A0A077ZC05_TRITR Loading...

Helicase SKI2W

AlphaFold DB , UniProt , Accession A0A077ZC05, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 194 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
1M56.6Low81.4Confident220 Ų220111.9 Ų111.9100%1.08459%0.586SS**  0136.90-75.2-159.5-97.700107.7
2S76.3Confident81.7Confident70 Ų70108.8 Ų108.849%0.4958%0.581SS.*  trans-83.5150.6175.356.30000110.5E4 A5 V6S2-E4 PolarHBondContact O-N 2.93Å; S2-E4 VanDerWaalsContact O-N 3.12Å; S2-A5 WeakPolarHBondContact O-CB 3.43Å; S2-A5 PolarHBondContact O-N 3.05Å; S2-V6 PolarHBondContact O-N 3.2Å
3D82.5Confident81.7Confident139 Ų139107.6 Ų107.674%0.74357%0.574SS**Hα-helixtrans-55.4-28.8175.3-77.5-22.5000112.7V6 S7D3-V6 PolarHBondContact O-N 3.42Å; D3-S7 WeakPolarHBondContact O-CB 3.42Å; D3-S7 PolarHBondContact O-N 3.33Å; D3-S7 PolarHBondContact O-OG 2.76Å
4E85.4Confident82Confident120 Ų120112.1 Ų112.156%0.56158%0.579SS**Hα-helixtrans-66.6-39.3175.9-163-178167.900112.4S2 S7 R8S2-E4 PolarHBondContact O-N 2.93Å; S2-E4 VanDerWaalsContact O-N 3.12Å; E4-S7 PolarHBondContact O-N 3.23Å; E4-R8 WeakPolarHBondContact O-CG 3.31Å; E4-R8 PolarHBondContact O-N 3.11Å; E4-R8 IonicContact OE1-CZ 2.73Å; E4-R8 IonicContact OE1-NE 3.66Å; E4-R8 IonicContact OE1-NH2 2.87Å; E4-R8 PolarHBondContact OE1-NH2 3.47Å
5A84Confident82.2Confident46 Ų46114.9 Ų114.938%0.3859%0.585SS.*Hα-helixtrans-68.1-37.5176.500000111.5S2 L9S2-A5 WeakPolarHBondContact O-CB 3.43Å; S2-A5 PolarHBondContact O-N 3.05Å; A5-L9 WeakPolarHBondContact O-CB 3.39Å; A5-L9 PolarHBondContact O-N 3.36Å
6V82.3Confident82.4Confident61 Ų61114.4 Ų114.437%0.3758%0.58SS.*Hα-helixtrans-65.7-42.4175.6179.70000110.8S2 D3 L9 L10S2-V6 PolarHBondContact O-N 3.2Å; D3-V6 PolarHBondContact O-N 3.42Å; V6-L9 PolarHBondContact O-N 3.1Å; V6-L10 HydrophobicContact CG1-CD1 4.13Å; V6-L10 WeakPolarHBondContact O-CG 3.21Å; V6-L10 PolarHBondContact O-N 2.98Å
7S85.4Confident82.4Confident68 Ų68111.2 Ų111.248%0.47657%0.574SS.*Hα-helixtrans-64.6-41.4178.3-59.70000112.5D3 E4 L10 Q11D3-S7 WeakPolarHBondContact O-CB 3.42Å; D3-S7 PolarHBondContact O-N 3.33Å; D3-S7 PolarHBondContact O-OG 2.76Å; E4-S7 PolarHBondContact O-N 3.23Å; S7-L10 PolarHBondContact O-N 2.82Å; S7-Q11 PolarHBondContact O-N 2.87Å
8R84.9Confident82.4Confident157 Ų157109.9 Ų109.959%0.59257%0.566SS**Hα-helixtrans-64.6-40.5174.5-70.8179.2-169.2-162.74.3111.7E4 Q11 S12E4-R8 WeakPolarHBondContact O-CG 3.31Å; E4-R8 PolarHBondContact O-N 3.11Å; E4-R8 IonicContact OE1-CZ 2.73Å; E4-R8 IonicContact OE1-NE 3.66Å; E4-R8 IonicContact OE1-NH2 2.87Å; E4-R8 PolarHBondContact OE1-NH2 3.47Å; R8-Q11 PolarHBondContact O-N 2.79Å; R8-S12 PolarHBondContact O-N 2.82Å; R8-S12 PolarHBondContact O-OG 3.21Å
9L86.2Confident82.5Confident107 Ų107110.3 Ų110.356%0.5656%0.564SS**Hα-helixtrans-63.3-45175.8-175.866.4000111.4A5 V6 Q11 S12 L13A5-L9 WeakPolarHBondContact O-CB 3.39Å; A5-L9 PolarHBondContact O-N 3.36Å; V6-L9 PolarHBondContact O-N 3.1Å; L9-Q11 PolarHBondContact O-N 3.19Å; L9-S12 PolarHBondContact O-N 3.27Å; L9-L13 HydrophobicContact CG-CD1 4.14Å; L9-L13 WeakPolarHBondContact O-CB 3.28Å; L9-L13 WeakPolarHBondContact O-CG 3.48Å; L9-L13 PolarHBondContact O-N 3.19Å
10L85.5Confident82.5Confident106 Ų106110.3 Ų110.356%0.55556%0.562SS**Hα-helixtrans-62.7-41177.1-75.3171.1000112.5V6 S7 L13 R14V6-L10 HydrophobicContact CG1-CD1 4.13Å; V6-L10 WeakPolarHBondContact O-CG 3.21Å; V6-L10 PolarHBondContact O-N 2.98Å; S7-L10 PolarHBondContact O-N 2.82Å; L10-L13 PolarHBondContact O-N 2.94Å; L10-R14 WeakPolarHBondContact O-CB 3.16Å; L10-R14 PolarHBondContact O-N 3.4Å
11Q86Confident82.4Confident137 Ų137109.9 Ų109.964%0.6456%0.56SS**Hα-helixtrans-63.6-41.4174.8-84-175-15.600112.5S7 R8 L9 R14 K15S7-Q11 PolarHBondContact O-N 2.87Å; R8-Q11 PolarHBondContact O-N 2.79Å; L9-Q11 PolarHBondContact O-N 3.19Å; Q11-R14 PolarHBondContact O-N 3.11Å; Q11-K15 PolarHBondContact O-N 2.91Å
12S84.8Confident83.3Confident75 Ų75104.4 Ų104.452%0.52454%0.535SS..Hα-helixtrans-65.7-44176.5-66.70000111.9R8 L9 R14 K15 Q16R8-S12 PolarHBondContact O-N 2.82Å; R8-S12 PolarHBondContact O-OG 3.21Å; L9-S12 PolarHBondContact O-N 3.27Å; S12-R14 VanDerWaalsContact C-N 3.32Å; S12-R14 PolarHBondContact O-N 2.85Å; S12-K15 PolarHBondContact O-N 3.24Å; S12-Q16 WeakPolarHBondContact O-CB 3.18Å; S12-Q16 PolarHBondContact O-N 3.11Å
13L81.9Confident83.3Confident93 Ų93105.6 Ų105.649%0.48754%0.535SS..Hα-helixtrans-62.1-40.1175.7-74.6171.5000111.8L9 L10 Q16 A17L9-L13 HydrophobicContact CG-CD1 4.14Å; L9-L13 WeakPolarHBondContact O-CB 3.28Å; L9-L13 WeakPolarHBondContact O-CG 3.48Å; L9-L13 PolarHBondContact O-N 3.19Å; L10-L13 PolarHBondContact O-N 2.94Å; L13-Q16 PolarHBondContact O-N 3.48Å; L13-A17 WeakPolarHBondContact O-CB 3.2Å; L13-A17 PolarHBondContact O-N 2.77Å
14R86.2Confident82.8Confident170 Ų170105.1 Ų105.164%0.64253%0.529SS*.Hα-helixtrans-62.7-47.7175.4-178.7178.7172.7171.54.2111.9L10 Q11 S12 Q16 A17 E18L10-R14 WeakPolarHBondContact O-CB 3.16Å; L10-R14 PolarHBondContact O-N 3.4Å; Q11-R14 PolarHBondContact O-N 3.11Å; S12-R14 VanDerWaalsContact C-N 3.32Å; S12-R14 PolarHBondContact O-N 2.85Å; R14-Q16 VanDerWaalsContact C-N 3.27Å; R14-Q16 PolarHBondContact O-N 3.45Å; R14-A17 PolarHBondContact O-N 2.76Å; R14-E18 WeakPolarHBondContact CG-OE1 3.45Å; R14-E18 IonicContact CZ-OE1 2.72Å; R14-E18 IonicContact NE-OE1 3.56Å; R14-E18 PolarHBondContact NE-OE1 2.78Å; R14-E18 IonicContact NH2-OE1 3.67Å; R14-E18 WeakPolarHBondContact O-CG 3.5Å; R14-E18 PolarHBondContact O-N 3.21Å
15K85.4Confident82Confident155 Ų155103.3 Ų103.367%0.67452%0.523SS*.Hα-helixtrans-61.2-37176.9-78-171.9176.6-171.80112.4Q11 S12 H19Q11-K15 PolarHBondContact O-N 2.91Å; S12-K15 PolarHBondContact O-N 3.24Å; K15-H19 WeakPolarHBondContact O-CB 3.46Å; K15-H19 PolarHBondContact O-N 2.86Å
16Q85.6Confident81.2Confident107 Ų107106.1 Ų106.150%0.553%0.53SS..Hα-helixtrans-68.3-44176.5-174176.6-18.300111.6S12 L13 R14 E18 H19 E20S12-Q16 WeakPolarHBondContact O-CB 3.18Å; S12-Q16 PolarHBondContact O-N 3.11Å; L13-Q16 PolarHBondContact O-N 3.48Å; R14-Q16 VanDerWaalsContact C-N 3.27Å; R14-Q16 PolarHBondContact O-N 3.45Å; Q16-E18 VanDerWaalsContact C-N 3.35Å; Q16-E18 PolarHBondContact O-N 3.23Å; Q16-H19 WeakPolarHBondContact O-CB 3.47Å; Q16-H19 PolarHBondContact O-N 2.96Å; Q16-E20 PolarHBondContact NE2-OE1 3.47Å; Q16-E20 PolarHBondContact O-N 2.94Å
