A0A087WSG1_MOUSE Loading...

RIKEN cDNA 1700017N19 gene

AlphaFold DB , UniProt , Accession A0A087WSG1, Species MOUSE (Mus musculus, Mouse), Gene 1700017N19Rik, Length 374 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
1M38.8Very low65.2Low239 Ų239116 Ų116100%1.17761%0.61SS**  0103.50-73.6170.8173.100106.6M3M1-M3 PolarHBondContact O-N 3.05Å
2E44.8Very low67.2Low194 Ų194117.3 Ų117.391%0.90761%0.608SS**  trans-70.2124.7172.6-72.1174.4118.600108.4Q4E2-Q4 PolarHBondContact O-N 2.96Å
3M46.1Very low69Low169 Ų169119.9 Ų119.983%0.83361%0.605SS**  trans-80.575.8174.1-70.8-166.5176.400109.1M1 Q5M1-M3 PolarHBondContact O-N 3.05Å; M3-Q5 PolarHBondContact O-N 3.49Å
4Q54.5Low70.4Confident137 Ų137113.6 Ų113.664%0.6457%0.572SS**  trans-72.473.4168.9-148.4-177.3-6.100108.5E2 N6 S44E2-Q4 PolarHBondContact O-N 2.96Å; Q4-N6 VanDerWaalsContact C-N 3.34Å; Q4-N6 WeakPolarHBondContact CG-OD1 3.13Å; Q4-N6 PolarHBondContact O-N 3.42Å; Q4-N6 PolarHBondContact O-OD1 3.02Å; Q4-S44 PolarHBondContact NE2-OG 2.8Å
5Q57.3Low71.4Confident124 Ų124113.9 Ų113.958%0.57958%0.582SS**  trans-73.393173.3-74.3-158.2-1.700108.7M3 C7M3-Q5 PolarHBondContact O-N 3.49Å; Q5-C7 PolarHBondContact O-N 3.15Å
6N61.6Low72.4Confident61 Ų61111.1 Ų111.133%0.32657%0.566SS.*  trans-74.675.3173.9-59.8-11000109.1Q4 T46Q4-N6 VanDerWaalsContact C-N 3.34Å; Q4-N6 WeakPolarHBondContact CG-OD1 3.13Å; Q4-N6 PolarHBondContact O-N 3.42Å; Q4-N6 PolarHBondContact O-OD1 3.02Å; N6-T46 WeakPolarHBondContact ND2-CG2 3.32Å; N6-T46 PolarHBondContact ND2-OG1 3.36Å
7C68.9Low72.9Confident38 Ų38112.4 Ų112.426%0.25758%0.583SS.*  trans-62.9137.2167.9-68.50000109.2Q5 I9 I26 Y28Q5-C7 PolarHBondContact O-N 3.15Å; C7-I9 PolarHBondContact O-N 3.25Å; C7-I26 WeakPolarHBondContact CB-O 3.15Å; C7-I26 PolarHBondContact SG-O 3.13Å; C7-Y28 WeakPolarHBondContact O-CB 3.07Å
8S77.6Confident73.5Confident120 Ų120114.7 Ų114.784%0.83960%0.596SS**SBendtrans-79.3-6175.751.90000113.9
9I86.9Confident74.3Confident108 Ų108110.1 Ų110.155%0.55458%0.579SS**SBendtrans-91.3122.6-175.3-58171.6000109C7 F27 Y28C7-I9 PolarHBondContact O-N 3.25Å; I9-F27 HydrophobicContact CB-CD1 4.2Å; I9-F27 HydrophobicContact CG2-CD1 4.07Å; I9-F27 HydrophobicContact CG2-CE1 4.33Å; I9-Y28 WeakPolarHBondContact O-CB 3.24Å; I9-Y28 PolarHBondContact O-N 2.83Å
10S88.7Confident75.1Confident82 Ų82105.2 Ų105.257%0.57355%0.554SS**BIsolated β-bridgetrans-61.4142.8176.752.50000112.7F12S10-F12 PolarHBondContact O-N 2.71Å
11C91.6Very high75.8Confident4 Ų4105.2 Ų105.23%0.02756%0.558CS.*PPolyproline II helixtrans-72.6116.3176.5-170.40000111W13 E14 C20 F27 Y28 H29C11-W13 PolarHBondContact O-N 3.11Å; C11-W13 VanDerWaalsContact O-N 3.1Å; C11-E14 HydrophobicContact CB-CB 4.38Å; C11-E14 WeakPolarHBondContact O-CB 3.43Å; C11-E14 PolarHBondContact O-N 2.97Å; C11-C20 VanDerWaalsContact SG-SG 3.65Å; C11-F27 HydrophobicContact CB-CB 3.68Å; C11-Y28 WeakPolarHBondContact CB-O 3.43Å; C11-Y28 PolarHBondContact N-O 2.9Å; C11-H29 WeakPolarHBondContact CB-CE1 2.99Å; C11-H29 PolarHBondContact SG-CE1 3.07Å
12F89.6Confident78.2Confident132 Ų13299.5 Ų99.558%0.57953%0.527SS*.G310 helixtrans-51.8-33.2174.2175.9-97.7000113.9S10 E14 T15 Q16S10-F12 PolarHBondContact O-N 2.71Å; F12-E14 VanDerWaalsContact C-N 3.29Å; F12-E14 PolarHBondContact O-N 2.87Å; F12-T15 PolarHBondContact O-OG1 2.8Å; F12-T15 VanDerWaalsContact O-OG1 3.13Å; F12-Q16 HydrophobicContact CE1-CG 4.44Å
13W91.3Very high80.2Confident151 Ų15194.2 Ų94.257%0.57250%0.504SS*.G310 helixtrans-77.8-8.8-179-63100.3000114C11 T15 Q16 G19 C20C11-W13 PolarHBondContact O-N 3.11Å; C11-W13 VanDerWaalsContact O-N 3.1Å; W13-T15 VanDerWaalsContact C-N 3.34Å; W13-Q16 HydrophobicContact CE3-CB 4.23Å; W13-Q16 HydrophobicContact CE3-CG 3.75Å; W13-Q16 HydrophobicContact CZ3-CG 4.21Å; W13-Q16 PolarHBondContact O-N 2.83Å; W13-G19 CarbonylContact O-C 3.55Å; W13-G19 WeakPolarHBondContact O-CA 3.24Å; W13-C20 HydrophobicContact CB-CB 3.84Å; W13-C20 PolarHBondContact O-N 3.15Å
14E88.6Confident82.1Confident32 Ų3290.4 Ų90.415%0.1549%0.494CS..G310 helixtrans-73-25.4176.8-173174.9168.400113.3C11 F12 Q16 H29 S30 K31C11-E14 HydrophobicContact CB-CB 4.38Å; C11-E14 WeakPolarHBondContact O-CB 3.43Å; C11-E14 PolarHBondContact O-N 2.97Å; F12-E14 VanDerWaalsContact C-N 3.29Å; F12-E14 PolarHBondContact O-N 2.87Å; E14-Q16 VanDerWaalsContact C-N 3.34Å; E14-H29 WeakPolarHBondContact OE2-CA 3.37Å; E14-H29 IonicContact OE2-CG 3.84Å; E14-H29 IonicContact OE2-ND1 3.08Å; E14-H29 PolarHBondContact OE2-ND1 3.18Å; E14-H29 VanDerWaalsContact OE2-ND1 3.08Å; E14-S30 WeakPolarHBondContact OE1-CA 3.33Å; E14-S30 WeakPolarHBondContact OE1-CB 3.47Å; E14-S30 PolarHBondContact OE1-N 2.98Å; E14-S30 PolarHBondContact OE1-OG 3.08Å; E14-S30 PolarHBondContact OE2-N 2.93Å; E14-S30 VanDerWaalsContact OE2-N 3.12Å; E14-K31 PolarHBondContact OE1-N 2.85Å
15T84.3Confident83.7Confident118 Ų11885 Ų8572%0.72447%0.471SS*.G310 helixtrans-87.4-3.9175.758.20000113.3F12 W13F12-T15 PolarHBondContact O-OG1 2.8Å; F12-T15 VanDerWaalsContact O-OG1 3.13Å; W13-T15 VanDerWaalsContact C-N 3.34Å
16Q88Confident85.2Confident68 Ų6883.2 Ų83.232%0.31847%0.465SS..SBendtrans-85.7149.4-179.8-61-60.6-29.900110.8F12 W13 E14 L18 G19F12-Q16 HydrophobicContact CE1-CG 4.44Å; W13-Q16 HydrophobicContact CE3-CB 4.23Å; W13-Q16 HydrophobicContact CE3-CG 3.75Å; W13-Q16 HydrophobicContact CZ3-CG 4.21Å; W13-Q16 PolarHBondContact O-N 2.83Å; E14-Q16 VanDerWaalsContact C-N 3.34Å; Q16-L18 PolarHBondContact O-N 3.38Å; Q16-L18 VanDerWaalsContact O-N 3.13Å; Q16-G19 PolarHBondContact O-N 3.08Å
17P81.1Confident86.5Confident133 Ų13384.5 Ų84.586%0.86447%0.467SS*.THydrogen-bonded Turntrans-62.6-23.3-176.524.1-34.7000114
18L83.4Confident87.5Confident155 Ų15585.7 Ų85.781%0.81247%0.467SS*.THydrogen-bonded Turntrans-87.2-8.9174.6-62.7176.4000113.7Q16Q16-L18 PolarHBondContact O-N 3.38Å; Q16-L18 VanDerWaalsContact O-N 3.13Å
19G87.9Confident88Confident26 Ų2680.1 Ų80.127%0.26843%0.428SS..  trans62.6-173.7-173.200000114.1W13 Q16 V21W13-G19 CarbonylContact O-C 3.55Å; W13-G19 WeakPolarHBondContact O-CA 3.24Å; Q16-G19 PolarHBondContact O-N 3.08Å; G19-V21 PolarHBondContact O-N 2.93Å
20C91.1Very high88Confident12 Ų1278.1 Ų78.18%0.08142%0.423CS..  trans-91.4102.5174.6-1730000111.5C11 W13 K22 C25 H29 R33 I35C11-C20 VanDerWaalsContact SG-SG 3.65Å; W13-C20 HydrophobicContact CB-CB 3.84Å; W13-C20 PolarHBondContact O-N 3.15Å; C20-K22 VanDerWaalsContact C-N 3.28Å; C20-K22 PolarHBondContact O-N 3.06Å; C20-C25 VanDerWaalsContact SG-SG 3.69Å; C20-H29 WeakPolarHBondContact CB-CE1 3.37Å; C20-R33 PolarHBondContact O-NH1 3.48Å; C20-I35 WeakPolarHBondContact O-CD1 3.48Å
21V90.4Very high88Confident106 Ų10680.6 Ų80.664%0.64242%0.424SS*.  trans-77.7-3.3178.3-59.30000114.8G19 I23G19-V21 PolarHBondContact O-N 2.93Å; V21-I23 PolarHBondContact O-N 2.75Å
22K89.1Confident87.8Confident119 Ų11983.6 Ų83.652%0.51744%0.443SS..  trans-80.7108179.4-171.1177.9-178.3-1790110C20 S24 C25 R33C20-K22 VanDerWaalsContact C-N 3.28Å; C20-K22 PolarHBondContact O-N 3.06Å; K22-S24 VanDerWaalsContact CE-O 3.27Å; K22-S24 WeakPolarHBondContact CE-O 3.45Å; K22-S24 PolarHBondContact O-N 3.07Å; K22-C25 HydrophobicContact CB-CB 4.35Å; K22-C25 WeakPolarHBondContact O-CB 3.42Å; K22-C25 PolarHBondContact O-N 2.83Å; K22-C25 VanDerWaalsContact O-N 3.12Å; K22-R33 PolarHBondContact O-NH1 2.59Å
23I86.3Confident87.8Confident83 Ų8378.8 Ų78.843%0.42642%0.421SS..THydrogen-bonded Turntrans-51.9-58.8-179.9-62.1172.1000110.1V21 C25 R33 I35 L38 L40V21-I23 PolarHBondContact O-N 2.75Å; I23-C25 PolarHBondContact O-N 2.94Å; I23-R33 PolarHBondContact O-NH2 2.87Å; I23-I35 HydrophobicContact CD1-CG2 4.24Å; I23-I35 HydrophobicContact CG1-CB 4.17Å; I23-I35 HydrophobicContact CG1-CD1 4.08Å; I23-I35 HydrophobicContact CG1-CG2 3.74Å; I23-L38 HydrophobicContact CG2-CD2 3.96Å; I23-L40 HydrophobicContact CB-CD1 4.45Å; I23-L40 HydrophobicContact CG2-CD1 4.1Å; I23-L40 HydrophobicContact CG2-CD2 4.44Å
24S85.9Confident87.6Confident89 Ų8977 Ų7762%0.62242%0.423SS*.THydrogen-bonded Turntrans-82.654.2172.852.20000112.8K22 I26K22-S24 VanDerWaalsContact CE-O 3.27Å; K22-S24 WeakPolarHBondContact CE-O 3.45Å; K22-S24 PolarHBondContact O-N 3.07Å; S24-I26 PolarHBondContact O-N 3.01Å
25C88.8Confident87.6Confident25 Ų2576.1 Ų76.117%0.16942%0.419CS..  trans-70.2127.7167.5-166.80000109.3C20 K22 I23 H29C20-C25 VanDerWaalsContact SG-SG 3.69Å; K22-C25 HydrophobicContact CB-CB 4.35Å; K22-C25 WeakPolarHBondContact O-CB 3.42Å; K22-C25 PolarHBondContact O-N 2.83Å; K22-C25 VanDerWaalsContact O-N 3.12Å; I23-C25 PolarHBondContact O-N 2.94Å; C25-H29 WeakPolarHBondContact CB-NE2 3.26Å; C25-H29 PolarHBondContact SG-NE2 3.38Å
26I88.4Confident87.7Confident85 Ų8578.2 Ų78.244%0.43643%0.426SS..  trans-82.8-15.2176.960.8172.5000112.7C7 S24C7-I26 WeakPolarHBondContact CB-O 3.15Å; C7-I26 PolarHBondContact SG-O 3.13Å; S24-I26 PolarHBondContact O-N 3.01Å
27F88.5Confident87.6Confident88 Ų8877.8 Ų77.839%0.38644%0.44SS..SBendtrans-83.9153.4-177.6-62.9-76000111.4I9 C11 H29I9-F27 HydrophobicContact CB-CD1 4.2Å; I9-F27 HydrophobicContact CG2-CD1 4.07Å; I9-F27 HydrophobicContact CG2-CE1 4.33Å; C11-F27 HydrophobicContact CB-CB 3.68Å; F27-H29 PolarHBondContact O-CD2 3.11Å; F27-H29 PolarHBondContact O-N 3.03Å
