A0A077ZGC7_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZGC7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 339 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
1M42.6Very low41.5Very low237 Ų237166.5 Ų166.5100%1.16785%0.851SS**  045.30-160.5179.7-179.300111.2
2I42.1Very low41.1Very low170 Ų170163.8 Ų163.887%0.87284%0.835SS**  trans-139.162.1165.4-56179.5000106.1
3L40.2Very low40.7Very low177 Ų177166 Ų16693%0.92784%0.835SS**SBendtrans-120.831.3169-105.5168.7000108
4R46.5Very low40.7Very low230 Ų230164.5 Ų164.587%0.86882%0.821SS**SBendtrans-149.319.3-163.3-138.2-172.4-92.8-173.3-5.6119.2
5R52.7Low40.9Very low234 Ų234157.1 Ų157.188%0.88379%0.791SS**SBendtrans-145.5119.2166.1-77.3-170.3178.5170.4-1.1110.9
6L48.3Very low42Very low177 Ų177155.1 Ų155.193%0.92779%0.79SS**  trans7681.4174-45.5173.1000112.4
7G40.8Very low43.6Very low58 Ų58150.2 Ų150.260%0.59876%0.763SS**  cis92.8106.142.800000108.7
8Y38Very low45Very low219 Ų219145.8 Ų145.886%0.85974%0.739SS**  trans72.995.8156.1-60.2-83000115.5
9S39.1Very low46.2Very low93 Ų93141.6 Ų141.665%0.6572%0.721SS**  59.289.486.977.50000111.8
10N33.9Very low47.5Very low166 Ų166140.3 Ų140.389%0.88871%0.707SS**  trans-175.6165.6143.7-93.2-19.1000108
11G31.8Very low49Very low70 Ų70137.9 Ų137.972%0.72270%0.695SS**  trans-42142.817000000111.5
12M36.9Very low50.6Low134 Ų134129.1 Ų129.166%0.6666%0.66SS**  -121.7114.159.9-69.6170.4169.700110.5F14M12-F14 PolarHBondContact O-N 3.45Å
13K36.3Very low52.1Low193 Ų193128.4 Ų128.484%0.83965%0.648SS**  -52.9110.8126.3-75.6179.8178.4179.50101.4S15K13-S15 PolarHBondContact O-N 3.15Å
14F41Very low54.1Low145 Ų145123.8 Ų123.864%0.63662%0.622SS**  trans-54.497.4148.9-94.8-84.1000100.9M12 T16 E18M12-F14 PolarHBondContact O-N 3.45Å; F14-T16 PolarHBondContact O-N 2.74Å; F14-E18 HydrophobicContact CD1-CB 3.73Å; F14-E18 WeakPolarHBondContact CD1-OE2 3.32Å; F14-E18 HydrophobicContact CE1-CB 4.3Å; F14-E18 WeakPolarHBondContact CE1-OE2 3.34Å
15S43.8Very low55.9Low53 Ų53118.8 Ų118.837%0.37161%0.606SS.*  trans-53.6138.5178177.70000101.9K13 E17 E18K13-S15 PolarHBondContact O-N 3.15Å; S15-E17 CarbonylContact O-C 3.4Å; S15-E17 WeakPolarHBondContact O-CA 3.48Å; S15-E17 PolarHBondContact O-N 3.28Å; S15-E17 WeakPolarHBondContact OG-CB 3.39Å; S15-E17 PolarHBondContact OG-N 2.75Å; S15-E18 PolarHBondContact O-N 3.31Å
16T57.3Low57.1Low125 Ų125114 Ų11477%0.76759%0.592SS**Hα-helixtrans-43.4-23.2166.941.40000110.8F14 R20F14-T16 PolarHBondContact O-N 2.74Å; T16-R20 VanDerWaalsContact O-CB 3.22Å; T16-R20 WeakPolarHBondContact O-CB 3.47Å; T16-R20 PolarHBondContact O-N 3.21Å
