.7179.9-73.5-90.4000112.2F3 E7 K8 S9F3-Y5 HydrophobicContact CB-CD2 4.26Å; F3-Y5 HydrophobicContact CB-CE2 3.89Å; F3-Y5 WeakPolarHBondContact O-CD2 3.33Å; F3-Y5 PolarHBondContact O-N 2.89Å; F3-Y5 VanDerWaalsContact O-N 3.1Å; Y5-E7 VanDerWaalsContact C-N 3.29Å; Y5-E7 PolarHBondContact O-N 3.31Å; Y5-K8 PolarHBondContact O-N 3.39Å; Y5-K8 VanDerWaalsContact O-N 3.13Å; Y5-S9 PolarHBondContact O-N 3.04Å; Y5-S9 PolarHBondContact O-OG 3.49Å
6S61.3Low57.9Low64 Ų64142.9 Ų142.945%0.44871%0.71SS.*Hα-helixtrans-61.9-36.5-179.867.90000112.4D4 S9 C10D4-S6 PolarHBondContact O-N 3.36Å; D4-S6 WeakPolarHBondContact OD1-CB 3.28Å; D4-S6 PolarHBondContact OD1-N 3.13Å; D4-S6 VanDerWaalsContact OD1-N 3.13Å; D4-S6 PolarHBondContact OD1-OG 3.15Å; D4-S6 PolarHBondContact OD2-OG 3.11Å; S6-S9 PolarHBondContact O-N 3.44Å; S6-C10 PolarHBondContact O-N 3.45Å; S6-C10 VanDerWaalsContact O-N 3.09Å
7E54.8Low59.1Low143 Ų143140.4 Ų140.467%0.66870%0.699SS**Hα-helixtrans-67.5-36.4174.6-95.3-172.7161.700112.6Y5 S9 H11Y5-E7 VanDerWaalsContact C-N 3.29Å; Y5-E7 PolarHBondContact O-N 3.31Å; E7-S9 VanDerWaalsContact C-N 3.35Å; E7-H11 PolarHBondContact O-CE1 3.01Å; E7-H11 PolarHBondContact O-ND1 3.27Å
8K53.2Low60.4Low157 Ų157138.8 Ų138.868%0.68369%0.692SS**Hα-helixtrans-70.6-32.6176.2-92.2-176.2175.8178.80112.4Y5Y5-K8 PolarHBondContact O-N 3.39Å; Y5-K8 VanDerWaalsContact O-N 3.13Å
9S54.2Low61.6Low86 Ų86138.3 Ų138.360%0.60169%0.685SS**Hα-helixtrans-72.8-33.6177.3-59.10000112.7Y5 S6 E7 H11Y5-S9 PolarHBondContact O-N 3.04Å; Y5-S9 PolarHBondContact O-OG 3.49Å; S6-S9 PolarHBondContact O-N 3.44Å; E7-S9 VanDerWaalsContact C-N 3.35Å; S9-H11 VanDerWaalsContact C-N 3.32Å; S9-H11 PolarHBondContact O-N 2.94Å
10C52.5Low62.6Low98 Ų98134.8 Ų134.866%0.66267%0.671SS**Hα-helixtrans-68.8-25178.6-95.60000114.4S6 Q12S6-C10 PolarHBondContact O-N 3.45Å; S6-C10 VanDerWaalsContact O-N 3.09Å; C10-Q12 VanDerWaalsContact C-N 3.32Å; C10-Q12 PolarHBondContact O-N 2.76Å
11H48.2Very low63.6Low158 Ų158130.9 Ų130.973%0.73165%0.654SS**THydrogen-bonded Turntrans-83.8-2.5-177-69.5108.3000114.6E7 S9 L13E7-H11 PolarHBondContact O-CE1 3.01Å; E7-H11 PolarHBondContact O-ND1 3.27Å; S9-H11 VanDerWaalsContact C-N 3.32Å; S9-H11 PolarHBondContact O-N 2.94Å; H11-L13 VanDerWaalsContact C-N 3.32Å; H11-L13 PolarHBondContact O-N 2.91Å
12Q55.1Low65.4Low167 Ų167125.8 Ų125.878%0.7863%0.628SS**  trans-95.361.8169-68.7-175.7-14.800109.9C10 I14C10-Q12 VanDerWaalsContact C-N 3.32Å; C10-Q12 PolarHBondContact O-N 2.76Å; Q12-I14 PolarHBondContact O-N 3.3Å
13L64.6Low66.9Low145 Ų145119.8 Ų119.876%0.75960%0.603SS**  trans-59.4115.1162.2-71.8171.6000106.9H11 P15H11-L13 VanDerWaalsContact C-N 3.32Å; H11-L13 PolarHBondContact O-N 2.91Å; L13-P15 WeakPolarHBondContact O-CD 3.47Å; L13-P15 VanDerWaalsContact O-N 3.14Å
14I63.6Low68.2Low141 Ų141116.9 Ų116.972%0.72359%0.593SS**  trans-54121.9173.3-64.5169.7000106.2Q12 Y16Q12-I14 PolarHBondContact O-N 3.3Å; I14-Y16 PolarHBondContact O-N 3.42Å
15P68Low69.3Low128 Ų128114.4 Ų114.483%0.83159%0.585SS**  trans-58.6111.4176.421.7-30.1000107.8L13L13-P15 WeakPolarHBondContact O-CD 3.47Å; L13-P15 VanDerWaalsContact O-N 3.14Å
