A0A077ZLQ1_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZLQ1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 197 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
1M69.6Low81.5Confident182 Ų18296.2 Ų96.290%0.89753%0.532SS*.  00.70-60.5-51.3149.400116.8
2P76.9Confident81.7Confident104 Ų10495.3 Ų95.368%0.67554%0.537SS*.Hα-helixtrans-66.4-38.6173.3-24.334.5000114.9L6P2-L6 WeakPolarHBondContact O-CB 3.49Å; P2-L6 PolarHBondContact O-N 3.2Å; P2-L6 VanDerWaalsContact O-N 3.1Å
3L79.5Confident81.7Confident143 Ų14396.8 Ų96.875%0.74953%0.534SS*.Hα-helixtrans-68.5-40.3-172-90.669.2000113.8L6 G7L3-L6 PolarHBondContact O-N 3.13Å; L3-G7 PolarHBondContact O-N 3.08Å
4V82.1Confident81.6Confident95 Ų9597.7 Ų97.758%0.57656%0.561SS**Hα-helixtrans-64.4-45.6-178.5-179.70000110.7L6 G7 I8V4-L6 VanDerWaalsContact C-N 3.32Å; V4-L6 PolarHBondContact O-N 3.2Å; V4-G7 PolarHBondContact O-N 3.46Å; V4-I8 HydrophobicContact CG1-CD1 4.24Å; V4-I8 WeakPolarHBondContact O-CG1 3.29Å; V4-I8 PolarHBondContact O-N 2.87Å; V4-I8 VanDerWaalsContact O-N 3.09Å
5L83.3Confident81.7Confident105 Ų10599.6 Ų99.655%0.5557%0.568SS.*Hα-helixtrans-64.5-37.6177-68.2175.8000112.1I8 R9L5-I8 PolarHBondContact O-N 3.11Å; L5-R9 WeakPolarHBondContact O-CG 3.23Å; L5-R9 PolarHBondContact O-N 3.45Å; L5-R9 VanDerWaalsContact O-N 3.15Å
6L83Confident81.8Confident59 Ų5998.8 Ų98.831%0.30956%0.561SS.*Hα-helixtrans-63.6-45.6176.2-176.259.7000111.1P2 L3 V4 I8 R9 T10 L29 L31P2-L6 WeakPolarHBondContact O-CB 3.49Å; P2-L6 PolarHBondContact O-N 3.2Å; P2-L6 VanDerWaalsContact O-N 3.1Å; L3-L6 PolarHBondContact O-N 3.13Å; V4-L6 VanDerWaalsContact C-N 3.32Å; V4-L6 PolarHBondContact O-N 3.2Å; L6-I8 VanDerWaalsContact C-N 3.34Å; L6-I8 PolarHBondContact O-N 3.01Å; L6-R9 PolarHBondContact O-N 3.05Å; L6-R9 VanDerWaalsContact O-N 3.07Å; L6-T10 HydrophobicContact CD1-CG2 4.43Å; L6-T10 PolarHBondContact O-N 3.01Å; L6-T10 VanDerWaalsContact O-N 3.07Å; L6-T10 PolarHBondContact O-OG1 3.45Å; L6-L29 HydrophobicContact CD1-CD1 4.21Å; L6-L31 HydrophobicContact CD1-CD2 3.64Å; L6-L31 HydrophobicContact CD2-CD2 3.42Å; L6-L31 VanDerWaalsContact CD2-CD2 3.42Å; L6-L31 HydrophobicContact CG-CD2 3.35Å
7G83.2Confident81.9Confident34 Ų3496.3 Ų96.335%0.35156%0.563SS.*Hα-helixtrans-58.7-41.6175.300000113.1L3 V4 R9 T10 A11L3-G7 PolarHBondContact O-N 3.08Å; V4-G7 PolarHBondContact O-N 3.46Å; G7-R9 VanDerWaalsContact C-N 3.27Å; G7-R9 PolarHBondContact O-N 2.94Å; G7-T10 PolarHBondContact O-N 2.84Å; G7-T10 PolarHBondContact O-OG1 3.43Å; G7-A11 VanDerWaalsContact O-CB 3.26Å; G7-A11 WeakPolarHBondContact O-CB 3.45Å; G7-A11 PolarHBondContact O-N 2.96Å
8I84.6Confident82.1Confident106 Ų10695.8 Ų95.854%0.54456%0.557SS.*Hα-helixtrans-63.7-33.7176-65.7166.4000111.6V4 L5 L6V4-I8 HydrophobicContact CG1-CD1 4.24Å; V4-I8 WeakPolarHBondContact O-CG1 3.29Å; V4-I8 PolarHBondContact O-N 2.87Å; V4-I8 VanDerWaalsContact O-N 3.09Å; L5-I8 PolarHBondContact O-N 3.11Å; L6-I8 VanDerWaalsContact C-N 3.34Å; L6-I8 PolarHBondContact O-N 3.01Å
9R85.3Confident82.4Confident140 Ų14090.8 Ų90.853%0.52853%0.528SS..Hα-helixtrans-76.9-26.7179.4-72.7-179.8-178.6-172.7-0.3113.5L5 L6 G7 P20 A21 L29L5-R9 WeakPolarHBondContact O-CG 3.23Å; L5-R9 PolarHBondContact O-N 3.45Å; L5-R9 VanDerWaalsContact O-N 3.15Å; L6-R9 PolarHBondContact O-N 3.05Å; L6-R9 VanDerWaalsContact O-N 3.07Å; G7-R9 VanDerWaalsContact C-N 3.27Å; G7-R9 PolarHBondContact O-N 2.94Å; R9-P20 WeakPolarHBondContact O-CD 3.49Å; R9-A21 HydrophobicContact CB-CB 4.37Å; R9-A21 VanDerWaalsContact O-CB 3.27Å; R9-A21 WeakPolarHBondContact O-CB 3.26Å; R9-A21 PolarHBondContact O-N 2.84Å; R9-L29 HydrophobicContact CB-CD1 4.43Å
10T84.6Confident82.7Confident34 Ų3489.2 Ų89.221%0.20952%0.52CS..Hα-helixtrans-99.8-14.5179.558.80000114.1L6 G7 S12 A19 L29 L31L6-T10 HydrophobicContact CD1-CG2 4.43Å; L6-T10 PolarHBondContact O-N 3.01Å; L6-T10 VanDerWaalsContact O-N 3.07Å; L6-T10 PolarHBondContact O-OG1 3.45Å; G7-T10 PolarHBondContact O-N 2.84Å; G7-T10 PolarHBondContact O-OG1 3.43Å; T10-S12 PolarHBondContact O-N 3.07Å; T10-A19 WeakPolarHBondContact O-CB 3.36Å; T10-L29 HydrophobicContact CG2-CB 3.76Å; T10-L29 HydrophobicContact CG2-CD1 4.03Å; T10-L29 HydrophobicContact CG2-CG 4.4Å; T10-L31 HydrophobicContact CG2-CD1 4.4Å; T10-L31 HydrophobicContact CG2-CD2 3.72Å; T10-L31 HydrophobicContact CG2-CG 4.19Å
11A84.6Confident83Confident56 Ų5685.1 Ų85.146%0.46350%0.497SS..SBendtrans-63.3121.817600000109.8G7 P20G7-A11 VanDerWaalsContact O-CB 3.26Å; G7-A11 WeakPolarHBondContact O-CB 3.45Å; G7-A11 PolarHBondContact O-N 2.96Å; A11-P20 WeakPolarHBondContact O-CD 3.35Å
12S83.6Confident83.9Confident85 Ų8578.6 Ų78.659%0.59447%0.465SS*.PPolyproline II helixtrans-69.5132.1173.354.20000109.6T10T10-S12 PolarHBondContact O-N 3.07Å
13K81.9Confident84.5Confident115 Ų11579.6 Ų79.650%0.546%0.462SS..PPolyproline II helixtrans-81.2122.3172.3-169.3-175.3-179.3-154.40107.8D15 L16 G17 L18K13-D15 HydrophobicContact CD-CB 4.36Å; K13-D15 HydrophobicContact CG-CB 4.27Å; K13-D15 IonicContact NZ-OD2 3.42Å; K13-D15 PolarHBondContact NZ-OD2 3.02Å; K13-D15 PolarHBondContact O-N 3.37Å; K13-L16 HydrophobicContact CD-CD1 4.15Å; K13-L16 HydrophobicContact CD-CG 4.34Å; K13-L16 PolarHBondContact O-N 3.12Å; K13-G17 PolarHBondContact O-N 2.72Å; K13-L18 PolarHBondContact N-O 2.9Å; K13-L18 VanDerWaalsContact N-O 3.13Å
14A79.7Confident85Confident110 Ų11077.9 Ų77.991%0.90946%0.457SS*.THydrogen-bonded Turntrans-53.9-29.4-176.900000114.3
15D84Confident85.3Confident126 Ų12680.9 Ų80.967%0.67446%0.459SS*.THydrogen-bonded Turntrans-74-32.7179.4-172.835.6000113.5K13K13-D15 HydrophobicContact CD-CB 4.36Å; K13-D15 HydrophobicContact CG-CB 4.27Å; K13-D15 IonicContact NZ-OD2 3.42Å; K13-D15 PolarHBondContact NZ-OD2 3.02Å; K13-D15 PolarHBondContact O-N 3.37Å
16L82.7Confident85.6Confident86 Ų8679.2 Ų79.245%0.4547%0.467SS..THydrogen-bonded Turntrans-105.8-18.3-177-64174.9000113.1K13 L18 M23K13-L16 HydrophobicContact CD-CD1 4.15Å; K13-L16 HydrophobicContact CD-CG 4.34Å; K13-L16 PolarHBondContact O-N 3.12Å; L16-L18 HydrophobicContact CB-CB 4.46Å; L16-L18 PolarHBondContact O-N 3.39Å; L16-M23 HydrophobicContact CD1-CE 4.4Å; L16-M23 HydrophobicContact CD1-SD 3.76Å
17G84.2Confident85.6Confident57 Ų5782 Ų8259%0.58848%0.483SS*.SBendtrans66.6-1.8-170.600000114.6K13K13-G17 PolarHBondContact O-N 2.72Å
18L85.6Confident85.6Confident87 Ų8783.5 Ų83.546%0.45549%0.488SS..SBendtrans-114.6149.8-174.2-72.5150000111.1K13 L16 E22 M23K13-L18 PolarHBondContact N-O 2.9Å; K13-L18 VanDerWaalsContact N-O 3.13Å; L16-L18 HydrophobicContact CB-CB 4.46Å; L16-L18 PolarHBondContact O-N 3.39Å; L18-E22 HydrophobicContact CD2-CB 4.21Å; L18-M23 HydrophobicContact CB-CG 4.44Å
19A87.5Confident85.4Confident2 Ų281.4 Ų81.42%0.01748%0.477CS..  trans-82.6148.6171.900000111.4T10 A21 E22 M23T10-A19 WeakPolarHBondContact O-CB 3.36Å; A19-A21 PolarHBondContact O-N 3.21Å; A19-A21 VanDerWaalsContact O-N 3.15Å; A19-E22 HydrophobicContact CB-CB 4.47Å; A19-E22 HydrophobicContact CB-CG 4.11Å; A19-E22 PolarHBondContact N-OE2 2.84Å; A19-E22 WeakPolarHBondContact O-CB 3.29Å; A19-E22 PolarHBondContact O-N 3.28Å; A19-M23 PolarHBondContact O-N 3.31Å; A19-M23 VanDerWaalsContact O-N 3.09Å
20P88.2Confident85.1Confident57 Ų5785.7 Ų85.737%0.3749%0.493SS..Hα-helixtrans-54.7-33.5175-27.934.5000113.9R9 A11 M23 V24R9-P20 WeakPolarHBondContact O-CD 3.49Å; A11-P20 WeakPolarHBondContact O-CD 3.35Å; P20-M23 PolarHBondContact O-N 2.85Å; P20-V24 WeakPolarHBondContact O-CG2 3.38Å; P20-V24 PolarHBondContact O-N 2.66Å
21A88.6Confident84.7Confident4 Ų486.3 Ų86.33%0.03350%0.495CS..Hα-helixtrans-68.9-35.3175.100000113.1R9 A19 M23 V24 Y25 L29R9-A21 HydrophobicContact CB-CB 4.37Å; R9-A21 VanDerWaalsContact O-CB 3.27Å; R9-A21 WeakPolarHBondContact O-CB 3.26Å; R9-A21 PolarHBondContact O-N 2.84Å; A19-A21 PolarHBondContact O-N 3.21Å; A19-A21 VanDerWaalsContact O-N 3.15Å; A21-M23 VanDerWaalsContact C-N 3.35Å; A21-V24 PolarHBondContact O-N 2.91Å; A21-Y25 HydrophobicContact CB-CD2 4.36Å; A21-Y25 WeakPolarHBondContact O-CB 3.44Å; A21-Y25 WeakPolarHBondContact O-CD2 3.21Å; A21-Y25 PolarHBondContact O-N 2.79Å; A21-L29 HydrophobicContact CB-CD1 3.36Å; A21-L29 HydrophobicContact CB-CD2 4.47Å; A21-L29 HydrophobicContact CB-CG 3.56Å