17A81.3Confident80.4Confident59 Ų59108.6 Ų108.649%0.48854%0.542SS..Hα-helixtrans-63-39.4176.400000112.4L13 R14 H19 E20 L21L13-A17 WeakPolarHBondContact O-CB 3.2Å; L13-A17 PolarHBondContact O-N 2.77Å; R14-A17 PolarHBondContact O-N 2.76Å; A17-H19 VanDerWaalsContact C-N 3.33Å; A17-E20 PolarHBondContact O-N 3.24Å; A17-L21 WeakPolarHBondContact O-CB 3.48Å; A17-L21 PolarHBondContact O-N 2.72Å
18E83.2Confident79.1Confident89 Ų89111 Ų11142%0.41655%0.547SS..Hα-helixtrans-63.3-39.3173.6-72.9169.2-174.300111.4R14 Q16 L22R14-E18 WeakPolarHBondContact CG-OE1 3.45Å; R14-E18 IonicContact CZ-OE1 2.72Å; R14-E18 IonicContact NE-OE1 3.56Å; R14-E18 PolarHBondContact NE-OE1 2.78Å; R14-E18 IonicContact NH2-OE1 3.67Å; R14-E18 WeakPolarHBondContact O-CG 3.5Å; R14-E18 PolarHBondContact O-N 3.21Å; Q16-E18 VanDerWaalsContact C-N 3.35Å; Q16-E18 PolarHBondContact O-N 3.23Å; E18-L22 WeakPolarHBondContact O-CB 3.43Å; E18-L22 VanDerWaalsContact O-CG 3.28Å; E18-L22 WeakPolarHBondContact O-CG 3.36Å; E18-L22 PolarHBondContact O-N 2.97Å; E18-L22 VanDerWaalsContact O-N 3.07Å
19H84.3Confident77.8Confident117 Ų117108.2 Ų108.254%0.54255%0.548SS..Hα-helixtrans-68.5-40.6176.5-172.8-91.6000112.8K15 Q16 A17 L22 L23K15-H19 WeakPolarHBondContact O-CB 3.46Å; K15-H19 PolarHBondContact O-N 2.86Å; Q16-H19 WeakPolarHBondContact O-CB 3.47Å; Q16-H19 PolarHBondContact O-N 2.96Å; A17-H19 VanDerWaalsContact C-N 3.33Å; H19-L22 PolarHBondContact O-N 3.04Å; H19-L23 WeakPolarHBondContact O-CG 3.33Å; H19-L23 PolarHBondContact O-N 2.78Å; H19-L23 VanDerWaalsContact O-N 3.1Å
20E81.9Confident76.4Confident109 Ų109108.4 Ų108.451%0.50955%0.553SS.*Hα-helixtrans-67.7-40.2175.9-73.7-175.9-162.600111.9Q16 A17 L22 L23 E24Q16-E20 PolarHBondContact NE2-OE1 3.47Å; Q16-E20 PolarHBondContact O-N 2.94Å; A17-E20 PolarHBondContact O-N 3.24Å; E20-L22 VanDerWaalsContact C-N 3.33Å; E20-L22 PolarHBondContact O-N 2.73Å; E20-L23 PolarHBondContact O-N 3.33Å; E20-E24 PolarHBondContact O-N 2.97Å
21L80.1Confident75Confident102 Ų102111.7 Ų111.753%0.53457%0.565SS.*Hα-helixtrans-62.2-40.2174.9-174.271.1000112A17 L23 E24 L25A17-L21 WeakPolarHBondContact O-CB 3.48Å; A17-L21 PolarHBondContact O-N 2.72Å; L21-L23 VanDerWaalsContact C-N 3.33Å; L21-E24 PolarHBondContact O-N 2.92Å; L21-L25 HydrophobicContact CG-CD1 4.41Å; L21-L25 WeakPolarHBondContact O-CG 3.12Å; L21-L25 PolarHBondContact O-N 3.36Å
22L75.3Confident73.6Confident106 Ų106112.2 Ų112.256%0.55557%0.568SS**Hα-helixtrans-65.3-36.6175.8-75.8169.3000112.1E18 H19 E20 L26E18-L22 WeakPolarHBondContact O-CB 3.43Å; E18-L22 VanDerWaalsContact O-CG 3.28Å; E18-L22 WeakPolarHBondContact O-CG 3.36Å; E18-L22 PolarHBondContact O-N 2.97Å; E18-L22 VanDerWaalsContact O-N 3.07Å; H19-L22 PolarHBondContact O-N 3.04Å; E20-L22 VanDerWaalsContact C-N 3.33Å; E20-L22 PolarHBondContact O-N 2.73Å; L22-L26 WeakPolarHBondContact O-CB 3.41Å; L22-L26 WeakPolarHBondContact O-CG 3.34Å; L22-L26 PolarHBondContact O-N 2.73Å
23L76.8Confident71.8Confident94 Ų94116.9 Ų116.949%0.49259%0.587SS.*Hα-helixtrans-68-41.4174.6-74.2170.9000111.9H19 E20 L21 L26 D27H19-L23 WeakPolarHBondContact O-CG 3.33Å; H19-L23 PolarHBondContact O-N 2.78Å; H19-L23 VanDerWaalsContact O-N 3.1Å; E20-L23 PolarHBondContact O-N 3.33Å; L21-L23 VanDerWaalsContact C-N 3.33Å; L23-L26 WeakPolarHBondContact O-CB 3.19Å; L23-L26 PolarHBondContact O-N 3.04Å; L23-D27 PolarHBondContact O-N 3.16Å
24E73.6Confident70.3Confident129 Ų129119.8 Ų119.860%0.60360%0.602SS**Hα-helixtrans-64.3-40.1176.3-173177.1-172.700112E20 L21 D27 M28E20-E24 PolarHBondContact O-N 2.97Å; L21-E24 PolarHBondContact O-N 2.92Å; E24-D27 PolarHBondContact O-N 2.8Å; E24-M28 PolarHBondContact O-N 2.87Å
25L68.3Low68.3Low83 Ų83119.2 Ų119.244%0.43561%0.61SS.*Hα-helixtrans-63.3-41.1173-73.8168.9000111.9L21 M28 T29L21-L25 HydrophobicContact CG-CD1 4.41Å; L21-L25 WeakPolarHBondContact O-CG 3.12Å; L21-L25 PolarHBondContact O-N 3.36Å; L25-M28 HydrophobicContact CD2-CE 3.71Å; L25-M28 PolarHBondContact O-N 2.75Å; L25-T29 WeakPolarHBondContact O-CG2 3.46Å; L25-T29 PolarHBondContact O-N 3.26Å; L25-T29 VanDerWaalsContact O-N 3.14Å; L25-T29 PolarHBondContact O-OG1 2.87Å
26L65.9Low66.3Low104 Ų104117 Ų11755%0.54561%0.612SS.*Hα-helixtrans-64.1-42.2175.3-85.4159.8000111.5L22 L23 T29 V30L22-L26 WeakPolarHBondContact O-CB 3.41Å; L22-L26 WeakPolarHBondContact O-CG 3.34Å; L22-L26 PolarHBondContact O-N 2.73Å; L23-L26 WeakPolarHBondContact O-CB 3.19Å; L23-L26 PolarHBondContact O-N 3.04Å; L26-T29 WeakPolarHBondContact CA-OG1 3.48Å; L26-T29 PolarHBondContact O-N 2.85Å; L26-T29 VanDerWaalsContact O-N 3.13Å; L26-T29 PolarHBondContact O-OG1 2.94Å; L26-V30 WeakPolarHBondContact O-CG2 3.21Å; L26-V30 PolarHBondContact O-N 3.46Å
27D66.1Low64.5Low113 Ų113118.9 Ų118.960%0.60463%0.63SS**Hα-helixtrans-65.8-40.1178.8-134.822.5000111.3L23 E24 T29 V30 E31L23-D27 PolarHBondContact O-N 3.16Å; E24-D27 PolarHBondContact O-N 2.8Å; D27-T29 VanDerWaalsContact C-N 3.26Å; D27-T29 PolarHBondContact O-N 3.48Å; D27-V30 PolarHBondContact O-N 3.12Å; D27-V30 VanDerWaalsContact O-N 3.11Å; D27-E31 PolarHBondContact O-N 3.21Å
28M57.8Low62.5Low119 Ų119125.8 Ų125.859%0.58666%0.655SS**Hα-helixtrans-61.1-32.4171.8-82.5-162.4-52.400113.1E24 L25 V30E24-M28 PolarHBondContact O-N 2.87Å; L25-M28 HydrophobicContact CD2-CE 3.71Å; L25-M28 PolarHBondContact O-N 2.75Å; M28-V30 VanDerWaalsContact C-N 3.3Å
29T57.7Low60.7Low99 Ų99124 Ų12461%0.60766%0.661SS**Hα-helixtrans-78.3-13.5177.456.70000113.9L25 L26 D27L25-T29 WeakPolarHBondContact O-CG2 3.46Å; L25-T29 PolarHBondContact O-N 3.26Å; L25-T29 VanDerWaalsContact O-N 3.14Å; L25-T29 PolarHBondContact O-OG1 2.87Å; L26-T29 WeakPolarHBondContact CA-OG1 3.48Å; L26-T29 PolarHBondContact O-N 2.85Å; L26-T29 VanDerWaalsContact O-N 3.13Å; L26-T29 PolarHBondContact O-OG1 2.94Å; D27-T29 VanDerWaalsContact C-N 3.26Å; D27-T29 PolarHBondContact O-N 3.48Å
30V57.6Low58.7Low111 Ų111127.3 Ų127.367%0.67368%0.677SS**Hα-helixtrans-91.6-22-178.9173.70000112.2L26 D27 M28L26-V30 WeakPolarHBondContact O-CG2 3.21Å; L26-V30 PolarHBondContact O-N 3.46Å; D27-V30 PolarHBondContact O-N 3.12Å; D27-V30 VanDerWaalsContact O-N 3.11Å; M28-V30 VanDerWaalsContact C-N 3.3Å
