A0A096MWN9_PAPAN Loading...

Pro-apoptotic WT1 regulator

AlphaFold DB , UniProt , Accession A0A096MWN9, Species PAPAN (Papio anubis, Olive baboon), Gene PAWR, Length 340 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
1M41.4Very low43.9Very low254 Ų254139.8 Ų139.8100%1.25185%0.851SS**  0148.40-73.6169.3167.600108.1
2A46.7Very low44.3Very low100 Ų100144.2 Ų144.283%0.82686%0.863SS**  trans-131137-179.500000110.5
3T43.8Very low44.6Very low149 Ų149137 Ų13791%0.91484%0.837SS**  trans-153.2111.4160.223.30000107.3
4G40.8Very low45.1Very low62 Ų62131.5 Ų131.564%0.63982%0.822SS**  trans-84.4126.5177.400000111.3Y6G4-Y6 WeakPolarHBondContact O-CD2 3.45Å; G4-Y6 PolarHBondContact O-N 3.3Å; G4-Y6 VanDerWaalsContact O-N 3.11Å
5G40.9Very low45.8Very low79 Ų79129 Ų12981%0.81481%0.811SS**  trans-7690.7167.800000110.4R7G5-R7 PolarHBondContact O-N 2.87Å
6Y34.6Very low46.2Very low215 Ų215127.4 Ų127.484%0.84380%0.8SS**  trans-61.1116.6177-72.1-92.2000110.7G4 T8G4-Y6 WeakPolarHBondContact O-CD2 3.45Å; G4-Y6 PolarHBondContact O-N 3.3Å; G4-Y6 VanDerWaalsContact O-N 3.11Å; Y6-T8 PolarHBondContact O-N 3.31Å
7R49.7Very low46.7Very low240 Ų240124.6 Ų124.691%0.90678%0.782SS**  trans-78.5102.1161.2-66.8-172.2-177.3-81.31.3107.7G5 S9G5-R7 PolarHBondContact O-N 2.87Å; R7-S9 PolarHBondContact O-N 3.47Å
8T42.7Very low48Very low137 Ų137123.4 Ų123.484%0.8477%0.769SS**  trans-68.398.9171.7400000109.7Y6Y6-T8 PolarHBondContact O-N 3.31Å
9S42.4Very low49.5Very low111 Ų111123.6 Ų123.678%0.77676%0.758SS**  trans-67139.8170.852.30000111.2R7R7-S9 PolarHBondContact O-N 3.47Å
10S52.7Low51.3Low128 Ų128122.3 Ų122.390%0.89575%0.745SS**  trans-9.5120.4167.3-49.20000117.8
11G47.3Very low53Low63 Ų63122 Ų12265%0.64974%0.735SS**  trans-171.6113.616700000113.3
12L48.6Very low55.2Low192 Ų192115.2 Ų115.2100%1.00570%0.701SS**SBendtrans47.466.5161-6291.6000117.2
13G47.6Very low57.2Low51 Ų51116.2 Ų116.253%0.52668%0.683SS.*  trans-154.8-20169.600000117.2S15G13-S15 PolarHBondContact O-N 2.73Å
14G51.9Low59.5Low60 Ų60114.3 Ų114.362%0.61966%0.662SS**THydrogen-bonded Turntrans-85.314.8-164.600000118.3D18G14-D18 WeakPolarHBondContact O-CB 3.11Å
15S56.3Low61.9Low94 Ų94114.1 Ų114.166%0.65766%0.655SS**THydrogen-bonded Turntrans-107-38.2-176.5175.70000113.6G13 F19G13-S15 PolarHBondContact O-N 2.73Å; S15-F19 WeakPolarHBondContact O-CB 3.26Å; S15-F19 PolarHBondContact O-N 3.49Å
16T51.3Low64.2Low104 Ų104116.7 Ų116.764%0.63864%0.644SS**Hα-helixtrans-77.9-29179.843.20000113.1L20T16-L20 WeakPolarHBondContact O-CD1 3.24Å; T16-L20 VanDerWaalsContact O-CG 3.31Å; T16-L20 WeakPolarHBondContact O-CG 3.29Å; T16-L20 PolarHBondContact O-N 3.04Å
17T54.8Low66.8Low80 Ų80113 Ų11349%0.49163%0.628SS.*Hα-helixtrans-69-45.3169.952.90000111.1L20 E21T17-L20 PolarHBondContact O-N 2.56Å; T17-E21 PolarHBondContact O-N 3.47Å
18D70.5Confident68.7Low103 Ų103106.3 Ų106.355%0.55161%0.607SS**Hα-helixtrans-62.7-49.3-178.8-168.227.1000111G14 L20 E21 E22G14-D18 WeakPolarHBondContact O-CB 3.11Å; D18-L20 VanDerWaalsContact C-N 3.3Å; D18-L20 PolarHBondContact O-N 3.38Å; D18-E21 CarbonylContact O-C 3.57Å; D18-E21 WeakPolarHBondContact O-CA 3.36Å; D18-E21 PolarHBondContact O-N 2.81Å; D18-E22 WeakPolarHBondContact O-CB 3.5Å; D18-E22 PolarHBondContact O-N 3.44Å
19F76.8Confident70.8Confident126 Ų126107.3 Ų107.355%0.55360%0.6SS**Hα-helixtrans-58-38.3174.1179.3-100.7000113.4S15 E21 W23S15-F19 WeakPolarHBondContact O-CB 3.26Å; S15-F19 PolarHBondContact O-N 3.49Å; F19-E21 VanDerWaalsContact C-N 3.35Å; F19-W23 WeakPolarHBondContact O-CB 3.35Å; F19-W23 PolarHBondContact O-N 2.8Å
20L85.6Confident72.9Confident97 Ų97108.1 Ų108.151%0.50859%0.593SS.*Hα-helixtrans-70.3-31.9176.2-74.7172.2000112.2T16 T17 D18 K24T16-L20 WeakPolarHBondContact O-CD1 3.24Å; T16-L20 VanDerWaalsContact O-CG 3.31Å; T16-L20 WeakPolarHBondContact O-CG 3.29Å; T16-L20 PolarHBondContact O-N 3.04Å; T17-L20 PolarHBondContact O-N 2.56Å; D18-L20 VanDerWaalsContact C-N 3.3Å; D18-L20 PolarHBondContact O-N 3.38Å; L20-K24 VanDerWaalsContact C-CE 3.5Å; L20-K24 WeakPolarHBondContact O-CB 3.3Å; L20-K24 WeakPolarHBondContact O-CE 3.43Å; L20-K24 VanDerWaalsContact O-CG 3.26Å; L20-K24 WeakPolarHBondContact O-CG 3.39Å; L20-K24 PolarHBondContact O-N 3.18Å
21E86.2Confident74.4Confident116 Ų116108.4 Ų108.454%0.54257%0.574SS.*Hα-helixtrans-76.1-41.7175.1-76.2177.8-179.300112.4T17 D18 F19 W23 K24 A25T17-E21 PolarHBondContact O-N 3.47Å; D18-E21 CarbonylContact O-C 3.57Å; D18-E21 WeakPolarHBondContact O-CA 3.36Å; D18-E21 PolarHBondContact O-N 2.81Å; F19-E21 VanDerWaalsContact C-N 3.35Å; E21-W23 PolarHBondContact O-N 3.01Å; E21-K24 VanDerWaalsContact CG-NZ 3.32Å; E21-K24 PolarHBondContact O-N 3.26Å; E21-K24 IonicContact OE1-NZ 3.72Å; E21-A25 VanDerWaalsContact O-CB 3.28Å; E21-A25 WeakPolarHBondContact O-CB 3.34Å; E21-A25 PolarHBondContact O-N 2.95Å
22E88Confident75.6Confident113 Ų113107.8 Ų107.853%0.52856%0.564SS.*Hα-helixtrans-59.4-45.5169.5-162.1-151152.200110.9D18 A25 K26D18-E22 WeakPolarHBondContact O-CB 3.5Å; D18-E22 PolarHBondContact O-N 3.44Å; E22-A25 CarbonylContact O-C 3.59Å; E22-A25 PolarHBondContact O-N 3.11Å; E22-K26 VanDerWaalsContact O-CB 3.25Å; E22-K26 WeakPolarHBondContact O-CB 3.34Å; E22-K26 PolarHBondContact O-N 3.13Å
23W88.5Confident76.8Confident121 Ų121107 Ų10746%0.45855%0.552SS.*Hα-helixtrans-68-39.3179.3-172.490.3000112.6F19 E21 K26 R27F19-W23 WeakPolarHBondContact O-CB 3.35Å; F19-W23 PolarHBondContact O-N 2.8Å; E21-W23 PolarHBondContact O-N 3.01Å; W23-K26 PolarHBondContact O-N 2.81Å; W23-R27 VanDerWaalsContact CH2-CZ 3.47Å; W23-R27 WeakPolarHBondContact O-CB 3.45Å; W23-R27 PolarHBondContact O-N 2.96Å
24K92.9Very high78Confident108 Ų108112.3 Ų112.347%0.4756%0.563SS.*Hα-helixtrans-59.2-48.9169-82174.7-74.6165.70110.5L20 E21 K26 R27 E28L20-K24 VanDerWaalsContact C-CE 3.5Å; L20-K24 WeakPolarHBondContact O-CB 3.3Å; L20-K24 WeakPolarHBondContact O-CE 3.43Å; L20-K24 VanDerWaalsContact O-CG 3.26Å; L20-K24 WeakPolarHBondContact O-CG 3.39Å; L20-K24 PolarHBondContact O-N 3.18Å; E21-K24 VanDerWaalsContact CG-NZ 3.32Å; E21-K24 PolarHBondContact O-N 3.26Å; E21-K24 IonicContact OE1-NZ 3.72Å; K24-K26 VanDerWaalsContact C-N 3.34Å; K24-K26 PolarHBondContact O-N 3.01Å; K24-R27 WeakPolarHBondContact O-CB 3.46Å; K24-R27 PolarHBondContact O-N 3.24Å; K24-E28 WeakPolarHBondContact O-CB 3.47Å; K24-E28 PolarHBondContact O-N 2.89Å
25A90.1Very high78.4Confident59 Ų59115.3 Ų115.349%0.48857%0.565SS.*Hα-helixtrans-63.8-35.4178.400000112.8E21 E22 E28 K29E21-A25 VanDerWaalsContact O-CB 3.28Å; E21-A25 WeakPolarHBondContact O-CB 3.34Å; E21-A25 PolarHBondContact O-N 2.95Å; E22-A25 CarbonylContact O-C 3.59Å; E22-A25 PolarHBondContact O-N 3.11Å; A25-E28 PolarHBondContact O-N 3.16Å; A25-K29 WeakPolarHBondContact O-CB 3.22Å; A25-K29 PolarHBondContact O-N 3.06Å
26K90.5Very high78.9Confident133 Ų133115.4 Ų115.458%0.57856%0.563SS**Hα-helixtrans-68.1-41.6176-168169.4-174.3169.40111.4E22 W23 K24 M30E22-K26 VanDerWaalsContact O-CB 3.25Å; E22-K26 WeakPolarHBondContact O-CB 3.34Å; E22-K26 PolarHBondContact O-N 3.13Å; W23-K26 PolarHBondContact O-N 2.81Å; K24-K26 VanDerWaalsContact C-N 3.34Å; K24-K26 PolarHBondContact O-N 3.01Å; K26-M30 WeakPolarHBondContact O-CG 3.38Å; K26-M30 PolarHBondContact O-N 3.36Å
27R88.9Confident79.3Confident136 Ų136115.8 Ų115.851%0.51357%0.568SS.*Hα-helixtrans-62.4-46170172.2-176.7-80.1-172.2-11.8111.6W23 K24 M30 R31W23-R27 VanDerWaalsContact CH2-CZ 3.47Å; W23-R27 WeakPolarHBondContact O-CB 3.45Å; W23-R27 PolarHBondContact O-N 2.96Å; K24-R27 WeakPolarHBondContact O-CB 3.46Å; K24-R27 PolarHBondContact O-N 3.24Å; R27-M30 PolarHBondContact O-N 3.07Å; R27-R31 PolarHBondContact O-N 2.87Å
28E88.5Confident79.2Confident101 Ų101114.5 Ų114.547%0.47257%0.57SS.*Hα-helixtrans-66-39.7-179.4-150.560.9-156.100111.5K24 A25 M30 R31 A32K24-E28 WeakPolarHBondContact O-CB 3.47Å; K24-E28 PolarHBondContact O-N 2.89Å; A25-E28 PolarHBondContact O-N 3.16Å; E28-M30 PolarHBondContact O-N 3.05Å; E28-R31 WeakPolarHBondContact O-CB 3.32Å; E28-R31 PolarHBondContact O-N 2.91Å; E28-R31 IonicContact OE1-NH1 3.61Å; E28-R31 IonicContact OE2-NH1 2.65Å; E28-R31 PolarHBondContact OE2-NH1 3.31Å; E28-A32 WeakPolarHBondContact O-CB 3.41Å; E28-A32 PolarHBondContact O-N 2.84Å
29K88.6Confident77.9Confident158 Ų158116.3 Ų116.369%0.68759%0.587SS**Hα-helixtrans-63.9-35.8173.1-175.7174.9-176.8175.80112.7A25 K33A25-K29 WeakPolarHBondContact O-CB 3.22Å; A25-K29 PolarHBondContact O-N 3.06Å; K29-K33 VanDerWaalsContact O-CB 3.25Å; K29-K33 WeakPolarHBondContact O-CB 3.49Å; K29-K33 PolarHBondContact O-N 3.21Å
30M85.7Confident76.2Confident127 Ų127114.9 Ų114.963%0.62660%0.599SS**Hα-helixtrans-68.5-43.7171.7-73-62.6-67.900111.4K26 R27 E28 A32 K33 Q34K26-M30 WeakPolarHBondContact O-CG 3.38Å; K26-M30 PolarHBondContact O-N 3.36Å; R27-M30 PolarHBondContact O-N 3.07Å; E28-M30 PolarHBondContact O-N 3.05Å; M30-A32 PolarHBondContact O-N 3.4Å; M30-K33 PolarHBondContact O-N 3.47Å; M30-K33 VanDerWaalsContact O-N 3.12Å; M30-Q34 WeakPolarHBondContact O-CB 3.17Å; M30-Q34 PolarHBondContact O-N 3.17Å
31R84Confident74Confident134 Ų134114.9 Ų114.951%0.50661%0.613SS.*Hα-helixtrans-58.7-46.6173.6177.9178.7-71126.7-3.8111.8R27 E28 K33 Q34 N35R27-R31 PolarHBondContact O-N 2.87Å; E28-R31 WeakPolarHBondContact O-CB 3.32Å; E28-R31 PolarHBondContact O-N 2.91Å; E28-R31 IonicContact OE1-NH1 3.61Å; E28-R31 IonicContact OE2-NH1 2.65Å; E28-R31 PolarHBondContact OE2-NH1 3.31Å; R31-K33 PolarHBondContact O-N 2.88Å; R31-Q34 PolarHBondContact O-N 3.29Å; R31-N35 PolarHBondContact O-N 2.87Å
32A73.6Confident71.7Confident51 Ų51114 Ų11442%0.42163%0.626SS.*Hα-helixtrans-71.6-12.3177.600000114.1E28 M30 N35 P36E28-A32 WeakPolarHBondContact O-CB 3.41Å; E28-A32 PolarHBondContact O-N 2.84Å; M30-A32 PolarHBondContact O-N 3.4Å; A32-N35 CarbonylContact C-O 3.55Å; A32-N35 WeakPolarHBondContact CA-O 3.15Å; A32-P36 VanDerWaalsContact O-CA 3.29Å; A32-P36 WeakPolarHBondContact O-CA 3.38Å
33K73Confident69.2Low174 Ų174112.5 Ų112.576%0.75764%0.641SS**Hα-helixtrans-95.1-21.1171.8-165.9174.8-179.1-172.50112.3K29 M30 R31K29-K33 VanDerWaalsContact O-CB 3.25Å; K29-K33 WeakPolarHBondContact O-CB 3.49Å; K29-K33 PolarHBondContact O-N 3.21Å; M30-K33 PolarHBondContact O-N 3.47Å; M30-K33 VanDerWaalsContact O-N 3.12Å; R31-K33 PolarHBondContact O-N 2.88Å
34Q72.2Confident66.5Low164 Ų164110.7 Ų110.777%0.76666%0.659SS**Hα-helixtrans-85-44172.5-169.7168.623.200111.4M30 R31M30-Q34 WeakPolarHBondContact O-CB 3.17Å; M30-Q34 PolarHBondContact O-N 3.17Å; R31-Q34 PolarHBondContact O-N 3.29Å
35N60Low63.5Low123 Ų123109.2 Ų109.266%0.65868%0.675SS**SBendtrans-11589.3167.6-73.66.1000108.5R31 A32R31-N35 PolarHBondContact O-N 2.87Å; A32-N35 CarbonylContact C-O 3.55Å; A32-N35 WeakPolarHBondContact CA-O 3.15Å
36P67Low60.8Low95 Ų95111.9 Ų111.962%0.61769%0.69SS**PPolyproline II helixtrans-60.3134.1170.326.3-33.6000109.5A32 G38A32-P36 VanDerWaalsContact O-CA 3.29Å; A32-P36 WeakPolarHBondContact O-CA 3.38Å; P36-G38 PolarHBondContact O-N 3.31Å; P36-G38 VanDerWaalsContact O-N 3.13Å
37P60.6Low58.1Low113 Ų113111.1 Ų111.173%0.73470%0.701SS**PPolyproline II helixtrans-61.8120.4173.625.5-32.4000108.8
38G51.8Low55.5Low53 Ų53112.7 Ų112.755%0.54672%0.72SS.*PPolyproline II helixtrans-56.2158.8168.500000110.8P36 A40P36-G38 PolarHBondContact O-N 3.31Å; P36-G38 VanDerWaalsContact O-N 3.13Å; G38-A40 PolarHBondContact O-N 3.02Å
39P43.8Very low52.9Low140 Ų140112.7 Ų112.791%0.90974%0.737SS**  trans-60.498.1-17124.7-34.6000111.5A41P39-A41 PolarHBondContact O-N 2.81Å; P39-A41 VanDerWaalsContact O-N 3.11Å
40A41.2Very low50.7Low97 Ų97110.7 Ų110.780%0.80275%0.75SS**  trans-67.9109.4179.600000109.4G38 A42G38-A40 PolarHBondContact O-N 3.02Å; A40-A42 PolarHBondContact O-N 3.01Å
41A39.7Very low48.2Very low97 Ų97108.4 Ų108.480%0.80276%0.759SS**PPolyproline II helixtrans-57.7135.9171.300000109.7P39 G43P39-A41 PolarHBondContact O-N 2.81Å; P39-A41 VanDerWaalsContact O-N 3.11Å; A41-G43 PolarHBondContact O-N 3.36Å
42A37.3Very low45.9Very low98 Ų98112 Ų11281%0.8178%0.778SS**PPolyproline II helixtrans-63.6120.2-176.400000111A40 G44A40-A42 PolarHBondContact O-N 3.01Å; A42-G44 PolarHBondContact O-N 3.27Å