16Y68.8Low70.6Confident142 Ų142112.6 Ų112.656%0.55758%0.583SS**  trans-98.1144.117856.9-97.2000109.3I14 M18 V21I14-Y16 PolarHBondContact O-N 3.42Å; Y16-M18 HydrophobicContact CD2-SD 4.42Å; Y16-M18 HydrophobicContact CE2-SD 3.64Å; Y16-M18 PolarHBondContact O-N 2.9Å; Y16-M18 VanDerWaalsContact O-N 3.16Å; Y16-V21 HydrophobicContact CD2-CB 4.25Å; Y16-V21 HydrophobicContact CD2-CG2 3.24Å; Y16-V21 HydrophobicContact CE2-CB 4.28Å; Y16-V21 HydrophobicContact CE2-CG2 3.57Å; Y16-V21 HydrophobicContact CG-CG2 4.02Å
17N79.1Confident71.9Confident100 Ų100114.7 Ų114.754%0.53559%0.587SS.*  trans-69.3114174-176-14.4000108.7K19 V20 V21N17-K19 PolarHBondContact O-N 2.96Å; N17-K19 VanDerWaalsContact O-N 3.09Å; N17-K19 WeakPolarHBondContact OD1-CB 3.49Å; N17-K19 PolarHBondContact OD1-N 3.35Å; N17-V20 HydrophobicContact CB-CB 4.3Å; N17-V20 HydrophobicContact CB-CG2 3.86Å; N17-V20 WeakPolarHBondContact O-CB 3.39Å; N17-V20 PolarHBondContact O-N 3.03Å; N17-V21 PolarHBondContact O-N 3.49Å
18M82.1Confident73.5Confident113 Ų113113.1 Ų113.156%0.55758%0.582SS**Hα-helixtrans-52.9-32.2178.3-75.8-71.1-7000112.6Y16 V21 Q22Y16-M18 HydrophobicContact CD2-SD 4.42Å; Y16-M18 HydrophobicContact CE2-SD 3.64Å; Y16-M18 PolarHBondContact O-N 2.9Å; Y16-M18 VanDerWaalsContact O-N 3.16Å; M18-V21 PolarHBondContact O-N 3.01Å; M18-Q22 WeakPolarHBondContact O-CG 3.44Å; M18-Q22 PolarHBondContact O-N 3.48Å
19K83.7Confident75Confident129 Ų129112.9 Ų112.956%0.56158%0.577SS**Hα-helixtrans-61.5-44.3175.4-170.3-176.6177.9-169.70111.8N17 V21 Q22 E23N17-K19 PolarHBondContact O-N 2.96Å; N17-K19 VanDerWaalsContact O-N 3.09Å; N17-K19 WeakPolarHBondContact OD1-CB 3.49Å; N17-K19 PolarHBondContact OD1-N 3.35Å; K19-V21 VanDerWaalsContact C-N 3.34Å; K19-V21 PolarHBondContact O-N 3.27Å; K19-Q22 PolarHBondContact O-N 3.38Å; K19-E23 WeakPolarHBondContact CE-OE1 3.48Å; K19-E23 WeakPolarHBondContact O-CG 3.5Å; K19-E23 PolarHBondContact O-N 2.91Å
20V80.6Confident76.5Confident67 Ų67117.4 Ų117.441%0.40658%0.581SS.*Hα-helixtrans-64.3-40.6178.5175.90000110.7N17 Q22 E23 I24N17-V20 HydrophobicContact CB-CB 4.3Å; N17-V20 HydrophobicContact CB-CG2 3.86Å; N17-V20 WeakPolarHBondContact O-CB 3.39Å; N17-V20 PolarHBondContact O-N 3.03Å; V20-Q22 PolarHBondContact O-N 3.27Å; V20-E23 PolarHBondContact O-N 2.93Å; V20-I24 HydrophobicContact CG1-CD1 3.9Å; V20-I24 HydrophobicContact CG1-CG1 4.47Å; V20-I24 WeakPolarHBondContact O-CG1 3.41Å; V20-I24 PolarHBondContact O-N 3.46Å
21V83.8Confident78Confident54 Ų54118.9 Ų118.933%0.32758%0.577SS.*Hα-helixtrans-64.6-40176.5171.40000112Y16 N17 M18 K19 S25Y16-V21 HydrophobicContact CD2-CB 4.25Å; Y16-V21 HydrophobicContact CD2-CG2 3.24Å; Y16-V21 HydrophobicContact CE2-CB 4.28Å; Y16-V21 HydrophobicContact CE2-CG2 3.57Å; Y16-V21 HydrophobicContact CG-CG2 4.02Å; N17-V21 PolarHBondContact O-N 3.49Å; M18-V21 PolarHBondContact O-N 3.01Å; K19-V21 VanDerWaalsContact C-N 3.34Å; K19-V21 PolarHBondContact O-N 3.27Å; V21-S25 WeakPolarHBondContact O-CB 3.42Å; V21-S25 PolarHBondContact O-N 3.3Å; V21-S25 PolarHBondContact O-OG 3.3Å