22E89.7Confident83.9Confident46 Ų4690.2 Ų90.222%0.21552%0.515CS..Hα-helixtrans-67.9-37.7175.5-68.6166.317300110.9L18 A19 V24 G26 S28L18-E22 HydrophobicContact CD2-CB 4.21Å; A19-E22 HydrophobicContact CB-CB 4.47Å; A19-E22 HydrophobicContact CB-CG 4.11Å; A19-E22 PolarHBondContact N-OE2 2.84Å; A19-E22 WeakPolarHBondContact O-CB 3.29Å; A19-E22 PolarHBondContact O-N 3.28Å; E22-V24 VanDerWaalsContact C-N 3.27Å; E22-V24 PolarHBondContact O-N 2.91Å; E22-G26 WeakPolarHBondContact O-CA 3.46Å; E22-G26 PolarHBondContact O-N 3.07Å; E22-S28 WeakPolarHBondContact OE1-CB 3.42Å; E22-S28 PolarHBondContact OE1-OG 3.14Å
23M88.5Confident82.9Confident125 Ų12589.6 Ų89.662%0.61652%0.515SS*.Hα-helixtrans-63.2-33.6174.8-68.6-176.365.200113.1L16 L18 A19 P20 A21L16-M23 HydrophobicContact CD1-CE 4.4Å; L16-M23 HydrophobicContact CD1-SD 3.76Å; L18-M23 HydrophobicContact CB-CG 4.44Å; A19-M23 PolarHBondContact O-N 3.31Å; A19-M23 VanDerWaalsContact O-N 3.09Å; P20-M23 PolarHBondContact O-N 2.85Å; A21-M23 VanDerWaalsContact C-N 3.35Å
24V90.6Very high81.9Confident107 Ų10790.6 Ų90.665%0.64852%0.522SS*.Hα-helixtrans-88.6-39.6-177175.10000112P20 A21 E22P20-V24 WeakPolarHBondContact O-CG2 3.38Å; P20-V24 PolarHBondContact O-N 2.66Å; A21-V24 PolarHBondContact O-N 2.91Å; E22-V24 VanDerWaalsContact C-N 3.27Å; E22-V24 PolarHBondContact O-N 2.91Å
25Y88.6Confident80.7Confident158 Ų15892.4 Ų92.462%0.6252%0.516SS*.Hα-helixtrans-109.1-7.6-172.7-61.1-66.8000114.1A21 N27A21-Y25 HydrophobicContact CB-CD2 4.36Å; A21-Y25 WeakPolarHBondContact O-CB 3.44Å; A21-Y25 WeakPolarHBondContact O-CD2 3.21Å; A21-Y25 PolarHBondContact O-N 2.79Å; Y25-N27 PolarHBondContact O-N 3.4Å
26G87.9Confident79.1Confident70 Ų7094.1 Ų94.172%0.72252%0.523SS*.SBendtrans713.8-176.700000114.6E22E22-G26 WeakPolarHBondContact O-CA 3.46Å; E22-G26 PolarHBondContact O-N 3.07Å
27N83.9Confident77.7Confident118 Ų11893.2 Ų93.263%0.63153%0.528SS*.SBendtrans-143.3150.6-177.9-164.715.4000111.5Y25Y25-N27 PolarHBondContact O-N 3.4Å
28S82.9Confident76.1Confident65 Ų6595.5 Ų95.546%0.45553%0.533SS..  trans-72.5138.8178.2-149.90000110.9E22 R30E22-S28 WeakPolarHBondContact OE1-CB 3.42Å; E22-S28 PolarHBondContact OE1-OG 3.14Å; S28-R30 PolarHBondContact O-N 2.78Å
29L81.7Confident74.6Confident61 Ų6196.4 Ų96.432%0.31954%0.542SS..  trans-79.8113.3178-65.6174.7000109.7L6 R9 T10 A21 L31L6-L29 HydrophobicContact CD1-CD1 4.21Å; R9-L29 HydrophobicContact CB-CD1 4.43Å; T10-L29 HydrophobicContact CG2-CB 3.76Å; T10-L29 HydrophobicContact CG2-CD1 4.03Å; T10-L29 HydrophobicContact CG2-CG 4.4Å; A21-L29 HydrophobicContact CB-CD1 3.36Å; A21-L29 HydrophobicContact CB-CD2 4.47Å; A21-L29 HydrophobicContact CB-CG 3.56Å; L29-L31 PolarHBondContact O-N 2.87Å
30R77.9Confident73.1Confident230 Ų230100.7 Ų100.787%0.86857%0.572SS**  trans-65.4106.5170.9-169.2175.9-177.3-176.11.6110.1S28S28-R30 PolarHBondContact O-N 2.78Å
31L77.1Confident71.5Confident48 Ų48105.1 Ų105.125%0.25159%0.592SS.*  trans-75.7137.1178.9-61.5179.6000110.1L6 T10 L29 A33 E34L6-L31 HydrophobicContact CD1-CD2 3.64Å; L6-L31 HydrophobicContact CD2-CD2 3.42Å; L6-L31 VanDerWaalsContact CD2-CD2 3.42Å; L6-L31 HydrophobicContact CG-CD2 3.35Å; T10-L31 HydrophobicContact CG2-CD1 4.4Å; T10-L31 HydrophobicContact CG2-CD2 3.72Å; T10-L31 HydrophobicContact CG2-CG 4.19Å; L29-L31 PolarHBondContact O-N 2.87Å; L31-A33 PolarHBondContact O-N 3.45Å; L31-E34 HydrophobicContact CB-CB 4.25Å; L31-E34 PolarHBondContact O-N 3.48Å
32P67.9Low69.9Low137 Ų137112.1 Ų112.189%0.8962%0.618SS**THydrogen-bonded Turntrans-59.7-17.9170.8-23.132.8000113.8
33A62.8Low68.2Low72 Ų72116.4 Ų116.460%0.59565%0.647SS**THydrogen-bonded Turntrans-122.225.5-176.400000112.8L31 L35L31-A33 PolarHBondContact O-N 3.45Å; A33-L35 PolarHBondContact O-N 3.25Å
34E60.7Low66.7Low137 Ų137118.2 Ų118.264%0.6466%0.659SS**  trans-66.566.6157.5-166.4177.3-175.500108L31 I36L31-E34 HydrophobicContact CB-CB 4.25Å; L31-E34 PolarHBondContact O-N 3.48Å; E34-I36 PolarHBondContact O-N 2.78Å; E34-I36 VanDerWaalsContact O-N 3.07Å
35L53.1Low65.5Low148 Ų148116 Ų11678%0.77565%0.646SS**  trans-65.1108.3167.7-80.9159.5000104.6A33 A37A33-L35 PolarHBondContact O-N 3.25Å; L35-A37 PolarHBondContact O-N 3.42Å
36I50.7Low64.9Low162 Ų162111.8 Ų111.883%0.83163%0.634SS**  trans-6079.6160.3-52.6177.1000106.2E34E34-I36 PolarHBondContact O-N 2.78Å; E34-I36 VanDerWaalsContact O-N 3.07Å
37A53.9Low64.4Low67 Ų67113 Ų11355%0.55463%0.63SS**  trans-109.7100.8160.900000103.9L35 T39L35-A37 PolarHBondContact O-N 3.42Å; A37-T39 PolarHBondContact O-N 2.84Å
38P50.1Low64.3Low105 Ų105111.8 Ų111.868%0.68263%0.627SS**  trans-52.4115.2163.522.7-30.8000106S40P38-S40 PolarHBondContact O-N 2.86Å
39T55.2Low64.4Low106 Ų106112.1 Ų112.165%0.6562%0.623SS**  trans-76.675.3169.932.60000105.9A37 D41A37-T39 PolarHBondContact O-N 2.84Å; T39-D41 PolarHBondContact O-N 2.86Å; T39-D41 VanDerWaalsContact O-N 3.09Å
40S55.3Low64.5Low92 Ų92114.4 Ų114.464%0.64363%0.63SS**THydrogen-bonded Turntrans-59.2112.5160.5-49.40000105.4P38P38-S40 PolarHBondContact O-N 2.86Å
41D54.3Low64.9Low149 Ų149106.4 Ų106.480%0.79761%0.608SS**THydrogen-bonded Turntrans67.266.5168.4-45.9-35.3000116.8T39T39-D41 PolarHBondContact O-N 2.86Å; T39-D41 VanDerWaalsContact O-N 3.09Å
42R56Low65.4Low151 Ų151111.8 Ų111.857%0.5763%0.625SS**  trans-12559.5156.3-78.1174.777.7163.52.7111.2N44 V45R42-N44 PolarHBondContact O-N 2.83Å; R42-V45 HydrophobicContact CB-CG2 4.23Å; R42-V45 HydrophobicContact CG-CG2 4.07Å
43T54.3Low66.4Low136 Ų136109.5 Ų109.583%0.83461%0.608SS**THydrogen-bonded Turntrans-61.4117.9154.246.60000107.5
44N56.2Low67.5Low163 Ų163110.2 Ų110.287%0.87260%0.601SS**THydrogen-bonded Turntrans67.155.2164.3-114.8-21000117.5R42 D46R42-N44 PolarHBondContact O-N 2.83Å; N44-D46 PolarHBondContact O-N 2.79Å
45V65.1Low68.8Low60 Ų60110.6 Ų110.636%0.36460%0.6SS.*  trans-73.8111.3156.2179.30000108.2R42 P47 F50R42-V45 HydrophobicContact CB-CG2 4.23Å; R42-V45 HydrophobicContact CG-CG2 4.07Å; V45-P47 VanDerWaalsContact O-N 3.17Å; V45-F50 HydrophobicContact CG1-CB 4.1Å
46D76.8Confident70.6Confident71 Ų71105.9 Ų105.938%0.3858%0.583SS.*  trans-49.4121.5171.6174.77000108.8N44 T48 D49 F50N44-D46 PolarHBondContact O-N 2.79Å; D46-T48 PolarHBondContact O-N 2.77Å; D46-T48 VanDerWaalsContact OD1-CB 3.31Å; D46-T48 WeakPolarHBondContact OD1-CB 3.47Å; D46-T48 PolarHBondContact OD1-N 3.34Å; D46-T48 PolarHBondContact OD1-OG1 2.96Å; D46-T48 WeakPolarHBondContact OD2-CB 3.17Å; D46-D49 HydrophobicContact CB-CB 4.42Å; D46-D49 PolarHBondContact O-N 2.84Å; D46-F50 PolarHBondContact O-N 3.37Å
47P77Confident72.4Confident96 Ų96100.4 Ų100.462%0.62356%0.562SS**Hα-helixtrans-54.6-28.917922.4-34.8000112.2V45 T51V45-P47 VanDerWaalsContact O-N 3.17Å; P47-T51 VanDerWaalsContact O-CG2 3.27Å; P47-T51 WeakPolarHBondContact O-CG2 3.22Å; P47-T51 PolarHBondContact O-N 3.08Å; P47-T51 PolarHBondContact O-OG1 2.96Å
48T82.4Confident74Confident92 Ų92102.7 Ų102.756%0.56456%0.563SS**Hα-helixtrans-64.7-43.3177.6-42.60000111.5D46 T51 R52D46-T48 PolarHBondContact O-N 2.77Å; D46-T48 VanDerWaalsContact OD1-CB 3.31Å; D46-T48 WeakPolarHBondContact OD1-CB 3.47Å; D46-T48 PolarHBondContact OD1-N 3.34Å; D46-T48 PolarHBondContact OD1-OG1 2.96Å; D46-T48 WeakPolarHBondContact OD2-CB 3.17Å; T48-T51 PolarHBondContact O-OG1 3.14Å; T48-R52 WeakPolarHBondContact O-CB 3.31Å; T48-R52 PolarHBondContact O-N 3.12Å
49D85.1Confident75.8Confident71 Ų71108.2 Ų108.238%0.3857%0.57SS.*Hα-helixtrans-68.9-41.4178.4-91.9-33000112.4D46 T51 R52 V53D46-D49 HydrophobicContact CB-CB 4.42Å; D46-D49 PolarHBondContact O-N 2.84Å; D49-T51 PolarHBondContact O-N 3.03Å; D49-R52 WeakPolarHBondContact O-CB 3.43Å; D49-R52 PolarHBondContact O-N 3.08Å; D49-R52 IonicContact OD1-CZ 3.43Å; D49-R52 IonicContact OD1-NE 3.17Å; D49-R52 PolarHBondContact OD1-NE 3.02Å; D49-R52 VanDerWaalsContact OD1-NE 3.17Å; D49-R52 IonicContact OD1-NH2 2.82Å; D49-R52 PolarHBondContact OD1-NH2 3.2Å; D49-V53 WeakPolarHBondContact O-CG2 3.42Å; D49-V53 PolarHBondContact O-N 3.12Å
