A0A061IC55_CRIGR Loading...

Protein BUD31 homolog

AlphaFold DB (A0A5F9DD90), UniProt , Accession A0A061IC55, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Bud31, Length 103 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M56.8Low78Confident201 Ų201147.3 Ų147.399%0.9973%0.729SS**  01270-79.8169.175.200108.6R30M1-R30 PolarHBondContact O-NH1 3.44Å
2P62.2Low79.3Confident120 Ų120142.9 Ų142.978%0.77972%0.719SS**  trans-62.1137.8178.325.6-32.2000110.5V4P2-V4 PolarHBondContact O-N 3.49Å
3K73.4Confident80.5Confident95 Ų95145 Ų14541%0.41373%0.734SS.*  trans-64.3124.2177.3-70.8-175.6171.5-176.70109.3K5 L22 D23 D26K3-K5 PolarHBondContact O-N 3.35Å; K3-K5 VanDerWaalsContact O-N 3.15Å; K3-L22 PolarHBondContact NZ-O 3.16Å; K3-D23 WeakPolarHBondContact CE-OD1 3.23Å; K3-D23 IonicContact NZ-OD1 2.57Å; K3-D23 PolarHBondContact NZ-OD1 3.17Å; K3-D26 WeakPolarHBondContact CE-OD2 3.26Å
4V77.9Confident81.3Confident136 Ų136137.9 Ų137.982%0.82472%0.715SS**  trans-73.9106.4175.4-179.80000108.3P2 R6P2-V4 PolarHBondContact O-N 3.49Å; V4-R6 PolarHBondContact O-N 3.15Å
5K79Confident82Confident154 Ų154134.2 Ų134.267%0.6769%0.688SS**  trans-72.6118.2176.1-65.5-170.6178.8-174.30109.5K3K3-K5 PolarHBondContact O-N 3.35Å; K3-K5 VanDerWaalsContact O-N 3.15Å
6R79.7Confident82.7Confident257 Ų257136 Ų13697%0.9769%0.693SS**SBendtrans-75.3-30.2175.3-65.6-175.1-179-176.10.8112.5V4V4-R6 PolarHBondContact O-N 3.15Å
7S82.3Confident83.4Confident69 Ų69136.5 Ų136.548%0.48370%0.697SS.*  trans-105.4142.3177-1790000110.6K9S7-K9 PolarHBondContact OG-N 3.1Å; S7-K9 VanDerWaalsContact OG-N 3.16Å
8R82.1Confident84Confident260 Ų260133.6 Ų133.698%0.98168%0.682SS**  trans-86.2-9.3171.9-62.7-178.3-176.7172.50.5113
9K88.3Confident84.4Confident178 Ų178130.3 Ų130.377%0.77466%0.663SS**SBendtrans-70.3145.7177.2-65-176179.1179.90110S7S7-K9 PolarHBondContact OG-N 3.1Å; S7-K9 VanDerWaalsContact OG-N 3.16Å
10A86.4Confident84.9Confident89 Ų89127.3 Ų127.374%0.73665%0.653SS**PPolyproline II helixtrans-59.6149173.300000110.5
11P90.1Very high85.4Confident61 Ų61124.9 Ų124.940%0.39665%0.645SS.*PPolyproline II helixtrans-57.3150.3169.9-18.531.3000110.9W15P11-W15 HydrophobicContact CB-CB 3.61Å; P11-W15 HydrophobicContact CB-CD2 3.99Å; P11-W15 HydrophobicContact CB-CG 3.38Å; P11-W15 HydrophobicContact CG-CG 4.22Å
12P93.2Very high87.2Confident95 Ų95118.6 Ų118.662%0.61761%0.614SS**PPolyproline II helixtrans-69.2164.8177.930.3-35000112G14 W15P12-G14 PolarHBondContact O-N 3.34Å; P12-W15 VanDerWaalsContact O-CB 3.23Å; P12-W15 WeakPolarHBondContact O-CB 3.41Å; P12-W15 PolarHBondContact O-N 3.19Å
13D94.6Very high88.6Confident170 Ų170116.1 Ų116.191%0.90960%0.595SS**THydrogen-bonded Turntrans-54.9137.9175.2-63.7-20.2000111.3W15D13-W15 VanDerWaalsContact C-N 3.32Å
14G92.3Very high89.5Confident46 Ų46117 Ų11747%0.47460%0.6SS.*THydrogen-bonded Turntrans82.3-0.9-177.500000115.4P12 E16 L17P12-G14 PolarHBondContact O-N 3.34Å; G14-E16 VanDerWaalsContact C-N 3.28Å; G14-E16 PolarHBondContact O-N 2.96Å; G14-L17 WeakPolarHBondContact O-CB 3.21Å; G14-L17 PolarHBondContact O-N 3.33Å
15W91.7Very high90.3Very high82 Ų82115.4 Ų115.431%0.31159%0.587SS.*Hα-helixtrans-57.7-38.3175.5-179.9-99.3000113.2P11 P12 D13 L17 I18 E19 L22P11-W15 HydrophobicContact CB-CB 3.61Å; P11-W15 HydrophobicContact CB-CD2 3.99Å; P11-W15 HydrophobicContact CB-CG 3.38Å; P11-W15 HydrophobicContact CG-CG 4.22Å; P12-W15 VanDerWaalsContact O-CB 3.23Å; P12-W15 WeakPolarHBondContact O-CB 3.41Å; P12-W15 PolarHBondContact O-N 3.19Å; D13-W15 VanDerWaalsContact C-N 3.32Å; W15-L17 PolarHBondContact O-N 2.57Å; W15-L17 VanDerWaalsContact O-N 3.1Å; W15-I18 HydrophobicContact CD2-CG1 4.47Å; W15-I18 HydrophobicContact CE3-CD1 3.76Å; W15-I18 HydrophobicContact CE3-CG1 4.12Å; W15-I18 HydrophobicContact CZ3-CD1 3.87Å; W15-I18 HydrophobicContact CZ3-CG1 4.47Å; W15-I18 VanDerWaalsContact O-CG1 3.26Å; W15-I18 WeakPolarHBondContact O-CG1 3.39Å; W15-I18 PolarHBondContact O-N 3.19Å; W15-E19 PolarHBondContact NE1-OE1 3.48Å; W15-E19 VanDerWaalsContact NE1-OE1 3.1Å; W15-E19 WeakPolarHBondContact O-CB 3.42Å; W15-E19 PolarHBondContact O-N 3.1Å; W15-L22 HydrophobicContact CH2-CD1 3.6Å; W15-L22 HydrophobicContact CZ2-CD1 4.19Å; W15-L22 HydrophobicContact CZ3-CD1 4Å
16E92.6Very high90.9Very high163 Ų163109.8 Ų109.876%0.76256%0.564SS**Hα-helixtrans-58.8-24179.8-62.2177.3174.400113.1G14 P20G14-E16 VanDerWaalsContact C-N 3.28Å; G14-E16 PolarHBondContact O-N 2.96Å; E16-P20 WeakPolarHBondContact O-CD 3.04Å
17L95.1Very high91.6Very high144 Ų144102.9 Ų102.975%0.75454%0.543SS*.Hα-helixtrans-76.1-28.1178.5-58.6176.1000112.7G14 W15G14-L17 WeakPolarHBondContact O-CB 3.21Å; G14-L17 PolarHBondContact O-N 3.33Å; W15-L17 PolarHBondContact O-N 2.57Å; W15-L17 VanDerWaalsContact O-N 3.1Å
18I94.5Very high92.2Very high85 Ų85105.9 Ų105.944%0.43655%0.547SS..Hα-helixtrans-107.4-20.4-176.562.5171.2000112.8W15 T21 L22W15-I18 HydrophobicContact CD2-CG1 4.47Å; W15-I18 HydrophobicContact CE3-CD1 3.76Å; W15-I18 HydrophobicContact CE3-CG1 4.12Å; W15-I18 HydrophobicContact CZ3-CD1 3.87Å; W15-I18 HydrophobicContact CZ3-CG1 4.47Å; W15-I18 VanDerWaalsContact O-CG1 3.26Å; W15-I18 WeakPolarHBondContact O-CG1 3.39Å; W15-I18 PolarHBondContact O-N 3.19Å; I18-T21 PolarHBondContact O-N 2.88Å; I18-L22 HydrophobicContact CD1-CD1 4.04Å; I18-L22 HydrophobicContact CG1-CD1 4.2Å; I18-L22 WeakPolarHBondContact O-CG 3.45Å; I18-L22 PolarHBondContact O-N 3.02Å
