A0A4W5LNN8_9TELE Loading...

Alpha-endosulfine

Protein phosphatase inhibitor that specifically inhibits protein phosphatase 2A (PP2A) during mitosis.

AlphaFold DB , UniProt , Accession A0A4W5LNN8, Species 9TELE (Hucho hucho, huchen), Gene n/a, Length 115 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 low47.2Very low244 Ų244144.5 Ų144.5100%1.20282%0.817SS**  096.50-70.8165.282.400106.7
2S47Very low46.7Very low122 Ų122146.7 Ų146.785%0.85382%0.815SS**  trans-75124.4175.2-48.80000108
3S53.6Low46.4Very low112 Ų112150.2 Ų150.278%0.78381%0.811SS**  trans-110.6102.7161.337.10000106.7N5S3-N5 PolarHBondContact O-N 3.48Å
4E51.8Low45.9Very low168 Ų168150.7 Ų150.779%0.78581%0.805SS**  trans-62.1116.8168.6-63.4172.9166.900107.6L6E4-L6 PolarHBondContact O-N 3.41Å
5N49Very low45.8Very low163 Ų163148.1 Ų148.187%0.87279%0.791SS**  trans-82.7113.7162.5-85.2-35.7000107.6S3S3-N5 PolarHBondContact O-N 3.48Å
6L47.3Very low45.8Very low149 Ų149150.4 Ų150.478%0.7880%0.796SS**  trans-56.3137.3178-126.762.7000110.6E4 D8E4-L6 PolarHBondContact O-N 3.41Å; L6-D8 PolarHBondContact O-N 2.98Å
7S41.2Very low45.7Very low99 Ų99152.2 Ų152.269%0.69280%0.795SS**  trans-38.8116.2170.850.10000114.8T9S7-T9 PolarHBondContact O-N 3.4Å
8D46.1Very low45.6Very low163 Ų163151.7 Ų151.787%0.87279%0.788SS**  trans-71100.1155-81.4-39.1000108.3L6L6-D8 PolarHBondContact O-N 2.98Å
9T53.2Low45.5Very low113 Ų113149.3 Ų149.369%0.69378%0.777SS**  trans-67.2126.9163.3150000108.9S7 M11S7-T9 PolarHBondContact O-N 3.4Å; T9-M11 PolarHBondContact O-N 3.35Å; T9-M11 VanDerWaalsContact O-N 3.11Å
10P42.3Very low45.9Very low120 Ų120145.6 Ų145.678%0.77976%0.764SS**  trans-71.7107.7165.629-28.4000107.3E12P10-E12 VanDerWaalsContact C-N 3.33Å; P10-E12 PolarHBondContact O-N 3.15Å
11M42.6Very low46.1Very low137 Ų137145.5 Ų145.568%0.67576%0.759SS**  trans-66.998.4164.5-85.3-110.3-91.700107.8T9 Y13T9-M11 PolarHBondContact O-N 3.35Å; T9-M11 VanDerWaalsContact O-N 3.11Å; M11-Y13 HydrophobicContact CB-CD2 4.3Å; M11-Y13 HydrophobicContact CB-CE2 4.1Å; M11-Y13 HydrophobicContact CE-CE2 3.86Å; M11-Y13 WeakPolarHBondContact CE-OH 3.48Å; M11-Y13 PolarHBondContact O-N 3.28Å; M11-Y13 VanDerWaalsContact O-N 3.13Å; M11-Y13 HydrophobicContact SD-CE2 4.34Å
12E40.5Very low46.4Very low170 Ų170140.5 Ų140.579%0.79473%0.733SS**  trans-50.6110.6158.3-82.6-178148.300108.9P10P10-E12 VanDerWaalsContact C-N 3.33Å; P10-E12 PolarHBondContact O-N 3.15Å
13Y42.8Very low46.7Very low193 Ų193141.1 Ų141.176%0.75772%0.72SS**  trans-111.864.8153.6-76.2-81.5000107.1M11M11-Y13 HydrophobicContact CB-CD2 4.3Å; M11-Y13 HydrophobicContact CB-CE2 4.1Å; M11-Y13 HydrophobicContact CE-CE2 3.86Å; M11-Y13 WeakPolarHBondContact CE-OH 3.48Å; M11-Y13 PolarHBondContact O-N 3.28Å; M11-Y13 VanDerWaalsContact O-N 3.13Å; M11-Y13 HydrophobicContact SD-CE2 4.34Å
14E39.3Very low46.8Very low157 Ų157140.2 Ų140.273%0.73471%0.707SS**  trans-94123.3165.9-74.3-64.4160.900108.7
15D44.9Very low47.2Very low112 Ų112134.1 Ų134.160%0.59969%0.685SS**  trans78.166.6136.4-129.13.9000120.8
16E45.8Very low47.8Very low185 Ų185131.7 Ų131.786%0.86467%0.672SS**SBendtrans-13522.1159-83-143168.900114.4
17K45Very low48.8Very low180 Ų180129.8 Ų129.878%0.78366%0.662SS**SBendtrans-118.9-3-179-77.2-73.3-170.5-171.70115.5
18Q43.1Very low50.1Low143 Ų143128.6 Ų128.667%0.66865%0.651SS**SBendtrans-92.1-36.4178.6-75.4-170.2-33.900113.8S20 Q21Q18-S20 PolarHBondContact O-N 3.22Å; Q18-Q21 PolarHBondContact O-N 3.09Å
19D44.7Very low51.4Low107 Ų107127 Ų12757%0.57264%0.636SS**Hα-helixtrans-76.9-25.6-172.2-157.340.1000114.1K23D19-K23 IonicContact OD2-NZ 3.9Å
20S52.7Low52.4Low74 Ų74123.1 Ų123.152%0.51762%0.619SS.*Hα-helixtrans-70.9-32.2170.6-760000111.9Q18 N24Q18-S20 PolarHBondContact O-N 3.22Å; S20-N24 VanDerWaalsContact O-CB 3.28Å; S20-N24 WeakPolarHBondContact O-CB 3.44Å; S20-N24 VanDerWaalsContact O-CG 3.3Å; S20-N24 PolarHBondContact O-N 3.11Å; S20-N24 PolarHBondContact O-ND2 3.4Å
21Q50Low53.9Low144 Ų144123.5 Ų123.567%0.67361%0.61SS**Hα-helixtrans-71.8-35.9-175-167.9170.5-19.400111.7Q18 A25Q18-Q21 PolarHBondContact O-N 3.09Å; Q21-A25 WeakPolarHBondContact O-CB 3.43Å; Q21-A25 PolarHBondContact O-N 3.32Å