50F83.3Confident77.5Confident109 Ų109111.4 Ų111.448%0.47858%0.575SS.*Hα-helixtrans-60.8-46.6176.2179-103000111.7V45 D46 R52 V53 L54V45-F50 HydrophobicContact CG1-CB 4.1Å; D46-F50 PolarHBondContact O-N 3.37Å; F50-R52 VanDerWaalsContact C-N 3.29Å; F50-R52 PolarHBondContact O-N 2.94Å; F50-V53 PolarHBondContact O-N 2.97Å; F50-L54 HydrophobicContact CE1-CD2 4.39Å; F50-L54 WeakPolarHBondContact O-CB 3.42Å; F50-L54 PolarHBondContact O-N 3.11Å
51T85.1Confident78.9Confident63 Ų63112.7 Ų112.739%0.38757%0.574SS.*Hα-helixtrans-65.8-33.1178.7620000112.1P47 T48 D49 K55P47-T51 VanDerWaalsContact O-CG2 3.27Å; P47-T51 WeakPolarHBondContact O-CG2 3.22Å; P47-T51 PolarHBondContact O-N 3.08Å; P47-T51 PolarHBondContact O-OG1 2.96Å; T48-T51 PolarHBondContact O-OG1 3.14Å; D49-T51 PolarHBondContact O-N 3.03Å; T51-K55 VanDerWaalsContact O-CB 3.3Å; T51-K55 WeakPolarHBondContact O-CB 3.16Å; T51-K55 VanDerWaalsContact O-CG 3.25Å; T51-K55 WeakPolarHBondContact O-CG 3.5Å; T51-K55 PolarHBondContact O-N 2.77Å
52R88.2Confident80.3Confident161 Ų161116.1 Ų116.161%0.60858%0.576SS**Hα-helixtrans-63.7-48.2173.3-177.5176.465.4102.5-2.7111.5T48 D49 F50 K55 A56T48-R52 WeakPolarHBondContact O-CB 3.31Å; T48-R52 PolarHBondContact O-N 3.12Å; D49-R52 WeakPolarHBondContact O-CB 3.43Å; D49-R52 PolarHBondContact O-N 3.08Å; D49-R52 IonicContact OD1-CZ 3.43Å; D49-R52 IonicContact OD1-NE 3.17Å; D49-R52 PolarHBondContact OD1-NE 3.02Å; D49-R52 VanDerWaalsContact OD1-NE 3.17Å; D49-R52 IonicContact OD1-NH2 2.82Å; D49-R52 PolarHBondContact OD1-NH2 3.2Å; F50-R52 VanDerWaalsContact C-N 3.29Å; F50-R52 PolarHBondContact O-N 2.94Å; R52-K55 PolarHBondContact O-N 2.81Å; R52-A56 WeakPolarHBondContact O-CB 3.36Å; R52-A56 PolarHBondContact O-N 3.35Å
53V89.1Confident81.6Confident89 Ų89115.1 Ų115.154%0.53959%0.588SS.*Hα-helixtrans-61.9-44.9176.7173.60000110.7D49 F50 A56 A57D49-V53 WeakPolarHBondContact O-CG2 3.42Å; D49-V53 PolarHBondContact O-N 3.12Å; F50-V53 PolarHBondContact O-N 2.97Å; V53-A56 WeakPolarHBondContact O-CB 3.25Å; V53-A56 PolarHBondContact O-N 2.93Å; V53-A57 WeakPolarHBondContact O-CB 3.23Å; V53-A57 PolarHBondContact O-N 2.8Å
54L85.3Confident83.1Confident86 Ų86116.3 Ų116.345%0.4559%0.588SS.*Hα-helixtrans-62.2-46.2177.1179.462.1000111.7F50 A56 A57 M58F50-L54 HydrophobicContact CE1-CD2 4.39Å; F50-L54 WeakPolarHBondContact O-CB 3.42Å; F50-L54 PolarHBondContact O-N 3.11Å; L54-A56 VanDerWaalsContact C-N 3.3Å; L54-A56 PolarHBondContact O-N 2.86Å; L54-A57 PolarHBondContact O-N 3.34Å; L54-M58 HydrophobicContact CD1-CG 4.11Å; L54-M58 HydrophobicContact CG-CG 4.36Å; L54-M58 WeakPolarHBondContact O-CB 3.45Å; L54-M58 VanDerWaalsContact O-CG 3.3Å; L54-M58 WeakPolarHBondContact O-CG 3.39Å; L54-M58 PolarHBondContact O-N 3.19Å
55K88.7Confident84.4Confident145 Ų145117 Ų11763%0.6359%0.586SS**Hα-helixtrans-58.8-43.1174.8-79.3175.4-179.3175.20111T51 R52 M58 R59T51-K55 VanDerWaalsContact O-CB 3.3Å; T51-K55 WeakPolarHBondContact O-CB 3.16Å; T51-K55 VanDerWaalsContact O-CG 3.25Å; T51-K55 WeakPolarHBondContact O-CG 3.5Å; T51-K55 PolarHBondContact O-N 2.77Å; R52-K55 PolarHBondContact O-N 2.81Å; K55-M58 PolarHBondContact O-N 2.76Å; K55-R59 WeakPolarHBondContact O-CB 3.44Å; K55-R59 VanDerWaalsContact O-CG 3.26Å; K55-R59 WeakPolarHBondContact O-CG 2.97Å; K55-R59 PolarHBondContact O-N 3.33Å
56A89.9Confident85.3Confident49 Ų49119.9 Ų119.941%0.40561%0.606SS.*Hα-helixtrans-62.8-42176.500000112R52 V53 L54 R59 K60R52-A56 WeakPolarHBondContact O-CB 3.36Å; R52-A56 PolarHBondContact O-N 3.35Å; V53-A56 WeakPolarHBondContact O-CB 3.25Å; V53-A56 PolarHBondContact O-N 2.93Å; L54-A56 VanDerWaalsContact C-N 3.3Å; L54-A56 PolarHBondContact O-N 2.86Å; A56-R59 PolarHBondContact O-N 3.07Å; A56-K60 WeakPolarHBondContact O-CG 3.37Å; A56-K60 PolarHBondContact O-N 2.88Å
57A88.9Confident85.6Confident48 Ų48128.1 Ų128.140%0.39763%0.632SS.*Hα-helixtrans-65.3-46.3175.900000112V53 L54 R59 K60 L61V53-A57 WeakPolarHBondContact O-CB 3.23Å; V53-A57 PolarHBondContact O-N 2.8Å; L54-A57 PolarHBondContact O-N 3.34Å; A57-R59 VanDerWaalsContact C-N 3.3Å; A57-R59 PolarHBondContact O-N 3.31Å; A57-K60 WeakPolarHBondContact O-CB 3.42Å; A57-K60 PolarHBondContact O-N 2.76Å; A57-L61 PolarHBondContact O-N 2.81Å
58M88Confident85.8Confident114 Ų114130.7 Ų130.756%0.56264%0.64SS**Hα-helixtrans-62.9-35.5177.3-70.5-65.8-67.300112.1L54 K55 K60 L61L54-M58 HydrophobicContact CD1-CG 4.11Å; L54-M58 HydrophobicContact CG-CG 4.36Å; L54-M58 WeakPolarHBondContact O-CB 3.45Å; L54-M58 VanDerWaalsContact O-CG 3.3Å; L54-M58 WeakPolarHBondContact O-CG 3.39Å; L54-M58 PolarHBondContact O-N 3.19Å; K55-M58 PolarHBondContact O-N 2.76Å; M58-K60 VanDerWaalsContact C-N 3.25Å; M58-K60 PolarHBondContact O-N 2.75Å; M58-L61 HydrophobicContact CE-CD1 4.26Å; M58-L61 WeakPolarHBondContact O-CB 3.28Å; M58-L61 PolarHBondContact O-N 3.26Å; M58-L61 VanDerWaalsContact O-N 3.16Å; M58-L61 HydrophobicContact SD-CD1 3.61Å
59R87.9Confident85.7Confident221 Ų221132.5 Ų132.583%0.83465%0.646SS**Hα-helixtrans-65.5-26.1173.6-76.6-179.671.7-164.72.4113.4K55 A56 A57 L61K55-R59 WeakPolarHBondContact O-CB 3.44Å; K55-R59 VanDerWaalsContact O-CG 3.26Å; K55-R59 WeakPolarHBondContact O-CG 2.97Å; K55-R59 PolarHBondContact O-N 3.33Å; A56-R59 PolarHBondContact O-N 3.07Å; A57-R59 VanDerWaalsContact C-N 3.3Å; A57-R59 PolarHBondContact O-N 3.31Å; R59-L61 VanDerWaalsContact C-N 3.34Å
60K90Very high85.5Confident173 Ų173135.1 Ų135.175%0.75266%0.664SS**Hα-helixtrans-75.7-23.9174.4-67.7174.9-177.9-178.70112.2A56 A57 M58 R62A56-K60 WeakPolarHBondContact O-CG 3.37Å; A56-K60 PolarHBondContact O-N 2.88Å; A57-K60 WeakPolarHBondContact O-CB 3.42Å; A57-K60 PolarHBondContact O-N 2.76Å; M58-K60 VanDerWaalsContact C-N 3.25Å; M58-K60 PolarHBondContact O-N 2.75Å; K60-R62 PolarHBondContact O-N 3.35Å
61L84.9Confident85.5Confident120 Ų120139.8 Ų139.863%0.62868%0.679SS**  trans-68.4103.6176.3-61.8176000109.1A57 M58 R59A57-L61 PolarHBondContact O-N 2.81Å; M58-L61 HydrophobicContact CE-CD1 4.26Å; M58-L61 WeakPolarHBondContact O-CB 3.28Å; M58-L61 PolarHBondContact O-N 3.26Å; M58-L61 VanDerWaalsContact O-N 3.16Å; M58-L61 HydrophobicContact SD-CD1 3.61Å; R59-L61 VanDerWaalsContact C-N 3.34Å
62R84.7Confident85.2Confident221 Ų221140.9 Ų140.983%0.83470%0.695SS**PPolyproline II helixtrans-80.5135.1171.7-69-175.3175.5-169.7-1.3109K60 I64K60-R62 PolarHBondContact O-N 3.35Å; R62-I64 PolarHBondContact O-N 3.42Å; R62-I64 VanDerWaalsContact O-N 3.15Å
63P82.9Confident84.8Confident129 Ų129138.6 Ų138.684%0.83870%0.699SS**PPolyproline II helixtrans-54.4122.4166.9-21.932.1000109.2
64I85.3Confident84.6Confident161 Ų161143.2 Ų143.283%0.82671%0.712SS**PPolyproline II helixtrans-73.1131.3171.4-59.7172.4000106.4R62R62-I64 PolarHBondContact O-N 3.42Å; R62-I64 VanDerWaalsContact O-N 3.15Å
65Q84.3Confident84.6Confident178 Ų178142.4 Ų142.483%0.83271%0.71SS**PPolyproline II helixtrans-56130.6174.9-69.8-17315.300109R67Q65-R67 PolarHBondContact O-N 3.28Å
66P82.9Confident84.5Confident121 Ų121137 Ų13779%0.78669%0.691SS**PPolyproline II helixtrans-53143.3172.4-22.531.9000109.6L68P66-L68 PolarHBondContact O-N 3.48Å
67R84.1Confident84.5Confident243 Ų243142.6 Ų142.692%0.91771%0.709SS**PPolyproline II helixtrans-55.6131.2172.6-66.2-177.1-178.7-178.80.2108.5Q65 N69Q65-R67 PolarHBondContact O-N 3.28Å; R67-N69 PolarHBondContact O-N 2.84Å; R67-N69 VanDerWaalsContact O-N 3.09Å
68L81Confident84.3Confident151 Ų151147.6 Ų147.679%0.79172%0.717SS**PPolyproline II helixtrans-57.5117.8173.5-179.267000108.2P66 T70P66-L68 PolarHBondContact O-N 3.48Å; L68-T70 HydrophobicContact CD2-CG2 3.93Å; L68-T70 HydrophobicContact CG-CG2 4.1Å; L68-T70 PolarHBondContact O-N 3.33Å; L68-T70 VanDerWaalsContact O-N 3.14Å
69N79.8Confident84.4Confident130 Ų130142.7 Ų142.770%0.69569%0.693SS**  trans-77.898.9171.7-170.8-5.8000108R67 R71R67-N69 PolarHBondContact O-N 2.84Å; R67-N69 VanDerWaalsContact O-N 3.09Å; N69-R71 WeakPolarHBondContact OD1-CB 3.49Å; N69-R71 PolarHBondContact OD1-N 3.36Å; N69-R71 VanDerWaalsContact OD1-N 3.1Å
