A0A060KZS5_PANTA Loading...

Zinc finger protein 593

Involved in pre-60S ribosomal particles maturation by promoting the nuclear export of the 60S ribosome. Negatively modulates the DNA binding activity of Oct-2 and therefore its transcriptional regulatory activity.

AlphaFold DB (M3WUL0), UniProt , Accession A0A060KZS5, Species PANTA (Panthera tigris altaica, Siberian tiger), Gene ZNF593, Length 134 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
1M68.2Low81.7Confident246 Ų246158.2 Ų158.2100%1.21281%0.813SS**  099.40-69.9-82.4-170.500108.6
2G75.9Confident82.1Confident78 Ų78153.3 Ų153.380%0.80481%0.814SS**PPolyproline II helixtrans-80.7150179.400000111.9S4G2-S4 PolarHBondContact O-N 3.47Å
3R78.3Confident82.5Confident253 Ų253155.2 Ų155.296%0.95582%0.815SS**PPolyproline II helixtrans-67.1121.8175.1-69179.3179.7-115.41.9109.6
4S83.4Confident83Confident112 Ų112149.5 Ų149.578%0.78379%0.794SS**PPolyproline II helixtrans-66.1143.3174.5-175.20000111.1G2G2-S4 PolarHBondContact O-N 3.47Å
5R81.9Confident83.4Confident226 Ų226147.8 Ų147.885%0.85379%0.785SS**PPolyproline II helixtrans-70.8136.5177.3-62.8-174.2-154.2-163.36.2109.5T7R5-T7 PolarHBondContact O-N 3.41Å
6R80.2Confident83.6Confident198 Ų198140.9 Ų140.975%0.74776%0.755SS**  trans-8580.5175.2-69.4-174.7-74.8-177.1-3110.1A9 H10R6-A9 HydrophobicContact CB-CB 4.37Å; R6-H10 PolarHBondContact O-CE1 3.44Å; R6-H10 PolarHBondContact O-NE2 2.93Å
7T85Confident83.6Confident123 Ų123145.9 Ų145.976%0.75576%0.761SS**SBendtrans-7013517345.90000110R5 A9R5-T7 PolarHBondContact O-N 3.41Å; T7-A9 PolarHBondContact O-N 3.44Å
8G83.8Confident83.6Confident79 Ų79145.4 Ų145.481%0.81475%0.754SS**SBendtrans75.1-18.9177.500000116.5H10G8-H10 VanDerWaalsContact C-N 3.3Å; G8-H10 PolarHBondContact O-N 3.04Å
9A86.9Confident83.6Confident64 Ų64143.6 Ų143.653%0.52974%0.743SS.*  trans-93.430.6178.400000113.5R6 T7R6-A9 HydrophobicContact CB-CB 4.37Å; T7-A9 PolarHBondContact O-N 3.44Å
10H87.3Confident83.7Confident153 Ų153144.9 Ų144.971%0.70874%0.743SS**PPolyproline II helixtrans-78.5126177.8-57.6-67.4000110.1R6 G8R6-H10 PolarHBondContact O-CE1 3.44Å; R6-H10 PolarHBondContact O-NE2 2.93Å; G8-H10 VanDerWaalsContact C-N 3.3Å; G8-H10 PolarHBondContact O-N 3.04Å
11R87.2Confident83.7Confident208 Ų208140 Ų14079%0.78572%0.724SS**PPolyproline II helixtrans-102.7138.5171.6-67.8-174177.4179.6-0.5109.5H13R11-H13 PolarHBondContact O-CD2 3.46Å; R11-H13 PolarHBondContact O-N 3.13Å; R11-H13 PolarHBondContact O-NE2 3.32Å
12A87Confident84.3Confident100 Ų100138.3 Ų138.383%0.82671%0.71SS**PPolyproline II helixtrans-74120.3168.400000108.6
13H86.9Confident84.5Confident178 Ų178146.3 Ų146.382%0.82472%0.716SS**  trans-98.33.4-179.4-65.6-76000113.2R11R11-H13 PolarHBondContact O-CD2 3.46Å; R11-H13 PolarHBondContact O-N 3.13Å; R11-H13 PolarHBondContact O-NE2 3.32Å
14S90.4Very high84.6Confident75 Ų75142 Ų14252%0.52470%0.699SS.*  trans-119.8126.2-174.8-175.70000112.2A16S14-A16 VanDerWaalsContact C-N 3.27Å; S14-A16 VanDerWaalsContact OG-CB 3.31Å; S14-A16 WeakPolarHBondContact OG-CB 3.28Å; S14-A16 PolarHBondContact OG-N 3.37Å
15L87.7Confident84.5Confident124 Ų124142.3 Ų142.365%0.64969%0.689SS**  trans-82.3-3.9171.3-60.3177.4000112.9R17 Q18 M19L15-R17 PolarHBondContact O-N 3.29Å; L15-Q18 PolarHBondContact O-N 3.19Å; L15-M19 PolarHBondContact O-N 3.32Å
16A87.4Confident84.8Confident38 Ų38133.1 Ų133.131%0.31466%0.658SS.*Hα-helixtrans-60.2-32.3-175.400000112.5S14 Q18 M19 K20S14-A16 VanDerWaalsContact C-N 3.27Å; S14-A16 VanDerWaalsContact OG-CB 3.31Å; S14-A16 WeakPolarHBondContact OG-CB 3.28Å; S14-A16 PolarHBondContact OG-N 3.37Å; A16-Q18 VanDerWaalsContact C-N 3.27Å; A16-Q18 PolarHBondContact O-N 3.49Å; A16-M19 PolarHBondContact O-N 2.91Å; A16-K20 HydrophobicContact CB-CD 4.31Å; A16-K20 VanDerWaalsContact O-CB 3.3Å; A16-K20 WeakPolarHBondContact O-CB 3.17Å; A16-K20 PolarHBondContact O-N 2.97Å
17R83.9Confident85.1Confident225 Ų225128.7 Ų128.785%0.84965%0.65SS**Hα-helixtrans-62.5-35176.5-70.6-173.6174.4-148.3-1.4112.5L15 A21L15-R17 PolarHBondContact O-N 3.29Å; R17-A21 WeakPolarHBondContact O-CB 3.23Å
18Q83.4Confident85.2Confident138 Ų138125.6 Ų125.665%0.64563%0.628SS**Hα-helixtrans-77.9-36.9178.7-174.1177.9-21.900111.9L15 A16L15-Q18 PolarHBondContact O-N 3.19Å; A16-Q18 VanDerWaalsContact C-N 3.27Å; A16-Q18 PolarHBondContact O-N 3.49Å
19M83.4Confident85.4Confident111 Ų111124.6 Ų124.655%0.54760%0.604SS.*Hα-helixtrans-94.8-29.3-171.5-61-61.5172.700114.9L15 A16 R24L15-M19 PolarHBondContact O-N 3.32Å; A16-M19 PolarHBondContact O-N 2.91Å; M19-R24 WeakPolarHBondContact O-CD 3.49Å; M19-R24 PolarHBondContact O-NH1 3.37Å
20K85.3Confident85.4Confident168 Ų168126.6 Ų126.673%0.7360%0.602SS**SBendtrans-102.2-6.3-175.2-60.7-172.8178.4-174.40113.9A16A16-K20 HydrophobicContact CB-CD 4.31Å; A16-K20 VanDerWaalsContact O-CB 3.3Å; A16-K20 WeakPolarHBondContact O-CB 3.17Å; A16-K20 PolarHBondContact O-N 2.97Å
21A84Confident85.4Confident42 Ų42119.4 Ų119.435%0.34757%0.569SS.*SBendtrans-61.6149.3175.200000110.4R17 R23 R24R17-A21 WeakPolarHBondContact O-CB 3.23Å; A21-R23 PolarHBondContact O-N 3.32Å; A21-R24 VanDerWaalsContact O-CG 3.28Å; A21-R24 WeakPolarHBondContact O-CG 3.41Å
22K80.5Confident85.3Confident212 Ų212110.2 Ų110.292%0.92254%0.535SS*.SBendtrans-76-11.9178-64.3-176178.2-175.10113.4R24K22-R24 VanDerWaalsContact C-N 3.29Å; K22-R24 PolarHBondContact O-N 3.1Å; K22-R24 VanDerWaalsContact O-N 3.17Å
23R79.4Confident85.3Confident246 Ų246113 Ų11393%0.92852%0.524SS*.  trans-88.561.5177.7-58.9-176.3-171.5-162.10.9110.4A21A21-R23 PolarHBondContact O-N 3.32Å
24R81Confident85Confident161 Ų161106.1 Ų106.161%0.60849%0.492SS*.PPolyproline II helixtrans-95.4159.6-179.6-75.8-177.9-59.4-157.68.9111.4M19 A21 K22M19-R24 WeakPolarHBondContact O-CD 3.49Å; M19-R24 PolarHBondContact O-NH1 3.37Å; A21-R24 VanDerWaalsContact O-CG 3.28Å; A21-R24 WeakPolarHBondContact O-CG 3.41Å; K22-R24 VanDerWaalsContact C-N 3.29Å; K22-R24 PolarHBondContact O-N 3.1Å; K22-R24 VanDerWaalsContact O-N 3.17Å
25Q82.5Confident84.4Confident120 Ų120104 Ų10456%0.56148%0.475SS*.PPolyproline II helixtrans-65.6150.1167.8-67.1-67.9-79.300109.5