28Y89.2Confident87.9Confident63 Ų6375.6 Ų75.625%0.24742%0.421CS..BIsolated β-bridgetrans-60.6134.4178.7-178-92.8000111.3C7 I9 C11 S43 N45C7-Y28 WeakPolarHBondContact O-CB 3.07Å; I9-Y28 WeakPolarHBondContact O-CB 3.24Å; I9-Y28 PolarHBondContact O-N 2.83Å; C11-Y28 WeakPolarHBondContact CB-O 3.43Å; C11-Y28 PolarHBondContact N-O 2.9Å; Y28-S43 WeakPolarHBondContact CA-OG 3.44Å; Y28-S43 WeakPolarHBondContact CD2-OG 3.44Å; Y28-S43 WeakPolarHBondContact CE2-O 3.41Å; Y28-S43 WeakPolarHBondContact CE2-OG 3.44Å; Y28-N45 HydrophobicContact CE2-CB 4.05Å
29H89.9Confident88.2Confident4 Ų474.5 Ų74.52%0.01941%0.409CS..  trans-118.9117.6174.2-78.3-59.6000111.8C11 E14 C20 C25 F27 R33 P42 S43C11-H29 WeakPolarHBondContact CB-CE1 2.99Å; C11-H29 PolarHBondContact SG-CE1 3.07Å; E14-H29 WeakPolarHBondContact OE2-CA 3.37Å; E14-H29 IonicContact OE2-CG 3.84Å; E14-H29 IonicContact OE2-ND1 3.08Å; E14-H29 PolarHBondContact OE2-ND1 3.18Å; E14-H29 VanDerWaalsContact OE2-ND1 3.08Å; C20-H29 WeakPolarHBondContact CB-CE1 3.37Å; C25-H29 WeakPolarHBondContact CB-NE2 3.26Å; C25-H29 PolarHBondContact SG-NE2 3.38Å; F27-H29 PolarHBondContact O-CD2 3.11Å; F27-H29 PolarHBondContact O-N 3.03Å; H29-R33 VanDerWaalsContact CD2-CZ 3.43Å; H29-R33 PolarHBondContact CD2-NE 3.27Å; H29-R33 VanDerWaalsContact CD2-NE 3.31Å; H29-R33 PolarHBondContact NE2-NE 3.06Å; H29-P42 CarbonylContact O-C 3.57Å; H29-P42 WeakPolarHBondContact O-CA 3.2Å; H29-P42 WeakPolarHBondContact O-CB 3.09Å; H29-S43 PolarHBondContact N-OG 3.19Å; H29-S43 PolarHBondContact O-N 2.95Å; H29-S43 PolarHBondContact O-OG 2.85Å
30S86.8Confident88.2Confident66 Ų6674.7 Ų74.746%0.46240%0.404SS..SBendtrans-80.1-29179.574.60000112.9E14E14-S30 WeakPolarHBondContact OE1-CA 3.33Å; E14-S30 WeakPolarHBondContact OE1-CB 3.47Å; E14-S30 PolarHBondContact OE1-N 2.98Å; E14-S30 PolarHBondContact OE1-OG 3.08Å; E14-S30 PolarHBondContact OE2-N 2.93Å; E14-S30 VanDerWaalsContact OE2-N 3.12Å
31K87.1Confident88Confident133 Ų13378.2 Ų78.258%0.57843%0.427SS*.SBendtrans-108.5148.6-179.1-65.4168.1-173.9175.40111.1E14E14-K31 PolarHBondContact OE1-N 2.85Å
32P87.9Confident87.9Confident67 Ų6775.8 Ų75.844%0.43541%0.413SS..  trans-62.9153.9168.428.3-33.6000110.4F39 L40P32-F39 HydrophobicContact CB-CE1 4.38Å; P32-F39 HydrophobicContact CB-CE2 3.56Å; P32-F39 HydrophobicContact CB-CZ 3.47Å; P32-F39 VanDerWaalsContact CB-CZ 3.47Å; P32-F39 HydrophobicContact CG-CE2 4.24Å; P32-F39 HydrophobicContact CG-CZ 4.26Å; P32-L40 CarbonylContact C-O 3.02Å; P32-L40 VanDerWaalsContact CA-O 3.26Å; P32-L40 WeakPolarHBondContact CA-O 3.27Å
33R89.9Confident87.6Confident31 Ų3171.6 Ų71.612%0.11740%0.399CS..EExtended strand (participates in β ladder)trans-126.5137.9-179.6-59.4-179.2-66.9139.1-1.4109.6C20 K22 I23 H29 I35 L40C20-R33 PolarHBondContact O-NH1 3.48Å; K22-R33 PolarHBondContact O-NH1 2.59Å; I23-R33 PolarHBondContact O-NH2 2.87Å; H29-R33 VanDerWaalsContact CD2-CZ 3.43Å; H29-R33 PolarHBondContact CD2-NE 3.27Å; H29-R33 VanDerWaalsContact CD2-NE 3.31Å; H29-R33 PolarHBondContact NE2-NE 3.06Å; R33-I35 HydrophobicContact CB-CD1 4.48Å; R33-L40 HydrophobicContact CB-CB 4.46Å; R33-L40 PolarHBondContact N-O 3.05Å; R33-L40 PolarHBondContact O-N 2.79Å
34N87.2Confident86.6Confident113 Ų11370 Ų7060%0.60440%0.395SS*.EExtended strand (participates in β ladder)trans-107.6121.1167.2-169.6-48.7000108.1G37 L38N34-G37 VanDerWaalsContact OD1-CA 3.27Å; N34-G37 WeakPolarHBondContact OD1-CA 3.36Å; N34-G37 PolarHBondContact OD1-N 2.99Å; N34-G37 VanDerWaalsContact OD1-N 3.1Å; N34-L38 WeakPolarHBondContact CA-O 3.37Å
35I88.6Confident85.1Confident14 Ų1471 Ų717%0.07239%0.394CS..EExtended strand (participates in β ladder)trans-130.1114.1-179.9-58.2165.2000107.2C20 I23 R33 G37 L38 L40C20-I35 WeakPolarHBondContact O-CD1 3.48Å; I23-I35 HydrophobicContact CD1-CG2 4.24Å; I23-I35 HydrophobicContact CG1-CB 4.17Å; I23-I35 HydrophobicContact CG1-CD1 4.08Å; I23-I35 HydrophobicContact CG1-CG2 3.74Å; R33-I35 HydrophobicContact CB-CD1 4.48Å; I35-G37 PolarHBondContact O-N 3.45Å; I35-L38 PolarHBondContact N-O 2.94Å; I35-L38 VanDerWaalsContact O-CB 3.3Å; I35-L38 WeakPolarHBondContact O-CB 3.33Å; I35-L38 PolarHBondContact O-N 3.12Å; I35-L40 HydrophobicContact CD1-CD1 3.8Å
36N86.3Confident82.8Confident162 Ų16274.2 Ų74.287%0.86641%0.412SS*.THydrogen-bonded Turntrans53.136.8-178.6-54.6-13.9000113.3L38N36-L38 VanDerWaalsContact C-N 3.26Å; N36-L38 PolarHBondContact O-N 3.23Å
37G86.7Confident80.5Confident60 Ų6075.7 Ų75.762%0.61943%0.425SS*.THydrogen-bonded Turntrans84.1-13.1-176.300000114.7N34 I35 F39N34-G37 VanDerWaalsContact OD1-CA 3.27Å; N34-G37 WeakPolarHBondContact OD1-CA 3.36Å; N34-G37 PolarHBondContact OD1-N 2.99Å; N34-G37 VanDerWaalsContact OD1-N 3.1Å; I35-G37 PolarHBondContact O-N 3.45Å; G37-F39 PolarHBondContact O-N 3.47Å
38L87.3Confident78Confident87 Ų8779 Ų7946%0.45545%0.447SS..EExtended strand (participates in β ladder)trans-78.1114.7174.8-17664.3000110.1I23 N34 I35 N36 L40I23-L38 HydrophobicContact CG2-CD2 3.96Å; N34-L38 WeakPolarHBondContact CA-O 3.37Å; I35-L38 PolarHBondContact N-O 2.94Å; I35-L38 VanDerWaalsContact O-CB 3.3Å; I35-L38 WeakPolarHBondContact O-CB 3.33Å; I35-L38 PolarHBondContact O-N 3.12Å; N36-L38 VanDerWaalsContact C-N 3.26Å; N36-L38 PolarHBondContact O-N 3.23Å; L38-L40 HydrophobicContact CD2-CD2 3.83Å; L38-L40 HydrophobicContact CG-CD2 3.95Å; L38-L40 HydrophobicContact CG-CG 4.44Å
39F89.3Confident75.4Confident131 Ų13184.4 Ų84.458%0.57547%0.474SS*.EExtended strand (participates in β ladder)trans-78.7120.5170.4-176.8-93.8000110.3P32 G37P32-F39 HydrophobicContact CB-CE1 4.38Å; P32-F39 HydrophobicContact CB-CE2 3.56Å; P32-F39 HydrophobicContact CB-CZ 3.47Å; P32-F39 VanDerWaalsContact CB-CZ 3.47Å; P32-F39 HydrophobicContact CG-CE2 4.24Å; P32-F39 HydrophobicContact CG-CZ 4.26Å; G37-F39 PolarHBondContact O-N 3.47Å
40L87.6Confident72.9Confident30 Ų3092.8 Ų92.816%0.15751%0.511CS..EExtended strand (participates in β ladder)trans-108.5123.7172.2-58.8177.9000108.5I23 P32 R33 I35 L38I23-L40 HydrophobicContact CB-CD1 4.45Å; I23-L40 HydrophobicContact CG2-CD1 4.1Å; I23-L40 HydrophobicContact CG2-CD2 4.44Å; P32-L40 CarbonylContact C-O 3.02Å; P32-L40 VanDerWaalsContact CA-O 3.26Å; P32-L40 WeakPolarHBondContact CA-O 3.27Å; R33-L40 HydrophobicContact CB-CB 4.46Å; R33-L40 PolarHBondContact N-O 3.05Å; R33-L40 PolarHBondContact O-N 2.79Å; I35-L40 HydrophobicContact CD1-CD1 3.8Å; L38-L40 HydrophobicContact CD2-CD2 3.83Å; L38-L40 HydrophobicContact CG-CD2 3.95Å; L38-L40 HydrophobicContact CG-CG 4.44Å
41P86.3Confident70.4Confident86 Ų8698.6 Ų98.656%0.55853%0.53SS*.PPolyproline II helixtrans-65165.4174.929.2-35.1000111.1
42P88.4Confident67.9Low55 Ų5596.7 Ų96.736%0.35753%0.534SS..PPolyproline II helixtrans-50.6146.2163.6-22.333.4000110.3H29 S44H29-P42 CarbonylContact O-C 3.57Å; H29-P42 WeakPolarHBondContact O-CA 3.2Å; H29-P42 WeakPolarHBondContact O-CB 3.09Å; P42-S44 PolarHBondContact O-N 2.91Å
43S82.8Confident65.3Low31 Ų31101.7 Ų101.722%0.21755%0.551CS.*PPolyproline II helixtrans-66.6120.7168.258.20000107.6Y28 H29 N45Y28-S43 WeakPolarHBondContact CA-OG 3.44Å; Y28-S43 WeakPolarHBondContact CD2-OG 3.44Å; Y28-S43 WeakPolarHBondContact CE2-O 3.41Å; Y28-S43 WeakPolarHBondContact CE2-OG 3.44Å; H29-S43 PolarHBondContact N-OG 3.19Å; H29-S43 PolarHBondContact O-N 2.95Å; H29-S43 PolarHBondContact O-OG 2.85Å; S43-N45 PolarHBondContact O-N 3Å; S43-N45 VanDerWaalsContact O-N 3.11Å
44S65Low62.7Low49 Ų49109.6 Ų109.634%0.34359%0.59SS.*PPolyproline II helixtrans-54121178.448.60000110.2Q4 P42 T46Q4-S44 PolarHBondContact NE2-OG 2.8Å; P42-S44 PolarHBondContact O-N 2.91Å; S44-T46 PolarHBondContact O-N 2.83Å
45N54.7Low59.8Low112 Ų112108 Ų10860%0.59960%0.599SS**  trans-65.288.815957.8-33000107.3Y28 S43 T47Y28-N45 HydrophobicContact CE2-CB 4.05Å; S43-N45 PolarHBondContact O-N 3Å; S43-N45 VanDerWaalsContact O-N 3.11Å; N45-T47 PolarHBondContact O-N 3.17Å
46T42.1Very low56.9Low91 Ų91113.1 Ų113.156%0.55864%0.637SS**  trans-64.287.2160.5460000106.9N6 S44 L48N6-T46 WeakPolarHBondContact ND2-CG2 3.32Å; N6-T46 PolarHBondContact ND2-OG1 3.36Å; S44-T46 PolarHBondContact O-N 2.83Å; T46-L48 PolarHBondContact O-N 2.97Å
47T38.3Very low55.1Low116 Ų116111.5 Ų111.571%0.71264%0.635SS**  trans-46.6117.7154.722.40000105.7N45 Q49N45-T47 PolarHBondContact O-N 3.17Å; T47-Q49 PolarHBondContact O-N 3.44Å
48L37.3Very low52.4Low159 Ų159114 Ų11483%0.83264%0.643SS**  trans-44.4101175.6-171.883.2000108.4T46 K50T46-L48 PolarHBondContact O-N 2.97Å; L48-K50 VanDerWaalsContact C-N 3.28Å; L48-K50 PolarHBondContact O-N 3.48Å
49Q33.4Very low50.3Low176 Ų176115.5 Ų115.582%0.82266%0.658SS**  trans-63100.7169.3-90.7-75.39.900105.2T47 E51T47-Q49 PolarHBondContact O-N 3.44Å; Q49-E51 PolarHBondContact O-N 3.25Å
50K38.3Very low47.2Very low180 Ų180114.6 Ų114.678%0.78366%0.663SS**  trans-74.574.4178.1-175.1-172.7172.8-173.20107.3L48 S52L48-K50 VanDerWaalsContact C-N 3.28Å; L48-K50 PolarHBondContact O-N 3.48Å; K50-S52 VanDerWaalsContact C-N 3.27Å; K50-S52 PolarHBondContact O-N 3.15Å