17E70.4Confident58.7Low72 Ų72110.3 Ų110.334%0.33657%0.572SS.*Hα-helixtrans-57.3-49.4163.3-151.268.9-173.900118.6S15 T19 R20 I21S15-E17 CarbonylContact O-C 3.4Å; S15-E17 WeakPolarHBondContact O-CA 3.48Å; S15-E17 PolarHBondContact O-N 3.28Å; S15-E17 WeakPolarHBondContact OG-CB 3.39Å; S15-E17 PolarHBondContact OG-N 2.75Å; E17-T19 PolarHBondContact O-N 2.97Å; E17-R20 VanDerWaalsContact CD-CZ 3.48Å; E17-R20 CarbonylContact O-C 3.59Å; E17-R20 WeakPolarHBondContact O-CA 3.22Å; E17-R20 WeakPolarHBondContact O-CB 3.24Å; E17-R20 PolarHBondContact O-N 3.14Å; E17-R20 VanDerWaalsContact O-N 3.14Å; E17-R20 IonicContact OE1-CZ 3.46Å; E17-R20 IonicContact OE1-NE 2.81Å; E17-R20 IonicContact OE1-NH1 3.98Å; E17-R20 PolarHBondContact OE1-NH1 2.75Å; E17-R20 IonicContact OE1-NH2 2.99Å; E17-R20 PolarHBondContact OE1-NH2 3.49Å; E17-R20 IonicContact OE2-CZ 3.46Å; E17-R20 IonicContact OE2-NH1 3.85Å; E17-R20 PolarHBondContact OE2-NH1 2.77Å; E17-R20 IonicContact OE2-NH2 3.48Å; E17-I21 HydrophobicContact CG-CD1 4.06Å; E17-I21 VanDerWaalsContact O-CG1 3.24Å; E17-I21 WeakPolarHBondContact O-CG1 3.47Å; E17-I21 PolarHBondContact O-N 3.05Å
18E68Low60.8Low72 Ų72114 Ų11434%0.33657%0.574SS.*Hα-helixtrans-68.2-39.1-176.1-78.8177.4166.300111.5F14 S15 R20 I21 A22F14-E18 HydrophobicContact CD1-CB 3.73Å; F14-E18 WeakPolarHBondContact CD1-OE2 3.32Å; F14-E18 HydrophobicContact CE1-CB 4.3Å; F14-E18 WeakPolarHBondContact CE1-OE2 3.34Å; S15-E18 PolarHBondContact O-N 3.31Å; E18-R20 VanDerWaalsContact C-N 3.33Å; E18-I21 PolarHBondContact O-N 3.29Å; E18-A22 PolarHBondContact O-N 3.22Å
19T67.1Low63Low65 Ų65108.8 Ų108.840%0.39956%0.558SS.*Hα-helixtrans-66.4-38.8171-30.80000110.5E17 A22 Y23E17-T19 PolarHBondContact O-N 2.97Å; T19-A22 PolarHBondContact O-N 2.67Å; T19-Y23 HydrophobicContact CG2-CD2 4.04Å; T19-Y23 HydrophobicContact CG2-CE2 3.77Å; T19-Y23 WeakPolarHBondContact O-CD2 3.09Å; T19-Y23 PolarHBondContact O-N 3.02Å
20R73.5Confident64.9Low115 Ų115108.9 Ų108.943%0.43455%0.55SS.*Hα-helixtrans-59.7-47.3173.9-162.3-171.592.3-149-10.1111.6T16 E17 E18 A22 Y23 E24T16-R20 VanDerWaalsContact O-CB 3.22Å; T16-R20 WeakPolarHBondContact O-CB 3.47Å; T16-R20 PolarHBondContact O-N 3.21Å; E17-R20 VanDerWaalsContact CD-CZ 3.48Å; E17-R20 CarbonylContact O-C 3.59Å; E17-R20 WeakPolarHBondContact O-CA 3.22Å; E17-R20 WeakPolarHBondContact O-CB 3.24Å; E17-R20 PolarHBondContact O-N 3.14Å; E17-R20 VanDerWaalsContact O-N 3.14Å; E17-R20 IonicContact OE1-CZ 3.46Å; E17-R20 IonicContact OE1-NE 2.81Å; E17-R20 IonicContact OE1-NH1 3.98Å; E17-R20 PolarHBondContact OE1-NH1 2.75Å; E17-R20 IonicContact OE1-NH2 2.99Å; E17-R20 PolarHBondContact OE1-NH2 3.49Å; E17-R20 IonicContact OE2-CZ 3.46Å; E17-R20 IonicContact OE2-NH1 3.85Å; E17-R20 PolarHBondContact OE2-NH1 2.77Å; E17-R20 IonicContact OE2-NH2 3.48Å; E18-R20 VanDerWaalsContact C-N 3.33Å; R20-A22 VanDerWaalsContact C-N 3.32Å; R20-A22 PolarHBondContact O-N 3.06Å; R20-Y23 CarbonylContact O-C 3.59Å; R20-Y23 PolarHBondContact O-N 3.46Å; R20-Y23 VanDerWaalsContact O-N 3.15Å; R20-E24 HydrophobicContact CG-CG 4.48Å; R20-E24 IonicContact CZ-OE1 3.99Å; R20-E24 IonicContact NE-OE1 3.03Å; R20-E24 PolarHBondContact NE-OE1 3.38Å; R20-E24 IonicContact NE-OE2 2.71Å; R20-E24 IonicContact NH2-OE1 2.72Å; R20-E24 PolarHBondContact NH2-OE1 2.83Å; R20-E24 IonicContact NH2-OE2 2.73Å; R20-E24 WeakPolarHBondContact O-CB 3.45Å; R20-E24 WeakPolarHBondContact O-CG 3.49Å; R20-E24 PolarHBondContact O-N 2.81Å