26P86.6Confident83.9Confident33 Ų33104.4 Ų104.421%0.21447%0.468CS..PPolyproline II helixtrans-62.8146.1178.325.1-32.7000111.5E30 I31 A67 R88P26-E30 HydrophobicContact CB-CG 4.48Å; P26-E30 WeakPolarHBondContact CB-OE2 3.34Å; P26-I31 HydrophobicContact CB-CG1 4.41Å; P26-I31 HydrophobicContact CG-CD1 4.34Å; P26-I31 HydrophobicContact CG-CG1 4.37Å; P26-A67 HydrophobicContact CG-CB 3.35Å; P26-R88 PolarHBondContact O-NH2 3.23Å
27D88.4Confident82.9Confident105 Ų105108.7 Ų108.756%0.56149%0.493SS*.PPolyproline II helixtrans-75.8166.3-178.2-71.3-51.7000111.2D29 E30 I31D27-D29 VanDerWaalsContact CB-OD1 3.28Å; D27-D29 WeakPolarHBondContact CB-OD1 3.38Å; D27-D29 PolarHBondContact O-N 3.39Å; D27-E30 PolarHBondContact O-N 3.08Å; D27-I31 WeakPolarHBondContact O-CG1 3.44Å; D27-I31 PolarHBondContact O-N 2.97Å
28L86.3Confident81.6Confident58 Ų58106 Ų10630%0.30449%0.49SS..Hα-helixtrans-65.1-39.4-174.7-80168.5000112.4I31 H32 Q91 L92L28-I31 PolarHBondContact O-N 3.02Å; L28-H32 PolarHBondContact O-N 3.28Å; L28-H32 PolarHBondContact O-ND1 3.4Å; L28-Q91 HydrophobicContact CD1-CB 4.27Å; L28-Q91 HydrophobicContact CD2-CB 3.98Å; L28-L92 HydrophobicContact CD2-CD2 3.89Å; L28-L92 HydrophobicContact CD2-CG 4.47Å
29D87.3Confident80.4Confident57 Ų57102.5 Ų102.531%0.30548%0.478SS..Hα-helixtrans-67.8-38.3179.764.8-44000111.9D27 I31 H32 R33 P96D27-D29 VanDerWaalsContact CB-OD1 3.28Å; D27-D29 WeakPolarHBondContact CB-OD1 3.38Å; D27-D29 PolarHBondContact O-N 3.39Å; D29-I31 VanDerWaalsContact C-N 3.35Å; D29-I31 PolarHBondContact O-N 2.97Å; D29-H32 PolarHBondContact O-N 2.9Å; D29-R33 WeakPolarHBondContact O-CG 3.47Å; D29-R33 PolarHBondContact O-N 3.43Å; D29-R33 IonicContact OD2-NH2 3.61Å; D29-P96 HydrophobicContact CB-CB 4.01Å
30E87.4Confident78.6Confident107 Ų107103.1 Ų103.150%0.549%0.49SS..Hα-helixtrans-59.7-45.2173.2-172175.4-166.100111.3P26 D27 H32 R33 E34P26-E30 HydrophobicContact CB-CG 4.48Å; P26-E30 WeakPolarHBondContact CB-OE2 3.34Å; D27-E30 PolarHBondContact O-N 3.08Å; E30-H32 PolarHBondContact O-N 2.98Å; E30-R33 WeakPolarHBondContact O-CB 3.43Å; E30-R33 PolarHBondContact O-N 2.91Å; E30-E34 PolarHBondContact O-N 3.47Å; E30-E34 VanDerWaalsContact O-N 3.07Å
31I87.3Confident76.8Confident1 Ų199.3 Ų99.31%0.00549%0.49CS..Hα-helixtrans-65.4-39.9177.1-64.4-177000111.7P26 D27 L28 D29 R33 E34 L35 A65 A67 L92P26-I31 HydrophobicContact CB-CG1 4.41Å; P26-I31 HydrophobicContact CG-CD1 4.34Å; P26-I31 HydrophobicContact CG-CG1 4.37Å; D27-I31 WeakPolarHBondContact O-CG1 3.44Å; D27-I31 PolarHBondContact O-N 2.97Å; L28-I31 PolarHBondContact O-N 3.02Å; D29-I31 VanDerWaalsContact C-N 3.35Å; D29-I31 PolarHBondContact O-N 2.97Å; I31-R33 VanDerWaalsContact C-N 3.26Å; I31-R33 PolarHBondContact O-N 3.06Å; I31-E34 PolarHBondContact O-N 2.89Å; I31-L35 HydrophobicContact CG2-CD1 3.81Å; I31-L35 HydrophobicContact CG2-CG 4.21Å; I31-L35 WeakPolarHBondContact O-CB 3.23Å; I31-L35 WeakPolarHBondContact O-CG 3.07Å; I31-L35 PolarHBondContact O-N 3.07Å; I31-A65 WeakPolarHBondContact CD1-O 3.32Å; I31-A67 HydrophobicContact CD1-CB 4.23Å; I31-L92 HydrophobicContact CB-CD2 4.4Å; I31-L92 HydrophobicContact CG2-CD1 4.23Å; I31-L92 HydrophobicContact CG2-CD2 3.94Å
32H85.8Confident75.3Confident15 Ų15106.8 Ų106.87%0.06951%0.509CS..Hα-helixtrans-62.3-34.4174.9-78.597.2000112.4L28 D29 E30 R36 L92 V94 P96L28-H32 PolarHBondContact O-N 3.28Å; L28-H32 PolarHBondContact O-ND1 3.4Å; D29-H32 PolarHBondContact O-N 2.9Å; E30-H32 PolarHBondContact O-N 2.98Å; H32-R36 WeakPolarHBondContact O-CG 3.45Å; H32-R36 PolarHBondContact O-N 3.37Å; H32-L92 WeakPolarHBondContact CE1-CD2 3.47Å; H32-L92 WeakPolarHBondContact NE2-CA 3.44Å; H32-L92 PolarHBondContact NE2-O 3.34Å; H32-V94 PolarHBondContact NE2-O 3.42Å; H32-P96 HydrophobicContact CB-CG 3.85Å
33R85.5Confident74Confident158 Ų15898.1 Ų98.160%0.59648%0.475SS*.Hα-helixtrans-67.1-40.4174.6-67.8170.1-169.6-179.26.7111.3D29 E30 I31 R36D29-R33 WeakPolarHBondContact O-CG 3.47Å; D29-R33 PolarHBondContact O-N 3.43Å; D29-R33 IonicContact OD2-NH2 3.61Å; E30-R33 WeakPolarHBondContact O-CB 3.43Å; E30-R33 PolarHBondContact O-N 2.91Å; I31-R33 VanDerWaalsContact C-N 3.26Å; I31-R33 PolarHBondContact O-N 3.06Å; R33-R36 PolarHBondContact O-N 3.18Å
34E81.3Confident73Confident34 Ų3494.3 Ų94.316%0.15946%0.461CS..Hα-helixtrans-69-35177.7-173174.1-163.800112.9E30 I31 R36 R62E30-E34 PolarHBondContact O-N 3.47Å; E30-E34 VanDerWaalsContact O-N 3.07Å; I31-E34 PolarHBondContact O-N 2.89Å; E34-R36 VanDerWaalsContact C-N 3.26Å; E34-R36 PolarHBondContact O-N 2.78Å; E34-R62 VanDerWaalsContact CD-NH2 3.27Å; E34-R62 IonicContact OE1-CZ 3.92Å; E34-R62 IonicContact OE1-NH1 2.98Å; E34-R62 PolarHBondContact OE1-NH1 2.8Å; E34-R62 IonicContact OE1-NH2 3.91Å; E34-R62 PolarHBondContact OE1-NH2 3.19Å; E34-R62 IonicContact OE2-NH2 2.8Å; E34-R62 PolarHBondContact OE2-NH2 3.02Å
35L78.8Confident72Confident32 Ų3288.6 Ų88.617%0.16845%0.445CS..THydrogen-bonded Turntrans-73.8-12.9177.7-73.9170.8000113.8I31 L64 L92 P120I31-L35 HydrophobicContact CG2-CD1 3.81Å; I31-L35 HydrophobicContact CG2-CG 4.21Å; I31-L35 WeakPolarHBondContact O-CB 3.23Å; I31-L35 WeakPolarHBondContact O-CG 3.07Å; I31-L35 PolarHBondContact O-N 3.07Å; L35-L64 HydrophobicContact CD2-CB 4.04Å; L35-L92 HydrophobicContact CD1-CD1 4.04Å; L35-P120 HydrophobicContact CD2-CG 4.37Å
36R77.4Confident70.9Confident131 Ų13188.1 Ų88.149%0.49445%0.446SS..SBendtrans-69130.5178.9-77.7169.8-173.5-164.2-0109.3H32 R33 E34 Q38 V39H32-R36 WeakPolarHBondContact O-CG 3.45Å; H32-R36 PolarHBondContact O-N 3.37Å; R33-R36 PolarHBondContact O-N 3.18Å; E34-R36 VanDerWaalsContact C-N 3.26Å; E34-R36 PolarHBondContact O-N 2.78Å; R36-Q38 PolarHBondContact O-N 3.25Å; R36-V39 PolarHBondContact O-N 3.41Å
37P64.6Low69.5Low128 Ų12895.2 Ų95.283%0.83148%0.481SS*.THydrogen-bonded Turntrans-63.7-9.6-175.724.8-34.4000114.2V39P37-V39 VanDerWaalsContact C-N 3.29Å; P37-V39 PolarHBondContact O-N 3.02Å
38Q58.4Low68.1Low169 Ų16993.4 Ų93.479%0.7949%0.487SS*.THydrogen-bonded Turntrans-80.9-6.4-179-51.2-176.148.200113.2R36 P40R36-Q38 PolarHBondContact O-N 3.25Å; Q38-P40 VanDerWaalsContact O-CD 3.28Å; Q38-P40 WeakPolarHBondContact O-CD 3.23Å
