A0A5K4F4R7_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A5K4F4R7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 82 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
1M45.4Very low50.4Low241 Ų241162.5 Ų162.5100%1.18783%0.833SS**  0112.20-76.9-170.4174.500108.4
2Q43.5Very low50Low195 Ų195163.4 Ų163.491%0.91183%0.831SS**  trans-78.7123.7177.2-65.8171.70.400107.5E4Q2-E4 PolarHBondContact O-N 3.4Å
3K50.8Low50.3Low168 Ų168159.2 Ų159.273%0.7383%0.825SS**  trans-84.6108.3176.3-75-179.5177.3-177.60107.8Y5K3-Y5 HydrophobicContact CB-CE2 4.1Å; K3-Y5 WeakPolarHBondContact O-CD2 3.05Å; K3-Y5 PolarHBondContact O-N 3.29Å
4E56.4Low50.2Low188 Ų188157.5 Ų157.588%0.87982%0.818SS**  trans-69.5111.4170.8-60.8-164.9176.400108.8Q2 S6Q2-E4 PolarHBondContact O-N 3.4Å; E4-S6 PolarHBondContact O-N 2.69Å
5Y53.9Low50.3Low186 Ų186154.8 Ų154.873%0.72981%0.814SS**  trans-88.3104.3172.4-71.6-85.6000108.3K3 S7K3-Y5 HydrophobicContact CB-CE2 4.1Å; K3-Y5 WeakPolarHBondContact O-CD2 3.05Å; K3-Y5 PolarHBondContact O-N 3.29Å; Y5-S7 PolarHBondContact O-N 2.79Å; Y5-S7 VanDerWaalsContact O-N 3.12Å
6S55.9Low50.4Low122 Ų122150.1 Ų150.185%0.85380%0.798SS**  trans-62.6107.4168.2-77.30000110.4E4E4-S6 PolarHBondContact O-N 2.69Å
7S54.8Low50.6Low120 Ų120151.8 Ų151.884%0.83980%0.8SS**  trans-98.794.4170.443.80000109.9Y5Y5-S7 PolarHBondContact O-N 2.79Å; Y5-S7 VanDerWaalsContact O-N 3.12Å
8S53.6Low51Low98 Ų98148.4 Ų148.469%0.68578%0.783SS**  trans-149.667.2166.854.80000112.1L10S8-L10 PolarHBondContact O-N 2.8Å
9I51.3Low51.5Low150 Ų150145.9 Ų145.977%0.76978%0.778SS**  trans-94.987.7155.1-58.2172.2000105.8H11I9-H11 VanDerWaalsContact C-N 3.25Å; I9-H11 PolarHBondContact O-N 2.74Å
10L42.2Very low52Low156 Ų156146.9 Ų146.982%0.81778%0.775SS**  trans-60.590.9163.7-87.1154000107.3S8 Q12S8-L10 PolarHBondContact O-N 2.8Å; L10-Q12 VanDerWaalsContact C-N 3.31Å; L10-Q12 PolarHBondContact O-N 2.8Å
11H46.3Very low52.8Low164 Ų164148.8 Ų148.876%0.75978%0.777SS**  trans-65.1101.6159.7-80.8163.1000106.8I9 S13I9-H11 VanDerWaalsContact C-N 3.25Å; I9-H11 PolarHBondContact O-N 2.74Å; H11-S13 PolarHBondContact O-N 2.73Å
12Q46.6Very low54Low173 Ų173147.4 Ų147.481%0.80877%0.765SS**  trans-56.396162.5-78167.4-4.600107.1L10 N14L10-Q12 VanDerWaalsContact C-N 3.31Å; L10-Q12 PolarHBondContact O-N 2.8Å; Q12-N14 PolarHBondContact O-N 2.67Å
13S53.4Low55.7Low108 Ų108143.6 Ų143.676%0.75576%0.755SS**  trans-66.590.2164.745.40000106H11 P15H11-S13 PolarHBondContact O-N 2.73Å; S13-P15 WeakPolarHBondContact O-CD 3.06Å
14N49.1Very low57.3Low136 Ų136145.6 Ų145.673%0.72776%0.764SS**  trans-58112.2165.7-83.6-16.9000106.4Q12 S16Q12-N14 PolarHBondContact O-N 2.67Å; N14-S16 PolarHBondContact O-N 2.92Å
15P51.9Low58.7Low117 Ų117140.2 Ų140.276%0.7674%0.741SS**  trans-79.566171.232.7-22.6000105.2S13 H17S13-P15 WeakPolarHBondContact O-CD 3.06Å; P15-H17 PolarHBondContact O-N 2.82Å
16S50.8Low60.5Low80 Ų80134.1 Ų134.156%0.55973%0.725SS**  trans-68.484162-179.10000104.5N14 N18N14-S16 PolarHBondContact O-N 2.92Å; S16-N18 PolarHBondContact O-N 2.91Å; S16-N18 PolarHBondContact OG-ND2 3.31Å; S16-N18 PolarHBondContact OG-OD1 3.27Å
17H54.5Low62.3Low178 Ų178133 Ų13382%0.82472%0.715SS**  trans-65.762.7167.8-148-76.6000106.1P15 S19P15-H17 PolarHBondContact O-N 2.82Å; H17-S19 PolarHBondContact O-N 3.49Å