51E35.1Very low44.6Very low187 Ų187122 Ų12287%0.87470%0.697SS**  trans-69.286.7172.6-172.4178.717600108.9Q49Q49-E51 PolarHBondContact O-N 3.25Å
52S34.2Very low42Very low93 Ų93122.9 Ų122.965%0.6571%0.705SS**  trans-159126.2154.5-147.50000112.1K50K50-S52 VanDerWaalsContact C-N 3.27Å; K50-S52 PolarHBondContact O-N 3.15Å
53Q33.1Very low39.6Very low173 Ų173129.8 Ų129.881%0.80873%0.733SS**  trans75.678.2166-51-140.8-65.500118.1
54E34.6Very low37.1Very low197 Ų197136.6 Ų136.692%0.92176%0.761SS**  40.2103.3103.3-163.7169.8-174.700117.6
55G26.8Very low36Very low78 Ų78139.3 Ų139.380%0.80478%0.78SS**  trans-160118.1164.800000109.1
56S27.6Very low35.2Very low123 Ų123140.6 Ų140.686%0.8679%0.786SS**  trans-81.2166.1-165.957.30000113.9
57P47.7Very low35Very low127 Ų127145 Ų14583%0.82580%0.798SS**  trans-98.1168.2-150.738.3-37.5000115.1
58S30.5Very low34.8Very low114 Ų114145.3 Ų145.380%0.79780%0.802SS**  trans-142.1145150.362.40000111.5
59P42.4Very low34.9Very low117 Ų117145.2 Ų145.276%0.7680%0.799SS**  trans-94.9167.1-173.638.6-36.4000112.5
60T25.8Very low35.3Very low113 Ų113145.5 Ų145.569%0.69380%0.8SS**  trans163.6135.6131.7-73.30000111.5
61Q32.8Very low35.6Very low186 Ų186142 Ų14287%0.86979%0.79SS**  trans59.4144.4166.3-76.3165.8-40.600118.1
62S31.4Very low35.8Very low104 Ų104138.9 Ų138.973%0.72778%0.783SS**  cis-139.4147.84.4440000111.3
63Q38.3Very low36.6Very low200 Ų200139.8 Ų139.894%0.93579%0.79SS**  trans-72.3127.3156.2-70.5177.6-81.300108
64E29.7Very low37.6Very low173 Ų173142 Ų14281%0.80879%0.791SS**  trans-136.3120.4148.9-163.6166.5167.800108.8
65S41.8Very low38.4Very low107 Ų107138.5 Ų138.575%0.74879%0.785SS**  trans-99.1104.4-167.255.30000111.4
66L37.2Very low39.6Very low139 Ų139142.9 Ų142.973%0.72879%0.788SS**  trans-138.4101.5168.2-72.2178.3000112.4
67K38.1Very low40.9Very low182 Ų182144 Ų14479%0.79178%0.78SS**  trans43.1134143.9-58.7174.6-177.7175.90119.7M69K67-M69 PolarHBondContact O-N 3.42Å; K67-M69 VanDerWaalsContact O-N 3.15Å
68P34.8Very low41.1Very low123 Ų123145.8 Ų145.880%0.79978%0.777SS**  trans-64.5118.1165.529.3-32.5000109.3E70P68-E70 PolarHBondContact O-N 3.23Å
69M38.7Very low42.3Very low157 Ų157145.9 Ų145.977%0.77378%0.775SS**  trans-82101.6176.2-163.6177.8157.200108.9K67 N71K67-M69 PolarHBondContact O-N 3.42Å; K67-M69 VanDerWaalsContact O-N 3.15Å; M69-N71 WeakPolarHBondContact CB-OD1 3.5Å; M69-N71 HydrophobicContact CE-CB 4.12Å; M69-N71 WeakPolarHBondContact CG-OD1 3.43Å; M69-N71 PolarHBondContact O-N 3.32Å; M69-N71 PolarHBondContact O-OD1 3.02Å; M69-N71 PolarHBondContact SD-OD1 3.38Å; M69-N71 VanDerWaalsContact SD-OD1 3.42Å
70E41.9Very low42.7Very low182 Ų182147 Ų14785%0.8577%0.774SS**  trans-73.264.7172.4-67.9-173.3148.900111.2P68 V72P68-E70 PolarHBondContact O-N 3.23Å; E70-V72 PolarHBondContact O-N 2.92Å
71N45.1Very low44.2Very low107 Ų107147.4 Ų147.457%0.57278%0.775SS**  trans-80.960.4167.841.2-97.4000111.1M69 S73M69-N71 WeakPolarHBondContact CB-OD1 3.5Å; M69-N71 HydrophobicContact CE-CB 4.12Å; M69-N71 WeakPolarHBondContact CG-OD1 3.43Å; M69-N71 PolarHBondContact O-N 3.32Å; M69-N71 PolarHBondContact O-OD1 3.02Å; M69-N71 PolarHBondContact SD-OD1 3.38Å; M69-N71 VanDerWaalsContact SD-OD1 3.42Å; N71-S73 PolarHBondContact O-N 2.98Å
72V40Very low45Very low121 Ų121145.8 Ų145.873%0.73377%0.772SS**  trans-80.4102.4151.5-174.40000106.2E70 R74E70-V72 PolarHBondContact O-N 2.92Å; V72-R74 PolarHBondContact O-N 3.07Å
73S50.9Low45.9Very low113 Ų113149.4 Ų149.479%0.7978%0.775SS**  trans-57.9106.7173.5-600000109.2N71N71-S73 PolarHBondContact O-N 2.98Å
74R53.9Low46.4Very low220 Ų220145.4 Ų145.483%0.8376%0.764SS**  trans-58.7137.4173-64.6-176.2179-149.1-1.6108.4V72 I76V72-R74 PolarHBondContact O-N 3.07Å; R74-I76 PolarHBondContact O-N 3.1Å
75P50.8Low47.1Very low122 Ų122144.4 Ų144.479%0.79276%0.764SS**  trans-57.4113.9174.3-24.434.2000110.2H77P75-H77 PolarHBondContact O-N 2.83Å
76I52.3Low47.4Very low170 Ų170148.4 Ų148.487%0.87277%0.769SS**  trans-79.773.9170.9-52.5176.9000107.1R74R74-I76 PolarHBondContact O-N 3.1Å
77H54.5Low47.9Very low148 Ų148150 Ų15069%0.68577%0.772SS**  trans-146127.1164.7-134.8-81.5000108.5P75P75-H77 PolarHBondContact O-N 2.83Å
78H52Low48.3Very low163 Ų163150.1 Ų150.176%0.75578%0.776SS**  trans-63.3135.4171.6-69.6-94.5000108.5L80H78-L80 PolarHBondContact O-N 2.84Å; H78-L80 VanDerWaalsContact O-N 3.08Å
79P55.1Low48.9Very low116 Ų116152.7 Ų152.775%0.75378%0.777SS**  trans-64.8113.1175.426.2-32.5000108.7V81P79-V81 PolarHBondContact O-N 3.29Å
80L51.7Low49.6Very low141 Ų141154.1 Ų154.174%0.73878%0.782SS**  trans-73.597.9174-64.9177.8000108.3H78 L82H78-L80 PolarHBondContact O-N 2.84Å; H78-L80 VanDerWaalsContact O-N 3.08Å; L80-L82 PolarHBondContact O-N 3.47Å
81V56.9Low49.9Very low121 Ų121154.5 Ų154.573%0.73378%0.784SS**  trans-71.596170.9-178.80000107.9P79 K83P79-V81 PolarHBondContact O-N 3.29Å; V81-K83 PolarHBondContact O-N 3.42Å
82L50.7Low49.9Very low153 Ų153158.4 Ų158.480%0.80180%0.798SS**  trans-66.7103.5166.4-66.5176.2000107.8L80 T84L80-L82 PolarHBondContact O-N 3.47Å; L82-T84 PolarHBondContact O-N 3.37Å
83K50.1Low50.3Low179 Ų179162 Ų16278%0.77881%0.807SS**  trans-70.297.2166.2-69.3-174.1177.9-174.30107.8V81 N85V81-K83 PolarHBondContact O-N 3.42Å; K83-N85 PolarHBondContact O-N 3.08Å
84T47.5Very low49.9Very low117 Ų117165.3 Ų165.372%0.71881%0.81SS**  trans-69.6103.5161.250.40000107.4L82 F86L82-T84 PolarHBondContact O-N 3.37Å; T84-F86 VanDerWaalsContact C-N 3.26Å; T84-F86 PolarHBondContact O-N 3.31Å
85N46Very low49.6Very low151 Ų151161.9 Ų161.981%0.80780%0.803SS**  trans-69.294.8161.1-60-9.5000105.5K83K83-N85 PolarHBondContact O-N 3.08Å
86F47.1Very low49.3Very low192 Ų192161.9 Ų161.984%0.84280%0.804SS**  trans-84.3110.9164-130.8-89.3000105.7T84T84-F86 VanDerWaalsContact C-N 3.26Å; T84-F86 PolarHBondContact O-N 3.31Å
87E48.2Very low49Very low171 Ų171159.9 Ų159.980%0.79980%0.795SS**  trans-70.3128.7172.1-154.7147.6-155.300106.7E89E87-E89 VanDerWaalsContact C-N 3.3Å; E87-E89 PolarHBondContact O-N 2.88Å
88E45.7Very low48.6Very low185 Ų185159.2 Ų159.286%0.86480%0.796SS**  trans-82.578.4-175.3-173.7169.1-146.600108.5E90E88-E90 PolarHBondContact O-N 3.24Å
89E47.5Very low47.8Very low177 Ų177156.4 Ų156.483%0.82780%0.802SS**  trans-82.296.7165.4-72.4-172.7147.300108.5E87 E91E87-E89 VanDerWaalsContact C-N 3.3Å; E87-E89 PolarHBondContact O-N 2.88Å; E89-E91 PolarHBondContact O-N 3.49Å
90E52.8Low47.5Very low188 Ų188156.3 Ų156.388%0.87980%0.804SS**  trans-57.9118154-69.8-177.7125.800108E88E88-E90 PolarHBondContact O-N 3.24Å
91E49Very low47.3Very low189 Ų189154.4 Ų154.488%0.88380%0.802SS**  trans-137.6151.4161.6-134.3177.9-156.200110.4E89E89-E91 PolarHBondContact O-N 3.49Å
92E46.2Very low46.8Very low189 Ų189156 Ų15688%0.88381%0.806SS**  trans-81166.2-143.2-65.5177.5124.600116E94E92-E94 PolarHBondContact O-N 3.25Å; E92-E94 VanDerWaalsContact O-N 3.17Å
93E47.7Very low46.8Very low197 Ų197159 Ų15992%0.92181%0.806SS**  trans-46.6105.5164.7179.1-178.6-166.600113.5
94E42Very low47Very low183 Ų183157.1 Ų157.186%0.85581%0.81SS**  trans-142.6125.9148.7-160.7172.1-16500111.6E92 P96E92-E94 PolarHBondContact O-N 3.25Å; E92-E94 VanDerWaalsContact O-N 3.17Å; E94-P96 WeakPolarHBondContact O-CD 3.2Å
95E47.1Very low48.3Very low147 Ų147155.4 Ų155.469%0.68779%0.793SS**  trans-87.5113.3175.6-179.9-162.2155.200110.7N97E95-N97 PolarHBondContact O-N 2.75Å; E95-N97 WeakPolarHBondContact OE1-CB 3.27Å; E95-N97 PolarHBondContact OE1-ND2 3.37Å
96P45.8Very low49.8Very low123 Ų123151.4 Ų151.480%0.79977%0.774SS**  trans-90.696.7155.332-31000109.5E94E94-P96 WeakPolarHBondContact O-CD 3.2Å
97N46.3Very low51.5Low127 Ų127146.9 Ų146.968%0.67976%0.764SS**  trans-58.4162.9165-152.9-62.5000110.8E95E95-N97 PolarHBondContact O-N 2.75Å; E95-N97 WeakPolarHBondContact OE1-CB 3.27Å; E95-N97 PolarHBondContact OE1-ND2 3.37Å
98D45.8Very low53.1Low134 Ų134145.5 Ų145.572%0.71776%0.757SS**  trans74.364.1168.2-149.715.7000119.2
99A33.9Very low54.9Low105 Ų105140 Ų14087%0.86873%0.731SS**SBendtrans-142.58.4152.800000115.3
100S49.4Very low56.9Low114 Ų114134 Ų13480%0.79771%0.705SS**  trans-109.931.7-177-172.70000114
101S48.3Very low58.8Low101 Ų101131.7 Ų131.771%0.70669%0.694SS**  trans-105.358.7-177.8-162.70000113.2
102L46.8Very low60.5Low155 Ų155128.5 Ų128.581%0.81268%0.679SS**  trans-155.629.1169.6-131.3148.2000115.4
103W50Low62.6Low214 Ų214124 Ų12481%0.81166%0.657SS**  trans-124.166.1170.8-71.263.7000109.7K105W103-K105 PolarHBondContact O-N 2.98Å
104T54.5Low64.7Low140 Ų140122.9 Ų122.986%0.85964%0.644SS**  trans-71.279.8175.1-39.10000109.7T106T104-T106 PolarHBondContact O-N 3.38Å
105K75.2Confident67.1Low82 Ų82116.4 Ų116.436%0.35762%0.622SS.*  trans-56.9126.7-179.5-61.4-166.4165.4-134.30110.1W103 E109 I110W103-K105 PolarHBondContact O-N 2.98Å; K105-E109 WeakPolarHBondContact CA-OE2 3.14Å; K105-E109 WeakPolarHBondContact CB-OE2 3.37Å; K105-E109 WeakPolarHBondContact CD-OE1 3.32Å; K105-E109 WeakPolarHBondContact CE-OE1 3.23Å; K105-E109 WeakPolarHBondContact CG-OE2 3.36Å; K105-E109 IonicContact NZ-OE1 2.72Å; K105-E109 PolarHBondContact NZ-OE1 3.24Å; K105-I110 HydrophobicContact CB-CD1 4.25Å; K105-I110 HydrophobicContact CB-CG1 4Å; K105-I110 WeakPolarHBondContact O-CD1 3.42Å