39V57.3Low67.2Low65 Ų6593.2 Ų93.239%0.39449%0.491SS..  trans-109.893.5178.4-174.70000109.3R36 P37 A41R36-V39 PolarHBondContact O-N 3.41Å; P37-V39 VanDerWaalsContact C-N 3.29Å; P37-V39 PolarHBondContact O-N 3.02Å; V39-A41 PolarHBondContact O-N 3.49Å
40P46.5Very low66.5Low124 Ų12499.4 Ų99.481%0.80552%0.517SS*.  trans-80.90.6-165.229.5-35.8000116.3Q38Q38-P40 VanDerWaalsContact O-CD 3.28Å; Q38-P40 WeakPolarHBondContact O-CD 3.23Å
41A47.6Very low66.1Low88 Ų8898.2 Ų98.273%0.72752%0.519SS*.SBendtrans-125.7-5.2-157.200000117.6V39V39-A41 PolarHBondContact O-N 3.49Å
42R51.4Low65.9Low199 Ų199101.2 Ų101.275%0.75154%0.535SS*.SBendtrans-127.6-18.3-176.9-67.7-173.8177.2-177.2-0.6114.9R62R42-R62 PolarHBondContact O-NH1 3.49Å
43S53.9Low65.9Low29 Ų29106.2 Ų106.220%0.20357%0.569CS.*SBendtrans-86-23.8-166.647.30000113.4L64S43-L64 WeakPolarHBondContact O-CD1 3.27Å; S43-L64 WeakPolarHBondContact O-CD2 3.49Å; S43-L64 WeakPolarHBondContact O-CG 3.37Å
44R58Low66Low166 Ų166105.9 Ų105.963%0.62658%0.579SS**SBendtrans-123.8122.8176.4-147.2167.9-177.3163.20.7108.5D46 E122R44-D46 PolarHBondContact O-N 3.29Å; R44-E122 IonicContact CZ-OE2 3.22Å; R44-E122 IonicContact NH1-OE2 2.78Å
45P59.3Low66.3Low42 Ų42106.7 Ų106.727%0.27358%0.584SS.*  trans-59.1113.7165.824.5-28.6000105.7L47 G59P45-L47 PolarHBondContact O-N 3.47Å; P45-G59 WeakPolarHBondContact CB-O 3.34Å
46D59.3Low66.7Low110 Ų110108 Ų10859%0.58860%0.595SS**  trans-62130.5175.7-170.1-92.4000106.7R44 G48 S49R44-D46 PolarHBondContact O-N 3.29Å; D46-G48 PolarHBondContact O-N 3.48Å; D46-G48 WeakPolarHBondContact OD1-CA 3.21Å; D46-G48 PolarHBondContact OD1-N 3.32Å; D46-S49 WeakPolarHBondContact O-CB 3.49Å; D46-S49 PolarHBondContact O-N 2.88Å; D46-S49 PolarHBondContact O-OG 3.03Å
47L58.3Low67.1Low182 Ų182103 Ų10395%0.95358%0.583SS**THydrogen-bonded Turntrans-60.7-15.4-179.9-76160.5000111.9P45P45-L47 PolarHBondContact O-N 3.47Å
48G58.8Low68Low66 Ų6697.7 Ų97.768%0.6855%0.552SS**THydrogen-bonded Turntrans-99.72.3172.400000115.3D46D46-G48 PolarHBondContact O-N 3.48Å; D46-G48 WeakPolarHBondContact OD1-CA 3.21Å; D46-G48 PolarHBondContact OD1-N 3.32Å
49S66.1Low69.1Low55 Ų5590 Ų9039%0.38552%0.519SS..SBendtrans-72.5138.2175620000111.6D46D46-S49 WeakPolarHBondContact O-CB 3.49Å; D46-S49 PolarHBondContact O-N 2.88Å; D46-S49 PolarHBondContact O-OG 3.03Å
50E73.3Confident70.3Confident186 Ų18690.7 Ų90.787%0.86952%0.52SS*.PPolyproline II helixtrans-60.2136.4174-82.9-174.89100110.3D52E50-D52 PolarHBondContact O-N 3.03Å
51P78.8Confident72.2Confident83 Ų8387.4 Ų87.454%0.53949%0.494SS..PPolyproline II helixtrans-65.5122.6-179.826.3-33000110.1P53 G58P51-P53 WeakPolarHBondContact O-CD 3.31Å; P51-G58 WeakPolarHBondContact CA-O 3.28Å
52D83.7Confident74.1Confident64 Ų6485 Ų8534%0.34247%0.466SS..PPolyproline II helixtrans-75117178-177-11.3000109.9E50 D54 L55 G58E50-D52 PolarHBondContact O-N 3.03Å; D52-D54 PolarHBondContact O-N 2.71Å; D52-D54 WeakPolarHBondContact OD1-CB 3.42Å; D52-D54 PolarHBondContact OD1-N 2.99Å; D52-L55 HydrophobicContact CB-CB 4.35Å; D52-L55 HydrophobicContact CB-CD1 4Å; D52-L55 HydrophobicContact CB-CG 4.37Å; D52-L55 PolarHBondContact O-N 2.98Å; D52-L55 WeakPolarHBondContact OD2-CD1 3.31Å; D52-G58 PolarHBondContact N-O 3.34Å; D52-G58 WeakPolarHBondContact O-CA 3.5Å
53P84.9Confident75.8Confident120 Ų12075.7 Ų75.778%0.77943%0.431SS*.THydrogen-bonded Turntrans-68.1-18.3-177.929.7-36.4000113.7P51P51-P53 WeakPolarHBondContact O-CD 3.31Å
54D88.5Confident77.3Confident151 Ų15175.3 Ų75.381%0.80743%0.427SS*.THydrogen-bonded Turntrans-83.9-15.7-179.4-70.7-38.3000112.6D52D52-D54 PolarHBondContact O-N 2.71Å; D52-D54 WeakPolarHBondContact OD1-CB 3.42Å; D52-D54 PolarHBondContact OD1-N 2.99Å
55L86.7Confident78.7Confident51 Ų5167.9 Ų67.927%0.26740%0.401SS..SBendtrans-99.8142.5180-71.2169.5000111.6D52 G57 G58 Y69D52-L55 HydrophobicContact CB-CB 4.35Å; D52-L55 HydrophobicContact CB-CD1 4Å; D52-L55 HydrophobicContact CB-CG 4.37Å; D52-L55 PolarHBondContact O-N 2.98Å; D52-L55 WeakPolarHBondContact OD2-CD1 3.31Å; L55-G57 PolarHBondContact O-N 2.84Å; L55-G58 PolarHBondContact O-N 3.24Å; L55-Y69 HydrophobicContact CD1-CE1 4.04Å; L55-Y69 HydrophobicContact CD1-CE2 4.39Å; L55-Y69 HydrophobicContact CD2-CD2 3.76Å; L55-Y69 HydrophobicContact CD2-CE1 4.5Å; L55-Y69 HydrophobicContact CD2-CE2 3.68Å; L55-Y69 HydrophobicContact CD2-CG 4.22Å
56P88.3Confident80Confident60 Ų6066.7 Ų66.739%0.3939%0.393SS..G310 helixtrans-65.7136.5177.228.1-31.3000109.8G58 Y69 V71P56-G58 PolarHBondContact O-N 2.83Å; P56-Y69 VanDerWaalsContact CG-CB 3.49Å; P56-V71 HydrophobicContact CB-CG2 4.21Å
57G84.9Confident81.4Confident24 Ų2462.2 Ų62.225%0.24737%0.371CS..G310 helixtrans66.123.7-176.800000114L55 G59 L60L55-G57 PolarHBondContact O-N 2.84Å; G57-G59 PolarHBondContact O-N 3.12Å; G57-L60 WeakPolarHBondContact O-CB 2.84Å; G57-L60 PolarHBondContact O-N 3.3Å; G57-L60 VanDerWaalsContact O-N 3.16Å
58G83.5Confident82.8Confident17 Ų1759.3 Ų59.318%0.17535%0.348CS..G310 helixtrans66.817.7178.700000113.9P51 D52 L55 P56 L60P51-G58 WeakPolarHBondContact CA-O 3.28Å; D52-G58 PolarHBondContact N-O 3.34Å; D52-G58 WeakPolarHBondContact O-CA 3.5Å; L55-G58 PolarHBondContact O-N 3.24Å; P56-G58 PolarHBondContact O-N 2.83Å; G58-L60 PolarHBondContact O-N 3.5Å
59G82.2Confident84.3Confident9 Ų959.9 Ų59.99%0.09333%0.33CS..G310 helixtrans75.9-2.2-174.200000115P45 G57P45-G59 WeakPolarHBondContact CB-O 3.34Å; G57-G59 PolarHBondContact O-N 3.12Å
60L82.6Confident85.4Confident79 Ų7958.4 Ų58.441%0.41432%0.316SS..  trans-74-35-172.7-58.7175000113.2G57 G58G57-L60 WeakPolarHBondContact O-CB 2.84Å; G57-L60 PolarHBondContact O-N 3.3Å; G57-L60 VanDerWaalsContact O-N 3.16Å; G58-L60 PolarHBondContact O-N 3.5Å
61H86.8Confident86.3Confident55 Ų5553.8 Ų53.826%0.25530%0.301SS..EExtended strand (participates in β ladder)trans-107.186.4-175.6-58.8-44.8000110.9Y69 F70 V71 D72 S73 L76H61-Y69 CarbonylContact O-C 3.57Å; H61-F70 HydrophobicContact CB-CB 4.15Å; H61-F70 WeakPolarHBondContact O-CB 3.02Å; H61-F70 PolarHBondContact O-N 3.35Å; H61-V71 PolarHBondContact CD2-O 3.42Å; H61-D72 VanDerWaalsContact CD2-C 3.43Å; H61-S73 PolarHBondContact CD2-N 3.45Å; H61-S73 PolarHBondContact NE2-N 3.07Å; H61-L76 HydrophobicContact CB-CD1 3.89Å