43G34.7Very low44.9Very low81 Ų81114.8 Ų114.884%0.83579%0.792SS**PPolyproline II helixtrans-60.3123.4173.500000110.8A41A41-G43 PolarHBondContact O-N 3.36Å
44G31.9Very low44Very low82 Ų82112.2 Ų112.285%0.84579%0.793SS**PPolyproline II helixtrans-77.6151.4-167.100000115.4A42A42-G44 PolarHBondContact O-N 3.27Å
45G29.8Very low41.9Very low77 Ų77109.5 Ų109.579%0.79480%0.799SS**  trans-120.1112.5169.800000111.5
46S33.9Very low40.5Very low116 Ų116107.2 Ų107.281%0.81181%0.805SS**  trans-5.3122.3172.1-169.10000120
47S33.8Very low38.9Very low117 Ų117107.7 Ų107.782%0.81882%0.817SS**  trans-170.9145130.127.40000112
48D34.7Very low37.6Very low169 Ų169110.8 Ų110.890%0.90483%0.826SS**  trans-81.4133.7-177.6-72.7-76.5000114
49A34.3Very low36.7Very low101 Ų101111.8 Ų111.884%0.83584%0.836SS**  trans-155.3130153.400000111.9
50A40.9Very low36.2Very low116 Ų116112.1 Ų112.196%0.95984%0.835SS**  trans-56.5138.3-169.200000117.5
51G33.2Very low35.8Very low79 Ų79113.5 Ų113.581%0.81484%0.839SS**  trans-176.3140163.700000111.8
52K36.6Very low35.6Very low209 Ų209113.1 Ų113.191%0.90984%0.836SS**  trans-121.8143.9179.8-160.5158.5-175.5170.60110.5
53P52.8Low35.4Very low109 Ų109113.1 Ų113.171%0.70884%0.836SS**  trans-93.4-165.2-160.245.4-40.9000110.5
54P52.9Low35.3Very low121 Ų121114.2 Ų114.279%0.78684%0.837SS**  cis-151.7-175.230.845.2-22.5000121
55A29.7Very low35.4Very low106 Ų106115.3 Ų115.388%0.87684%0.839SS**  trans89.6130.414800000119.4
56G30.6Very low35.6Very low76 Ų76116.3 Ų116.378%0.78484%0.839SS**  trans159.2109.7166.300000116
57A33Very low35.7Very low105 Ų105118.1 Ų118.187%0.86884%0.84SS**  trans44.1108.314900000121.2
58L33Very low35.8Very low178 Ų178121.4 Ų121.493%0.93284%0.842SS**  trans-37.7144.7149.4-67.8150.7000114.1
59G32.5Very low36Very low73 Ų73122.2 Ų122.275%0.75385%0.846SS**  trans-94.8157.117200000113.2
60T32.8Very low36.1Very low147 Ų147124.2 Ų124.290%0.90284%0.842SS**  trans-90.9121.8174.153.30000111.6
61S34.3Very low35.9Very low126 Ų126125.3 Ų125.388%0.88183%0.832SS**  trans-119.8125.1169.5-72.50000110.2
62A34Very low36.1Very low90 Ų90127.9 Ų127.974%0.74483%0.827SS**  trans-113114.8174.800000110.1
63A33.5Very low36Very low97 Ų97125.9 Ų125.980%0.80283%0.825SS**  trans-132.5105.1163.300000106.7
64A33.1Very low35.5Very low104 Ų104126.3 Ų126.386%0.8683%0.828SS**  72.587.47700000111.4
65A33.3Very low34.7Very low106 Ų106124.7 Ų124.788%0.87683%0.834SS**  trans-71.4144.3-17600000113.6
66A35Very low34.8Very low97 Ų97123.2 Ų123.280%0.80283%0.828SS**  trans-114.1115.1152.100000106.2
67N35.6Very low35.4Very low155 Ų155124.5 Ų124.583%0.82983%0.832SS**  93.572.865.1-173.677.9000111.7
68E35.5Very low35.8Very low185 Ų185125.4 Ų125.486%0.86483%0.829SS**  trans-129.6129.8158.2-71.5-155.5149.800110.1
69L38.8Very low35.9Very low187 Ų187121.6 Ų121.698%0.97982%0.823SS**  trans-141.4105.8163.2-79.6-179.9000109.1
70N37.7Very low36.4Very low142 Ų142122.6 Ų122.676%0.75982%0.824SS**  trans-125118.9166.9173.610.4000108
71N36.8Very low36.6Very low139 Ų139121.3 Ų121.374%0.74382%0.818SS**  trans-157.7108.7162.4-110.3-51.4000113.9
72N36Very low36.7Very low134 Ų134120 Ų12072%0.71782%0.815SS**  trans28.5107.7136.9-59.1-73.7000118.9
73L35.7Very low36.9Very low166 Ų166122.3 Ų122.387%0.86982%0.82SS**PPolyproline II helixtrans-83.3133.6164.6-7872.2000111.7
74P41.2Very low37.2Very low119 Ų119123.5 Ų123.577%0.77382%0.819SS**PPolyproline II helixtrans-83.4144.1141.634-29.1000110
75G37.1Very low37.3Very low87 Ų87122 Ų12290%0.89781%0.814SS**PPolyproline II helixtrans-74137.3-174.800000114.5
76G31.8Very low37.9Very low74 Ų74123.2 Ų123.276%0.76381%0.813SS**  trans-164.5112.217000000110.7
77A43.1Very low37.8Very low103 Ų103122.4 Ų122.485%0.85181%0.814SS**PPolyproline II helixtrans-87.4129.1-177.800000111.4
78P41.5Very low37.7Very low125 Ų125118.3 Ų118.381%0.81281%0.809SS**PPolyproline II helixtrans-81139.6167.132.5-31.5000110.7
79A35.2Very low37.7Very low98 Ų98115.7 Ų115.781%0.8181%0.805SS**PPolyproline II helixtrans-76.4152.7172.200000111.3
80A43.2Very low37.4Very low94 Ų94113.5 Ų113.578%0.77779%0.794SS**PPolyproline II helixtrans-68.9138.217700000111.9
81P37.2Very low36.9Very low120 Ų120112.6 Ų112.678%0.77980%0.798SS**PPolyproline II helixtrans-73.7131.1169.330.8-32.7000110.2
82A34.5Very low36.8Very low99 Ų99110.4 Ų110.482%0.81880%0.798SS**PPolyproline II helixtrans-78.1132.4176.200000111.2
83V38.2Very low36.6Very low138 Ų138111.3 Ų111.384%0.83681%0.809SS**PPolyproline II helixtrans-90.9124.9172.2-177.80000109.3
84P41.4Very low36.2Very low122 Ų122106.5 Ų106.579%0.79280%0.799SS**PPolyproline II helixtrans-77.7124.3173.531.1-32.4000110.5
85G35.6Very low35.8Very low73 Ų73106.7 Ų106.775%0.75380%0.803SS**PPolyproline II helixtrans-99.4152.5176.400000113.7
86P45.1Very low35.6Very low131 Ų131107.1 Ų107.185%0.85180%0.798SS**  trans-107.1163.1143.736.2-28.8000110.4
87G32.2Very low35.7Very low79 Ų79111.5 Ų111.581%0.81480%0.801SS**  cis163.220.90.300000115.6
88G33.5Very low35.1Very low70 Ų70113.5 Ų113.572%0.72280%0.796SS**  trans78.6174.3-178.200000114.7
89V35Very low34.7Very low129 Ų129114.8 Ų114.878%0.78280%0.802SS**  cis-157.8174-5.1-830000109.9
90N33.2Very low34.5Very low142 Ų142121.9 Ų121.976%0.75981%0.808SS**  trans88.284.7156.5-58.2-21.8000121.8
91C27.8Very low33.8Very low123 Ų123122.4 Ų122.483%0.83181%0.812SS**  46.2109.1111.7-56.20000123.7
92A33.8Very low33.6Very low92 Ų92121.2 Ų121.276%0.7681%0.812SS**  83.6160.9116.800000123.3
93V31.7Very low34.2Very low154 Ų154122.4 Ų122.493%0.93381%0.812SS**  trans74.7131.8177.9-165.10000115.6
94G28.8Very low33.8Very low64 Ų64119.3 Ų119.366%0.6681%0.808SS**  cis167.8146.8-12.400000115.7
95S32.8Very low34Very low124 Ų124118.9 Ų118.987%0.86781%0.805SS**  trans69.5112.8155.4-62.20000123.7
96A31.7Very low33.8Very low95 Ų95126.3 Ų126.379%0.78581%0.81SS**  trans70.2162.8130.600000119.9
97M33.5Very low33.2Very low167 Ų167130.2 Ų130.282%0.82381%0.808SS**  cis-142.1153.38.1-104.3-155.3171.400114.5
98L31.7Very low33.1Very low145 Ų145130.2 Ų130.276%0.75980%0.796SS**  trans10.5137.7144.8-59.6168.7000121.8
99T31.9Very low33.1Very low152 Ų152134.6 Ų134.693%0.93380%0.797SS**  -145.3161.7127.216.30000110.6
100R31.6Very low32.8Very low247 Ų247135.9 Ų135.993%0.93280%0.8SS**  trans-144.5133.2-167.3158.7-174.8165-178.2-3.5110.7
101A29.5Very low32.7Very low104 Ų104137.2 Ų137.286%0.8680%0.801SS**  trans-151.9133.5170.400000113.5
102A33.1Very low33.8Very low95 Ų95136 Ų13679%0.78579%0.792SS**  trans-174.4170.5172.900000107.3
103P46Very low34.7Very low124 Ų124137.1 Ų137.181%0.80579%0.792SS**  cis-143.9162.58.941.4-22.3000119.2
104G29.7Very low34.7Very low73 Ų73134.6 Ų134.675%0.75379%0.787SS**  trans69.8-170.4146.200000119.8
105P46Very low34.8Very low114 Ų114136.6 Ų136.674%0.7480%0.797SS**  cis-142-179.2-13.637.8-18000116.7
106R31.9Very low34.8Very low228 Ų228136.5 Ų136.586%0.8680%0.797SS**  trans84146.7165.4-51.9176.4-169.7-138.11.2117.2
107R32.3Very low34.8Very low214 Ų214136.9 Ų136.981%0.80880%0.799SS**  cis-163.9149.5-16.6-125.5-169.2-179.1-175.6-1.7110.5
108S30Very low34.8Very low79 Ų79134.8 Ų134.855%0.55280%0.801SS**  trans21.8160.9141.252.70000122.2
109E32.6Very low34.8Very low162 Ų162132.5 Ų132.576%0.75780%0.804SS**  cis-149.7165.524.7-90.8106.8-108.100107.6
110D29.7Very low34.8Very low156 Ų156129.7 Ų129.783%0.83480%0.796SS**  cis-162.8-169.9-14.1-135.3-73.1000111.7
111E29.8Very low35.4Very low169 Ų169123.7 Ų123.779%0.7979%0.788SS**  trans-126.3-165.5-178.2-131.5-171.468.300111.4
112P51.8Low36.4Very low99 Ų99124.2 Ų124.264%0.64378%0.783SS**  cis-129.9-139.8-34.642-22.3000110.8
113P53.2Low36.9Very low115 Ų115125.7 Ų125.775%0.74779%0.785SS**  cis-135.3-173.6-2236.6-16.3000116.8
114A30.4Very low36.5Very low101 Ų101131.4 Ų131.484%0.83579%0.791SS**  trans96.314215300000118.2
115A32.3Very low36.6Very low106 Ų106138.4 Ų138.488%0.87679%0.794SS**  cis-1451762.300000112.6
116S32Very low35.9Very low122 Ų122138.8 Ų138.885%0.85379%0.79SS**  trans-120.6147.4-175.9178.30000113.4
117A31.6Very low36.3Very low102 Ų102136.5 Ų136.584%0.84379%0.789SS**  trans-159.4166165.300000110.9
118S33.4Very low36.6Very low123 Ų123134.9 Ų134.986%0.8679%0.79SS**  trans-151.1173.4-166.8-169.30000114.4
119A31.4Very low36.9Very low98 Ų98138.3 Ų138.381%0.8180%0.798SS**  trans86.3148.6161.100000121.4
120A32.9Very low37.1Very low93 Ų93138 Ų13877%0.76980%0.797SS**  trans-123.4-169.6165.900000107.1
121P43.5Very low37.7Very low120 Ų120138.7 Ų138.778%0.77980%0.8SS**  cis-135.5-165.411.345.7-25.5000113.8
122P50.6Low37.8Very low116 Ų116133.2 Ų133.275%0.75379%0.789SS**  trans-109.5171-170.941-33.7000116.2
123P43.6Very low37.2Very low126 Ų126135.2 Ų135.282%0.81880%0.799SS**  trans-94.3169.9170.637.4-34.1000114.5
124R37.5Very low37.5Very low244 Ų244135.3 Ų135.392%0.92180%0.799SS**  trans-129.4172.6174.2-50.5-177.5-171.7-159.82.7110.8
125R32.3Very low38.2Very low220 Ų220137.6 Ų137.683%0.8379%0.793SS**  trans138.9153161.1-81.5-170.4177-105.98.5109.8
126D31.7Very low38.6Very low121 Ų121140 Ų14065%0.64778%0.783SS**  cis-156.6-179.1-19.2-92.4-19.4000107.4
127E40.2Very low38.9Very low180 Ų180137.9 Ų137.984%0.84178%0.781SS**  trans-103.7-168.3-169.9-53.9-169.3107.300114.8
128E39.1Very low39.8Very low180 Ų180141.6 Ų141.684%0.84178%0.778SS**  trans74.5150.8165.2-67.7174.3172.900118.4
129E35.8Very low40.7Very low151 Ų151141.3 Ų141.371%0.70678%0.776SS**  cis-158.1-179.1-17.6-179163.4-17700111.4
130Q37.2Very low41.3Very low157 Ų157142.5 Ų142.573%0.73478%0.779SS**  trans-53.3148.4-171.1-61.9173.787.300122.7
131D40.7Very low41.9Very low170 Ų170140.1 Ų140.191%0.90976%0.763SS**  54.6153125.6-157.332.8000124.8
132G31.7Very low42.3Very low53 Ų53141 Ų14155%0.54677%0.769SS.*  trans150.2148.817100000112.9
133V39.6Very low42.4Very low142 Ų142140.9 Ų140.986%0.86177%0.771SS**  cis-153.1147.53.4173.20000109.1
134P60Low42.7Very low116 Ų116138.9 Ų138.975%0.75377%0.765SS**  trans-103.4169.1-175.940.1-37.1000115.8
135E44.4Very low43.7Very low150 Ų150137.2 Ų137.270%0.70176%0.758SS**  trans-174.8168.2166.8-105.7-69.16000109.1
136K41.7Very low44.9Very low156 Ų156136.7 Ų136.768%0.67876%0.762SS**  cis-154.8108.6-6.7-170.9174.6-154.4103.20110.5
137G38.4Very low46.3Very low78 Ų78132.6 Ų132.680%0.80475%0.749SS**  trans-135.912.5-156.300000121.9
138K50.1Low47.2Very low179 Ų179130.6 Ų130.678%0.77874%0.737SS**  trans28.692.8161.7-59.5177.3-176.2175.90120
139S52.9Low48.5Very low118 Ų118124 Ų12483%0.82572%0.718SS**  trans35.4122.8133.5610000122.8
140S42.6Very low50.1Low123 Ų123123.9 Ų123.986%0.8672%0.717SS**  -174.5151.9118.7-167.80000113.1
141G45.7Very low51.5Low42 Ų42120.9 Ų120.943%0.43371%0.705SS.*  trans89.5107.6156.100000119.1S143G141-S143 PolarHBondContact O-N 3.29Å
142P52.2Low53.1Low140 Ų140118 Ų11891%0.90969%0.686SS**G310 helixtrans-63-21.6170.3-23.134.5000114.7A144P142-A144 VanDerWaalsContact C-N 3.35Å; P142-A144 PolarHBondContact O-N 3.32Å
143S53.3Low55.4Low113 Ų113122.8 Ų122.879%0.7969%0.692SS**G310 helixtrans-83.3-3.3-174.3-1490000114.6G141 R145G141-S143 PolarHBondContact O-N 3.29Å; S143-R145 VanDerWaalsContact C-N 3.33Å; S143-R145 PolarHBondContact O-N 2.84Å
144A49.8Very low57Low84 Ų84123.6 Ų123.669%0.69468%0.68SS**G310 helixtrans-81.1-1.5-175.200000115.2P142P142-A144 VanDerWaalsContact C-N 3.35Å; P142-A144 PolarHBondContact O-N 3.32Å
145R57.3Low57.9Low208 Ų208124.5 Ų124.579%0.78567%0.672SS**G310 helixtrans-119.76.5-168.4-62-169.4-178.9-147.71.2116.1S143 G147 K148S143-R145 VanDerWaalsContact C-N 3.33Å; S143-R145 PolarHBondContact O-N 2.84Å; R145-G147 PolarHBondContact O-N 2.85Å; R145-K148 PolarHBondContact O-N 2.71Å
146K59.2Low59.1Low209 Ų209122.2 Ų122.291%0.90966%0.664SS**THydrogen-bonded Turntrans-75.953.9-179.7-160.1177.8179.8179.70113.2
147G60.2Low60.6Low35 Ų35122.3 Ų122.336%0.36166%0.66SS.*THydrogen-bonded Turntrans-172.5-41.2177.900000112.4R145 G149 Q150 I151R145-G147 PolarHBondContact O-N 2.85Å; G147-G149 PolarHBondContact O-N 3.06Å; G147-Q150 PolarHBondContact O-N 3.46Å; G147-I151 PolarHBondContact O-N 3.01Å