19E92.1Very high92.7Very high70 Ų7099.2 Ų99.233%0.32753%0.529SS..Hα-helixtrans-53.1-47.5-178.5178.7167.1-120.300113W15 T21 L22 D23W15-E19 PolarHBondContact NE1-OE1 3.48Å; W15-E19 VanDerWaalsContact NE1-OE1 3.1Å; W15-E19 WeakPolarHBondContact O-CB 3.42Å; W15-E19 PolarHBondContact O-N 3.1Å; E19-T21 PolarHBondContact O-N 3.04Å; E19-L22 PolarHBondContact O-N 3.25Å; E19-D23 WeakPolarHBondContact O-CB 3.26Å; E19-D23 PolarHBondContact O-N 3.35Å
20P94.6Very high93Very high70 Ų7095.5 Ų95.546%0.45551%0.51SS..Hα-helixtrans-60.6-43.5178.4-23.334.5000112.6E16 L22 D23 E24E16-P20 WeakPolarHBondContact O-CD 3.04Å; P20-L22 PolarHBondContact O-N 2.9Å; P20-D23 PolarHBondContact O-N 3.39Å; P20-E24 WeakPolarHBondContact O-CG 3.32Å; P20-E24 PolarHBondContact O-N 3.14Å
21T95.6Very high93.3Very high78 Ų7895.9 Ų95.948%0.47950%0.496SS..Hα-helixtrans-64.7-40.6178.6-52.80000111.7I18 E19 E24 L25I18-T21 PolarHBondContact O-N 2.88Å; E19-T21 PolarHBondContact O-N 3.04Å; T21-E24 PolarHBondContact O-N 3.36Å; T21-L25 HydrophobicContact CG2-CD1 4.42Å; T21-L25 WeakPolarHBondContact O-CG 3.35Å; T21-L25 PolarHBondContact O-N 3.42Å
22L93.1Very high93.6Very high68 Ų6899.8 Ų99.836%0.35651%0.509SS..Hα-helixtrans-69.9-32.4176.8-67.7178.5000112.5K3 W15 I18 E19 P20 D26K3-L22 PolarHBondContact NZ-O 3.16Å; W15-L22 HydrophobicContact CH2-CD1 3.6Å; W15-L22 HydrophobicContact CZ2-CD1 4.19Å; W15-L22 HydrophobicContact CZ3-CD1 4Å; I18-L22 HydrophobicContact CD1-CD1 4.04Å; I18-L22 HydrophobicContact CG1-CD1 4.2Å; I18-L22 WeakPolarHBondContact O-CG 3.45Å; I18-L22 PolarHBondContact O-N 3.02Å; E19-L22 PolarHBondContact O-N 3.25Å; P20-L22 PolarHBondContact O-N 2.9Å; L22-D26 WeakPolarHBondContact O-CB 3.34Å; L22-D26 PolarHBondContact O-N 3.44Å; L22-D26 VanDerWaalsContact O-N 3.14Å
23D91.5Very high93.8Very high68 Ų68100.5 Ų100.536%0.36451%0.507SS..Hα-helixtrans-66.8-44.6172.7-78.8-4.3000111.3K3 E19 P20 D26 Q27K3-D23 WeakPolarHBondContact CE-OD1 3.23Å; K3-D23 IonicContact NZ-OD1 2.57Å; K3-D23 PolarHBondContact NZ-OD1 3.17Å; E19-D23 WeakPolarHBondContact O-CB 3.26Å; E19-D23 PolarHBondContact O-N 3.35Å; P20-D23 PolarHBondContact O-N 3.39Å; D23-D26 PolarHBondContact O-N 2.65Å; D23-Q27 WeakPolarHBondContact O-CB 3.43Å; D23-Q27 PolarHBondContact O-N 2.92Å
24E93.4Very high93.8Very high113 Ų11397.5 Ų97.553%0.52848%0.484SS..Hα-helixtrans-61.9-44176.4-74.8177.5-168.700112.5P20 T21 Q27 K28P20-E24 WeakPolarHBondContact O-CG 3.32Å; P20-E24 PolarHBondContact O-N 3.14Å; T21-E24 PolarHBondContact O-N 3.36Å; E24-Q27 PolarHBondContact O-N 2.86Å; E24-K28 WeakPolarHBondContact O-CG 3.35Å; E24-K28 PolarHBondContact O-N 3.26Å
25L94.6Very high94Very high103 Ų103101.7 Ų101.754%0.53949%0.491SS..Hα-helixtrans-63.8-43.5177.6-73.4173.2000112T21 K28 M29T21-L25 HydrophobicContact CG2-CD1 4.42Å; T21-L25 WeakPolarHBondContact O-CG 3.35Å; T21-L25 PolarHBondContact O-N 3.42Å; L25-K28 PolarHBondContact O-N 3.03Å; L25-M29 WeakPolarHBondContact O-CB 3.36Å; L25-M29 PolarHBondContact O-N 3.24Å
26D91.8Very high94.3Very high37 Ų37103.4 Ų103.420%0.19850%0.498CS..Hα-helixtrans-64.3-39.7176.1177.347.9000111.5K3 L22 D23 M29 R30K3-D26 WeakPolarHBondContact CE-OD2 3.26Å; L22-D26 WeakPolarHBondContact O-CB 3.34Å; L22-D26 PolarHBondContact O-N 3.44Å; L22-D26 VanDerWaalsContact O-N 3.14Å; D23-D26 PolarHBondContact O-N 2.65Å; D26-M29 PolarHBondContact O-N 3.39Å; D26-R30 VanDerWaalsContact O-CG 3.26Å; D26-R30 WeakPolarHBondContact O-CG 3.43Å; D26-R30 PolarHBondContact O-N 3.3Å; D26-R30 VanDerWaalsContact O-N 3.1Å; D26-R30 IonicContact OD1-CZ 3.12Å; D26-R30 IonicContact OD1-NE 3.04Å; D26-R30 PolarHBondContact OD1-NE 2.88Å; D26-R30 IonicContact OD1-NH2 2.65Å; D26-R30 PolarHBondContact OD1-NH2 3.44Å; D26-R30 IonicContact OD2-CZ 3.6Å; D26-R30 IonicContact OD2-NE 3.25Å; D26-R30 PolarHBondContact OD2-NE 3.34Å; D26-R30 IonicContact OD2-NH2 3.35Å; D26-R30 PolarHBondContact OD2-NH2 3.02Å
27Q93.4Very high94.5Very high111 Ų11197.7 Ų97.752%0.51948%0.476SS..Hα-helixtrans-62.3-49.4174.9-179.2174.5-11.800111.6D23 E24 M29 R30 E31D23-Q27 WeakPolarHBondContact O-CB 3.43Å; D23-Q27 PolarHBondContact O-N 2.92Å; E24-Q27 PolarHBondContact O-N 2.86Å; Q27-M29 VanDerWaalsContact C-N 3.31Å; Q27-M29 PolarHBondContact O-N 3.46Å; Q27-R30 PolarHBondContact O-N 3Å; Q27-R30 VanDerWaalsContact O-N 3.13Å; Q27-E31 HydrophobicContact CG-CG 4.45Å; Q27-E31 WeakPolarHBondContact CG-OE1 3.45Å; Q27-E31 PolarHBondContact NE2-OE1 3.46Å; Q27-E31 WeakPolarHBondContact O-CG 3.37Å; Q27-E31 PolarHBondContact O-N 3.2Å
28K94.6Very high94.7Very high132 Ų13292.6 Ų92.657%0.57445%0.449SS*.Hα-helixtrans-57.7-44178.3-76.4178176.9174.30112E24 L25 R30 E31 E32E24-K28 WeakPolarHBondContact O-CG 3.35Å; E24-K28 PolarHBondContact O-N 3.26Å; L25-K28 PolarHBondContact O-N 3.03Å; K28-R30 VanDerWaalsContact C-N 3.31Å; K28-R30 PolarHBondContact O-N 3.44Å; K28-E31 PolarHBondContact O-N 3.08Å; K28-E32 WeakPolarHBondContact O-CB 3.39Å; K28-E32 PolarHBondContact O-N 2.93Å
29M93.1Very high94.8Very high121 Ų12196.7 Ų96.760%0.59646%0.463SS*.Hα-helixtrans-62.5-37.7178.1-171.9174.962.200112.2L25 D26 Q27 L33L25-M29 WeakPolarHBondContact O-CB 3.36Å; L25-M29 PolarHBondContact O-N 3.24Å; D26-M29 PolarHBondContact O-N 3.39Å; Q27-M29 VanDerWaalsContact C-N 3.31Å; Q27-M29 PolarHBondContact O-N 3.46Å; M29-L33 WeakPolarHBondContact O-CB 3.47Å; M29-L33 PolarHBondContact O-N 3.13Å; M29-L33 VanDerWaalsContact O-N 3.08Å