22Q85.1Confident79.5Confident114 Ų114119.3 Ų119.353%0.53357%0.573SS.*Hα-helixtrans-64.5-43.4175.1-73.1175.1-19.400111.9M18 K19 V20 S25 Q26M18-Q22 WeakPolarHBondContact O-CG 3.44Å; M18-Q22 PolarHBondContact O-N 3.48Å; K19-Q22 PolarHBondContact O-N 3.38Å; V20-Q22 PolarHBondContact O-N 3.27Å; Q22-S25 PolarHBondContact O-N 3.34Å; Q22-Q26 WeakPolarHBondContact O-CG 3.34Å; Q22-Q26 PolarHBondContact O-N 3.45Å
23E88.2Confident80.8Confident86 Ų86117.1 Ų117.140%0.40256%0.558SS.*Hα-helixtrans-61-48176.5-73.5169.4-176.900111.4K19 V20 S25 Q26 I27K19-E23 WeakPolarHBondContact CE-OE1 3.48Å; K19-E23 WeakPolarHBondContact O-CG 3.5Å; K19-E23 PolarHBondContact O-N 2.91Å; V20-E23 PolarHBondContact O-N 2.93Å; E23-S25 VanDerWaalsContact C-N 3.33Å; E23-S25 PolarHBondContact O-N 2.86Å; E23-Q26 PolarHBondContact O-N 2.92Å; E23-I27 WeakPolarHBondContact O-CG1 3.39Å; E23-I27 PolarHBondContact O-N 2.7Å
24I85.6Confident81.6Confident89 Ų89114.1 Ų114.146%0.45654%0.543SS..Hα-helixtrans-59.8-43.9175.6-68.8169.4000110.9V20 Q26 I27 I28V20-I24 HydrophobicContact CG1-CD1 3.9Å; V20-I24 HydrophobicContact CG1-CG1 4.47Å; V20-I24 WeakPolarHBondContact O-CG1 3.41Å; V20-I24 PolarHBondContact O-N 3.46Å; I24-Q26 VanDerWaalsContact C-N 3.3Å; I24-Q26 PolarHBondContact O-N 3.43Å; I24-I27 PolarHBondContact O-N 2.92Å; I24-I28 HydrophobicContact CG2-CD1 3.85Å; I24-I28 HydrophobicContact CG2-CG1 4.43Å; I24-I28 WeakPolarHBondContact O-CG1 3.36Å; I24-I28 PolarHBondContact O-N 3.36Å
25S84.9Confident82.6Confident66 Ų66112 Ų11246%0.46253%0.532SS..Hα-helixtrans-62.7-38178.9-58.60000112V21 Q22 E23 R29V21-S25 WeakPolarHBondContact O-CB 3.42Å; V21-S25 PolarHBondContact O-N 3.3Å; V21-S25 PolarHBondContact O-OG 3.3Å; Q22-S25 PolarHBondContact O-N 3.34Å; E23-S25 VanDerWaalsContact C-N 3.33Å; E23-S25 PolarHBondContact O-N 2.86Å; S25-R29 WeakPolarHBondContact O-CB 3.48Å; S25-R29 PolarHBondContact O-N 3.47Å
26Q85.8Confident83.4Confident118 Ų118107.5 Ų107.555%0.55151%0.506SS*.Hα-helixtrans-65.2-45.9174.3-73.4175.2-0.500111.3Q22 E23 I24 I28 R29 W30Q22-Q26 WeakPolarHBondContact O-CG 3.34Å; Q22-Q26 PolarHBondContact O-N 3.45Å; E23-Q26 PolarHBondContact O-N 2.92Å; I24-Q26 VanDerWaalsContact C-N 3.3Å; I24-Q26 PolarHBondContact O-N 3.43Å; Q26-I28 VanDerWaalsContact C-N 3.35Å; Q26-I28 PolarHBondContact O-N 2.89Å; Q26-R29 PolarHBondContact O-N 3.23Å; Q26-R29 VanDerWaalsContact O-N 3.15Å; Q26-W30 PolarHBondContact O-N 2.91Å
27I88.9Confident84.1Confident107 Ų107106.7 Ų106.755%0.54951%0.507SS..Hα-helixtrans-58.5-46.1177.6-67.6165.3000111.1E23 I24 R29 W30 K31E23-I27 WeakPolarHBondContact O-CG1 3.39Å; E23-I27 PolarHBondContact O-N 2.7Å; I24-I27 PolarHBondContact O-N 2.92Å; I27-R29 VanDerWaalsContact C-N 3.32Å; I27-R29 PolarHBondContact O-N 2.91Å; I27-W30 PolarHBondContact O-N 2.95Å; I27-K31 WeakPolarHBondContact O-CG 3.44Å; I27-K31 PolarHBondContact O-N 3.39Å
28I87.6Confident84.4Confident110 Ų110106.9 Ų106.956%0.56451%0.508SS*.Hα-helixtrans-59.7-45.2176.9-69168.7000110.4I24 Q26 W30 K31 Y32I24-I28 HydrophobicContact CG2-CD1 3.85Å; I24-I28 HydrophobicContact CG2-CG1 4.43Å; I24-I28 WeakPolarHBondContact O-CG1 3.36Å; I24-I28 PolarHBondContact O-N 3.36Å; Q26-I28 VanDerWaalsContact C-N 3.35Å; Q26-I28 PolarHBondContact O-N 2.89Å; I28-W30 PolarHBondContact O-N 3.37Å; I28-K31 PolarHBondContact O-N 3.45Å; I28-Y32 WeakPolarHBondContact O-CB 3.38Å; I28-Y32 PolarHBondContact O-N 3.48Å