22E51.6Low55.3Low139 Ų139122.9 Ų122.965%0.6561%0.605SS**Hα-helixtrans-71.9-40.5175.4-74.9-164158.600113.5A25 N26E22-A25 PolarHBondContact O-N 2.9Å; E22-N26 PolarHBondContact O-N 3.45Å
23K54.3Low57.1Low135 Ų135119.6 Ų119.659%0.58760%0.597SS**Hα-helixtrans-63.1-43.8172.8-82177.3-177.5156.60111.7D19 N26 L27D19-K23 IonicContact OD2-NZ 3.9Å; K23-N26 PolarHBondContact O-N 2.66Å; K23-L27 WeakPolarHBondContact O-CD1 3.37Å; K23-L27 PolarHBondContact O-N 2.7Å
24N55.8Low59.1Low93 Ų93117.2 Ų117.250%0.49759%0.59SS.*Hα-helixtrans-65.9-39.2175.4-76.1-60.6000111.7S20 N26 L27 V28S20-N24 VanDerWaalsContact O-CB 3.28Å; S20-N24 WeakPolarHBondContact O-CB 3.44Å; S20-N24 VanDerWaalsContact O-CG 3.3Å; S20-N24 PolarHBondContact O-N 3.11Å; S20-N24 PolarHBondContact O-ND2 3.4Å; N24-N26 VanDerWaalsContact C-N 3.29Å; N24-N26 PolarHBondContact O-N 2.65Å; N24-L27 PolarHBondContact O-N 2.88Å; N24-V28 WeakPolarHBondContact O-CB 3.47Å; N24-V28 WeakPolarHBondContact O-CG2 3.27Å; N24-V28 PolarHBondContact O-N 2.99Å
25A58.4Low61Low40 Ų40113.9 Ų113.933%0.33158%0.577SS.*Hα-helixtrans-62.7-35.8174.800000112.4Q21 E22 K29Q21-A25 WeakPolarHBondContact O-CB 3.43Å; Q21-A25 PolarHBondContact O-N 3.32Å; E22-A25 PolarHBondContact O-N 2.9Å; A25-K29 WeakPolarHBondContact O-CB 3.33Å; A25-K29 WeakPolarHBondContact O-CD 3.44Å; A25-K29 WeakPolarHBondContact O-CG 3.33Å; A25-K29 PolarHBondContact O-N 2.98Å
26N62.9Low62.7Low113 Ų113113.7 Ų113.760%0.60457%0.571SS**Hα-helixtrans-68.2-42.1174-106.9-67.7000112.6E22 K23 N24 K29 G30E22-N26 PolarHBondContact O-N 3.45Å; K23-N26 PolarHBondContact O-N 2.66Å; N24-N26 VanDerWaalsContact C-N 3.29Å; N24-N26 PolarHBondContact O-N 2.65Å; N26-K29 PolarHBondContact O-N 3.25Å; N26-G30 PolarHBondContact O-N 3.42Å
27L68.4Low64.4Low108 Ų108108.7 Ų108.757%0.56556%0.562SS**Hα-helixtrans-62-46.6174.2-97.175.9000111.7K23 N24 K29 G30 E31K23-L27 WeakPolarHBondContact O-CD1 3.37Å; K23-L27 PolarHBondContact O-N 2.7Å; N24-L27 PolarHBondContact O-N 2.88Å; L27-K29 PolarHBondContact O-N 2.98Å; L27-G30 PolarHBondContact O-N 3.39Å; L27-G30 VanDerWaalsContact O-N 3.12Å; L27-E31 PolarHBondContact O-N 2.63Å
28V68.8Low66.4Low75 Ų75107.5 Ų107.546%0.45556%0.557SS.*Hα-helixtrans-59.1-46.1178.41710000110.8N24 G30 E31 E32N24-V28 WeakPolarHBondContact O-CB 3.47Å; N24-V28 WeakPolarHBondContact O-CG2 3.27Å; N24-V28 PolarHBondContact O-N 2.99Å; V28-G30 VanDerWaalsContact C-N 3.32Å; V28-G30 PolarHBondContact O-N 3.24Å; V28-E31 PolarHBondContact O-N 2.81Å; V28-E32 WeakPolarHBondContact O-CG 3.35Å; V28-E32 PolarHBondContact O-N 3.28Å
29K71.7Confident68.2Low129 Ų129107.2 Ų107.256%0.56155%0.55SS**Hα-helixtrans-60.5-40.8175.3-72.8169.8-174.1177.80112.1A25 N26 L27 E32 V33A25-K29 WeakPolarHBondContact O-CB 3.33Å; A25-K29 WeakPolarHBondContact O-CD 3.44Å; A25-K29 WeakPolarHBondContact O-CG 3.33Å; A25-K29 PolarHBondContact O-N 2.98Å; N26-K29 PolarHBondContact O-N 3.25Å; L27-K29 PolarHBondContact O-N 2.98Å; K29-E32 PolarHBondContact O-N 3.08Å; K29-V33 WeakPolarHBondContact O-CG2 3.27Å; K29-V33 PolarHBondContact O-N 2.94Å; K29-V33 VanDerWaalsContact O-N 3.12Å
30G73.9Confident69.8Low32 Ų32107.8 Ų107.833%0.3356%0.56SS.*Hα-helixtrans-65.9-37.8177.700000113.3N26 L27 V28 K34N26-G30 PolarHBondContact O-N 3.42Å; L27-G30 PolarHBondContact O-N 3.39Å; L27-G30 VanDerWaalsContact O-N 3.12Å; V28-G30 VanDerWaalsContact C-N 3.32Å; V28-G30 PolarHBondContact O-N 3.24Å; G30-K34 WeakPolarHBondContact O-CG 3.38Å; G30-K34 PolarHBondContact O-N 2.97Å
31E75.8Confident70.7Confident127 Ų127106.1 Ų106.159%0.59356%0.555SS**Hα-helixtrans-69.3-41.2174.8-71.6-175.717500111.9L27 V28 V33 K34 L35L27-E31 PolarHBondContact O-N 2.63Å; V28-E31 PolarHBondContact O-N 2.81Å; E31-V33 VanDerWaalsContact C-N 3.31Å; E31-V33 PolarHBondContact O-N 3.03Å; E31-K34 PolarHBondContact O-N 3.13Å; E31-L35 WeakPolarHBondContact O-CB 3.35Å; E31-L35 PolarHBondContact O-N 2.9Å
32E71.8Confident71.7Confident124 Ų124103 Ų10358%0.57954%0.542SS*.Hα-helixtrans-60.1-38.8175.3-74.8-175.1164.900112.5V28 K29 L35 K36V28-E32 WeakPolarHBondContact O-CG 3.35Å; V28-E32 PolarHBondContact O-N 3.28Å; K29-E32 PolarHBondContact O-N 3.08Å; E32-L35 PolarHBondContact O-N 3.1Å; E32-K36 VanDerWaalsContact O-CB 3.27Å; E32-K36 WeakPolarHBondContact O-CB 3.34Å; E32-K36 PolarHBondContact O-N 2.92Å