30R93.9Very high95.1Very high100 Ų10098 Ų9838%0.37747%0.47SS..Hα-helixtrans-70.1-40176.3-69.8170.9-168.8-160.83.3112.4M1 D26 Q27 K28 Y34M1-R30 PolarHBondContact O-NH1 3.44Å; D26-R30 VanDerWaalsContact O-CG 3.26Å; D26-R30 WeakPolarHBondContact O-CG 3.43Å; D26-R30 PolarHBondContact O-N 3.3Å; D26-R30 VanDerWaalsContact O-N 3.1Å; D26-R30 IonicContact OD1-CZ 3.12Å; D26-R30 IonicContact OD1-NE 3.04Å; D26-R30 PolarHBondContact OD1-NE 2.88Å; D26-R30 IonicContact OD1-NH2 2.65Å; D26-R30 PolarHBondContact OD1-NH2 3.44Å; D26-R30 IonicContact OD2-CZ 3.6Å; D26-R30 IonicContact OD2-NE 3.25Å; D26-R30 PolarHBondContact OD2-NE 3.34Å; D26-R30 IonicContact OD2-NH2 3.35Å; D26-R30 PolarHBondContact OD2-NH2 3.02Å; Q27-R30 PolarHBondContact O-N 3Å; Q27-R30 VanDerWaalsContact O-N 3.13Å; K28-R30 VanDerWaalsContact C-N 3.31Å; K28-R30 PolarHBondContact O-N 3.44Å; R30-Y34 VanDerWaalsContact O-CB 3.28Å; R30-Y34 WeakPolarHBondContact O-CB 3.28Å; R30-Y34 PolarHBondContact O-N 3.02Å
31E94.5Very high95.1Very high96 Ų9697.6 Ų97.645%0.44948%0.478SS..Hα-helixtrans-63.4-48.1176.3-73.2173.9-175.800110.7Q27 K28 L33 Y34 E35Q27-E31 HydrophobicContact CG-CG 4.45Å; Q27-E31 WeakPolarHBondContact CG-OE1 3.45Å; Q27-E31 PolarHBondContact NE2-OE1 3.46Å; Q27-E31 WeakPolarHBondContact O-CG 3.37Å; Q27-E31 PolarHBondContact O-N 3.2Å; K28-E31 PolarHBondContact O-N 3.08Å; E31-L33 PolarHBondContact O-N 3.1Å; E31-Y34 WeakPolarHBondContact O-CB 3.41Å; E31-Y34 PolarHBondContact O-N 2.96Å; E31-E35 WeakPolarHBondContact O-CG 3.45Å; E31-E35 PolarHBondContact O-N 3.4Å
32E96.1Very high95.2Very high144 Ų144102.4 Ų102.467%0.67349%0.489SS*.Hα-helixtrans-61.8-44.6179.1-171.9175.1-173.200112K28 Y34 E35 Y36K28-E32 WeakPolarHBondContact O-CB 3.39Å; K28-E32 PolarHBondContact O-N 2.93Å; E32-Y34 VanDerWaalsContact C-N 3.33Å; E32-Y34 PolarHBondContact O-N 3.28Å; E32-E35 PolarHBondContact O-N 2.96Å; E32-Y36 WeakPolarHBondContact O-CB 3.47Å; E32-Y36 PolarHBondContact O-N 3.39Å
33L96.8Very high95.4Very high109 Ų109100.9 Ų100.957%0.57149%0.486SS*.Hα-helixtrans-63.6-39.3176.4-178.162.9000112.1M29 E31 Y36 C37M29-L33 WeakPolarHBondContact O-CB 3.47Å; M29-L33 PolarHBondContact O-N 3.13Å; M29-L33 VanDerWaalsContact O-N 3.08Å; E31-L33 PolarHBondContact O-N 3.1Å; L33-Y36 PolarHBondContact O-N 3.38Å; L33-C37 PolarHBondContact O-N 3.49Å; L33-C37 PolarHBondContact O-SG 3.46Å
34Y95.4Very high95.7Very high107 Ų107101.4 Ų101.442%0.4249%0.489SS..Hα-helixtrans-63.3-45176.8172.3-94.2000111.5R30 E31 E32 C37 I38 I48R30-Y34 VanDerWaalsContact O-CB 3.28Å; R30-Y34 WeakPolarHBondContact O-CB 3.28Å; R30-Y34 PolarHBondContact O-N 3.02Å; E31-Y34 WeakPolarHBondContact O-CB 3.41Å; E31-Y34 PolarHBondContact O-N 2.96Å; E32-Y34 VanDerWaalsContact C-N 3.33Å; E32-Y34 PolarHBondContact O-N 3.28Å; Y34-C37 PolarHBondContact O-N 3.18Å; Y34-I38 HydrophobicContact CD1-CD1 4Å; Y34-I38 HydrophobicContact CE1-CD1 3.37Å; Y34-I38 HydrophobicContact CE2-CD1 4.24Å; Y34-I38 PolarHBondContact O-N 3.38Å; Y34-I48 HydrophobicContact CE2-CD1 4.26Å; Y34-I48 VanDerWaalsContact OH-CG2 3.32Å; Y34-I48 WeakPolarHBondContact OH-CG2 3.27Å
35E96.3Very high95.9Very high135 Ų135102.9 Ų102.963%0.63149%0.494SS*.Hα-helixtrans-65.5-40176.5-70.4-172.8167.100112.3E31 E32 I38 K39E31-E35 WeakPolarHBondContact O-CG 3.45Å; E31-E35 PolarHBondContact O-N 3.4Å; E32-E35 PolarHBondContact O-N 2.96Å; E35-I38 PolarHBondContact O-N 3.43Å; E35-K39 WeakPolarHBondContact O-CB 3.47Å; E35-K39 PolarHBondContact O-N 3.5Å
36Y97.2Very high96.1Very high118 Ų118103 Ų10346%0.46349%0.494SS..Hα-helixtrans-58.4-49.1174.4177.5-97.7000111.7E32 L33 I38 K39 E40E32-Y36 WeakPolarHBondContact O-CB 3.47Å; E32-Y36 PolarHBondContact O-N 3.39Å; L33-Y36 PolarHBondContact O-N 3.38Å; Y36-I38 PolarHBondContact O-N 2.93Å; Y36-K39 PolarHBondContact O-N 3.2Å; Y36-E40 HydrophobicContact CD1-CG 4.27Å; Y36-E40 HydrophobicContact CD2-CG 4Å; Y36-E40 HydrophobicContact CE1-CG 3.82Å; Y36-E40 HydrophobicContact CE2-CG 3.51Å; Y36-E40 HydrophobicContact CG-CG 4.36Å; Y36-E40 VanDerWaalsContact CZ-CG 3.41Å; Y36-E40 PolarHBondContact O-N 2.97Å
37C97.9Very high96.3Very high42 Ų42102.4 Ų102.428%0.28449%0.491SS..Hα-helixtrans-57.4-35.4177-73.80000112.9L33 Y34 G41 Y42 A43L33-C37 PolarHBondContact O-N 3.49Å; L33-C37 PolarHBondContact O-SG 3.46Å; Y34-C37 PolarHBondContact O-N 3.18Å; C37-G41 PolarHBondContact O-N 3.21Å; C37-Y42 WeakPolarHBondContact O-CB 3.46Å; C37-Y42 PolarHBondContact O-N 2.95Å; C37-A43 PolarHBondContact O-N 2.82Å
38I97.8Very high96.5Very high37 Ų3798.3 Ų98.319%0.1947%0.473CS..Hα-helixtrans-70.8-45.3175-70.4172.3000110.9Y34 E35 Y36 E40 G41 A43 K45 I48Y34-I38 HydrophobicContact CD1-CD1 4Å; Y34-I38 HydrophobicContact CE1-CD1 3.37Å; Y34-I38 HydrophobicContact CE2-CD1 4.24Å; Y34-I38 PolarHBondContact O-N 3.38Å; E35-I38 PolarHBondContact O-N 3.43Å; Y36-I38 PolarHBondContact O-N 2.93Å; I38-E40 PolarHBondContact O-N 3.24Å; I38-G41 PolarHBondContact O-N 3.06Å; I38-A43 HydrophobicContact CG1-CB 4.41Å; I38-K45 HydrophobicContact CG2-CB 3.77Å; I38-K45 HydrophobicContact CG2-CD 4.34Å; I38-K45 HydrophobicContact CG2-CG 4.33Å; I38-I48 HydrophobicContact CD1-CD1 4.28Å; I38-I48 HydrophobicContact CG1-CD1 4.34Å