29R84.7Confident84.6Confident152 Ų152106 Ų10657%0.57451%0.505SS*.Hα-helixtrans-63.2-41.1179.6-173.7175.7-179.8-164.1-5.3112.1S25 Q26 I27 Y32 Y33S25-R29 WeakPolarHBondContact O-CB 3.48Å; S25-R29 PolarHBondContact O-N 3.47Å; Q26-R29 PolarHBondContact O-N 3.23Å; Q26-R29 VanDerWaalsContact O-N 3.15Å; I27-R29 VanDerWaalsContact C-N 3.32Å; I27-R29 PolarHBondContact O-N 2.91Å; R29-Y32 PolarHBondContact O-N 3.29Å; R29-Y33 HydrophobicContact CG-CD2 3.96Å; R29-Y33 HydrophobicContact CG-CE2 3.5Å; R29-Y33 PolarHBondContact NE-OH 2.88Å; R29-Y33 PolarHBondContact NH2-OH 3.47Å; R29-Y33 WeakPolarHBondContact O-CD2 3.34Å; R29-Y33 PolarHBondContact O-N 3.07Å; R29-Y33 VanDerWaalsContact O-N 3.09Å
30W84.9Confident84.8Confident182 Ų182104.3 Ų104.369%0.68950%0.501SS*.Hα-helixtrans-64.4-47.6176.9-75.239.7000110.9Q26 I27 I28 Y32 Y33 D34Q26-W30 PolarHBondContact O-N 2.91Å; I27-W30 PolarHBondContact O-N 2.95Å; I28-W30 PolarHBondContact O-N 3.37Å; W30-Y32 VanDerWaalsContact C-N 3.27Å; W30-Y32 PolarHBondContact O-N 2.94Å; W30-Y33 PolarHBondContact O-N 3.11Å; W30-D34 PolarHBondContact O-N 3.02Å
31K84.3Confident85.2Confident129 Ų129105.5 Ų105.556%0.56150%0.502SS*.Hα-helixtrans-58.6-37.9175-74.7-66.7-176.7-168.70113I27 I28 D34 I35I27-K31 WeakPolarHBondContact O-CG 3.44Å; I27-K31 PolarHBondContact O-N 3.39Å; I28-K31 PolarHBondContact O-N 3.45Å; K31-D34 PolarHBondContact O-N 3.21Å; K31-I35 WeakPolarHBondContact O-CB 3.48Å; K31-I35 WeakPolarHBondContact O-CD1 3.32Å; K31-I35 VanDerWaalsContact O-CG1 3.24Å; K31-I35 WeakPolarHBondContact O-CG1 3.44Å; K31-I35 PolarHBondContact O-N 3.02Å
32Y80.6Confident85.4Confident166 Ų166107.8 Ų107.865%0.65151%0.512SS*.Hα-helixtrans-63.7-42.7175.3-176-91.1000111.9I28 R29 W30 I35 A36I28-Y32 WeakPolarHBondContact O-CB 3.38Å; I28-Y32 PolarHBondContact O-N 3.48Å; R29-Y32 PolarHBondContact O-N 3.29Å; W30-Y32 VanDerWaalsContact C-N 3.27Å; W30-Y32 PolarHBondContact O-N 2.94Å; Y32-I35 PolarHBondContact O-N 2.83Å; Y32-A36 WeakPolarHBondContact O-CB 3.28Å; Y32-A36 PolarHBondContact O-N 3.46Å
33Y82.5Confident85.5Confident122 Ų122109.2 Ų109.248%0.47852%0.517SS..Hα-helixtrans-67.4-41.4175.5-71.7-56.7000112.5R29 W30 I35 A36 E37R29-Y33 HydrophobicContact CG-CD2 3.96Å; R29-Y33 HydrophobicContact CG-CE2 3.5Å; R29-Y33 PolarHBondContact NE-OH 2.88Å; R29-Y33 PolarHBondContact NH2-OH 3.47Å; R29-Y33 WeakPolarHBondContact O-CD2 3.34Å; R29-Y33 PolarHBondContact O-N 3.07Å; R29-Y33 VanDerWaalsContact O-N 3.09Å; W30-Y33 PolarHBondContact O-N 3.11Å; Y33-I35 VanDerWaalsContact C-N 3.29Å; Y33-I35 PolarHBondContact O-N 3.12Å; Y33-A36 WeakPolarHBondContact O-CB 3.4Å; Y33-A36 PolarHBondContact O-N 2.96Å; Y33-A36 VanDerWaalsContact O-N 3.12Å; Y33-E37 WeakPolarHBondContact O-CB 3.4Å; Y33-E37 PolarHBondContact O-N 3.42Å
34D81Confident85.6Confident82 Ų82109.9 Ų109.944%0.43952%0.518SS..Hα-helixtrans-57.4-43.9174.6-65.4-14.6000111W30 K31 E37 L38W30-D34 PolarHBondContact O-N 3.02Å; K31-D34 PolarHBondContact O-N 3.21Å; D34-E37 PolarHBondContact O-N 3.31Å; D34-L38 VanDerWaalsContact O-CB 3.32Å; D34-L38 WeakPolarHBondContact O-CB 3.37Å; D34-L38 PolarHBondContact O-N 3.44Å