31E55.8Low57.3Low175 Ų175134.1 Ų134.182%0.81870%0.698SS**SBendtrans-86.9-4.9179.4-68.6-156.4157.100115.3D27D27-E31 PolarHBondContact O-N 3.21Å
32E55.2Low55.5Low147 Ų147136.7 Ų136.769%0.68771%0.712SS**SBendtrans-95.9109.4169.7-70.9-168.2164.500110.9L34E32-L34 VanDerWaalsContact C-N 3.33Å; E32-L34 PolarHBondContact O-N 3.33Å
33D47.2Very low53.7Low173 Ų173135.5 Ų135.593%0.92573%0.725SS**  trans-45.476.3176.3-87.6-39.8000115.3
34L51.2Low51.9Low154 Ų154134.1 Ų134.181%0.80673%0.733SS**  trans-125.277.5174.9-79.8159.7000111.5E32E32-L34 VanDerWaalsContact C-N 3.33Å; E32-L34 PolarHBondContact O-N 3.33Å
35I43.5Very low50.7Low159 Ų159134 Ų13482%0.81574%0.741SS**  trans-123.8144.4156.6-27-178.4000104.6
36P43.5Very low49.5Very low109 Ų109137.4 Ų137.471%0.70876%0.76SS**  cis-153.6130.123.437-12.6000117.4
37T47.7Very low48.7Very low145 Ų145136.8 Ų136.889%0.8976%0.764SS**  trans-153.775.1152.81.50000111.8G39T37-G39 PolarHBondContact O-N 3.46Å
38M40.2Very low48Very low204 Ų204137.4 Ų137.4100%1.00577%0.768SS**  trans-74.974.7156.3-78-161.1-63.300108.5
39G44.5Very low47.5Very low52 Ų52137.7 Ų137.754%0.53678%0.78SS.*  trans-106.6112165.700000108.3T37 W41T37-G39 PolarHBondContact O-N 3.46Å; G39-W41 PolarHBondContact O-N 2.79Å
40Q43.4Very low47.2Very low187 Ų187139.6 Ų139.687%0.87479%0.785SS**  trans33.186.9159.6-74.9175.4-31.100116.5D42Q40-D42 PolarHBondContact O-N 2.91Å
41W51.2Low46.7Very low251 Ų251142.8 Ų142.895%0.95179%0.791SS**  trans-94.582.9156.5-119.545.4000107.8G39G39-W41 PolarHBondContact O-N 2.79Å
42D43.6Very low46.5Very low157 Ų157140.5 Ų140.584%0.8478%0.784SS**  trans-109.4108.6173.1-145.43.7000106.8Q40Q40-D42 PolarHBondContact O-N 2.91Å
43G36Very low46.5Very low81 Ų81141.2 Ų141.284%0.83579%0.793SS**SBendtrans57.894.2163.900000118.5
44G40.3Very low46.8Very low64 Ų64139.8 Ų139.866%0.6679%0.785SS**  trans-167.992.6167.700000112.8
45V47.9Very low47.1Very low126 Ų126136.2 Ų136.276%0.76478%0.778SS**  trans5.8121.9152.6-175.20000115.1S47V45-S47 VanDerWaalsContact C-N 3.34Å; V45-S47 PolarHBondContact O-N 3.38Å; V45-S47 PolarHBondContact O-OG 3.06Å
46D43.1Very low47.7Very low156 Ų156138 Ų13883%0.83478%0.783SS**  trans-45.192.4171.4-69.2-38.3000111.5
47S48.3Very low48.4Very low90 Ų90139.2 Ų139.263%0.62978%0.777SS**  trans-97.68.8-173.9-54.50000112.1V45 C49V45-S47 VanDerWaalsContact C-N 3.34Å; V45-S47 PolarHBondContact O-N 3.38Å; V45-S47 PolarHBondContact O-OG 3.06Å; S47-C49 PolarHBondContact O-N 3.27Å
48N51.8Low48.9Very low127 Ų127138.3 Ų138.368%0.67977%0.767SS**THydrogen-bonded Turntrans-93.720.2-168.9-74-3000114.4F51N48-F51 WeakPolarHBondContact O-CE2 3.37Å
49C47.3Very low49.9Very low125 Ų125132.2 Ų132.285%0.84574%0.738SS**THydrogen-bonded Turntrans-106.312.8173.2-59.80000113.7S47S47-C49 PolarHBondContact O-N 3.27Å
50L51.7Low50.3Low138 Ų138133.1 Ų133.172%0.72373%0.73SS**  trans-111.458.2172.9-119120.8000109.5D52L50-D52 PolarHBondContact O-N 3.28Å
51F48Very low51.3Low178 Ų178128.1 Ų128.178%0.78171%0.707SS**  trans-80102.1152.8-65.9-78.3000104.5N48 D53N48-F51 WeakPolarHBondContact O-CE2 3.37Å; F51-D53 PolarHBondContact O-N 3.15Å
52D51.8Low52.2Low128 Ų128120.7 Ų120.768%0.68469%0.689SS**  trans-59.5110.3167.9-68.6-35.7000105.8L50 D54L50-D52 PolarHBondContact O-N 3.28Å; D52-D54 PolarHBondContact O-N 2.99Å
53D53.5Low53.7Low161 Ų161116.4 Ų116.486%0.86166%0.663SS**  trans-53113.9165.4-96.4-24.8000105.7F51 A55F51-D53 PolarHBondContact O-N 3.15Å; D53-A55 PolarHBondContact O-N 3.47Å; D53-A55 VanDerWaalsContact O-N 3.11Å
54D55Low55.6Low143 Ų143116 Ų11677%0.76564%0.644SS**  trans-46124.2179.4-75.2-40.1000108.5D52 Q56 F57D52-D54 PolarHBondContact O-N 2.99Å; D54-Q56 PolarHBondContact O-N 2.7Å; D54-F57 HydrophobicContact CB-CE2 4.44Å
55A56.4Low57.1Low80 Ų80115.4 Ų115.466%0.66163%0.628SS**  trans-49136.6-177.200000110D53 F57D53-A55 PolarHBondContact O-N 3.47Å; D53-A55 VanDerWaalsContact O-N 3.11Å; A55-F57 VanDerWaalsContact O-CD2 3.3Å; A55-F57 WeakPolarHBondContact O-CD2 3.48Å; A55-F57 PolarHBondContact O-N 3.14Å
56Q56.9Low58.6Low195 Ų195117.9 Ų117.991%0.91162%0.623SS**  trans-59.1106.5179.5-68.9179.214.400109.5D54 N58D54-Q56 PolarHBondContact O-N 2.7Å; Q56-N58 PolarHBondContact O-N 2.66Å
57F57.1Low59.9Low135 Ų135113.5 Ų113.559%0.59260%0.6SS**  trans-65.4118.6173.4-64-87.6000109.1D54 A55 D85D54-F57 HydrophobicContact CB-CE2 4.44Å; A55-F57 VanDerWaalsContact O-CD2 3.3Å; A55-F57 WeakPolarHBondContact O-CD2 3.48Å; A55-F57 PolarHBondContact O-N 3.14Å; F57-D85 WeakPolarHBondContact CD1-OD2 3.46Å; F57-D85 HydrophobicContact CE1-CB 3.94Å; F57-D85 WeakPolarHBondContact CE1-OD2 3.43Å
58N58.5Low61.4Low126 Ų126118 Ų11867%0.67461%0.611SS**  trans-114.990172.1-177.347.9000109.8Q56 L60Q56-N58 PolarHBondContact O-N 2.66Å; N58-L60 PolarHBondContact ND2-O 3.03Å; N58-L60 VanDerWaalsContact ND2-O 3.16Å; N58-L60 PolarHBondContact O-N 3.06Å
59D61Low62.4Low76 Ų76120.1 Ų120.141%0.40662%0.617SS.*  trans-75.2-4.5176.6-56.9-24.3000112.8E61 I80 E81D59-E61 PolarHBondContact O-N 3.11Å; D59-I80 HydrophobicContact CB-CG2 3.97Å; D59-I80 VanDerWaalsContact O-CA 3.31Å; D59-I80 WeakPolarHBondContact O-CA 3.34Å; D59-E81 PolarHBondContact O-N 3.08Å
60L54.1Low63.8Low71 Ų71118.3 Ų118.337%0.37260%0.602SS.*EExtended strand (participates in β ladder)trans-88.1109.8-175.5-15974.4000110.7N58 E78 I80N58-L60 PolarHBondContact ND2-O 3.03Å; N58-L60 VanDerWaalsContact ND2-O 3.16Å; N58-L60 PolarHBondContact O-N 3.06Å; L60-E78 HydrophobicContact CD1-CB 3.9Å; L60-E78 HydrophobicContact CD1-CG 4.42Å; L60-E78 HydrophobicContact CD2-CG 4.16Å; L60-E78 HydrophobicContact CG-CB 4.24Å; L60-E78 HydrophobicContact CG-CG 4.3Å; L60-I80 HydrophobicContact CD1-CG1 4.45Å
61E64.7Low64.8Low83 Ų83113.7 Ų113.739%0.38859%0.588SS.*EExtended strand (participates in β ladder)trans-106.2143.6172.2-68.3-169.3171.200111.8D59 A79 E81D59-E61 PolarHBondContact O-N 3.11Å; E61-A79 PolarHBondContact N-O 3.36Å; E61-A79 PolarHBondContact O-N 3.05Å; E61-A79 VanDerWaalsContact O-O 3.11Å; E61-E81 HydrophobicContact CB-CB 4.48Å; E61-E81 HydrophobicContact CG-CB 3.89Å
62V70.1Confident66.1Low95 Ų95111.8 Ų111.858%0.57658%0.581SS**EExtended strand (participates in β ladder)trans-91.1111.3174.2-178.90000109.4Y76V62-Y76 HydrophobicContact CG1-CD1 3.85Å; V62-Y76 HydrophobicContact CG1-CG 4.27Å