62R87.2Confident86.8Confident37 Ų3753.7 Ų53.714%0.1430%0.296CS..EExtended strand (participates in β ladder)trans-118140-179-168-172178.2-159.8-12.5112.1E34 R42 L64 R68 Y69E34-R62 VanDerWaalsContact CD-NH2 3.27Å; E34-R62 IonicContact OE1-CZ 3.92Å; E34-R62 IonicContact OE1-NH1 2.98Å; E34-R62 PolarHBondContact OE1-NH1 2.8Å; E34-R62 IonicContact OE1-NH2 3.91Å; E34-R62 PolarHBondContact OE1-NH2 3.19Å; E34-R62 IonicContact OE2-NH2 2.8Å; E34-R62 PolarHBondContact OE2-NH2 3.02Å; R42-R62 PolarHBondContact O-NH1 3.49Å; R62-L64 HydrophobicContact CG-CD2 4.3Å; R62-R68 WeakPolarHBondContact CA-O 3.49Å; R62-Y69 HydrophobicContact CB-CD1 3.76Å; R62-Y69 HydrophobicContact CB-CE1 3.85Å; R62-Y69 VanDerWaalsContact CD-CE1 3.44Å; R62-Y69 HydrophobicContact CG-CD1 3.78Å; R62-Y69 HydrophobicContact CG-CE1 3.68Å; R62-Y69 HydrophobicContact CG-CG 4.25Å
63C87.4Confident87.1Confident4 Ų453.1 Ų53.13%0.02730%0.297CS..EExtended strand (participates in β ladder)trans-98.4121165.5175.90000109.9C66 A67 R68 F70 H79 F80 H85C63-C66 HydrophobicContact CB-CB 4.42Å; C63-A67 VanDerWaalsContact O-CA 3.26Å; C63-A67 WeakPolarHBondContact O-CA 3.41Å; C63-A67 PolarHBondContact O-N 2.74Å; C63-R68 PolarHBondContact N-O 3.21Å; C63-R68 PolarHBondContact O-N 2.94Å; C63-F70 HydrophobicContact CB-CE2 3.92Å; C63-H79 PolarHBondContact SG-NE2 2.98Å; C63-F80 HydrophobicContact CB-CE1 4.4Å; C63-H85 VanDerWaalsContact SG-CE1 3.55Å
64L85.2Confident87.4Confident21 Ų2151.4 Ų51.411%0.1128%0.284CS..THydrogen-bonded Turntrans-74-43.9-175.7-52.1-174.9000112.5L35 S43 R62 C66 A67 E122L35-L64 HydrophobicContact CD2-CB 4.04Å; S43-L64 WeakPolarHBondContact O-CD1 3.27Å; S43-L64 WeakPolarHBondContact O-CD2 3.49Å; S43-L64 WeakPolarHBondContact O-CG 3.37Å; R62-L64 HydrophobicContact CG-CD2 4.3Å; L64-C66 PolarHBondContact O-N 3.13Å; L64-C66 VanDerWaalsContact O-N 3.13Å; L64-A67 PolarHBondContact O-N 3.12Å; L64-A67 VanDerWaalsContact O-N 3.12Å; L64-E122 VanDerWaalsContact CD1-OE1 3.31Å; L64-E122 WeakPolarHBondContact CD1-OE1 3.44Å
65A86.5Confident87.6Confident10 Ų1046.5 Ų46.58%0.08326%0.26CS..THydrogen-bonded Turntrans-58.2-31.1178.100000113.2I31 R88 L89 L92I31-A65 WeakPolarHBondContact CD1-O 3.32Å; A65-R88 WeakPolarHBondContact O-CG 3.24Å; A65-R88 PolarHBondContact O-NE 3.38Å; A65-L89 HydrophobicContact CB-CD2 3.91Å; A65-L92 HydrophobicContact CB-CD1 3.62Å
66C87.6Confident87.8Confident16 Ų1645.3 Ų45.311%0.10825%0.253CS..THydrogen-bonded Turntrans-104.8-7.3179.5-64.10000113.7C63 L64 R68 H79C63-C66 HydrophobicContact CB-CB 4.42Å; L64-C66 PolarHBondContact O-N 3.13Å; L64-C66 VanDerWaalsContact O-N 3.13Å; C66-R68 HydrophobicContact CB-CB 4.49Å; C66-R68 HydrophobicContact CB-CG 4.42Å; C66-R68 PolarHBondContact O-N 3.2Å; C66-H79 VanDerWaalsContact SG-CE1 3.55Å; C66-H79 PolarHBondContact SG-NE2 3.38Å; C66-H79 VanDerWaalsContact SG-NE2 3.43Å
67A87.8Confident87.9Confident16 Ų1648.5 Ų48.513%0.13226%0.261CS..THydrogen-bonded Turntrans47.241.2-172.600000114P26 I31 C63 L64P26-A67 HydrophobicContact CG-CB 3.35Å; I31-A67 HydrophobicContact CD1-CB 4.23Å; C63-A67 VanDerWaalsContact O-CA 3.26Å; C63-A67 WeakPolarHBondContact O-CA 3.41Å; C63-A67 PolarHBondContact O-N 2.74Å; L64-A67 PolarHBondContact O-N 3.12Å; L64-A67 VanDerWaalsContact O-N 3.12Å
68R88.3Confident88.3Confident122 Ų12251.8 Ų51.846%0.4628%0.277SS..EExtended strand (participates in β ladder)trans-117.1137.1-178.5-75.717564.7-174.20.8111R62 C63 C66 F70R62-R68 WeakPolarHBondContact CA-O 3.49Å; C63-R68 PolarHBondContact N-O 3.21Å; C63-R68 PolarHBondContact O-N 2.94Å; C66-R68 HydrophobicContact CB-CB 4.49Å; C66-R68 HydrophobicContact CB-CG 4.42Å; C66-R68 PolarHBondContact O-N 3.2Å; R68-F70 HydrophobicContact CB-CE2 4.07Å; R68-F70 HydrophobicContact CB-CZ 4.28Å
69Y89.6Confident88.8Confident78 Ų7851.7 Ų51.731%0.30627%0.272SS..EExtended strand (participates in β ladder)trans-92.9147.3171.8-63.8-86.6000110.6L55 P56 H61 R62L55-Y69 HydrophobicContact CD1-CE1 4.04Å; L55-Y69 HydrophobicContact CD1-CE2 4.39Å; L55-Y69 HydrophobicContact CD2-CD2 3.76Å; L55-Y69 HydrophobicContact CD2-CE1 4.5Å; L55-Y69 HydrophobicContact CD2-CE2 3.68Å; L55-Y69 HydrophobicContact CD2-CG 4.22Å; P56-Y69 VanDerWaalsContact CG-CB 3.49Å; H61-Y69 CarbonylContact O-C 3.57Å; R62-Y69 HydrophobicContact CB-CD1 3.76Å; R62-Y69 HydrophobicContact CB-CE1 3.85Å; R62-Y69 VanDerWaalsContact CD-CE1 3.44Å; R62-Y69 HydrophobicContact CG-CD1 3.78Å; R62-Y69 HydrophobicContact CG-CE1 3.68Å; R62-Y69 HydrophobicContact CG-CG 4.25Å
70F90.6Very high89.1Confident23 Ų2354.3 Ų54.310%0.10128%0.281CS..EExtended strand (participates in β ladder)trans-128155.6-177.1-68.8-83000109.5H61 C63 R68 L76 H79H61-F70 HydrophobicContact CB-CB 4.15Å; H61-F70 WeakPolarHBondContact O-CB 3.02Å; H61-F70 PolarHBondContact O-N 3.35Å; C63-F70 HydrophobicContact CB-CE2 3.92Å; R68-F70 HydrophobicContact CB-CE2 4.07Å; R68-F70 HydrophobicContact CB-CZ 4.28Å; F70-L76 HydrophobicContact CB-CB 4.41Å; F70-L76 HydrophobicContact CD2-CB 4.35Å; F70-L76 HydrophobicContact CD2-CG 4.43Å; F70-L76 HydrophobicContact CG-CB 4.4Å; F70-H79 HydrophobicContact CE1-CB 3.9Å; F70-H79 HydrophobicContact CE2-CB 4.22Å; F70-H79 AromaticContact CE2-CD2 3.87Å; F70-H79 AromaticContact CE2-CG 3.92Å; F70-H79 HydrophobicContact CZ-CB 3.58Å; F70-H79 AromaticContact CZ-CD2 3.75Å; F70-H79 AromaticContact CZ-CG 3.35Å; F70-H79 AromaticContact CZ-ND1 3.63Å
71V91.1Very high89.6Confident90 Ų9060.3 Ų60.355%0.54530%0.298SS..SBendtrans-79-40.1-178.7-176.20000111.1P56 H61P56-V71 HydrophobicContact CB-CG2 4.21Å; H61-V71 PolarHBondContact CD2-O 3.42Å
72D89.9Confident89.9Confident81 Ų8159.4 Ų59.443%0.43330%0.298SS..SBendtrans-129.7153.1-174.4-53.9-50.5000112.7H61 T74 T75 L76H61-D72 VanDerWaalsContact CD2-C 3.43Å; D72-T74 PolarHBondContact O-N 2.93Å; D72-T75 HydrophobicContact CB-CG2 4.25Å; D72-T75 PolarHBondContact N-OG1 3.17Å; D72-T75 PolarHBondContact O-N 3.25Å; D72-T75 PolarHBondContact O-OG1 3.19Å; D72-L76 PolarHBondContact O-N 3.29Å