18N58.1Low64.1Low92 Ų92135 Ų13549%0.49271%0.711SS.*  trans-59.8100.4165.9-86.1-28.8000102.7S16 F20S16-N18 PolarHBondContact O-N 2.91Å; S16-N18 PolarHBondContact OG-ND2 3.31Å; S16-N18 PolarHBondContact OG-OD1 3.27Å; N18-F20 HydrophobicContact CB-CD1 4.29Å; N18-F20 HydrophobicContact CB-CD2 3.81Å; N18-F20 HydrophobicContact CB-CE1 3.93Å; N18-F20 HydrophobicContact CB-CE2 3.41Å; N18-F20 VanDerWaalsContact CB-CE2 3.41Å; N18-F20 HydrophobicContact CB-CG 4.24Å; N18-F20 HydrophobicContact CB-CZ 3.48Å; N18-F20 VanDerWaalsContact CB-CZ 3.48Å; N18-F20 WeakPolarHBondContact O-CD2 3.44Å; N18-F20 PolarHBondContact O-N 2.96Å
19S59.6Low65.8Low100 Ų100136.1 Ų136.170%0.69970%0.703SS**  trans-6277.7164.357.70000105.3H17 K21H17-S19 PolarHBondContact O-N 3.49Å; S19-K21 PolarHBondContact O-N 2.92Å
20F62.5Low67.8Low165 Ų165132.4 Ų132.472%0.72468%0.684SS**  trans-62.599.8172.6-67.6-74.8000103.8N18 K22N18-F20 HydrophobicContact CB-CD1 4.29Å; N18-F20 HydrophobicContact CB-CD2 3.81Å; N18-F20 HydrophobicContact CB-CE1 3.93Å; N18-F20 HydrophobicContact CB-CE2 3.41Å; N18-F20 VanDerWaalsContact CB-CE2 3.41Å; N18-F20 HydrophobicContact CB-CG 4.24Å; N18-F20 HydrophobicContact CB-CZ 3.48Å; N18-F20 VanDerWaalsContact CB-CZ 3.48Å; N18-F20 WeakPolarHBondContact O-CD2 3.44Å; N18-F20 PolarHBondContact O-N 2.96Å; F20-K22 PolarHBondContact O-N 3.36Å
21K68.5Low70.3Confident188 Ų188129.8 Ų129.882%0.81767%0.671SS**  trans-49.2115.6165.5-74.2-176.3179.1179.20104.4S19 T23S19-K21 PolarHBondContact O-N 2.92Å; K21-T23 PolarHBondContact O-N 3.46Å
22K71.6Confident72.2Confident212 Ų212129.4 Ų129.492%0.92267%0.667SS**  trans-63.890.9-178-70.5179.7179.5178.90107.3F20 K24F20-K22 PolarHBondContact O-N 3.36Å; K22-K24 PolarHBondContact O-N 2.88Å
23T78.6Confident74.1Confident115 Ų115124.7 Ų124.771%0.70665%0.647SS**PPolyproline II helixtrans-72.2118.5175.452.80000107.3K21 L25K21-T23 PolarHBondContact O-N 3.46Å; T23-L25 PolarHBondContact O-N 3.39Å
24K83.6Confident75.8Confident210 Ų210123.6 Ų123.691%0.91363%0.632SS**PPolyproline II helixtrans-62.2125.4171.8-165.9174.1-176.8179.60108.2K22K22-K24 PolarHBondContact O-N 2.88Å
25L85.8Confident77.6Confident75 Ų75122.7 Ų122.739%0.39362%0.623SS.*PPolyproline II helixtrans-73.8145.2176.9-71.8155.8000109.7T23 K29 I30T23-L25 PolarHBondContact O-N 3.39Å; L25-K29 HydrophobicContact CD2-CB 4.42Å; L25-K29 HydrophobicContact CD2-CD 3.46Å; L25-K29 VanDerWaalsContact CD2-CD 3.46Å; L25-K29 HydrophobicContact CD2-CG 3.87Å; L25-I30 HydrophobicContact CB-CD1 4.16Å; L25-I30 HydrophobicContact CB-CG1 3.83Å
26S91.8Very high78.9Confident57 Ų57126.8 Ų126.840%0.39962%0.623SS.*PPolyproline II helixtrans-68.7150.2170.367.30000110.5Q28 K29 I30S26-Q28 PolarHBondContact O-N 3.1Å; S26-K29 PolarHBondContact O-N 3.06Å; S26-K29 PolarHBondContact OG-N 3.5Å; S26-I30 PolarHBondContact O-N 3.23Å; S26-I30 VanDerWaalsContact O-N 3.1Å
27P93.2Very high80.3Confident99 Ų99129.4 Ų129.464%0.64363%0.63SS**Hα-helixtrans-54.4-38.6176.6-27.135000113.3K29 I30 N31P27-K29 VanDerWaalsContact C-N 3.34Å; P27-K29 PolarHBondContact O-N 3.09Å; P27-I30 PolarHBondContact O-N 2.94Å; P27-N31 PolarHBondContact O-N 3.12Å
28Q93.2Very high81.6Confident163 Ų163125.5 Ų125.576%0.76262%0.619SS**Hα-helixtrans-60.6-42.1177-68.4174.4-16.600112.4S26 I30 N31 K32S26-Q28 PolarHBondContact O-N 3.1Å; Q28-I30 VanDerWaalsContact C-N 3.35Å; Q28-N31 PolarHBondContact O-N 3.29Å; Q28-K32 PolarHBondContact O-N 2.84Å
29K90.3Very high82.5Confident120 Ų120125.8 Ų125.852%0.52262%0.621SS.*Hα-helixtrans-69.6-36.1178.8-170.6164.3172.9-178.60111.4L25 S26 P27 K32 I33L25-K29 HydrophobicContact CD2-CB 4.42Å; L25-K29 HydrophobicContact CD2-CD 3.46Å; L25-K29 VanDerWaalsContact CD2-CD 3.46Å; L25-K29 HydrophobicContact CD2-CG 3.87Å; S26-K29 PolarHBondContact O-N 3.06Å; S26-K29 PolarHBondContact OG-N 3.5Å; P27-K29 VanDerWaalsContact C-N 3.34Å; P27-K29 PolarHBondContact O-N 3.09Å; K29-K32 PolarHBondContact O-N 3.07Å; K29-I33 HydrophobicContact CG-CD1 4.33Å; K29-I33 WeakPolarHBondContact O-CD1 3.43Å; K29-I33 VanDerWaalsContact O-CG1 3.27Å; K29-I33 WeakPolarHBondContact O-CG1 3.38Å; K29-I33 PolarHBondContact O-N 3.09Å; K29-I33 VanDerWaalsContact O-N 3.09Å