70T81.1Confident84.4Confident125 Ų125137.2 Ų137.277%0.76768%0.68SS**  trans-81.4-3.3176.949.80000113L68 A72L68-T70 HydrophobicContact CD2-CG2 3.93Å; L68-T70 HydrophobicContact CG-CG2 4.1Å; L68-T70 PolarHBondContact O-N 3.33Å; L68-T70 VanDerWaalsContact O-N 3.14Å; T70-A72 PolarHBondContact O-N 3.3Å
71R82.6Confident84.3Confident207 Ų207135.6 Ų135.678%0.78168%0.68SS**SBendtrans-70.1126.6180-169.8177.9176.4178.4-0.2109.3N69 T73N69-R71 WeakPolarHBondContact OD1-CB 3.49Å; N69-R71 PolarHBondContact OD1-N 3.36Å; N69-R71 VanDerWaalsContact OD1-N 3.1Å; R71-T73 PolarHBondContact O-N 3.09Å
72A79.3Confident84.4Confident87 Ų87130.5 Ų130.572%0.71965%0.654SS**PPolyproline II helixtrans-55.6126.4171.200000110T70 F74T70-A72 PolarHBondContact O-N 3.3Å; A72-F74 PolarHBondContact O-N 3.1Å
73T80.6Confident84.8Confident113 Ų113121.9 Ų121.969%0.69363%0.628SS**PPolyproline II helixtrans-62.4127.9175.1-510000108.8R71 V75R71-T73 PolarHBondContact O-N 3.09Å; T73-V75 PolarHBondContact O-N 3.14Å
74F84.6Confident85.3Confident185 Ų185118.3 Ų118.381%0.81160%0.6SS**  trans-71.6112.6174.6176.5-102.6000109.3A72A72-F74 PolarHBondContact O-N 3.1Å
75V85.9Confident85.8Confident69 Ų69110.6 Ų110.642%0.41856%0.56SS.*  trans-107.8128.9170-177.90000107.6T73 Q77 L79 I127T73-V75 PolarHBondContact O-N 3.14Å; V75-Q77 PolarHBondContact O-N 3.09Å; V75-L79 HydrophobicContact CG1-CD1 4.19Å; V75-I127 HydrophobicContact CG1-CG2 3.85Å; V75-I127 HydrophobicContact CG2-CG2 4.5Å
76S86.4Confident86.2Confident32 Ų32105.7 Ų105.722%0.22454%0.536CS..  trans-66.7126.6176.657.50000110R78 L79S76-R78 PolarHBondContact O-N 3.33Å; S76-R78 VanDerWaalsContact O-N 3.08Å; S76-L79 WeakPolarHBondContact O-CB 3.31Å; S76-L79 PolarHBondContact O-N 3.46Å; S76-L79 VanDerWaalsContact OG-CD1 3.23Å; S76-L79 WeakPolarHBondContact OG-CD1 3.19Å; S76-L79 VanDerWaalsContact OG-CG 3.28Å; S76-L79 WeakPolarHBondContact OG-CG 3.24Å
77Q88.4Confident86.8Confident166 Ų166100.1 Ų100.178%0.77650%0.5SS*.THydrogen-bonded Turntrans-54.1-32.3179.2-67.4174.7-11.600112.6V75 L79 N80V75-Q77 PolarHBondContact O-N 3.09Å; Q77-L79 PolarHBondContact O-N 3.1Å; Q77-L79 VanDerWaalsContact O-N 3.14Å; Q77-N80 WeakPolarHBondContact O-CB 3.38Å; Q77-N80 PolarHBondContact O-N 3.15Å; Q77-N80 VanDerWaalsContact O-N 3.08Å
78R86.6Confident87.2Confident154 Ų15492 Ų9258%0.58147%0.47SS*.Hα-helixtrans-62.5-18.5178-60.6-165.4-179.9179.7-4.9114.4S76 N80 D81 C82 P132S76-R78 PolarHBondContact O-N 3.33Å; S76-R78 VanDerWaalsContact O-N 3.08Å; R78-N80 PolarHBondContact O-N 3.37Å; R78-D81 PolarHBondContact O-N 3.07Å; R78-C82 WeakPolarHBondContact O-CB 3.34Å; R78-C82 PolarHBondContact O-N 3.41Å; R78-P132 HydrophobicContact CB-CB 4.42Å; R78-P132 HydrophobicContact CB-CG 4.49Å
79L88.7Confident87.7Confident11 Ų1188.7 Ų88.76%0.05845%0.45CS..Hα-helixtrans-70-18.5175.2-76.2166.7000112.9V75 S76 Q77 V85 L114 I127 P132V75-L79 HydrophobicContact CG1-CD1 4.19Å; S76-L79 WeakPolarHBondContact O-CB 3.31Å; S76-L79 PolarHBondContact O-N 3.46Å; S76-L79 VanDerWaalsContact OG-CD1 3.23Å; S76-L79 WeakPolarHBondContact OG-CD1 3.19Å; S76-L79 VanDerWaalsContact OG-CG 3.28Å; S76-L79 WeakPolarHBondContact OG-CG 3.24Å; Q77-L79 PolarHBondContact O-N 3.1Å; Q77-L79 VanDerWaalsContact O-N 3.14Å; L79-V85 HydrophobicContact CD2-CG1 3.86Å; L79-L114 HydrophobicContact CD2-CD1 4.46Å; L79-I127 HydrophobicContact CD1-CG2 3.93Å; L79-P132 HydrophobicContact CD2-CB 4.2Å
80N87.6Confident87.9Confident105 Ų10588 Ų8856%0.56144%0.443SS*.Hα-helixtrans-71.7-36.3174.4-64.2-26.2000111.4Q77 R78 R109Q77-N80 WeakPolarHBondContact O-CB 3.38Å; Q77-N80 PolarHBondContact O-N 3.15Å; Q77-N80 VanDerWaalsContact O-N 3.08Å; R78-N80 PolarHBondContact O-N 3.37Å; N80-R109 WeakPolarHBondContact O-CD 3.26Å; N80-R109 PolarHBondContact O-NE 3.07Å
81D88.4Confident88Confident140 Ų14085 Ų8575%0.74944%0.436SS*.Hα-helixtrans-113.5-5.4-169.5-52.6-37.6000113.8R78R78-D81 PolarHBondContact O-N 3.07Å
82C88.2Confident87.7Confident12 Ų1280.8 Ų80.88%0.08144%0.438CS..  trans-70.2134.3-175.261.30000113.1R78 V85 R109 P132R78-C82 WeakPolarHBondContact O-CB 3.34Å; R78-C82 PolarHBondContact O-N 3.41Å; C82-V85 WeakPolarHBondContact SG-CG1 3.39Å; C82-R109 PolarHBondContact O-NH2 3.25Å; C82-P132 HydrophobicContact CB-CB 4.13Å
83S91.6Very high87.2Confident40 Ų4078.9 Ų78.928%0.2842%0.419SS..SBendtrans-68.7-40.7175.459.60000112.4V106 D138S83-V106 PolarHBondContact O-N 3.32Å; S83-V106 VanDerWaalsContact O-N 3.11Å; S83-D138 PolarHBondContact OG-OD1 3.21Å
84H94Very high87.2Confident54 Ų5476 Ų7625%0.2541%0.411CS..EExtended strand (participates in β ladder)trans-128.6151-175.5-62.775.4000112P103 H104 A133 L135H84-P103 HydrophobicContact CB-CB 3.95Å; H84-H104 CarbonylContact C-O 3.58Å; H84-H104 VanDerWaalsContact CA-O 3.29Å; H84-H104 WeakPolarHBondContact CA-O 3.47Å; H84-A133 HydrophobicContact CB-CB 3.91Å; H84-A133 WeakPolarHBondContact O-CB 3.38Å; H84-A133 PolarHBondContact O-N 3.4Å; H84-L135 HydrophobicContact CB-CD1 4.31Å; H84-L135 VanDerWaalsContact CE1-CD1 3.49Å; H84-L135 WeakPolarHBondContact CE1-CD1 3.49Å; H84-L135 VanDerWaalsContact ND1-CD1 3.29Å; H84-L135 WeakPolarHBondContact ND1-CD1 3.48Å
85V94.8Very high87.1Confident0 Ų075.7 Ų75.70%042%0.416CS..EExtended strand (participates in β ladder)trans-134.9145.3178.2-65.60000112.2L79 C82 V87 G102 H104 V106 L114 I116 T130 K131L79-V85 HydrophobicContact CD2-CG1 3.86Å; C82-V85 WeakPolarHBondContact SG-CG1 3.39Å; V85-V87 HydrophobicContact CG2-CG2 4.31Å; V85-G102 VanDerWaalsContact O-O 3.12Å; V85-H104 PolarHBondContact N-O 3.31Å; V85-H104 PolarHBondContact O-N 3.26Å; V85-V106 HydrophobicContact CB-CG2 4.21Å; V85-V106 HydrophobicContact CG1-CG2 3.64Å; V85-V106 HydrophobicContact CG2-CG2 3.66Å; V85-L114 HydrophobicContact CG1-CD1 4.32Å; V85-I116 HydrophobicContact CG2-CG2 3.62Å; V85-T130 HydrophobicContact CG2-CG2 4.49Å; V85-K131 CarbonylContact C-O 3.52Å; V85-K131 VanDerWaalsContact CA-O 3.22Å; V85-K131 WeakPolarHBondContact CA-O 3.4Å; V85-K131 WeakPolarHBondContact CB-O 3.39Å
86F94.7Very high87Confident74 Ų7480.4 Ų80.433%0.32544%0.438SS..EExtended strand (participates in β ladder)trans-86.8138.2166.2-67.8-75.3000110.1Y100 S101 G102 P103 T130 K131 A133F86-Y100 HydrophobicContact CB-CD1 4.18Å; F86-S101 WeakPolarHBondContact CD1-O 3.44Å; F86-G102 VanDerWaalsContact CD1-C 3.44Å; F86-P103 HydrophobicContact CE1-CB 4.5Å; F86-T130 CarbonylContact O-C 3.59Å; F86-T130 VanDerWaalsContact O-CA 3.25Å; F86-T130 WeakPolarHBondContact O-CA 3.43Å; F86-K131 HydrophobicContact CB-CB 4.31Å; F86-K131 PolarHBondContact N-O 2.96Å; F86-K131 PolarHBondContact O-N 3.02Å; F86-A133 HydrophobicContact CD2-CB 3.66Å; F86-A133 HydrophobicContact CE2-CB 3.38Å; F86-A133 HydrophobicContact CG-CB 4.49Å; F86-A133 HydrophobicContact CZ-CB 4.01Å
87V94.5Very high87Confident4 Ų481.1 Ų81.12%0.02445%0.445CS..EExtended strand (participates in β ladder)trans-119.1126.3-173.2177.90000109.5V85 E89 Y100 S101 I116 V125 T130V85-V87 HydrophobicContact CG2-CG2 4.31Å; V87-E89 PolarHBondContact O-N 3.13Å; V87-Y100 CarbonylContact O-C 3.46Å; V87-Y100 VanDerWaalsContact O-CA 3.31Å; V87-Y100 WeakPolarHBondContact O-CA 3.1Å; V87-S101 PolarHBondContact N-O 3.34Å; V87-S101 VanDerWaalsContact N-O 3.14Å; V87-S101 PolarHBondContact O-N 2.77Å; V87-I116 HydrophobicContact CB-CD1 4.35Å; V87-I116 HydrophobicContact CG1-CD1 4.4Å; V87-I116 HydrophobicContact CG2-CD1 3.34Å; V87-V125 HydrophobicContact CG1-CG1 3.95Å; V87-T130 HydrophobicContact CG2-CG2 4.39Å
88R92.9Very high87Confident74 Ų7477.4 Ų77.428%0.27944%0.436SS..EExtended strand (participates in β ladder)trans-70.3124.1175.4-177.7178.8165.9-152-7110.5R99 Y100 R129R88-R99 WeakPolarHBondContact CA-O 3.39Å; R88-R99 HydrophobicContact CG-CG 4.22Å; R88-Y100 HydrophobicContact CB-CD1 4.03Å; R88-Y100 HydrophobicContact CB-CE1 3.76Å; R88-R129 HydrophobicContact CB-CB 4.25Å; R88-R129 WeakPolarHBondContact CB-O 3.35Å; R88-R129 PolarHBondContact N-O 3.38Å; R88-R129 PolarHBondContact O-NE 3.15Å; R88-R129 PolarHBondContact O-NH2 2.96Å
89E90.7Very high87.2Confident80 Ų8076.8 Ų76.837%0.37443%0.434SS..PPolyproline II helixtrans-73.7138.2173.3-63.1-174.7176.700110.4V87 R99 S101V87-E89 PolarHBondContact O-N 3.13Å; E89-R99 PolarHBondContact N-O 3.22Å; E89-R99 VanDerWaalsContact N-O 3.07Å; E89-S101 WeakPolarHBondContact OE1-CB 3.26Å