33V78.2Confident72.3Confident102 Ų10299.2 Ų99.262%0.61854%0.54SS*.Hα-helixtrans-65.2-45.5175.91720000111.2K29 E31 L35 K36 A37K29-V33 WeakPolarHBondContact O-CG2 3.27Å; K29-V33 PolarHBondContact O-N 2.94Å; K29-V33 VanDerWaalsContact O-N 3.12Å; E31-V33 VanDerWaalsContact C-N 3.31Å; E31-V33 PolarHBondContact O-N 3.03Å; V33-L35 VanDerWaalsContact C-N 3.3Å; V33-L35 PolarHBondContact O-N 3.35Å; V33-K36 PolarHBondContact O-N 3.37Å; V33-A37 WeakPolarHBondContact O-CB 3.19Å; V33-A37 PolarHBondContact O-N 3.09Å
34K83.7Confident73Confident142 Ų142100.6 Ų100.662%0.61755%0.549SS*.Hα-helixtrans-62.9-39.2175.9-69.3171.2-175173.10111.2G30 E31 A37 K38G30-K34 WeakPolarHBondContact O-CG 3.38Å; G30-K34 PolarHBondContact O-N 2.97Å; E31-K34 PolarHBondContact O-N 3.13Å; K34-A37 PolarHBondContact O-N 2.81Å; K34-K38 WeakPolarHBondContact O-CB 3.27Å; K34-K38 VanDerWaalsContact O-CG 3.27Å; K34-K38 WeakPolarHBondContact O-CG 3.42Å; K34-K38 PolarHBondContact O-N 3.3Å
35L79.7Confident73.5Confident88 Ų88103 Ų10346%0.46156%0.555SS.*Hα-helixtrans-65.8-42.8177-151.885.9000111.1E31 E32 V33 K38 Y39 L42E31-L35 WeakPolarHBondContact O-CB 3.35Å; E31-L35 PolarHBondContact O-N 2.9Å; E32-L35 PolarHBondContact O-N 3.1Å; V33-L35 VanDerWaalsContact C-N 3.3Å; V33-L35 PolarHBondContact O-N 3.35Å; L35-K38 PolarHBondContact O-N 2.87Å; L35-Y39 HydrophobicContact CG-CD2 4.29Å; L35-Y39 WeakPolarHBondContact O-CD2 3.5Å; L35-Y39 PolarHBondContact O-N 3.5Å; L35-L42 HydrophobicContact CD2-CD2 3.42Å; L35-L42 VanDerWaalsContact CD2-CD2 3.42Å; L35-L42 HydrophobicContact CG-CD2 3.81Å
36K80.3Confident73.7Confident107 Ų107107.8 Ų107.847%0.46558%0.583SS.*Hα-helixtrans-66.9-38.1176.9-174.764.8175.2-124.50112.5E32 V33 Y39E32-K36 VanDerWaalsContact O-CB 3.27Å; E32-K36 WeakPolarHBondContact O-CB 3.34Å; E32-K36 PolarHBondContact O-N 2.92Å; V33-K36 PolarHBondContact O-N 3.37Å; K36-Y39 CarbonylContact O-C 3.24Å; K36-Y39 VanDerWaalsContact O-C 3.24Å; K36-Y39 PolarHBondContact O-N 2.92Å
37A81.1Confident74Confident81 Ų81104.4 Ų104.467%0.66957%0.574SS**Hα-helixtrans-66.5-38175.100000111.9V33 K34V33-A37 WeakPolarHBondContact O-CB 3.19Å; V33-A37 PolarHBondContact O-N 3.09Å; K34-A37 PolarHBondContact O-N 2.81Å
38K88.4Confident74.4Confident155 Ų155101.6 Ų101.667%0.67457%0.571SS**Hα-helixtrans-71.6-32.3175.3-73.5177.7-179.8-172.10113K34 L35K34-K38 WeakPolarHBondContact O-CB 3.27Å; K34-K38 VanDerWaalsContact O-CG 3.27Å; K34-K38 WeakPolarHBondContact O-CG 3.42Å; K34-K38 PolarHBondContact O-N 3.3Å; L35-K38 PolarHBondContact O-N 2.87Å
39Y81Confident74.7Confident136 Ų136101.5 Ų101.553%0.53357%0.574SS.*SBendtrans-128.478.4-175.4-56.6-70.9000111.2L35 K36 G41 L42L35-Y39 HydrophobicContact CG-CD2 4.29Å; L35-Y39 WeakPolarHBondContact O-CD2 3.5Å; L35-Y39 PolarHBondContact O-N 3.5Å; K36-Y39 CarbonylContact O-C 3.24Å; K36-Y39 VanDerWaalsContact O-C 3.24Å; K36-Y39 PolarHBondContact O-N 2.92Å; Y39-G41 PolarHBondContact O-N 2.84Å; Y39-L42 HydrophobicContact CD2-CD2 4.06Å; Y39-L42 HydrophobicContact CG-CD2 4.36Å; Y39-L42 WeakPolarHBondContact O-CB 3.44Å; Y39-L42 PolarHBondContact O-N 3.44Å; Y39-L42 VanDerWaalsContact O-N 3.08Å
40P77.1Confident75.2Confident119 Ų119101.1 Ų101.177%0.77358%0.578SS**THydrogen-bonded Turntrans-61.7107.5173.923.9-31000109.5
41G72.5Confident75.7Confident40 Ų40106.5 Ų106.541%0.41259%0.592SS.*THydrogen-bonded Turntrans119-7.6-176.900000115.4Y39 G43 Q44Y39-G41 PolarHBondContact O-N 2.84Å; G41-G43 PolarHBondContact O-N 3.22Å; G41-G43 VanDerWaalsContact O-N 3.09Å; G41-Q44 PolarHBondContact O-N 3.25Å
42L70.3Confident76Confident78 Ų78104.9 Ų104.941%0.40859%0.587SS.*THydrogen-bonded Turntrans-60.4-26.5-175.5-168.660.9000114.6L35 Y39L35-L42 HydrophobicContact CD2-CD2 3.42Å; L35-L42 VanDerWaalsContact CD2-CD2 3.42Å; L35-L42 HydrophobicContact CG-CD2 3.81Å; Y39-L42 HydrophobicContact CD2-CD2 4.06Å; Y39-L42 HydrophobicContact CG-CD2 4.36Å; Y39-L42 WeakPolarHBondContact O-CB 3.44Å; Y39-L42 PolarHBondContact O-N 3.44Å; Y39-L42 VanDerWaalsContact O-N 3.08Å