30I93.2Very high82.8Confident72 Ų72128.9 Ų128.937%0.36962%0.618SS.*Hα-helixtrans-62.4-49.4173.8-65.2169.2000110.1L25 S26 P27 Q28 K32 I33 I34L25-I30 HydrophobicContact CB-CD1 4.16Å; L25-I30 HydrophobicContact CB-CG1 3.83Å; S26-I30 PolarHBondContact O-N 3.23Å; S26-I30 VanDerWaalsContact O-N 3.1Å; P27-I30 PolarHBondContact O-N 2.94Å; Q28-I30 VanDerWaalsContact C-N 3.35Å; I30-K32 VanDerWaalsContact C-N 3.31Å; I30-K32 PolarHBondContact O-N 2.61Å; I30-I33 WeakPolarHBondContact O-CB 3.27Å; I30-I33 PolarHBondContact O-N 3.06Å; I30-I34 HydrophobicContact CG2-CD1 3.76Å; I30-I34 HydrophobicContact CG2-CG1 4.33Å; I30-I34 WeakPolarHBondContact O-CG1 3.47Å; I30-I34 PolarHBondContact O-N 3.43Å
31N93.4Very high83Confident102 Ų102124.2 Ų124.255%0.54560%0.601SS.*Hα-helixtrans-59.6-41.3179.1-71-9000112.2P27 Q28 I33 I34 E35P27-N31 PolarHBondContact O-N 3.12Å; Q28-N31 PolarHBondContact O-N 3.29Å; N31-I33 VanDerWaalsContact C-N 3.31Å; N31-I33 PolarHBondContact O-N 3.42Å; N31-I34 PolarHBondContact O-N 3.49Å; N31-E35 WeakPolarHBondContact O-CB 3.33Å; N31-E35 PolarHBondContact O-N 3.24Å
32K87.7Confident82.7Confident156 Ų156123 Ų12368%0.67860%0.596SS**Hα-helixtrans-62.4-37.6175.2-173.3172.8-176172.50112.7Q28 K29 I30 R36Q28-K32 PolarHBondContact O-N 2.84Å; K29-K32 PolarHBondContact O-N 3.07Å; I30-K32 VanDerWaalsContact C-N 3.31Å; I30-K32 PolarHBondContact O-N 2.61Å; K32-R36 WeakPolarHBondContact O-CB 3.48Å; K32-R36 PolarHBondContact O-N 3.1Å; K32-R36 VanDerWaalsContact O-N 3.11Å
33I86Confident82.4Confident73 Ų73118.2 Ų118.237%0.37458%0.584SS.*Hα-helixtrans-67.8-46175.2-68.4163.3000109.9K29 I30 N31 R36 L37K29-I33 HydrophobicContact CG-CD1 4.33Å; K29-I33 WeakPolarHBondContact O-CD1 3.43Å; K29-I33 VanDerWaalsContact O-CG1 3.27Å; K29-I33 WeakPolarHBondContact O-CG1 3.38Å; K29-I33 PolarHBondContact O-N 3.09Å; K29-I33 VanDerWaalsContact O-N 3.09Å; I30-I33 WeakPolarHBondContact O-CB 3.27Å; I30-I33 PolarHBondContact O-N 3.06Å; N31-I33 VanDerWaalsContact C-N 3.31Å; N31-I33 PolarHBondContact O-N 3.42Å; I33-R36 PolarHBondContact O-N 3.42Å; I33-L37 HydrophobicContact CG2-CD1 3.67Å; I33-L37 HydrophobicContact CG2-CG 4.28Å; I33-L37 WeakPolarHBondContact O-CB 3.47Å; I33-L37 VanDerWaalsContact O-CG 3.27Å; I33-L37 WeakPolarHBondContact O-CG 3.41Å; I33-L37 PolarHBondContact O-N 2.93Å
34I89Confident81.5Confident85 Ų85118.9 Ų118.944%0.43658%0.582SS.*Hα-helixtrans-58.1-54.1177.7-68.3169.8000109.7I30 N31 R36 L37 T38I30-I34 HydrophobicContact CG2-CD1 3.76Å; I30-I34 HydrophobicContact CG2-CG1 4.33Å; I30-I34 WeakPolarHBondContact O-CG1 3.47Å; I30-I34 PolarHBondContact O-N 3.43Å; N31-I34 PolarHBondContact O-N 3.49Å; I34-R36 VanDerWaalsContact C-N 3.28Å; I34-R36 PolarHBondContact O-N 3.43Å; I34-L37 CarbonylContact O-C 3.53Å; I34-L37 PolarHBondContact O-N 2.87Å; I34-T38 HydrophobicContact CG2-CG2 3.89Å; I34-T38 WeakPolarHBondContact O-CB 3.4Å; I34-T38 WeakPolarHBondContact O-CG2 3.37Å; I34-T38 PolarHBondContact O-N 3.05Å; I34-T38 PolarHBondContact O-OG1 3.35Å
35E86.9Confident80Confident117 Ų117109.8 Ų109.855%0.54755%0.548SS..Hα-helixtrans-54.6-44.5179.9-173.7-178.8-171.400111.8N31 L37 T38 N39N31-E35 WeakPolarHBondContact O-CB 3.33Å; N31-E35 PolarHBondContact O-N 3.24Å; E35-L37 VanDerWaalsContact C-N 3.33Å; E35-L37 PolarHBondContact O-N 3.46Å; E35-T38 WeakPolarHBondContact CA-OG1 3.33Å; E35-T38 PolarHBondContact O-OG1 3.05Å; E35-N39 WeakPolarHBondContact CG-ND2 3.27Å; E35-N39 WeakPolarHBondContact O-CB 3.49Å; E35-N39 VanDerWaalsContact O-CG 3.24Å; E35-N39 PolarHBondContact O-N 2.75Å; E35-N39 PolarHBondContact O-ND2 3.35Å