73S89.1Confident90.3Very high51 Ų5166.1 Ų66.136%0.35733%0.328SS..Hα-helixtrans-59-30.3171.568.70000113.4H61 L76 K77H61-S73 PolarHBondContact CD2-N 3.45Å; H61-S73 PolarHBondContact NE2-N 3.07Å; S73-L76 PolarHBondContact O-N 2.92Å; S73-K77 WeakPolarHBondContact O-CG 3.35Å; S73-K77 PolarHBondContact O-N 3.29Å
74T92.2Very high90.5Very high85 Ų8571.8 Ų71.852%0.52136%0.358SS..Hα-helixtrans-67.3-43.2177.658.20000111.2D72 L76 K77 T78D72-T74 PolarHBondContact O-N 2.93Å; T74-L76 VanDerWaalsContact C-N 3.31Å; T74-L76 PolarHBondContact O-N 2.89Å; T74-K77 PolarHBondContact O-N 2.77Å; T74-T78 WeakPolarHBondContact O-CG2 3.36Å; T74-T78 PolarHBondContact O-N 3.16Å
75T92.1Very high90.8Very high48 Ų4871.4 Ų71.429%0.29436%0.356SS..Hα-helixtrans-67.7-32.4177.565.50000112.3D72 T78 H79D72-T75 HydrophobicContact CB-CG2 4.25Å; D72-T75 PolarHBondContact N-OG1 3.17Å; D72-T75 PolarHBondContact O-N 3.25Å; D72-T75 PolarHBondContact O-OG1 3.19Å; T75-T78 WeakPolarHBondContact CA-OG1 3.38Å; T75-T78 PolarHBondContact O-OG1 3.31Å; T75-H79 WeakPolarHBondContact O-CB 3.45Å; T75-H79 PolarHBondContact O-N 3.18Å
76L90.4Very high91Very high25 Ų2576.2 Ų76.213%0.13137%0.374CS..Hα-helixtrans-67.1-43.1172.3-174.2158.9000111H61 F70 D72 S73 T74 T78 H79 F80H61-L76 HydrophobicContact CB-CD1 3.89Å; F70-L76 HydrophobicContact CB-CB 4.41Å; F70-L76 HydrophobicContact CD2-CB 4.35Å; F70-L76 HydrophobicContact CD2-CG 4.43Å; F70-L76 HydrophobicContact CG-CB 4.4Å; D72-L76 PolarHBondContact O-N 3.29Å; S73-L76 PolarHBondContact O-N 2.92Å; T74-L76 VanDerWaalsContact C-N 3.31Å; T74-L76 PolarHBondContact O-N 2.89Å; L76-T78 PolarHBondContact O-N 3.46Å; L76-H79 WeakPolarHBondContact O-CB 3.35Å; L76-H79 PolarHBondContact O-N 3.36Å; L76-F80 HydrophobicContact CD2-CD2 3.8Å; L76-F80 HydrophobicContact CD2-CE1 4.23Å; L76-F80 HydrophobicContact CD2-CE2 3.08Å; L76-F80 HydrophobicContact CD2-CZ 3.34Å; L76-F80 HydrophobicContact CG-CE2 4.32Å; L76-F80 HydrophobicContact CG-CZ 4.22Å; L76-F80 PolarHBondContact O-N 3.27Å; L76-F80 VanDerWaalsContact O-N 3.14Å
77K90.9Very high91.2Very high128 Ų12881.7 Ų81.756%0.55740%0.397SS*.Hα-helixtrans-62.4-40.8175.2-71.9171.2-176.3177.20112.3S73 T74 H79 F80S73-K77 WeakPolarHBondContact O-CG 3.35Å; S73-K77 PolarHBondContact O-N 3.29Å; T74-K77 PolarHBondContact O-N 2.77Å; K77-H79 VanDerWaalsContact C-N 3.34Å; K77-F80 PolarHBondContact O-N 3.27Å
78T93.7Very high91.3Very high93 Ų9383.2 Ų83.257%0.57140%0.399SS*.Hα-helixtrans-68.2-35.3175.959.90000111.7T74 T75 L76 F80 R81 S82T74-T78 WeakPolarHBondContact O-CG2 3.36Å; T74-T78 PolarHBondContact O-N 3.16Å; T75-T78 WeakPolarHBondContact CA-OG1 3.38Å; T75-T78 PolarHBondContact O-OG1 3.31Å; L76-T78 PolarHBondContact O-N 3.46Å; T78-F80 PolarHBondContact O-N 3.31Å; T78-R81 PolarHBondContact O-N 2.92Å; T78-R81 VanDerWaalsContact O-N 3.17Å; T78-S82 PolarHBondContact O-N 2.67Å
79H92.8Very high91.4Very high15 Ų1579.3 Ų79.37%0.06939%0.387CS..Hα-helixtrans-58.1-43.8173.3170.569.8000112.4C63 C66 F70 T75 L76 K77 R81 S82 H85C63-H79 PolarHBondContact SG-NE2 2.98Å; C66-H79 VanDerWaalsContact SG-CE1 3.55Å; C66-H79 PolarHBondContact SG-NE2 3.38Å; C66-H79 VanDerWaalsContact SG-NE2 3.43Å; F70-H79 HydrophobicContact CE1-CB 3.9Å; F70-H79 HydrophobicContact CE2-CB 4.22Å; F70-H79 AromaticContact CE2-CD2 3.87Å; F70-H79 AromaticContact CE2-CG 3.92Å; F70-H79 HydrophobicContact CZ-CB 3.58Å; F70-H79 AromaticContact CZ-CD2 3.75Å; F70-H79 AromaticContact CZ-CG 3.35Å; F70-H79 AromaticContact CZ-ND1 3.63Å; T75-H79 WeakPolarHBondContact O-CB 3.45Å; T75-H79 PolarHBondContact O-N 3.18Å; L76-H79 WeakPolarHBondContact O-CB 3.35Å; L76-H79 PolarHBondContact O-N 3.36Å; K77-H79 VanDerWaalsContact C-N 3.34Å; H79-R81 PolarHBondContact O-N 3.23Å; H79-S82 WeakPolarHBondContact O-CB 3.39Å; H79-S82 PolarHBondContact O-N 2.86Å; H79-S82 PolarHBondContact O-OG 3.18Å; H79-H85 AromaticContact CD2-ND1 3.85Å; H79-H85 AromaticContact CE1-ND1 4Å; H79-H85 AromaticContact NE2-CG 3.8Å; H79-H85 AromaticContact NE2-ND1 3.22Å; H79-H85 PolarHBondContact NE2-ND1 3.05Å; H79-H85 WeakPolarHBondContact O-CB 3.48Å
80F90.1Very high91.3Very high64 Ų6483 Ų8328%0.28141%0.405SS..Hα-helixtrans-61.3-29.3177.7-66.5-34.1000113.8C63 L76 K77 T78 S82 H85C63-F80 HydrophobicContact CB-CE1 4.4Å; L76-F80 HydrophobicContact CD2-CD2 3.8Å; L76-F80 HydrophobicContact CD2-CE1 4.23Å; L76-F80 HydrophobicContact CD2-CE2 3.08Å; L76-F80 HydrophobicContact CD2-CZ 3.34Å; L76-F80 HydrophobicContact CG-CE2 4.32Å; L76-F80 HydrophobicContact CG-CZ 4.22Å; L76-F80 PolarHBondContact O-N 3.27Å; L76-F80 VanDerWaalsContact O-N 3.14Å; K77-F80 PolarHBondContact O-N 3.27Å; T78-F80 PolarHBondContact O-N 3.31Å; F80-S82 VanDerWaalsContact C-N 3.3Å; F80-H85 AromaticContact CD1-CD2 3.97Å; F80-H85 AromaticContact CD1-CE1 3.64Å; F80-H85 AromaticContact CD1-NE2 3.53Å; F80-H85 AromaticContact CE1-CE1 3.91Å
81R92.1Very high91.3Very high204 Ų20485.6 Ų85.677%0.7742%0.417SS*.Hα-helixtrans-77-19.4177.4-59.5178.682.4175.25.2112.6T78 H79 K86T78-R81 PolarHBondContact O-N 2.92Å; T78-R81 VanDerWaalsContact O-N 3.17Å; H79-R81 PolarHBondContact O-N 3.23Å; R81-K86 WeakPolarHBondContact O-CE 3.47Å; R81-K86 PolarHBondContact O-NZ 3.24Å
82S93.9Very high91.1Very high36 Ų3681.4 Ų81.425%0.25239%0.392SS..SBendtrans-64.5152.8-17677.40000113.1T78 H79 F80 D84 H85 K86T78-S82 PolarHBondContact O-N 2.67Å; H79-S82 WeakPolarHBondContact O-CB 3.39Å; H79-S82 PolarHBondContact O-N 2.86Å; H79-S82 PolarHBondContact O-OG 3.18Å; F80-S82 VanDerWaalsContact C-N 3.3Å; S82-D84 VanDerWaalsContact C-N 3.34Å; S82-H85 WeakPolarHBondContact OG-CB 3.43Å; S82-H85 PolarHBondContact OG-N 3.22Å; S82-K86 WeakPolarHBondContact O-CG 3.43Å; S82-K86 PolarHBondContact O-N 2.85Å
83K94.1Very high91Very high179 Ų17979.5 Ų79.578%0.77839%0.385SS*.Hα-helixtrans-68.7-34.8178.9-67.8-179.1-179.6177.90112.1K86 K87K83-K86 PolarHBondContact O-N 3.36Å; K83-K87 WeakPolarHBondContact O-CB 3.36Å; K83-K87 PolarHBondContact O-N 3.39Å
84D93.1Very high90.9Very high123 Ų12380.1 Ų80.166%0.65839%0.386SS*.Hα-helixtrans-65.7-41.6-178.7-62.3-30.7000111.3S82 K87 R88S82-D84 VanDerWaalsContact C-N 3.34Å; D84-K87 WeakPolarHBondContact O-CB 3.28Å; D84-K87 PolarHBondContact O-N 2.62Å; D84-R88 PolarHBondContact O-N 2.9Å