63K73.8Confident67.4Low66 Ų66109 Ų10929%0.28757%0.569SS.*EExtended strand (participates in β ladder)trans-94.6128.4174.7-67.4-171.1-178.8178.60110.8R77 A79 E81K63-R77 HydrophobicContact CB-CG 4.01Å; K63-R77 PolarHBondContact N-O 2.89Å; K63-R77 PolarHBondContact O-N 3.31Å; K63-A79 HydrophobicContact CB-CB 4.44Å; K63-A79 HydrophobicContact CD-CB 3.51Å; K63-A79 HydrophobicContact CG-CB 3.83Å; K63-E81 WeakPolarHBondContact CE-OE2 3.36Å; K63-E81 IonicContact NZ-OE2 3.58Å; K63-E81 PolarHBondContact NZ-OE2 3.2Å
64V75.4Confident68.3Low72 Ų72103.7 Ų103.744%0.43655%0.547SS..EExtended strand (participates in β ladder)trans-83.6125.2179.1-177.20000109.8R66 V73 Y76V64-R66 HydrophobicContact CG1-CG 4.37Å; V64-V73 HydrophobicContact CG1-CB 4.01Å; V64-V73 HydrophobicContact CG1-CG1 3.5Å; V64-V73 VanDerWaalsContact CG1-CG1 3.5Å; V64-V73 HydrophobicContact CG1-CG2 3.45Å; V64-V73 VanDerWaalsContact CG1-CG2 3.45Å; V64-Y76 HydrophobicContact CG2-CD1 3.99Å; V64-Y76 HydrophobicContact CG2-CE1 3.91Å
65V73.4Confident69.1Low52 Ų52102.2 Ų102.232%0.31554%0.54SS..EExtended strand (participates in β ladder)trans-97.9122.7172.1-177.10000108.2A74 N75 R77V65-A74 PolarHBondContact O-N 2.73Å; V65-N75 WeakPolarHBondContact CA-O 3.29Å; V65-N75 HydrophobicContact CB-CB 4.33Å; V65-N75 WeakPolarHBondContact CB-O 3.31Å; V65-N75 PolarHBondContact N-O 3.11Å; V65-N75 PolarHBondContact O-N 3.41Å; V65-R77 HydrophobicContact CG2-CG 4.26Å
66R78.1Confident69.9Low178 Ų178106 Ų10667%0.67254%0.538SS*.EExtended strand (participates in β ladder)trans-100.9146.3178.4-65.6-177.6-178.9-176.80.5111.2V64 G71 E72V64-R66 HydrophobicContact CG1-CG 4.37Å; R66-G71 WeakPolarHBondContact CD-O 3.39Å; R66-E72 CarbonylContact C-O 3.49Å; R66-E72 WeakPolarHBondContact CA-O 3.03Å
67D70.5Confident70.4Confident64 Ų64103.9 Ų103.934%0.34252%0.521SS..PPolyproline II helixtrans-66.2133.3169.4-174.2-68000109.8H69 T70 G71 E72 A74D67-H69 VanDerWaalsContact C-N 3.25Å; D67-H69 PolarHBondContact O-N 3.39Å; D67-H69 WeakPolarHBondContact OD1-CA 3.09Å; D67-H69 WeakPolarHBondContact OD1-CB 3.3Å; D67-H69 PolarHBondContact OD1-N 3Å; D67-H69 IonicContact OD1-ND1 3.82Å; D67-T70 VanDerWaalsContact CB-OG1 3.31Å; D67-T70 WeakPolarHBondContact CB-OG1 3.43Å; D67-T70 PolarHBondContact OD1-N 3.04Å; D67-G71 WeakPolarHBondContact O-CA 3.43Å; D67-G71 PolarHBondContact O-N 3.33Å; D67-E72 PolarHBondContact N-O 3.32Å; D67-A74 HydrophobicContact CB-CB 4.29Å
68E79.6Confident70.7Confident186 Ų186104.3 Ų104.387%0.86953%0.525SS*.THydrogen-bonded Turntrans-67.9-23.5-176-64.6-177.717000113.5
69H74.3Confident70.9Confident170 Ų17099.2 Ų99.279%0.78750%0.501SS*.THydrogen-bonded Turntrans-101.3-38.9-173.3-58.582000112.3D67D67-H69 VanDerWaalsContact C-N 3.25Å; D67-H69 PolarHBondContact O-N 3.39Å; D67-H69 WeakPolarHBondContact OD1-CA 3.09Å; D67-H69 WeakPolarHBondContact OD1-CB 3.3Å; D67-H69 PolarHBondContact OD1-N 3Å; D67-H69 IonicContact OD1-ND1 3.82Å
70T75.4Confident70.7Confident87 Ų87101.7 Ų101.753%0.53451%0.512SS..THydrogen-bonded Turntrans-96.2-22.3179.964.90000112.3D67 E72D67-T70 VanDerWaalsContact CB-OG1 3.31Å; D67-T70 WeakPolarHBondContact CB-OG1 3.43Å; D67-T70 PolarHBondContact OD1-N 3.04Å; T70-E72 PolarHBondContact O-N 3.34Å; T70-E72 WeakPolarHBondContact OG1-CB 3.28Å; T70-E72 PolarHBondContact OG1-N 3.02Å
71G73.8Confident71.1Confident42 Ų42101.5 Ų101.543%0.43351%0.51SS..  trans69.52-169.900000113.7R66 D67R66-G71 WeakPolarHBondContact CD-O 3.39Å; D67-G71 WeakPolarHBondContact O-CA 3.43Å; D67-G71 PolarHBondContact O-N 3.33Å
72E74.4Confident70.6Confident138 Ų138105.5 Ų105.565%0.64553%0.529SS*.  trans-72155.8177.9-66.2-176.3157.400110.7R66 D67 T70 A74R66-E72 CarbonylContact C-O 3.49Å; R66-E72 WeakPolarHBondContact CA-O 3.03Å; D67-E72 PolarHBondContact N-O 3.32Å; T70-E72 PolarHBondContact O-N 3.34Å; T70-E72 WeakPolarHBondContact OG1-CB 3.28Å; T70-E72 PolarHBondContact OG1-N 3.02Å; E72-A74 PolarHBondContact O-N 2.66Å; E72-A74 VanDerWaalsContact O-N 3.11Å
73V78.3Confident69.8Low69 Ų69104 Ų10442%0.41852%0.52SS..EExtended strand (participates in β ladder)trans-69.2109.8175.5176.80000108.9V64 Y76V64-V73 HydrophobicContact CG1-CB 4.01Å; V64-V73 HydrophobicContact CG1-CG1 3.5Å; V64-V73 VanDerWaalsContact CG1-CG1 3.5Å; V64-V73 HydrophobicContact CG1-CG2 3.45Å; V64-V73 VanDerWaalsContact CG1-CG2 3.45Å; V73-Y76 HydrophobicContact CG1-CE1 3.99Å; V73-Y76 HydrophobicContact CG1-CE2 4.1Å
74A73Confident68.7Low50 Ų50104.7 Ų104.741%0.41353%0.531SS..EExtended strand (participates in β ladder)trans-84.3-39.9-179.900000111.7V65 D67 E72V65-A74 PolarHBondContact O-N 2.73Å; D67-A74 HydrophobicContact CB-CB 4.29Å; E72-A74 PolarHBondContact O-N 2.66Å; E72-A74 VanDerWaalsContact O-N 3.11Å
75N72.7Confident67.6Low112 Ų112106.2 Ų106.260%0.59954%0.536SS*.EExtended strand (participates in β ladder)trans-158.4165.3-177.7-84.3-47.5000111.8V65V65-N75 WeakPolarHBondContact CA-O 3.29Å; V65-N75 HydrophobicContact CB-CB 4.33Å; V65-N75 WeakPolarHBondContact CB-O 3.31Å; V65-N75 PolarHBondContact N-O 3.11Å; V65-N75 PolarHBondContact O-N 3.41Å
76Y72.9Confident66.3Low158 Ų158107.5 Ų107.562%0.6255%0.545SS*.EExtended strand (participates in β ladder)trans-110.9143.3167.6-57.3-85.9000108.7V62 V64 V73V62-Y76 HydrophobicContact CG1-CD1 3.85Å; V62-Y76 HydrophobicContact CG1-CG 4.27Å; V64-Y76 HydrophobicContact CG2-CD1 3.99Å; V64-Y76 HydrophobicContact CG2-CE1 3.91Å; V73-Y76 HydrophobicContact CG1-CE1 3.99Å; V73-Y76 HydrophobicContact CG1-CE2 4.1Å
77R68.1Low64.8Low151 Ų151102.9 Ų102.957%0.5755%0.545SS*.EExtended strand (participates in β ladder)trans-130.1137.4169.773.3-178.5-171-140.8-0.6109.5K63 V65K63-R77 HydrophobicContact CB-CG 4.01Å; K63-R77 PolarHBondContact N-O 2.89Å; K63-R77 PolarHBondContact O-N 3.31Å; V65-R77 HydrophobicContact CG2-CG 4.26Å
78E63.1Low63.9Low144 Ų144102.3 Ų102.367%0.67355%0.545SS*.EExtended strand (participates in β ladder)trans-72.6132.7168.2-67.9172.2-172.600108.7L60L60-E78 HydrophobicContact CD1-CB 3.9Å; L60-E78 HydrophobicContact CD1-CG 4.42Å; L60-E78 HydrophobicContact CD2-CG 4.16Å; L60-E78 HydrophobicContact CG-CB 4.24Å; L60-E78 HydrophobicContact CG-CG 4.3Å