43G65.3Low76.7Confident59 Ų59102.9 Ų102.961%0.60858%0.579SS**THydrogen-bonded Turntrans-96.2-5.4175.200000114.9G41 K45G41-G43 PolarHBondContact O-N 3.22Å; G41-G43 VanDerWaalsContact O-N 3.09Å; G43-K45 VanDerWaalsContact C-N 3.28Å; G43-K45 PolarHBondContact O-N 3.02Å
44Q68.1Low77.1Confident164 Ų164105 Ų10577%0.76658%0.58SS**  trans-96.958.7172.6-67-152.3-8.600109.3G41 P46G41-Q44 PolarHBondContact O-N 3.25Å; Q44-P46 WeakPolarHBondContact O-CD 3.46Å
45K65.8Low77Confident145 Ų145106.7 Ų106.763%0.6358%0.583SS**  trans-78.7117.8163.6-68-166.8176.31800106.8G43 G47 G48G43-K45 VanDerWaalsContact C-N 3.28Å; G43-K45 PolarHBondContact O-N 3.02Å; K45-G47 PolarHBondContact O-N 2.87Å; K45-G48 PolarHBondContact O-N 2.98Å
46P62.5Low77.2Confident140 Ų140107.2 Ų107.291%0.90959%0.585SS**THydrogen-bonded Turntrans-58108.716723.6-29.9000107Q44Q44-P46 WeakPolarHBondContact O-CD 3.46Å
47G69.4Low77.4Confident42 Ų42109.7 Ų109.743%0.43360%0.599SS.*THydrogen-bonded Turntrans110.5-3.6-174.500000116.9K45 D50 F51K45-G47 PolarHBondContact O-N 2.87Å; G47-D50 PolarHBondContact O-N 3.12Å; G47-F51 WeakPolarHBondContact O-CB 3.18Å; G47-F51 PolarHBondContact O-N 3.36Å
48G76.9Confident77.3Confident48 Ų48113.4 Ų113.450%0.49560%0.6SS.*THydrogen-bonded Turntrans33.3-142.6163.700000117.5K45 D50K45-G48 PolarHBondContact O-N 2.98Å; G48-D50 VanDerWaalsContact C-N 3.29Å
49S76.3Confident76.8Confident74 Ų74108 Ų10852%0.51759%0.587SS.*THydrogen-bonded Turntrans-78.3-15.9164.752.60000111.8F51 L52 M53S49-F51 VanDerWaalsContact C-N 3.34Å; S49-F51 PolarHBondContact O-N 3.44Å; S49-L52 CarbonylContact O-C 3.57Å; S49-L52 WeakPolarHBondContact O-CA 3.46Å; S49-L52 WeakPolarHBondContact O-CB 3.44Å; S49-L52 PolarHBondContact O-N 2.93Å; S49-M53 VanDerWaalsContact O-CG 3.3Å; S49-M53 WeakPolarHBondContact O-CG 3.48Å; S49-M53 PolarHBondContact O-N 2.84Å
50D81.4Confident76.7Confident120 Ų120108.7 Ų108.764%0.64260%0.595SS**Hα-helixtrans-60.1-39.4-177-68.5-29.5000113.2G47 G48 L52 M53 K54G47-D50 PolarHBondContact O-N 3.12Å; G48-D50 VanDerWaalsContact C-N 3.29Å; D50-L52 VanDerWaalsContact C-N 3.34Å; D50-M53 PolarHBondContact O-N 3.38Å; D50-K54 WeakPolarHBondContact O-CB 3.15Å; D50-K54 PolarHBondContact O-N 3.34Å
51F84.6Confident76.7Confident145 Ų145111.3 Ų111.364%0.63660%0.595SS**Hα-helixtrans-63.4-43174.9179-98.7000111.5G47 S49 K54 R55G47-F51 WeakPolarHBondContact O-CB 3.18Å; G47-F51 PolarHBondContact O-N 3.36Å; S49-F51 VanDerWaalsContact C-N 3.34Å; S49-F51 PolarHBondContact O-N 3.44Å; F51-K54 PolarHBondContact O-N 2.99Å; F51-R55 WeakPolarHBondContact O-CB 3.24Å; F51-R55 PolarHBondContact O-N 3.48Å
52L82.7Confident76.9Confident93 Ų93119 Ų11949%0.48761%0.613SS.*Hα-helixtrans-66.9-45.2177.8-17861.9000110.8S49 D50 K54 R55 L56S49-L52 CarbonylContact O-C 3.57Å; S49-L52 WeakPolarHBondContact O-CA 3.46Å; S49-L52 WeakPolarHBondContact O-CB 3.44Å; S49-L52 PolarHBondContact O-N 2.93Å; D50-L52 VanDerWaalsContact C-N 3.34Å; L52-K54 PolarHBondContact O-N 3.47Å; L52-R55 PolarHBondContact O-N 3Å; L52-R55 VanDerWaalsContact O-N 3.14Å; L52-L56 HydrophobicContact CD1-CD1 4.27Å; L52-L56 HydrophobicContact CD1-CG 4.29Å; L52-L56 HydrophobicContact CG-CD1 3.97Å; L52-L56 HydrophobicContact CG-CG 4.41Å; L52-L56 WeakPolarHBondContact O-CB 3.3Å; L52-L56 VanDerWaalsContact O-CG 3.3Å; L52-L56 WeakPolarHBondContact O-CG 3.3Å; L52-L56 PolarHBondContact O-N 3.14Å
53M85.9Confident77.1Confident83 Ų83120 Ų12041%0.40961%0.614SS.*Hα-helixtrans-60.5-44.5176.1-68.2-56.7121.600111.2S49 D50 R55 L56 Q57S49-M53 VanDerWaalsContact O-CG 3.3Å; S49-M53 WeakPolarHBondContact O-CG 3.48Å; S49-M53 PolarHBondContact O-N 2.84Å; D50-M53 PolarHBondContact O-N 3.38Å; M53-R55 VanDerWaalsContact C-N 3.27Å; M53-R55 PolarHBondContact O-N 3.46Å; M53-L56 HydrophobicContact CE-CD1 4.05Å; M53-L56 PolarHBondContact O-N 3.5Å; M53-Q57 VanDerWaalsContact O-CB 3.24Å; M53-Q57 WeakPolarHBondContact O-CB 3.49Å; M53-Q57 WeakPolarHBondContact O-CG 3.47Å; M53-Q57 PolarHBondContact O-N 2.78Å