106T77.4Confident69.2Low66 Ų66113.8 Ų113.841%0.40561%0.612SS.*  trans-64.6154.6179.5630000110T104 E108 E109 I110T104-T106 PolarHBondContact O-N 3.38Å; T106-E108 PolarHBondContact O-N 3.1Å; T106-E108 VanDerWaalsContact O-N 3.17Å; T106-E109 PolarHBondContact O-N 3.43Å; T106-E109 VanDerWaalsContact O-N 3.11Å; T106-E109 PolarHBondContact OG1-N 2.93Å; T106-I110 WeakPolarHBondContact O-CG1 3.44Å; T106-I110 PolarHBondContact O-N 2.69Å
107P81.9Confident71.3Confident98 Ų98115.5 Ų115.564%0.63661%0.606SS**Hα-helixtrans-55.9-31.8174.722.3-33.6000112.1I110 E111P107-I110 WeakPolarHBondContact O-CB 3.4Å; P107-I110 PolarHBondContact O-N 3.46Å; P107-E111 PolarHBondContact O-N 2.95Å
108E81.9Confident73.3Confident142 Ų142114.4 Ų114.466%0.66460%0.597SS**Hα-helixtrans-65.6-47.3175.2-63.4144.4175.400111.8T106 I110 E111 E112T106-E108 PolarHBondContact O-N 3.1Å; T106-E108 VanDerWaalsContact O-N 3.17Å; E108-I110 PolarHBondContact O-N 2.89Å; E108-E111 PolarHBondContact O-N 3.3Å; E108-E111 VanDerWaalsContact O-N 3.17Å; E108-E112 WeakPolarHBondContact O-CB 3.49Å; E108-E112 PolarHBondContact O-N 3.38Å
109E84.4Confident75.2Confident68 Ų68114.3 Ų114.332%0.31859%0.594SS.*Hα-helixtrans-63.6-31.3174-165.1-157.1145.600111.5K105 T106 K113K105-E109 WeakPolarHBondContact CA-OE2 3.14Å; K105-E109 WeakPolarHBondContact CB-OE2 3.37Å; K105-E109 WeakPolarHBondContact CD-OE1 3.32Å; K105-E109 WeakPolarHBondContact CE-OE1 3.23Å; K105-E109 WeakPolarHBondContact CG-OE2 3.36Å; K105-E109 IonicContact NZ-OE1 2.72Å; K105-E109 PolarHBondContact NZ-OE1 3.24Å; T106-E109 PolarHBondContact O-N 3.43Å; T106-E109 VanDerWaalsContact O-N 3.11Å; T106-E109 PolarHBondContact OG1-N 2.93Å; E109-K113 WeakPolarHBondContact O-CB 3.38Å; E109-K113 VanDerWaalsContact O-CG 3.32Å; E109-K113 WeakPolarHBondContact O-CG 3.3Å; E109-K113 PolarHBondContact O-N 2.58Å
110I89Confident77.8Confident51 Ų51111.3 Ų111.326%0.26257%0.566SS.*Hα-helixtrans-71.9-33.9175.8-66.7163.1000111.9K105 T106 P107 E108 K113 R114K105-I110 HydrophobicContact CB-CD1 4.25Å; K105-I110 HydrophobicContact CB-CG1 4Å; K105-I110 WeakPolarHBondContact O-CD1 3.42Å; T106-I110 WeakPolarHBondContact O-CG1 3.44Å; T106-I110 PolarHBondContact O-N 2.69Å; P107-I110 WeakPolarHBondContact O-CB 3.4Å; P107-I110 PolarHBondContact O-N 3.46Å; E108-I110 PolarHBondContact O-N 2.89Å; I110-K113 WeakPolarHBondContact O-CG 3.27Å; I110-R114 WeakPolarHBondContact O-CD 3.33Å; I110-R114 WeakPolarHBondContact O-CG 3.34Å
111E91.7Very high79.5Confident141 Ų141114.5 Ų114.566%0.65956%0.562SS**Hα-helixtrans-75.9-45.3173.6-172.4170.8-174.800111.1P107 E108 K113 R114 A115P107-E111 PolarHBondContact O-N 2.95Å; E108-E111 PolarHBondContact O-N 3.3Å; E108-E111 VanDerWaalsContact O-N 3.17Å; E111-K113 PolarHBondContact O-N 3.1Å; E111-R114 WeakPolarHBondContact O-CB 3.21Å; E111-R114 PolarHBondContact O-N 3.13Å; E111-R114 VanDerWaalsContact O-N 3.07Å; E111-A115 PolarHBondContact O-N 3.17Å
112E86.1Confident81.1Confident122 Ų122116.6 Ų116.657%0.5756%0.559SS**Hα-helixtrans-58.7-48.6178.1-176.8175.9-168.100111.6E108 R114 A115 I116E108-E112 WeakPolarHBondContact O-CB 3.49Å; E108-E112 PolarHBondContact O-N 3.38Å; E112-R114 PolarHBondContact O-N 3.04Å; E112-A115 PolarHBondContact O-N 2.87Å; E112-I116 HydrophobicContact CG-CD1 3.82Å; E112-I116 HydrophobicContact CG-CG1 4.41Å; E112-I116 WeakPolarHBondContact O-CG1 3.26Å; E112-I116 PolarHBondContact O-N 3.26Å
113K89.6Confident82.7Confident95 Ų95112.4 Ų112.441%0.41354%0.542SS..Hα-helixtrans-63.4-28.4177.178.7-168.6-175.2-168.90112.9E109 I110 E111 K117E109-K113 WeakPolarHBondContact O-CB 3.38Å; E109-K113 VanDerWaalsContact O-CG 3.32Å; E109-K113 WeakPolarHBondContact O-CG 3.3Å; E109-K113 PolarHBondContact O-N 2.58Å; I110-K113 WeakPolarHBondContact O-CG 3.27Å; E111-K113 PolarHBondContact O-N 3.1Å; K113-K117 VanDerWaalsContact O-CB 3.26Å; K113-K117 WeakPolarHBondContact O-CB 3.41Å; K113-K117 PolarHBondContact O-N 3.13Å; K113-K117 VanDerWaalsContact O-N 3.12Å
114R91.4Very high83.8Confident172 Ų172104.5 Ų104.565%0.64953%0.527SS*.Hα-helixtrans-74.3-45.1174.2-75.2171.7-177.5-174.63.1110.7I110 E111 E112 K117 E118I110-R114 WeakPolarHBondContact O-CD 3.33Å; I110-R114 WeakPolarHBondContact O-CG 3.34Å; E111-R114 WeakPolarHBondContact O-CB 3.21Å; E111-R114 PolarHBondContact O-N 3.13Å; E111-R114 VanDerWaalsContact O-N 3.07Å; E112-R114 PolarHBondContact O-N 3.04Å; R114-K117 PolarHBondContact O-N 3.41Å; R114-E118 WeakPolarHBondContact O-CB 3.38Å; R114-E118 PolarHBondContact O-N 3.49Å
115A92.1Very high83.9Confident47 Ų47105.2 Ų105.239%0.38852%0.521SS..Hα-helixtrans-60.4-46.9176.300000111.5E111 E112 K117 E118 M119E111-A115 PolarHBondContact O-N 3.17Å; E112-A115 PolarHBondContact O-N 2.87Å; A115-K117 PolarHBondContact O-N 3.31Å; A115-E118 PolarHBondContact O-N 3.39Å; A115-M119 WeakPolarHBondContact O-CB 3.38Å; A115-M119 VanDerWaalsContact O-CG 3.23Å; A115-M119 WeakPolarHBondContact O-CG 3.41Å; A115-M119 PolarHBondContact O-N 2.86Å
116I91.4Very high82.7Confident93 Ų93108.2 Ų108.248%0.47753%0.531SS..Hα-helixtrans-59.6-47.9174.6-66.1168.6000110.3E112 E118 M119 C120E112-I116 HydrophobicContact CG-CD1 3.82Å; E112-I116 HydrophobicContact CG-CG1 4.41Å; E112-I116 WeakPolarHBondContact O-CG1 3.26Å; E112-I116 PolarHBondContact O-N 3.26Å; I116-E118 VanDerWaalsContact C-N 3.34Å; I116-E118 PolarHBondContact O-N 3.41Å; I116-M119 PolarHBondContact O-N 2.89Å; I116-C120 PolarHBondContact O-N 3.05Å; I116-C120 PolarHBondContact O-SG 3.12Å
117K90.6Very high81.5Confident159 Ų159114.3 Ų114.369%0.69155%0.548SS*.Hα-helixtrans-60.6-40.8178.3-173.7175.5-178.8176.50112.5K113 R114 A115 Y121K113-K117 VanDerWaalsContact O-CB 3.26Å; K113-K117 WeakPolarHBondContact O-CB 3.41Å; K113-K117 PolarHBondContact O-N 3.13Å; K113-K117 VanDerWaalsContact O-N 3.12Å; R114-K117 PolarHBondContact O-N 3.41Å; A115-K117 PolarHBondContact O-N 3.31Å; K117-Y121 VanDerWaalsContact O-CB 3.32Å; K117-Y121 WeakPolarHBondContact O-CB 3.21Å; K117-Y121 PolarHBondContact O-N 3.3Å
118E88.5Confident79.9Confident104 Ų104119.6 Ų119.649%0.48656%0.555SS.*Hα-helixtrans-66.7-40.9176.4-173.2179.317100111.7R114 A115 I116 Y121 K122R114-E118 WeakPolarHBondContact O-CB 3.38Å; R114-E118 PolarHBondContact O-N 3.49Å; A115-E118 PolarHBondContact O-N 3.39Å; I116-E118 VanDerWaalsContact C-N 3.34Å; I116-E118 PolarHBondContact O-N 3.41Å; E118-Y121 PolarHBondContact O-N 3.44Å; E118-K122 HydrophobicContact CG-CD 4.19Å; E118-K122 WeakPolarHBondContact O-CB 3.18Å; E118-K122 WeakPolarHBondContact O-CG 3.19Å; E118-K122 PolarHBondContact O-N 3.22Å; E118-K122 WeakPolarHBondContact OE1-CE 3.32Å; E118-K122 IonicContact OE1-NZ 2.58Å; E118-K122 PolarHBondContact OE1-NZ 3.39Å
119M85.5Confident77.9Confident131 Ų131121 Ų12165%0.64556%0.559SS**Hα-helixtrans-64.7-43.3175.2-71.1-63.1-65.100112A115 I116 K122 S123A115-M119 WeakPolarHBondContact O-CB 3.38Å; A115-M119 VanDerWaalsContact O-CG 3.23Å; A115-M119 WeakPolarHBondContact O-CG 3.41Å; A115-M119 PolarHBondContact O-N 2.86Å; I116-M119 PolarHBondContact O-N 2.89Å; M119-K122 PolarHBondContact O-N 3.22Å; M119-S123 VanDerWaalsContact O-CB 3.27Å; M119-S123 WeakPolarHBondContact O-CB 3.44Å; M119-S123 PolarHBondContact O-N 2.85Å; M119-S123 PolarHBondContact O-OG 2.88Å
120C87.7Confident75.9Confident43 Ų43125.7 Ų125.729%0.29158%0.581SS.*Hα-helixtrans-66.4-34.6175-66.50000112.8I116 S123 G124 E125I116-C120 PolarHBondContact O-N 3.05Å; I116-C120 PolarHBondContact O-SG 3.12Å; C120-S123 WeakPolarHBondContact CA-OG 3.44Å; C120-S123 PolarHBondContact O-OG 2.85Å; C120-G124 PolarHBondContact O-N 3.32Å; C120-E125 PolarHBondContact O-N 3.22Å
121Y84.6Confident73.7Confident180 Ų180127.2 Ų127.271%0.70660%0.601SS**Hα-helixtrans-69.5-45.3174.7-177-100.8000111.7K117 E118 G124K117-Y121 VanDerWaalsContact O-CB 3.32Å; K117-Y121 WeakPolarHBondContact O-CB 3.21Å; K117-Y121 PolarHBondContact O-N 3.3Å; E118-Y121 PolarHBondContact O-N 3.44Å; Y121-G124 PolarHBondContact O-N 3.12Å
122K83.8Confident71.7Confident146 Ų146125.5 Ų125.564%0.63560%0.602SS**Hα-helixtrans-72.5-30179.7-73.2-178.5-1761740114.3E118 M119 G124E118-K122 HydrophobicContact CG-CD 4.19Å; E118-K122 WeakPolarHBondContact O-CB 3.18Å; E118-K122 WeakPolarHBondContact O-CG 3.19Å; E118-K122 PolarHBondContact O-N 3.22Å; E118-K122 WeakPolarHBondContact OE1-CE 3.32Å; E118-K122 IonicContact OE1-NZ 2.58Å; E118-K122 PolarHBondContact OE1-NZ 3.39Å; M119-K122 PolarHBondContact O-N 3.22Å; K122-G124 VanDerWaalsContact C-N 3.28Å
123S79.8Confident69.7Low66 Ų66125.7 Ų125.746%0.46261%0.614SS.*THydrogen-bonded Turntrans-78-12.1175.353.70000113.3M119 C120 E125M119-S123 VanDerWaalsContact O-CB 3.27Å; M119-S123 WeakPolarHBondContact O-CB 3.44Å; M119-S123 PolarHBondContact O-N 2.85Å; M119-S123 PolarHBondContact O-OG 2.88Å; C120-S123 WeakPolarHBondContact CA-OG 3.44Å; C120-S123 PolarHBondContact O-OG 2.85Å; S123-E125 PolarHBondContact O-N 3.43Å