90E84Confident87.4Confident117 Ų11779.8 Ų79.855%0.54745%0.445SS..SBendtrans-95.9126.9175.4-69.4-71.7170.700109.2R129E90-R129 VanDerWaalsContact CG-NH1 3.34Å; E90-R129 VanDerWaalsContact CG-NH2 3.28Å; E90-R129 VanDerWaalsContact OE1-CD 3.24Å; E90-R129 WeakPolarHBondContact OE1-CD 3.18Å; E90-R129 IonicContact OE1-CZ 3.54Å; E90-R129 IonicContact OE1-NE 3.12Å; E90-R129 PolarHBondContact OE1-NE 3.02Å; E90-R129 VanDerWaalsContact OE1-NE 3.12Å; E90-R129 IonicContact OE1-NH1 3.87Å
91G84.3Confident87.6Confident60 Ų6075.9 Ų75.962%0.61943%0.426SS*.SBendtrans131174.7-171.700000111P93G91-P93 WeakPolarHBondContact O-CD 3.27Å
92S75.7Confident87.3Confident119 Ų11970.7 Ų70.783%0.83241%0.405SS*.  trans-85.199.1164.862.40000107.8G94S92-G94 PolarHBondContact O-N 3.09Å
93P68Low87.5Confident48 Ų4873.2 Ų73.231%0.31242%0.421SS..  trans-54.7145.7160.624.2-31.3000107.5G91 A97G91-P93 WeakPolarHBondContact O-CD 3.27Å; P93-A97 HydrophobicContact CB-CB 3.62Å
94G81Confident87.7Confident51 Ų5172.2 Ų72.253%0.52641%0.412SS..  trans-50.6158.8169.200000110.2S92 L96 A97S92-G94 PolarHBondContact O-N 3.09Å; G94-L96 PolarHBondContact O-N 3.15Å; G94-A97 PolarHBondContact O-N 2.95Å
95I82.2Confident87.6Confident179 Ų17971 Ų7192%0.91841%0.412SS*.THydrogen-bonded Turntrans-49.9-28-173.3-63.4172.2000112.9
96L84.2Confident87.6Confident169 Ų16971.9 Ų71.989%0.88542%0.417SS*.THydrogen-bonded Turntrans-105.3-5.4-177.9-55.7178.6000114.7G94G94-L96 PolarHBondContact O-N 3.15Å
97A87.1Confident87.5Confident46 Ų4672 Ų7238%0.3842%0.421SS..SBendtrans-80.2138-178.600000110.6P93 G94 R99P93-A97 HydrophobicContact CB-CB 3.62Å; G94-A97 PolarHBondContact O-N 2.95Å; A97-R99 PolarHBondContact O-N 2.89Å
98P88.5Confident87.5Confident89 Ų8979.8 Ų79.858%0.57845%0.45SS*.  trans-65.7133.6-178.128.1-34.3000110.3Y100P98-Y100 PolarHBondContact O-N 3.05Å
99R90.7Very high87.4Confident140 Ų14081.5 Ų81.553%0.52846%0.456SS..SBendtrans-66.1-21.5177.9-175.2171.6-175.4174.45.2113.5R88 E89 A97R88-R99 WeakPolarHBondContact CA-O 3.39Å; R88-R99 HydrophobicContact CG-CG 4.22Å; E89-R99 PolarHBondContact N-O 3.22Å; E89-R99 VanDerWaalsContact N-O 3.07Å; A97-R99 PolarHBondContact O-N 2.89Å
100Y92.7Very high87.4Confident74 Ų7481.8 Ų81.829%0.2946%0.464SS..EExtended strand (participates in β ladder)trans-117126.2178-69.2-96.1000108.8F86 V87 R88 P98 K131F86-Y100 HydrophobicContact CB-CD1 4.18Å; V87-Y100 CarbonylContact O-C 3.46Å; V87-Y100 VanDerWaalsContact O-CA 3.31Å; V87-Y100 WeakPolarHBondContact O-CA 3.1Å; R88-Y100 HydrophobicContact CB-CD1 4.03Å; R88-Y100 HydrophobicContact CB-CE1 3.76Å; P98-Y100 PolarHBondContact O-N 3.05Å; Y100-K131 HydrophobicContact CE1-CD 4.04Å; Y100-K131 HydrophobicContact CE1-CG 4Å; Y100-K131 WeakPolarHBondContact OH-CE 3.37Å
101S91Very high87.7Confident23 Ų2385 Ų8516%0.16148%0.478CS..EExtended strand (participates in β ladder)trans-71.6149.5165.6-1640000109.2F86 V87 E89 H104F86-S101 WeakPolarHBondContact CD1-O 3.44Å; V87-S101 PolarHBondContact N-O 3.34Å; V87-S101 VanDerWaalsContact N-O 3.14Å; V87-S101 PolarHBondContact O-N 2.77Å; E89-S101 WeakPolarHBondContact OE1-CB 3.26Å; S101-H104 WeakPolarHBondContact CB-NE2 3.07Å; S101-H104 PolarHBondContact OG-NE2 2.85Å
102G83.5Confident88Confident31 Ų3190 Ų9032%0.3248%0.483SS..EExtended strand (participates in β ladder)trans-55.4-167.8-165.900000117V85 F86 H104V85-G102 VanDerWaalsContact O-O 3.12Å; F86-G102 VanDerWaalsContact CD1-C 3.44Å; G102-H104 PolarHBondContact O-CD2 2.94Å; G102-H104 PolarHBondContact O-N 3.47Å; G102-H104 VanDerWaalsContact O-N 3.07Å; G102-H104 PolarHBondContact O-NE2 3.36Å
103P92.4Very high88.9Confident65 Ų6586.4 Ų86.442%0.42246%0.456SS..EExtended strand (participates in β ladder)trans-71.9106.4178.329.4-31.5000109.7H84 F86 A133H84-P103 HydrophobicContact CB-CB 3.95Å; F86-P103 HydrophobicContact CE1-CB 4.5Å; P103-A133 HydrophobicContact CB-CB 3.98Å
104H94.3Very high90.1Very high19 Ų1984.3 Ų84.39%0.08844%0.442CS..EExtended strand (participates in β ladder)trans-93.4136.6173.5-61.1-72.2000109.7H84 V85 S101 G102 I116 E117H84-H104 CarbonylContact C-O 3.58Å; H84-H104 VanDerWaalsContact CA-O 3.29Å; H84-H104 WeakPolarHBondContact CA-O 3.47Å; V85-H104 PolarHBondContact N-O 3.31Å; V85-H104 PolarHBondContact O-N 3.26Å; S101-H104 WeakPolarHBondContact CB-NE2 3.07Å; S101-H104 PolarHBondContact OG-NE2 2.85Å; G102-H104 PolarHBondContact O-CD2 2.94Å; G102-H104 PolarHBondContact O-N 3.47Å; G102-H104 VanDerWaalsContact O-N 3.07Å; G102-H104 PolarHBondContact O-NE2 3.36Å; H104-I116 HydrophobicContact CB-CB 4.03Å; H104-I116 HydrophobicContact CB-CD1 4.03Å; H104-I116 HydrophobicContact CB-CG2 4.46Å; H104-E117 PolarHBondContact ND1-O 3.15Å
105A93.5Very high90.8Very high29 Ų2982.7 Ų82.724%0.2442%0.422CS..EExtended strand (participates in β ladder)trans-69.1133.1177.500000110.2I116 E117A105-I116 CarbonylContact O-C 3.53Å; A105-I116 VanDerWaalsContact O-CA 3.26Å; A105-I116 WeakPolarHBondContact O-CA 3.3Å; A105-E117 PolarHBondContact O-N 2.68Å
106V94.1Very high91.4Very high18 Ų1874.2 Ų74.211%0.10938%0.379CS..EExtended strand (participates in β ladder)trans-89.5115178-178.30000109.6S83 V85 R109 L114 I116S83-V106 PolarHBondContact O-N 3.32Å; S83-V106 VanDerWaalsContact O-N 3.11Å; V85-V106 HydrophobicContact CB-CG2 4.21Å; V85-V106 HydrophobicContact CG1-CG2 3.64Å; V85-V106 HydrophobicContact CG2-CG2 3.66Å; V106-R109 HydrophobicContact CG1-CG 3.72Å; V106-L114 HydrophobicContact CG1-CD2 4.01Å; V106-I116 HydrophobicContact CG2-CG2 4.36Å
107L93.1Very high91.9Very high78 Ų7870.7 Ų70.741%0.40836%0.358SS..EExtended strand (participates in β ladder)trans-87.4-46.9-179.6-60176.8000112.1V115 E117 E122L107-V115 PolarHBondContact N-O 3.22Å; L107-E117 HydrophobicContact CD1-CB 4.13Å; L107-E117 HydrophobicContact CG-CB 4.33Å; L107-E122 HydrophobicContact CD1-CG 3.66Å
108R92.8Very high92.2Very high167 Ų16770.6 Ų70.663%0.6335%0.349SS*.EExtended strand (participates in β ladder)trans-139.8147.5-178.2-59.7178.9174.7166-0.4111.2V115R108-V115 HydrophobicContact CB-CB 3.98Å; R108-V115 HydrophobicContact CB-CG2 4.05Å; R108-V115 PolarHBondContact N-O 2.98Å; R108-V115 PolarHBondContact O-N 2.86Å
109R91.4Very high92.2Very high110 Ų11074 Ų7442%0.41536%0.363SS..EExtended strand (participates in β ladder)trans-122.1136.1-178.8-54.4-170.9-178.772.57.6111.1N80 C82 V106 L114N80-R109 WeakPolarHBondContact O-CD 3.26Å; N80-R109 PolarHBondContact O-NE 3.07Å; C82-R109 PolarHBondContact O-NH2 3.25Å; V106-R109 HydrophobicContact CG1-CG 3.72Å; R109-L114 HydrophobicContact CB-CD2 3.97Å; R109-L114 HydrophobicContact CG-CD2 3.63Å
110T92Very high92.2Very high86 Ų8670.3 Ų70.353%0.52837%0.369SS..  trans-126.7167.3171.1-53.60000108.6K112 T113T110-K112 PolarHBondContact O-N 3.07Å; T110-K112 VanDerWaalsContact O-N 3.12Å; T110-T113 WeakPolarHBondContact CA-O 3.39Å; T110-T113 WeakPolarHBondContact CB-O 3.44Å; T110-T113 PolarHBondContact N-O 3.33Å
111Q88.9Confident92.2Very high184 Ų18469.3 Ų69.386%0.8638%0.376SS*.SBendtrans-59.8-22.3179.7-65.7-178.9-7.400115.2I127Q111-I127 VanDerWaalsContact O-CD1 3.31Å; Q111-I127 WeakPolarHBondContact O-CD1 3.04Å
112K92Very high92.3Very high165 Ų16574.3 Ų74.372%0.71740%0.397SS*.SBendtrans-127-16.3-177.1-66.9-175.9179.6177.70114.1T110 I127T110-K112 PolarHBondContact O-N 3.07Å; T110-K112 VanDerWaalsContact O-N 3.12Å; K112-I127 WeakPolarHBondContact O-CG1 3.42Å; K112-I127 PolarHBondContact O-N 3.38Å
113T94.1Very high92.8Very high44 Ų4475.1 Ų75.127%0.2740%0.395SS..EExtended strand (participates in β ladder)trans-137.4150.6-172.655.30000111.3T110 T124 V125T110-T113 WeakPolarHBondContact CA-O 3.39Å; T110-T113 WeakPolarHBondContact CB-O 3.44Å; T110-T113 PolarHBondContact N-O 3.33Å; T113-T124 HydrophobicContact CG2-CG2 4.09Å; T113-V125 CarbonylContact C-O 3.47Å; T113-V125 WeakPolarHBondContact CA-O 3.4Å; T113-V125 WeakPolarHBondContact CB-O 3.4Å