85H91.1Very high90.6Very high13 Ų1379.8 Ų79.86%0.0638%0.379CS..Hα-helixtrans-61.7-48.4174.4-178.474000111.5C63 H79 F80 S82 K87 R88 L89C63-H85 VanDerWaalsContact SG-CE1 3.55Å; H79-H85 AromaticContact CD2-ND1 3.85Å; H79-H85 AromaticContact CE1-ND1 4Å; H79-H85 AromaticContact NE2-CG 3.8Å; H79-H85 AromaticContact NE2-ND1 3.22Å; H79-H85 PolarHBondContact NE2-ND1 3.05Å; H79-H85 WeakPolarHBondContact O-CB 3.48Å; F80-H85 AromaticContact CD1-CD2 3.97Å; F80-H85 AromaticContact CD1-CE1 3.64Å; F80-H85 AromaticContact CD1-NE2 3.53Å; F80-H85 AromaticContact CE1-CE1 3.91Å; S82-H85 WeakPolarHBondContact OG-CB 3.43Å; S82-H85 PolarHBondContact OG-N 3.22Å; H85-K87 VanDerWaalsContact C-N 3.26Å; H85-K87 PolarHBondContact O-N 2.93Å; H85-R88 WeakPolarHBondContact O-CA 3.39Å; H85-R88 WeakPolarHBondContact O-CB 3.26Å; H85-R88 PolarHBondContact O-N 3.05Å; H85-L89 WeakPolarHBondContact NE2-CD1 3.14Å; H85-L89 PolarHBondContact O-N 3.12Å
86K90.4Very high90.4Very high110 Ų11078.6 Ų78.648%0.47837%0.371SS..Hα-helixtrans-59.9-36.5176.5-67.6171.8-176.5170.50112.4R81 S82 K83 K90R81-K86 WeakPolarHBondContact O-CE 3.47Å; R81-K86 PolarHBondContact O-NZ 3.24Å; S82-K86 WeakPolarHBondContact O-CG 3.43Å; S82-K86 PolarHBondContact O-N 2.85Å; K83-K86 PolarHBondContact O-N 3.36Å; K86-K90 WeakPolarHBondContact O-CG 3.39Å; K86-K90 PolarHBondContact O-N 3.37Å
87K91.8Very high90.3Very high132 Ų13284.5 Ų84.557%0.57439%0.393SS*.Hα-helixtrans-66.3-41.3174.3-174.2179.6177.8-176.80111K83 D84 H85 K90 Q91K83-K87 WeakPolarHBondContact O-CB 3.36Å; K83-K87 PolarHBondContact O-N 3.39Å; D84-K87 WeakPolarHBondContact O-CB 3.28Å; D84-K87 PolarHBondContact O-N 2.62Å; H85-K87 VanDerWaalsContact C-N 3.26Å; H85-K87 PolarHBondContact O-N 2.93Å; K87-K90 PolarHBondContact O-N 2.76Å; K87-Q91 WeakPolarHBondContact O-CG 3.3Å; K87-Q91 PolarHBondContact O-N 3.36Å
88R90.6Very high90.2Very high47 Ų4780.1 Ų80.118%0.17738%0.379CS..Hα-helixtrans-63.6-44.5176.9-167.861.4160.8-171.1-4.1111.7P26 A65 D84 H85 K90 Q91 L92P26-R88 PolarHBondContact O-NH2 3.23Å; A65-R88 WeakPolarHBondContact O-CG 3.24Å; A65-R88 PolarHBondContact O-NE 3.38Å; D84-R88 PolarHBondContact O-N 2.9Å; H85-R88 WeakPolarHBondContact O-CA 3.39Å; H85-R88 WeakPolarHBondContact O-CB 3.26Å; H85-R88 PolarHBondContact O-N 3.05Å; R88-K90 VanDerWaalsContact C-N 3.3Å; R88-K90 PolarHBondContact O-N 3.22Å; R88-Q91 WeakPolarHBondContact O-CB 3.33Å; R88-Q91 PolarHBondContact O-N 2.84Å; R88-L92 HydrophobicContact CG-CD1 4.31Å; R88-L92 WeakPolarHBondContact O-CG 3.49Å; R88-L92 PolarHBondContact O-N 2.94Å
89L89.4Confident90Very high40 Ų4082.8 Ų82.821%0.20939%0.385CS..Hα-helixtrans-58.8-40.9174.7-68.6178000112.3A65 H85 Q91 L92 S93 V119 T121A65-L89 HydrophobicContact CB-CD2 3.91Å; H85-L89 WeakPolarHBondContact NE2-CD1 3.14Å; H85-L89 PolarHBondContact O-N 3.12Å; L89-Q91 VanDerWaalsContact C-N 3.33Å; L89-Q91 PolarHBondContact O-N 3.37Å; L89-L92 PolarHBondContact O-N 3.35Å; L89-S93 PolarHBondContact O-N 3.03Å; L89-V119 HydrophobicContact CD2-CG1 4.27Å; L89-T121 HydrophobicContact CD1-CG2 4.36Å
90K89Confident89.7Confident156 Ų15688.5 Ų88.568%0.67841%0.411SS*.Hα-helixtrans-62.5-39.4173.8-71.4177-178.6-172.30112.2K86 K87 R88 L92 S93K86-K90 WeakPolarHBondContact O-CG 3.39Å; K86-K90 PolarHBondContact O-N 3.37Å; K87-K90 PolarHBondContact O-N 2.76Å; R88-K90 VanDerWaalsContact C-N 3.3Å; R88-K90 PolarHBondContact O-N 3.22Å; K90-L92 VanDerWaalsContact C-N 3.35Å; K90-S93 PolarHBondContact O-N 3.29Å; K90-S93 PolarHBondContact O-OG 3.43Å
91Q89.6Confident89.7Confident78 Ų7888.5 Ų88.536%0.36441%0.412SS..Hα-helixtrans-65.7-37.9175.6-69.5173.4-18.700112.3L28 K87 R88 L89 S93 V94L28-Q91 HydrophobicContact CD1-CB 4.27Å; L28-Q91 HydrophobicContact CD2-CB 3.98Å; K87-Q91 WeakPolarHBondContact O-CG 3.3Å; K87-Q91 PolarHBondContact O-N 3.36Å; R88-Q91 WeakPolarHBondContact O-CB 3.33Å; R88-Q91 PolarHBondContact O-N 2.84Å; L89-Q91 VanDerWaalsContact C-N 3.33Å; L89-Q91 PolarHBondContact O-N 3.37Å; Q91-S93 VanDerWaalsContact C-N 3.26Å; Q91-S93 PolarHBondContact O-N 3.4Å; Q91-V94 PolarHBondContact O-N 3.37Å
92L88.1Confident89.6Confident2 Ų280.3 Ų80.31%0.0139%0.388CS..Hα-helixtrans-74.2-16.6178.5-65.1172.3000113.2L28 I31 H32 L35 A65 R88 L89 K90 V94 V119L28-L92 HydrophobicContact CD2-CD2 3.89Å; L28-L92 HydrophobicContact CD2-CG 4.47Å; I31-L92 HydrophobicContact CB-CD2 4.4Å; I31-L92 HydrophobicContact CG2-CD1 4.23Å; I31-L92 HydrophobicContact CG2-CD2 3.94Å; H32-L92 WeakPolarHBondContact CE1-CD2 3.47Å; H32-L92 WeakPolarHBondContact NE2-CA 3.44Å; H32-L92 PolarHBondContact NE2-O 3.34Å; L35-L92 HydrophobicContact CD1-CD1 4.04Å; A65-L92 HydrophobicContact CB-CD1 3.62Å; R88-L92 HydrophobicContact CG-CD1 4.31Å; R88-L92 WeakPolarHBondContact O-CG 3.49Å; R88-L92 PolarHBondContact O-N 2.94Å; L89-L92 PolarHBondContact O-N 3.35Å; K90-L92 VanDerWaalsContact C-N 3.35Å; L92-V94 PolarHBondContact O-N 2.89Å; L92-V119 HydrophobicContact CB-CG1 4.06Å; L92-V119 HydrophobicContact CB-CG2 3.88Å; L92-V119 HydrophobicContact CD1-CG1 4.5Å; L92-V119 VanDerWaalsContact O-CG2 3.27Å; L92-V119 WeakPolarHBondContact O-CG2 3.41Å
93S86.9Confident89.4Confident41 Ų4182.4 Ų82.429%0.28739%0.394SS..THydrogen-bonded Turntrans-72.7-8.8176.572.60000114L89 K90 Q91 R116 L117 V119L89-S93 PolarHBondContact O-N 3.03Å; K90-S93 PolarHBondContact O-N 3.29Å; K90-S93 PolarHBondContact O-OG 3.43Å; Q91-S93 VanDerWaalsContact C-N 3.26Å; Q91-S93 PolarHBondContact O-N 3.4Å; S93-R116 CarbonylContact O-C 3.59Å; S93-R116 VanDerWaalsContact O-CA 3.24Å; S93-R116 WeakPolarHBondContact O-CA 3.42Å; S93-L117 PolarHBondContact O-N 3.17Å; S93-V119 VanDerWaalsContact CA-CG2 3.41Å; S93-V119 VanDerWaalsContact N-CG2 3.33Å
94V87.1Confident89.3Confident63 Ų6377 Ų7738%0.38237%0.369SS..BIsolated β-bridgetrans-111.4139.3176.8-176.20000107.6H32 Q91 L92 P114H32-V94 PolarHBondContact NE2-O 3.42Å; Q91-V94 PolarHBondContact O-N 3.37Å; L92-V94 PolarHBondContact O-N 2.89Å; V94-P114 HydrophobicContact CG1-CB 4.3Å
95E85.8Confident89.1Confident79 Ų7975.3 Ų75.337%0.36937%0.372SS..PPolyproline II helixtrans-51.2132.4174-168.3173.6-175.300111.4Q115 L117E95-Q115 PolarHBondContact N-O 3.38Å; E95-L117 HydrophobicContact CB-CD1 4.3Å; E95-L117 HydrophobicContact CB-CG 4.41Å; E95-L117 HydrophobicContact CG-CD1 4.48Å