79A62.6Low62.8Low19 Ų1995.1 Ų95.116%0.15752%0.516CS..EExtended strand (participates in β ladder)trans-131.4136.8174.400000108.3E61 K63 E81E61-A79 PolarHBondContact N-O 3.36Å; E61-A79 PolarHBondContact O-N 3.05Å; E61-A79 VanDerWaalsContact O-O 3.11Å; K63-A79 HydrophobicContact CB-CB 4.44Å; K63-A79 HydrophobicContact CD-CB 3.51Å; K63-A79 HydrophobicContact CG-CB 3.83Å; A79-E81 PolarHBondContact O-N 3.09Å
80I57.4Low62.3Low128 Ų12890 Ų9066%0.65650%0.496SS*.EExtended strand (participates in β ladder)trans-80.7113.2172.1-59.3171.3000106.3D59 L60D59-I80 HydrophobicContact CB-CG2 3.97Å; D59-I80 VanDerWaalsContact O-CA 3.31Å; D59-I80 WeakPolarHBondContact O-CA 3.34Å; L60-I80 HydrophobicContact CD1-CG1 4.45Å
81E60.9Low62Low67 Ų6787.7 Ų87.731%0.31348%0.481SS..  trans-9994168.5-173.8133.8169.900107.2D59 E61 K63 A79 T83D59-E81 PolarHBondContact O-N 3.08Å; E61-E81 HydrophobicContact CB-CB 4.48Å; E61-E81 HydrophobicContact CG-CB 3.89Å; K63-E81 WeakPolarHBondContact CE-OE2 3.36Å; K63-E81 IonicContact NZ-OE2 3.58Å; K63-E81 PolarHBondContact NZ-OE2 3.2Å; A79-E81 PolarHBondContact O-N 3.09Å; E81-T83 HydrophobicContact CG-CG2 4.2Å; E81-T83 PolarHBondContact O-N 3.08Å
82E54.8Low61.8Low168 Ų16887.5 Ų87.579%0.78547%0.472SS*.  trans-7680.2175-164.3179.9-171.700107.9P84E82-P84 VanDerWaalsContact O-CD 3.29Å; E82-P84 WeakPolarHBondContact O-CD 3.46Å
83T53.5Low61.9Low63 Ų6387.8 Ų87.839%0.38748%0.478SS..  trans-77.7111.4159.944.50000106.9E81 D85E81-T83 HydrophobicContact CG-CG2 4.2Å; E81-T83 PolarHBondContact O-N 3.08Å; T83-D85 PolarHBondContact O-N 2.99Å
84P51.4Low61.7Low81 Ų8189 Ų8953%0.52649%0.489SS..  trans-62.4118.8178.625-32.4000108.1E82 T86E82-P84 VanDerWaalsContact O-CD 3.29Å; E82-P84 WeakPolarHBondContact O-CD 3.46Å; P84-T86 HydrophobicContact CB-CG2 4.34Å; P84-T86 PolarHBondContact O-N 2.93Å; P84-T86 PolarHBondContact O-OG1 3.28Å; P84-T86 VanDerWaalsContact O-OG1 3.06Å
85D50.4Low61.7Low103 Ų10389.7 Ų89.755%0.55148%0.481SS*.  trans-66.863.5167.6-80.9-35.3000110.4F57 T83F57-D85 WeakPolarHBondContact CD1-OD2 3.46Å; F57-D85 HydrophobicContact CE1-CB 3.94Å; F57-D85 WeakPolarHBondContact CE1-OD2 3.43Å; T83-D85 PolarHBondContact O-N 2.99Å
86T46.7Very low61.6Low80 Ų8093.2 Ų93.249%0.49149%0.494SS..SBendtrans-108.2160.5169.343.60000106.4P84 S88 S89P84-T86 HydrophobicContact CB-CG2 4.34Å; P84-T86 PolarHBondContact O-N 2.93Å; P84-T86 PolarHBondContact O-OG1 3.28Å; P84-T86 VanDerWaalsContact O-OG1 3.06Å; T86-S88 CarbonylContact O-C 3.58Å; T86-S88 PolarHBondContact O-N 3.49Å; T86-S89 PolarHBondContact O-N 2.98Å
87A47.3Very low61.7Low81 Ų8192.6 Ų92.667%0.66950%0.5SS*.Hα-helixtrans-48.2-14.3176.500000114.9V90A87-V90 PolarHBondContact O-N 3.49Å
88S51.6Low61.8Low51 Ų5189.1 Ų89.136%0.35749%0.493SS..Hα-helixtrans-62.3-34.8168-1670000114.6T86 V90 L91 S92T86-S88 CarbonylContact O-C 3.58Å; T86-S88 PolarHBondContact O-N 3.49Å; S88-V90 VanDerWaalsContact C-N 3.28Å; S88-V90 PolarHBondContact O-N 2.87Å; S88-L91 PolarHBondContact O-N 2.98Å; S88-S92 PolarHBondContact O-N 3.45Å
89S56.3Low62.4Low36 Ų3688.2 Ų88.225%0.25250%0.497SS..Hα-helixtrans-63.2-38.2176.4-179.80000110.7T86 L91 S92 R95T86-S89 PolarHBondContact O-N 2.98Å; S89-L91 PolarHBondContact O-N 3.5Å; S89-S92 WeakPolarHBondContact O-CB 3.4Å; S89-S92 PolarHBondContact O-N 3.41Å; S89-R95 WeakPolarHBondContact O-CB 3.5Å
90V64.6Low62.9Low62 Ų6293.9 Ų93.938%0.37653%0.525SS..Hα-helixtrans-65.2-26.6-179.5-169.20000112.9A87 S88 R95 I111A87-V90 PolarHBondContact O-N 3.49Å; S88-V90 VanDerWaalsContact C-N 3.28Å; S88-V90 PolarHBondContact O-N 2.87Å; V90-R95 WeakPolarHBondContact O-CD 3.34Å; V90-R95 PolarHBondContact O-NH1 2.94Å; V90-I111 HydrophobicContact CB-CD1 4.45Å; V90-I111 HydrophobicContact CG1-CB 3.94Å; V90-I111 HydrophobicContact CG1-CD1 3.53Å; V90-I111 HydrophobicContact CG1-CG1 4.25Å; V90-I111 HydrophobicContact CG1-CG2 4.25Å
91L69.1Low63.4Low39 Ų3990.2 Ų90.220%0.20451%0.506CS..THydrogen-bonded Turntrans-88.6-11.4175.2-62175.3000113.2S88 S89 I111 P112 M114S88-L91 PolarHBondContact O-N 2.98Å; S89-L91 PolarHBondContact O-N 3.5Å; L91-I111 HydrophobicContact CD2-CG2 3.33Å; L91-I111 HydrophobicContact CG-CG2 4.36Å; L91-P112 WeakPolarHBondContact CD2-O 3.46Å; L91-M114 HydrophobicContact CB-CB 4.24Å; L91-M114 PolarHBondContact O-N 2.9Å
92S69.8Low63.7Low37 Ų3791 Ų9126%0.25952%0.516SS..SBendtrans-68.8146.4-175.3-171.40000111.9S88 S89 S94 R95 F113S88-S92 PolarHBondContact O-N 3.45Å; S89-S92 WeakPolarHBondContact O-CB 3.4Å; S89-S92 PolarHBondContact O-N 3.41Å; S92-S94 PolarHBondContact O-N 3.42Å; S92-S94 PolarHBondContact OG-N 2.87Å; S92-S94 VanDerWaalsContact OG-N 3.11Å; S92-S94 PolarHBondContact OG-OG 3.05Å; S92-R95 WeakPolarHBondContact O-CB 3.46Å; S92-R95 WeakPolarHBondContact O-CG 3.5Å; S92-R95 PolarHBondContact O-N 2.72Å; S92-F113 WeakPolarHBondContact O-CD1 3.32Å
93L76.4Confident64.2Low144 Ų14491.6 Ų91.675%0.75452%0.519SS*.THydrogen-bonded Turntrans-66.5-23.3168-70.6169.8000112.1R95 F113L93-R95 VanDerWaalsContact C-N 3.32Å; L93-F113 HydrophobicContact CD2-CB 4.25Å; L93-F113 HydrophobicContact CD2-CD1 3.86Å; L93-F113 HydrophobicContact CD2-CE1 4.33Å; L93-F113 HydrophobicContact CD2-CG 4.03Å
94S73.6Confident64.6Low95 Ų9597.9 Ų97.966%0.66454%0.541SS*.THydrogen-bonded Turntrans-87.65.5177.863.40000113.9S92S92-S94 PolarHBondContact O-N 3.42Å; S92-S94 PolarHBondContact OG-N 2.87Å; S92-S94 VanDerWaalsContact OG-N 3.11Å; S92-S94 PolarHBondContact OG-OG 3.05Å
95R72.2Confident65.1Low65 Ų6599.5 Ų99.525%0.24555%0.55CS..SBendtrans-60.6148.6177.975.2-173.2-178.5-178.2-1.9111S89 V90 S92 L93 I97 I111 F113S89-R95 WeakPolarHBondContact O-CB 3.5Å; V90-R95 WeakPolarHBondContact O-CD 3.34Å; V90-R95 PolarHBondContact O-NH1 2.94Å; S92-R95 WeakPolarHBondContact O-CB 3.46Å; S92-R95 WeakPolarHBondContact O-CG 3.5Å; S92-R95 PolarHBondContact O-N 2.72Å; L93-R95 VanDerWaalsContact C-N 3.32Å; R95-I97 PolarHBondContact O-N 3.12Å; R95-I111 PolarHBondContact NH1-O 3.1Å; R95-I111 PolarHBondContact NH2-O 3.39Å; R95-F113 HydrophobicContact CG-CE1 4.12Å
96E71.6Confident65.7Low186 Ų18696.4 Ų96.487%0.86954%0.542SS*.  trans-56.6137.7177.2-170.7174.4-168.500111.4N98E96-N98 PolarHBondContact O-N 2.74Å
97I74.5Confident66.5Low144 Ų14496.4 Ų96.474%0.73854%0.538SS*.  trans-77110.6177.7-60.4174.3000107.8R95 T99R95-I97 PolarHBondContact O-N 3.12Å; I97-T99 PolarHBondContact O-N 2.69Å; I97-T99 VanDerWaalsContact O-N 3.11Å