114L93.1Very high93Very high3 Ų376.5 Ų76.52%0.01640%0.403CS..EExtended strand (participates in β ladder)trans-118.8134.8173.5-65.5165.7000107.5L79 V85 V106 R109 I116 V125 I127 T130L79-L114 HydrophobicContact CD2-CD1 4.46Å; V85-L114 HydrophobicContact CG1-CD1 4.32Å; V106-L114 HydrophobicContact CG1-CD2 4.01Å; R109-L114 HydrophobicContact CB-CD2 3.97Å; R109-L114 HydrophobicContact CG-CD2 3.63Å; L114-I116 HydrophobicContact CB-CG2 4.4Å; L114-V125 HydrophobicContact CB-CG2 4.05Å; L114-V125 PolarHBondContact N-O 2.93Å; L114-V125 WeakPolarHBondContact O-CG2 3.27Å; L114-V125 PolarHBondContact O-N 3.45Å; L114-I127 HydrophobicContact CD1-CG1 4.3Å; L114-I127 HydrophobicContact CG-CG1 4.09Å; L114-T130 HydrophobicContact CD1-CG2 3.96Å; L114-T130 WeakPolarHBondContact CD1-OG1 3.31Å
115V95.9Very high93Very high18 Ų1875.9 Ų75.911%0.10940%0.4CS..EExtended strand (participates in β ladder)trans-94.6117.4168.5-175.30000106.6L107 R108 E122 V123L107-V115 PolarHBondContact N-O 3.22Å; R108-V115 HydrophobicContact CB-CB 3.98Å; R108-V115 HydrophobicContact CB-CG2 4.05Å; R108-V115 PolarHBondContact N-O 2.98Å; R108-V115 PolarHBondContact O-N 2.86Å; V115-E122 HydrophobicContact CG1-CB 4.01Å; V115-V123 WeakPolarHBondContact CA-O 3.3Å
116I95.2Very high93Very high0 Ų076.6 Ų76.60%041%0.406CS..EExtended strand (participates in β ladder)trans-114.1154.3-178.661.4172.2000110V85 V87 H104 A105 V106 L114 Q118 E122 V123 V125V85-I116 HydrophobicContact CG2-CG2 3.62Å; V87-I116 HydrophobicContact CB-CD1 4.35Å; V87-I116 HydrophobicContact CG1-CD1 4.4Å; V87-I116 HydrophobicContact CG2-CD1 3.34Å; H104-I116 HydrophobicContact CB-CB 4.03Å; H104-I116 HydrophobicContact CB-CD1 4.03Å; H104-I116 HydrophobicContact CB-CG2 4.46Å; A105-I116 CarbonylContact O-C 3.53Å; A105-I116 VanDerWaalsContact O-CA 3.26Å; A105-I116 WeakPolarHBondContact O-CA 3.3Å; V106-I116 HydrophobicContact CG2-CG2 4.36Å; L114-I116 HydrophobicContact CB-CG2 4.4Å; I116-Q118 HydrophobicContact CD1-CB 4.42Å; I116-E122 WeakPolarHBondContact O-CA 3.25Å; I116-V123 HydrophobicContact CG1-CB 4.14Å; I116-V123 WeakPolarHBondContact CG1-O 3.44Å; I116-V123 PolarHBondContact N-O 2.91Å; I116-V123 PolarHBondContact O-N 3.42Å; I116-V125 HydrophobicContact CD1-CG1 3.76Å; I116-V125 HydrophobicContact CD1-CG2 4.07Å; I116-V125 HydrophobicContact CG1-CG1 4.23Å; I116-V125 HydrophobicContact CG1-CG2 4.26Å; I116-V125 HydrophobicContact CG2-CG2 4.07Å
117E94.5Very high92.9Very high96 Ų9676.9 Ų76.945%0.44941%0.407SS..EExtended strand (participates in β ladder)trans-88.6113.4166.4-172.1179.6-15600109.3H104 A105 L107H104-E117 PolarHBondContact ND1-O 3.15Å; A105-E117 PolarHBondContact O-N 2.68Å; L107-E117 HydrophobicContact CD1-CB 4.13Å; L107-E117 HydrophobicContact CG-CB 4.33Å
118Q91.8Very high92.8Very high43 Ų4379.8 Ų79.820%0.20142%0.422CS..EExtended strand (participates in β ladder)trans-123.3119.6176.7-175.9172.31500108.9I116 G120 A121 V123I116-Q118 HydrophobicContact CD1-CB 4.42Å; Q118-G120 PolarHBondContact O-N 3.45Å; Q118-A121 PolarHBondContact N-O 3.48Å; Q118-A121 PolarHBondContact O-N 3.49Å; Q118-V123 HydrophobicContact CB-CB 4.46Å; Q118-V123 HydrophobicContact CB-CG2 3.97Å
119N89.3Confident92.8Very high160 Ų16075.1 Ų75.186%0.85641%0.405SS*.THydrogen-bonded Turntrans52.934.1-177.8-56.4-30.1000113.9A121N119-A121 VanDerWaalsContact C-N 3.3Å; N119-A121 PolarHBondContact O-N 3.44Å
120G89.8Confident92.9Very high64 Ų6470.4 Ų70.466%0.6639%0.388SS*.THydrogen-bonded Turntrans78.84.9-178.300000115.2Q118Q118-G120 PolarHBondContact O-N 3.45Å
121A93Very high92.9Very high52 Ų5271.4 Ų71.443%0.4339%0.385SS..EExtended strand (participates in β ladder)trans-111.4147.4173.800000111.2Q118 N119 V123Q118-A121 PolarHBondContact N-O 3.48Å; Q118-A121 PolarHBondContact O-N 3.49Å; N119-A121 VanDerWaalsContact C-N 3.3Å; N119-A121 PolarHBondContact O-N 3.44Å; A121-V123 PolarHBondContact O-N 3.24Å
122E94.7Very high93.1Very high129 Ų12963.8 Ų63.860%0.60335%0.352SS*.EExtended strand (participates in β ladder)trans-78.7118.1172.8-59.1-165.9170.200110.3L107 V115 I116L107-E122 HydrophobicContact CD1-CG 3.66Å; V115-E122 HydrophobicContact CG1-CB 4.01Å; I116-E122 WeakPolarHBondContact O-CA 3.25Å
123V93.9Very high93.1Very high48 Ų4856.1 Ų56.129%0.29132%0.319SS..EExtended strand (participates in β ladder)trans-117.3131.3178.8-177.90000109.5V115 I116 Q118 A121 V125V115-V123 WeakPolarHBondContact CA-O 3.3Å; I116-V123 HydrophobicContact CG1-CB 4.14Å; I116-V123 WeakPolarHBondContact CG1-O 3.44Å; I116-V123 PolarHBondContact N-O 2.91Å; I116-V123 PolarHBondContact O-N 3.42Å; Q118-V123 HydrophobicContact CB-CB 4.46Å; Q118-V123 HydrophobicContact CB-CG2 3.97Å; A121-V123 PolarHBondContact O-N 3.24Å; V123-V125 HydrophobicContact CG1-CG1 4.02Å
124T95.1Very high92.7Very high94 Ų9460.4 Ų60.458%0.57733%0.334SS*.EExtended strand (participates in β ladder)trans-90.7118.7174.2-58.90000110T113T113-T124 HydrophobicContact CG2-CG2 4.09Å
125V94.1Very high92.2Very high6 Ų663.1 Ų63.14%0.03635%0.348CS..EExtended strand (participates in β ladder)trans-118.3146.6179.7-62.30000111.1V87 T113 L114 I116 V123 T130V87-V125 HydrophobicContact CG1-CG1 3.95Å; T113-V125 CarbonylContact C-O 3.47Å; T113-V125 WeakPolarHBondContact CA-O 3.4Å; T113-V125 WeakPolarHBondContact CB-O 3.4Å; L114-V125 HydrophobicContact CB-CG2 4.05Å; L114-V125 PolarHBondContact N-O 2.93Å; L114-V125 WeakPolarHBondContact O-CG2 3.27Å; L114-V125 PolarHBondContact O-N 3.45Å; I116-V125 HydrophobicContact CD1-CG1 3.76Å; I116-V125 HydrophobicContact CD1-CG2 4.07Å; I116-V125 HydrophobicContact CG1-CG1 4.23Å; I116-V125 HydrophobicContact CG1-CG2 4.26Å; I116-V125 HydrophobicContact CG2-CG2 4.07Å; V123-V125 HydrophobicContact CG1-CG1 4.02Å; V125-T130 HydrophobicContact CB-CG2 4.41Å; V125-T130 HydrophobicContact CG2-CG2 3.61Å
126A93.8Very high91.2Very high43 Ų4367.9 Ų67.936%0.35539%0.39SS..EExtended strand (participates in β ladder)trans-75.6143.4173.900000111D128 R129A126-D128 PolarHBondContact O-N 3.16Å; A126-R129 PolarHBondContact O-N 3.39Å
127I92.7Very high89.7Confident25 Ų2572.8 Ų72.813%0.12842%0.424CS..G310 helixtrans-57-36.1-178.8-68.7170.9000112.1V75 L79 Q111 K112 L114 R129 T130V75-I127 HydrophobicContact CG1-CG2 3.85Å; V75-I127 HydrophobicContact CG2-CG2 4.5Å; L79-I127 HydrophobicContact CD1-CG2 3.93Å; Q111-I127 VanDerWaalsContact O-CD1 3.31Å; Q111-I127 WeakPolarHBondContact O-CD1 3.04Å; K112-I127 WeakPolarHBondContact O-CG1 3.42Å; K112-I127 PolarHBondContact O-N 3.38Å; L114-I127 HydrophobicContact CD1-CG1 4.3Å; L114-I127 HydrophobicContact CG-CG1 4.09Å; I127-R129 PolarHBondContact O-N 3.47Å; I127-R129 VanDerWaalsContact O-N 3.11Å; I127-T130 PolarHBondContact O-N 3.24Å; I127-T130 PolarHBondContact O-OG1 3.03Å
128D91.1Very high87.9Confident138 Ų13870 Ų7074%0.73841%0.412SS*.G310 helixtrans-58.5-25.2178.9-174.473.6000113.6A126A126-D128 PolarHBondContact O-N 3.16Å
129R92.5Very high86.2Confident69 Ų6973.7 Ų73.726%0.2644%0.44SS..G310 helixtrans-93.41.2179.3-67.9177.854.2-165-8.8113.3R88 E90 A126 I127R88-R129 HydrophobicContact CB-CB 4.25Å; R88-R129 WeakPolarHBondContact CB-O 3.35Å; R88-R129 PolarHBondContact N-O 3.38Å; R88-R129 PolarHBondContact O-NE 3.15Å; R88-R129 PolarHBondContact O-NH2 2.96Å; E90-R129 VanDerWaalsContact CG-NH1 3.34Å; E90-R129 VanDerWaalsContact CG-NH2 3.28Å; E90-R129 VanDerWaalsContact OE1-CD 3.24Å; E90-R129 WeakPolarHBondContact OE1-CD 3.18Å; E90-R129 IonicContact OE1-CZ 3.54Å; E90-R129 IonicContact OE1-NE 3.12Å; E90-R129 PolarHBondContact OE1-NE 3.02Å; E90-R129 VanDerWaalsContact OE1-NE 3.12Å; E90-R129 IonicContact OE1-NH1 3.87Å; A126-R129 PolarHBondContact O-N 3.39Å; I127-R129 PolarHBondContact O-N 3.47Å; I127-R129 VanDerWaalsContact O-N 3.11Å
130T93.2Very high84.5Confident11 Ų1171.1 Ų71.17%0.06743%0.434CS..EExtended strand (participates in β ladder)trans-111149.6-174.763.30000112.5V85 F86 V87 L114 V125 I127V85-T130 HydrophobicContact CG2-CG2 4.49Å; F86-T130 CarbonylContact O-C 3.59Å; F86-T130 VanDerWaalsContact O-CA 3.25Å; F86-T130 WeakPolarHBondContact O-CA 3.43Å; V87-T130 HydrophobicContact CG2-CG2 4.39Å; L114-T130 HydrophobicContact CD1-CG2 3.96Å; L114-T130 WeakPolarHBondContact CD1-OG1 3.31Å; V125-T130 HydrophobicContact CB-CG2 4.41Å; V125-T130 HydrophobicContact CG2-CG2 3.61Å; I127-T130 PolarHBondContact O-N 3.24Å; I127-T130 PolarHBondContact O-OG1 3.03Å