36R78.9Confident78.6Confident204 Ų204110.3 Ų110.377%0.7756%0.556SS**Hα-helixtrans-63-37175.4179.5-178.6173.3-172.5-0.8112.9K32 I33 I34K32-R36 WeakPolarHBondContact O-CB 3.48Å; K32-R36 PolarHBondContact O-N 3.1Å; K32-R36 VanDerWaalsContact O-N 3.11Å; I33-R36 PolarHBondContact O-N 3.42Å; I34-R36 VanDerWaalsContact C-N 3.28Å; I34-R36 PolarHBondContact O-N 3.43Å
37L79.1Confident76.7Confident134 Ų134111 Ų11170%0.70256%0.559SS**Hα-helixtrans-86-25.2-176.6-68.4177.4000113I33 I34 E35I33-L37 HydrophobicContact CG2-CD1 3.67Å; I33-L37 HydrophobicContact CG2-CG 4.28Å; I33-L37 WeakPolarHBondContact O-CB 3.47Å; I33-L37 VanDerWaalsContact O-CG 3.27Å; I33-L37 WeakPolarHBondContact O-CG 3.41Å; I33-L37 PolarHBondContact O-N 2.93Å; I34-L37 CarbonylContact O-C 3.53Å; I34-L37 PolarHBondContact O-N 2.87Å; E35-L37 VanDerWaalsContact C-N 3.33Å; E35-L37 PolarHBondContact O-N 3.46Å
38T83.8Confident74.9Confident96 Ų96112.7 Ų112.759%0.58956%0.558SS**Hα-helixtrans-85.2-32.717654.10000112I34 E35 Y40I34-T38 HydrophobicContact CG2-CG2 3.89Å; I34-T38 WeakPolarHBondContact O-CB 3.4Å; I34-T38 WeakPolarHBondContact O-CG2 3.37Å; I34-T38 PolarHBondContact O-N 3.05Å; I34-T38 PolarHBondContact O-OG1 3.35Å; E35-T38 WeakPolarHBondContact CA-OG1 3.33Å; E35-T38 PolarHBondContact O-OG1 3.05Å; T38-Y40 PolarHBondContact O-N 3.11Å
39N75.8Confident73.1Confident99 Ų99107.6 Ų107.653%0.52954%0.54SS..SBendtrans-88.295.4177.3-62.5-22.8000109.2E35 D41E35-N39 WeakPolarHBondContact CG-ND2 3.27Å; E35-N39 WeakPolarHBondContact O-CB 3.49Å; E35-N39 VanDerWaalsContact O-CG 3.24Å; E35-N39 PolarHBondContact O-N 2.75Å; E35-N39 PolarHBondContact O-ND2 3.35Å; N39-D41 PolarHBondContact O-N 3.29Å; N39-D41 VanDerWaalsContact O-N 3.16Å
40Y66.9Low71.5Confident165 Ų165104.5 Ų104.565%0.64753%0.53SS*.  trans-71.5107.1169.5177.9-105.8000109.6T38 K42T38-Y40 PolarHBondContact O-N 3.11Å; Y40-K42 HydrophobicContact CD1-CB 4.48Å; Y40-K42 HydrophobicContact CE1-CB 3.67Å
41D66.8Low69.9Low66 Ų66106.6 Ų106.635%0.35355%0.551SS.*  trans-95.6110.2164.1-171.8-20.5000108.6N39 T43 I44 G45N39-D41 PolarHBondContact O-N 3.29Å; N39-D41 VanDerWaalsContact O-N 3.16Å; D41-T43 VanDerWaalsContact CG-OG1 3.24Å; D41-T43 PolarHBondContact O-N 3.44Å; D41-T43 VanDerWaalsContact O-N 3.08Å; D41-T43 WeakPolarHBondContact OD1-CA 3.43Å; D41-T43 WeakPolarHBondContact OD1-CB 3.41Å; D41-T43 PolarHBondContact OD1-N 2.94Å; D41-T43 PolarHBondContact OD1-OG1 2.96Å; D41-T43 PolarHBondContact OD2-OG1 3.27Å; D41-I44 HydrophobicContact CB-CB 3.96Å; D41-I44 HydrophobicContact CB-CD1 4.1Å; D41-I44 HydrophobicContact CB-CG1 4.03Å; D41-I44 CarbonylContact O-C 3.31Å; D41-I44 VanDerWaalsContact O-C 3.31Å; D41-I44 PolarHBondContact O-N 3.35Å; D41-I44 WeakPolarHBondContact OD2-CD1 3.43Å; D41-I44 VanDerWaalsContact OD2-CG1 3.29Å; D41-I44 WeakPolarHBondContact OD2-CG1 3.25Å; D41-G45 PolarHBondContact O-N 2.83Å
42K61.4Low68.6Low164 Ų164106 Ų10671%0.71355%0.545SS*.THydrogen-bonded Turntrans-56.3-23.817665.7-178.9-179.81780113.2Y40Y40-K42 HydrophobicContact CD1-CB 4.48Å; Y40-K42 HydrophobicContact CE1-CB 3.67Å
43T64Low68Low110 Ų110103 Ų10368%0.67553%0.532SS*.THydrogen-bonded Turntrans-87.7-20.3178.274.40000112.7D41D41-T43 VanDerWaalsContact CG-OG1 3.24Å; D41-T43 PolarHBondContact O-N 3.44Å; D41-T43 VanDerWaalsContact O-N 3.08Å; D41-T43 WeakPolarHBondContact OD1-CA 3.43Å; D41-T43 WeakPolarHBondContact OD1-CB 3.41Å; D41-T43 PolarHBondContact OD1-N 2.94Å; D41-T43 PolarHBondContact OD1-OG1 2.96Å; D41-T43 PolarHBondContact OD2-OG1 3.27Å