148K59.3Low61.9Low138 Ų138123.8 Ų123.860%0.665%0.646SS**Hα-helixtrans-60.6-46.7-177.9-159.6167.6-176.2175.40112.3R145 Q150 I151 E152R145-K148 PolarHBondContact O-N 2.71Å; K148-Q150 VanDerWaalsContact C-N 3.28Å; K148-Q150 PolarHBondContact O-N 3.09Å; K148-I151 WeakPolarHBondContact O-CG2 3.38Å; K148-I151 PolarHBondContact O-N 3.47Å; K148-E152 WeakPolarHBondContact O-CB 3.35Å; K148-E152 WeakPolarHBondContact O-CG 3.43Å; K148-E152 PolarHBondContact O-N 2.8Å
149G66.6Low63.2Low43 Ų43124.2 Ų124.244%0.44365%0.648SS.*Hα-helixtrans-64.9-26.2174.700000114.6G147 K153G147-G149 PolarHBondContact O-N 3.06Å; G149-K153 WeakPolarHBondContact O-CB 3.18Å; G149-K153 PolarHBondContact O-N 3.39Å
150Q68.9Low64.5Low147 Ų147128.5 Ų128.569%0.68765%0.646SS**Hα-helixtrans-81-35.5176.8-165.3176.312.700111.7G147 K148 K153 R154G147-Q150 PolarHBondContact O-N 3.46Å; K148-Q150 VanDerWaalsContact C-N 3.28Å; K148-Q150 PolarHBondContact O-N 3.09Å; Q150-K153 PolarHBondContact O-N 3.46Å; Q150-R154 WeakPolarHBondContact O-CB 3.23Å; Q150-R154 PolarHBondContact O-N 2.96Å
151I65.8Low66Low94 Ų94130.5 Ų130.548%0.48264%0.635SS.*Hα-helixtrans-76.4-31.1174.4-145.3166.9000111.7G147 K148 R154 K155G147-I151 PolarHBondContact O-N 3.01Å; K148-I151 WeakPolarHBondContact O-CG2 3.38Å; K148-I151 PolarHBondContact O-N 3.47Å; I151-R154 PolarHBondContact O-N 3.12Å; I151-K155 WeakPolarHBondContact O-CB 3.36Å; I151-K155 WeakPolarHBondContact O-CG 3.26Å; I151-K155 PolarHBondContact O-N 2.82Å
152E75.4Confident66.6Low109 Ų109134.3 Ų134.351%0.50966%0.655SS.*Hα-helixtrans-66.3-43.4167-75.8166.7159.700111.1K148 R154 K155 L156K148-E152 WeakPolarHBondContact O-CB 3.35Å; K148-E152 WeakPolarHBondContact O-CG 3.43Å; K148-E152 PolarHBondContact O-N 2.8Å; E152-R154 VanDerWaalsContact C-N 3.31Å; E152-R154 PolarHBondContact O-N 3.08Å; E152-K155 CarbonylContact O-C 3.53Å; E152-K155 PolarHBondContact O-N 3.2Å; E152-L156 VanDerWaalsContact O-CB 3.24Å; E152-L156 WeakPolarHBondContact O-CB 3.18Å; E152-L156 PolarHBondContact O-N 2.75Å
153K79.6Confident66.9Low155 Ų155132.3 Ų132.367%0.67464%0.64SS**Hα-helixtrans-68.3-28.3174.9-167.2170.3-174.41740112.8G149 Q150 R157G149-K153 WeakPolarHBondContact O-CB 3.18Å; G149-K153 PolarHBondContact O-N 3.39Å; Q150-K153 PolarHBondContact O-N 3.46Å; K153-R157 PolarHBondContact O-N 2.9Å; K153-R157 VanDerWaalsContact O-N 3.09Å
154R73.2Confident67.5Low158 Ų158130 Ų13060%0.59663%0.634SS**Hα-helixtrans-66.7-58.3167.1-172.8-178.9-67.6175.8-1.7109.9Q150 I151 E152 L156 R157 E158Q150-R154 WeakPolarHBondContact O-CB 3.23Å; Q150-R154 PolarHBondContact O-N 2.96Å; I151-R154 PolarHBondContact O-N 3.12Å; E152-R154 VanDerWaalsContact C-N 3.31Å; E152-R154 PolarHBondContact O-N 3.08Å; R154-L156 PolarHBondContact O-N 3.01Å; R154-L156 VanDerWaalsContact O-N 3.14Å; R154-R157 CarbonylContact O-C 3.58Å; R154-R157 WeakPolarHBondContact O-CA 3.36Å; R154-R157 WeakPolarHBondContact O-CB 3.44Å; R154-R157 PolarHBondContact O-N 3.03Å; R154-E158 VanDerWaalsContact O-CB 3.27Å; R154-E158 WeakPolarHBondContact O-CB 3.23Å; R154-E158 PolarHBondContact O-N 2.87Å
155K78.4Confident67.9Low136 Ų136132.3 Ų132.359%0.59164%0.639SS**Hα-helixtrans-55.9-31177-78-171.2172.1-169.60113.7I151 E152 E158 K159I151-K155 WeakPolarHBondContact O-CB 3.36Å; I151-K155 WeakPolarHBondContact O-CG 3.26Å; I151-K155 PolarHBondContact O-N 2.82Å; E152-K155 CarbonylContact O-C 3.53Å; E152-K155 PolarHBondContact O-N 3.2Å; K155-E158 PolarHBondContact O-N 3.29Å; K155-K159 WeakPolarHBondContact O-CB 3.46Å; K155-K159 WeakPolarHBondContact O-CG 3.47Å; K155-K159 PolarHBondContact O-N 3.42Å
156L70.8Confident67.7Low101 Ų101127.1 Ų127.153%0.52963%0.63SS.*Hα-helixtrans-77.8-34.4174.9-172.266.1000112.2E152 R154 E158 R160E152-L156 VanDerWaalsContact O-CB 3.24Å; E152-L156 WeakPolarHBondContact O-CB 3.18Å; E152-L156 PolarHBondContact O-N 2.75Å; R154-L156 PolarHBondContact O-N 3.01Å; R154-L156 VanDerWaalsContact O-N 3.14Å; L156-E158 VanDerWaalsContact C-N 3.28Å; L156-R160 VanDerWaalsContact O-CB 3.24Å; L156-R160 WeakPolarHBondContact O-CB 3.44Å; L156-R160 VanDerWaalsContact O-CG 3.24Å; L156-R160 WeakPolarHBondContact O-CG 3.33Å; L156-R160 PolarHBondContact O-N 3.04Å
157R72.8Confident67.6Low158 Ų158124.1 Ų124.160%0.59662%0.624SS**Hα-helixtrans-66.5-31.9166.7-95.5-170.8165.8-160.8-3.3112.1K153 R154 R160 R161K153-R157 PolarHBondContact O-N 2.9Å; K153-R157 VanDerWaalsContact O-N 3.09Å; R154-R157 CarbonylContact O-C 3.58Å; R154-R157 WeakPolarHBondContact O-CA 3.36Å; R154-R157 WeakPolarHBondContact O-CB 3.44Å; R154-R157 PolarHBondContact O-N 3.03Å; R157-R160 CarbonylContact O-C 3.56Å; R157-R160 PolarHBondContact O-N 2.87Å; R157-R161 WeakPolarHBondContact O-CB 3.41Å; R157-R161 WeakPolarHBondContact O-CD 3.44Å; R157-R161 WeakPolarHBondContact O-CG 3.42Å; R157-R161 PolarHBondContact O-N 3.25Å
158E65.1Low67.3Low110 Ų110128.6 Ų128.651%0.51464%0.639SS.*Hα-helixtrans-84.8-26.4-176.5-160.6158.6-131.200112.3R154 K155 L156R154-E158 VanDerWaalsContact O-CB 3.27Å; R154-E158 WeakPolarHBondContact O-CB 3.23Å; R154-E158 PolarHBondContact O-N 2.87Å; K155-E158 PolarHBondContact O-N 3.29Å; L156-E158 VanDerWaalsContact C-N 3.28Å
159K77.9Confident67.1Low188 Ų188127.3 Ų127.382%0.81764%0.644SS**SBendtrans-79.1-15.5163.2-79.1-168170.8-163.60113.9K155K155-K159 WeakPolarHBondContact O-CB 3.46Å; K155-K159 WeakPolarHBondContact O-CG 3.47Å; K155-K159 PolarHBondContact O-N 3.42Å
160R79.7Confident66.5Low208 Ų208130.7 Ų130.779%0.78567%0.668SS**SBendtrans-113.83.1-178.9-66.7-176.166.3174.42.3114.3L156 R157L156-R160 VanDerWaalsContact O-CB 3.24Å; L156-R160 WeakPolarHBondContact O-CB 3.44Å; L156-R160 VanDerWaalsContact O-CG 3.24Å; L156-R160 WeakPolarHBondContact O-CG 3.33Å; L156-R160 PolarHBondContact O-N 3.04Å; R157-R160 CarbonylContact O-C 3.56Å; R157-R160 PolarHBondContact O-N 2.87Å
161R73.9Confident65.6Low165 Ų165127.9 Ų127.962%0.62367%0.67SS**SBendtrans-119.5122.5164.9-71169.7164.8-148.9-13104.1R157 T163R157-R161 WeakPolarHBondContact O-CB 3.41Å; R157-R161 WeakPolarHBondContact O-CD 3.44Å; R157-R161 WeakPolarHBondContact O-CG 3.42Å; R157-R161 PolarHBondContact O-N 3.25Å; R161-T163 PolarHBondContact O-N 3.33Å
162S59.6Low64.8Low122 Ų122132 Ų13285%0.85369%0.687SS**  trans-52.2143.4179.3-170.70000110.4G164S162-G164 PolarHBondContact O-N 2.87Å
163T58.8Low63.4Low97 Ų97132.3 Ų132.360%0.59570%0.7SS**  trans-73.270.3179.248.80000110.6R161 V165R161-T163 PolarHBondContact O-N 3.33Å; T163-V165 PolarHBondContact O-N 2.83Å
164G64.6Low62Low65 Ų65133.6 Ų133.667%0.6771%0.714SS**  trans-62.5116.7167.600000109.3S162S162-G164 PolarHBondContact O-N 2.87Å
165V59.1Low60.5Low132 Ų132133.3 Ų133.380%0.872%0.724SS**  trans63.588.6-175.3-167.40000113.5T163T163-V165 PolarHBondContact O-N 2.83Å
166V52.3Low59Low99 Ų99135.3 Ų135.360%0.674%0.735SS**  trans-91.2123.5151.9177.20000107.2I168V166-I168 PolarHBondContact O-N 3.23Å; V166-I168 VanDerWaalsContact O-N 3.11Å
167N58.3Low57.8Low146 Ų146140.7 Ų140.778%0.78175%0.75SS**  trans-68.3105.9171.3-79.571.9000110
168I52.9Low56.3Low130 Ų130141.9 Ų141.967%0.66776%0.762SS**  trans-82.5126.4165.8-57.6177.8000107.7V166 A170V166-I168 PolarHBondContact O-N 3.23Å; V166-I168 VanDerWaalsContact O-N 3.11Å; I168-A170 PolarHBondContact O-N 2.87Å
169P55.9Low56Low110 Ų110143.6 Ų143.671%0.71478%0.775SS**  trans-63121.9171.2-2234.4000110.8A171P169-A171 VanDerWaalsContact C-N 3.29Å; P169-A171 PolarHBondContact O-N 2.87Å
170A54Low54.8Low114 Ų114139.9 Ų139.994%0.94276%0.764SS**THydrogen-bonded Turntrans-78.971.2-172.900000112.5I168I168-A170 PolarHBondContact O-N 2.87Å
171A48.7Very low53.7Low88 Ų88137.1 Ų137.173%0.72776%0.76SS**THydrogen-bonded Turntrans-133.6-31.5178.700000114.1P169P169-A171 VanDerWaalsContact C-N 3.29Å; P169-A171 PolarHBondContact O-N 2.87Å
172E49.6Very low53Low180 Ų180132 Ų13284%0.84175%0.753SS**  trans-135.789.7-173.8-68.7179-16800111.3
173C45.9Very low53Low116 Ų116126.9 Ų126.978%0.78472%0.719SS**  trans-130.5104.7157.6-79.70000107.7D175C173-D175 VanDerWaalsContact C-N 3.33Å; C173-D175 PolarHBondContact O-N 2.84Å
174L50.1Low53.1Low183 Ų183129.2 Ų129.296%0.95872%0.724SS**  trans-79.577.3-175.1-176.179.6000110.3
175D41.8Very low53.1Low151 Ų151133.4 Ų133.481%0.80772%0.723SS**  trans-150.866.8164.9-153.44.9000110.7C173 Y177C173-D175 VanDerWaalsContact C-N 3.33Å; C173-D175 PolarHBondContact O-N 2.84Å; D175-Y177 PolarHBondContact O-N 3.33Å; D175-Y177 VanDerWaalsContact O-N 3.17Å
176E47.3Very low53.5Low178 Ų178131.1 Ų131.183%0.83270%0.704SS**  trans-74.594.4167.5-68.5-175.4146.800108.8
177Y44.8Very low54.6Low214 Ų214133.4 Ų133.484%0.83970%0.702SS**  trans173.386.1130.2-93.5-63.6000113.2D175D175-Y177 PolarHBondContact O-N 3.33Å; D175-Y177 VanDerWaalsContact O-N 3.17Å
178E41.3Very low55.6Low184 Ų184134.1 Ų134.186%0.8670%0.698SS**  trans-152.986.8143-130167.4-144.100110D180E178-D180 PolarHBondContact O-N 3.49Å
179D59.8Low56.9Low146 Ų146134 Ų13478%0.78169%0.689SS**  trans-78.763.2179.8-176.128.4000111.6E181D179-E181 VanDerWaalsContact C-N 3.29Å; D179-E181 PolarHBondContact O-N 3.25Å
180D52.1Low58Low109 Ų109134.3 Ų134.358%0.58368%0.681SS**  trans-81.977.1177.1-126.428.6000109.5E178 A182 G183 Q184E178-D180 PolarHBondContact O-N 3.49Å; D180-A182 PolarHBondContact O-N 2.85Å; D180-G183 PolarHBondContact O-N 3.04Å; D180-Q184 PolarHBondContact O-N 3.13Å
181E57.6Low59.5Low150 Ų150133.5 Ų133.570%0.70166%0.661SS**Hα-helixtrans-44.8-37.3168.4-96.9-147.9142.600110.8D179 G183 Q184 K185D179-E181 VanDerWaalsContact C-N 3.29Å; D179-E181 PolarHBondContact O-N 3.25Å; E181-G183 VanDerWaalsContact C-N 3.33Å; E181-G183 PolarHBondContact O-N 3.38Å; E181-Q184 PolarHBondContact O-N 2.97Å; E181-K185 VanDerWaalsContact O-CB 3.24Å; E181-K185 WeakPolarHBondContact O-CB 3.43Å; E181-K185 PolarHBondContact O-N 2.72Å
182A59.6Low61.4Low57 Ų57131.8 Ų131.847%0.47165%0.647SS.*Hα-helixtrans-51.1-48.8173.700000112D180 K185 E186D180-A182 PolarHBondContact O-N 2.85Å; A182-K185 CarbonylContact O-C 3.51Å; A182-K185 PolarHBondContact O-N 3.42Å; A182-E186 VanDerWaalsContact O-CB 3.27Å; A182-E186 WeakPolarHBondContact O-CB 3.33Å; A182-E186 PolarHBondContact O-N 3.22Å
183G59.3Low63.3Low15 Ų15127.4 Ų127.416%0.15563%0.628CS.*Hα-helixtrans-70.7-29.6-178.300000114.9D180 E181 E186 R187D180-G183 PolarHBondContact O-N 3.04Å; E181-G183 VanDerWaalsContact C-N 3.33Å; E181-G183 PolarHBondContact O-N 3.38Å; G183-E186 WeakPolarHBondContact O-CB 3.12Å; G183-R187 PolarHBondContact O-N 3.29Å; G183-R187 PolarHBondContact O-NE 3.4Å; G183-R187 PolarHBondContact O-NH1 2.95Å; G183-R187 PolarHBondContact O-NH2 2.89Å
184Q59.8Low65.5Low147 Ų147125.6 Ų125.669%0.68761%0.614SS**Hα-helixtrans-73.1-41.3168.1-79.9-155.329.300111.7D180 E181 E186 R187 K188D180-Q184 PolarHBondContact O-N 3.13Å; E181-Q184 PolarHBondContact O-N 2.97Å; Q184-E186 VanDerWaalsContact C-N 3.29Å; Q184-E186 PolarHBondContact O-N 3.04Å; Q184-R187 PolarHBondContact O-N 3.1Å; Q184-K188 VanDerWaalsContact O-CB 3.27Å; Q184-K188 WeakPolarHBondContact O-CB 3.45Å; Q184-K188 PolarHBondContact O-N 3.49Å
185K64.4Low67.5Low152 Ų152122.8 Ų122.866%0.66160%0.596SS**Hα-helixtrans-67-31.1177.8-168.4175-177.9176.90112.2E181 A182 R189E181-K185 VanDerWaalsContact O-CB 3.24Å; E181-K185 WeakPolarHBondContact O-CB 3.43Å; E181-K185 PolarHBondContact O-N 2.72Å; A182-K185 CarbonylContact O-C 3.51Å; A182-K185 PolarHBondContact O-N 3.42Å; K185-R189 WeakPolarHBondContact O-CB 3.28Å; K185-R189 PolarHBondContact O-N 3.43Å
186E68.9Low69.7Low84 Ų84120.5 Ų120.539%0.39358%0.58SS.*Hα-helixtrans-56.6-66.8167.7-174.2100.3-160.100110.1A182 G183 Q184 K188 R189 E190A182-E186 VanDerWaalsContact O-CB 3.27Å; A182-E186 WeakPolarHBondContact O-CB 3.33Å; A182-E186 PolarHBondContact O-N 3.22Å; G183-E186 WeakPolarHBondContact O-CB 3.12Å; Q184-E186 VanDerWaalsContact C-N 3.29Å; Q184-E186 PolarHBondContact O-N 3.04Å; E186-K188 VanDerWaalsContact C-N 3.26Å; E186-K188 PolarHBondContact O-N 3.07Å; E186-R189 VanDerWaalsContact CD-CZ 3.43Å; E186-R189 WeakPolarHBondContact O-CG 3.31Å; E186-R189 PolarHBondContact O-N 3.4Å; E186-R189 IonicContact OE1-CZ 2.75Å; E186-R189 IonicContact OE1-NH1 2.97Å; E186-R189 IonicContact OE1-NH2 2.71Å; E186-R189 PolarHBondContact OE1-NH2 3.41Å; E186-R189 IonicContact OE2-CZ 3.95Å; E186-R189 IonicContact OE2-NH1 3.23Å; E186-R189 PolarHBondContact OE2-NH1 3.47Å; E186-R189 IonicContact OE2-NH2 3.73Å; E186-R189 PolarHBondContact OE2-NH2 3.46Å; E186-E190 PolarHBondContact O-N 2.82Å