39K97.4Very high96.7Very high171 Ų17194.3 Ų94.374%0.74346%0.464SS*.Hα-helixtrans-63.8-41-177.1-175.2-177.3174.8-173.50112.3E35 Y36 G41E35-K39 WeakPolarHBondContact O-CB 3.47Å; E35-K39 PolarHBondContact O-N 3.5Å; Y36-K39 PolarHBondContact O-N 3.2Å; K39-G41 PolarHBondContact O-N 2.9Å
40E98.1Very high96.9Very high99 Ų9991.8 Ų91.846%0.46345%0.45SS..THydrogen-bonded Turntrans-80.2-0.4178.3-62.6-56.1124.600113.3Y36 I38 Y42Y36-E40 HydrophobicContact CD1-CG 4.27Å; Y36-E40 HydrophobicContact CD2-CG 4Å; Y36-E40 HydrophobicContact CE1-CG 3.82Å; Y36-E40 HydrophobicContact CE2-CG 3.51Å; Y36-E40 HydrophobicContact CG-CG 4.36Å; Y36-E40 VanDerWaalsContact CZ-CG 3.41Å; Y36-E40 PolarHBondContact O-N 2.97Å; I38-E40 PolarHBondContact O-N 3.24Å; E40-Y42 VanDerWaalsContact C-N 3.33Å; E40-Y42 HydrophobicContact CB-CD2 3.65Å; E40-Y42 HydrophobicContact CB-CE2 3.62Å; E40-Y42 HydrophobicContact CG-CE2 4.36Å; E40-Y42 PolarHBondContact O-N 3.22Å
41G95.6Very high97Very high61 Ų6192.4 Ų92.463%0.62945%0.452SS*.THydrogen-bonded Turntrans77.911.9175.700000115.1C37 I38 K39 A43C37-G41 PolarHBondContact O-N 3.21Å; I38-G41 PolarHBondContact O-N 3.06Å; K39-G41 PolarHBondContact O-N 2.9Å; G41-A43 PolarHBondContact O-N 3.43Å
42Y97.7Very high97.1Very high179 Ų17995.6 Ų95.670%0.70247%0.465SS*.SBendtrans-66.2-25.8170.2-66.3-71.4000112.2C37 E40C37-Y42 WeakPolarHBondContact O-CB 3.46Å; C37-Y42 PolarHBondContact O-N 2.95Å; E40-Y42 VanDerWaalsContact C-N 3.33Å; E40-Y42 HydrophobicContact CB-CD2 3.65Å; E40-Y42 HydrophobicContact CB-CE2 3.62Å; E40-Y42 HydrophobicContact CG-CE2 4.36Å; E40-Y42 PolarHBondContact O-N 3.22Å
43A96.7Very high97.1Very high36 Ų3694.2 Ų94.230%0.29846%0.457SS..SBendtrans-137.7137.6179.400000112.2C37 I38 G41 K45 I48C37-A43 PolarHBondContact O-N 2.82Å; I38-A43 HydrophobicContact CG1-CB 4.41Å; G41-A43 PolarHBondContact O-N 3.43Å; A43-K45 PolarHBondContact O-N 3.42Å; A43-I48 HydrophobicContact CB-CD1 4Å
44D97.7Very high97.1Very high79 Ų7997.6 Ų97.642%0.42247%0.47SS..  trans-84.2111.5-179.9-176.2-31.4000111.2N46 L47 I48D44-N46 VanDerWaalsContact C-N 3.29Å; D44-N46 PolarHBondContact O-N 3.35Å; D44-N46 WeakPolarHBondContact OD1-CA 3.32Å; D44-N46 WeakPolarHBondContact OD1-CB 3.28Å; D44-N46 PolarHBondContact OD1-N 3.44Å; D44-L47 HydrophobicContact CB-CB 3.89Å; D44-L47 PolarHBondContact O-N 3.25Å; D44-L47 PolarHBondContact OD1-N 3.22Å; D44-L47 VanDerWaalsContact OD1-N 3.08Å; D44-I48 VanDerWaalsContact O-CG1 3.3Å; D44-I48 WeakPolarHBondContact O-CG1 3.29Å; D44-I48 PolarHBondContact O-N 3.3Å
45K97.7Very high97Very high144 Ų14494 Ų9463%0.62647%0.465SS*.Hα-helixtrans-53-42.9177.6-173.9176179174.80113.3I38 A43 A49I38-K45 HydrophobicContact CG2-CB 3.77Å; I38-K45 HydrophobicContact CG2-CD 4.34Å; I38-K45 HydrophobicContact CG2-CG 4.33Å; A43-K45 PolarHBondContact O-N 3.42Å; K45-A49 WeakPolarHBondContact O-CB 3.04Å; K45-A49 PolarHBondContact O-N 2.79Å
46N97.8Very high97Very high104 Ų10490.7 Ų90.756%0.55645%0.447SS*.Hα-helixtrans-72.4-39-175.8-68-44.9000110.7D44 A49 K50 L62D44-N46 VanDerWaalsContact C-N 3.29Å; D44-N46 PolarHBondContact O-N 3.35Å; D44-N46 WeakPolarHBondContact OD1-CA 3.32Å; D44-N46 WeakPolarHBondContact OD1-CB 3.28Å; D44-N46 PolarHBondContact OD1-N 3.44Å; N46-A49 PolarHBondContact O-N 3.01Å; N46-K50 WeakPolarHBondContact O-CG 3.3Å; N46-K50 PolarHBondContact O-N 3.24Å; N46-K50 VanDerWaalsContact O-N 3.12Å; N46-L62 HydrophobicContact CB-CD1 3.62Å; N46-L62 HydrophobicContact CB-CD2 4.24Å
47L97.6Very high97Very high26 Ų2689.8 Ų89.814%0.13645%0.447CS..Hα-helixtrans-64.6-45.7175.5-172.359.3000111.1D44 A49 K50 W51 L59 L62D44-L47 HydrophobicContact CB-CB 3.89Å; D44-L47 PolarHBondContact O-N 3.25Å; D44-L47 PolarHBondContact OD1-N 3.22Å; D44-L47 VanDerWaalsContact OD1-N 3.08Å; L47-A49 VanDerWaalsContact C-N 3.3Å; L47-A49 PolarHBondContact O-N 3.28Å; L47-K50 WeakPolarHBondContact O-CA 3.26Å; L47-K50 WeakPolarHBondContact O-CB 3.32Å; L47-K50 PolarHBondContact O-N 2.07Å; L47-W51 HydrophobicContact CD1-CZ2 4.39Å; L47-W51 HydrophobicContact CD2-CH2 4.01Å; L47-W51 HydrophobicContact CD2-CZ2 3.58Å; L47-W51 HydrophobicContact CG-CD2 4.33Å; L47-W51 HydrophobicContact CG-CH2 4.27Å; L47-W51 HydrophobicContact CG-CZ2 3.71Å; L47-W51 PolarHBondContact O-N 2.98Å; L47-L59 HydrophobicContact CD1-CB 4.49Å; L47-L59 HydrophobicContact CD1-CD2 3.95Å; L47-L59 HydrophobicContact CD1-CG 4.11Å; L47-L62 HydrophobicContact CD1-CD2 4.4Å
48I97.8Very high96.9Very high24 Ų2493.5 Ų93.512%0.12346%0.464CS..Hα-helixtrans-60-41.7175.5-61.9166000111.1Y34 I38 A43 D44 K50 W51 K52Y34-I48 HydrophobicContact CE2-CD1 4.26Å; Y34-I48 VanDerWaalsContact OH-CG2 3.32Å; Y34-I48 WeakPolarHBondContact OH-CG2 3.27Å; I38-I48 HydrophobicContact CD1-CD1 4.28Å; I38-I48 HydrophobicContact CG1-CD1 4.34Å; A43-I48 HydrophobicContact CB-CD1 4Å; D44-I48 VanDerWaalsContact O-CG1 3.3Å; D44-I48 WeakPolarHBondContact O-CG1 3.29Å; D44-I48 PolarHBondContact O-N 3.3Å; I48-K50 PolarHBondContact O-N 2.82Å; I48-W51 HydrophobicContact CG1-CE3 4.22Å; I48-W51 HydrophobicContact CG1-CZ3 4.28Å; I48-W51 PolarHBondContact O-N 3.19Å; I48-K52 PolarHBondContact O-N 2.98Å
49A97.6Very high96.8Very high48 Ų4891.9 Ų91.940%0.39746%0.456SS..Hα-helixtrans-61.6-29176.400000112.6K45 N46 L47K45-A49 WeakPolarHBondContact O-CB 3.04Å; K45-A49 PolarHBondContact O-N 2.79Å; N46-A49 PolarHBondContact O-N 3.01Å; L47-A49 VanDerWaalsContact C-N 3.3Å; L47-A49 PolarHBondContact O-N 3.28Å