54K85.8Confident77.7Confident147 Ų147122.2 Ų122.264%0.63961%0.612SS**Hα-helixtrans-64.5-31.5176.4-169.9157.7-178.6160.30112.6D50 F51 L52 K58D50-K54 WeakPolarHBondContact O-CB 3.15Å; D50-K54 PolarHBondContact O-N 3.34Å; F51-K54 PolarHBondContact O-N 2.99Å; L52-K54 PolarHBondContact O-N 3.47Å; K54-K58 WeakPolarHBondContact O-CB 3.21Å; K54-K58 PolarHBondContact O-N 2.85Å
55R82.8Confident78Confident177 Ų177119.3 Ų119.367%0.66861%0.61SS**Hα-helixtrans-74.9-40.6174.6-172171.1179.7106.70.3112.3F51 L52 M53 K58F51-R55 WeakPolarHBondContact O-CB 3.24Å; F51-R55 PolarHBondContact O-N 3.48Å; L52-R55 PolarHBondContact O-N 3Å; L52-R55 VanDerWaalsContact O-N 3.14Å; M53-R55 VanDerWaalsContact C-N 3.27Å; M53-R55 PolarHBondContact O-N 3.46Å; R55-K58 PolarHBondContact O-N 3.2Å
56L84.2Confident78.6Confident98 Ų98114.4 Ų114.451%0.51360%0.601SS.*Hα-helixtrans-69.2-41.2176.8-69172000111.6L52 M53 K58 G59L52-L56 HydrophobicContact CD1-CD1 4.27Å; L52-L56 HydrophobicContact CD1-CG 4.29Å; L52-L56 HydrophobicContact CG-CD1 3.97Å; L52-L56 HydrophobicContact CG-CG 4.41Å; L52-L56 WeakPolarHBondContact O-CB 3.3Å; L52-L56 VanDerWaalsContact O-CG 3.3Å; L52-L56 WeakPolarHBondContact O-CG 3.3Å; L52-L56 PolarHBondContact O-N 3.14Å; M53-L56 HydrophobicContact CE-CD1 4.05Å; M53-L56 PolarHBondContact O-N 3.5Å; L56-K58 VanDerWaalsContact C-N 3.27Å; L56-K58 PolarHBondContact O-N 3.37Å; L56-G59 PolarHBondContact O-N 3.41Å
57Q84.1Confident79.3Confident160 Ų160111.2 Ų111.275%0.74858%0.576SS**Hα-helixtrans-62.7-32.7175-75.4170.72.500112.6M53 G59M53-Q57 VanDerWaalsContact O-CB 3.24Å; M53-Q57 WeakPolarHBondContact O-CB 3.49Å; M53-Q57 WeakPolarHBondContact O-CG 3.47Å; M53-Q57 PolarHBondContact O-N 2.78Å; Q57-G59 PolarHBondContact O-N 3.06Å
58K78.1Confident80Confident159 Ų159117 Ų11769%0.69159%0.586SS**THydrogen-bonded Turntrans-69.9-5.4175.4-128.3165.7-179.9175.80113.2K54 R55 L56K54-K58 WeakPolarHBondContact O-CB 3.21Å; K54-K58 PolarHBondContact O-N 2.85Å; R55-K58 PolarHBondContact O-N 3.2Å; L56-K58 VanDerWaalsContact C-N 3.27Å; L56-K58 PolarHBondContact O-N 3.37Å
59G79.1Confident80Confident40 Ų40120 Ų12041%0.41259%0.591SS.*  trans71.9169.2-178.900000113L56 Q57 K61L56-G59 PolarHBondContact O-N 3.41Å; Q57-G59 PolarHBondContact O-N 3.06Å; G59-K61 PolarHBondContact O-N 3.44Å; G59-K61 VanDerWaalsContact O-N 3.11Å
60Q78.3Confident79.8Confident151 Ų151123.1 Ų123.171%0.70660%0.598SS**  trans-69.6106.3166.8-68.8-61.9-26.300108.2Y62Q60-Y62 HydrophobicContact CB-CE2 4.38Å; Q60-Y62 PolarHBondContact O-N 3.41Å
61K77.2Confident78.9Confident175 Ų175122 Ų12276%0.76161%0.606SS**  trans-82.298.6169.9-67.5-170.667.867.20107.6G59G59-K61 PolarHBondContact O-N 3.44Å; G59-K61 VanDerWaalsContact O-N 3.11Å
62Y76.6Confident78Confident200 Ų200123.3 Ų123.378%0.78461%0.611SS**PPolyproline II helixtrans-60.8143.7162.6-55.6-75.4000108.4Q60 D64Q60-Y62 HydrophobicContact CB-CE2 4.38Å; Q60-Y62 PolarHBondContact O-N 3.41Å; Y62-D64 PolarHBondContact O-N 3.05Å
63F74.3Confident77.1Confident99 Ų99122.4 Ų122.443%0.43462%0.617SS.*PPolyproline II helixtrans-65117.2168.7-164.8-95.5000107.3S65 D67 Y68F63-S65 PolarHBondContact O-N 3.47Å; F63-D67 HydrophobicContact CD1-CB 4.04Å; F63-D67 HydrophobicContact CD2-CB 3.84Å; F63-D67 HydrophobicContact CE1-CB 3.56Å; F63-D67 HydrophobicContact CE2-CB 3.39Å; F63-D67 HydrophobicContact CG-CB 4.18Å; F63-D67 HydrophobicContact CZ-CB 3.28Å; F63-D67 WeakPolarHBondContact CZ-O 3.2Å; F63-Y68 HydrophobicContact CD1-CD1 4.48Å; F63-Y68 HydrophobicContact CD1-CD2 4.12Å; F63-Y68 HydrophobicContact CD1-CE1 4.12Å; F63-Y68 AromaticContact CD1-CE2 3.7Å; F63-Y68 HydrophobicContact CD1-CE2 3.7Å; F63-Y68 HydrophobicContact CD1-CG 4.46Å; F63-Y68 AromaticContact CD1-CZ 3.7Å; F63-Y68 AromaticContact CE1-CD1 3.47Å; F63-Y68 HydrophobicContact CE1-CD1 3.47Å; F63-Y68 VanDerWaalsContact CE1-CD1 3.47Å; F63-Y68 AromaticContact CE1-CD2 3.34Å; F63-Y68 HydrophobicContact CE1-CD2 3.34Å; F63-Y68 AromaticContact CE1-CE1 3.52Å; F63-Y68 HydrophobicContact CE1-CE1 3.52Å; F63-Y68 AromaticContact CE1-CE2 3.36Å; F63-Y68 HydrophobicContact CE1-CE2 3.36Å; F63-Y68 AromaticContact CE1-CG 3.35Å; F63-Y68 HydrophobicContact CE1-CG 3.35Å; F63-Y68 AromaticContact CE1-CZ 3.45Å; F63-Y68 VanDerWaalsContact CE1-CZ 3.45Å; F63-Y68 VanDerWaalsContact CE1-N 3.28Å; F63-Y68 AromaticContact CZ-CD1 3.57Å; F63-Y68 HydrophobicContact CZ-CD1 3.57Å; F63-Y68 HydrophobicContact CZ-CD2 4.21Å; F63-Y68 AromaticContact CZ-CE1 3.83Å; F63-Y68 HydrophobicContact CZ-CE1 3.83Å; F63-Y68 HydrophobicContact CZ-CE2 4.41Å; F63-Y68 AromaticContact CZ-CG 3.75Å; F63-Y68 HydrophobicContact CZ-CG 3.75Å