44I61.3Low67.6Low129 Ų129103.4 Ų103.466%0.66253%0.534SS*.SBendtrans-113.617.4178-44.6170.2000110.7D41D41-I44 HydrophobicContact CB-CB 3.96Å; D41-I44 HydrophobicContact CB-CD1 4.1Å; D41-I44 HydrophobicContact CB-CG1 4.03Å; D41-I44 CarbonylContact O-C 3.31Å; D41-I44 VanDerWaalsContact O-C 3.31Å; D41-I44 PolarHBondContact O-N 3.35Å; D41-I44 WeakPolarHBondContact OD2-CD1 3.43Å; D41-I44 VanDerWaalsContact OD2-CG1 3.29Å; D41-I44 WeakPolarHBondContact OD2-CG1 3.25Å
45G52.5Low67.3Low19 Ų19106.1 Ų106.120%0.19654%0.539CS..SBendtrans-57155.2172.600000110.2D41 P47D41-G45 PolarHBondContact O-N 2.83Å; G45-P47 VanDerWaalsContact O-N 3.11Å
46P55.6Low67.1Low87 Ų87105.4 Ų105.457%0.56554%0.539SS*.  trans-50.2129.6165.921.4-28.5000106.5E48 S49P46-E48 PolarHBondContact O-N 3.25Å; P46-S49 PolarHBondContact O-N 2.95Å; P46-S49 PolarHBondContact O-OG 2.77Å
47P52.6Low67.3Low70 Ų7096.4 Ų96.446%0.45551%0.51SS..THydrogen-bonded Turntrans-62.1-10.2-167.123-34.6000113.2G45 Y63G45-P47 VanDerWaalsContact O-N 3.11Å; P47-Y63 VanDerWaalsContact O-CD1 3.26Å; P47-Y63 WeakPolarHBondContact O-CD1 3.26Å; P47-Y63 WeakPolarHBondContact O-CE1 3.18Å
48E54.2Low67.8Low135 Ų13599.8 Ų99.863%0.63151%0.514SS*.THydrogen-bonded Turntrans-82.6-15.2174.8-57.7-176.5-17300114.9P46P46-E48 PolarHBondContact O-N 3.25Å
49S54.9Low67.7Low56 Ų5697.9 Ų97.939%0.39251%0.514SS..  trans-96.111.1-177.186.10000114.4P46 S51P46-S49 PolarHBondContact O-N 2.95Å; P46-S49 PolarHBondContact O-OG 2.77Å; S49-S51 PolarHBondContact O-N 3.17Å
50N57.1Low67.8Low55 Ų55101.3 Ų101.329%0.29452%0.519SS..  trans-70128.1174.9-158.12.9000108.9E52 K53N50-E52 PolarHBondContact ND2-OE2 3.3Å; N50-E52 PolarHBondContact O-N 3.38Å; N50-E52 PolarHBondContact OD1-OE2 2.9Å; N50-K53 PolarHBondContact O-N 2.77Å; N50-K53 VanDerWaalsContact O-N 3.09Å
51S60.5Low68.6Low117 Ų11797.9 Ų97.982%0.81851%0.506SS*.THydrogen-bonded Turntrans-59.2-18.2177.946.50000112.5S49 K53S49-S51 PolarHBondContact O-N 3.17Å; S51-K53 VanDerWaalsContact C-N 3.29Å; S51-K53 PolarHBondContact O-N 2.83Å
52E66.7Low69.2Low88 Ų8899.4 Ų99.441%0.41151%0.511SS..THydrogen-bonded Turntrans-86.49.4179.8-61.6162.5158.700113.3N50 I54 P64 H65N50-E52 PolarHBondContact ND2-OE2 3.3Å; N50-E52 PolarHBondContact O-N 3.38Å; N50-E52 PolarHBondContact OD1-OE2 2.9Å; E52-I54 PolarHBondContact O-N 2.84Å; E52-P64 WeakPolarHBondContact O-CD 3.33Å; E52-H65 IonicContact OE1-CD2 3.59Å; E52-H65 IonicContact OE1-NE2 3.52Å; E52-H65 IonicContact OE2-CD2 3.3Å; E52-H65 PolarHBondContact OE2-CD2 2.96Å; E52-H65 IonicContact OE2-CG 3.93Å; E52-H65 IonicContact OE2-NE2 2.61Å; E52-H65 PolarHBondContact OE2-NE2 3.28Å
53K73.7Confident70Confident94 Ų9493.3 Ų93.341%0.40948%0.484SS..PPolyproline II helixtrans-64.5127.5175.771.7-176.5-179.7-179.10110.5N50 S51 Y61 E62 Y63N50-K53 PolarHBondContact O-N 2.77Å; N50-K53 VanDerWaalsContact O-N 3.09Å; S51-K53 VanDerWaalsContact C-N 3.29Å; S51-K53 PolarHBondContact O-N 2.83Å; K53-Y61 HydrophobicContact CB-CD1 4.29Å; K53-Y61 HydrophobicContact CD-CD1 3.8Å; K53-Y61 HydrophobicContact CD-CE1 4.06Å; K53-Y61 HydrophobicContact CD-CG 4.46Å; K53-Y61 HydrophobicContact CG-CD1 4.02Å; K53-Y61 HydrophobicContact CG-CE1 4.5Å; K53-E62 WeakPolarHBondContact CA-O 3.16Å; K53-Y63 HydrophobicContact CB-CD1 4Å; K53-Y63 HydrophobicContact CB-CE1 3.69Å