50K97.3Very high96.8Very high68 Ų6885.7 Ų85.730%0.29643%0.434SS..Hα-helixtrans-76.6-42.1173.1-64.6-66.5178.1167.90111.8N46 L47 I48 K52 K53 Y56 L59 L62 I65N46-K50 WeakPolarHBondContact O-CG 3.3Å; N46-K50 PolarHBondContact O-N 3.24Å; N46-K50 VanDerWaalsContact O-N 3.12Å; L47-K50 WeakPolarHBondContact O-CA 3.26Å; L47-K50 WeakPolarHBondContact O-CB 3.32Å; L47-K50 PolarHBondContact O-N 2.07Å; I48-K50 PolarHBondContact O-N 2.82Å; K50-K52 PolarHBondContact O-N 3.37Å; K50-K52 VanDerWaalsContact O-N 3.15Å; K50-K53 WeakPolarHBondContact O-CB 3.39Å; K50-K53 PolarHBondContact O-N 3.27Å; K50-Y56 WeakPolarHBondContact O-CB 3.41Å; K50-L59 HydrophobicContact CB-CD2 3.72Å; K50-L59 HydrophobicContact CG-CD2 4.07Å; K50-L62 HydrophobicContact CG-CD2 4.02Å; K50-I65 HydrophobicContact CD-CD1 3.73Å; K50-I65 HydrophobicContact CG-CD1 3.93Å
51W97.4Very high96.8Very high113 Ų11382.2 Ų82.243%0.42842%0.42SS..Hα-helixtrans-58.3-27.2177.3-67.4-21.4000113.7L47 I48 K53 Y56 L59L47-W51 HydrophobicContact CD1-CZ2 4.39Å; L47-W51 HydrophobicContact CD2-CH2 4.01Å; L47-W51 HydrophobicContact CD2-CZ2 3.58Å; L47-W51 HydrophobicContact CG-CD2 4.33Å; L47-W51 HydrophobicContact CG-CH2 4.27Å; L47-W51 HydrophobicContact CG-CZ2 3.71Å; L47-W51 PolarHBondContact O-N 2.98Å; I48-W51 HydrophobicContact CG1-CE3 4.22Å; I48-W51 HydrophobicContact CG1-CZ3 4.28Å; I48-W51 PolarHBondContact O-N 3.19Å; W51-K53 PolarHBondContact O-N 3Å; W51-Y56 VanDerWaalsContact CD1-O 3.27Å; W51-L59 PolarHBondContact NE1-O 3.4Å
52K96.4Very high96.8Very high163 Ų16381.8 Ų81.871%0.70940%0.403SS*.THydrogen-bonded Turntrans-73.8-9.5173.7-67.1-179.1-179-176.70114.4I48 K50I48-K52 PolarHBondContact O-N 2.98Å; K50-K52 PolarHBondContact O-N 3.37Å; K50-K52 VanDerWaalsContact O-N 3.15Å
53K96.3Very high96.8Very high116 Ų11679.6 Ų79.650%0.50439%0.393SS..SBendtrans-94.7140.7179.9-59.8-168.5-178.8-159.20110.7K50 W51 G55 Y56K50-K53 WeakPolarHBondContact O-CB 3.39Å; K50-K53 PolarHBondContact O-N 3.27Å; W51-K53 PolarHBondContact O-N 3Å; K53-G55 PolarHBondContact O-N 3.23Å; K53-Y56 HydrophobicContact CB-CD2 4.17Å; K53-Y56 PolarHBondContact O-N 3.21Å; K53-Y56 VanDerWaalsContact O-N 3.1Å
54Q95.1Very high96.8Very high180 Ų18077.9 Ų77.984%0.84138%0.379SS*.THydrogen-bonded Turntrans-56.4131.1177.2-169.3177.313.100111.6Y56 E57Q54-Y56 VanDerWaalsContact C-N 3.32Å; Q54-Y56 WeakPolarHBondContact O-CD2 3.47Å; Q54-E57 VanDerWaalsContact CA-OE1 3.25Å; Q54-E57 WeakPolarHBondContact CA-OE1 3.32Å
55G94Very high96.7Very high32 Ų3275.1 Ų75.133%0.3336%0.364SS..THydrogen-bonded Turntrans83.6-1.3-179.500000114.9K53 E57 R79K53-G55 PolarHBondContact O-N 3.23Å; G55-E57 WeakPolarHBondContact CA-OE2 3.38Å; G55-E57 VanDerWaalsContact N-CD 3.25Å; G55-E57 PolarHBondContact N-OE1 3.38Å; G55-E57 PolarHBondContact N-OE2 2.84Å; G55-R79 VanDerWaalsContact O-CZ 3.28Å; G55-R79 PolarHBondContact O-NH1 3.36Å; G55-R79 PolarHBondContact O-NH2 2.88Å
56Y96.6Very high96.7Very high64 Ų6471.4 Ų71.425%0.25135%0.349SS..  trans-117.410178.6-68.7-90.5000113K50 W51 K53 Q54 N58 L59 I65K50-Y56 WeakPolarHBondContact O-CB 3.41Å; W51-Y56 VanDerWaalsContact CD1-O 3.27Å; K53-Y56 HydrophobicContact CB-CD2 4.17Å; K53-Y56 PolarHBondContact O-N 3.21Å; K53-Y56 VanDerWaalsContact O-N 3.1Å; Q54-Y56 VanDerWaalsContact C-N 3.32Å; Q54-Y56 WeakPolarHBondContact O-CD2 3.47Å; Y56-N58 PolarHBondContact O-N 3.12Å; Y56-N58 VanDerWaalsContact O-N 3.12Å; Y56-L59 HydrophobicContact CD1-CB 4.5Å; Y56-L59 HydrophobicContact CD1-CD1 4.4Å; Y56-L59 HydrophobicContact CD1-CD2 4.13Å; Y56-L59 VanDerWaalsContact O-CB 3.25Å; Y56-L59 WeakPolarHBondContact O-CB 3.25Å; Y56-L59 PolarHBondContact O-N 3.15Å; Y56-I65 HydrophobicContact CD1-CG2 4.16Å; Y56-I65 HydrophobicContact CE1-CB 4.39Å; Y56-I65 HydrophobicContact CE1-CD1 4.47Å; Y56-I65 HydrophobicContact CE1-CG2 3.64Å
57E96.1Very high96.5Very high100 Ų10069.8 Ų69.847%0.46734%0.343SS..THydrogen-bonded Turntrans-56.8-32.6-174.3-5882.3177.100112.2Q54 G55Q54-E57 VanDerWaalsContact CA-OE1 3.25Å; Q54-E57 WeakPolarHBondContact CA-OE1 3.32Å; G55-E57 WeakPolarHBondContact CA-OE2 3.38Å; G55-E57 VanDerWaalsContact N-CD 3.25Å; G55-E57 PolarHBondContact N-OE1 3.38Å; G55-E57 PolarHBondContact N-OE2 2.84Å
58N95.9Very high96.4Very high119 Ų11978 Ų7864%0.63637%0.372SS*.THydrogen-bonded Turntrans-110.928179.2-62.5-45.9000112.6Y56 C60 C101Y56-N58 PolarHBondContact O-N 3.12Å; Y56-N58 VanDerWaalsContact O-N 3.12Å; N58-C60 PolarHBondContact O-N 3.3Å; N58-C101 WeakPolarHBondContact O-CB 3.11Å
59L96.9Very high96.2Very high4 Ų479.6 Ų79.62%0.02138%0.381CS..  trans-62.4127179.6178.964.3000111L47 K50 W51 Y56 I65L47-L59 HydrophobicContact CD1-CB 4.49Å; L47-L59 HydrophobicContact CD1-CD2 3.95Å; L47-L59 HydrophobicContact CD1-CG 4.11Å; K50-L59 HydrophobicContact CB-CD2 3.72Å; K50-L59 HydrophobicContact CG-CD2 4.07Å; W51-L59 PolarHBondContact NE1-O 3.4Å; Y56-L59 HydrophobicContact CD1-CB 4.5Å; Y56-L59 HydrophobicContact CD1-CD1 4.4Å; Y56-L59 HydrophobicContact CD1-CD2 4.13Å; Y56-L59 VanDerWaalsContact O-CB 3.25Å; Y56-L59 WeakPolarHBondContact O-CB 3.25Å; Y56-L59 PolarHBondContact O-N 3.15Å; L59-I65 HydrophobicContact CD1-CG2 3.44Å; L59-I65 VanDerWaalsContact CD1-CG2 3.44Å; L59-I65 HydrophobicContact CD2-CD1 3.73Å; L59-I65 HydrophobicContact CD2-CG1 4.17Å; L59-I65 HydrophobicContact CD2-CG2 4.13Å; L59-I65 HydrophobicContact CG-CG2 4.46Å