35I84.3Confident85.9Confident96 Ų96112 Ų11249%0.49253%0.526SS..Hα-helixtrans-66.1-41.5176.9-69.6166.7000110.8K31 Y32 Y33 L38 N39K31-I35 WeakPolarHBondContact O-CB 3.48Å; K31-I35 WeakPolarHBondContact O-CD1 3.32Å; K31-I35 VanDerWaalsContact O-CG1 3.24Å; K31-I35 WeakPolarHBondContact O-CG1 3.44Å; K31-I35 PolarHBondContact O-N 3.02Å; Y32-I35 PolarHBondContact O-N 2.83Å; Y33-I35 VanDerWaalsContact C-N 3.29Å; Y33-I35 PolarHBondContact O-N 3.12Å; I35-L38 PolarHBondContact O-N 2.94Å; I35-N39 WeakPolarHBondContact O-CB 3.36Å; I35-N39 PolarHBondContact O-N 3.37Å; I35-N39 PolarHBondContact O-ND2 3.37Å
36A84Confident86.2Confident33 Ų33115.5 Ų115.527%0.27353%0.533SS..Hα-helixtrans-63.6-42.6177.600000111.6Y32 Y33 N39 I40Y32-A36 WeakPolarHBondContact O-CB 3.28Å; Y32-A36 PolarHBondContact O-N 3.46Å; Y33-A36 WeakPolarHBondContact O-CB 3.4Å; Y33-A36 PolarHBondContact O-N 2.96Å; Y33-A36 VanDerWaalsContact O-N 3.12Å; A36-N39 PolarHBondContact O-N 3.38Å; A36-I40 VanDerWaalsContact O-CG1 3.28Å; A36-I40 WeakPolarHBondContact O-CG1 3.28Å; A36-I40 PolarHBondContact O-N 2.98Å
37E84.9Confident86.4Confident126 Ų126115.8 Ų115.859%0.58953%0.532SS*.Hα-helixtrans-63.9-46.8175.5-173.9171.5-159.400111.3Y33 D34 N39 I40 E41Y33-E37 WeakPolarHBondContact O-CB 3.4Å; Y33-E37 PolarHBondContact O-N 3.42Å; D34-E37 PolarHBondContact O-N 3.31Å; E37-N39 VanDerWaalsContact C-N 3.31Å; E37-N39 PolarHBondContact O-N 3.48Å; E37-I40 WeakPolarHBondContact O-CB 3.46Å; E37-I40 PolarHBondContact O-N 2.89Å; E37-I40 VanDerWaalsContact O-N 3.11Å; E37-E41 PolarHBondContact O-N 3.15Å
38L84.9Confident86.6Confident104 Ų104115.6 Ų115.655%0.54553%0.532SS..Hα-helixtrans-58.2-42.9175.2-175.967.6000111.8D34 I35 I40 E41 L42D34-L38 VanDerWaalsContact O-CB 3.32Å; D34-L38 WeakPolarHBondContact O-CB 3.37Å; D34-L38 PolarHBondContact O-N 3.44Å; I35-L38 PolarHBondContact O-N 2.94Å; L38-I40 VanDerWaalsContact C-N 3.33Å; L38-I40 PolarHBondContact O-N 2.97Å; L38-E41 PolarHBondContact O-N 2.93Å; L38-L42 HydrophobicContact CG-CD1 4.15Å; L38-L42 WeakPolarHBondContact O-CB 3.49Å; L38-L42 VanDerWaalsContact O-CG 3.28Å; L38-L42 WeakPolarHBondContact O-CG 3.48Å; L38-L42 PolarHBondContact O-N 3.23Å
39N87.3Confident86.8Confident93 Ų93113.3 Ų113.350%0.49753%0.526SS..Hα-helixtrans-63.6-38.1176.9-74.8-25.3000112.1I35 A36 E37 F43I35-N39 WeakPolarHBondContact O-CB 3.36Å; I35-N39 PolarHBondContact O-N 3.37Å; I35-N39 PolarHBondContact O-ND2 3.37Å; A36-N39 PolarHBondContact O-N 3.38Å; E37-N39 VanDerWaalsContact C-N 3.31Å; E37-N39 PolarHBondContact O-N 3.48Å; N39-F43 WeakPolarHBondContact O-CB 3.46Å; N39-F43 PolarHBondContact O-N 3.09Å
40I87.2Confident87.2Confident94 Ų94110.7 Ų110.748%0.48252%0.52SS..Hα-helixtrans-66.2-45.6176.1-71.4164.9000110.6A36 E37 L38 F43 K44A36-I40 VanDerWaalsContact O-CG1 3.28Å; A36-I40 WeakPolarHBondContact O-CG1 3.28Å; A36-I40 PolarHBondContact O-N 2.98Å; E37-I40 WeakPolarHBondContact O-CB 3.46Å; E37-I40 PolarHBondContact O-N 2.89Å; E37-I40 VanDerWaalsContact O-N 3.11Å; L38-I40 VanDerWaalsContact C-N 3.33Å; L38-I40 PolarHBondContact O-N 2.97Å; I40-F43 WeakPolarHBondContact O-CB 3.24Å; I40-F43 PolarHBondContact O-N 3.41Å; I40-K44 HydrophobicContact CG2-CD 4.46Å; I40-K44 WeakPolarHBondContact O-CG 3.49Å; I40-K44 PolarHBondContact O-N 3.3Å