64D76.8Confident76.1Confident106 Ų106127 Ų12757%0.56764%0.635SS**PPolyproline II helixtrans-63.1136.1169.2-171.8-2000106.5Y62 G66 D67Y62-D64 PolarHBondContact O-N 3.05Å; D64-G66 PolarHBondContact O-N 2.95Å; D64-D67 PolarHBondContact O-N 3.27Å
65S74.6Confident75Confident103 Ų103128 Ų12872%0.7264%0.644SS**THydrogen-bonded Turntrans-51-16.6-179.759.20000113.8F63F63-S65 PolarHBondContact O-N 3.47Å
66G78.6Confident74.1Confident43 Ų43128.8 Ų128.844%0.44365%0.652SS.*THydrogen-bonded Turntrans-89.6-10.5174.400000117.8D64 Y68D64-G66 PolarHBondContact O-N 2.95Å; G66-Y68 PolarHBondContact O-N 3.4Å
67D78.6Confident72.8Confident72 Ų72131.5 Ų131.539%0.38567%0.667SS.*G310 helixtrans-74.1-8.1-173.9-84.3-14.8000113.7F63 D64 N69 M70F63-D67 HydrophobicContact CD1-CB 4.04Å; F63-D67 HydrophobicContact CD2-CB 3.84Å; F63-D67 HydrophobicContact CE1-CB 3.56Å; F63-D67 HydrophobicContact CE2-CB 3.39Å; F63-D67 HydrophobicContact CG-CB 4.18Å; F63-D67 HydrophobicContact CZ-CB 3.28Å; F63-D67 WeakPolarHBondContact CZ-O 3.2Å; D64-D67 PolarHBondContact O-N 3.27Å; D67-N69 PolarHBondContact O-N 3.01Å; D67-M70 HydrophobicContact CB-CE 4.15Å; D67-M70 PolarHBondContact O-N 3.12Å
68Y82.8Confident71.8Confident165 Ų165133.3 Ų133.365%0.64767%0.673SS**G310 helixtrans-62.4-19.8-177-75-64000113.1F63 G66 M70F63-Y68 HydrophobicContact CD1-CD1 4.48Å; F63-Y68 HydrophobicContact CD1-CD2 4.12Å; F63-Y68 HydrophobicContact CD1-CE1 4.12Å; F63-Y68 AromaticContact CD1-CE2 3.7Å; F63-Y68 HydrophobicContact CD1-CE2 3.7Å; F63-Y68 HydrophobicContact CD1-CG 4.46Å; F63-Y68 AromaticContact CD1-CZ 3.7Å; F63-Y68 AromaticContact CE1-CD1 3.47Å; F63-Y68 HydrophobicContact CE1-CD1 3.47Å; F63-Y68 VanDerWaalsContact CE1-CD1 3.47Å; F63-Y68 AromaticContact CE1-CD2 3.34Å; F63-Y68 HydrophobicContact CE1-CD2 3.34Å; F63-Y68 AromaticContact CE1-CE1 3.52Å; F63-Y68 HydrophobicContact CE1-CE1 3.52Å; F63-Y68 AromaticContact CE1-CE2 3.36Å; F63-Y68 HydrophobicContact CE1-CE2 3.36Å; F63-Y68 AromaticContact CE1-CG 3.35Å; F63-Y68 HydrophobicContact CE1-CG 3.35Å; F63-Y68 AromaticContact CE1-CZ 3.45Å; F63-Y68 VanDerWaalsContact CE1-CZ 3.45Å; F63-Y68 VanDerWaalsContact CE1-N 3.28Å; F63-Y68 AromaticContact CZ-CD1 3.57Å; F63-Y68 HydrophobicContact CZ-CD1 3.57Å; F63-Y68 HydrophobicContact CZ-CD2 4.21Å; F63-Y68 AromaticContact CZ-CE1 3.83Å; F63-Y68 HydrophobicContact CZ-CE1 3.83Å; F63-Y68 HydrophobicContact CZ-CE2 4.41Å; F63-Y68 AromaticContact CZ-CG 3.75Å; F63-Y68 HydrophobicContact CZ-CG 3.75Å; G66-Y68 PolarHBondContact O-N 3.4Å; Y68-M70 VanDerWaalsContact C-N 3.34Å; Y68-M70 PolarHBondContact O-N 2.9Å
69N76.4Confident70.9Confident111 Ų111134.8 Ų134.859%0.59468%0.682SS**G310 helixtrans-80-9.1-173.7-73-30.5000114.7D67 A71 K72 A73D67-N69 PolarHBondContact O-N 3.01Å; N69-A71 VanDerWaalsContact C-N 3.28Å; N69-A71 PolarHBondContact O-N 3.04Å; N69-K72 PolarHBondContact O-N 3.26Å; N69-A73 VanDerWaalsContact O-CB 3.27Å; N69-A73 WeakPolarHBondContact O-CB 3.28Å; N69-A73 PolarHBondContact O-N 3.28Å
70M72.5Confident69.6Low138 Ų138139.5 Ų139.568%0.6870%0.697SS**G310 helixtrans-64.1-32.3174.4-69-172.7-73.400112.8D67 Y68 K72D67-M70 HydrophobicContact CB-CE 4.15Å; D67-M70 PolarHBondContact O-N 3.12Å; Y68-M70 VanDerWaalsContact C-N 3.34Å; Y68-M70 PolarHBondContact O-N 2.9Å; M70-K72 VanDerWaalsContact C-N 3.34Å
71A62.9Low68.6Low96 Ų96137.9 Ų137.979%0.79370%0.7SS**G310 helixtrans-76.8-20.6177.400000113.3N69N69-A71 VanDerWaalsContact C-N 3.28Å; N69-A71 PolarHBondContact O-N 3.04Å
72K65.9Low67.4Low173 Ų173136.3 Ų136.375%0.75271%0.705SS**THydrogen-bonded Turntrans-101-22.5-178.6-68.3-79-175.9170.50112.6N69 M70 K74N69-K72 PolarHBondContact O-N 3.26Å; M70-K72 VanDerWaalsContact C-N 3.34Å; K72-K74 PolarHBondContact O-N 3.45Å