60C96.8Very high96Very high41 Ų4178.9 Ų78.928%0.27737%0.372SS..  trans-75.6-42.7-177.534.20000114.8N58 C78 C98 C101N58-C60 PolarHBondContact O-N 3.3Å; C60-C78 VanDerWaalsContact SG-SG 3.68Å; C60-C98 HydrophobicContact CB-CB 3.74Å; C60-C98 PolarHBondContact SG-SG 2.71Å; C60-C101 HydrophobicContact CB-CB 4.2Å; C60-C101 WeakPolarHBondContact CB-SG 3.34Å; C60-C101 WeakPolarHBondContact SG-CB 3.29Å; C60-C101 CovalentContact SG-SG 2.07Å; C60-C101 PolarHBondContact SG-SG 3.32Å
61C97.1Very high95.8Very high25 Ų2583.4 Ų83.417%0.16940%0.4CS..  trans-163.6166.9176.669.20000111.4C64 C96C61-C64 PolarHBondContact O-N 2.94Å; C61-C64 PolarHBondContact SG-SG 3.25Å; C61-C96 VanDerWaalsContact SG-SG 3.64Å
62L96.9Very high95.7Very high52 Ų5287 Ų8727%0.27242%0.419SS..SBendtrans-70.7-30.4179.8-64173.3000113.3N46 L47 K50 C64 I65 Q66N46-L62 HydrophobicContact CB-CD1 3.62Å; N46-L62 HydrophobicContact CB-CD2 4.24Å; L47-L62 HydrophobicContact CD1-CD2 4.4Å; K50-L62 HydrophobicContact CG-CD2 4.02Å; L62-C64 VanDerWaalsContact C-N 3.27Å; L62-C64 PolarHBondContact O-N 3.24Å; L62-I65 HydrophobicContact CD2-CD1 4.42Å; L62-I65 WeakPolarHBondContact O-CG1 3.37Å; L62-I65 PolarHBondContact O-N 2.77Å; L62-Q66 PolarHBondContact O-N 3.36Å
63R97.1Very high95.6Very high133 Ų13381.4 Ų81.450%0.50241%0.407SS..G310 helixtrans-62.3-34.7177.7-65.7-179.367.7-173.73.1112.5I65 Q66 H95R63-I65 PolarHBondContact O-N 2.97Å; R63-I65 VanDerWaalsContact O-N 3.12Å; R63-Q66 PolarHBondContact O-N 2.89Å; R63-Q66 VanDerWaalsContact O-N 3.17Å; R63-H95 HydrophobicContact CB-CB 4.24Å; R63-H95 PolarHBondContact NH2-ND1 3.41Å
64C96.8Very high95.5Very high0 Ų079.7 Ų79.70%041%0.406CS..G310 helixtrans-67.1-13.1-178.5-76.30000114.6C61 L62 C76 C78 C93C61-C64 PolarHBondContact O-N 2.94Å; C61-C64 PolarHBondContact SG-SG 3.25Å; L62-C64 VanDerWaalsContact C-N 3.27Å; L62-C64 PolarHBondContact O-N 3.24Å; C64-C76 HydrophobicContact CB-CB 3.92Å; C64-C76 WeakPolarHBondContact O-CB 3.25Å; C64-C76 PolarHBondContact O-N 3.02Å; C64-C78 PolarHBondContact SG-SG 3.08Å; C64-C93 PolarHBondContact SG-SG 3.17Å
65I96.2Very high95.5Very high22 Ų2273.9 Ų73.911%0.11338%0.381CS..G310 helixtrans-118.48179.461160.7000112K50 Y56 L59 L62 R63 N75 R79K50-I65 HydrophobicContact CD-CD1 3.73Å; K50-I65 HydrophobicContact CG-CD1 3.93Å; Y56-I65 HydrophobicContact CD1-CG2 4.16Å; Y56-I65 HydrophobicContact CE1-CB 4.39Å; Y56-I65 HydrophobicContact CE1-CD1 4.47Å; Y56-I65 HydrophobicContact CE1-CG2 3.64Å; L59-I65 HydrophobicContact CD1-CG2 3.44Å; L59-I65 VanDerWaalsContact CD1-CG2 3.44Å; L59-I65 HydrophobicContact CD2-CD1 3.73Å; L59-I65 HydrophobicContact CD2-CG1 4.17Å; L59-I65 HydrophobicContact CD2-CG2 4.13Å; L59-I65 HydrophobicContact CG-CG2 4.46Å; L62-I65 HydrophobicContact CD2-CD1 4.42Å; L62-I65 WeakPolarHBondContact O-CG1 3.37Å; L62-I65 PolarHBondContact O-N 2.77Å; R63-I65 PolarHBondContact O-N 2.97Å; R63-I65 VanDerWaalsContact O-N 3.12Å; I65-N75 WeakPolarHBondContact CA-OD1 3.41Å; I65-N75 PolarHBondContact O-OD1 3.35Å; I65-R79 HydrophobicContact CG2-CG 4.11Å
66Q96.4Very high95.6Very high66 Ų6673 Ų7331%0.30837%0.369SS..  trans-99106.3-175.2-174.664-13.100109.4L62 R63 R68 D69L62-Q66 PolarHBondContact O-N 3.36Å; R63-Q66 PolarHBondContact O-N 2.89Å; R63-Q66 VanDerWaalsContact O-N 3.17Å; Q66-R68 VanDerWaalsContact C-N 3.26Å; Q66-R68 HydrophobicContact CG-CG 3.46Å; Q66-R68 VanDerWaalsContact CG-CG 3.46Å; Q66-R68 VanDerWaalsContact NE2-CD 3.34Å; Q66-R68 VanDerWaalsContact NE2-CZ 3.3Å; Q66-R68 PolarHBondContact O-N 3.41Å; Q66-D69 HydrophobicContact CB-CB 4.34Å; Q66-D69 HydrophobicContact CG-CB 4.41Å; Q66-D69 PolarHBondContact O-N 3.42Å
67T94.6Very high95.4Very high70 Ų7073 Ų7343%0.42937%0.373SS..G310 helixtrans-63-31.3-173.552.10000113.1D69 T70 G73T67-D69 PolarHBondContact O-N 3.5Å; T67-T70 PolarHBondContact O-N 3.12Å; T67-T70 PolarHBondContact O-OG1 3.37Å; T67-G73 VanDerWaalsContact CB-O 3.29Å; T67-G73 WeakPolarHBondContact CB-O 3.37Å; T67-G73 VanDerWaalsContact CG2-O 3.23Å; T67-G73 WeakPolarHBondContact CG2-O 3.42Å; T67-G73 VanDerWaalsContact O-CA 3.29Å; T67-G73 WeakPolarHBondContact O-CA 3.45Å
68R95.8Very high95.4Very high198 Ų19868.3 Ų68.375%0.74735%0.351SS*.G310 helixtrans-68.3-16.5175.262.8163.8-163.8-155.30.7114.4Q66 T70Q66-R68 VanDerWaalsContact C-N 3.26Å; Q66-R68 HydrophobicContact CG-CG 3.46Å; Q66-R68 VanDerWaalsContact CG-CG 3.46Å; Q66-R68 VanDerWaalsContact NE2-CD 3.34Å; Q66-R68 VanDerWaalsContact NE2-CZ 3.3Å; Q66-R68 PolarHBondContact O-N 3.41Å; R68-T70 VanDerWaalsContact C-N 3.29Å
69D93.2Very high95.3Very high57 Ų5764 Ų6431%0.30533%0.326SS..G310 helixtrans-90.13.8-177.3-64.5-3000111.6Q66 T67Q66-D69 HydrophobicContact CB-CB 4.34Å; Q66-D69 HydrophobicContact CG-CB 4.41Å; Q66-D69 PolarHBondContact O-N 3.42Å; T67-D69 PolarHBondContact O-N 3.5Å
70T93.3Very high95.2Very high34 Ų3466.1 Ų66.121%0.20934%0.339CS..SBendtrans-127.2149176.4730000111.7T67 R68 F72 G73 T74T67-T70 PolarHBondContact O-N 3.12Å; T67-T70 PolarHBondContact O-OG1 3.37Å; R68-T70 VanDerWaalsContact C-N 3.29Å; T70-F72 PolarHBondContact O-N 3.09Å; T70-G73 PolarHBondContact O-N 2.89Å; T70-T74 VanDerWaalsContact CG2-O 3.28Å; T70-T74 WeakPolarHBondContact CG2-O 3.25Å; T70-T74 PolarHBondContact OG1-N 2.98Å; T70-T74 PolarHBondContact OG1-O 3.05Å
71N92.7Very high95Very high163 Ų16366.1 Ų66.187%0.87234%0.338SS*.THydrogen-bonded Turntrans-61.1-30.3-175.2-64.8-21.6000114