187R74.2Confident71.5Confident147 Ų147115.7 Ų115.756%0.55556%0.56SS**Hα-helixtrans-56.2-41-178.9-68.3-179.4-72.5-94.15.2111.9G183 Q184 R189 E190 D191G183-R187 PolarHBondContact O-N 3.29Å; G183-R187 PolarHBondContact O-NE 3.4Å; G183-R187 PolarHBondContact O-NH1 2.95Å; G183-R187 PolarHBondContact O-NH2 2.89Å; Q184-R187 PolarHBondContact O-N 3.1Å; R187-R189 PolarHBondContact O-N 2.89Å; R187-E190 PolarHBondContact O-N 3.4Å; R187-D191 WeakPolarHBondContact O-CB 3.36Å; R187-D191 PolarHBondContact O-N 2.87Å
188K79.3Confident73.7Confident161 Ų161108.6 Ų108.670%0.754%0.539SS*.Hα-helixtrans-68.8-29.1177.8-167.2170.1-176173.60114.1Q184 E186 A192Q184-K188 VanDerWaalsContact O-CB 3.27Å; Q184-K188 WeakPolarHBondContact O-CB 3.45Å; Q184-K188 PolarHBondContact O-N 3.49Å; E186-K188 VanDerWaalsContact C-N 3.26Å; E186-K188 PolarHBondContact O-N 3.07Å; K188-A192 WeakPolarHBondContact O-CB 3.34Å; K188-A192 PolarHBondContact O-N 3.34Å
189R81.3Confident75.8Confident127 Ų127105.7 Ų105.748%0.47953%0.527SS..Hα-helixtrans-77.4-35.6172.296.5-161.5177.8-125.8-13.3110.9K185 E186 R187 A192 I193K185-R189 WeakPolarHBondContact O-CB 3.28Å; K185-R189 PolarHBondContact O-N 3.43Å; E186-R189 VanDerWaalsContact CD-CZ 3.43Å; E186-R189 WeakPolarHBondContact O-CG 3.31Å; E186-R189 PolarHBondContact O-N 3.4Å; E186-R189 IonicContact OE1-CZ 2.75Å; E186-R189 IonicContact OE1-NH1 2.97Å; E186-R189 IonicContact OE1-NH2 2.71Å; E186-R189 PolarHBondContact OE1-NH2 3.41Å; E186-R189 IonicContact OE2-CZ 3.95Å; E186-R189 IonicContact OE2-NH1 3.23Å; E186-R189 PolarHBondContact OE2-NH1 3.47Å; E186-R189 IonicContact OE2-NH2 3.73Å; E186-R189 PolarHBondContact OE2-NH2 3.46Å; R187-R189 PolarHBondContact O-N 2.89Å; R189-A192 PolarHBondContact O-N 2.9Å; R189-I193 HydrophobicContact CG-CD1 4.29Å; R189-I193 WeakPolarHBondContact O-CB 3.36Å; R189-I193 WeakPolarHBondContact O-CD1 3.35Å; R189-I193 WeakPolarHBondContact O-CG1 3.5Å; R189-I193 PolarHBondContact O-N 3.23Å
190E78.4Confident77.1Confident117 Ų117103.5 Ų103.555%0.54751%0.512SS..Hα-helixtrans-66.7-45176.9-173.8175.8-161.900111.4E186 R187 A192 I193 T194E186-E190 PolarHBondContact O-N 2.82Å; R187-E190 PolarHBondContact O-N 3.4Å; E190-A192 VanDerWaalsContact C-N 3.3Å; E190-A192 PolarHBondContact O-N 3.34Å; E190-I193 PolarHBondContact O-N 2.67Å; E190-T194 VanDerWaalsContact O-CB 3.32Å; E190-T194 WeakPolarHBondContact O-CB 3.47Å; E190-T194 PolarHBondContact O-N 2.87Å; E190-T194 PolarHBondContact O-OG1 3.5Å
191D85.4Confident78.2Confident97 Ų97103.1 Ų103.152%0.51951%0.51SS..Hα-helixtrans-57.7-41.6170.9-76.8-31.7000112R187 T194 Q195R187-D191 WeakPolarHBondContact O-CB 3.36Å; R187-D191 PolarHBondContact O-N 2.87Å; D191-T194 PolarHBondContact O-N 3.16Å; D191-Q195 WeakPolarHBondContact O-CB 3.37Å; D191-Q195 VanDerWaalsContact O-CG 3.32Å; D191-Q195 WeakPolarHBondContact O-CG 3.46Å; D191-Q195 PolarHBondContact O-N 3.25Å; D191-Q195 PolarHBondContact O-NE2 2.86Å
192A88.9Confident79.3Confident52 Ų52102 Ų10243%0.4351%0.505SS..Hα-helixtrans-70.1-41.9178.900000112.2K188 R189 E190 T194 Q195 Q196K188-A192 WeakPolarHBondContact O-CB 3.34Å; K188-A192 PolarHBondContact O-N 3.34Å; R189-A192 PolarHBondContact O-N 2.9Å; E190-A192 VanDerWaalsContact C-N 3.3Å; E190-A192 PolarHBondContact O-N 3.34Å; A192-T194 VanDerWaalsContact C-N 3.31Å; A192-Q195 PolarHBondContact O-N 3.37Å; A192-Q196 VanDerWaalsContact O-CB 3.31Å; A192-Q196 WeakPolarHBondContact O-CB 3.44Å; A192-Q196 PolarHBondContact O-N 3.16Å
193I89.8Confident80Confident89 Ų89101.5 Ų101.546%0.45650%0.501SS..Hα-helixtrans-63.2-39.8173.4-71.1162.9000110.2R189 E190 Q196 N197R189-I193 HydrophobicContact CG-CD1 4.29Å; R189-I193 WeakPolarHBondContact O-CB 3.36Å; R189-I193 WeakPolarHBondContact O-CD1 3.35Å; R189-I193 WeakPolarHBondContact O-CG1 3.5Å; R189-I193 PolarHBondContact O-N 3.23Å; E190-I193 PolarHBondContact O-N 2.67Å; I193-Q196 PolarHBondContact O-N 2.65Å; I193-N197 WeakPolarHBondContact O-CB 3.4Å; I193-N197 PolarHBondContact O-N 2.67Å; I193-N197 PolarHBondContact O-ND2 3.28Å
194T90.8Very high80.5Confident78 Ų78105.4 Ų105.448%0.47952%0.521SS..Hα-helixtrans-65.2-49177.2-590000111E190 D191 A192 Q196 N197 T198E190-T194 VanDerWaalsContact O-CB 3.32Å; E190-T194 WeakPolarHBondContact O-CB 3.47Å; E190-T194 PolarHBondContact O-N 2.87Å; E190-T194 PolarHBondContact O-OG1 3.5Å; D191-T194 PolarHBondContact O-N 3.16Å; A192-T194 VanDerWaalsContact C-N 3.31Å; T194-Q196 VanDerWaalsContact C-N 3.32Å; T194-Q196 PolarHBondContact O-N 3.14Å; T194-N197 PolarHBondContact O-N 2.76Å; T194-T198 PolarHBondContact O-N 2.88Å; T194-T198 PolarHBondContact O-OG1 3Å; T194-T198 VanDerWaalsContact O-OG1 3.1Å
195Q91.8Very high80.5Confident124 Ų124103.3 Ų103.358%0.57952%0.515SS*.Hα-helixtrans-59.2-41.6174-75.8169.368.400112.2D191 A192 T198 M199D191-Q195 WeakPolarHBondContact O-CB 3.37Å; D191-Q195 VanDerWaalsContact O-CG 3.32Å; D191-Q195 WeakPolarHBondContact O-CG 3.46Å; D191-Q195 PolarHBondContact O-N 3.25Å; D191-Q195 PolarHBondContact O-NE2 2.86Å; A192-Q195 PolarHBondContact O-N 3.37Å; Q195-T198 PolarHBondContact O-N 3.06Å; Q195-M199 WeakPolarHBondContact O-CG 3.38Å; Q195-M199 PolarHBondContact O-N 2.78Å
196Q88.5Confident80.2Confident102 Ų102103.3 Ų103.348%0.47752%0.521SS..Hα-helixtrans-64.2-42.1176.1-176.6175.9-10.700112.1A192 I193 T194 M199 Q200A192-Q196 VanDerWaalsContact O-CB 3.31Å; A192-Q196 WeakPolarHBondContact O-CB 3.44Å; A192-Q196 PolarHBondContact O-N 3.16Å; I193-Q196 PolarHBondContact O-N 2.65Å; T194-Q196 VanDerWaalsContact C-N 3.32Å; T194-Q196 PolarHBondContact O-N 3.14Å; Q196-M199 PolarHBondContact O-N 3.2Å; Q196-Q200 HydrophobicContact CG-CG 4.49Å; Q196-Q200 WeakPolarHBondContact O-CB 3.4Å; Q196-Q200 VanDerWaalsContact O-CG 3.28Å; Q196-Q200 WeakPolarHBondContact O-CG 3.43Å; Q196-Q200 PolarHBondContact O-N 2.94Å
197N85.3Confident79.7Confident77 Ų77106.2 Ų106.241%0.41254%0.539SS..Hα-helixtrans-65.2-41.6175.3-86-91.2000111.7I193 T194 Q200 N201I193-N197 WeakPolarHBondContact O-CB 3.4Å; I193-N197 PolarHBondContact O-N 2.67Å; I193-N197 PolarHBondContact O-ND2 3.28Å; T194-N197 PolarHBondContact O-N 2.76Å; N197-Q200 PolarHBondContact O-N 3.11Å; N197-N201 WeakPolarHBondContact O-CB 3.43Å; N197-N201 VanDerWaalsContact O-CG 3.31Å; N197-N201 PolarHBondContact O-N 2.91Å; N197-N201 PolarHBondContact O-ND2 3.3Å
198T90.3Very high78.3Confident66 Ų66103 Ų10341%0.40553%0.532SS..Hα-helixtrans-59.1-52.2174.4-59.80000110.8T194 Q195 Q200 N201 E202T194-T198 PolarHBondContact O-N 2.88Å; T194-T198 PolarHBondContact O-OG1 3Å; T194-T198 VanDerWaalsContact O-OG1 3.1Å; Q195-T198 PolarHBondContact O-N 3.06Å; T198-Q200 VanDerWaalsContact C-N 3.29Å; T198-Q200 PolarHBondContact O-N 3.26Å; T198-N201 PolarHBondContact O-N 3.4Å; T198-E202 WeakPolarHBondContact O-CB 3.2Å; T198-E202 WeakPolarHBondContact O-CG 3.4Å; T198-E202 PolarHBondContact O-N 2.84Å
199M87.2Confident77Confident122 Ų122101.3 Ų101.360%0.60154%0.538SS*.Hα-helixtrans-61.3-34.9176.6-70.1-170.1-58.600113Q195 Q196 A203Q195-M199 WeakPolarHBondContact O-CG 3.38Å; Q195-M199 PolarHBondContact O-N 2.78Å; Q196-M199 PolarHBondContact O-N 3.2Å; M199-A203 WeakPolarHBondContact O-CB 3.45Å; M199-A203 PolarHBondContact O-N 3.44Å
200Q85.9Confident75.9Confident100 Ų10097.6 Ų97.647%0.46754%0.54SS..Hα-helixtrans-69.5-43.2176.1-79.1179.9-12.900112Q196 N197 T198 A203 V204Q196-Q200 HydrophobicContact CG-CG 4.49Å; Q196-Q200 WeakPolarHBondContact O-CB 3.4Å; Q196-Q200 VanDerWaalsContact O-CG 3.28Å; Q196-Q200 WeakPolarHBondContact O-CG 3.43Å; Q196-Q200 PolarHBondContact O-N 2.94Å; N197-Q200 PolarHBondContact O-N 3.11Å; T198-Q200 VanDerWaalsContact C-N 3.29Å; T198-Q200 PolarHBondContact O-N 3.26Å; Q200-A203 PolarHBondContact O-N 3.32Å; Q200-V204 WeakPolarHBondContact O-CB 3.36Å; Q200-V204 VanDerWaalsContact O-CG2 3.23Å; Q200-V204 WeakPolarHBondContact O-CG2 3.42Å; Q200-V204 PolarHBondContact O-N 3.43Å
201N76.2Confident74.6Confident102 Ų10295 Ų9555%0.54553%0.534SS..Hα-helixtrans-65.7-41.2176.1-71.5-41.9000111.8N197 T198 N205N197-N201 WeakPolarHBondContact O-CB 3.43Å; N197-N201 VanDerWaalsContact O-CG 3.31Å; N197-N201 PolarHBondContact O-N 2.91Å; N197-N201 PolarHBondContact O-ND2 3.3Å; T198-N201 PolarHBondContact O-N 3.4Å; N201-N205 WeakPolarHBondContact O-CB 3.18Å; N201-N205 PolarHBondContact O-N 3.47Å
202E79.3Confident73.1Confident127 Ų12795.4 Ų95.459%0.59355%0.545SS*.Hα-helixtrans-65.2-44.1174.3-72.5176.6179.700111.8T198 N205 L206T198-E202 WeakPolarHBondContact O-CB 3.2Å; T198-E202 WeakPolarHBondContact O-CG 3.4Å; T198-E202 PolarHBondContact O-N 2.84Å; E202-N205 PolarHBondContact O-N 2.97Å; E202-L206 WeakPolarHBondContact O-CB 3.42Å; E202-L206 PolarHBondContact O-N 2.93Å
203A75.1Confident71.2Confident45 Ų45102.9 Ų102.937%0.37256%0.563SS.*Hα-helixtrans-65.7-40.6176.500000112.3M199 Q200 L206 L207M199-A203 WeakPolarHBondContact O-CB 3.45Å; M199-A203 PolarHBondContact O-N 3.44Å; Q200-A203 PolarHBondContact O-N 3.32Å; A203-L206 CarbonylContact O-C 3.6Å; A203-L206 PolarHBondContact O-N 3.26Å; A203-L207 WeakPolarHBondContact O-CB 3.48Å; A203-L207 WeakPolarHBondContact O-CD1 3.33Å; A203-L207 PolarHBondContact O-N 2.83Å
204V69.7Low69.5Low98 Ų98106.2 Ų106.259%0.59458%0.581SS**Hα-helixtrans-62.8-42.4174.9166.90000110.9Q200 L206 L207 D208Q200-V204 WeakPolarHBondContact O-CB 3.36Å; Q200-V204 VanDerWaalsContact O-CG2 3.23Å; Q200-V204 WeakPolarHBondContact O-CG2 3.42Å; Q200-V204 PolarHBondContact O-N 3.43Å; V204-L206 PolarHBondContact O-N 2.99Å; V204-L207 PolarHBondContact O-N 3.21Å; V204-D208 PolarHBondContact O-N 2.74Å
205N60.3Low67.4Low102 Ų102110.7 Ų110.755%0.54560%0.601SS.*Hα-helixtrans-65.6-19.9172.6-78.3-17.6000113.9N201 E202N201-N205 WeakPolarHBondContact O-CB 3.18Å; N201-N205 PolarHBondContact O-N 3.47Å; E202-N205 PolarHBondContact O-N 2.97Å
206L58.6Low65.2Low152 Ų152113.9 Ų113.980%0.79662%0.616SS**Hα-helixtrans-94.1-22.4177.2-153.675000113.1E202 A203 V204E202-L206 WeakPolarHBondContact O-CB 3.42Å; E202-L206 PolarHBondContact O-N 2.93Å; A203-L206 CarbonylContact O-C 3.6Å; A203-L206 PolarHBondContact O-N 3.26Å; V204-L206 PolarHBondContact O-N 2.99Å
207L57.6Low62.7Low145 Ų145118.1 Ų118.176%0.75964%0.636SS**Hα-helixtrans-91.2-11.8179.4-93.477.2000113.9A203 V204 P209A203-L207 WeakPolarHBondContact O-CB 3.48Å; A203-L207 WeakPolarHBondContact O-CD1 3.33Å; A203-L207 PolarHBondContact O-N 2.83Å; V204-L207 PolarHBondContact O-N 3.21Å; L207-P209 WeakPolarHBondContact O-CD 3.32Å
208D43.7Very low60.7Low79 Ų79119 Ų11942%0.42265%0.646SS.*  trans-102.5108.8167.2175.933.2000112V204 G210 S211V204-D208 PolarHBondContact O-N 2.74Å; D208-G210 VanDerWaalsContact CG-N 3.35Å; D208-G210 PolarHBondContact O-N 3.14Å; D208-G210 VanDerWaalsContact O-N 3.16Å; D208-G210 PolarHBondContact OD1-N 3.13Å; D208-S211 WeakPolarHBondContact OD2-CB 3.4Å; D208-S211 PolarHBondContact OD2-N 3.38Å
209P53.8Low58.6Low126 Ų126122.2 Ų122.282%0.81867%0.668SS**SBendtrans-63.9-11.6172.2-22.434.8000115.1L207L207-P209 WeakPolarHBondContact O-CD 3.32Å
210G57.2Low56.6Low50 Ų50126.9 Ų126.952%0.51568%0.679SS.*SBendtrans-84.4-39-178.300000115.4D208 S212D208-G210 VanDerWaalsContact CG-N 3.35Å; D208-G210 PolarHBondContact O-N 3.14Å; D208-G210 VanDerWaalsContact O-N 3.16Å; D208-G210 PolarHBondContact OD1-N 3.13Å; G210-S212 VanDerWaalsContact C-N 3.32Å; G210-S212 PolarHBondContact O-N 3.48Å
211S51.6Low54.3Low62 Ų62128.8 Ų128.843%0.43470%0.698SS.*G310 helixtrans-61.5-31.3-169.2-172.50000115.1D208 Y213D208-S211 WeakPolarHBondContact OD2-CB 3.4Å; D208-S211 PolarHBondContact OD2-N 3.38Å; S211-Y213 VanDerWaalsContact C-N 3.25Å; S211-Y213 PolarHBondContact O-N 3.02Å
212S52.6Low52.9Low105 Ų105131 Ų13173%0.73472%0.715SS**G310 helixtrans-68.2-8.9-164.4-156.70000116.5G210G210-S212 VanDerWaalsContact C-N 3.32Å; G210-S212 PolarHBondContact O-N 3.48Å
213Y49.8Very low51Low209 Ų209130.5 Ų130.582%0.8273%0.725SS**G310 helixtrans-113.7-1.6-169.4-95.4-81.7000117.3S211S211-Y213 VanDerWaalsContact C-N 3.25Å; S211-Y213 PolarHBondContact O-N 3.02Å