98N70.8Confident67Low78 Ų7899.4 Ų99.442%0.41755%0.554SS.*  trans-66.3112167.8179.8-19.8000108.9E96 D100 N101E96-N98 PolarHBondContact O-N 2.74Å; N98-D100 PolarHBondContact O-N 3.43Å; N98-D100 WeakPolarHBondContact OD1-CB 3.5Å; N98-D100 PolarHBondContact OD1-N 3.13Å; N98-N101 WeakPolarHBondContact O-CB 3.43Å; N98-N101 PolarHBondContact O-N 3.48Å
99T74.5Confident67.6Low125 Ų125100 Ų10077%0.76757%0.568SS**THydrogen-bonded Turntrans-67.2-17-17651.10000113.7I97I97-T99 PolarHBondContact O-N 2.69Å; I97-T99 VanDerWaalsContact O-N 3.11Å
100D73.2Confident68Low139 Ų139100.1 Ų100.174%0.74358%0.575SS**THydrogen-bonded Turntrans-88-9.9180-58-26.9000112.3N98N98-D100 PolarHBondContact O-N 3.43Å; N98-D100 WeakPolarHBondContact OD1-CB 3.5Å; N98-D100 PolarHBondContact OD1-N 3.13Å
101N67.6Low68.3Low50 Ų50101.4 Ų101.427%0.26758%0.579SS.*SBendtrans-73.3137.2177.9-74.5-12.8000111.7N98 Q103 I107N98-N101 WeakPolarHBondContact O-CB 3.43Å; N98-N101 PolarHBondContact O-N 3.48Å; N101-Q103 PolarHBondContact O-N 3.14Å; N101-Q103 VanDerWaalsContact O-N 3.1Å; N101-I107 WeakPolarHBondContact OD1-CD1 3.41Å; N101-I107 WeakPolarHBondContact OD1-CG1 3.38Å; N101-I107 WeakPolarHBondContact OD1-CG2 3.43Å
102V67.2Low68.5Low85 Ų85104.1 Ų104.152%0.51560%0.599SS.*  trans-68.4110.5167.4-176.10000108.4F104 T105 G106V102-F104 PolarHBondContact O-N 3.31Å; V102-T105 VanDerWaalsContact CB-OG1 3.28Å; V102-T105 WeakPolarHBondContact CB-OG1 3.37Å; V102-T105 HydrophobicContact CG1-CG2 4.44Å; V102-T105 WeakPolarHBondContact CG1-OG1 3.45Å; V102-T105 PolarHBondContact O-N 3.03Å; V102-G106 WeakPolarHBondContact O-CA 3.48Å; V102-G106 PolarHBondContact O-N 3.25Å
103Q65.1Low69Low180 Ų180107.2 Ų107.284%0.84161%0.608SS**THydrogen-bonded Turntrans-52.4-30.8-169.1-67.4-178.2-3.500115N101N101-Q103 PolarHBondContact O-N 3.14Å; N101-Q103 VanDerWaalsContact O-N 3.1Å
104F62.4Low68.9Low194 Ų194104.2 Ų104.285%0.85159%0.591SS**THydrogen-bonded Turntrans-100.5-36.2-175.4-73-80.8000114.5V102V102-F104 PolarHBondContact O-N 3.31Å
105T63Low69Low116 Ų116102 Ų10271%0.71257%0.574SS**THydrogen-bonded Turntrans-92.9-15-176.858.40000112.5V102V102-T105 VanDerWaalsContact CB-OG1 3.28Å; V102-T105 WeakPolarHBondContact CB-OG1 3.37Å; V102-T105 HydrophobicContact CG1-CG2 4.44Å; V102-T105 WeakPolarHBondContact CG1-OG1 3.45Å; V102-T105 PolarHBondContact O-N 3.03Å
106G62.7Low69Low37 Ų37102.9 Ų102.938%0.38160%0.604SS.*  trans62.3-167.6-166.800000111.7V102V102-G106 WeakPolarHBondContact O-CA 3.48Å; V102-G106 PolarHBondContact O-N 3.25Å
107I63.6Low68.8Low80 Ų80103.2 Ų103.241%0.4161%0.606SS.*  trans-115.3144.9169.253.2160.8000108.1N101 G109 G110N101-I107 WeakPolarHBondContact OD1-CD1 3.41Å; N101-I107 WeakPolarHBondContact OD1-CG1 3.38Å; N101-I107 WeakPolarHBondContact OD1-CG2 3.43Å; I107-G109 PolarHBondContact O-N 3.19Å; I107-G110 PolarHBondContact O-N 2.98Å
108S56.8Low68.2Low144 Ų144103.4 Ų103.4100%1.00760%0.604SS**THydrogen-bonded Turntrans-65-9.9-18057.90000113.9
109G64.8Low67.7Low64 Ų64110 Ų11066%0.6663%0.628SS**THydrogen-bonded Turntrans-1001.9171.700000114.8I107I107-G109 PolarHBondContact O-N 3.19Å
110G65.3Low67Low39 Ų39108.8 Ų108.840%0.40262%0.615SS.*PPolyproline II helixtrans-77125.4-17700000111.4I107I107-G110 PolarHBondContact O-N 2.98Å
111I70.5Confident66.1Low88 Ų88107.8 Ų107.845%0.45163%0.627SS.*PPolyproline II helixtrans-67.2134.8172.9-64.5168.3000108.3V90 L91 R95V90-I111 HydrophobicContact CB-CD1 4.45Å; V90-I111 HydrophobicContact CG1-CB 3.94Å; V90-I111 HydrophobicContact CG1-CD1 3.53Å; V90-I111 HydrophobicContact CG1-CG1 4.25Å; V90-I111 HydrophobicContact CG1-CG2 4.25Å; L91-I111 HydrophobicContact CD2-CG2 3.33Å; L91-I111 HydrophobicContact CG-CG2 4.36Å; R95-I111 PolarHBondContact NH1-O 3.1Å; R95-I111 PolarHBondContact NH2-O 3.39Å
112P73.5Confident65.5Low96 Ų96107.8 Ų107.862%0.62364%0.638SS**PPolyproline II helixtrans-70.5161.9-179.529.3-35.7000112.4L91L91-P112 WeakPolarHBondContact CD2-O 3.46Å
113F79Confident64.5Low103 Ų103113.5 Ų113.545%0.45266%0.656SS.*PPolyproline II helixtrans-70.6154.6171.8-65.3-73.4000111.9S92 L93 R95S92-F113 WeakPolarHBondContact O-CD1 3.32Å; L93-F113 HydrophobicContact CD2-CB 4.25Å; L93-F113 HydrophobicContact CD2-CD1 3.86Å; L93-F113 HydrophobicContact CD2-CE1 4.33Å; L93-F113 HydrophobicContact CD2-CG 4.03Å; R95-F113 HydrophobicContact CG-CE1 4.12Å
114M74.8Confident63Low80 Ų80116.4 Ų116.439%0.39466%0.659SS.*PPolyproline II helixtrans-63.4127.9175.7-167165.862.800111.1L91 I125L91-M114 HydrophobicContact CB-CB 4.24Å; L91-M114 PolarHBondContact O-N 2.9Å; M114-I125 HydrophobicContact CE-CG2 3.97Å; M114-I125 HydrophobicContact SD-CD1 3.58Å; M114-I125 VanDerWaalsContact SD-CD1 3.58Å; M114-I125 HydrophobicContact SD-CG2 4.21Å
115P75.7Confident62Low48 Ų48110.9 Ų110.931%0.31264%0.638SS.*PPolyproline II helixtrans-69.3136175.529.5-32000109.9Q117 E118 M120P115-Q117 VanDerWaalsContact C-N 3.27Å; P115-Q117 PolarHBondContact O-N 3.44Å; P115-E118 HydrophobicContact CB-CB 4.46Å; P115-E118 HydrophobicContact CG-CB 4.04Å; P115-M120 HydrophobicContact CG-CE 3.62Å
116G73.1Confident60.8Low85 Ų85110.6 Ų110.688%0.87664%0.636SS**SBendtrans-70.3-13.2-170.300000116.4
117Q66.8Low59.8Low192 Ų192113.3 Ų113.390%0.89765%0.646SS**SBendtrans-132.4-7.1-170-64.8-172-26.400114.9P115P115-Q117 VanDerWaalsContact C-N 3.27Å; P115-Q117 PolarHBondContact O-N 3.44Å
118E62.8Low58.7Low149 Ų149116.5 Ų116.570%0.69666%0.664SS**  trans-92.7125.5-179.7-70.4-171.315800110.9P115 M120P115-E118 HydrophobicContact CB-CB 4.46Å; P115-E118 HydrophobicContact CG-CB 4.04Å; E118-M120 PolarHBondContact O-N 3.46Å
119K58.9Low57.7Low216 Ų216116.8 Ų116.894%0.93965%0.653SS**  trans-70.794.3170.4-69.2-178.8-179.1177.20108.5
120M60.6Low56.2Low99 Ų99121.3 Ų121.349%0.48866%0.661SS.*  trans-67.5142.4170.2-69.2-140.3-156.500110.7P115 E118 G122P115-M120 HydrophobicContact CG-CE 3.62Å; E118-M120 PolarHBondContact O-N 3.46Å; M120-G122 PolarHBondContact O-N 3.18Å
121A54.5Low54.6Low119 Ų119124.4 Ų124.498%0.98367%0.668SS**SBendtrans-72.878.717300000109.9
122G54.2Low53.2Low49 Ų49125.7 Ų125.751%0.50568%0.683SS.*SBendtrans-152.7145.6175.100000108.3M120 R124M120-G122 PolarHBondContact O-N 3.18Å; G122-R124 PolarHBondContact O-N 3.06Å; G122-R124 VanDerWaalsContact O-N 3.14Å