72F95Very high94.7Very high189 Ų18970.6 Ų70.683%0.82936%0.355SS*.THydrogen-bonded Turntrans-105.513.3-175-59.5-71.5000113.2T70 T74T70-F72 PolarHBondContact O-N 3.09Å; F72-T74 VanDerWaalsContact C-N 3.27Å; F72-T74 HydrophobicContact CB-CG2 4.41Å; F72-T74 PolarHBondContact O-N 2.74Å
73G95Very high94.4Very high45 Ų4573.6 Ų73.646%0.46438%0.38SS..SBendtrans67.826.8176.600000113.9T67 T70T67-G73 VanDerWaalsContact CB-O 3.29Å; T67-G73 WeakPolarHBondContact CB-O 3.37Å; T67-G73 VanDerWaalsContact CG2-O 3.23Å; T67-G73 WeakPolarHBondContact CG2-O 3.42Å; T67-G73 VanDerWaalsContact O-CA 3.29Å; T67-G73 WeakPolarHBondContact O-CA 3.45Å; T70-G73 PolarHBondContact O-N 2.89Å
74T95.1Very high94.2Very high80 Ų8075.2 Ų75.249%0.49139%0.391SS..  trans-118.5170.6-174.7-168.90000112.2T70 F72T70-T74 VanDerWaalsContact CG2-O 3.28Å; T70-T74 WeakPolarHBondContact CG2-O 3.25Å; T70-T74 PolarHBondContact OG1-N 2.98Å; T70-T74 PolarHBondContact OG1-O 3.05Å; F72-T74 VanDerWaalsContact C-N 3.27Å; F72-T74 HydrophobicContact CB-CG2 4.41Å; F72-T74 PolarHBondContact O-N 2.74Å
75N93.9Very high93.9Very high58 Ų5876.8 Ų76.831%0.3140%0.399SS..  trans-75.8161173.7-68.3-21.9000111I65 R79I65-N75 WeakPolarHBondContact CA-OD1 3.41Å; I65-N75 PolarHBondContact O-OD1 3.35Å; N75-R79 HydrophobicContact CB-CB 4.24Å; N75-R79 HydrophobicContact CB-CG 4.33Å
76C95.3Very high93.7Very high12 Ų1282.6 Ų82.68%0.08143%0.426CS..  trans-65.1151.2176.1-173.90000111.7C64 C78 R79 C93C64-C76 HydrophobicContact CB-CB 3.92Å; C64-C76 WeakPolarHBondContact O-CB 3.25Å; C64-C76 PolarHBondContact O-N 3.02Å; C76-C78 PolarHBondContact O-N 2.97Å; C76-R79 WeakPolarHBondContact O-CB 3.27Å; C76-R79 PolarHBondContact O-N 2.71Å; C76-C93 PolarHBondContact SG-SG 3.43Å
77I93.8Very high93.3Very high65 Ų6587 Ų8733%0.33346%0.457SS..G310 helixtrans-53-27.7175.5-172.760.5000113.3R79 V80 L85 I91I77-R79 PolarHBondContact O-N 3.1Å; I77-R79 VanDerWaalsContact O-N 3.09Å; I77-V80 HydrophobicContact CD1-CB 4.24Å; I77-V80 HydrophobicContact CD1-CG2 3.83Å; I77-V80 WeakPolarHBondContact O-CB 3.15Å; I77-V80 PolarHBondContact O-N 3.08Å; I77-L85 HydrophobicContact CD1-CD2 3.99Å; I77-I91 HydrophobicContact CG1-CD1 3.89Å; I77-I91 HydrophobicContact CG1-CG2 4.29Å; I77-I91 HydrophobicContact CG2-CG2 3.85Å
78C95.1Very high92.8Very high1 Ų187 Ų871%0.00747%0.472CS..G310 helixtrans-62.7-16.5175.969.90000113.3C60 C64 C76 C93 C98 G100 C101C60-C78 VanDerWaalsContact SG-SG 3.68Å; C64-C78 PolarHBondContact SG-SG 3.08Å; C76-C78 PolarHBondContact O-N 2.97Å; C78-C93 HydrophobicContact CB-CB 4.27Å; C78-C98 WeakPolarHBondContact CB-SG 3.15Å; C78-G100 CarbonylContact O-C 3.56Å; C78-G100 WeakPolarHBondContact O-CA 3.5Å; C78-C101 PolarHBondContact O-N 2.95Å; C78-C101 VanDerWaalsContact SG-SG 3.64Å
79R95.4Very high92.5Very high29 Ų2984 Ų8411%0.10946%0.46CS..G310 helixtrans-87.1-5175.9-66.3-63.1-61.2145.45.2113.7G55 I65 N75 C76 I77 C101 S102G55-R79 VanDerWaalsContact O-CZ 3.28Å; G55-R79 PolarHBondContact O-NH1 3.36Å; G55-R79 PolarHBondContact O-NH2 2.88Å; I65-R79 HydrophobicContact CG2-CG 4.11Å; N75-R79 HydrophobicContact CB-CB 4.24Å; N75-R79 HydrophobicContact CB-CG 4.33Å; C76-R79 WeakPolarHBondContact O-CB 3.27Å; C76-R79 PolarHBondContact O-N 2.71Å; I77-R79 PolarHBondContact O-N 3.1Å; I77-R79 VanDerWaalsContact O-N 3.09Å; R79-C101 PolarHBondContact NH1-O 3.26Å; R79-S102 WeakPolarHBondContact O-CB 3.29Å; R79-S102 PolarHBondContact O-OG 3.21Å
80V94Very high92.2Very high49 Ų4987.9 Ų87.930%0.29748%0.479SS..SBendtrans-79.1125.6174.5-1770000109.1I77 K84 L85I77-V80 HydrophobicContact CD1-CB 4.24Å; I77-V80 HydrophobicContact CD1-CG2 3.83Å; I77-V80 WeakPolarHBondContact O-CB 3.15Å; I77-V80 PolarHBondContact O-N 3.08Å; V80-K84 HydrophobicContact CG1-CB 4.07Å; V80-L85 HydrophobicContact CB-CD2 4.16Å; V80-L85 HydrophobicContact CG1-CD2 3.71Å; V80-L85 HydrophobicContact CG1-CG 4.03Å
81P93.4Very high92.1Very high40 Ų4087 Ų8726%0.2647%0.473SS..  trans-57.7141.3174.6-24.334.2000111.5S83 K84P81-S83 PolarHBondContact O-N 3.5Å; P81-S83 VanDerWaalsContact O-N 3.15Å; P81-K84 PolarHBondContact O-N 3.05Å
82K90.6Very high92.2Very high120 Ų12085.5 Ų85.552%0.52246%0.461SS..G310 helixtrans-60.1-29.9-177-69.7176.2-178.2159.70113.5K84 L85 G103K82-K84 PolarHBondContact O-N 3.2Å; K82-L85 PolarHBondContact O-N 2.98Å; K82-G103 WeakPolarHBondContact CE-OXT 3.23Å; K82-G103 PolarHBondContact NZ-OXT 3.29Å
83S90.8Very high92.2Very high114 Ų11476.7 Ų76.780%0.79742%0.423SS*.G310 helixtrans-62.7-19.817656.30000114.4P81P81-S83 PolarHBondContact O-N 3.5Å; P81-S83 VanDerWaalsContact O-N 3.15Å
84K92.1Very high92.1Very high168 Ų16880.9 Ų80.973%0.7344%0.439SS*.G310 helixtrans-98.90.1176.7-62-171.5178.4-174.90112.9V80 P81 K82V80-K84 HydrophobicContact CG1-CB 4.07Å; P81-K84 PolarHBondContact O-N 3.05Å; K82-K84 PolarHBondContact O-N 3.2Å
85L91Very high92.1Very high32 Ų3279.2 Ų79.217%0.16843%0.426CS..SBendtrans-98.6154.4176.8-62.3175.8000110I77 V80 K82 V87 I91I77-L85 HydrophobicContact CD1-CD2 3.99Å; V80-L85 HydrophobicContact CB-CD2 4.16Å; V80-L85 HydrophobicContact CG1-CD2 3.71Å; V80-L85 HydrophobicContact CG1-CG 4.03Å; K82-L85 PolarHBondContact O-N 2.98Å; L85-V87 PolarHBondContact O-N 3.15Å; L85-I91 HydrophobicContact CD1-CD1 4.06Å; L85-I91 HydrophobicContact CD1-CG1 3.6Å