214L54.7Low49.3Very low160 Ų160130.7 Ų130.784%0.83873%0.731SS**SBendtrans-126.618-171.8-75.1179.2000116.8
215L46.8Very low48.1Very low172 Ų172137.3 Ų137.390%0.90175%0.746SS**  trans-135.752171.8-154.468.9000114.4
216Q46.1Very low47Very low191 Ų191143 Ų14389%0.89376%0.761SS**  trans-122.660.1166.5-166.1173.884.900111.5P218Q216-P218 WeakPolarHBondContact O-CD 3.32Å
217E34.8Very low46.4Very low190 Ų190145.3 Ų145.389%0.88877%0.765SS**PPolyproline II helixtrans-86.3119.9162.7-78.8-143.3120.200110.7
218P43.1Very low45.2Very low95 Ų95144 Ų14462%0.61777%0.767SS**PPolyproline II helixtrans-72.2136.6174.2-18.132.9000111.7Q216 R220Q216-P218 WeakPolarHBondContact O-CD 3.32Å; P218-R220 PolarHBondContact O-N 3.5Å
219P47.6Very low44.6Very low134 Ų134146.8 Ų146.887%0.8779%0.788SS**PPolyproline II helixtrans-66.3123.6-173.826.4-35000112
220R44.1Very low44Very low220 Ų220147.1 Ų147.183%0.8379%0.788SS**  trans-132.6121.2178.5-73.6-169.3173.7-168.60.1114.6P218P218-R220 PolarHBondContact O-N 3.5Å
221T38.8Very low42.9Very low141 Ų141149.7 Ų149.787%0.86580%0.798SS**  trans69.2132147.950.60000120.6
222V45.1Very low42.1Very low149 Ų149153.2 Ų153.290%0.90382%0.817SS**  trans-74.3131.8174169.90000111.8
223S39.8Very low41.7Very low115 Ų115152.2 Ų152.280%0.80481%0.81SS**  trans-163150.1150.9-163.60000108.8
224G40.6Very low41.6Very low50 Ų50151.2 Ų151.252%0.51581%0.812SS.*  cis137.699.5-4.100000111.4
225R42.8Very low40.9Very low236 Ų236151.8 Ų151.889%0.89181%0.811SS**  trans68.6160-163.8-65.4-180167.7-163.9-4.9111.6
226Y38.5Very low40.8Very low221 Ų221150.6 Ų150.687%0.86781%0.805SS**  cis-138.517025.5-4.1-91.3000113.2
227K44.3Very low40.7Very low201 Ų201148.1 Ų148.187%0.87480%0.803SS**  trans-116.3169.4174-92.5-167.7173.1-170.90110.4
228S32.9Very low40.8Very low117 Ų117142.1 Ų142.182%0.81878%0.782SS**  trans80.9147.7179.4-47.70000113
229T32.2Very low40.9Very low138 Ų138143.4 Ų143.485%0.84779%0.793SS**  cis-142.5167.433.243.80000115.9
230T40.6Very low40.8Very low133 Ų133145.4 Ų145.482%0.81678%0.783SS**  trans-76.1136.7173.6-60.40000114.6
231S35Very low40.4Very low104 Ų104144.8 Ų144.873%0.72778%0.782SS**  trans-166.4120.715046.30000107.4
232V33.2Very low40.4Very low137 Ų137143.7 Ų143.783%0.8378%0.78SS**  78.5133.172.7171.30000112.7
233S45.3Very low40.2Very low84 Ų84148.4 Ų148.459%0.58778%0.782SS**  trans-68.8147.1-174.6174.90000113.5E235S233-E235 PolarHBondContact OG-OE2 3.24Å
234E46.4Very low40.3Very low188 Ų188148.4 Ų148.488%0.87978%0.777SS**  trans-140.2111.3150.957.1-165.3143.600110.4
235E41.1Very low40.1Very low172 Ų172153 Ų15380%0.80479%0.79SS**  trans-105.2157.3170.5-73.6162.195.400109.5S233S233-E235 PolarHBondContact OG-OE2 3.24Å
236D45.3Very low40.2Very low147 Ų147153.7 Ų153.779%0.78679%0.793SS**  trans68.194.1-178.7-167.320.8000117.9
237V43Very low40.6Very low139 Ų139149.3 Ų149.384%0.84279%0.794SS**  trans-134116.4155.4-179.50000111.8
238S38.1Very low40.3Very low64 Ų64142.9 Ų142.945%0.44879%0.785SS.*  trans6971158.5-172.50000118.3R240S238-R240 VanDerWaalsContact C-N 3.35Å; S238-R240 PolarHBondContact O-N 2.9Å; S238-R240 PolarHBondContact OG-NE 2.87Å
239S44.1Very low41Very low122 Ų122146.6 Ų146.685%0.85379%0.787SS**  trans-57.988.8152-176.70000112.6
240R46.5Very low42.1Very low176 Ų176145.7 Ų145.766%0.66478%0.783SS**  trans-153.2127.4167.7-71.8-174.9-75.4-169.3-4.9107.8S238S238-R240 VanDerWaalsContact C-N 3.35Å; S238-R240 PolarHBondContact O-N 2.9Å; S238-R240 PolarHBondContact OG-NE 2.87Å
241Y34.1Very low43.3Very low207 Ų207149.7 Ų149.781%0.81278%0.783SS**  cis-135.2156.915.1-73.2-95000112.1
242S39.7Very low43.8Very low117 Ų117155.7 Ų155.782%0.81879%0.792SS**  trans-101.5163.6161.4-49.80000111.6
243R40.3Very low44.5Very low248 Ų248156.1 Ų156.194%0.93679%0.789SS**  trans105.6122.7147.1-152.6173.5-164.3-136.41.4117.6
244T42.4Very low45Very low116 Ų116162.3 Ų162.371%0.71280%0.8SS**  trans-70.8178.2175.2-280000112.8
245D37Very low45Very low146 Ų146159.7 Ų159.778%0.78179%0.792SS**  trans80.292.9160.5-53.5-45.4000118.9
246R44.1Very low45.5Very low251 Ų251155.1 Ų155.195%0.94778%0.784SS**  trans-150.8127.1130.8-120.1171.1-172.6-106.4-1.1113
247S46.6Very low45.6Very low128 Ų128155 Ų15590%0.89578%0.783SS**  trans-69.8144.3173.4179.30000111.4
248G39.3Very low46.1Very low66 Ų66154.6 Ų154.668%0.6878%0.78SS**  trans176.184.1176.200000114P250G248-P250 WeakPolarHBondContact O-CD 3.45Å
249F46.6Very low46.8Very low195 Ų195157.1 Ų157.186%0.85580%0.798SS**  trans-73.5136.9161.5-94.8-86.9000110.3
250P55.4Low47.3Very low120 Ų120154.7 Ų154.778%0.77979%0.792SS**  trans-114.7128137.83.117.3000109.6G248G248-P250 WeakPolarHBondContact O-CD 3.45Å
251R66.6Low47.8Very low216 Ų216151.3 Ų151.382%0.81579%0.788SS**  trans-80.3129.6163.1-59180-178.3-165.20.2107.6
252Y45.5Very low48.9Very low230 Ų230149.7 Ų149.790%0.90279%0.792SS**  trans166.584.1141.6-93.3-63.2000111.5
253N46.3Very low49.8Very low146 Ų146150.2 Ų150.278%0.78179%0.79SS**  trans-158.296.3142.8-148.8-49.7000109.3
254R56.2Low50.8Low215 Ų215140.2 Ų140.281%0.81176%0.758SS**SBendtrans-120.6-21.7-175.9172.961.2172.4179.5-2.1112.5
255D47.7Very low52.5Low132 Ų132137.7 Ų137.771%0.70675%0.745SS**SBendtrans-137.461-160.1-53.2-74.1000111.8
256A51.3Low54.7Low77 Ų77134.8 Ų134.864%0.63674%0.736SS**SBendtrans-142-1.1-178.600000116.5
257N46.5Very low56.9Low144 Ų144127.2 Ų127.277%0.7772%0.718SS**  trans-15255.9177.4-159.15.2000113.7
258V54.3Low59.2Low130 Ų130125.5 Ų125.579%0.78870%0.698SS**  trans-90.7-14.3-178.6-177.80000112.6
259S52.9Low61.7Low118 Ų118127 Ų12783%0.82569%0.688SS**SBendtrans-113.988.9-178.7-62.20000111.7
260G53Low64Low70 Ų70123.8 Ų123.872%0.72267%0.673SS**SBendtrans178-28.9172.300000115.8L262G260-L262 PolarHBondContact O-N 3.01Å
261N58Low65.9Low106 Ų106124.5 Ų124.557%0.56766%0.664SS**  trans-9616.3-166.3-156.636.1000115.7V263 S264N261-V263 VanDerWaalsContact C-N 3.32Å; N261-V263 PolarHBondContact O-N 3.3Å; N261-S264 WeakPolarHBondContact O-CB 3.48Å; N261-S264 PolarHBondContact O-N 3.3Å; N261-S264 PolarHBondContact O-OG 3.35Å; N261-S264 WeakPolarHBondContact OD1-CB 3.27Å; N261-S264 PolarHBondContact OD1-OG 3.36Å
262L57.3Low67.4Low173 Ų173118.6 Ų118.691%0.90665%0.648SS**THydrogen-bonded Turntrans-72.6-20.2-166.1-147.374.3000114.6G260 S264G260-L262 PolarHBondContact O-N 3.01Å; L262-S264 PolarHBondContact O-N 3.02Å
263V58.6Low69.8Low128 Ų128112.3 Ų112.378%0.77663%0.627SS**THydrogen-bonded Turntrans-72.7-18.2171.8176.80000111.7N261 T267N261-V263 VanDerWaalsContact C-N 3.32Å; N261-V263 PolarHBondContact O-N 3.3Å; V263-T267 PolarHBondContact O-OG1 2.58Å
264S62.2Low72.2Confident37 Ų37108.6 Ų108.626%0.25961%0.607SS.*THydrogen-bonded Turntrans-98.2-31.4-164.9-46.30000114.5N261 L262 T267 L268N261-S264 WeakPolarHBondContact O-CB 3.48Å; N261-S264 PolarHBondContact O-N 3.3Å; N261-S264 PolarHBondContact O-OG 3.35Å; N261-S264 WeakPolarHBondContact OD1-CB 3.27Å; N261-S264 PolarHBondContact OD1-OG 3.36Å; L262-S264 PolarHBondContact O-N 3.02Å; S264-T267 PolarHBondContact O-N 3.08Å; S264-L268 WeakPolarHBondContact O-CB 3.41Å; S264-L268 VanDerWaalsContact O-CG 3.24Å; S264-L268 WeakPolarHBondContact O-CG 3.2Å; S264-L268 PolarHBondContact O-N 3.35Å
265S77.7Confident74.2Confident63 Ų63103.2 Ų103.244%0.44159%0.593SS.*Hα-helixtrans-61.9-58.7-169.6-152.20000112.3T267 L268 E269S265-T267 PolarHBondContact O-N 3.17Å; S265-L268 CarbonylContact O-C 3.55Å; S265-L268 WeakPolarHBondContact O-CB 3.42Å; S265-L268 PolarHBondContact O-N 3.31Å; S265-E269 VanDerWaalsContact CB-OE1 3.26Å; S265-E269 WeakPolarHBondContact CB-OE1 3.27Å; S265-E269 WeakPolarHBondContact O-CB 3.24Å; S265-E269 VanDerWaalsContact O-CD 3.28Å; S265-E269 VanDerWaalsContact O-CG 3.3Å; S265-E269 WeakPolarHBondContact O-CG 3.5Å; S265-E269 PolarHBondContact O-N 3.11Å; S265-E269 PolarHBondContact OG-OE1 3.44Å
266S82.5Confident76.6Confident85 Ų85102.7 Ų102.759%0.59459%0.587SS**Hα-helixtrans-57.3-34.31761740000113K270S266-K270 WeakPolarHBondContact O-CB 3.32Å; S266-K270 PolarHBondContact O-N 3.33Å
267T90.9Very high78.8Confident92 Ų92103.3 Ų103.356%0.56458%0.575SS**Hα-helixtrans-70.5-36.4177.1-51.30000112V263 S264 S265 K271V263-T267 PolarHBondContact O-OG1 2.58Å; S264-T267 PolarHBondContact O-N 3.08Å; S265-T267 PolarHBondContact O-N 3.17Å; T267-K271 VanDerWaalsContact O-CB 3.32Å; T267-K271 WeakPolarHBondContact O-CB 3.45Å; T267-K271 PolarHBondContact O-N 3.45Å; T267-K271 VanDerWaalsContact O-N 3.07Å
268L93.4Very high81.3Confident92 Ų92100.1 Ų100.148%0.48256%0.555SS.*Hα-helixtrans-74.6-42.8174.9-73.6166.1000111.5S264 S265 K271 I272S264-L268 WeakPolarHBondContact O-CB 3.41Å; S264-L268 VanDerWaalsContact O-CG 3.24Å; S264-L268 WeakPolarHBondContact O-CG 3.2Å; S264-L268 PolarHBondContact O-N 3.35Å; S265-L268 CarbonylContact O-C 3.55Å; S265-L268 WeakPolarHBondContact O-CB 3.42Å; S265-L268 PolarHBondContact O-N 3.31Å; L268-K271 CarbonylContact O-C 3.55Å; L268-K271 PolarHBondContact O-N 3.43Å; L268-K271 VanDerWaalsContact O-N 3.13Å; L268-I272 VanDerWaalsContact O-CG1 3.29Å; L268-I272 WeakPolarHBondContact O-CG1 3.43Å; L268-I272 PolarHBondContact O-N 3.05Å
269E92.7Very high83.4Confident99 Ų9996.6 Ų96.646%0.46353%0.534SS..Hα-helixtrans-56.3-51.6173.6-71.7150.3-140.100110.3S265 K271 I272 E273S265-E269 VanDerWaalsContact CB-OE1 3.26Å; S265-E269 WeakPolarHBondContact CB-OE1 3.27Å; S265-E269 WeakPolarHBondContact O-CB 3.24Å; S265-E269 VanDerWaalsContact O-CD 3.28Å; S265-E269 VanDerWaalsContact O-CG 3.3Å; S265-E269 WeakPolarHBondContact O-CG 3.5Å; S265-E269 PolarHBondContact O-N 3.11Å; S265-E269 PolarHBondContact OG-OE1 3.44Å; E269-K271 VanDerWaalsContact C-N 3.32Å; E269-K271 PolarHBondContact O-N 3.41Å; E269-I272 WeakPolarHBondContact O-CB 3.26Å; E269-I272 PolarHBondContact O-N 2.96Å; E269-I272 VanDerWaalsContact O-N 3.11Å; E269-E273 PolarHBondContact O-N 2.94Å
270K95Very high85.5Confident127 Ų12795.2 Ų95.255%0.55252%0.521SS*.Hα-helixtrans-58.6-41.7173.5-178.5177.6176.8-176.80112.4S266 I272 E273 D274S266-K270 WeakPolarHBondContact O-CB 3.32Å; S266-K270 PolarHBondContact O-N 3.33Å; K270-I272 VanDerWaalsContact C-N 3.29Å; K270-I272 PolarHBondContact O-N 3.22Å; K270-E273 PolarHBondContact O-N 2.9Å; K270-D274 VanDerWaalsContact CE-OD2 3.23Å; K270-D274 WeakPolarHBondContact CE-OD2 3.35Å; K270-D274 WeakPolarHBondContact O-CB 3.41Å; K270-D274 VanDerWaalsContact O-CG 3.3Å; K270-D274 PolarHBondContact O-N 3.32Å
271K96Very high87.7Confident135 Ų13598.3 Ų98.359%0.58751%0.51SS*.Hα-helixtrans-66.1-31.5177.8-173.3172.4-179.5177.50112.4T267 L268 E269 L275T267-K271 VanDerWaalsContact O-CB 3.32Å; T267-K271 WeakPolarHBondContact O-CB 3.45Å; T267-K271 PolarHBondContact O-N 3.45Å; T267-K271 VanDerWaalsContact O-N 3.07Å; L268-K271 CarbonylContact O-C 3.55Å; L268-K271 PolarHBondContact O-N 3.43Å; L268-K271 VanDerWaalsContact O-N 3.13Å; E269-K271 VanDerWaalsContact C-N 3.32Å; E269-K271 PolarHBondContact O-N 3.41Å; K271-L275 HydrophobicContact CG-CD1 4.29Å; K271-L275 WeakPolarHBondContact O-CB 3.48Å; K271-L275 WeakPolarHBondContact O-CD1 3.45Å; K271-L275 VanDerWaalsContact O-CG 3.22Å; K271-L275 WeakPolarHBondContact O-CG 3.48Å; K271-L275 PolarHBondContact O-N 2.83Å
272I96.4Very high89.6Confident91 Ų9199.2 Ų99.247%0.46751%0.511SS..Hα-helixtrans-67.4-51.4171.9-69.6160.2000109.3L268 E269 K270 D274 L275 E276L268-I272 VanDerWaalsContact O-CG1 3.29Å; L268-I272 WeakPolarHBondContact O-CG1 3.43Å; L268-I272 PolarHBondContact O-N 3.05Å; E269-I272 WeakPolarHBondContact O-CB 3.26Å; E269-I272 PolarHBondContact O-N 2.96Å; E269-I272 VanDerWaalsContact O-N 3.11Å; K270-I272 VanDerWaalsContact C-N 3.29Å; K270-I272 PolarHBondContact O-N 3.22Å; I272-D274 VanDerWaalsContact C-N 3.29Å; I272-D274 PolarHBondContact O-N 2.91Å; I272-L275 PolarHBondContact O-N 3.07Å; I272-E276 HydrophobicContact CG2-CG 4.4Å; I272-E276 WeakPolarHBondContact O-CG 3.29Å; I272-E276 PolarHBondContact O-N 3.18Å