73A63.6Low66.2Low75 Ų75130.7 Ų130.762%0.6270%0.699SS**  trans-74.672.817300000110.7N69 M75N69-A73 VanDerWaalsContact O-CB 3.27Å; N69-A73 WeakPolarHBondContact O-CB 3.28Å; N69-A73 PolarHBondContact O-N 3.28Å; A73-M75 PolarHBondContact O-N 3.38Å
74K64.4Low65.3Low179 Ų179127.9 Ų127.978%0.77870%0.698SS**  trans-54107.3162.6-75.9179.4171.6-178.30109.1K72 K76K72-K74 PolarHBondContact O-N 3.45Å; K74-K76 PolarHBondContact O-N 2.8Å
75M63Low64.2Low167 Ų167129.2 Ų129.282%0.82371%0.713SS**  trans14.581.4143.438.1-156.363.600115.4A73A73-M75 PolarHBondContact O-N 3.38Å
76K64.9Low63.1Low194 Ų194129.9 Ų129.984%0.84371%0.708SS**  trans-1037.4164.3-91.9-172.7176.9-177.80113.7K74 K78K74-K76 PolarHBondContact O-N 2.8Å; K76-K78 PolarHBondContact O-N 3.27Å; K76-K78 VanDerWaalsContact O-N 3.13Å
77N56.6Low62.1Low155 Ų155137.6 Ų137.683%0.82973%0.729SS**  trans-83.390.6164.2-73.6-16.2000109Q79N77-Q79 PolarHBondContact O-N 3.35Å
78K63.3Low61.1Low198 Ų198140.2 Ų140.286%0.86174%0.744SS**  trans-71.264.8173.7-78.2-90.1-171176.30111.4K76K76-K78 PolarHBondContact O-N 3.27Å; K76-K78 VanDerWaalsContact O-N 3.13Å
79Q58.7Low59.9Low190 Ų190139.5 Ų139.589%0.88875%0.75SS**  trans-146.772.8148.1-72-161.972.900107.5N77N77-Q79 PolarHBondContact O-N 3.35Å
80L51.4Low59.3Low139 Ų139139.1 Ų139.173%0.72875%0.751SS**  trans-74.6137153.4-73.2162.4000106.3V82L80-V82 PolarHBondContact O-N 2.84Å
81P57.5Low58.6Low117 Ų117137.4 Ų137.476%0.7675%0.749SS**  trans-54.5132.1162.325.2-31.3000107.2A83P81-A83 VanDerWaalsContact C-N 3.28Å; P81-A83 PolarHBondContact O-N 3.07Å
82V52Low58.7Low143 Ų143136.6 Ų136.687%0.86775%0.75SS**  trans-61.397.8171.8172.70000106.5L80 G84L80-V82 PolarHBondContact O-N 2.84Å; V82-G84 PolarHBondContact O-N 3.2Å
83A52.6Low58.5Low81 Ų81135.9 Ų135.967%0.66975%0.754SS**  trans-65.2127.3158.700000105.7P81P81-A83 VanDerWaalsContact C-N 3.28Å; P81-A83 PolarHBondContact O-N 3.07Å
84G54.8Low59.2Low40 Ų40137.6 Ų137.641%0.41275%0.749SS.*  trans-59.9-168.917400000111.5V82 D86V82-G84 PolarHBondContact O-N 3.2Å; G84-D86 PolarHBondContact O-N 2.97Å
85P52.8Low59.7Low135 Ų135135.7 Ų135.788%0.87775%0.746SS**SBendtrans-70.765.9176.932.7-34.7000110.6
86D51.3Low60.3Low117 Ų117131.1 Ų131.163%0.62673%0.729SS**  trans-105.4105.1-179.4-76.3-33.4000108.4G84 N88G84-D86 PolarHBondContact O-N 2.97Å; D86-N88 PolarHBondContact O-N 3.29Å
87K57.2Low61.1Low204 Ų204124.8 Ų124.889%0.88771%0.707SS**  trans-16.534.3162-42-174.8-169.9-175.40120.1
88N58.7Low62.1Low128 Ų128123.2 Ų123.268%0.68471%0.705SS**  trans-117.761.9-178.9-69.3-70.4000110.1D86 V90D86-N88 PolarHBondContact O-N 3.29Å; N88-V90 PolarHBondContact O-N 3.39Å
89L58.2Low62.9Low150 Ų150122.2 Ų122.279%0.78570%0.703SS**  trans-77.163161-68.1173.2000108.9T91L89-T91 PolarHBondContact O-N 3.35Å
90V62.4Low63.8Low102 Ų102117.8 Ų117.862%0.61869%0.685SS**  trans-89.639.3174.187.40000110.4N88 G92N88-V90 PolarHBondContact O-N 3.39Å; V90-G92 PolarHBondContact O-N 3.17Å
91T57.7Low65Low103 Ų103116 Ų11663%0.63268%0.676SS**SBendtrans-63.9130.4156-52.90000104.5L89 D93 H94L89-T91 PolarHBondContact O-N 3.35Å; T91-D93 PolarHBondContact O-N 2.85Å; T91-H94 PolarHBondContact O-N 2.98Å; T91-H94 VanDerWaalsContact O-N 3.1Å
92G65.1Low66.2Low78 Ų78116.2 Ų116.280%0.80468%0.678SS**THydrogen-bonded Turntrans-55.47.3-166.500000118V90V90-G92 PolarHBondContact O-N 3.17Å
93D62.6Low67.7Low159 Ų159117.5 Ų117.585%0.8567%0.674SS**THydrogen-bonded Turntrans-73.3-26.4166.3-76.9-8.1000113.5T91T91-D93 PolarHBondContact O-N 2.85Å
94H77.2Confident69Low111 Ų111124.5 Ų124.551%0.51468%0.683SS.*SBendtrans-105.6103.5-179.8-164.164.8000111.8T91T91-H94 PolarHBondContact O-N 2.98Å; T91-H94 VanDerWaalsContact O-N 3.1Å
95I76.5Confident70.3Confident139 Ų139133 Ų13371%0.71370%0.703SS**PPolyproline II helixtrans-71.5123.2173.5-58.6180000108.4T97I95-T97 PolarHBondContact O-N 3.11Å
96P75.8Confident71.4Confident70 Ų70131.7 Ų131.746%0.45570%0.697SS.*PPolyproline II helixtrans-57.2126.3178-22.431.8000110.7D100 L101P96-D100 HydrophobicContact CB-CB 4.41Å; P96-L101 HydrophobicContact CB-CD1 3.67Å