96P87.9Confident89.2Confident22 Ų2278.3 Ų78.314%0.14340%0.399CS..PPolyproline II helixtrans-67.6145-179.728.5-35.1000110.6D29 H32 S98D29-P96 HydrophobicContact CB-CB 4.01Å; H32-P96 HydrophobicContact CB-CG 3.85Å; P96-S98 PolarHBondContact O-N 3.28Å
97Y87.4Confident89.1Confident149 Ų14976.1 Ų76.158%0.58441%0.408SS*.PPolyproline II helixtrans-57.6129.2173.5-173.4-104.4000110.6E101 A102Y97-E101 HydrophobicContact CD2-CB 4.3Å; Y97-E101 HydrophobicContact CD2-CG 4.2Å; Y97-E101 VanDerWaalsContact CD2-OE2 3.31Å; Y97-E101 WeakPolarHBondContact CD2-OE2 3.39Å; Y97-E101 HydrophobicContact CE2-CB 4.11Å; Y97-E101 HydrophobicContact CE2-CG 3.99Å; Y97-A102 HydrophobicContact CE1-CB 4.14Å; Y97-A102 VanDerWaalsContact OH-CA 3.23Å; Y97-A102 WeakPolarHBondContact OH-CA 3.49Å; Y97-A102 WeakPolarHBondContact OH-CB 3.4Å
98S88.9Confident88.8Confident37 Ų3776.7 Ų76.726%0.25941%0.414SS..  trans-117.1157.6-178.763.40000111.2P96 E100 E101 A102P96-S98 PolarHBondContact O-N 3.28Å; S98-E100 PolarHBondContact O-N 3.19Å; S98-E101 VanDerWaalsContact O-CB 3.32Å; S98-E101 WeakPolarHBondContact O-CB 3.46Å; S98-E101 PolarHBondContact O-N 3.23Å; S98-E101 VanDerWaalsContact O-N 3.1Å; S98-E101 PolarHBondContact OG-N 3.22Å; S98-A102 PolarHBondContact O-N 2.87Å
99Q89.2Confident88.5Confident149 Ų14976.8 Ų76.870%0.69643%0.429SS*.Hα-helixtrans-62.2-35.4175.9-176.9164.3-15.300112E101 A102 E103Q99-E101 PolarHBondContact O-N 3Å; Q99-A102 WeakPolarHBondContact O-CA 3.48Å; Q99-A102 VanDerWaalsContact O-CB 3.23Å; Q99-A102 WeakPolarHBondContact O-CB 3.31Å; Q99-A102 PolarHBondContact O-N 2.76Å; Q99-E103 PolarHBondContact NE2-OE1 3.01Å; Q99-E103 PolarHBondContact O-N 3.45Å
100E88Confident88.3Confident135 Ų13579 Ų7963%0.63145%0.449SS*.Hα-helixtrans-60.9-34174.4-60.9172-174.600112S98 R104S98-E100 PolarHBondContact O-N 3.19Å; E100-R104 WeakPolarHBondContact O-CB 3.35Å; E100-R104 VanDerWaalsContact O-CG 3.23Å; E100-R104 WeakPolarHBondContact O-CG 3.47Å; E100-R104 PolarHBondContact O-N 3.47Å; E100-R104 PolarHBondContact O-NE 2.99Å
101E88.5Confident88.1Confident64 Ų6480.9 Ų80.930%0.29945%0.453SS..Hα-helixtrans-67.2-39.4172.5-167.6-176.9163.700111.7Y97 S98 Q99 R104 A105Y97-E101 HydrophobicContact CD2-CB 4.3Å; Y97-E101 HydrophobicContact CD2-CG 4.2Å; Y97-E101 VanDerWaalsContact CD2-OE2 3.31Å; Y97-E101 WeakPolarHBondContact CD2-OE2 3.39Å; Y97-E101 HydrophobicContact CE2-CB 4.11Å; Y97-E101 HydrophobicContact CE2-CG 3.99Å; S98-E101 VanDerWaalsContact O-CB 3.32Å; S98-E101 WeakPolarHBondContact O-CB 3.46Å; S98-E101 PolarHBondContact O-N 3.23Å; S98-E101 VanDerWaalsContact O-N 3.1Å; S98-E101 PolarHBondContact OG-N 3.22Å; Q99-E101 PolarHBondContact O-N 3Å; E101-R104 PolarHBondContact O-N 3.18Å; E101-A105 WeakPolarHBondContact O-CB 3.39Å; E101-A105 PolarHBondContact O-N 3.15Å
102A90.3Very high87.9Confident32 Ų3280.3 Ų80.326%0.26445%0.454SS..Hα-helixtrans-61.4-44.8174.900000112.1Y97 S98 Q99 A105 A106Y97-A102 HydrophobicContact CE1-CB 4.14Å; Y97-A102 VanDerWaalsContact OH-CA 3.23Å; Y97-A102 WeakPolarHBondContact OH-CA 3.49Å; Y97-A102 WeakPolarHBondContact OH-CB 3.4Å; S98-A102 PolarHBondContact O-N 2.87Å; Q99-A102 WeakPolarHBondContact O-CA 3.48Å; Q99-A102 VanDerWaalsContact O-CB 3.23Å; Q99-A102 WeakPolarHBondContact O-CB 3.31Å; Q99-A102 PolarHBondContact O-N 2.76Å; A102-A105 PolarHBondContact O-N 3.23Å; A102-A106 PolarHBondContact O-N 3.24Å
103E91.4Very high87.7Confident79 Ų7983.9 Ų83.937%0.36948%0.478SS..Hα-helixtrans-66.7-40.9179.4-70172.9-17400111.6Q99 A105 A106 G107 M108Q99-E103 PolarHBondContact NE2-OE1 3.01Å; Q99-E103 PolarHBondContact O-N 3.45Å; E103-A105 VanDerWaalsContact C-N 3.34Å; E103-A105 PolarHBondContact O-N 3.02Å; E103-A106 CarbonylContact O-C 3.44Å; E103-A106 WeakPolarHBondContact O-CB 3.33Å; E103-A106 PolarHBondContact O-N 3.42Å; E103-A106 VanDerWaalsContact O-N 3.13Å; E103-G107 PolarHBondContact O-N 3.43Å; E103-M108 HydrophobicContact CB-CB 4.34Å; E103-M108 HydrophobicContact CB-CE 4.38Å; E103-M108 HydrophobicContact CG-CE 4.18Å; E103-M108 WeakPolarHBondContact O-CB 3.48Å; E103-M108 PolarHBondContact O-N 3.14Å
104R90.4Very high87.4Confident66 Ų6685.5 Ų85.525%0.24949%0.487CS..Iπ-helixtrans-58.9-44.3171.7-76.4177.1-76.5159.8-4.4111.8E100 E101 A106 G107 S110 V112E100-R104 WeakPolarHBondContact O-CB 3.35Å; E100-R104 VanDerWaalsContact O-CG 3.23Å; E100-R104 WeakPolarHBondContact O-CG 3.47Å; E100-R104 PolarHBondContact O-N 3.47Å; E100-R104 PolarHBondContact O-NE 2.99Å; E101-R104 PolarHBondContact O-N 3.18Å; R104-A106 VanDerWaalsContact C-N 3.26Å; R104-A106 PolarHBondContact O-N 2.72Å; R104-G107 PolarHBondContact O-N 3.19Å; R104-G107 VanDerWaalsContact O-N 3.08Å; R104-S110 WeakPolarHBondContact CD-O 3.35Å; R104-V112 VanDerWaalsContact NH1-CB 3.29Å
105A89.1Confident87.2Confident87 Ų8788.2 Ų88.272%0.71950%0.496SS*.Iπ-helixtrans-65.5-29176.200000113E101 A102 E103 G107E101-A105 WeakPolarHBondContact O-CB 3.39Å; E101-A105 PolarHBondContact O-N 3.15Å; A102-A105 PolarHBondContact O-N 3.23Å; E103-A105 VanDerWaalsContact C-N 3.34Å; E103-A105 PolarHBondContact O-N 3.02Å; A105-G107 PolarHBondContact O-N 3.44Å
106A92.8Very high87Confident76 Ų7695.5 Ų95.563%0.62852%0.52SS*.Iπ-helixtrans-77.71.7173.400000113.9A102 E103 R104A102-A106 PolarHBondContact O-N 3.24Å; E103-A106 CarbonylContact O-C 3.44Å; E103-A106 WeakPolarHBondContact O-CB 3.33Å; E103-A106 PolarHBondContact O-N 3.42Å; E103-A106 VanDerWaalsContact O-N 3.13Å; R104-A106 VanDerWaalsContact C-N 3.26Å; R104-A106 PolarHBondContact O-N 2.72Å
107G88.9Confident86.5Confident65 Ų6597.6 Ų97.667%0.6753%0.529SS*.Iπ-helixtrans91.27.917900000114.7E103 R104 A105 G109E103-G107 PolarHBondContact O-N 3.43Å; R104-G107 PolarHBondContact O-N 3.19Å; R104-G107 VanDerWaalsContact O-N 3.08Å; A105-G107 PolarHBondContact O-N 3.44Å; G107-G109 VanDerWaalsContact C-N 3.29Å; G107-G109 PolarHBondContact O-N 3.22Å
108M85.6Confident85.6Confident144 Ų14495.3 Ų95.371%0.70954%0.542SS*.Iπ-helixtrans-9024.9177.6-63.7-163.3-8900113.5E103E103-M108 HydrophobicContact CB-CB 4.34Å; E103-M108 HydrophobicContact CB-CE 4.38Å; E103-M108 HydrophobicContact CG-CE 4.18Å; E103-M108 WeakPolarHBondContact O-CB 3.48Å; E103-M108 PolarHBondContact O-N 3.14Å