86E90.7Very high92.1Very high144 Ų14479.2 Ų79.267%0.67343%0.43SS*.PPolyproline II helixtrans-59.3136.4172.7-67167.1172.700110.5G88 R89E86-G88 PolarHBondContact O-N 3.41Å; E86-R89 HydrophobicContact CB-CB 4.28Å; E86-R89 VanDerWaalsContact O-CB 3.27Å; E86-R89 WeakPolarHBondContact O-CB 3.2Å; E86-R89 PolarHBondContact O-N 3.12Å; E86-R89 VanDerWaalsContact O-N 3.08Å
87V88.7Confident92.2Very high158 Ų15880.2 Ų80.296%0.95844%0.443SS*.THydrogen-bonded Turntrans-60.8127.9-178.7-177.60000109.4L85 R89L85-V87 PolarHBondContact O-N 3.15Å; V87-R89 VanDerWaalsContact C-N 3.33Å
88G84.3Confident92.3Very high72 Ų7278.2 Ų78.274%0.74243%0.434SS*.THydrogen-bonded Turntrans85.4-2.8-179.500000115E86 I90E86-G88 PolarHBondContact O-N 3.41Å; G88-I90 PolarHBondContact O-N 3.27Å
89R88.5Confident92.2Very high135 Ų13586.1 Ų86.151%0.50946%0.463SS..  trans-70114.2174.4-174.1174.3177.1172-0.7110.8E86 V87 I91E86-R89 HydrophobicContact CB-CB 4.28Å; E86-R89 VanDerWaalsContact O-CB 3.27Å; E86-R89 WeakPolarHBondContact O-CB 3.2Å; E86-R89 PolarHBondContact O-N 3.12Å; E86-R89 VanDerWaalsContact O-N 3.08Å; V87-R89 VanDerWaalsContact C-N 3.33Å; R89-I91 HydrophobicContact CG-CD1 3.93Å
90I87.5Confident92.1Very high138 Ų13886 Ų8671%0.70847%0.472SS*.  trans-77.9125.8172.1-57.7174.8000108.4G88G88-I90 PolarHBondContact O-N 3.27Å
91I91.2Very high92Very high16 Ų1683.9 Ų83.98%0.08246%0.459CS..  trans-102.3134.5174.8-59.5-57000108.9I77 L85 R89 R99I77-I91 HydrophobicContact CG1-CD1 3.89Å; I77-I91 HydrophobicContact CG1-CG2 4.29Å; I77-I91 HydrophobicContact CG2-CG2 3.85Å; L85-I91 HydrophobicContact CD1-CD1 4.06Å; L85-I91 HydrophobicContact CD1-CG1 3.6Å; R89-I91 HydrophobicContact CG-CD1 3.93Å; I91-R99 VanDerWaalsContact O-CA 3.27Å; I91-R99 WeakPolarHBondContact O-CA 3.39Å; I91-R99 VanDerWaalsContact O-CB 3.32Å; I91-R99 WeakPolarHBondContact O-CB 3.42Å; I91-R99 VanDerWaalsContact O-CG 3.26Å; I91-R99 WeakPolarHBondContact O-CG 3.28Å
92E94.5Very high91.8Very high130 Ų13083.9 Ų83.961%0.60746%0.46SS*.  trans-136.2121.6167.9-172.3169.6172.700109.1
93C94.8Very high90.7Very high4 Ų481.4 Ų81.43%0.02747%0.469CS..  trans-75130179.7175.80000111.5C64 C76 C78 H95 G97 C98C64-C93 PolarHBondContact SG-SG 3.17Å; C76-C93 PolarHBondContact SG-SG 3.43Å; C78-C93 HydrophobicContact CB-CB 4.27Å; C93-H95 PolarHBondContact O-N 3.28Å; C93-H95 PolarHBondContact SG-N 2.94Å; C93-G97 VanDerWaalsContact O-CA 3.28Å; C93-G97 WeakPolarHBondContact O-CA 3.49Å; C93-G97 PolarHBondContact O-N 3.3Å; C93-C98 WeakPolarHBondContact CB-SG 3.39Å; C93-C98 PolarHBondContact N-O 3.35Å
94T93.2Very high90.7Very high133 Ų13379.8 Ų79.882%0.81645%0.452SS*.THydrogen-bonded Turntrans-68.5-16.8175.855.10000114
95H94.5Very high90.6Very high45 Ų4575.2 Ų75.221%0.20844%0.437CS..THydrogen-bonded Turntrans-87.7-33.1179.2-56.9-52.6000113.8R63 C93R63-H95 HydrophobicContact CB-CB 4.24Å; R63-H95 PolarHBondContact NH2-ND1 3.41Å; C93-H95 PolarHBondContact O-N 3.28Å; C93-H95 PolarHBondContact SG-N 2.94Å
96C95.8Very high90.6Very high59 Ų5977.6 Ų77.640%0.39945%0.452SS..THydrogen-bonded Turntrans-149.84.3-172.263.50000115.3C61 C98C61-C96 VanDerWaalsContact SG-SG 3.64Å; C96-C98 PolarHBondContact O-N 3.02Å; C96-C98 PolarHBondContact SG-SG 3.42Å
97G95.5Very high90.5Very high33 Ų3373.6 Ų73.634%0.3444%0.44SS..  trans72.86176.600000115.6C93C93-G97 VanDerWaalsContact O-CA 3.28Å; C93-G97 WeakPolarHBondContact O-CA 3.49Å; C93-G97 PolarHBondContact O-N 3.3Å
98C96.1Very high90.7Very high22 Ų2268.4 Ų68.415%0.14941%0.407CS..  trans-68.2154.8179.667.80000112.5C60 C78 C93 C96 C101C60-C98 HydrophobicContact CB-CB 3.74Å; C60-C98 PolarHBondContact SG-SG 2.71Å; C78-C98 WeakPolarHBondContact CB-SG 3.15Å; C93-C98 WeakPolarHBondContact CB-SG 3.39Å; C93-C98 PolarHBondContact N-O 3.35Å; C96-C98 PolarHBondContact O-N 3.02Å; C96-C98 PolarHBondContact SG-SG 3.42Å; C98-C101 PolarHBondContact SG-SG 2.99Å
99R94.2Very high91.1Very high167 Ų16768.1 Ų68.163%0.6339%0.385SS*.SBendtrans-114.432.9-175-52.5-169175.5175.9-2.8113.9I91I91-R99 VanDerWaalsContact O-CA 3.27Å; I91-R99 WeakPolarHBondContact O-CA 3.39Å; I91-R99 VanDerWaalsContact O-CB 3.32Å; I91-R99 WeakPolarHBondContact O-CB 3.42Å; I91-R99 VanDerWaalsContact O-CG 3.26Å; I91-R99 WeakPolarHBondContact O-CG 3.28Å
100G92.5Very high91.3Very high28 Ų2863.4 Ų63.429%0.28938%0.376SS..  trans117.2123.2-174.900000111.9C78C78-G100 CarbonylContact O-C 3.56Å; C78-G100 WeakPolarHBondContact O-CA 3.5Å
101C93.1Very high91.6Very high4 Ų457.6 Ų57.63%0.02735%0.35CS..SBendtrans-117.95.4-176.4-44.70000111.6N58 C60 C78 R79 C98N58-C101 WeakPolarHBondContact O-CB 3.11Å; C60-C101 HydrophobicContact CB-CB 4.2Å; C60-C101 WeakPolarHBondContact CB-SG 3.34Å; C60-C101 WeakPolarHBondContact SG-CB 3.29Å; C60-C101 CovalentContact SG-SG 2.07Å; C60-C101 PolarHBondContact SG-SG 3.32Å; C78-C101 PolarHBondContact O-N 2.95Å; C78-C101 VanDerWaalsContact SG-SG 3.64Å; R79-C101 PolarHBondContact NH1-O 3.26Å; C98-C101 PolarHBondContact SG-SG 2.99Å
102S87.4Confident91.6Very high40 Ų4061.1 Ų61.128%0.2837%0.373SS..  trans-117.419.1-172.4-141.70000113.3R79R79-S102 WeakPolarHBondContact O-CB 3.29Å; R79-S102 PolarHBondContact O-OG 3.21Å
103G67.7Low91.3Very high68 Ų6854.8 Ų54.870%0.70135%0.351SS*.  trans90.20-166.900000111.6K82K82-G103 WeakPolarHBondContact CE-OXT 3.23Å; K82-G103 PolarHBondContact NZ-OXT 3.29Å

Retrieved 103 of 103 residues in 92.3 ms (Link to these results)