41E87.9Confident87.5Confident93 Ų93104.7 Ų104.744%0.43550%0.504SS..Hα-helixtrans-65.2-40.9178.3-70.7-54.2129.400112E37 L38 F43 K44 H45E37-E41 PolarHBondContact O-N 3.15Å; L38-E41 PolarHBondContact O-N 2.93Å; E41-F43 VanDerWaalsContact C-N 3.32Å; E41-F43 PolarHBondContact O-N 3.05Å; E41-K44 PolarHBondContact O-N 3.32Å; E41-K44 IonicContact OE1-NZ 2.7Å; E41-K44 PolarHBondContact OE1-NZ 3.4Å; E41-H45 WeakPolarHBondContact O-CB 3.5Å; E41-H45 PolarHBondContact O-N 3.03Å
42L88Confident87.9Confident101 Ų101103.3 Ų103.353%0.52950%0.502SS..Hα-helixtrans-60.9-40.6172.3-74.6171.6000112L38 H45 K46L38-L42 HydrophobicContact CG-CD1 4.15Å; L38-L42 WeakPolarHBondContact O-CB 3.49Å; L38-L42 VanDerWaalsContact O-CG 3.28Å; L38-L42 WeakPolarHBondContact O-CG 3.48Å; L38-L42 PolarHBondContact O-N 3.23Å; L42-H45 PolarHBondContact O-N 3.21Å; L42-K46 WeakPolarHBondContact O-CB 3.42Å; L42-K46 PolarHBondContact O-N 2.93Å
43F88.5Confident88.4Confident144 Ų144100.9 Ų100.963%0.63250%0.495SS*.Hα-helixtrans-63.2-46.6175.3177.2-94.7000111.9N39 I40 E41 H45 K46 F47N39-F43 WeakPolarHBondContact O-CB 3.46Å; N39-F43 PolarHBondContact O-N 3.09Å; I40-F43 WeakPolarHBondContact O-CB 3.24Å; I40-F43 PolarHBondContact O-N 3.41Å; E41-F43 VanDerWaalsContact C-N 3.32Å; E41-F43 PolarHBondContact O-N 3.05Å; F43-H45 VanDerWaalsContact C-N 3.34Å; F43-H45 PolarHBondContact O-N 2.94Å; F43-K46 PolarHBondContact O-N 2.95Å; F43-F47 WeakPolarHBondContact O-CB 3.34Å; F43-F47 PolarHBondContact O-N 3.24Å
44K90.3Very high88.8Confident101 Ų10199 Ų9944%0.43950%0.495SS..Hα-helixtrans-58.4-46175.8-72.3175.1-174.6168.30111.4I40 E41 F47 L48I40-K44 HydrophobicContact CG2-CD 4.46Å; I40-K44 WeakPolarHBondContact O-CG 3.49Å; I40-K44 PolarHBondContact O-N 3.3Å; E41-K44 PolarHBondContact O-N 3.32Å; E41-K44 IonicContact OE1-NZ 2.7Å; E41-K44 PolarHBondContact OE1-NZ 3.4Å; K44-F47 PolarHBondContact O-N 3.47Å; K44-L48 WeakPolarHBondContact O-CB 3.48Å; K44-L48 WeakPolarHBondContact O-CG 3.35Å; K44-L48 PolarHBondContact O-N 3.34Å
45H91.1Very high89.3Confident134 Ų13499 Ų9962%0.6249%0.494SS*.Hα-helixtrans-62-46178.2-176.7-83.5000111.6E41 L42 F43 F47 L48 S49E41-H45 WeakPolarHBondContact O-CB 3.5Å; E41-H45 PolarHBondContact O-N 3.03Å; L42-H45 PolarHBondContact O-N 3.21Å; F43-H45 VanDerWaalsContact C-N 3.34Å; F43-H45 PolarHBondContact O-N 2.94Å; H45-F47 VanDerWaalsContact C-N 3.35Å; H45-F47 PolarHBondContact O-N 2.95Å; H45-L48 PolarHBondContact O-N 3.34Å; H45-S49 WeakPolarHBondContact O-CB 3.14Å; H45-S49 PolarHBondContact O-N 3.49Å
46K91.5Very high89.7Confident139 Ų13998.5 Ų98.560%0.60449%0.492SS*.Hα-helixtrans-60.9-44.9176.5-173.6177.2-179.8-179.90111.5L42 F43 S49 E50L42-K46 WeakPolarHBondContact O-CB 3.42Å; L42-K46 PolarHBondContact O-N 2.93Å; F43-K46 PolarHBondContact O-N 2.95Å; K46-S49 PolarHBondContact O-N 2.93Å; K46-E50 WeakPolarHBondContact O-CG 3.48Å; K46-E50 PolarHBondContact O-N 2.75Å