123K45.4Very low51.3Low206 Ų206128.3 Ų128.390%0.89669%0.686SS**SBendtrans-43.1122.5-177.8-69.4173.1179.2174.20110.1I125K123-I125 PolarHBondContact O-N 3.07Å
124R34.3Very low49.2Very low241 Ų241127.8 Ų127.891%0.90970%0.696SS**  trans-11.692.7178.6-80.2179.6172.1174.7-2.7113.3G122 V126G122-R124 PolarHBondContact O-N 3.06Å; G122-R124 VanDerWaalsContact O-N 3.14Å; R124-V126 PolarHBondContact O-N 3.44Å; R124-V126 VanDerWaalsContact O-N 3.12Å
125I42.7Very low47.2Very low77 Ų77129.3 Ų129.340%0.39571%0.709SS.*  trans-75.4101.3161.9-56.9175.7000104.6M114 K123 P127M114-I125 HydrophobicContact CE-CG2 3.97Å; M114-I125 HydrophobicContact SD-CD1 3.58Å; M114-I125 VanDerWaalsContact SD-CD1 3.58Å; M114-I125 HydrophobicContact SD-CG2 4.21Å; K123-I125 PolarHBondContact O-N 3.07Å; I125-P127 WeakPolarHBondContact O-CD 3.42Å
126V37.3Very low45.2Very low111 Ų111135.6 Ų135.667%0.67373%0.732SS**  trans-64.3121.1168.3-179.90000105.1R124 L128R124-V126 PolarHBondContact O-N 3.44Å; R124-V126 VanDerWaalsContact O-N 3.12Å; V126-L128 PolarHBondContact O-N 3.47Å
127P42.1Very low43.4Very low93 Ų93141.5 Ų141.560%0.60473%0.734SS**  trans-61114.1167.74.74.7000105.6I125 L129I125-P127 WeakPolarHBondContact O-CD 3.42Å; P127-L129 PolarHBondContact O-N 2.96Å
128L38.9Very low41.8Very low148 Ų148141 Ų14178%0.77573%0.729SS**  trans-64.180.3158.2-78165.2000105.7V126 L130V126-L128 PolarHBondContact O-N 3.47Å; L128-L130 PolarHBondContact O-N 3.38Å
129L35.6Very low40.6Very low149 Ų149141 Ų14178%0.7873%0.733SS**  trans-57.294.3153.1-95148.5000104.2P127 N131P127-L129 PolarHBondContact O-N 2.96Å; L129-N131 PolarHBondContact O-N 3.36Å
130L34.6Very low39.6Very low159 Ų159135.8 Ų135.883%0.83272%0.721SS**  trans-5096.3158.5-96.284.9000105.5L128 P132L128-L130 PolarHBondContact O-N 3.38Å; L130-P132 WeakPolarHBondContact O-CD 3.5Å
131N32.2Very low38.6Very low104 Ų104136.8 Ų136.856%0.55674%0.735SS**  trans-91104.8170.7-1550.4000104.4L129 H133 S134L129-N131 PolarHBondContact O-N 3.36Å; N131-H133 PolarHBondContact O-N 2.97Å; N131-S134 PolarHBondContact O-N 2.94Å
132P41.1Very low38.1Very low116 Ų116139.5 Ų139.575%0.75373%0.727SS**THydrogen-bonded Turntrans-63.40.6178.325.4-32.8000113L130L130-P132 WeakPolarHBondContact O-CD 3.5Å
133H33.6Very low37.3Very low151 Ų151143.1 Ų143.170%0.69974%0.742SS**THydrogen-bonded Turntrans-121.521.5-178.7-69.2-75.4000114.5N131 T135N131-H133 PolarHBondContact O-N 2.97Å; H133-T135 PolarHBondContact O-N 2.93Å; H133-T135 PolarHBondContact O-OG1 3.21Å
134S34.4Very low37.1Very low92 Ų92139.6 Ų139.664%0.64374%0.738SS**  trans-73.277.5172.875.90000111.7N131 F136N131-S134 PolarHBondContact O-N 2.94Å; S134-F136 PolarHBondContact O-N 3.26Å
135T33.3Very low37.2Very low111 Ų111137.4 Ų137.468%0.68174%0.738SS**  trans8107.4136.423.30000116.2H133H133-T135 PolarHBondContact O-N 2.93Å; H133-T135 PolarHBondContact O-OG1 3.21Å
136F32.8Very low36.8Very low181 Ų181137 Ų13779%0.79475%0.752SS**  trans44.689.5135.6-66-91.5000117.3S134 K138S134-F136 PolarHBondContact O-N 3.26Å; F136-K138 PolarHBondContact O-N 3.01Å
137F34.6Very low36.5Very low209 Ų209141.5 Ų141.592%0.91776%0.757SS**  trans-71.988.4135.6-79.3-78.2000107.1L139F137-L139 PolarHBondContact O-N 3.33Å
138K34.3Very low36.1Very low182 Ų182144.7 Ų144.779%0.79177%0.768SS**  trans-64.391.1163.8-158.3175.1-170.1178.10105.7F136F136-K138 PolarHBondContact O-N 3.01Å
139L36.7Very low36Very low148 Ų148147.2 Ų147.278%0.77577%0.767SS**PPolyproline II helixtrans-48.5131.5166.6-79.5162.8000106.6F137F137-L139 PolarHBondContact O-N 3.33Å
140P37.3Very low35.9Very low106 Ų106146.1 Ų146.169%0.68877%0.767SS**PPolyproline II helixtrans-52.7137.6174.722.6-31.3000107.8Q142P140-Q142 PolarHBondContact O-N 3.46Å; P140-Q142 VanDerWaalsContact O-N 3.15Å
141P41.3Very low36.1Very low121 Ų121144.9 Ų144.979%0.78677%0.766SS**PPolyproline II helixtrans-51.7128.2178.321.3-31.3000108.2
142Q44.1Very low36.2Very low176 Ų176145 Ų14582%0.82277%0.773SS**PPolyproline II helixtrans-51132.1175-83.7-157.37.300108.5P140 T144P140-Q142 PolarHBondContact O-N 3.46Å; P140-Q142 VanDerWaalsContact O-N 3.15Å; Q142-T144 PolarHBondContact O-N 3.44Å
143P36.8Very low35.8Very low124 Ų124147.1 Ų147.181%0.80578%0.777SS**  trans-63.9112.6177.325.1-30.1000108.2E145P143-E145 PolarHBondContact O-N 3.46Å
144T41.9Very low36.1Very low132 Ų132144.9 Ų144.981%0.8178%0.779SS**  trans-48.8128.2167.3-47.50000108.6Q142 G146Q142-T144 PolarHBondContact O-N 3.44Å; T144-G146 PolarHBondContact O-N 2.9Å; T144-G146 VanDerWaalsContact O-N 3.11Å
145E35.2Very low35.9Very low196 Ų196148.2 Ų148.292%0.91679%0.788SS**SBendtrans-38.1114.6176.4-62178.8150.600111.4P143P143-E145 PolarHBondContact O-N 3.46Å
146G33.6Very low36Very low68 Ų68153.1 Ų153.170%0.70180%0.796SS**  trans17585.7-174.900000114.8T144T144-G146 PolarHBondContact O-N 2.9Å; T144-G146 VanDerWaalsContact O-N 3.11Å
147R31.5Very low35.9Very low205 Ų205156 Ų15677%0.77480%0.802SS**  trans74.588.4151.4-154.3176.9-161.6172.25.8116.6R149R147-R149 PolarHBondContact O-N 2.91Å
148I33.5Very low36Very low161 Ų161152.5 Ų152.583%0.82680%0.797SS**  trans-57.7116.1160.7-58.1168.7000108.8T150I148-T150 HydrophobicContact CG2-CG2 4.06Å
149R36.9Very low36.2Very low200 Ų200151.3 Ų151.376%0.75580%0.799SS**  trans-116.7106158.9-81.8-172.8170.1-165-2.4107.4R147R147-R149 PolarHBondContact O-N 2.91Å
150T33.6Very low35.9Very low126 Ų126147.7 Ų147.777%0.77380%0.798SS**  trans-70.7124.3171.345.80000110I148I148-T150 HydrophobicContact CG2-CG2 4.06Å
151T40.4Very low35.8Very low133 Ų133149.7 Ų149.782%0.81680%0.801SS**  trans-131.5132.2153.641.30000108.5
152P34.1Very low35.4Very low108 Ų108149.8 Ų149.870%0.70180%0.802SS**  trans-76.5169.6175.336.3-32.6000109.2
153D32.5Very low35.2Very low159 Ų159149.6 Ų149.685%0.8580%0.798SS**  trans96.188.5173.5-51.6-23.6000115.6
154S39.3Very low35.3Very low105 Ų105154.9 Ų154.973%0.73480%0.802SS**  trans-168.692.3142.4167.90000110.1
155L30.1Very low35Very low161 Ų161157.2 Ų157.284%0.84380%0.801SS**  trans-62119.8165.6-71.3152.6000110.9
156Y36.2Very low35.1Very low215 Ų215154.3 Ų154.384%0.84379%0.791SS**  trans-142110.5148.5-80.2-78.3000109.6
157R30.9Very low35.1Very low242 Ų242159.9 Ų159.991%0.91380%0.799SS**  trans-79.9127.5164.8-72.3-177.3174.9-159.8-1.3108