97T81.8Confident72.4Confident62 Ų62130.9 Ų130.938%0.3870%0.701SS.*PPolyproline II helixtrans-78.8160.2174.468.90000109.7I95 Q99 D100I95-T97 PolarHBondContact O-N 3.11Å; T97-Q99 PolarHBondContact O-N 3.25Å; T97-D100 WeakPolarHBondContact CB-OD2 3.34Å; T97-D100 PolarHBondContact N-OD2 2.88Å; T97-D100 WeakPolarHBondContact O-CB 3.34Å; T97-D100 PolarHBondContact O-N 3.03Å; T97-D100 PolarHBondContact OG1-OD2 2.8Å
98P77.6Confident73Confident122 Ų122128.6 Ų128.679%0.79270%0.697SS**THydrogen-bonded Turntrans-56.7-21.1178.2-25.634.7000114.2
99Q79.9Confident73.4Confident176 Ų176128.2 Ų128.282%0.82270%0.699SS**THydrogen-bonded Turntrans-75.7-26.3176.6-158.769.19.100112.8T97 L101T97-Q99 PolarHBondContact O-N 3.25Å; Q99-L101 VanDerWaalsContact C-N 3.31Å
100D77.4Confident73.9Confident97 Ų97126.3 Ų126.352%0.51969%0.694SS.*THydrogen-bonded Turntrans-82.4-13.9179.2-55.9-48.1000112.1P96 T97P96-D100 HydrophobicContact CB-CB 4.41Å; T97-D100 WeakPolarHBondContact CB-OD2 3.34Å; T97-D100 PolarHBondContact N-OD2 2.88Å; T97-D100 WeakPolarHBondContact O-CB 3.34Å; T97-D100 PolarHBondContact O-N 3.03Å; T97-D100 PolarHBondContact OG1-OD2 2.8Å
101L76.2Confident74.4Confident103 Ų103126.1 Ų126.154%0.53970%0.697SS.*SBendtrans-87.7138.2177.4-93.167000110.7P96 Q99 Q103P96-L101 HydrophobicContact CB-CD1 3.67Å; Q99-L101 VanDerWaalsContact C-N 3.31Å; L101-Q103 PolarHBondContact O-N 3.23Å
102P83.2Confident75Confident121 Ų121130.7 Ų130.779%0.78671%0.708SS**PPolyproline II helixtrans-59.2127.9173.624.7-32.6000109.8R104P102-R104 PolarHBondContact O-N 3.42Å; P102-R104 VanDerWaalsContact O-N 3.09Å
103Q82.8Confident75Confident170 Ų170134.7 Ų134.779%0.79471%0.71SS**PPolyproline II helixtrans-59.8117-177.6-165.8175.26.800110L101 R105L101-Q103 PolarHBondContact O-N 3.23Å; Q103-R105 PolarHBondContact O-N 2.7Å; Q103-R105 VanDerWaalsContact O-N 3.11Å
104R79.3Confident74.9Confident227 Ų227132 Ų13286%0.85771%0.71SS**PPolyproline II helixtrans-61116179.5-173.2173.3-179.4-98.70.3109.1P102 S106P102-R104 PolarHBondContact O-N 3.42Å; P102-R104 VanDerWaalsContact O-N 3.09Å; R104-S106 PolarHBondContact O-N 3.18Å
105R82Confident73.5Confident219 Ų219134 Ų13483%0.82676%0.761SS**PPolyproline II helixtrans-70124.7173.1-60.7-63.3-166.4174.42.3108.6Q103 S107Q103-R105 PolarHBondContact O-N 2.7Å; Q103-R105 VanDerWaalsContact O-N 3.11Å; R105-S107 PolarHBondContact O-N 3.13Å
106S75.8Confident73.4Confident107 Ų107133.8 Ų133.875%0.74876%0.764SS**PPolyproline II helixtrans-69.9117.116747.80000108R104 L108R104-S106 PolarHBondContact O-N 3.18Å; S106-L108 PolarHBondContact O-N 3.44Å; S106-L108 VanDerWaalsContact O-N 3.15Å
107S73.6Confident73.2Confident101 Ų101137.2 Ų137.271%0.70678%0.78SS**  trans-77.599.417462.30000108.4R105 V109R105-S107 PolarHBondContact O-N 3.13Å; S107-V109 PolarHBondContact O-N 3.11Å
108L69.1Low72.8Confident156 Ų156141.3 Ų141.382%0.81780%0.802SS**  trans-80.666.3167.4-142.5161000107.9S106 T110S106-L108 PolarHBondContact O-N 3.44Å; S106-L108 VanDerWaalsContact O-N 3.15Å; L108-T110 HydrophobicContact CD2-CG2 4Å; L108-T110 PolarHBondContact O-N 2.99Å
109V68Low72.5Confident120 Ų120142.5 Ų142.573%0.72780%0.803SS**  trans-88.997.1174.3177.10000106.6S107 S111S107-V109 PolarHBondContact O-N 3.11Å; V109-S111 PolarHBondContact O-N 3.2Å
110T68.4Low72Confident110 Ų110140.4 Ų140.468%0.67580%0.801SS**  trans-70115.7162.557.10000107.1L108 K112L108-T110 HydrophobicContact CD2-CG2 4Å; L108-T110 PolarHBondContact O-N 2.99Å; T110-K112 PolarHBondContact O-N 3.37Å
111S71.8Confident71.7Confident97 Ų97143.3 Ų143.368%0.67882%0.82SS**  trans-59.9132.4173.350.30000109.7V109 L113V109-S111 PolarHBondContact O-N 3.2Å; S111-L113 PolarHBondContact O-N 3.39Å
112K71.6Confident71.3Confident199 Ų199146.1 Ų146.187%0.86584%0.84SS**  trans-86.232.6171.1-67-175.4173.3-179.70112.1T110 A114T110-K112 PolarHBondContact O-N 3.37Å; K112-A114 PolarHBondContact O-N 3.46Å
113L65.2Low70.4Confident163 Ų163148.1 Ų148.185%0.85384%0.844SS**  trans-102.860.2-179.8-63.3-179000110.3S111S111-L113 PolarHBondContact O-N 3.39Å
114A59.7Low69.4Low102 Ų102146.3 Ų146.384%0.84385%0.849SS**  trans-170.7105158.300000106.1K112K112-A114 PolarHBondContact O-N 3.46Å
115G48.4Very low68.5Low154 Ų154138.9 Ų138.9100%1.58885%0.848SS**  trans178.70-179.500000108.8

Retrieved 115 of 115 residues in 582.7 ms (Link to these results)