47F90.2Very high90Very high123 Ų123101.1 Ų101.154%0.53950%0.502SS..Hα-helixtrans-60.1-48.2177.6-178.2-100.3000111.7F43 K44 H45 S49 E50 V51F43-F47 WeakPolarHBondContact O-CB 3.34Å; F43-F47 PolarHBondContact O-N 3.24Å; K44-F47 PolarHBondContact O-N 3.47Å; H45-F47 VanDerWaalsContact C-N 3.35Å; H45-F47 PolarHBondContact O-N 2.95Å; F47-S49 VanDerWaalsContact C-N 3.33Å; F47-S49 PolarHBondContact O-N 3.09Å; F47-E50 PolarHBondContact O-N 3.26Å; F47-V51 HydrophobicContact CD1-CG2 4.23Å; F47-V51 HydrophobicContact CE1-CG2 3.86Å; F47-V51 HydrophobicContact CE2-CG2 4.38Å; F47-V51 HydrophobicContact CZ-CG2 3.94Å; F47-V51 WeakPolarHBondContact O-CG2 3.36Å; F47-V51 PolarHBondContact O-N 3.16Å
48L92.7Very high90Very high104 Ų104101.2 Ų101.255%0.54551%0.506SS..Hα-helixtrans-60.1-42176-74170.9000112.2K44 H45 E50 V51 L52K44-L48 WeakPolarHBondContact O-CB 3.48Å; K44-L48 WeakPolarHBondContact O-CG 3.35Å; K44-L48 PolarHBondContact O-N 3.34Å; H45-L48 PolarHBondContact O-N 3.34Å; L48-E50 PolarHBondContact O-N 3Å; L48-V51 PolarHBondContact O-N 3.04Å; L48-L52 WeakPolarHBondContact O-CB 3.39Å; L48-L52 WeakPolarHBondContact O-CG 3.22Å; L48-L52 PolarHBondContact O-N 2.9Å
49S92.8Very high89.9Confident62 Ų62103.8 Ų103.843%0.43452%0.515SS..Hα-helixtrans-61.8-41.9177.3-172.60000112.4H45 K46 F47 K53H45-S49 WeakPolarHBondContact O-CB 3.14Å; H45-S49 PolarHBondContact O-N 3.49Å; K46-S49 PolarHBondContact O-N 2.93Å; F47-S49 VanDerWaalsContact C-N 3.33Å; F47-S49 PolarHBondContact O-N 3.09Å; S49-K53 WeakPolarHBondContact O-CB 3.37Å; S49-K53 PolarHBondContact O-N 3.36Å
50E92.1Very high88.8Confident96 Ų96109.7 Ų109.745%0.44954%0.536SS..Hα-helixtrans-68.2-41.5176.6-68.9-62.715200111.5K46 F47 L48 K53 V54K46-E50 WeakPolarHBondContact O-CG 3.48Å; K46-E50 PolarHBondContact O-N 2.75Å; F47-E50 PolarHBondContact O-N 3.26Å; L48-E50 PolarHBondContact O-N 3Å; E50-K53 WeakPolarHBondContact O-CB 3.41Å; E50-K53 PolarHBondContact O-N 3.1Å; E50-V54 WeakPolarHBondContact O-CG2 3.34Å; E50-V54 PolarHBondContact O-N 2.99Å
51V90.9Very high88.9Confident57 Ų57110.5 Ų110.535%0.34554%0.539SS..Hα-helixtrans-60.2-47.2175.2170.30000111.1F47 L48 K53 V54 I55F47-V51 HydrophobicContact CD1-CG2 4.23Å; F47-V51 HydrophobicContact CE1-CG2 3.86Å; F47-V51 HydrophobicContact CE2-CG2 4.38Å; F47-V51 HydrophobicContact CZ-CG2 3.94Å; F47-V51 WeakPolarHBondContact O-CG2 3.36Å; F47-V51 PolarHBondContact O-N 3.16Å; L48-V51 PolarHBondContact O-N 3.04Å; V51-K53 VanDerWaalsContact C-N 3.32Å; V51-K53 PolarHBondContact O-N 3.13Å; V51-V54 PolarHBondContact O-N 3.37Å; V51-I55 HydrophobicContact CG1-CD1 3.93Å; V51-I55 WeakPolarHBondContact O-CG1 3.37Å; V51-I55 PolarHBondContact O-N 3.37Å
52L92.5Very high88.9Confident100 Ų100111.4 Ų111.452%0.52455%0.545SS..Hα-helixtrans-61.5-41.1177.9-76172.1000112L48 V54 I55 I56L48-L52 WeakPolarHBondContact O-CB 3.39Å; L48-L52 WeakPolarHBondContact O-CG 3.22Å; L48-L52 PolarHBondContact O-N 2.9Å; L52-V54 PolarHBondContact O-N 3.16Å; L52-I55 PolarHBondContact O-N 3.46Å; L52-I56 WeakPolarHBondContact O-CB 3.21Å; L52-I56 WeakPolarHBondContact O-CD1 3.44Å; L52-I56 VanDerWaalsContact O-CG1 3.28Å; L52-I56 WeakPolarHBondContact O-CG1 3.37Å; L52-I56 PolarHBondContact O-N 3.41Å