109G84.6Confident84.4Confident48 Ų4895 Ų9550%0.49554%0.538SS..SBendtrans175.4-168.4175.400000114.1G107G107-G109 VanDerWaalsContact C-N 3.29Å; G107-G109 PolarHBondContact O-N 3.22Å
110S85.1Confident82.9Confident88 Ų8891.3 Ų91.362%0.61553%0.527SS*.  trans-92.7143.8179.157.90000112.7R104 V112R104-S110 WeakPolarHBondContact CD-O 3.35Å; S110-V112 PolarHBondContact O-N 2.98Å
111Y85Confident81.3Confident195 Ų19589.5 Ų89.577%0.76553%0.525SS*.  trans-63.1132.2173.6178.1-103.9000111.4P113Y111-P113 HydrophobicContact CE1-CB 4.33Å
112V84.9Confident79.7Confident65 Ų6590.3 Ų90.339%0.39453%0.529SS..  trans-130.3128.5170.7-173.70000107.5R104 S110R104-V112 VanDerWaalsContact NH1-CB 3.29Å; S110-V112 PolarHBondContact O-N 2.98Å
113P83.6Confident77.5Confident78 Ų7892.9 Ų92.951%0.50654%0.541SS..PPolyproline II helixtrans-68.9145.9177.329-34.5000111.1Y111 Q115Y111-P113 HydrophobicContact CE1-CB 4.33Å; P113-Q115 PolarHBondContact O-N 2.91Å
114P81.1Confident75Confident74 Ų7492.7 Ų92.748%0.48155%0.549SS..PPolyproline II helixtrans-66133.4179.326.8-34000110.9V94V94-P114 HydrophobicContact CG1-CB 4.3Å
115Q83.6Confident72.5Confident121 Ų12195.1 Ų95.157%0.56557%0.571SS**PPolyproline II helixtrans-86.5148.1-179.8-60.5-173.817.100111.3E95 P113E95-Q115 PolarHBondContact N-O 3.38Å; P113-Q115 PolarHBondContact O-N 2.91Å
116R81.7Confident70.1Confident231 Ų23198.8 Ų98.887%0.87257%0.573SS**BIsolated β-bridgetrans-84.3117.8170-68.5-174-172.4178.44108.9S93S93-R116 CarbonylContact O-C 3.59Å; S93-R116 VanDerWaalsContact O-CA 3.24Å; S93-R116 WeakPolarHBondContact O-CA 3.42Å
117L76.9Confident67.3Low66 Ų6698.9 Ų98.935%0.34657%0.574SS.*PPolyproline II helixtrans-87.5138.3176.9-60.7179.1000110S93 E95 V119S93-L117 PolarHBondContact O-N 3.17Å; E95-L117 HydrophobicContact CB-CD1 4.3Å; E95-L117 HydrophobicContact CB-CG 4.41Å; E95-L117 HydrophobicContact CG-CD1 4.48Å; L117-V119 PolarHBondContact O-N 3.46Å; L117-V119 VanDerWaalsContact O-N 3.12Å
118A69.2Low65.1Low102 Ų102101.2 Ų101.284%0.84358%0.577SS**  trans-72.5101.9167.700000108.3
119V63.4Low63Low31 Ų31103.4 Ų103.419%0.18859%0.586CS.*  trans-71.8126.3174.7-165.90000107.8L89 L92 S93 L117 T121L89-V119 HydrophobicContact CD2-CG1 4.27Å; L92-V119 HydrophobicContact CB-CG1 4.06Å; L92-V119 HydrophobicContact CB-CG2 3.88Å; L92-V119 HydrophobicContact CD1-CG1 4.5Å; L92-V119 VanDerWaalsContact O-CG2 3.27Å; L92-V119 WeakPolarHBondContact O-CG2 3.41Å; S93-V119 VanDerWaalsContact CA-CG2 3.41Å; S93-V119 VanDerWaalsContact N-CG2 3.33Å; L117-V119 PolarHBondContact O-N 3.46Å; L117-V119 VanDerWaalsContact O-N 3.12Å; V119-T121 VanDerWaalsContact C-N 3.33Å; V119-T121 PolarHBondContact O-N 3.02Å
120P57.9Low61.3Low70 Ų70108.7 Ų108.746%0.45560%0.6SS.*  trans-65.198.6170.926.1-30.8000107.9L35 E122L35-P120 HydrophobicContact CD2-CG 4.37Å; P120-E122 PolarHBondContact O-N 3.18Å
121T54.2Low59.2Low98 Ų98110.9 Ų110.960%0.60160%0.604SS**  trans-75.376.6160.950.40000106.5L89 V119 V123L89-T121 HydrophobicContact CD1-CG2 4.36Å; V119-T121 VanDerWaalsContact C-N 3.33Å; V119-T121 PolarHBondContact O-N 3.02Å; T121-V123 PolarHBondContact O-N 3.23Å
122E53.8Low57.7Low80 Ų80107.9 Ų107.937%0.37461%0.606SS.*  trans-70.771.8164.852.9-165139.500108.8R44 L64 P120 S124R44-E122 IonicContact CZ-OE2 3.22Å; R44-E122 IonicContact NH1-OE2 2.78Å; L64-E122 VanDerWaalsContact CD1-OE1 3.31Å; L64-E122 WeakPolarHBondContact CD1-OE1 3.44Å; P120-E122 PolarHBondContact O-N 3.18Å; E122-S124 PolarHBondContact O-N 3.39Å
123V45.4Very low56.1Low87 Ų87108.9 Ų108.953%0.52762%0.617SS.*  trans-84.172.3155.7-173.10000105.2T121 T125T121-V123 PolarHBondContact O-N 3.23Å; V123-T125 HydrophobicContact CG1-CG2 4.11Å; V123-T125 PolarHBondContact O-N 2.62Å
124S38.4Very low55.2Low75 Ų75114.7 Ų114.752%0.52465%0.654SS.*  trans-73.577.2160.2-66.80000107.2E122 E126E122-S124 PolarHBondContact O-N 3.39Å; S124-E126 PolarHBondContact O-N 3.47Å; S124-E126 VanDerWaalsContact O-N 3.12Å
125T38.5Very low53.9Low116 Ų116116.7 Ų116.771%0.71266%0.663SS**  trans-7469147.737.90000107.5V123V123-T125 HydrophobicContact CG1-CG2 4.11Å; V123-T125 PolarHBondContact O-N 2.62Å
126E37.2Very low52.3Low164 Ų164116.5 Ų116.577%0.76667%0.668SS**  trans-118.885.2158.2-64.4-177.6154.200103.5S124 P128S124-E126 PolarHBondContact O-N 3.47Å; S124-E126 VanDerWaalsContact O-N 3.12Å; E126-P128 WeakPolarHBondContact O-CD 3.21Å
127A34.6Very low50.7Low78 Ų78110.1 Ų110.165%0.64566%0.657SS**  trans-60.3126156.200000104.8E129A127-E129 PolarHBondContact O-N 3.11Å
128P41.6Very low49.1Very low114 Ų114112.7 Ų112.774%0.7468%0.675SS**  trans-58.1113.7162.225.4-30.4000105.2E126 M130E126-P128 WeakPolarHBondContact O-CD 3.21Å; P128-M130 PolarHBondContact O-N 3.28Å
129E43.3Very low47.9Very low190 Ų190113.4 Ų113.489%0.88866%0.664SS**  trans-58.9101.4164.4-60.1-141.8128.100104.7A127 D131A127-E129 PolarHBondContact O-N 3.11Å; E129-D131 PolarHBondContact O-N 3.15Å
130M48.8Very low46.8Very low160 Ų160118.9 Ų118.979%0.78870%0.696SS**  trans-65100.2168.8-68.7-122.6-50.500105.1P128 T132P128-M130 PolarHBondContact O-N 3.28Å; M130-T132 PolarHBondContact O-N 3.37Å; M130-T132 PolarHBondContact O-OG1 3.01Å
131D39.5Very low46.1Very low133 Ų133122.4 Ų122.471%0.71171%0.713SS**  trans-52.293.9166.6-159-81.6000107E129 S133E129-D131 PolarHBondContact O-N 3.15Å; D131-S133 PolarHBondContact O-N 3.17Å; D131-S133 WeakPolarHBondContact OD1-CB 3.45Å; D131-S133 PolarHBondContact OD1-OG 3.31Å
132T53.3Low45.4Very low132 Ų132124.2 Ų124.281%0.8172%0.722SS**  trans-81.974172.2-46.90000104.5M130M130-T132 PolarHBondContact O-N 3.37Å; M130-T132 PolarHBondContact O-OG1 3.01Å
133S53Low44.7Very low87 Ų87127.9 Ų127.961%0.60875%0.751SS**  trans-68.9138.6168.9-90.40000109D131D131-S133 PolarHBondContact O-N 3.17Å; D131-S133 WeakPolarHBondContact OD1-CB 3.45Å; D131-S133 PolarHBondContact OD1-OG 3.31Å
134P63.2Low44.7Very low199 Ų199131.6 Ų131.6100%1.29277%0.771SS**  trans-68.20-166.527.9-36.1000115

Retrieved 134 of 134 residues in 143.4 ms (Link to these results)