131K93.1Very high82.6Confident108 Ų10872.3 Ų72.347%0.4744%0.438SS..EExtended strand (participates in β ladder)trans-125.9144166.3-70.2-171.9175-174.70109.5V85 F86 Y100 A133V85-K131 CarbonylContact C-O 3.52Å; V85-K131 VanDerWaalsContact CA-O 3.22Å; V85-K131 WeakPolarHBondContact CA-O 3.4Å; V85-K131 WeakPolarHBondContact CB-O 3.39Å; F86-K131 HydrophobicContact CB-CB 4.31Å; F86-K131 PolarHBondContact N-O 2.96Å; F86-K131 PolarHBondContact O-N 3.02Å; Y100-K131 HydrophobicContact CE1-CD 4.04Å; Y100-K131 HydrophobicContact CE1-CG 4Å; Y100-K131 WeakPolarHBondContact OH-CE 3.37Å; K131-A133 PolarHBondContact O-N 3.25Å
132P93Very high80.3Confident24 Ų2475.4 Ų75.416%0.15645%0.452CS..EExtended strand (participates in β ladder)trans-64.4135.1173.128.1-33.2000109.9R78 L79 C82 F134R78-P132 HydrophobicContact CB-CB 4.42Å; R78-P132 HydrophobicContact CB-CG 4.49Å; L79-P132 HydrophobicContact CD2-CB 4.2Å; C82-P132 HydrophobicContact CB-CB 4.13Å; P132-F134 HydrophobicContact CB-CZ 4.4Å; P132-F134 HydrophobicContact CG-CZ 4.16Å
133A90.9Very high77.7Confident3 Ų375.7 Ų75.73%0.02546%0.462CS..EExtended strand (participates in β ladder)trans-93.2139.1168.800000109.2H84 F86 P103 K131H84-A133 HydrophobicContact CB-CB 3.91Å; H84-A133 WeakPolarHBondContact O-CB 3.38Å; H84-A133 PolarHBondContact O-N 3.4Å; F86-A133 HydrophobicContact CD2-CB 3.66Å; F86-A133 HydrophobicContact CE2-CB 3.38Å; F86-A133 HydrophobicContact CG-CB 4.49Å; F86-A133 HydrophobicContact CZ-CB 4.01Å; P103-A133 HydrophobicContact CB-CB 3.98Å; K131-A133 PolarHBondContact O-N 3.25Å
134F86.9Confident75.2Confident135 Ų13577.5 Ų77.559%0.59248%0.482SS*.  trans-106109.1175.4-59.2-64.5000108P132P132-F134 HydrophobicContact CB-CZ 4.4Å; P132-F134 HydrophobicContact CG-CZ 4.16Å
135L80.9Confident72.8Confident60 Ų6078.7 Ų78.731%0.31449%0.492SS..  trans-96.7145.8172.5-59.1-176.8000109H84 S137 D138H84-L135 HydrophobicContact CB-CD1 4.31Å; H84-L135 VanDerWaalsContact CE1-CD1 3.49Å; H84-L135 WeakPolarHBondContact CE1-CD1 3.49Å; H84-L135 VanDerWaalsContact ND1-CD1 3.29Å; H84-L135 WeakPolarHBondContact ND1-CD1 3.48Å; L135-S137 PolarHBondContact O-N 3.4Å; L135-S137 VanDerWaalsContact O-N 3.08Å; L135-D138 PolarHBondContact N-OD2 2.83Å; L135-D138 VanDerWaalsContact N-OD2 3.12Å; L135-D138 PolarHBondContact O-N 2.85Å; L135-D138 VanDerWaalsContact O-N 3.13Å
136A75.1Confident70.2Confident118 Ų11883.2 Ų83.298%0.97553%0.53SS*.THydrogen-bonded Turntrans-61.7-18.3179.900000113.2
137S64.4Low67.6Low103 Ų10387.6 Ų87.672%0.7255%0.552SS**THydrogen-bonded Turntrans-90.2-1.3179.395.40000114.2L135 P139L135-S137 PolarHBondContact O-N 3.4Å; L135-S137 VanDerWaalsContact O-N 3.08Å; S137-P139 VanDerWaalsContact O-CD 3.23Å; S137-P139 WeakPolarHBondContact O-CD 3.42Å
138D56.4Low65.1Low37 Ų3790.9 Ų90.920%0.19858%0.578CS.*  trans-74.8114.8178.4-67.5-44.4000109.3S83 L135 S140 A141S83-D138 PolarHBondContact OG-OD1 3.21Å; L135-D138 PolarHBondContact N-OD2 2.83Å; L135-D138 VanDerWaalsContact N-OD2 3.12Å; L135-D138 PolarHBondContact O-N 2.85Å; L135-D138 VanDerWaalsContact O-N 3.13Å; D138-S140 PolarHBondContact O-N 3.07Å; D138-A141 PolarHBondContact O-N 3.38Å
139P56.9Low62.9Low120 Ų12090 Ų9078%0.77958%0.58SS**G310 helixtrans-66-10.8-177.526.6-34.6000113.5S137 A141S137-P139 VanDerWaalsContact O-CD 3.23Å; S137-P139 WeakPolarHBondContact O-CD 3.42Å; P139-A141 PolarHBondContact O-N 2.89Å
140S52.8Low60.3Low107 Ų10796.1 Ų96.175%0.74861%0.608SS**G310 helixtrans-75.8-5.8176.6179.90000114D138 T142D138-S140 PolarHBondContact O-N 3.07Å; S140-T142 PolarHBondContact O-N 2.94Å
141A50.2Low57.8Low88 Ų88107.2 Ų107.273%0.72765%0.648SS**G310 helixtrans-70.9-15172.900000112.9D138 P139D138-A141 PolarHBondContact O-N 3.38Å; P139-A141 PolarHBondContact O-N 2.89Å
142T45.1Very low55.6Low118 Ų118109.2 Ų109.272%0.72466%0.663SS**SBendtrans-93.8105.9176.3-58.80000109.8S140S140-T142 PolarHBondContact O-N 2.94Å
143T38.8Very low52.9Low134 Ų134110.8 Ų110.882%0.82268%0.683SS**SBendtrans115.977167-43.80000114.4
144A41.7Very low50.5Low87 Ų87115.7 Ų115.772%0.71972%0.717SS**  -166.2130.6128.500000108.7
145P44.7Very low48.7Very low118 Ų118115.8 Ų115.877%0.76672%0.723SS**  trans-66.7149.8-169.728.4-33.7000110.6T147P145-T147 VanDerWaalsContact C-N 3.34Å; P145-T147 PolarHBondContact O-N 3.06Å
146A39.6Very low46.6Very low102 Ų102122.1 Ų122.184%0.84374%0.744SS**  trans-45.1100165.700000109.2S148A146-S148 PolarHBondContact O-N 3.28Å
147T39.1Very low45.2Very low135 Ų135122.6 Ų122.683%0.82873%0.734SS**  trans-67.4108.51635.30000104P145P145-T147 VanDerWaalsContact C-N 3.34Å; P145-T147 PolarHBondContact O-N 3.06Å
148S39.9Very low43.9Very low94 Ų94122.3 Ų122.366%0.65773%0.731SS**  trans-42.6135179.344.20000109.9A146 K150A146-S148 PolarHBondContact O-N 3.28Å; S148-K150 PolarHBondContact O-N 3.05Å
149P45.5Very low43.4Very low120 Ų120126 Ų12678%0.77976%0.755SS**  trans-54.8118.3171.622.4-30.4000106.5R151P149-R151 VanDerWaalsContact C-N 3.32Å; P149-R151 PolarHBondContact O-N 3.36Å
150K39Very low43Very low196 Ų196129.6 Ų129.685%0.85276%0.759SS**  trans-51.4107.7167.2-75-176.5177.8-177.80105S148 I152S148-K150 PolarHBondContact O-N 3.05Å; K150-I152 PolarHBondContact O-N 3.07Å
151R39.6Very low42.7Very low244 Ų244128.6 Ų128.692%0.92176%0.757SS**  trans-51.496.8169.8-93.1179.2167-178.4-3.7105.6P149 G153P149-R151 VanDerWaalsContact C-N 3.32Å; P149-R151 PolarHBondContact O-N 3.36Å; R151-G153 PolarHBondContact O-N 3.49Å
152I46.1Very low42.3Very low150 Ų150127.1 Ų127.177%0.76975%0.75SS**  trans-62.9104.4160.6-72.3167.9000102.5K150 S154K150-I152 PolarHBondContact O-N 3.07Å; I152-S154 PolarHBondContact O-N 3.45Å
153G37.1Very low42.1Very low57 Ų57131 Ų13159%0.58875%0.752SS**  trans-49.1132.7-17100000109.6R151 I155R151-G153 PolarHBondContact O-N 3.49Å; G153-I155 PolarHBondContact O-N 3.42Å
154S40Very low42.7Very low106 Ų106129.3 Ų129.374%0.74174%0.744SS**  trans10.480.9152.7-171.10000112.4I152 Y156I152-S154 PolarHBondContact O-N 3.45Å; S154-Y156 PolarHBondContact O-N 3.08Å
155I49.1Very low43.1Very low137 Ų137130.1 Ų130.170%0.70374%0.736SS**  trans-60.1108.4159.7-64.4173000102.3G153 V157G153-I155 PolarHBondContact O-N 3.42Å; I155-V157 PolarHBondContact O-N 3.25Å
156Y37.9Very low43.5Very low194 Ų194131.5 Ų131.576%0.76173%0.733SS**  trans-49.499.9164.4-101.6-102.3000105.2S154 C158S154-Y156 PolarHBondContact O-N 3.08Å; Y156-C158 PolarHBondContact O-N 3.4Å
157V45Very low43.8Very low128 Ų128133.2 Ų133.278%0.77672%0.721SS**  trans-64.880.2151.6-107.20000103.3I155 T159I155-V157 PolarHBondContact O-N 3.25Å; V157-T159 PolarHBondContact O-N 3.47Å
158C38.3Very low44.6Very low96 Ų96129.7 Ų129.765%0.64970%0.702SS**  trans-57.595154.4-74.80000103.8Y156 F160Y156-C158 PolarHBondContact O-N 3.4Å; C158-F160 PolarHBondContact O-N 3.04Å
159T45.5Very low45.1Very low114 Ų114134 Ų13470%0.69970%0.704SS**  trans-46.6119.8168.4370000106.7V157 A161 G162V157-T159 PolarHBondContact O-N 3.47Å; T159-A161 PolarHBondContact O-N 3.11Å; T159-G162 PolarHBondContact O-N 3.32Å
160F48Very low45.6Very low196 Ų196134.6 Ų134.686%0.8670%0.696SS**THydrogen-bonded Turntrans-43.7-15.6-178.1-103.3-107.6000115.4C158 G162C158-F160 PolarHBondContact O-N 3.04Å; F160-G162 VanDerWaalsContact C-N 3.28Å; F160-G162 PolarHBondContact O-N 3.17Å
161A47.7Very low46.2Very low87 Ų87128.1 Ų128.172%0.71968%0.679SS**THydrogen-bonded Turntrans-60.8-28.8178.800000114.4T159T159-A161 PolarHBondContact O-N 3.11Å
162G40.5Very low46.9Very low56 Ų56122.7 Ų122.758%0.57767%0.665SS**THydrogen-bonded Turntrans-88.3-23.9-176.500000115.6T159 F160T159-G162 PolarHBondContact O-N 3.32Å; F160-G162 VanDerWaalsContact C-N 3.28Å; F160-G162 PolarHBondContact O-N 3.17Å
163W40.2Very low47.1Very low200 Ų200117.7 Ų117.776%0.75865%0.645SS**Hα-helixtrans-92.3-17.8-173.2-141.750.3000113.4
164C51.6Low48.1Very low99 Ų99119.4 Ų119.467%0.66965%0.645SS**Hα-helixtrans-71.2-34.3176.2-151.20000112S168C164-S168 PolarHBondContact O-N 3.01Å
165D50.5Low48.9Very low103 Ų103117.6 Ų117.655%0.55163%0.632SS**Hα-helixtrans-78.3-29.6-173.2-152.322.7000113