54I78.6Confident70.2Confident82 Ų8291.3 Ų91.342%0.42147%0.473SS..EExtended strand (participates in β ladder)trans-97.1120.4175.8-53.8172.1000107.3E52 L56 Y61 E62 P64E52-I54 PolarHBondContact O-N 2.84Å; I54-L56 HydrophobicContact CG2-CD2 4.27Å; I54-L56 PolarHBondContact O-N 2.92Å; I54-Y61 CarbonylContact O-C 3.53Å; I54-Y61 VanDerWaalsContact O-CA 3.28Å; I54-Y61 WeakPolarHBondContact O-CA 3.36Å; I54-E62 HydrophobicContact CB-CB 4.2Å; I54-E62 PolarHBondContact N-O 3.29Å; I54-E62 PolarHBondContact O-N 2.88Å; I54-P64 HydrophobicContact CD1-CG 3.8Å; I54-P64 HydrophobicContact CG1-CG 4.27Å
55Y81.2Confident70.5Confident141 Ų14191 Ų9155%0.55347%0.468SS*.EExtended strand (participates in β ladder)trans-75.7120.2176.6-178.1-122.9000110.3G57 Y58 R60 Y61Y55-G57 VanDerWaalsContact CZ-CA 3.46Å; Y55-Y58 PolarHBondContact OH-N 2.85Å; Y55-R60 WeakPolarHBondContact CD2-O 3.05Å; Y55-Y61 AromaticContact CD2-CD1 3.92Å; Y55-Y61 HydrophobicContact CD2-CD1 3.92Å; Y55-Y61 AromaticContact CD2-CE1 3.41Å; Y55-Y61 HydrophobicContact CD2-CE1 3.41Å; Y55-Y61 VanDerWaalsContact CD2-CE1 3.41Å; Y55-Y61 HydrophobicContact CD2-CE2 4.21Å; Y55-Y61 AromaticContact CD2-CZ 3.57Å; Y55-Y61 HydrophobicContact CE2-CE1 4.29Å; Y55-Y61 HydrophobicContact CE2-CE2 4.44Å; Y55-Y61 AromaticContact CE2-CZ 3.99Å; Y55-Y61 HydrophobicContact CG-CE1 4.08Å
56L84.5Confident71.1Confident102 Ų10295.1 Ų95.153%0.53448%0.478SS..EExtended strand (participates in β ladder)trans-99.21.9-178.7-60.6-179.5000113.2I54 R60 E62I54-L56 HydrophobicContact CG2-CD2 4.27Å; I54-L56 PolarHBondContact O-N 2.92Å; L56-R60 HydrophobicContact CB-CB 4.13Å; L56-R60 PolarHBondContact N-O 2.84Å; L56-E62 HydrophobicContact CD1-CB 3.93Å; L56-E62 HydrophobicContact CD2-CB 4.35Å; L56-E62 HydrophobicContact CG-CB 4.15Å
57G81.7Confident71.3Confident15 Ų1599.1 Ų99.116%0.15549%0.486CS..EExtended strand (participates in β ladder)trans90.5163.1-175.100000113.7Y55 G59 R60Y55-G57 VanDerWaalsContact CZ-CA 3.46Å; G57-G59 PolarHBondContact O-N 2.96Å; G57-R60 VanDerWaalsContact O-CB 3.25Å; G57-R60 WeakPolarHBondContact O-CB 3.49Å; G57-R60 WeakPolarHBondContact O-CG 3.29Å; G57-R60 PolarHBondContact O-N 2.79Å
58Y90.8Very high71.7Confident205 Ų205103.2 Ų103.280%0.80449%0.494SS*.THydrogen-bonded Turntrans5337.6176.5-53-81.2000114.2Y55 R60Y55-Y58 PolarHBondContact OH-N 2.85Å; Y58-R60 PolarHBondContact O-N 3.41Å
59G80.9Confident71.6Confident56 Ų56103.8 Ų103.858%0.57750%0.495SS*.THydrogen-bonded Turntrans70.711.5-177.300000114.9G57G57-G59 PolarHBondContact O-N 2.96Å
60R78.8Confident71.7Confident171 Ų171106.8 Ų106.865%0.64551%0.506SS*.EExtended strand (participates in β ladder)trans-93.6142.3178.4-53.7-178.8-159.3-142.14.3110.8Y55 L56 G57 Y58Y55-R60 WeakPolarHBondContact CD2-O 3.05Å; L56-R60 HydrophobicContact CB-CB 4.13Å; L56-R60 PolarHBondContact N-O 2.84Å; G57-R60 VanDerWaalsContact O-CB 3.25Å; G57-R60 WeakPolarHBondContact O-CB 3.49Å; G57-R60 WeakPolarHBondContact O-CG 3.29Å; G57-R60 PolarHBondContact O-N 2.79Å; Y58-R60 PolarHBondContact O-N 3.41Å
61Y84Confident71.6Confident94 Ų94110.3 Ų110.337%0.36953%0.525SS..EExtended strand (participates in β ladder)trans-134.2139.9177.4-63.1-90.1000110.2K53 I54 Y55K53-Y61 HydrophobicContact CB-CD1 4.29Å; K53-Y61 HydrophobicContact CD-CD1 3.8Å; K53-Y61 HydrophobicContact CD-CE1 4.06Å; K53-Y61 HydrophobicContact CD-CG 4.46Å; K53-Y61 HydrophobicContact CG-CD1 4.02Å; K53-Y61 HydrophobicContact CG-CE1 4.5Å; I54-Y61 CarbonylContact O-C 3.53Å; I54-Y61 VanDerWaalsContact O-CA 3.28Å; I54-Y61 WeakPolarHBondContact O-CA 3.36Å; Y55-Y61 AromaticContact CD2-CD1 3.92Å; Y55-Y61 HydrophobicContact CD2-CD1 3.92Å; Y55-Y61 AromaticContact CD2-CE1 3.41Å; Y55-Y61 HydrophobicContact CD2-CE1 3.41Å; Y55-Y61 VanDerWaalsContact CD2-CE1 3.41Å; Y55-Y61 HydrophobicContact CD2-CE2 4.21Å; Y55-Y61 AromaticContact CD2-CZ 3.57Å; Y55-Y61 HydrophobicContact CE2-CE1 4.29Å; Y55-Y61 HydrophobicContact CE2-CE2 4.44Å; Y55-Y61 AromaticContact CE2-CZ 3.99Å; Y55-Y61 HydrophobicContact CG-CE1 4.08Å