273E96.9Very high91.6Very high99 Ų9999.6 Ų99.646%0.46350%0.501SS..Hα-helixtrans-56.7-42.3176.7-64.6-177.7-162.500112.6E269 K270 L275 E276 K277E269-E273 PolarHBondContact O-N 2.94Å; K270-E273 PolarHBondContact O-N 2.9Å; E273-L275 VanDerWaalsContact C-N 3.35Å; E273-E276 PolarHBondContact O-N 3.01Å; E273-K277 VanDerWaalsContact CB-NZ 3.34Å; E273-K277 WeakPolarHBondContact O-CB 3.22Å; E273-K277 WeakPolarHBondContact O-CD 3.47Å; E273-K277 VanDerWaalsContact O-CE 3.26Å; E273-K277 WeakPolarHBondContact O-CE 3.29Å; E273-K277 WeakPolarHBondContact O-CG 3.35Å; E273-K277 PolarHBondContact O-N 2.99Å; E273-K277 IonicContact OE2-NZ 2.81Å; E273-K277 PolarHBondContact OE2-NZ 3.07Å
274D97Very high93.5Very high68 Ų68100.2 Ų100.236%0.36450%0.495SS..Hα-helixtrans-71.3-31.1-177.8-70.5-16000111.6K270 I272 K277 E278K270-D274 VanDerWaalsContact CE-OD2 3.23Å; K270-D274 WeakPolarHBondContact CE-OD2 3.35Å; K270-D274 WeakPolarHBondContact O-CB 3.41Å; K270-D274 VanDerWaalsContact O-CG 3.3Å; K270-D274 PolarHBondContact O-N 3.32Å; I272-D274 VanDerWaalsContact C-N 3.29Å; I272-D274 PolarHBondContact O-N 2.91Å; D274-K277 IonicContact OD1-NZ 2.76Å; D274-K277 PolarHBondContact OD1-NZ 3.07Å; D274-E278 PolarHBondContact O-N 3.15Å; D274-E278 VanDerWaalsContact O-N 3.12Å
275L98.2Very high95.2Very high101 Ų101102 Ų10253%0.52950%0.499SS..Hα-helixtrans-71.4-38.2168.3-75.2169000112.6K271 I272 E273 E278 V279K271-L275 HydrophobicContact CG-CD1 4.29Å; K271-L275 WeakPolarHBondContact O-CB 3.48Å; K271-L275 WeakPolarHBondContact O-CD1 3.45Å; K271-L275 VanDerWaalsContact O-CG 3.22Å; K271-L275 WeakPolarHBondContact O-CG 3.48Å; K271-L275 PolarHBondContact O-N 2.83Å; I272-L275 PolarHBondContact O-N 3.07Å; E273-L275 VanDerWaalsContact C-N 3.35Å; L275-E278 PolarHBondContact O-N 3.43Å; L275-V279 WeakPolarHBondContact O-CG2 3.32Å; L275-V279 PolarHBondContact O-N 3.39Å
276E97.2Very high96.2Very high122 Ų122103.8 Ų103.857%0.5750%0.504SS*.Hα-helixtrans-63.5-41.9174.8-73.8176.8168.500111.3I272 E273 E278 V279 V280I272-E276 HydrophobicContact CG2-CG 4.4Å; I272-E276 WeakPolarHBondContact O-CG 3.29Å; I272-E276 PolarHBondContact O-N 3.18Å; E273-E276 PolarHBondContact O-N 3.01Å; E276-E278 VanDerWaalsContact C-N 3.32Å; E276-E278 PolarHBondContact O-N 2.95Å; E276-V279 PolarHBondContact O-N 3.31Å; E276-V280 WeakPolarHBondContact O-CG2 3.49Å; E276-V280 PolarHBondContact O-N 2.96Å
277K98.4Very high97Very high90 Ų90104 Ų10439%0.39150%0.498SS..Hα-helixtrans-60-40.8172-68.3159.2-147.7159.80111.3E273 D274 V280 R281E273-K277 VanDerWaalsContact CB-NZ 3.34Å; E273-K277 WeakPolarHBondContact O-CB 3.22Å; E273-K277 WeakPolarHBondContact O-CD 3.47Å; E273-K277 VanDerWaalsContact O-CE 3.26Å; E273-K277 WeakPolarHBondContact O-CE 3.29Å; E273-K277 WeakPolarHBondContact O-CG 3.35Å; E273-K277 PolarHBondContact O-N 2.99Å; E273-K277 IonicContact OE2-NZ 2.81Å; E273-K277 PolarHBondContact OE2-NZ 3.07Å; D274-K277 IonicContact OD1-NZ 2.76Å; D274-K277 PolarHBondContact OD1-NZ 3.07Å; K277-V280 PolarHBondContact O-N 2.91Å; K277-R281 PolarHBondContact O-N 2.93Å; K277-R281 VanDerWaalsContact O-N 3.08Å
278E97.9Very high97.3Very high76 Ų76104.8 Ų104.836%0.35549%0.491SS..Hα-helixtrans-66.8-47.2176.5-16169.1-86.700112.1D274 L275 E276 V280 R281 E282D274-E278 PolarHBondContact O-N 3.15Å; D274-E278 VanDerWaalsContact O-N 3.12Å; L275-E278 PolarHBondContact O-N 3.43Å; E276-E278 VanDerWaalsContact C-N 3.32Å; E276-E278 PolarHBondContact O-N 2.95Å; E278-V280 PolarHBondContact O-N 3.22Å; E278-R281 CarbonylContact O-C 3.49Å; E278-R281 WeakPolarHBondContact O-CA 3.48Å; E278-R281 WeakPolarHBondContact O-CB 3.17Å; E278-R281 PolarHBondContact O-N 3.37Å; E278-R281 IonicContact OE1-CZ 3.11Å; E278-R281 VanDerWaalsContact OE1-CZ 3.23Å; E278-R281 IonicContact OE1-NE 2.7Å; E278-R281 PolarHBondContact OE1-NE 3.49Å; E278-R281 IonicContact OE1-NH2 2.58Å; E278-R281 PolarHBondContact OE1-NH2 2.94Å; E278-R281 IonicContact OE2-CZ 3.3Å; E278-R281 IonicContact OE2-NE 2.67Å; E278-R281 IonicContact OE2-NH2 3.82Å; E278-R281 PolarHBondContact OE2-NH2 3.25Å; E278-E282 HydrophobicContact CG-CG 4.43Å; E278-E282 PolarHBondContact O-N 3.25Å
279V98.5Very high97.6Very high56 Ų56104.4 Ų104.434%0.33949%0.489SS..Hα-helixtrans-59.7-32.4176.9170.10000111.9L275 E276 R283L275-V279 WeakPolarHBondContact O-CG2 3.32Å; L275-V279 PolarHBondContact O-N 3.39Å; E276-V279 PolarHBondContact O-N 3.31Å; V279-R283 WeakPolarHBondContact O-CB 3.45Å; V279-R283 WeakPolarHBondContact O-CD 3.46Å; V279-R283 WeakPolarHBondContact O-CG 3.36Å; V279-R283 PolarHBondContact O-N 3.11Å; V279-R283 VanDerWaalsContact O-N 3.09Å
280V98.6Very high97.9Very high90 Ų90102.3 Ų102.355%0.54548%0.482SS..Hα-helixtrans-69.2-43171.7171.90000111.7E276 K277 E278 R283 Q284E276-V280 WeakPolarHBondContact O-CG2 3.49Å; E276-V280 PolarHBondContact O-N 2.96Å; K277-V280 PolarHBondContact O-N 2.91Å; E278-V280 PolarHBondContact O-N 3.22Å; V280-R283 PolarHBondContact O-N 2.8Å; V280-Q284 WeakPolarHBondContact O-CB 3.31Å; V280-Q284 PolarHBondContact O-N 2.7Å
281R98.3Very high98.1Very high134 Ų134103.4 Ų103.451%0.50648%0.483SS..Hα-helixtrans-62.1-48.9174.5-73.8-166.6-66.7-109.16.6112.3K277 E278 R283 Q284 E285K277-R281 PolarHBondContact O-N 2.93Å; K277-R281 VanDerWaalsContact O-N 3.08Å; E278-R281 CarbonylContact O-C 3.49Å; E278-R281 WeakPolarHBondContact O-CA 3.48Å; E278-R281 WeakPolarHBondContact O-CB 3.17Å; E278-R281 PolarHBondContact O-N 3.37Å; E278-R281 IonicContact OE1-CZ 3.11Å; E278-R281 VanDerWaalsContact OE1-CZ 3.23Å; E278-R281 IonicContact OE1-NE 2.7Å; E278-R281 PolarHBondContact OE1-NE 3.49Å; E278-R281 IonicContact OE1-NH2 2.58Å; E278-R281 PolarHBondContact OE1-NH2 2.94Å; E278-R281 IonicContact OE2-CZ 3.3Å; E278-R281 IonicContact OE2-NE 2.67Å; E278-R281 IonicContact OE2-NH2 3.82Å; E278-R281 PolarHBondContact OE2-NH2 3.25Å; R281-R283 VanDerWaalsContact C-N 3.32Å; R281-R283 PolarHBondContact O-N 3.24Å; R281-Q284 PolarHBondContact O-N 2.93Å; R281-Q284 VanDerWaalsContact O-N 3.13Å; R281-E285 PolarHBondContact O-N 3.31Å
282E98.3Very high98.2Very high125 Ų125100.3 Ų100.358%0.58447%0.473SS*.Hα-helixtrans-58.9-41.7178-71.8-175.7156.400111.7E278 E285 N286E278-E282 HydrophobicContact CG-CG 4.43Å; E278-E282 PolarHBondContact O-N 3.25Å; E282-E285 PolarHBondContact O-N 3.07Å; E282-N286 WeakPolarHBondContact O-CB 3.5Å; E282-N286 PolarHBondContact O-N 3.24Å
283R98.4Very high98.3Very high181 Ų181100.8 Ų100.868%0.68347%0.474SS*.Hα-helixtrans-65.9-38.1175-75.4170.8179.5-176.71.6112.8V279 V280 R281 L287V279-R283 WeakPolarHBondContact O-CB 3.45Å; V279-R283 WeakPolarHBondContact O-CD 3.46Å; V279-R283 WeakPolarHBondContact O-CG 3.36Å; V279-R283 PolarHBondContact O-N 3.11Å; V279-R283 VanDerWaalsContact O-N 3.09Å; V280-R283 PolarHBondContact O-N 2.8Å; R281-R283 VanDerWaalsContact C-N 3.32Å; R281-R283 PolarHBondContact O-N 3.24Å; R283-L287 WeakPolarHBondContact O-CB 3.34Å; R283-L287 PolarHBondContact O-N 3.21Å
284Q98.6Very high98.4Very high141 Ų141101.2 Ų101.266%0.65948%0.476SS*.Hα-helixtrans-67.2-42.9176.4-178.1176.8-10.200111.6V280 R281 L287 R288V280-Q284 WeakPolarHBondContact O-CB 3.31Å; V280-Q284 PolarHBondContact O-N 2.7Å; R281-Q284 PolarHBondContact O-N 2.93Å; R281-Q284 VanDerWaalsContact O-N 3.13Å; Q284-L287 PolarHBondContact O-N 2.91Å; Q284-R288 PolarHBondContact O-N 3.44Å
285E98.1Very high98.5Very high75 Ų75102.4 Ų102.435%0.3548%0.482SS..Hα-helixtrans-70-39.3176.717854.9-162.600111.7R281 E282 L287 R288 L289R281-E285 PolarHBondContact O-N 3.31Å; E282-E285 PolarHBondContact O-N 3.07Å; E285-L287 VanDerWaalsContact C-N 3.3Å; E285-L287 PolarHBondContact O-N 3.33Å; E285-R288 VanDerWaalsContact CD-NE 3.32Å; E285-R288 WeakPolarHBondContact O-CA 3.42Å; E285-R288 WeakPolarHBondContact O-CB 3.39Å; E285-R288 PolarHBondContact O-N 3.04Å; E285-R288 IonicContact OE1-CZ 3.23Å; E285-R288 VanDerWaalsContact OE1-CZ 3.3Å; E285-R288 IonicContact OE1-NE 3.51Å; E285-R288 PolarHBondContact OE1-NE 3.48Å; E285-R288 VanDerWaalsContact OE1-NE 3.11Å; E285-R288 IonicContact OE1-NH2 3.33Å; E285-R288 PolarHBondContact OE1-NH2 3.27Å; E285-R288 WeakPolarHBondContact OE2-CD 3.5Å; E285-R288 IonicContact OE2-CZ 2.72Å; E285-R288 IonicContact OE2-NE 2.8Å; E285-R288 PolarHBondContact OE2-NE 2.95Å; E285-R288 IonicContact OE2-NH2 2.67Å; E285-L289 HydrophobicContact CG-CD1 4.17Å; E285-L289 HydrophobicContact CG-CG 4.43Å; E285-L289 WeakPolarHBondContact O-CG 3.48Å; E285-L289 PolarHBondContact O-N 2.86Å; E285-L289 WeakPolarHBondContact OE1-CG 3.12Å
286N98.4Very high98.5Very high101 Ų101103.6 Ų103.654%0.5448%0.483SS..Hα-helixtrans-58-43.1172.5-170.5-84.6000111.4E282 R288 L289 V290E282-N286 WeakPolarHBondContact O-CB 3.5Å; E282-N286 PolarHBondContact O-N 3.24Å; N286-R288 VanDerWaalsContact C-N 3.32Å; N286-R288 PolarHBondContact O-N 3.26Å; N286-L289 PolarHBondContact O-N 3.4Å; N286-V290 WeakPolarHBondContact O-CG2 3.47Å; N286-V290 PolarHBondContact O-N 2.81Å
287L98.8Very high98.6Very high89 Ų89103.3 Ų103.347%0.46648%0.482SS..Hα-helixtrans-63.3-35.1173.7-178.463.4000112.8R283 Q284 E285 R291R283-L287 WeakPolarHBondContact O-CB 3.34Å; R283-L287 PolarHBondContact O-N 3.21Å; Q284-L287 PolarHBondContact O-N 2.91Å; E285-L287 VanDerWaalsContact C-N 3.3Å; E285-L287 PolarHBondContact O-N 3.33Å; L287-R291 WeakPolarHBondContact O-CG 3.25Å; L287-R291 PolarHBondContact O-N 2.93Å
288R98.8Very high98.6Very high109 Ų109104.4 Ų104.441%0.41149%0.488SS..Hα-helixtrans-66.7-43.5173.6-166-165.169.780.82.8111.4Q284 E285 N286 R291 L292Q284-R288 PolarHBondContact O-N 3.44Å; E285-R288 VanDerWaalsContact CD-NE 3.32Å; E285-R288 WeakPolarHBondContact O-CA 3.42Å; E285-R288 WeakPolarHBondContact O-CB 3.39Å; E285-R288 PolarHBondContact O-N 3.04Å; E285-R288 IonicContact OE1-CZ 3.23Å; E285-R288 VanDerWaalsContact OE1-CZ 3.3Å; E285-R288 IonicContact OE1-NE 3.51Å; E285-R288 PolarHBondContact OE1-NE 3.48Å; E285-R288 VanDerWaalsContact OE1-NE 3.11Å; E285-R288 IonicContact OE1-NH2 3.33Å; E285-R288 PolarHBondContact OE1-NH2 3.27Å; E285-R288 WeakPolarHBondContact OE2-CD 3.5Å; E285-R288 IonicContact OE2-CZ 2.72Å; E285-R288 IonicContact OE2-NE 2.8Å; E285-R288 PolarHBondContact OE2-NE 2.95Å; E285-R288 IonicContact OE2-NH2 2.67Å; N286-R288 VanDerWaalsContact C-N 3.32Å; N286-R288 PolarHBondContact O-N 3.26Å; R288-R291 PolarHBondContact O-N 3.47Å; R288-L292 WeakPolarHBondContact O-CB 3.29Å; R288-L292 PolarHBondContact O-N 3.12Å
289L98.8Very high98.6Very high84 Ų84105.7 Ų105.744%0.4450%0.496SS..Hα-helixtrans-66-40.7177.8-68.8170.5000112.1E285 N286 R291 L292 M293E285-L289 HydrophobicContact CG-CD1 4.17Å; E285-L289 HydrophobicContact CG-CG 4.43Å; E285-L289 WeakPolarHBondContact O-CG 3.48Å; E285-L289 PolarHBondContact O-N 2.86Å; E285-L289 WeakPolarHBondContact OE1-CG 3.12Å; N286-L289 PolarHBondContact O-N 3.4Å; L289-R291 PolarHBondContact O-N 3.04Å; L289-L292 PolarHBondContact O-N 3.03Å; L289-M293 WeakPolarHBondContact O-CB 3.39Å; L289-M293 PolarHBondContact O-N 2.78Å
290V98.8Very high98.7Very high54 Ų54107.3 Ų107.333%0.32750%0.501SS..Hα-helixtrans-62-41.7175.4167.90000111.5N286 M293 Q294N286-V290 WeakPolarHBondContact O-CG2 3.47Å; N286-V290 PolarHBondContact O-N 2.81Å; V290-M293 WeakPolarHBondContact O-CB 3.39Å; V290-M293 PolarHBondContact O-N 3.04Å; V290-Q294 WeakPolarHBondContact O-CG 3.2Å; V290-Q294 PolarHBondContact O-N 3.22Å
291R98.8Very high98.7Very high150 Ų150104.3 Ų104.357%0.56649%0.489SS*.Hα-helixtrans-64.1-48.3174-71.3173.9-177.5176.41111.8L287 R288 L289 M293 Q294 D295L287-R291 WeakPolarHBondContact O-CG 3.25Å; L287-R291 PolarHBondContact O-N 2.93Å; R288-R291 PolarHBondContact O-N 3.47Å; L289-R291 PolarHBondContact O-N 3.04Å; R291-M293 PolarHBondContact O-N 3.13Å; R291-Q294 WeakPolarHBondContact O-CB 3.49Å; R291-Q294 PolarHBondContact O-N 3.2Å; R291-D295 VanDerWaalsContact O-CG 3.24Å; R291-D295 PolarHBondContact O-N 3.31Å
292L98.8Very high98.7Very high71 Ų71102.9 Ų102.937%0.37249%0.486SS..Hα-helixtrans-59.7-33.9177.1-179.660.9000112.1R288 L289 K296R288-L292 WeakPolarHBondContact O-CB 3.29Å; R288-L292 PolarHBondContact O-N 3.12Å; L289-L292 PolarHBondContact O-N 3.03Å; L292-K296 WeakPolarHBondContact O-CG 3.46Å; L292-K296 PolarHBondContact O-N 3.33Å; L292-K296 VanDerWaalsContact O-N 3.16Å