124G72.5Confident67.4Low48 Ų48128.6 Ų128.650%0.49563%0.634SS.*SBendtrans73.40.4-177.600000114.4C120 Y121 K122 Y126 Y127C120-G124 PolarHBondContact O-N 3.32Å; Y121-G124 PolarHBondContact O-N 3.12Å; K122-G124 VanDerWaalsContact C-N 3.28Å; G124-Y126 PolarHBondContact O-N 3.27Å; G124-Y126 VanDerWaalsContact O-N 3.15Å; G124-Y127 PolarHBondContact O-N 3.49Å
125E57.2Low64.8Low155 Ų155127.7 Ų127.772%0.72464%0.64SS**THydrogen-bonded Turntrans-64.8-19.3-178.4-66.2-175.2161.600112.9C120 S123 Y127C120-E125 PolarHBondContact O-N 3.22Å; S123-E125 PolarHBondContact O-N 3.43Å; E125-Y127 VanDerWaalsContact C-N 3.32Å; E125-Y127 PolarHBondContact O-N 3.1Å
126Y50.7Low62.1Low145 Ų145131.1 Ų131.157%0.56966%0.659SS**THydrogen-bonded Turntrans-71.7-18.3177.7-166.6-99000114.5G124G124-Y126 PolarHBondContact O-N 3.27Å; G124-Y126 VanDerWaalsContact O-N 3.15Å
127Y51.3Low59.5Low195 Ų195132.4 Ų132.477%0.76568%0.676SS**  trans-111.764.6176.1-85.8-79.6000112.2G124 E125G124-Y127 PolarHBondContact O-N 3.49Å; E125-Y127 VanDerWaalsContact C-N 3.32Å; E125-Y127 PolarHBondContact O-N 3.1Å
128R48.4Very low56.9Low208 Ų208130 Ų13079%0.78568%0.679SS**  trans-132.860.5153.8-166.5179.8-80.1135.3-3.4111.2
129F39.8Very low54.3Low171 Ų171134.9 Ų134.975%0.7570%0.699SS**  trans-77.5125.8151.8-73.1-82.8000107.9A131F129-A131 PolarHBondContact O-N 3Å; F129-A131 VanDerWaalsContact O-N 3.17Å
130H41.7Very low51.9Low168 Ų168134 Ų13478%0.77871%0.705SS**  trans-70.7106.9166.3-75.2-89.9000107.7
131A44.5Very low49.3Very low82 Ų82138.7 Ų138.768%0.67873%0.733SS**  trans-57.8133.116200000108.2F129F129-A131 PolarHBondContact O-N 3Å; F129-A131 VanDerWaalsContact O-N 3.17Å
132P48.4Very low46.8Very low106 Ų106133.8 Ų133.869%0.68873%0.729SS**  trans-54.6142.5165.9-22.133.6000109.3D134P132-D134 PolarHBondContact O-N 3.07Å; P132-D134 VanDerWaalsContact O-N 3.07Å
133P45.1Very low44.5Very low125 Ų125132.7 Ų132.781%0.81274%0.737SS**  trans-63114.4173.3-2032.2000109.7I135P133-I135 PolarHBondContact O-N 3.25Å; P133-I135 VanDerWaalsContact O-N 3.13Å
134D39.6Very low42Very low157 Ų157136 Ų13684%0.8476%0.755SS**  trans-58.3117.7173.1-69.9-52.7000109.4P132P132-D134 PolarHBondContact O-N 3.07Å; P132-D134 VanDerWaalsContact O-N 3.07Å
135I37Very low40.1Very low152 Ų152139.6 Ų139.678%0.77977%0.767SS**  trans-68.5127.8174.1-62.4170.6000107P133 S137P133-I135 PolarHBondContact O-N 3.25Å; P133-I135 VanDerWaalsContact O-N 3.13Å; I135-S137 PolarHBondContact O-N 3.04Å
136P36.9Very low39.1Very low120 Ų120141.1 Ų141.178%0.77977%0.774SS**  trans-6993.7-178.627.1-34.1000110.8S138P136-S138 PolarHBondContact O-N 3.45Å
137S35.3Very low38.6Very low120 Ų120143.6 Ų143.684%0.83979%0.787SS**  trans-72.294.9171.5-1720000109.8I135 K139I135-S137 PolarHBondContact O-N 3.04Å; S137-K139 PolarHBondContact O-N 3.19Å
138S36.2Very low37.5Very low109 Ų109143 Ų14376%0.76279%0.792SS**  trans-75101.8178.258.20000111.4P136P136-S138 PolarHBondContact O-N 3.45Å
139K35Very low36.5Very low205 Ų205139.3 Ų139.389%0.89179%0.787SS**  trans-161118.2143.4-112.2161.4-172.5177.40113S137S137-K139 PolarHBondContact O-N 3.19Å
140S34Very low35.9Very low112 Ų112137.8 Ų137.878%0.78378%0.782SS**  trans-71.3135.2170.6166.50000111.1
141V34.6Very low35.5Very low143 Ų143138.4 Ų138.487%0.86778%0.783SS**  trans-137.6131.8143.4-179.10000107
142A30.8Very low35.1Very low77 Ų77140.5 Ų140.564%0.63679%0.789SS**PPolyproline II helixtrans-80.8156.6-176.500000112.2
143P35Very low34.2Very low122 Ų122142.6 Ų142.679%0.79279%0.794SS**PPolyproline II helixtrans-72.1132.217929.4-34.5000112V145P143-V145 PolarHBondContact O-N 2.84Å
144T28.1Very low33.5Very low136 Ų136144 Ų14483%0.83479%0.789SS**PPolyproline II helixtrans-70.6117171.7-33.70000109.5
145V31.7Very low32.9Very low124 Ų124143.1 Ų143.175%0.75279%0.79SS**  trans-86.3115.3171.5169.20000108.9P143P143-V145 PolarHBondContact O-N 2.84Å
146E36.6Very low32.6Very low187 Ų187138.6 Ų138.687%0.87478%0.781SS**  trans-69.3144.1168.9-64.2-172.8146.400110.5
147K39.9Very low32.3Very low196 Ų196138.4 Ų138.485%0.85278%0.783SS**  trans-112.9128.4179.8-69.2179.6176.3-179.90109.9
148E29.1Very low32.2Very low184 Ų184141.6 Ų141.686%0.8678%0.784SS**  trans179.7144.6147.8-102.7176.9-174.800105.9
149L27.6Very low32.4Very low129 Ų129143.7 Ų143.768%0.67579%0.786SS**  cis-156157.99.8-168.776.4000109.5
150E27.8Very low32.7Very low140 Ų140143.1 Ų143.165%0.65479%0.786SS**  trans63.498.5151.1-96.2178.9-132.700122.8
151K31.8Very low33Very low181 Ų181146.2 Ų146.279%0.78779%0.788SS**  167.1135.996.4-93.3161.8-172.3167.10112.5
152P36.5Very low33.1Very low125 Ų125143.1 Ų143.181%0.81279%0.785SS**  trans-101.4144.2178.636.9-30.9000112.8
153L29.1Very low33.5Very low150 Ų150146.5 Ų146.579%0.78579%0.793SS**  trans-154.6132.5156-161.956000113.2
154E30.8Very low33.7Very low155 Ų155144.1 Ų144.172%0.72479%0.79SS**  trans67.2102.6155.8-76175.8142.100122.9
155T26.5Very low34.2Very low138 Ų138144.7 Ų144.785%0.84779%0.788SS**  92.2132.5108.4-59.10000120.6
156G30.4Very low34.6Very low57 Ų57145.4 Ų145.459%0.58879%0.792SS**  trans109.885.1167.300000112.5
157S32.4Very low34.7Very low117 Ų117142.6 Ų142.682%0.81879%0.788SS**  53.6121.794.368.50000112.6
158E33Very low34.9Very low187 Ų187138.5 Ų138.587%0.87478%0.781SS**  -168.416854.1-170.5162.7-169.900111
159L40.4Very low35.1Very low152 Ų152136.5 Ų136.580%0.79678%0.781SS**  trans-76.8143.7-177.2-61.2160.5000111.9
160Q40.2Very low35.9Very low193 Ų193138.4 Ų138.490%0.90278%0.784SS**  -150.7131127.3-160163-5.500112.2
161E41.5Very low36.1Very low177 Ų177140 Ų14083%0.82779%0.79SS**  trans-81.5151.5178.5-61153138.900110.8
162G35.3Very low36.2Very low78 Ų78136.7 Ų136.780%0.80479%0.789SS**  trans-167.968.6-177.400000112.3
163D40.6Very low36.1Very low149 Ų149137.2 Ų137.280%0.79778%0.784SS**  trans-68.6150.3173.7-171.113.6000111.5
164G37.6Very low36.4Very low71 Ų71139.9 Ų139.973%0.73279%0.79SS**  trans17850-166.800000114.9
165L39.9Very low36.5Very low149 Ų149141 Ų14178%0.7880%0.795SS**  trans-46136.7173.2-65.7160.4000113.9
166T39.1Very low37.1Very low138 Ų138146.3 Ų146.385%0.84780%0.8SS**  174.1142.2119.5-65.60000110.8
167V39.5Very low37.3Very low129 Ų129148.3 Ų148.378%0.78281%0.811SS**  trans-105.9-168.8-176.3-145.50000111.2
168P44.8Very low37.4Very low109 Ų109146.6 Ų146.671%0.70881%0.811SS**  -106.1173.1-121.941.4-26.2000115
169T32Very low37.7Very low142 Ų142146 Ų14687%0.87181%0.808SS**  trans-130130.4167.3-56.90000111.8
170K44.8Very low37.5Very low170 Ų170143.5 Ų143.574%0.73981%0.81SS**  trans-103170.5177.5-71.3-176.2175.7-179.30111.7
171F32.4Very low37.9Very low174 Ų174142.6 Ų142.676%0.76380%0.803SS**  trans76.4122.4159.7-69.4-77.5000119.3
172S32.5Very low37.4Very low111 Ų111140.9 Ų140.978%0.77681%0.805SS**  -158.9144.298.245.30000111.6
173L34.2Very low37.2Very low136 Ų136141.8 Ų141.871%0.71280%0.799SS**  trans-83.3156.7157-75.990.9000108.3
174F35.6Very low37Very low206 Ų206142.6 Ų142.690%0.90480%0.802SS**  trans-149.2126.4138.8-99.5-69.4000111.7
175E34.6Very low36.6Very low179 Ų179145.2 Ų145.284%0.83680%0.8SS**  trans-73.4155.9160.9-67.2170.398.800110.5
176R38.7Very low36.3Very low249 Ų249149.4 Ų149.494%0.9481%0.805SS**  trans-151.5105.2147.8-154.2170.8-163.5154.76112.3
177A34.7Very low36.7Very low99 Ų99151.6 Ų151.682%0.81880%0.803SS**  trans-83.6154.5159.600000110.2
178G34.8Very low36.8Very low80 Ų80151.6 Ų151.683%0.82581%0.805SS**  trans-165105.8174.800000110.7
179E39.3Very low36.5Very low175 Ų175158.2 Ų158.282%0.81882%0.816SS**  trans-82.6152.1178.6-64.4-176.4104.300112.6
180A35Very low36.8Very low100 Ų100156.8 Ų156.883%0.82681%0.808SS**  trans-149.1141.8150.300000109.7
181K48Very low36.4Very low173 Ų173155 Ų15575%0.75281%0.806SS**  trans-124.9-178.1179.2-69.6-168.4180177.90110.9
182T31.2Very low36.7Very low141 Ų141153.9 Ų153.987%0.86581%0.807SS**  trans91.7141.8-178.772.30000114.8
183S32.4Very low36.8Very low98 Ų98153.4 Ų153.469%0.68581%0.809SS**  cis-166.8158.7-15.145.90000112.9
184L36Very low37Very low165 Ų165151.6 Ų151.686%0.86481%0.814SS**  trans67119.9149.3-76.4161.5000123.9
185D29.5Very low37Very low127 Ų127151.1 Ų151.168%0.67981%0.812SS**  61.4108.2129-166.244.2000122.7
186R32.4Very low37.5Very low236 Ų236151.4 Ų151.489%0.89181%0.813SS**  -165.3142.6116.3-111.5173.3175.6166.4-0.8113.8
187K47.4Very low37.8Very low184 Ų184147.5 Ų147.580%0.881%0.811SS**PPolyproline II helixtrans-69.3149.4179.2-61174177.2178.20113.7
188P43Very low37.9Very low129 Ų129146.7 Ų146.784%0.83881%0.812SS**PPolyproline II helixtrans-73.4148.9153.933-32.3000110.6
189R39Very low37.9Very low248 Ų248146.9 Ų146.994%0.93681%0.814SS**PPolyproline II helixtrans-102.5121.1-170.7-157178.3-167.7171.11.8110.3
190T36.8Very low37.7Very low113 Ų113141.8 Ų141.869%0.69381%0.808SS**PPolyproline II helixtrans-73.5140.716041.40000109.7
191D36.8Very low38.1Very low132 Ų132144.6 Ų144.671%0.70681%0.809SS**  169.1138.9105.2-93.4-31.3000115.8
192I39.8Very low37.6Very low151 Ų151142 Ų14277%0.77481%0.812SS**  trans59.7116.8138.1-56.5162.8000120.3
193A34.2Very low37.9Very low100 Ų100146.3 Ų146.383%0.82681%0.814SS**  -160.4140.711500000110.9
194A38.5Very low38.3Very low98 Ų98145.4 Ų145.481%0.8181%0.812SS**  trans-103159.8-175.900000112.6