158V36.6Very low35.3Very low134 Ų134156 Ų15681%0.81280%0.798SS**  trans-135.4139.8153.9179.50000106.5
159D37.9Very low35.2Very low158 Ų158157.5 Ų157.585%0.84579%0.793SS**  trans-54.8133.9-160.8-58-66.7000115.9
160G31.2Very low35.3Very low72 Ų72152.4 Ų152.474%0.74279%0.793SS**  87.443.8120.300000120.2
161I34.3Very low35.4Very low147 Ų147153 Ų15375%0.75479%0.788SS**  trans-148.5118.9151.6-53.3-179.9000109.7K163I161-K163 PolarHBondContact O-N 3.29Å; I161-K163 VanDerWaalsContact O-N 3.08Å
162P33.3Very low35.4Very low124 Ų124152.9 Ų152.981%0.80579%0.787SS**  trans-76.698.2173.329.9-28.8000109.6R164P162-R164 PolarHBondContact O-N 2.9Å
163K40.4Very low35.8Very low171 Ų171154 Ų15474%0.74379%0.792SS**  trans-6798164.9-75.6-173.1177.1-175.70108.8I161 F165I161-K163 PolarHBondContact O-N 3.29Å; I161-K163 VanDerWaalsContact O-N 3.08Å; K163-F165 VanDerWaalsContact C-N 3.26Å; K163-F165 HydrophobicContact CB-CD2 4.15Å; K163-F165 HydrophobicContact CB-CE2 4.25Å; K163-F165 HydrophobicContact CD-CE2 4.35Å; K163-F165 PolarHBondContact O-N 3.04Å
164R37.5Very low35.8Very low235 Ų235149.8 Ų149.889%0.88779%0.785SS**  trans-63.493.1157.9-86.3-175.3167.4-171.2-2.5107.6P162 I166P162-R164 PolarHBondContact O-N 2.9Å; R164-I166 VanDerWaalsContact C-N 3.34Å; R164-I166 PolarHBondContact O-N 3.02Å
165F36Very low35.9Very low181 Ų181151.8 Ų151.879%0.79479%0.788SS**  trans-65.596.7160-90.7-95.7000107.6K163 Q167K163-F165 VanDerWaalsContact C-N 3.26Å; K163-F165 HydrophobicContact CB-CD2 4.15Å; K163-F165 HydrophobicContact CB-CE2 4.25Å; K163-F165 HydrophobicContact CD-CE2 4.35Å; K163-F165 PolarHBondContact O-N 3.04Å; F165-Q167 PolarHBondContact O-N 3.28Å
166I37.5Very low36.4Very low135 Ų135153 Ų15369%0.69279%0.789SS**  trans-80.698.2160.1-60.3178.5000105.6R164 T168R164-I166 VanDerWaalsContact C-N 3.34Å; R164-I166 PolarHBondContact O-N 3.02Å; I166-T168 VanDerWaalsContact C-N 3.27Å; I166-T168 PolarHBondContact O-N 3.29Å; I166-T168 VanDerWaalsContact O-N 3.08Å
167Q33.2Very low36.8Very low186 Ų186151.6 Ų151.687%0.86979%0.793SS**  trans-76.482.1169.4-169168.523.400107.7F165 R169F165-Q167 PolarHBondContact O-N 3.28Å; Q167-R169 PolarHBondContact O-N 3.4Å; Q167-R169 VanDerWaalsContact O-N 3.09Å
168T36.9Very low37.6Very low123 Ų123145.2 Ų145.276%0.75578%0.782SS**  trans-76.999171.5-11.90000108.4I166 A170I166-T168 VanDerWaalsContact C-N 3.27Å; I166-T168 PolarHBondContact O-N 3.29Å; I166-T168 VanDerWaalsContact O-N 3.08Å; T168-A170 PolarHBondContact O-N 3.24Å
169R31.2Very low37.8Very low193 Ų193144.6 Ų144.673%0.72878%0.782SS**  trans-56.495.5169-179.9-178.2-174.9175.8-0.5110Q167 Q171Q167-R169 PolarHBondContact O-N 3.4Å; Q167-R169 VanDerWaalsContact O-N 3.09Å; R169-Q171 HydrophobicContact CG-CG 4.01Å; R169-Q171 PolarHBondContact O-N 2.97Å
170A38.3Very low38.3Very low92 Ų92146 Ų14676%0.7679%0.785SS**  trans-82.493.5158.400000108T168 T172T168-A170 PolarHBondContact O-N 3.24Å; A170-T172 PolarHBondContact O-N 3.11Å
171Q35.1Very low39Very low140 Ų140151 Ų15165%0.65479%0.789SS**  trans-73.3104.9160.6-82.9178.3-42.700107.7R169R169-Q171 HydrophobicContact CG-CG 4.01Å; R169-Q171 PolarHBondContact O-N 2.97Å
172T41.2Very low39.2Very low130 Ų130152.6 Ų152.680%0.79879%0.793SS**  trans-118.891.7153.948.90000106.9A170 G174A170-T172 PolarHBondContact O-N 3.11Å; T172-G174 PolarHBondContact O-N 3.46Å
173T42.2Very low39.6Very low132 Ų132152.8 Ų152.881%0.8179%0.792SS**  trans-46.8121.2160.5160000108.8D175T173-D175 PolarHBondContact O-N 2.89Å
174G33.3Very low39.8Very low69 Ų69152.8 Ų152.871%0.71180%0.797SS**  trans-64.3127.4160.500000108.7T172T172-G174 PolarHBondContact O-N 3.46Å
175D41.3Very low40.2Very low148 Ų148148.7 Ų148.779%0.79179%0.792SS**  trans-151.3113.1149-93.5-28.4000106.9T173T173-D175 PolarHBondContact O-N 2.89Å
176E39.2Very low40.7Very low185 Ų185145.5 Ų145.586%0.86479%0.79SS**  trans31.2104151-62-176.4144.600118.9
177M44.4Very low41.2Very low187 Ų187147.1 Ų147.192%0.92180%0.795SS**  trans-90.1127.3153.1-81.9-163.6-74.700110.1
178P47.6Very low41.9Very low107 Ų107147.6 Ų147.670%0.69580%0.797SS**  trans-78.5155.9171.132.5-31.8000110.9M180P178-M180 PolarHBondContact O-N 3.35Å
179P42.4Very low42.2Very low122 Ų122147.2 Ų147.279%0.79281%0.806SS**  trans-73.9112.8-17830-31.9000110Q181P179-Q181 PolarHBondContact O-N 2.98Å
180M48.1Very low42.8Very low187 Ų187141.1 Ų141.192%0.92180%0.803SS**  trans-75.4113.1169.2-80.6-158.5-75.800109.9P178P178-M180 PolarHBondContact O-N 3.35Å
181Q45.5Very low43.1Very low178 Ų178143.8 Ų143.883%0.83281%0.805SS**  trans-64.7140.7176.7-67.6173.2-9.900111.2P179 T183P179-Q181 PolarHBondContact O-N 2.98Å; Q181-T183 PolarHBondContact O-N 2.94Å
182H38.3Very low44Very low180 Ų180148.5 Ų148.583%0.83382%0.818SS**  trans-57129.9166.2-80-82.2000111.1
183T42.5Very low44.7Very low128 Ų128149.4 Ų149.479%0.78582%0.816SS**  trans-137107.7149.5-57.40000106.4Q181Q181-T183 PolarHBondContact O-N 2.94Å
184M44Very low45.2Very low170 Ų170156.4 Ų156.484%0.83784%0.836SS**  trans-75.9121.4172-74.8-140.4-117.100108.8
185D46.5Very low45.8Very low149 Ų149160.8 Ų160.880%0.79784%0.842SS**  trans-111.7112.8159.5-108.3-30.9000108.3Q187D185-Q187 PolarHBondContact O-N 3.21Å
186P45.4Very low46.1Very low115 Ų115161.4 Ų161.475%0.74785%0.845SS**  trans-9781177.536-27.6000109.1
187Q48.6Very low46.5Very low169 Ų169160.1 Ų160.179%0.7984%0.844SS**  trans-140.897.5163.2-69-168.9-2.900107.1D185D185-Q187 PolarHBondContact O-N 3.21Å
188H47Very low46.6Very low196 Ų196158.5 Ų158.591%0.90784%0.839SS**  trans170.860.8151.6-93.668000107.2
189A43.2Very low46.5Very low115 Ų115161.8 Ų161.895%0.9585%0.848SS**  trans-88.698.9162.200000106.9
190G44.7Very low46.8Very low65 Ų65164.4 Ų164.467%0.6785%0.852SS**  trans-144.3124.4177.800000110.3
191N44.8Very low46.7Very low148 Ų148162.8 Ų162.879%0.79185%0.847SS**  trans8078.2171.3-63.6-5.2000117.9
192Y53Low46.8Very low239 Ų239161.6 Ų161.694%0.93785%0.848SS**  trans-100.2125.2133.1-83.1-90.8000107.8
193I56.9Low47.5Very low148 Ų148160.1 Ų160.176%0.75985%0.85SS**  trans-93.9141.6170.7-54.4174.1000106.4
194F53.3Low47.9Very low279 Ų279163 Ų163100%1.22486%0.855SS**  trans-37.90-174.3-68.4-89.2000116.9

Retrieved 194 of 194 residues in 110.2 ms (Link to these results)