62E78.7Confident71.6Confident98 Ų98113.4 Ų113.446%0.45853%0.527SS..EExtended strand (participates in β ladder)trans-97143.8167.6-169.5173.4-173.200110.2K53 I54 L56K53-E62 WeakPolarHBondContact CA-O 3.16Å; I54-E62 HydrophobicContact CB-CB 4.2Å; I54-E62 PolarHBondContact N-O 3.29Å; I54-E62 PolarHBondContact O-N 2.88Å; L56-E62 HydrophobicContact CD1-CB 3.93Å; L56-E62 HydrophobicContact CD2-CB 4.35Å; L56-E62 HydrophobicContact CG-CB 4.15Å
63Y77.6Confident71.4Confident35 Ų35113 Ų11314%0.13753%0.534CS..  trans-125.588-178.3-59.6-82.2000109P47 K53 H65 R66P47-Y63 VanDerWaalsContact O-CD1 3.26Å; P47-Y63 WeakPolarHBondContact O-CD1 3.26Å; P47-Y63 WeakPolarHBondContact O-CE1 3.18Å; K53-Y63 HydrophobicContact CB-CD1 4Å; K53-Y63 HydrophobicContact CB-CE1 3.69Å; Y63-H65 PolarHBondContact O-N 3.16Å; Y63-H65 VanDerWaalsContact O-N 3.1Å; Y63-R66 WeakPolarHBondContact O-CB 3.28Å; Y63-R66 PolarHBondContact O-N 3.26Å
64P69.4Low71.3Confident69 Ų69115.4 Ų115.445%0.44854%0.544SS..THydrogen-bonded Turntrans-58.8-31-167.6-24.432.6000114.1E52 I54E52-P64 WeakPolarHBondContact O-CD 3.33Å; I54-P64 HydrophobicContact CD1-CG 3.8Å; I54-P64 HydrophobicContact CG1-CG 4.27Å
65H67Low71.3Confident122 Ų122120.8 Ų120.857%0.56556%0.564SS**THydrogen-bonded Turntrans-92.71.4-177.6-57.6-83.2000113.9E52 Y63 K67E52-H65 IonicContact OE1-CD2 3.59Å; E52-H65 IonicContact OE1-NE2 3.52Å; E52-H65 IonicContact OE2-CD2 3.3Å; E52-H65 PolarHBondContact OE2-CD2 2.96Å; E52-H65 IonicContact OE2-CG 3.93Å; E52-H65 IonicContact OE2-NE2 2.61Å; E52-H65 PolarHBondContact OE2-NE2 3.28Å; Y63-H65 PolarHBondContact O-N 3.16Å; Y63-H65 VanDerWaalsContact O-N 3.1Å; H65-K67 VanDerWaalsContact C-N 3.34Å; H65-K67 PolarHBondContact O-N 2.92Å
66R64Low71.3Confident106 Ų106119.7 Ų119.740%0.457%0.567SS.*  trans-67.9100167.8-94-169.7-176.6-151.111108Y63 Y68Y63-R66 WeakPolarHBondContact O-CB 3.28Å; Y63-R66 PolarHBondContact O-N 3.26Å; R66-Y68 HydrophobicContact CB-CD2 4.4Å; R66-Y68 HydrophobicContact CB-CE2 4.08Å; R66-Y68 PolarHBondContact O-N 3.41Å
67K61.1Low71.3Confident170 Ų170118.2 Ų118.274%0.73956%0.563SS**  trans-63.296.7152.3-65.1-176.4-177.5-178.90105.8H65 F69H65-K67 VanDerWaalsContact C-N 3.34Å; H65-K67 PolarHBondContact O-N 2.92Å; K67-F69 HydrophobicContact CB-CD2 4.21Å; K67-F69 HydrophobicContact CB-CE2 4.04Å; K67-F69 HydrophobicContact CB-CZ 4.44Å; K67-F69 HydrophobicContact CD-CZ 4.28Å; K67-F69 PolarHBondContact O-N 2.89Å
68Y60.8Low71.5Confident156 Ų156125.2 Ų125.261%0.61259%0.592SS**  trans-62.795.3158.5-64.4-82.3000104.6R66 N70R66-Y68 HydrophobicContact CB-CD2 4.4Å; R66-Y68 HydrophobicContact CB-CE2 4.08Å; R66-Y68 PolarHBondContact O-N 3.41Å; Y68-N70 PolarHBondContact O-N 3.01Å
69F52.7Low71.5Confident148 Ų148120.8 Ų120.865%0.64959%0.586SS**  trans-64.385.8164.5-75-79.7000105.5K67 N71K67-F69 HydrophobicContact CB-CD2 4.21Å; K67-F69 HydrophobicContact CB-CE2 4.04Å; K67-F69 HydrophobicContact CB-CZ 4.44Å; K67-F69 HydrophobicContact CD-CZ 4.28Å; K67-F69 PolarHBondContact O-N 2.89Å; F69-N71 WeakPolarHBondContact CD1-OD1 3.33Å; F69-N71 PolarHBondContact O-N 3.1Å
70N55.2Low71.7Confident119 Ų119122 Ų12264%0.63658%0.577SS**  trans-70.956.4158.9-87-4.7000107.2Y68 E72 S73Y68-N70 PolarHBondContact O-N 3.01Å; N70-E72 PolarHBondContact O-N 2.64Å; N70-S73 VanDerWaalsContact CG-OG 3.27Å; N70-S73 PolarHBondContact OD1-OG 3.27Å