195F35.7Very low38.5Very low196 Ų196143.7 Ų143.786%0.8681%0.811SS**  trans-147.3129.4147.356.4-91.9000113
196E45.2Very low38.9Very low186 Ų186146.4 Ų146.487%0.86982%0.82SS**  trans48132.9155.3-93.1172.9134.900125.1
197N43.3Very low39Very low167 Ų167146.4 Ų146.489%0.89382%0.819SS**  trans-69.3146.2178.9-51.6-72.6000113.1
198G38.3Very low38.7Very low81 Ų81144.2 Ų144.284%0.83582%0.815SS**  trans-16168.9170.500000111.2
199G34.9Very low38.5Very low84 Ų84145 Ų14587%0.86681%0.811SS**  trans-69.1144.5-17600000113.7
200G33.9Very low38.4Very low68 Ų68142.2 Ų142.270%0.70181%0.806SS**  trans-164.199174.600000109.8C202G200-C202 PolarHBondContact O-N 2.81Å
201D43.3Very low38.4Very low159 Ų159144.7 Ų144.785%0.8581%0.814SS**  trans-68.5120.5-164.9-60.7-49.5000113.4
202C37.9Very low38.3Very low119 Ų119141.6 Ų141.680%0.80481%0.813SS**  trans-88.4104.8174.552.50000111.1G200 A204G200-C202 PolarHBondContact O-N 2.81Å; C202-A204 PolarHBondContact O-N 3.18Å; C202-A204 VanDerWaalsContact O-N 3.1Å
203Y38.1Very low37.8Very low232 Ų232141.2 Ų141.291%0.9182%0.818SS**  trans-68.7105.1171.7-91.9-91.3000111.4
204A40.8Very low37.6Very low78 Ų78143.8 Ų143.865%0.64582%0.817SS**  trans-111.6118.2169.200000110.1C202 Q206C202-A204 PolarHBondContact O-N 3.18Å; C202-A204 VanDerWaalsContact O-N 3.1Å; A204-Q206 PolarHBondContact O-N 3.15Å; A204-Q206 VanDerWaalsContact O-N 3.1Å
205P39.8Very low37.4Very low130 Ų130147.1 Ų147.184%0.84482%0.816SS**  trans-71.7104.4175.7-16.430.9000110.8
206Q37.4Very low37.5Very low184 Ų184143.4 Ų143.486%0.8682%0.815SS**  trans-74.7145.4170.5-78.9-175.2-7.800111.4A204A204-Q206 PolarHBondContact O-N 3.15Å; A204-Q206 VanDerWaalsContact O-N 3.1Å
207R35.8Very low36.9Very low235 Ų235143.2 Ų143.289%0.88781%0.814SS**  trans-87.8120.2-173.9-54.9168.4-165.4-111.8-0.3107.9I209R207-I209 PolarHBondContact O-N 3.38Å
208I40.4Very low36.4Very low138 Ų138138.3 Ų138.371%0.70880%0.797SS**  trans-77.3114.2179.6-56.8174.7000109F210I208-F210 HydrophobicContact CG2-CD2 3.63Å; I208-F210 HydrophobicContact CG2-CE2 3.46Å; I208-F210 VanDerWaalsContact CG2-CE2 3.46Å; I208-F210 HydrophobicContact CG2-CG 4.29Å; I208-F210 HydrophobicContact CG2-CZ 3.99Å
209I39.4Very low36.1Very low146 Ų146142.8 Ų142.875%0.74980%0.8SS**  trans-99.1114.2163.6-60.8174.3000106.3R207 L211R207-I209 PolarHBondContact O-N 3.38Å; I209-L211 HydrophobicContact CG2-CG 4.44Å; I209-L211 PolarHBondContact O-N 3.3Å
210F35.3Very low35.8Very low189 Ų189142.6 Ų142.683%0.82979%0.79SS**  trans-84.7106.2167.9-79.5-80.2000109I208I208-F210 HydrophobicContact CG2-CD2 3.63Å; I208-F210 HydrophobicContact CG2-CE2 3.46Å; I208-F210 VanDerWaalsContact CG2-CE2 3.46Å; I208-F210 HydrophobicContact CG2-CG 4.29Å; I208-F210 HydrophobicContact CG2-CZ 3.99Å
211L37.5Very low35.7Very low165 Ų165148.2 Ų148.286%0.86480%0.799SS**  trans-89.6136.2153.8-73.2167.5000107.3I209I209-L211 HydrophobicContact CG2-CG 4.44Å; I209-L211 PolarHBondContact O-N 3.3Å
212G33.9Very low35.2Very low67 Ų67146.7 Ų146.769%0.69179%0.79SS**  trans-109176.2-178.200000113.2
213V30.8Very low35.4Very low144 Ų144149 Ų14987%0.87379%0.787SS**  trans70.4117.7173.7-166.80000112
214D29.2Very low35.1Very low153 Ų153146.2 Ų146.282%0.81878%0.782SS**  -155171.662.5-154.30.4000113.9
215E34.7Very low34.8Very low169 Ų169147.4 Ų147.479%0.7979%0.792SS**  trans-106.4153.1-170.6-62.6-177.1110.100115.1
216S36.6Very low34.4Very low118 Ų118147.4 Ų147.483%0.82579%0.789SS**  trans65.7162.3157.476.80000117.2
217E32.9Very low34.6Very low182 Ų182143.6 Ų143.685%0.8578%0.783SS**  cis-148.6170.63.2-103.7-136.8120.600106.8
218A32.5Very low34.5Very low64 Ų64142.3 Ų142.353%0.52978%0.784SS.*  cis-173.6-157.4-14.700000109.2
219L31.9Very low34.1Very low174 Ų174142.2 Ų142.291%0.91179%0.794SS**  trans79.4134.5169.5-57.3-178.8000117.9
220A29.8Very low33.8Very low80 Ų80140.7 Ų140.766%0.66180%0.796SS**  cis-149170.67.300000113.8
221E30.9Very low34Very low187 Ų187139.6 Ų139.687%0.87480%0.799SS**  trans70.9133.6158.5-74.7174-173.100118.2
222D33.1Very low33.9Very low127 Ų127138.1 Ų138.168%0.67980%0.797SS**  cis-160.9163.5-2.8-161.414.1000112.3
223K42.2Very low34Very low166 Ų166144 Ų14472%0.72280%0.803SS**  trans7992160-47.1-145.7175.2-1640122.6
224E33.1Very low34.1Very low175 Ų175143.3 Ų143.382%0.81880%0.799SS**  56.4107.8109-164.2176.7-167.200121
225A32.7Very low34.7Very low102 Ų102143.5 Ų143.584%0.84380%0.8SS**  trans-153.2123.5142.300000111.1
226T32.8Very low34.7Very low130 Ų130142.9 Ų142.980%0.79880%0.802SS**  trans-99.2125.8-174.2-600000112.3
227S40.8Very low34.7Very low105 Ų105142.2 Ų142.273%0.73479%0.793SS**  trans-170.2106.5146.357.60000116.2
228K34Very low35.1Very low207 Ų207141.4 Ų141.490%0.979%0.789SS**  trans50.4117.3135-59.3178.3-178.1176.70120.5
229C32.2Very low35.8Very low136 Ų136143.4 Ų143.492%0.91980%0.797SS**  trans-58.9152.2170.1-56.20000115.5
230S32.8Very low36Very low114 Ų114141.8 Ų141.880%0.79779%0.794SS**  trans-148.2147.613368.70000110.6
231N38.6Very low36.6Very low167 Ų167149.4 Ų149.489%0.89381%0.806SS**  trans-109.1111.8-173.7-136.9-40.8000108.2
232V35.4Very low37.4Very low134 Ų134149.6 Ų149.681%0.81280%0.804SS**  trans-137.5140.7171.6-174.90000110.9
233K36.8Very low38.1Very low189 Ų189149.4 Ų149.482%0.82281%0.809SS**  trans-79.7174.4-172.5-167.1176.3-174176.40112.1
234V32.3Very low38.1Very low130 Ų130149.2 Ų149.279%0.78881%0.81SS**  trans106.1131.4159.9-175.10000115.5
235N42.8Very low38.7Very low157 Ų157149.9 Ų149.984%0.8481%0.811SS**  trans-64.9144177.6-50.2-72.6000111.9
236D34Very low39.7Very low156 Ų156153.6 Ų153.683%0.83481%0.808SS**  trans-142.6149.2148.9-154.14.6000112.8
237V37.9Very low40.2Very low104 Ų104150.8 Ų150.863%0.6381%0.805SS**  trans-55.9143.4-168.2171.50000115.8
238Q40.8Very low40.5Very low166 Ų166152 Ų15278%0.77681%0.808SS**  -176.2127.6120.4-92.6-54.9-49.600110.7V240Q238-V240 PolarHBondContact O-N 3.05Å
239P46.2Very low41.4Very low105 Ų105151.3 Ų151.368%0.68281%0.805SS**PPolyproline II helixtrans-73.7126.9174.329.5-33.1000111.5R241P239-R241 PolarHBondContact O-N 2.72Å
240V36Very low42.2Very low141 Ų141154.2 Ų154.286%0.85580%0.802SS**PPolyproline II helixtrans-56.7123.1177.6174.90000110.7Q238 K242Q238-V240 PolarHBondContact O-N 3.05Å; V240-K242 PolarHBondContact O-N 3.33Å
241R44.2Very low43.1Very low239 Ų239159.8 Ų159.890%0.90281%0.805SS**PPolyproline II helixtrans-60.7116.7178.3-76.3176.4166.1171.1-4.5110.7P239P239-R241 PolarHBondContact O-N 2.72Å
242K45.8Very low43.6Very low192 Ų192161 Ų16184%0.83580%0.803SS**PPolyproline II helixtrans-60.4135.4167.7-66.6179.2178.9178.50109.9V240 H244V240-K242 PolarHBondContact O-N 3.33Å; K242-H244 PolarHBondContact O-N 2.97Å
243P48.1Very low43.7Very low122 Ų122166.6 Ų166.679%0.79281%0.81SS**PPolyproline II helixtrans-64126.2172.725.3-32.2000110.2F245P243-F245 PolarHBondContact O-N 3.3Å
244H43Very low44.1Very low162 Ų162164.9 Ų164.975%0.7581%0.808SS**  trans-73.694.9-173.8-175-58.9000111K242 K246K242-H244 PolarHBondContact O-N 2.97Å; H244-K246 PolarHBondContact O-N 3.33Å
245F44.7Very low44.1Very low190 Ų190168.3 Ų168.383%0.83381%0.808SS**  trans-59.3102.1173.7-126-89.6000110P243 G247P243-F245 PolarHBondContact O-N 3.3Å; F245-G247 PolarHBondContact O-N 3.11Å
246K53.9Low44.1Very low179 Ų179167.9 Ų167.978%0.77881%0.806SS**  trans-70.7119174.6-71.1-167.2177.8-175.10108.2H244 V248H244-K246 PolarHBondContact O-N 3.33Å; K246-V248 PolarHBondContact O-N 2.91Å
247G43.7Very low44.9Very low72 Ų72167.9 Ų167.974%0.74280%0.801SS**  trans-57.1128.3-168.500000113.6F245 K249F245-G247 PolarHBondContact O-N 3.11Å; G247-K249 PolarHBondContact O-N 3.17Å
248V47.8Very low45.2Very low129 Ų129168.1 Ų168.178%0.78281%0.805SS**  trans-66.2106.5170.3178.20000108.3K246 K250K246-V248 PolarHBondContact O-N 2.91Å; V248-K250 PolarHBondContact O-N 3.16Å
249K51.8Low45.2Very low194 Ų194169.1 Ų169.184%0.84381%0.806SS**  trans-63.4106.2177.8-171.3174-176.1176.30109.2G247 R251G247-K249 PolarHBondContact O-N 3.17Å; K249-R251 PolarHBondContact O-N 3.33Å
250K49.8Very low45.1Very low196 Ų196171.4 Ų171.485%0.85281%0.813SS**  trans-51.7113.3174.7-70.1-175.6177.1-178.20109.3V248 K252V248-K250 PolarHBondContact O-N 3.16Å; K250-K252 PolarHBondContact O-N 3.46Å
251R51.6Low45.5Very low231 Ų231174.3 Ų174.387%0.87281%0.814SS**  trans-68.9113.3166.8-81-174.6-77.9-163.3-3.2107.4K249 W253K249-R251 PolarHBondContact O-N 3.33Å; R251-W253 PolarHBondContact O-N 3.35Å
252K49.7Very low45.5Very low194 Ų194168.7 Ų168.784%0.84381%0.809SS**PPolyproline II helixtrans-66.6122163.7-69.2-176.3176.3-175.30106.8K250 I254K250-K252 PolarHBondContact O-N 3.46Å; K252-I254 PolarHBondContact O-N 3.17Å
253W37Very low45.3Very low251 Ų251163.5 Ų163.595%0.95181%0.809SS**PPolyproline II helixtrans-68.5118.4165-68.591.3000107.3R251R251-W253 PolarHBondContact O-N 3.35Å
254I44.9Very low44.9Very low153 Ų153163.7 Ų163.779%0.78581%0.814SS**PPolyproline II helixtrans-93.6124.6166.6-60.5176.6000105.4K252 D256K252-I254 PolarHBondContact O-N 3.17Å; I254-D256 PolarHBondContact O-N 3.17Å