293M98.8Very high98.7Very high101 Ų101101.8 Ų101.850%0.49848%0.484SS..Hα-helixtrans-65.4-46.9173.2-171.9179.177.600111.2L289 V290 R291 D295 K296 E297L289-M293 WeakPolarHBondContact O-CB 3.39Å; L289-M293 PolarHBondContact O-N 2.78Å; V290-M293 WeakPolarHBondContact O-CB 3.39Å; V290-M293 PolarHBondContact O-N 3.04Å; R291-M293 PolarHBondContact O-N 3.13Å; M293-D295 PolarHBondContact O-N 2.79Å; M293-K296 PolarHBondContact O-N 3.46Å; M293-K296 VanDerWaalsContact O-N 3.14Å; M293-E297 WeakPolarHBondContact O-CG 3.21Å; M293-E297 PolarHBondContact O-N 3.49Å
294Q98.9Very high98.7Very high107 Ų10799.1 Ų99.150%0.548%0.477SS..Hα-helixtrans-60.8-43.8175.7-70.7170.9-25.900112.2V290 R291 K296 E297 E298V290-Q294 WeakPolarHBondContact O-CG 3.2Å; V290-Q294 PolarHBondContact O-N 3.22Å; R291-Q294 WeakPolarHBondContact O-CB 3.49Å; R291-Q294 PolarHBondContact O-N 3.2Å; Q294-K296 PolarHBondContact O-N 2.88Å; Q294-E297 PolarHBondContact O-N 3.11Å; Q294-E297 VanDerWaalsContact O-N 3.16Å; Q294-E298 PolarHBondContact O-N 3.31Å
295D98.8Very high98.7Very high93 Ų9398.3 Ų98.350%0.49747%0.474SS..Hα-helixtrans-59-35.2175.3-60.4-28.4000111.8R291 M293 M299R291-D295 VanDerWaalsContact O-CG 3.24Å; R291-D295 PolarHBondContact O-N 3.31Å; M293-D295 PolarHBondContact O-N 2.79Å; D295-M299 WeakPolarHBondContact O-CB 3.16Å; D295-M299 PolarHBondContact O-N 3Å
296K98.8Very high98.8Very high127 Ų12799.9 Ų99.955%0.55248%0.481SS*.Hα-helixtrans-76.9-37.1176.4-66.8-69.1178-175.80112.1L292 M293 Q294 M299 I300L292-K296 WeakPolarHBondContact O-CG 3.46Å; L292-K296 PolarHBondContact O-N 3.33Å; L292-K296 VanDerWaalsContact O-N 3.16Å; M293-K296 PolarHBondContact O-N 3.46Å; M293-K296 VanDerWaalsContact O-N 3.14Å; Q294-K296 PolarHBondContact O-N 2.88Å; K296-M299 PolarHBondContact O-N 3.41Å; K296-I300 WeakPolarHBondContact O-CB 3.5Å; K296-I300 WeakPolarHBondContact O-CD1 3.44Å; K296-I300 WeakPolarHBondContact O-CG1 3.49Å; K296-I300 PolarHBondContact O-N 2.98Å
297E98.8Very high98.8Very high116 Ų11699.6 Ų99.654%0.54248%0.478SS..Hα-helixtrans-63.2-42.5173.5-73.1174.4162.500111.4M293 Q294 I300 G301M293-E297 WeakPolarHBondContact O-CG 3.21Å; M293-E297 PolarHBondContact O-N 3.49Å; Q294-E297 PolarHBondContact O-N 3.11Å; Q294-E297 VanDerWaalsContact O-N 3.16Å; E297-I300 PolarHBondContact O-N 3.17Å; E297-G301 PolarHBondContact O-N 3.02Å
298E98.8Very high98.8Very high112 Ų11299.3 Ų99.352%0.52348%0.477SS..Hα-helixtrans-62.6-42.8173.8-169.1-171.4151.900111.7Q294 G301 K302Q294-E298 PolarHBondContact O-N 3.31Å; E298-G301 PolarHBondContact O-N 2.81Å; E298-K302 PolarHBondContact O-N 3.32Å; E298-K302 VanDerWaalsContact O-N 3.08Å; E298-K302 VanDerWaalsContact OE1-CE 3.26Å; E298-K302 WeakPolarHBondContact OE1-CE 3.5Å; E298-K302 IonicContact OE1-NZ 3.48Å; E298-K302 PolarHBondContact OE1-NZ 2.8Å
299M98.8Very high98.8Very high103 Ų10397.8 Ų97.851%0.50748%0.477SS..Hα-helixtrans-63.1-41.2175.4-169.264.161.300112.1D295 K296 G301 K302 L303D295-M299 WeakPolarHBondContact O-CB 3.16Å; D295-M299 PolarHBondContact O-N 3Å; K296-M299 PolarHBondContact O-N 3.41Å; M299-G301 VanDerWaalsContact C-N 3.31Å; M299-G301 PolarHBondContact O-N 2.87Å; M299-K302 PolarHBondContact O-N 2.88Å; M299-L303 HydrophobicContact CG-CD1 4.17Å; M299-L303 WeakPolarHBondContact O-CB 3Å; M299-L303 VanDerWaalsContact O-CG 3.29Å; M299-L303 WeakPolarHBondContact O-CG 3.17Å; M299-L303 PolarHBondContact O-N 2.92Å
300I98.8Very high98.8Very high90 Ų9098.3 Ų98.346%0.46248%0.48SS..Hα-helixtrans-65.5-35175.4-71.9163.1000111K296 E297 K304K296-I300 WeakPolarHBondContact O-CB 3.5Å; K296-I300 WeakPolarHBondContact O-CD1 3.44Å; K296-I300 WeakPolarHBondContact O-CG1 3.49Å; K296-I300 PolarHBondContact O-N 2.98Å; E297-I300 PolarHBondContact O-N 3.17Å; I300-K304 HydrophobicContact CG2-CD 4.34Å; I300-K304 VanDerWaalsContact O-CG 3.32Å; I300-K304 WeakPolarHBondContact O-CG 3.43Å; I300-K304 PolarHBondContact O-N 3.23Å; I300-K304 VanDerWaalsContact O-N 3.14Å
301G98.8Very high98.8Very high27 Ų2799.7 Ų99.728%0.27849%0.485SS..Hα-helixtrans-58.6-57.1171.900000111.8E297 E298 M299 L303 K304 E305E297-G301 PolarHBondContact O-N 3.02Å; E298-G301 PolarHBondContact O-N 2.81Å; M299-G301 VanDerWaalsContact C-N 3.31Å; M299-G301 PolarHBondContact O-N 2.87Å; G301-L303 VanDerWaalsContact C-N 3.3Å; G301-L303 PolarHBondContact O-N 3.39Å; G301-K304 WeakPolarHBondContact O-CB 3.37Å; G301-K304 PolarHBondContact O-N 3.03Å; G301-E305 PolarHBondContact O-N 3.24Å
302K98.9Very high98.8Very high105 Ų10598.5 Ų98.546%0.45748%0.481SS..Hα-helixtrans-59.4-38.1-180-67.5171.2-173.7170.30113.2E298 M299 K304 E305 E306E298-K302 PolarHBondContact O-N 3.32Å; E298-K302 VanDerWaalsContact O-N 3.08Å; E298-K302 VanDerWaalsContact OE1-CE 3.26Å; E298-K302 WeakPolarHBondContact OE1-CE 3.5Å; E298-K302 IonicContact OE1-NZ 3.48Å; E298-K302 PolarHBondContact OE1-NZ 2.8Å; M299-K302 PolarHBondContact O-N 2.88Å; K302-K304 VanDerWaalsContact C-N 3.32Å; K302-K304 PolarHBondContact O-N 3.48Å; K302-E305 PolarHBondContact O-N 3.18Å; K302-E306 WeakPolarHBondContact O-CB 3.3Å; K302-E306 PolarHBondContact O-N 3.09Å
303L98.9Very high98.8Very high101 Ų10199.3 Ų99.353%0.52949%0.485SS..Hα-helixtrans-68.9-28.5176.6-71.4170.9000112.9M299 G301 I307M299-L303 HydrophobicContact CG-CD1 4.17Å; M299-L303 WeakPolarHBondContact O-CB 3Å; M299-L303 VanDerWaalsContact O-CG 3.29Å; M299-L303 WeakPolarHBondContact O-CG 3.17Å; M299-L303 PolarHBondContact O-N 2.92Å; G301-L303 VanDerWaalsContact C-N 3.3Å; G301-L303 PolarHBondContact O-N 3.39Å; L303-I307 WeakPolarHBondContact O-CD1 3.36Å; L303-I307 VanDerWaalsContact O-CG1 3.22Å; L303-I307 WeakPolarHBondContact O-CG1 3.36Å; L303-I307 PolarHBondContact O-N 2.93Å
304K98.8Very high98.8Very high125 Ų12598.7 Ų98.754%0.54348%0.483SS..Hα-helixtrans-72.6-43.9170.4-71.4167.6179.2178.10111.5I300 G301 K302 E306 I307 D308I300-K304 HydrophobicContact CG2-CD 4.34Å; I300-K304 VanDerWaalsContact O-CG 3.32Å; I300-K304 WeakPolarHBondContact O-CG 3.43Å; I300-K304 PolarHBondContact O-N 3.23Å; I300-K304 VanDerWaalsContact O-N 3.14Å; G301-K304 WeakPolarHBondContact O-CB 3.37Å; G301-K304 PolarHBondContact O-N 3.03Å; K302-K304 VanDerWaalsContact C-N 3.32Å; K302-K304 PolarHBondContact O-N 3.48Å; K304-E306 VanDerWaalsContact C-N 3.29Å; K304-E306 PolarHBondContact O-N 2.8Å; K304-I307 PolarHBondContact O-N 2.95Å; K304-I307 VanDerWaalsContact O-N 3.13Å; K304-D308 WeakPolarHBondContact O-CB 3.49Å; K304-D308 PolarHBondContact O-N 2.81Å
305E98.8Very high98.8Very high125 Ų12598.1 Ų98.158%0.58448%0.484SS*.Hα-helixtrans-58.3-41.6176.7-68.7170177.200111.8G301 K302 D308 L309G301-E305 PolarHBondContact O-N 3.24Å; K302-E305 PolarHBondContact O-N 3.18Å; E305-D308 PolarHBondContact O-N 3.14Å; E305-L309 WeakPolarHBondContact O-CB 3.12Å; E305-L309 WeakPolarHBondContact O-CD1 3.24Å; E305-L309 WeakPolarHBondContact O-CG 3.24Å; E305-L309 PolarHBondContact O-N 2.85Å
306E98.8Very high98.8Very high108 Ų10899.2 Ų99.251%0.50549%0.49SS..Hα-helixtrans-64.1-43173.4-172.776.7174.500112.3K302 K304 L309 L310K302-E306 WeakPolarHBondContact O-CB 3.3Å; K302-E306 PolarHBondContact O-N 3.09Å; K304-E306 VanDerWaalsContact C-N 3.29Å; K304-E306 PolarHBondContact O-N 2.8Å; E306-L309 WeakPolarHBondContact O-CB 3.16Å; E306-L309 PolarHBondContact O-N 2.79Å; E306-L310 HydrophobicContact CG-CD1 4.09Å; E306-L310 WeakPolarHBondContact O-CB 3.24Å; E306-L310 VanDerWaalsContact O-CG 3.31Å; E306-L310 WeakPolarHBondContact O-CG 3.42Å; E306-L310 PolarHBondContact O-N 2.82Å
307I98.9Very high98.8Very high94 Ų9498.2 Ų98.248%0.48249%0.489SS..Hα-helixtrans-62.9-44.3175.2-73.3165.1000110.7L303 K304 L309 L310 N311L303-I307 WeakPolarHBondContact O-CD1 3.36Å; L303-I307 VanDerWaalsContact O-CG1 3.22Å; L303-I307 WeakPolarHBondContact O-CG1 3.36Å; L303-I307 PolarHBondContact O-N 2.93Å; K304-I307 PolarHBondContact O-N 2.95Å; K304-I307 VanDerWaalsContact O-N 3.13Å; I307-L309 VanDerWaalsContact C-N 3.27Å; I307-L309 PolarHBondContact O-N 2.75Å; I307-L310 PolarHBondContact O-N 2.89Å; I307-N311 WeakPolarHBondContact O-CB 3.42Å; I307-N311 PolarHBondContact O-N 3.23Å; I307-N311 PolarHBondContact O-ND2 3.19Å; I307-N311 VanDerWaalsContact O-ND2 3.11Å
308D98.8Very high98.8Very high83 Ų8398.6 Ų98.644%0.44449%0.491SS..Hα-helixtrans-67.7-27.6179.1-67.6-22000112.1K304 E305 R312K304-D308 WeakPolarHBondContact O-CB 3.49Å; K304-D308 PolarHBondContact O-N 2.81Å; E305-D308 PolarHBondContact O-N 3.14Å; D308-R312 VanDerWaalsContact C-NH2 3.28Å; D308-R312 PolarHBondContact O-NE 3.44Å; D308-R312 VanDerWaalsContact O-NE 3.07Å; D308-R312 PolarHBondContact O-NH2 3.45Å; D308-R312 VanDerWaalsContact O-NH2 3.07Å
309L98.8Very high98.8Very high78 Ų7899.2 Ų99.241%0.40850%0.498SS..Hα-helixtrans-69.4-55.4168.7-79.7158.7000111.2E305 E306 I307 N311 R312 D313E305-L309 WeakPolarHBondContact O-CB 3.12Å; E305-L309 WeakPolarHBondContact O-CD1 3.24Å; E305-L309 WeakPolarHBondContact O-CG 3.24Å; E305-L309 PolarHBondContact O-N 2.85Å; E306-L309 WeakPolarHBondContact O-CB 3.16Å; E306-L309 PolarHBondContact O-N 2.79Å; I307-L309 VanDerWaalsContact C-N 3.27Å; I307-L309 PolarHBondContact O-N 2.75Å; L309-N311 PolarHBondContact O-N 3.3Å; L309-R312 VanDerWaalsContact CD2-NH1 3.35Å; L309-R312 PolarHBondContact O-N 2.95Å; L309-D313 PolarHBondContact O-N 3.45Å
310L98.8Very high98.8Very high95 Ų95100 Ų10050%0.49750%0.5SS..Hα-helixtrans-61.1-29.6-178.4-69.5170.5000113.3E306 I307 L314E306-L310 HydrophobicContact CG-CD1 4.09Å; E306-L310 WeakPolarHBondContact O-CB 3.24Å; E306-L310 VanDerWaalsContact O-CG 3.31Å; E306-L310 WeakPolarHBondContact O-CG 3.42Å; E306-L310 PolarHBondContact O-N 2.82Å; I307-L310 PolarHBondContact O-N 2.89Å; L310-L314 VanDerWaalsContact O-CB 3.32Å; L310-L314 WeakPolarHBondContact O-CB 3.28Å; L310-L314 PolarHBondContact O-N 3.39Å
311N98.8Very high98.8Very high82 Ų8299.7 Ų99.744%0.43950%0.5SS..Hα-helixtrans-67-42171.9-70.8-30000111.8I307 L309 L314 D315I307-N311 WeakPolarHBondContact O-CB 3.42Å; I307-N311 PolarHBondContact O-N 3.23Å; I307-N311 PolarHBondContact O-ND2 3.19Å; I307-N311 VanDerWaalsContact O-ND2 3.11Å; L309-N311 PolarHBondContact O-N 3.3Å; N311-L314 WeakPolarHBondContact O-CB 3.35Å; N311-L314 PolarHBondContact O-N 3.34Å; N311-D315 VanDerWaalsContact O-CG 3.3Å; N311-D315 PolarHBondContact O-N 2.8Å
312R98.8Very high98.8Very high126 Ų126102.1 Ų102.148%0.47550%0.504SS..Hα-helixtrans-68.6-41.6176.9-76.2178.7-106.4107.60.6112D308 L309 L314 D315 D316D308-R312 VanDerWaalsContact C-NH2 3.28Å; D308-R312 PolarHBondContact O-NE 3.44Å; D308-R312 VanDerWaalsContact O-NE 3.07Å; D308-R312 PolarHBondContact O-NH2 3.45Å; D308-R312 VanDerWaalsContact O-NH2 3.07Å; L309-R312 VanDerWaalsContact CD2-NH1 3.35Å; L309-R312 PolarHBondContact O-N 2.95Å; R312-L314 PolarHBondContact O-N 2.87Å; R312-D315 PolarHBondContact O-N 2.85Å; R312-D316 PolarHBondContact O-N 3.42Å
313D98.8Very high98.8Very high87 Ų87102.6 Ų102.647%0.46551%0.508SS..Hα-helixtrans-60.1-32.8172.9-68.45.8000111.3L309 I317L309-D313 PolarHBondContact O-N 3.45Å; D313-I317 WeakPolarHBondContact O-CB 3.27Å; D313-I317 VanDerWaalsContact O-CD1 3.29Å; D313-I317 WeakPolarHBondContact O-CD1 3.42Å; D313-I317 WeakPolarHBondContact O-CG1 3.46Å; D313-I317 PolarHBondContact O-N 3.05Å
314L98.8Very high98.8Very high88 Ų88101.1 Ų101.146%0.46150%0.5SS..Hα-helixtrans-73.4-45.1175.1-174.7151.9000112L310 N311 R312 D316 I317 E318L310-L314 VanDerWaalsContact O-CB 3.32Å; L310-L314 WeakPolarHBondContact O-CB 3.28Å; L310-L314 PolarHBondContact O-N 3.39Å; N311-L314 WeakPolarHBondContact O-CB 3.35Å; N311-L314 PolarHBondContact O-N 3.34Å; R312-L314 PolarHBondContact O-N 2.87Å; L314-D316 PolarHBondContact O-N 3.4Å; L314-I317 PolarHBondContact O-N 3.39Å; L314-E318 HydrophobicContact CD2-CG 4.15Å; L314-E318 PolarHBondContact O-N 2.82Å
315D98.8Very high98.8Very high96 Ų96100 Ų10051%0.51350%0.495SS..Hα-helixtrans-57-48.1175.1-67.5-30.3000110.8N311 R312 I317 E318 D319N311-D315 VanDerWaalsContact O-CG 3.3Å; N311-D315 PolarHBondContact O-N 2.8Å; R312-D315 PolarHBondContact O-N 2.85Å; D315-I317 VanDerWaalsContact C-N 3.31Å; D315-I317 PolarHBondContact O-N 3.39Å; D315-E318 PolarHBondContact O-N 3.3Å; D315-E318 VanDerWaalsContact O-N 3.15Å; D315-D319 PolarHBondContact O-N 2.97Å