71N55.9Low71.6Confident128 Ų128118.9 Ų118.968%0.68458%0.576SS**SBendtrans-69.9-16.1176.5-75.24.9000110.4F69F69-N71 WeakPolarHBondContact CD1-OD1 3.33Å; F69-N71 PolarHBondContact O-N 3.1Å
72E59.7Low70.7Confident183 Ų183123 Ų12386%0.85560%0.603SS**  trans-139.525.3-174.3-60.8-162174.400114.6N70 K74N70-E72 PolarHBondContact O-N 2.64Å; E72-K74 PolarHBondContact O-N 2.78Å
73S62.5Low70.3Confident80 Ų80124.3 Ų124.356%0.55961%0.61SS**  trans-72.673.9159.9-54.90000108.1N70 K75N70-S73 VanDerWaalsContact CG-OG 3.27Å; N70-S73 PolarHBondContact OD1-OG 3.27Å; S73-K75 PolarHBondContact O-N 3.08Å
74K73.2Confident69.9Low144 Ų144129 Ų12963%0.62664%0.635SS**  trans-51.9116.2169.1-176.9-174.1-178.6-171.30106.3E72 L76 E80E72-K74 PolarHBondContact O-N 2.78Å; K74-L76 PolarHBondContact O-N 2.93Å; K74-L76 VanDerWaalsContact O-N 3.1Å; K74-E80 WeakPolarHBondContact CE-OE1 3.34Å; K74-E80 IonicContact NZ-OE1 3.89Å; K74-E80 PolarHBondContact NZ-OE1 2.75Å; K74-E80 IonicContact NZ-OE2 2.75Å
75K76.8Confident69.9Low194 Ų194132.3 Ų132.384%0.84365%0.646SS**  trans-62.9115.4167.3-79.7-172.1176-175.80106.4S73 T77S73-K75 PolarHBondContact O-N 3.08Å; K75-T77 PolarHBondContact O-N 3.33Å
76L81.2Confident70.1Confident118 Ų118132.9 Ų132.962%0.61865%0.65SS**  trans-59.5135.4173.4-68.2171.6000108.6K74 E80 V81K74-L76 PolarHBondContact O-N 2.93Å; K74-L76 VanDerWaalsContact O-N 3.1Å; L76-E80 WeakPolarHBondContact CA-OE2 3.37Å; L76-E80 HydrophobicContact CD2-CB 4.11Å; L76-V81 HydrophobicContact CB-CG2 4.11Å; L76-V81 HydrophobicContact CD1-CG2 4.5Å
77T84.9Confident70.5Confident72 Ų72134.6 Ų134.644%0.44267%0.666SS.*  trans-80.9153.7171.453.60000109.4K75 T79 E80K75-T77 PolarHBondContact O-N 3.33Å; T77-T79 PolarHBondContact O-N 3.06Å; T77-T79 PolarHBondContact OG1-OG1 3.34Å; T77-T79 VanDerWaalsContact OG1-OG1 3.09Å; T77-E80 PolarHBondContact N-OE2 2.81Å; T77-E80 PolarHBondContact O-N 3.3Å; T77-E80 WeakPolarHBondContact OG1-CG 3.43Å; T77-E80 PolarHBondContact OG1-OE2 3.49Å
78Q87.1Confident71.1Confident162 Ų162132.3 Ų132.376%0.75766%0.661SS**Hα-helixtrans-56.2-29-178.5-170.8175.42.400112.4E80 V81 I82Q78-E80 VanDerWaalsContact C-N 3.31Å; Q78-E80 PolarHBondContact O-N 3.46Å; Q78-V81 PolarHBondContact O-N 3.09Å; Q78-I82 HydrophobicContact CG-CD1 4.3Å
79T89.8Confident71.8Confident112 Ų112130.6 Ų130.669%0.68767%0.665SS**Hα-helixtrans-71.2-17.9175.5470000114.7T77T77-T79 PolarHBondContact O-N 3.06Å; T77-T79 PolarHBondContact OG1-OG1 3.34Å; T77-T79 VanDerWaalsContact OG1-OG1 3.09Å
80E84.7Confident73.3Confident81 Ų81129.2 Ų129.238%0.37967%0.666SS.*Hα-helixtrans-91.8-15175.3-67.6169.2129.900112.3K74 L76 T77 Q78K74-E80 WeakPolarHBondContact CE-OE1 3.34Å; K74-E80 IonicContact NZ-OE1 3.89Å; K74-E80 PolarHBondContact NZ-OE1 2.75Å; K74-E80 IonicContact NZ-OE2 2.75Å; L76-E80 WeakPolarHBondContact CA-OE2 3.37Å; L76-E80 HydrophobicContact CD2-CB 4.11Å; T77-E80 PolarHBondContact N-OE2 2.81Å; T77-E80 PolarHBondContact O-N 3.3Å; T77-E80 WeakPolarHBondContact OG1-CG 3.43Å; T77-E80 PolarHBondContact OG1-OE2 3.49Å; Q78-E80 VanDerWaalsContact C-N 3.31Å; Q78-E80 PolarHBondContact O-N 3.46Å
81V77.3Confident74.8Confident105 Ų105130.1 Ų130.164%0.63667%0.668SS**Hα-helixtrans-90.6-18.5-178.3-1800000111.8L76 Q78L76-V81 HydrophobicContact CB-CG2 4.11Å; L76-V81 HydrophobicContact CD1-CG2 4.5Å; Q78-V81 PolarHBondContact O-N 3.09Å
82I64.5Low76.5Confident182 Ų182130.3 Ų130.393%0.93367%0.667SS**  trans-100.20178.6-57.8170.5000108.9Q78Q78-I82 HydrophobicContact CG-CD1 4.3Å

Retrieved 82 of 82 residues in 53 ms (Link to these results)