255Y32.7Very low44.5Very low202 Ų202159 Ų15979%0.79281%0.809SS**PPolyproline II helixtrans-73.3117171.7-166-90.7000107.5E257Y255-E257 HydrophobicContact CD1-CG 4.49Å; Y255-E257 PolarHBondContact O-N 3.31Å
256D42.8Very low44.5Very low148 Ų148158.5 Ų158.579%0.79181%0.812SS**  trans-79.1103.7174.9-131-15.5000107.4I254I254-D256 PolarHBondContact O-N 3.17Å
257E50Low43.7Very low155 Ų155161.1 Ų161.172%0.72482%0.816SS**  trans-62138173.2-78.8-172.1128.400110.1Y255 K259Y255-E257 HydrophobicContact CD1-CG 4.49Å; Y255-E257 PolarHBondContact O-N 3.31Å; E257-K259 PolarHBondContact O-N 3.47Å
258P45Very low43.8Very low110 Ų110168.7 Ų168.771%0.71482%0.823SS**  trans-63.4110173.726.3-32.8000109.6N260P258-N260 PolarHBondContact O-N 3.25Å
259K40.9Very low43.2Very low187 Ų187168.7 Ų168.781%0.81382%0.823SS**  trans-55.9108.8178.6-80.3175.9177.2166.60111.1E257 F261E257-K259 PolarHBondContact O-N 3.47Å; K259-F261 PolarHBondContact O-N 3.17Å
260N44.1Very low42.7Very low153 Ų153167.8 Ų167.882%0.81882%0.821SS**PPolyproline II helixtrans-60.7132.1158.5-74.7-75.5000108.9P258P258-N260 PolarHBondContact O-N 3.25Å
261F43.9Very low42.2Very low201 Ų201166 Ų16688%0.88282%0.819SS**PPolyproline II helixtrans-70127.1177.4-70-90.9000110.3K259K259-F261 PolarHBondContact O-N 3.17Å
262P43.6Very low41.6Very low122 Ų122160.6 Ų160.679%0.79281%0.814SS**PPolyproline II helixtrans-70.2144.3169.930.2-33.1000109.9S264P262-S264 PolarHBondContact O-N 2.84Å
263G41.4Very low41.1Very low82 Ų82156.8 Ų156.885%0.84580%0.803SS**PPolyproline II helixtrans-58.4127.6-169.400000114.3
264S40Very low41.3Very low127 Ų127150.6 Ų150.689%0.88880%0.795SS**PPolyproline II helixtrans-77.1136.3166.8-1720000110.2P262P262-S264 PolarHBondContact O-N 2.84Å
265G34.8Very low40.9Very low63 Ų63151.9 Ų151.965%0.64980%0.795SS**PPolyproline II helixtrans-67.5157.3-167.800000115.5R267G265-R267 PolarHBondContact O-N 3.32Å
266M44.3Very low41.1Very low180 Ų180149 Ų14989%0.88779%0.789SS**  trans-46.5102.5176.5-168.679.468.400113.7
267R37.5Very low41Very low233 Ų233151.5 Ų151.588%0.87979%0.792SS**  trans-122109.5155.6-79.4-166.4173.5-159.3-0.8109.7G265 V269G265-R267 PolarHBondContact O-N 3.32Å; R267-V269 PolarHBondContact O-N 3.41Å
268R45.8Very low41.1Very low232 Ų232151.1 Ų151.188%0.87579%0.792SS**  trans-64.3112.6173.3-71.8-177-77.1-149-3.3109.2
269V35.3Very low40.5Very low128 Ų128151.2 Ų151.278%0.77680%0.796SS**  trans-110129164179.80000107.1R267R267-V269 PolarHBondContact O-N 3.41Å
270H41.6Very low40.4Very low175 Ų175152.9 Ų152.981%0.8180%0.798SS**PPolyproline II helixtrans-65.7138.8-173.8-85.4-103.3000112.3P272H270-P272 WeakPolarHBondContact O-CD 3.35Å
271I38.7Very low40.1Very low158 Ų158153.8 Ų153.881%0.8180%0.797SS**PPolyproline II helixtrans-82.1124.4170.8-60.6163.6000109.2
272P39.4Very low40.3Very low118 Ų118152.7 Ų152.777%0.76680%0.795SS**PPolyproline II helixtrans-85.8122.4160.2-322.8000109.8H270H270-P272 WeakPolarHBondContact O-CD 3.35Å
273N38.6Very low40Very low115 Ų115153.4 Ų153.462%0.61579%0.787SS**PPolyproline II helixtrans-76.6125-179.8177.2-6.1000111.8K275N273-K275 PolarHBondContact O-N 3.26Å
274P41.1Very low40.1Very low120 Ų120155.3 Ų155.378%0.77978%0.778SS**  trans-83.389.617733.5-33.2000112H276P274-H276 PolarHBondContact O-N 2.97Å
275K38.5Very low40.7Very low180 Ų180157.4 Ų157.478%0.78377%0.771SS**  trans-84.390.2170.6-73.3-170.9178.5-179.20112.4N273N273-K275 PolarHBondContact O-N 3.26Å
276H36.6Very low41.3Very low143 Ų143160.7 Ų160.766%0.66277%0.774SS**  trans-4.1117.2144.6171-65.2000116.8P274 M278P274-H276 PolarHBondContact O-N 2.97Å; H276-M278 VanDerWaalsContact CE1-CE 3.44Å; H276-M278 WeakPolarHBondContact CE1-CE 3.49Å; H276-M278 VanDerWaalsContact NE2-CE 3.33Å; H276-M278 WeakPolarHBondContact NE2-CE 3.38Å
277K40.3Very low41.3Very low200 Ų200163.3 Ų163.387%0.8777%0.774SS**  trans-153.7140.2136.9-77.8-151.7178.6-177.10111.1
278M51.8Low41.6Very low147 Ų147159.9 Ų159.972%0.72477%0.773SS**  trans-79.3150.1176.38.9-70.9-158.300111.9H276H276-M278 VanDerWaalsContact CE1-CE 3.44Å; H276-M278 WeakPolarHBondContact CE1-CE 3.49Å; H276-M278 VanDerWaalsContact NE2-CE 3.33Å; H276-M278 WeakPolarHBondContact NE2-CE 3.38Å
279S33.1Very low41.3Very low112 Ų112152.8 Ų152.878%0.78376%0.764SS**  trans-154.7119.6155.1-169.90000110.1
280Y39.1Very low41.6Very low221 Ų221154.8 Ų154.887%0.86777%0.765SS**  trans-78.3130.6167.6-86.7-103.6000108.6
281H37.8Very low41.4Very low172 Ų172153.6 Ų153.680%0.79676%0.764SS**  trans-144.2105.4153-126-68.6000111.8
282H46.3Very low41.2Very low179 Ų179151.2 Ų151.283%0.82977%0.768SS**  trans-70.4125.6166.1-149.6-84000107.4
283H38.1Very low41.3Very low136 Ų136151.2 Ų151.263%0.6377%0.771SS**  trans-12890.6167.9-153.3-20000111.1K285H283-K285 WeakPolarHBondContact CE1-CE 3.34Å; H283-K285 VanDerWaalsContact CE1-CG 3.48Å; H283-K285 WeakPolarHBondContact CE1-CG 3.41Å; H283-K285 WeakPolarHBondContact ND1-CG 3.38Å; H283-K285 WeakPolarHBondContact NE2-CE 3.44Å
284N44Very low41Very low123 Ų123154.7 Ų154.766%0.65878%0.777SS**  trans-65.2130.7158.9177.8-7.2000108.3N286N284-N286 PolarHBondContact OD1-N 3.48Å; N284-N286 VanDerWaalsContact OD1-N 3.08Å
285K52Low40.9Very low171 Ų171155.4 Ų155.474%0.74378%0.779SS**  trans-128.572.7167.7-74.6-162177.4-177.10111.4H283 R287H283-K285 WeakPolarHBondContact CE1-CE 3.34Å; H283-K285 VanDerWaalsContact CE1-CG 3.48Å; H283-K285 WeakPolarHBondContact CE1-CG 3.41Å; H283-K285 WeakPolarHBondContact ND1-CG 3.38Å; H283-K285 WeakPolarHBondContact NE2-CE 3.44Å; K285-R287 PolarHBondContact O-N 3.49Å
286N48Very low40.8Very low132 Ų132154.3 Ų154.371%0.70678%0.777SS**  trans-57.5115.5145161.28.3000109.6N284N284-N286 PolarHBondContact OD1-N 3.48Å; N284-N286 VanDerWaalsContact OD1-N 3.08Å
287R44.6Very low40.9Very low235 Ų235151.6 Ų151.689%0.88778%0.779SS**  trans-165.5118.9132-123178.3174.8178.9-2.9112.1K285K285-R287 PolarHBondContact O-N 3.49Å
288N43.1Very low41Very low160 Ų160148.3 Ų148.386%0.85678%0.778SS**  trans-76.1145.9168-65.6-22.5000110.7
289A39.4Very low40.2Very low84 Ų84153 Ų15369%0.69479%0.787SS**  trans-162.2114.6143.900000111.1
290E42.2Very low40.4Very low169 Ų169155.8 Ų155.879%0.7979%0.794SS**  trans72119.8137-68.6171.4-150.100122.8
291N36.1Very low40.3Very low151 Ų151149.7 Ų149.781%0.80779%0.789SS**  trans73.796.5136.8-56.7-23.1000121.2
292A34.5Very low40.2Very low108 Ų108148.1 Ų148.189%0.89379%0.791SS**  -156.5136.8123.600000111.3
293S43.2Very low39.9Very low117 Ų117150.6 Ų150.682%0.81879%0.793SS**  trans-93139.5-172.953.50000114
294Y32Very low39.8Very low189 Ų189151 Ų15174%0.74181%0.805SS**  trans-162.9115.8135.6-161.9-122.1000111.7H296Y294-H296 AromaticContact CE1-CD2 3.54Å; Y294-H296 AromaticContact CE1-NE2 3.33Å; Y294-H296 VanDerWaalsContact CE1-NE2 3.33Å; Y294-H296 WeakPolarHBondContact CE1-NE2 3.14Å; Y294-H296 AromaticContact CZ-NE2 3.81Å; Y294-H296 PolarHBondContact OH-CE1 2.98Å
295T37.6Very low39.5Very low134 Ų134150.7 Ų150.782%0.82281%0.808SS**  trans-110.8128174.533.30000110.6
296H37.6Very low38.4Very low158 Ų158149.7 Ų149.773%0.73182%0.816SS**  trans-96.4120.9159.9-90-64.1000109.5Y294Y294-H296 AromaticContact CE1-CD2 3.54Å; Y294-H296 AromaticContact CE1-NE2 3.33Å; Y294-H296 VanDerWaalsContact CE1-NE2 3.33Å; Y294-H296 WeakPolarHBondContact CE1-NE2 3.14Å; Y294-H296 AromaticContact CZ-NE2 3.81Å; Y294-H296 PolarHBondContact OH-CE1 2.98Å
297A39.2Very low38.1Very low86 Ų86150.1 Ų150.171%0.71182%0.818SS**  trans-106.8137.2169.200000110
298P40.6Very low37.5Very low131 Ų131146.6 Ų146.685%0.85182%0.816SS**PPolyproline II helixtrans-75.2142.4156.2-6.324.7000109.5
299R36.6Very low37.1Very low244 Ų244143.2 Ų143.292%0.92181%0.811SS**PPolyproline II helixtrans-91.3134.9177.3-72.8-178.7170.9-176.7-3111.3
300D36.3Very low37.5Very low172 Ų172145 Ų14592%0.9282%0.815SS**PPolyproline II helixtrans-100.6127.3158.4-87.1-38.7000110.9
301A38Very low38.3Very low92 Ų92142 Ų14276%0.7681%0.811SS**  trans-169.1139166.900000106.3
302V34.8Very low38.1Very low139 Ų139146.4 Ų146.484%0.84282%0.816SS**  cis-148.4155.920.6172.20000109.3
303R40.4Very low37.9Very low231 Ų231147.1 Ų147.187%0.87281%0.814SS**  trans-86.9148.4169.6-69.8-178.8172.4113.1-2.6112.5
304T35.1Very low37.7Very low145 Ų145152.4 Ų152.489%0.8982%0.816SS**  trans-124150.4152.845.30000110.9
305V37.8Very low38.3Very low117 Ų117148.8 Ų148.871%0.70982%0.815SS**  trans-115.8142.5-172.2170.60000109.7
306T30.2Very low38.1Very low149 Ų149148.2 Ų148.291%0.91481%0.812SS**  trans-142.5148.7154.3-2.60000111
307L41.4Very low37.8Very low142 Ų142146.1 Ų146.174%0.74382%0.815SS**  trans-93.6151.9-166.2-64.1151.4000112.4
308N31.8Very low37.4Very low161 Ų161152.9 Ų152.986%0.86182%0.823SS**  157.8148.3119.2-77.6-39.4000114
309A34.2Very low37.2Very low89 Ų89152 Ų15274%0.73682%0.819SS**  trans-129.7-175.2168.200000107.1
310P48.6Very low37.1Very low122 Ų122149.3 Ų149.379%0.79281%0.81SS**  cis-139-127.713.331.3-1.6000114.6
311P57.4Low37.1Very low106 Ų106149.1 Ų149.169%0.68881%0.809SS**  -133.5-167.7-106.443.1-23.9000117.4
312R31.7Very low37.2Very low243 Ų243153.6 Ų153.692%0.91781%0.812SS**  trans94.5129.6168.7-59.7173171.8-120.1-0.8115.4
313S31.3Very low37.2Very low122 Ų122150.7 Ų150.785%0.85380%0.802SS**  -164157.867.5560000115.7