166Q52.8Low49.3Very low147 Ų147115.3 Ų115.369%0.68762%0.624SS**Hα-helixtrans-73.7-35.3176.8-159.6771300112.2
167F46.8Very low50.1Low138 Ų138111.3 Ų111.361%0.60562%0.616SS**Hα-helixtrans-75.3-29.7179.4-113.7-86.5000112.7R169 Q170 A171F167-R169 PolarHBondContact O-N 2.82Å; F167-Q170 PolarHBondContact O-N 3.29Å; F167-A171 PolarHBondContact O-N 3.22Å; F167-A171 VanDerWaalsContact O-N 3.15Å
168S54.6Low50.6Low61 Ų61113.4 Ų113.443%0.42761%0.611SS.*Hα-helixtrans-66.5-36.8177.5-161.80000112.2C164 Q172C164-S168 PolarHBondContact O-N 3.01Å; S168-Q172 PolarHBondContact O-N 3.24Å
169R52.2Low51.5Low185 Ų185113.9 Ų113.970%0.69861%0.607SS**Hα-helixtrans-71.4-35.4178.2-67.8-169.4-172.2-115.21.7113F167 A173F167-R169 PolarHBondContact O-N 2.82Å; R169-A173 PolarHBondContact O-N 2.94Å
170Q54.2Low51.8Low132 Ų132117.2 Ų117.262%0.61761%0.606SS**Hα-helixtrans-73.8-37.2179.2-160.866.123.900111.9F167 Q172 A173 V174F167-Q170 PolarHBondContact O-N 3.29Å; Q170-Q172 PolarHBondContact O-N 3.47Å; Q170-A173 PolarHBondContact O-N 2.87Å; Q170-V174 WeakPolarHBondContact O-CG2 3.45Å; Q170-V174 PolarHBondContact O-N 2.88Å
171A52.9Low52.2Low60 Ų60115.7 Ų115.750%0.49660%0.595SS.*Hα-helixtrans-67.3-35-178.800000113.3F167F167-A171 PolarHBondContact O-N 3.22Å; F167-A171 VanDerWaalsContact O-N 3.15Å
172Q53.1Low52.1Low131 Ų131113.6 Ų113.661%0.61257%0.574SS**Hα-helixtrans-73.5-32.5176.4-70178.7-84.900112.5S168 Q170 S175 V176S168-Q172 PolarHBondContact O-N 3.24Å; Q170-Q172 PolarHBondContact O-N 3.47Å; Q172-S175 PolarHBondContact O-N 3.07Å; Q172-V176 WeakPolarHBondContact O-CG2 3.38Å; Q172-V176 PolarHBondContact O-N 3.3Å
173A52.1Low52.5Low44 Ų44118 Ų11836%0.36458%0.58SS.*Hα-helixtrans-64.5-45.3179.200000112.4R169 Q170 S175 V176 D177R169-A173 PolarHBondContact O-N 2.94Å; Q170-A173 PolarHBondContact O-N 2.87Å; A173-S175 VanDerWaalsContact C-N 3.33Å; A173-S175 PolarHBondContact O-N 3.49Å; A173-V176 PolarHBondContact O-N 2.97Å; A173-D177 PolarHBondContact O-N 2.72Å; A173-D177 VanDerWaalsContact O-N 3.11Å
174V56.5Low53Low94 Ų94111.3 Ų111.357%0.5756%0.564SS**Hα-helixtrans-67.5-32.1-179.6-120.70000112.8Q170 Y178Q170-V174 WeakPolarHBondContact O-CG2 3.45Å; Q170-V174 PolarHBondContact O-N 2.88Å; V174-Y178 WeakPolarHBondContact O-CB 3.36Å; V174-Y178 PolarHBondContact O-N 2.72Å; V174-Y178 VanDerWaalsContact O-N 3.07Å
175S57.3Low52.6Low68 Ų68112.6 Ų112.648%0.47656%0.56SS.*Hα-helixtrans-73-36.4179.5-166.80000112.4Q172 A173 L179Q172-S175 PolarHBondContact O-N 3.07Å; A173-S175 VanDerWaalsContact C-N 3.33Å; A173-S175 PolarHBondContact O-N 3.49Å; S175-L179 WeakPolarHBondContact O-CB 3.49Å; S175-L179 PolarHBondContact O-N 2.98Å; S175-L179 VanDerWaalsContact O-N 3.08Å
176V57.1Low52.2Low88 Ų88114.2 Ų114.253%0.53357%0.567SS.*Hα-helixtrans-75-37.1178.4-179.30000110.9Q172 A173 R180Q172-V176 WeakPolarHBondContact O-CG2 3.38Å; Q172-V176 PolarHBondContact O-N 3.3Å; A173-V176 PolarHBondContact O-N 2.97Å; V176-R180 VanDerWaalsContact O-CB 3.29Å; V176-R180 WeakPolarHBondContact O-CB 3.36Å; V176-R180 PolarHBondContact O-N 2.93Å
177D56.1Low51.8Low110 Ų110112 Ų11259%0.58857%0.568SS**Hα-helixtrans-66.7-38.7174.4-78.8-25.1000112.2A173 R181A173-D177 PolarHBondContact O-N 2.72Å; A173-D177 VanDerWaalsContact O-N 3.11Å; D177-R181 WeakPolarHBondContact O-CB 3.29Å; D177-R181 PolarHBondContact O-N 3.01Å
178Y55.5Low51.7Low173 Ų173114.3 Ų114.368%0.67858%0.578SS**Hα-helixtrans-67.2-43.7175.9-168.7-93.8000112.1V174 R181 C182V174-Y178 WeakPolarHBondContact O-CB 3.36Å; V174-Y178 PolarHBondContact O-N 2.72Å; V174-Y178 VanDerWaalsContact O-N 3.07Å; Y178-R181 PolarHBondContact O-N 3.28Å; Y178-C182 PolarHBondContact O-N 2.92Å; Y178-C182 PolarHBondContact O-SG 3.48Å
179L55.9Low51.1Low106 Ų106120 Ų12056%0.55560%0.598SS**Hα-helixtrans-65.1-40.4176.8-83.5162.4000112.4S175 R181 C182 E183S175-L179 WeakPolarHBondContact O-CB 3.49Å; S175-L179 PolarHBondContact O-N 2.98Å; S175-L179 VanDerWaalsContact O-N 3.08Å; L179-R181 VanDerWaalsContact C-N 3.32Å; L179-R181 PolarHBondContact O-N 3.34Å; L179-C182 PolarHBondContact O-N 2.75Å; L179-E183 PolarHBondContact O-N 2.88Å
180R52.9Low50.3Low183 Ų183114.3 Ų114.369%0.69160%0.597SS**Hα-helixtrans-69.4-31.2176.7-165.4-177.5-94.6-168.1-5.8111.9V176 S184V176-R180 VanDerWaalsContact O-CB 3.29Å; V176-R180 WeakPolarHBondContact O-CB 3.36Å; V176-R180 PolarHBondContact O-N 2.93Å; R180-S184 PolarHBondContact O-N 3.31Å
181R56.6Low49.3Very low165 Ų165114.1 Ų114.162%0.62361%0.609SS**Hα-helixtrans-67.2-42.9171.6-166.872.2-175.2-173.73.8111.3D177 Y178 L179 S184 E185D177-R181 WeakPolarHBondContact O-CB 3.29Å; D177-R181 PolarHBondContact O-N 3.01Å; Y178-R181 PolarHBondContact O-N 3.28Å; L179-R181 VanDerWaalsContact C-N 3.32Å; L179-R181 PolarHBondContact O-N 3.34Å; R181-S184 PolarHBondContact O-N 3.07Å; R181-S184 PolarHBondContact O-OG 3.09Å; R181-E185 PolarHBondContact O-N 3.43Å
182C45.6Very low48.8Very low43 Ų43117.2 Ų117.229%0.29162%0.624SS.*Hα-helixtrans-65.5-38.9177.4-74.40000113.5Y178 L179 S184 E185 I186Y178-C182 PolarHBondContact O-N 2.92Å; Y178-C182 PolarHBondContact O-SG 3.48Å; L179-C182 PolarHBondContact O-N 2.75Å; C182-S184 VanDerWaalsContact C-N 3.3Å; C182-S184 PolarHBondContact O-N 3.28Å; C182-E185 PolarHBondContact O-N 3.29Å; C182-I186 WeakPolarHBondContact O-CG1 3.32Å; C182-I186 PolarHBondContact O-N 3.22Å; C182-I186 VanDerWaalsContact O-N 3.07Å
183E47.6Very low48.2Very low147 Ų147119.1 Ų119.169%0.68764%0.638SS**Hα-helixtrans-66.8-31.5175.2-79.7-176.2146.400112.7L179 S187L179-E183 PolarHBondContact O-N 2.88Å; E183-S187 PolarHBondContact O-N 3.31Å
184S52.3Low47.7Very low61 Ų61121.5 Ų121.543%0.42766%0.658SS.*Hα-helixtrans-72.6-28.617668.30000113.8R180 R181 C182R180-S184 PolarHBondContact O-N 3.31Å; R181-S184 PolarHBondContact O-N 3.07Å; R181-S184 PolarHBondContact O-OG 3.09Å; C182-S184 VanDerWaalsContact C-N 3.3Å; C182-S184 PolarHBondContact O-N 3.28Å
185E43.1Very low46.8Very low125 Ų125125.1 Ų125.158%0.58467%0.669SS**Hα-helixtrans-82.4-27.5175.3-80.2178.6176.800112.5R181 C182 S187R181-E185 PolarHBondContact O-N 3.43Å; C182-E185 PolarHBondContact O-N 3.29Å; E185-S187 VanDerWaalsContact C-N 3.32Å
186I41.5Very low46.1Very low138 Ų138130.7 Ų130.771%0.70869%0.687SS**Hα-helixtrans-73.6-24.4174.6-69.2166.3000111.9C182 F188C182-I186 WeakPolarHBondContact O-CG1 3.32Å; C182-I186 PolarHBondContact O-N 3.22Å; C182-I186 VanDerWaalsContact O-N 3.07Å; I186-F188 VanDerWaalsContact C-N 3.34Å; I186-F188 PolarHBondContact O-N 3.44Å
187S44.9Very low45.4Very low99 Ų99137.1 Ų137.169%0.69272%0.718SS**THydrogen-bonded Turntrans-79.1-9.1-179.9-157.90000114.7E183 E185E183-S187 PolarHBondContact O-N 3.31Å; E185-S187 VanDerWaalsContact C-N 3.32Å
188F43Very low44.9Very low187 Ų187138.5 Ų138.582%0.8273%0.725SS**THydrogen-bonded Turntrans-103.4-1.3-176.8-106.6-85.4000116.1I186I186-F188 VanDerWaalsContact C-N 3.34Å; I186-F188 PolarHBondContact O-N 3.44Å
189Q42.2Very low44.3Very low181 Ų181136.6 Ų136.685%0.84673%0.727SS**  trans-11353.4174.2-132.794.5-11.800110.5
190G36.1Very low43.7Very low66 Ų66138.3 Ų138.368%0.6874%0.737SS**  trans-87.3125.9171.700000111.9
191C33.8Very low43.2Very low128 Ų128135.7 Ų135.787%0.86574%0.74SS**  trans84.7110.3159.4-70.60000119.1
192P42.1Very low42.3Very low125 Ų125133.9 Ų133.981%0.81275%0.747SS**PPolyproline II helixtrans-80.4149.1176.333.6-32.9000112.3A194P192-A194 PolarHBondContact O-N 3.24Å
193D39.3Very low42.1Very low170 Ų170139.9 Ų139.991%0.90978%0.777SS**PPolyproline II helixtrans-54.8118.8174.6-68.3-64000111.3
194A41.6Very low41.7Very low95 Ų95139.4 Ų139.479%0.78578%0.784SS**PPolyproline II helixtrans-68.2129.2171.700000109.8P192P192-A194 PolarHBondContact O-N 3.24Å
195Q38.5Very low40.9Very low169 Ų169145.5 Ų145.579%0.7981%0.811SS**PPolyproline II helixtrans-51.3143.6154.7-75.7-179.9-112.700110.3
196E42.1Very low40.7Very low185 Ų185147.2 Ų147.286%0.86483%0.83SS**  trans-144.1140.6138.6-157.194.5147.900106.8
197D43.2Very low40.6Very low223 Ų223148 Ų148100%1.19384%0.841SS**  trans-53.30-163.2-65.1-58.9000118.6

Retrieved 197 of 197 residues in 41 ms (Link to these results)