316D98.8Very high98.8Very high116 Ų11699.1 Ų99.162%0.6249%0.491SS*.Hα-helixtrans-59.6-38.9177.4-79.1-13.1000112R312 L314 E320R312-D316 PolarHBondContact O-N 3.42Å; L314-D316 PolarHBondContact O-N 3.4Å; D316-E320 PolarHBondContact O-N 2.96Å
317I98.8Very high98.8Very high106 Ų10698.2 Ų98.254%0.54449%0.487SS..Hα-helixtrans-71.1-34.6176.6-73.3168.2000111.9D313 L314 D315 N321D313-I317 WeakPolarHBondContact O-CB 3.27Å; D313-I317 VanDerWaalsContact O-CD1 3.29Å; D313-I317 WeakPolarHBondContact O-CD1 3.42Å; D313-I317 WeakPolarHBondContact O-CG1 3.46Å; D313-I317 PolarHBondContact O-N 3.05Å; L314-I317 PolarHBondContact O-N 3.39Å; D315-I317 VanDerWaalsContact C-N 3.31Å; D315-I317 PolarHBondContact O-N 3.39Å; I317-N321 WeakPolarHBondContact O-CB 3.48Å; I317-N321 PolarHBondContact O-N 3.29Å
318E98.8Very high98.7Very high124 Ų12498.5 Ų98.558%0.57949%0.489SS*.Hα-helixtrans-67.6-39.6175.4-72-158.8172.400111.7L314 D315 N321 E322L314-E318 HydrophobicContact CD2-CG 4.15Å; L314-E318 PolarHBondContact O-N 2.82Å; D315-E318 PolarHBondContact O-N 3.3Å; D315-E318 VanDerWaalsContact O-N 3.15Å; E318-N321 PolarHBondContact O-N 2.74Å; E318-E322 PolarHBondContact O-N 3.25Å
319D98.8Very high98.7Very high125 Ų125102.1 Ų102.167%0.66850%0.501SS*.Hα-helixtrans-66.6-46.3175-100.52.2000112.3D315 N321 E322 Q323D315-D319 PolarHBondContact O-N 2.97Å; D319-N321 VanDerWaalsContact C-N 3.31Å; D319-N321 PolarHBondContact O-N 2.81Å; D319-E322 PolarHBondContact O-N 3.43Å; D319-Q323 PolarHBondContact O-N 2.82Å
320E98.7Very high98.7Very high119 Ų119102.4 Ų102.456%0.55651%0.506SS*.Hα-helixtrans-58.9-44.7174.5-173.1-171.7179.300110.9D316 E322 Q323 L324D316-E320 PolarHBondContact O-N 2.96Å; E320-E322 VanDerWaalsContact C-N 3.35Å; E320-E322 PolarHBondContact O-N 2.94Å; E320-Q323 WeakPolarHBondContact O-CB 3.41Å; E320-Q323 PolarHBondContact O-N 3.29Å; E320-L324 HydrophobicContact CG-CD1 4.04Å; E320-L324 HydrophobicContact CG-CG 4.41Å; E320-L324 WeakPolarHBondContact O-CB 3.41Å; E320-L324 WeakPolarHBondContact O-CG 3.45Å; E320-L324 PolarHBondContact O-N 3.05Å
321N98.7Very high98.7Very high84 Ų84103 Ų10345%0.44951%0.51SS..Hα-helixtrans-63.4-40.5-179.9-170.5-13.8000111.2I317 E318 D319 L324 K325I317-N321 WeakPolarHBondContact O-CB 3.48Å; I317-N321 PolarHBondContact O-N 3.29Å; E318-N321 PolarHBondContact O-N 2.74Å; D319-N321 VanDerWaalsContact C-N 3.31Å; D319-N321 PolarHBondContact O-N 2.81Å; N321-L324 PolarHBondContact O-N 3.08Å; N321-K325 VanDerWaalsContact C-CE 3.48Å; N321-K325 WeakPolarHBondContact O-CB 3.28Å; N321-K325 WeakPolarHBondContact O-CE 3.44Å; N321-K325 WeakPolarHBondContact O-CG 3.36Å; N321-K325 PolarHBondContact O-N 3.39Å; N321-K325 WeakPolarHBondContact OD1-CE 3.43Å
322E98.8Very high98.7Very high77 Ų77105.3 Ų105.336%0.3652%0.521SS..Hα-helixtrans-68.8-37.1174.5-172.652.6-144.400113E318 D319 E320 K325 Q326E318-E322 PolarHBondContact O-N 3.25Å; D319-E322 PolarHBondContact O-N 3.43Å; E320-E322 VanDerWaalsContact C-N 3.35Å; E320-E322 PolarHBondContact O-N 2.94Å; E322-K325 WeakPolarHBondContact O-CB 3.25Å; E322-K325 PolarHBondContact O-N 3.48Å; E322-K325 WeakPolarHBondContact OE2-CD 3.5Å; E322-K325 WeakPolarHBondContact OE2-CE 3.45Å; E322-K325 IonicContact OE2-NZ 3.81Å; E322-K325 PolarHBondContact OE2-NZ 2.84Å; E322-Q326 WeakPolarHBondContact O-CG 3.43Å; E322-Q326 PolarHBondContact O-N 3.33Å; E322-Q326 PolarHBondContact OE1-NE2 3.09Å
323Q98.8Very high98.7Very high115 Ų115106.1 Ų106.154%0.53753%0.528SS..Hα-helixtrans-57.9-51.1168.4178.8-179.7-30.100110.7D319 E320 K325 Q326 E327D319-Q323 PolarHBondContact O-N 2.82Å; E320-Q323 WeakPolarHBondContact O-CB 3.41Å; E320-Q323 PolarHBondContact O-N 3.29Å; Q323-K325 VanDerWaalsContact C-N 3.29Å; Q323-K325 PolarHBondContact O-N 2.78Å; Q323-Q326 WeakPolarHBondContact O-CA 3.37Å; Q323-Q326 WeakPolarHBondContact O-CB 3.41Å; Q323-Q326 PolarHBondContact O-N 3.01Å; Q323-E327 HydrophobicContact CG-CG 4.43Å; Q323-E327 PolarHBondContact NE2-OE1 3.22Å; Q323-E327 PolarHBondContact O-N 2.83Å
324L98.8Very high98.6Very high70 Ų70105.2 Ų105.237%0.36653%0.526SS..Hα-helixtrans-61.3-35.3179.2-71.1171.8000112.3E320 N321 N328E320-L324 HydrophobicContact CG-CD1 4.04Å; E320-L324 HydrophobicContact CG-CG 4.41Å; E320-L324 WeakPolarHBondContact O-CB 3.41Å; E320-L324 WeakPolarHBondContact O-CG 3.45Å; E320-L324 PolarHBondContact O-N 3.05Å; N321-L324 PolarHBondContact O-N 3.08Å; L324-N328 VanDerWaalsContact O-CB 3.3Å; L324-N328 WeakPolarHBondContact O-CB 3.5Å; L324-N328 PolarHBondContact O-N 2.96Å; L324-N328 PolarHBondContact O-ND2 2.9Å
325K98.8Very high98.6Very high101 Ų101104.9 Ų104.944%0.43953%0.527SS..Hα-helixtrans-61.5-42.7170.8-82.8171.6-98.9149.20111.6N321 E322 Q323 K329N321-K325 VanDerWaalsContact C-CE 3.48Å; N321-K325 WeakPolarHBondContact O-CB 3.28Å; N321-K325 WeakPolarHBondContact O-CE 3.44Å; N321-K325 WeakPolarHBondContact O-CG 3.36Å; N321-K325 PolarHBondContact O-N 3.39Å; N321-K325 WeakPolarHBondContact OD1-CE 3.43Å; E322-K325 WeakPolarHBondContact O-CB 3.25Å; E322-K325 PolarHBondContact O-N 3.48Å; E322-K325 WeakPolarHBondContact OE2-CD 3.5Å; E322-K325 WeakPolarHBondContact OE2-CE 3.45Å; E322-K325 IonicContact OE2-NZ 3.81Å; E322-K325 PolarHBondContact OE2-NZ 2.84Å; Q323-K325 VanDerWaalsContact C-N 3.29Å; Q323-K325 PolarHBondContact O-N 2.78Å; K325-K329 WeakPolarHBondContact O-CB 3.49Å; K325-K329 PolarHBondContact O-N 3.08Å
326Q98.8Very high98.5Very high107 Ų107101.1 Ų101.150%0.551%0.511SS..Hα-helixtrans-71.2-37.2179-68.1177.238.900112.9E322 Q323 T330E322-Q326 WeakPolarHBondContact O-CG 3.43Å; E322-Q326 PolarHBondContact O-N 3.33Å; E322-Q326 PolarHBondContact OE1-NE2 3.09Å; Q323-Q326 WeakPolarHBondContact O-CA 3.37Å; Q323-Q326 WeakPolarHBondContact O-CB 3.41Å; Q323-Q326 PolarHBondContact O-N 3.01Å; Q326-T330 WeakPolarHBondContact O-CB 3.17Å; Q326-T330 PolarHBondContact O-N 3.5Å; Q326-T330 PolarHBondContact O-OG1 2.96Å
327E98.4Very high98.4Very high90 Ų90101.5 Ų101.542%0.42151%0.509SS..Hα-helixtrans-64.9-51.3172.4-71.9-175.3-162.500111.4Q323 K329 T330 L331Q323-E327 HydrophobicContact CG-CG 4.43Å; Q323-E327 PolarHBondContact NE2-OE1 3.22Å; Q323-E327 PolarHBondContact O-N 2.83Å; E327-K329 VanDerWaalsContact C-N 3.31Å; E327-K329 PolarHBondContact O-N 2.88Å; E327-T330 CarbonylContact O-C 3.59Å; E327-T330 WeakPolarHBondContact O-CA 3.41Å; E327-T330 WeakPolarHBondContact O-CB 3.26Å; E327-T330 PolarHBondContact O-N 2.76Å; E327-L331 WeakPolarHBondContact O-CG 3.46Å; E327-L331 PolarHBondContact O-N 3.27Å
328N98.5Very high98.3Very high100 Ų100103.2 Ų103.254%0.53552%0.518SS..Hα-helixtrans-59-40.8177.1-82.2-69.8000112.5L324 T330 L331 L332L324-N328 VanDerWaalsContact O-CB 3.3Å; L324-N328 WeakPolarHBondContact O-CB 3.5Å; L324-N328 PolarHBondContact O-N 2.96Å; L324-N328 PolarHBondContact O-ND2 2.9Å; N328-T330 VanDerWaalsContact C-N 3.27Å; N328-T330 PolarHBondContact O-N 3.02Å; N328-L331 PolarHBondContact O-N 3.39Å; N328-L332 VanDerWaalsContact O-CB 3.28Å; N328-L332 WeakPolarHBondContact O-CB 3.5Å; N328-L332 PolarHBondContact O-N 2.99Å
329K98.7Very high98.1Very high158 Ų158102.3 Ų102.369%0.68752%0.522SS*.Hα-helixtrans-60.8-34.7172.8179.4-179.2-178.3179.50112.5K325 E327 K333K325-K329 WeakPolarHBondContact O-CB 3.49Å; K325-K329 PolarHBondContact O-N 3.08Å; E327-K329 VanDerWaalsContact C-N 3.31Å; E327-K329 PolarHBondContact O-N 2.88Å; K329-K333 WeakPolarHBondContact O-CB 3.49Å; K329-K333 PolarHBondContact O-N 3.24Å
330T98.6Very high96.8Very high85 Ų85109 Ų10952%0.52154%0.537SS..Hα-helixtrans-75.5-44.9176.9-59.80000111.5Q326 E327 N328 K333 V334Q326-T330 WeakPolarHBondContact O-CB 3.17Å; Q326-T330 PolarHBondContact O-N 3.5Å; Q326-T330 PolarHBondContact O-OG1 2.96Å; E327-T330 CarbonylContact O-C 3.59Å; E327-T330 WeakPolarHBondContact O-CA 3.41Å; E327-T330 WeakPolarHBondContact O-CB 3.26Å; E327-T330 PolarHBondContact O-N 2.76Å; N328-T330 VanDerWaalsContact C-N 3.27Å; N328-T330 PolarHBondContact O-N 3.02Å; T330-K333 WeakPolarHBondContact O-CB 2.92Å; T330-K333 PolarHBondContact O-N 3.36Å; T330-V334 WeakPolarHBondContact O-CG2 3.38Å; T330-V334 PolarHBondContact O-N 3.48Å
331L98.4Very high96.7Very high108 Ų108108.5 Ų108.557%0.56554%0.536SS*.Hα-helixtrans-58.8-47.6174.1-68.8173.5000111.3E327 N328 K333 V334 V335E327-L331 WeakPolarHBondContact O-CG 3.46Å; E327-L331 PolarHBondContact O-N 3.27Å; N328-L331 PolarHBondContact O-N 3.39Å; L331-K333 VanDerWaalsContact C-N 3.26Å; L331-K333 PolarHBondContact O-N 3.01Å; L331-V334 PolarHBondContact O-N 2.8Å; L331-V334 VanDerWaalsContact O-N 3.08Å; L331-V335 WeakPolarHBondContact O-CG2 3.35Å; L331-V335 PolarHBondContact O-N 3Å
332L98.3Very high96.6Very high129 Ų129109.8 Ų109.868%0.67554%0.541SS*.Hα-helixtrans-60.4-35.4177.1-174.164.4000112.3N328 G336N328-L332 VanDerWaalsContact O-CB 3.28Å; N328-L332 WeakPolarHBondContact O-CB 3.5Å; N328-L332 PolarHBondContact O-N 2.99Å; L332-G336 PolarHBondContact O-N 3.27Å
333K98.2Very high96.4Very high143 Ų143111.6 Ų111.662%0.62255%0.551SS**Hα-helixtrans-67.4-40.1173.9-176.6-176.3177-173.60112.3K329 T330 L331 G336 Q337K329-K333 WeakPolarHBondContact O-CB 3.49Å; K329-K333 PolarHBondContact O-N 3.24Å; T330-K333 WeakPolarHBondContact O-CB 2.92Å; T330-K333 PolarHBondContact O-N 3.36Å; L331-K333 VanDerWaalsContact C-N 3.26Å; L331-K333 PolarHBondContact O-N 3.01Å; K333-G336 CarbonylContact O-C 3.55Å; K333-Q337 WeakPolarHBondContact O-CG 3.39Å; K333-Q337 PolarHBondContact O-N 3.47Å
334V98.1Very high96.3Very high69 Ų69111.4 Ų111.442%0.41855%0.552SS.*Hα-helixtrans-69.2-47.1176.5172.70000110.9T330 L331 G336 Q337 L338T330-V334 WeakPolarHBondContact O-CG2 3.38Å; T330-V334 PolarHBondContact O-N 3.48Å; L331-V334 PolarHBondContact O-N 2.8Å; L331-V334 VanDerWaalsContact O-N 3.08Å; V334-G336 VanDerWaalsContact C-N 3.3Å; V334-G336 PolarHBondContact O-N 3.36Å; V334-Q337 WeakPolarHBondContact O-CA 3.48Å; V334-Q337 WeakPolarHBondContact O-CB 3.31Å; V334-Q337 PolarHBondContact O-N 3.23Å; V334-L338 HydrophobicContact CG1-CD1 4.06Å; V334-L338 WeakPolarHBondContact O-CG 3.33Å; V334-L338 PolarHBondContact O-N 2.92Å; V334-L338 VanDerWaalsContact O-N 3.09Å
335V97.8Very high96.2Very high80 Ų80114 Ų11449%0.48556%0.564SS.*Hα-helixtrans-56.3-47.2173.6172.60000110.1L331 Q337 L338 T339L331-V335 WeakPolarHBondContact O-CG2 3.35Å; L331-V335 PolarHBondContact O-N 3Å; V335-Q337 PolarHBondContact O-N 3.03Å; V335-Q337 VanDerWaalsContact O-N 3.08Å; V335-L338 PolarHBondContact O-N 2.98Å; V335-T339 HydrophobicContact CG1-CG2 4.15Å; V335-T339 PolarHBondContact O-N 3.3Å; V335-T339 PolarHBondContact O-OG1 2.96Å
336G97.6Very high96Very high17 Ų17114.9 Ų114.918%0.17557%0.572CS.*Hα-helixtrans-68.6217500000116.2L332 K333 V334 R340L332-G336 PolarHBondContact O-N 3.27Å; K333-G336 CarbonylContact O-C 3.55Å; V334-G336 VanDerWaalsContact C-N 3.3Å; V334-G336 PolarHBondContact O-N 3.36Å; G336-R340 VanDerWaalsContact O-CZ 3.27Å; G336-R340 PolarHBondContact O-NE 3.19Å; G336-R340 PolarHBondContact O-NH2 3.11Å
337Q96.6Very high95.8Very high125 Ų125115.4 Ų115.458%0.58458%0.577SS**Hα-helixtrans-104.2-25.8165.2-75.2177.3-22.100112.4K333 V334 V335K333-Q337 WeakPolarHBondContact O-CG 3.39Å; K333-Q337 PolarHBondContact O-N 3.47Å; V334-Q337 WeakPolarHBondContact O-CA 3.48Å; V334-Q337 WeakPolarHBondContact O-CB 3.31Å; V334-Q337 PolarHBondContact O-N 3.23Å; V335-Q337 PolarHBondContact O-N 3.03Å; V335-Q337 VanDerWaalsContact O-N 3.08Å
338L96.6Very high95.6Very high141 Ų141117.4 Ų117.474%0.73859%0.589SS**Hα-helixtrans-87-16.3178-64.3172.5000113.1V334 V335V334-L338 HydrophobicContact CG1-CD1 4.06Å; V334-L338 WeakPolarHBondContact O-CG 3.33Å; V334-L338 PolarHBondContact O-N 2.92Å; V334-L338 VanDerWaalsContact O-N 3.09Å; V335-L338 PolarHBondContact O-N 2.98Å
339T93.7Very high95.3Very high106 Ų106118.8 Ų118.865%0.6559%0.593SS**  trans-105.722.4179.558.80000113.8V335V335-T339 HydrophobicContact CG1-CG2 4.15Å; V335-T339 PolarHBondContact O-N 3.3Å; V335-T339 PolarHBondContact O-OG1 2.96Å
340R71.5Confident95Very high265 Ų265115.3 Ų115.3100%159%0.585SS**  trans-1330177-92-170.1-76-155.7-7112.1G336G336-R340 VanDerWaalsContact O-CZ 3.27Å; G336-R340 PolarHBondContact O-NE 3.19Å; G336-R340 PolarHBondContact O-NH2 3.11Å

Retrieved 340 of 340 residues in 1189.2 ms (Link to these results)