314R39.2Very low36.7Very low229 Ų229146.5 Ų146.586%0.86480%0.797SS**  trans-125.7148160.5-143.7-167.2-166.9-163.85.7105.3
315P45.4Very low37.1Very low112 Ų112145.7 Ų145.773%0.72779%0.792SS**  -154.4149.285.738.8-17.4000115.6
316T33Very low36.9Very low123 Ų123147.7 Ų147.776%0.75580%0.798SS**  81.5116.598.7-56.70000119.1
317S30.6Very low37.1Very low114 Ų114150.2 Ų150.280%0.79780%0.797SS**  trans-166.9116.6148.1-160.10000105.9
318R31.8Very low36.8Very low228 Ų228152 Ų15286%0.8680%0.801SS**  41.4135.165.4-101.9-177.2178.6-177.9-0.4113.1
319S34.7Very low37.5Very low111 Ų111149.4 Ų149.478%0.77679%0.793SS**  cis-150.2-179.222.151.70000114.7
320Y34.6Very low37.7Very low188 Ų188153.5 Ų153.574%0.73779%0.794SS**  trans-68.6163-175.9-77.7-106.9000116
321N37.1Very low37Very low168 Ų168155.7 Ų155.790%0.89880%0.798SS**  -152.4157.4118.8-94.6-30.1000113.4
322K39.2Very low36Very low186 Ų186157.7 Ų157.781%0.80980%0.804SS**  trans-114.4177.4-177.6-84.5-162.9179-167.40108.8
323A35.1Very low36.2Very low78 Ų78153.9 Ų153.965%0.64580%0.8SS**  cis-168.2-157.3-23.200000106.7
324D30.5Very low36.4Very low144 Ų144153.5 Ų153.577%0.7780%0.797SS**  trans74.1125.8176.3-56.6-33.8000116.6
325V42.6Very low36.8Very low127 Ų127148.4 Ų148.477%0.7779%0.793SS**  cis88.510023-172.60000114.9
326N33.4Very low36.2Very low159 Ų159148.6 Ų148.685%0.8579%0.788SS**  trans-151.3154.8163.534.6-28.8000110.6
327K36.3Very low36.7Very low202 Ų202150.5 Ų150.588%0.87879%0.786SS**  trans-101.4161.3-149.1-58.5176.7178.7179.20115.7
328E34.6Very low36.8Very low179 Ų179154.2 Ų154.284%0.83679%0.79SS**  trans-48.9169.6154.9-81.4-167.8127.700114.1
329P46.2Very low37Very low107 Ų107151.9 Ų151.970%0.69579%0.791SS**  cis-152172.332.742.9-21.1000121.3
330K39.2Very low37Very low175 Ų175152 Ų15276%0.76179%0.792SS**  trans31.7130.7145.2-67.2174.8178.9171.80122.1
331L32.7Very low36.9Very low168 Ų168149.4 Ų149.488%0.8880%0.796SS**  trans-137.7138.5134.1-77.8-179.3000111.1
332N36.8Very low36.9Very low149 Ų149146.3 Ų146.380%0.79779%0.788SS**  trans-98.9135.7167.9-65.4-80.1000108.8
333L35.3Very low36.5Very low162 Ų162147.7 Ų147.785%0.84879%0.789SS**  trans-139.4129.6155.5-85.6104000110.2
334C35.4Very low36.8Very low115 Ų115150 Ų15078%0.77779%0.791SS**  trans-108.1142.9163.5178.50000107.3
335P48.3Very low37.3Very low121 Ų121147.1 Ų147.179%0.78680%0.795SS**  trans-125.8149.3141.335.1-26.4000113
336D32.5Very low37.3Very low116 Ų116144.9 Ų144.962%0.6279%0.785SS**  trans-82164.2-174.2-172.816.2000112.7
337K44.5Very low38.1Very low164 Ų164141.9 Ų141.971%0.71378%0.782SS**  trans52.3100.7166.8-69.8140.7-175.2148.40118.5
338H31.6Very low38.3Very low191 Ų191143.9 Ų143.988%0.88478%0.784SS**  -144.1135.2123.1-115.155.3000111.2
339M35.8Very low38.8Very low179 Ų179145.8 Ų145.888%0.88278%0.784SS**  trans-75.4133.6176-61.2-163.376.400109.7
340S36.5Very low38.8Very low115 Ų115151.2 Ų151.280%0.80479%0.791SS**  trans-135107165.4-79.60000108.7S342S340-S342 PolarHBondContact O-N 2.74Å
341T32.5Very low39.1Very low133 Ų133154 Ų15482%0.81680%0.796SS**  trans-61.9103.6-175.9-43.70000110Y343T341-Y343 PolarHBondContact O-N 3.37Å
342S35.3Very low39.9Very low103 Ų103152.7 Ų152.772%0.7279%0.789SS**  trans-65.7104.6168.6480000108.8S340 N344S340-S342 PolarHBondContact O-N 2.74Å; S342-N344 PolarHBondContact O-N 3.19Å
343Y31Very low40.7Very low215 Ų215149.7 Ų149.784%0.84378%0.778SS**  trans-68.7103178.6-159.4-91000109.1T341 G345T341-Y343 PolarHBondContact O-N 3.37Å; Y343-G345 PolarHBondContact O-N 3.02Å; Y343-G345 VanDerWaalsContact O-N 3.11Å
344N41.9Very low41Very low126 Ų126150.7 Ų150.767%0.67478%0.775SS**  trans-54.7117.1175.5-98.5-45.8000109.8S342 S346S342-N344 PolarHBondContact O-N 3.19Å; N344-S346 PolarHBondContact O-N 3.03Å; N344-S346 PolarHBondContact O-OG 3.38Å
345G41.8Very low41.3Very low84 Ų84151 Ų15187%0.86678%0.779SS**  trans-63.973.7168.900000110.9Y343Y343-G345 PolarHBondContact O-N 3.02Å; Y343-G345 VanDerWaalsContact O-N 3.11Å
346S41.9Very low41.2Very low79 Ų79154 Ų15455%0.55278%0.779SS**  trans-81.9120.6-169-58.40000109.9N344 W348N344-S346 PolarHBondContact O-N 3.03Å; N344-S346 PolarHBondContact O-OG 3.38Å; S346-W348 VanDerWaalsContact O-CD1 3.23Å; S346-W348 PolarHBondContact O-N 3.23Å
347A50.8Low41.8Very low96 Ų96154.6 Ų154.679%0.79379%0.788SS**  trans-58.6110.4-179.300000111.9R349A347-R349 PolarHBondContact O-N 3.32Å
348W39.6Very low41.5Very low244 Ų244157.6 Ų157.692%0.92480%0.796SS**  trans-75.873.2170.6-76.982.9000110.8S346 R350S346-W348 VanDerWaalsContact O-CD1 3.23Å; S346-W348 PolarHBondContact O-N 3.23Å; W348-R350 PolarHBondContact O-N 2.95Å
349R44.3Very low42.2Very low220 Ų220153.6 Ų153.683%0.8379%0.789SS**  trans-61.5105.5166.9-164.2-172-149.5-75.54.1107.9A347 R351A347-R349 PolarHBondContact O-N 3.32Å; R349-R351 PolarHBondContact O-N 3.09Å
350R47.5Very low42.7Very low220 Ų220154.8 Ų154.883%0.8379%0.79SS**  trans-51.5106.5177.5-70.9171.367.3163.20.4110.3W348W348-R350 PolarHBondContact O-N 2.95Å
351R44.4Very low43.3Very low234 Ų234155.1 Ų155.188%0.88379%0.787SS**  trans-91.4112.9159.4-81-166.9-72-140.5-1.5107.6R349 P353R349-R351 PolarHBondContact O-N 3.09Å; R351-P353 WeakPolarHBondContact O-CD 3.43Å
352I50.8Low43.8Very low140 Ų140157 Ų15772%0.71879%0.787SS**  trans-87.3115.4168.9-59.6169000106.5
353P52.9Low44.4Very low87 Ų87161.2 Ų161.257%0.56579%0.792SS**  trans-80.3164.2162.132.8-30.6000110.5R351R351-P353 WeakPolarHBondContact O-CD 3.43Å
354F41.5Very low45.3Very low183 Ų183156.7 Ų156.780%0.80379%0.786SS**  trans82.466.4174-42.6-59.7000118.1
355S42.4Very low45.2Very low121 Ų121160.8 Ų160.885%0.84679%0.794SS**  trans-82.799.4141.356.20000109.5
356K46.2Very low45.7Very low184 Ų184162 Ų16280%0.879%0.786SS**  trans-85122.3162.5-81.5-173.4177.4178.70108.8Y358K356-Y358 PolarHBondContact O-N 2.91Å
357T43.9Very low46.1Very low129 Ų129166.9 Ų166.979%0.79180%0.8SS**  trans-69.1120.1173.945.50000110.4S359T357-S359 PolarHBondContact O-N 3.36Å
358Y39.5Very low46Very low226 Ų226168 Ų16889%0.88680%0.799SS**  trans-79.4108.8166.1-90.6-92.5000109.9K356 K360K356-Y358 PolarHBondContact O-N 2.91Å; Y358-K360 PolarHBondContact O-N 3.02Å; Y358-K360 VanDerWaalsContact O-N 3.15Å
359S45.9Very low46.5Very low107 Ų107167.4 Ų167.475%0.74880%0.797SS**  trans-66.7106.7168.8-44.50000109.1T357 T361T357-S359 PolarHBondContact O-N 3.36Å; S359-T361 PolarHBondContact O-N 3.06Å; S359-T361 VanDerWaalsContact O-N 3.16Å
360K46.9Very low46.7Very low205 Ų205168.7 Ų168.789%0.89180%0.802SS**  trans-70.9108.1174.2-174.1177.8-178.5-178.30108.8Y358 E362Y358-K360 PolarHBondContact O-N 3.02Å; Y358-K360 VanDerWaalsContact O-N 3.15Å; K360-E362 PolarHBondContact O-N 3.27Å
361T48.3Very low46.6Very low122 Ų122165.5 Ų165.575%0.74880%0.801SS**  trans-71.7118.3171.840.60000109.9S359 K363S359-T361 PolarHBondContact O-N 3.06Å; S359-T361 VanDerWaalsContact O-N 3.16Å; T361-K363 PolarHBondContact O-N 3.01Å
362E42.8Very low46.4Very low172 Ų172158.1 Ų158.180%0.80480%0.798SS**  trans-75.2104.8177-174.6172.7-174.300109.6K360 V364K360-E362 PolarHBondContact O-N 3.27Å; E362-V364 HydrophobicContact CG-CG2 4.43Å; E362-V364 PolarHBondContact O-N 3.42Å
363K48.6Very low46Very low192 Ų192157.2 Ų157.284%0.83580%0.804SS**  trans-89.797.5165.9-74-164.8176.3-174.40109T361 Y365T361-K363 PolarHBondContact O-N 3.01Å; K363-Y365 PolarHBondContact O-N 3.23Å
364V48.3Very low45.4Very low119 Ų119166.6 Ų166.672%0.72184%0.836SS**  trans-57.1123.1167.1178.30000108.7E362E362-V364 HydrophobicContact CG-CG2 4.43Å; E362-V364 PolarHBondContact O-N 3.42Å
365Y41Very low45.6Very low213 Ų213165.8 Ų165.884%0.83584%0.838SS**  trans-106.9128.9169.1-139.2-85.1000107.9K363K363-Y365 PolarHBondContact O-N 3.23Å
366P52Low45.8Very low108 Ų108168.2 Ų168.270%0.70184%0.837SS**  trans-68.7136.1-17826.8-33.2000111.4
367E49.6Very low45.8Very low183 Ų183167.3 Ų167.386%0.85584%0.839SS**  trans-70.3130.5-174.4-166.5170-141.900112R369E367-R369 PolarHBondContact O-N 3.48Å; E367-R369 VanDerWaalsContact O-N 3.09Å
368P48.9Very low45.9Very low118 Ų118169.5 Ų169.577%0.76684%0.842SS**  trans-71.7106.1177.2-16.430.5000111.1R370P368-R370 PolarHBondContact O-N 3.2Å
369R50Low46.3Very low233 Ų233166 Ų16688%0.87984%0.84SS**  trans-58.5105169.7-81.1-174167.8163.5-2.5110.7E367 N371E367-R369 PolarHBondContact O-N 3.48Å; E367-R369 VanDerWaalsContact O-N 3.09Å; R369-N371 PolarHBondContact O-N 3.31Å
370R48.8Very low46.3Very low246 Ų246169.9 Ų169.993%0.92885%0.846SS**  trans-83103.1160.1-80.5-168.8172.5-172.2-1.3109.4P368P368-R370 PolarHBondContact O-N 3.2Å
371N46.6Very low46.3Very low154 Ų154167.4 Ų167.482%0.82484%0.842SS**  trans-65141.6161.6-62.7-24.8000109.2R369R369-N371 PolarHBondContact O-N 3.31Å
372G39.9Very low46.1Very low79 Ų79170.9 Ų170.981%0.81485%0.85SS**  trans143.484165.600000115.5
373S41.7Very low46.4Very low121 Ų121170.8 Ų170.885%0.84685%0.853SS**  trans-176.998130.7-173.20000111.1
374K41.6Very low46.2Very low284 Ų284168.9 Ų168.9100%1.23586%0.855SS**  trans-165.10139.9-109.8178.3-177.4-177.60108.8

Retrieved 374 of 374 residues in 230.6 ms (Link to these results)