53K92.9Very high89Confident115 Ų115111.9 Ų111.950%0.555%0.546SS..Hα-helixtrans-59.5-46.7176.2-175.5-178.1176.5-171.20111.4S49 E50 V51 I55 I56 D57S49-K53 WeakPolarHBondContact O-CB 3.37Å; S49-K53 PolarHBondContact O-N 3.36Å; E50-K53 WeakPolarHBondContact O-CB 3.41Å; E50-K53 PolarHBondContact O-N 3.1Å; V51-K53 VanDerWaalsContact C-N 3.32Å; V51-K53 PolarHBondContact O-N 3.13Å; K53-I55 VanDerWaalsContact C-N 3.34Å; K53-I55 PolarHBondContact O-N 2.61Å; K53-I56 PolarHBondContact O-N 3.34Å; K53-D57 WeakPolarHBondContact O-CB 3.18Å; K53-D57 VanDerWaalsContact O-CG 3.25Å; K53-D57 PolarHBondContact O-N 3.13Å
54V91Very high89Confident81 Ų81110.1 Ų110.149%0.49154%0.541SS..Hα-helixtrans-61.4-41.6176.8172.90000111.5E50 V51 L52 N58E50-V54 WeakPolarHBondContact O-CG2 3.34Å; E50-V54 PolarHBondContact O-N 2.99Å; V51-V54 PolarHBondContact O-N 3.37Å; L52-V54 PolarHBondContact O-N 3.16Å; V54-N58 WeakPolarHBondContact CG1-ND2 3.11Å; V54-N58 WeakPolarHBondContact O-CB 3.35Å; V54-N58 PolarHBondContact O-N 2.73Å; V54-N58 VanDerWaalsContact O-N 3.11Å; V54-N58 PolarHBondContact O-ND2 3.07Å
55I91.4Very high88.9Confident82 Ų82110.6 Ų110.642%0.42155%0.547SS..Hα-helixtrans-62.3-50.6177.4-67.4166.6000110.4V51 L52 K53 D57 N58 E59V51-I55 HydrophobicContact CG1-CD1 3.93Å; V51-I55 WeakPolarHBondContact O-CG1 3.37Å; V51-I55 PolarHBondContact O-N 3.37Å; L52-I55 PolarHBondContact O-N 3.46Å; K53-I55 VanDerWaalsContact C-N 3.34Å; K53-I55 PolarHBondContact O-N 2.61Å; I55-D57 VanDerWaalsContact C-N 3.32Å; I55-D57 PolarHBondContact O-N 3.49Å; I55-N58 PolarHBondContact O-N 3.28Å; I55-N58 VanDerWaalsContact O-N 3.15Å; I55-E59 PolarHBondContact O-N 3.35Å; I55-E59 VanDerWaalsContact O-N 3.13Å
56I91.4Very high88.8Confident86 Ų86109.1 Ų109.144%0.44154%0.542SS..Hα-helixtrans-61.7-39.8-179.5-68.4163.2000111.8L52 K53 N58 E59L52-I56 WeakPolarHBondContact O-CB 3.21Å; L52-I56 WeakPolarHBondContact O-CD1 3.44Å; L52-I56 VanDerWaalsContact O-CG1 3.28Å; L52-I56 WeakPolarHBondContact O-CG1 3.37Å; L52-I56 PolarHBondContact O-N 3.41Å; K53-I56 PolarHBondContact O-N 3.34Å; I56-N58 VanDerWaalsContact C-N 3.29Å; I56-N58 PolarHBondContact O-N 3.09Å; I56-E59 PolarHBondContact O-N 3.29Å
57D90.7Very high88.6Confident89 Ų89106.9 Ų106.948%0.47654%0.537SS..Hα-helixtrans-71.3-24.1179.5-72.1-18000112.3K53 I55K53-D57 WeakPolarHBondContact O-CB 3.18Å; K53-D57 VanDerWaalsContact O-CG 3.25Å; K53-D57 PolarHBondContact O-N 3.13Å; I55-D57 VanDerWaalsContact C-N 3.32Å; I55-D57 PolarHBondContact O-N 3.49Å
58N85.7Confident88.5Confident127 Ų127105.7 Ų105.768%0.67954%0.537SS*.Hα-helixtrans-88-13.4174.6-76.7-64.2000113.9V54 I55 I56V54-N58 WeakPolarHBondContact CG1-ND2 3.11Å; V54-N58 WeakPolarHBondContact O-CB 3.35Å; V54-N58 PolarHBondContact O-N 2.73Å; V54-N58 VanDerWaalsContact O-N 3.11Å; V54-N58 PolarHBondContact O-ND2 3.07Å; I55-N58 PolarHBondContact O-N 3.28Å; I55-N58 VanDerWaalsContact O-N 3.15Å; I56-N58 VanDerWaalsContact C-N 3.29Å; I56-N58 PolarHBondContact O-N 3.09Å
59E81.1Confident88.1Confident159 Ų159105.8 Ų105.874%0.74354%0.537SS*.  trans-87.3-8.1175.5-74.6-176.417100113.4I55 I56I55-E59 PolarHBondContact O-N 3.35Å; I55-E59 VanDerWaalsContact O-N 3.13Å; I56-E59 PolarHBondContact O-N 3.29Å
60K65.2Low87.7Confident216 Ų216109.8 Ų109.894%0.93955%0.546SS*.  trans-96.80176.1-71.2179.5-179170.80112.1

Retrieved 60 of 60 residues in 48.1 ms (Link to these results)