21I78.8Confident67.4Low90 Ų90105.6 Ų105.646%0.46253%0.533SS..Hα-helixtrans-60.6-41.4177.8-69.5163.9000110.7E17 E18 E24 K25E17-I21 HydrophobicContact CG-CD1 4.06Å; E17-I21 VanDerWaalsContact O-CG1 3.24Å; E17-I21 WeakPolarHBondContact O-CG1 3.47Å; E17-I21 PolarHBondContact O-N 3.05Å; E18-I21 PolarHBondContact O-N 3.29Å; I21-E24 PolarHBondContact O-N 2.84Å; I21-K25 WeakPolarHBondContact O-CB 3.48Å; I21-K25 PolarHBondContact O-N 2.75Å
22A75.7Confident70Confident53 Ų53108.7 Ų108.744%0.43853%0.526SS..Hα-helixtrans-66-37.4176.500000112.7E18 T19 R20 K26E18-A22 PolarHBondContact O-N 3.22Å; T19-A22 PolarHBondContact O-N 2.67Å; R20-A22 VanDerWaalsContact C-N 3.32Å; R20-A22 PolarHBondContact O-N 3.06Å; A22-K26 PolarHBondContact O-N 2.6Å
23Y73.9Confident72.3Confident156 Ų156106.4 Ų106.461%0.61252%0.517SS*.Hα-helixtrans-70.3-40.6173.2-82-66.1000112.3T19 R20 K26 L27T19-Y23 HydrophobicContact CG2-CD2 4.04Å; T19-Y23 HydrophobicContact CG2-CE2 3.77Å; T19-Y23 WeakPolarHBondContact O-CD2 3.09Å; T19-Y23 PolarHBondContact O-N 3.02Å; R20-Y23 CarbonylContact O-C 3.59Å; R20-Y23 PolarHBondContact O-N 3.46Å; R20-Y23 VanDerWaalsContact O-N 3.15Å; Y23-K26 PolarHBondContact O-N 2.73Å; Y23-L27 WeakPolarHBondContact O-CG 3.37Å; Y23-L27 PolarHBondContact O-N 2.71Å
24E81.1Confident74.6Confident79 Ų79101.7 Ų101.737%0.36950%0.5SS..Hα-helixtrans-58.6-46.1174.2-77.8170.1177.200110.8R20 I21 K26 L27 E28R20-E24 HydrophobicContact CG-CG 4.48Å; R20-E24 IonicContact CZ-OE1 3.99Å; R20-E24 IonicContact NE-OE1 3.03Å; R20-E24 PolarHBondContact NE-OE1 3.38Å; R20-E24 IonicContact NE-OE2 2.71Å; R20-E24 IonicContact NH2-OE1 2.72Å; R20-E24 PolarHBondContact NH2-OE1 2.83Å; R20-E24 IonicContact NH2-OE2 2.73Å; R20-E24 WeakPolarHBondContact O-CB 3.45Å; R20-E24 WeakPolarHBondContact O-CG 3.49Å; R20-E24 PolarHBondContact O-N 2.81Å; I21-E24 PolarHBondContact O-N 2.84Å; E24-K26 PolarHBondContact O-N 3.15Å; E24-L27 WeakPolarHBondContact O-CB 3.45Å; E24-L27 PolarHBondContact O-N 3.5Å; E24-L27 VanDerWaalsContact O-N 3.16Å; E24-E28 PolarHBondContact O-N 3.43Å
25K85.1Confident76.9Confident126 Ų126101.4 Ų101.455%0.54850%0.501SS..Hα-helixtrans-62.4-40.3176.2-173.3179.9176.4-173.90112.8I21 L27 E28 E29I21-K25 WeakPolarHBondContact O-CB 3.48Å; I21-K25 PolarHBondContact O-N 2.75Å; K25-L27 VanDerWaalsContact C-N 3.32Å; K25-E28 PolarHBondContact O-N 2.96Å; K25-E29 WeakPolarHBondContact CE-OE1 3.32Å; K25-E29 WeakPolarHBondContact O-CG 3.46Å; K25-E29 PolarHBondContact O-N 3.46Å
26K78.5Confident79Confident133 Ų133103 Ų10358%0.57851%0.506SS*.Hα-helixtrans-67-34175.3-79.7-174.2176.9-178.80112.3A22 Y23 E24 E29 L30A22-K26 PolarHBondContact O-N 2.6Å; Y23-K26 PolarHBondContact O-N 2.73Å; E24-K26 PolarHBondContact O-N 3.15Å; K26-E29 PolarHBondContact O-N 2.89Å; K26-L30 WeakPolarHBondContact O-CB 3.48Å; K26-L30 VanDerWaalsContact O-CG 3.29Å; K26-L30 WeakPolarHBondContact O-CG 3.49Å; K26-L30 PolarHBondContact O-N 3.28Å
27L80.6Confident80.4Confident99 Ų99100.8 Ų100.852%0.51849%0.488SS..Hα-helixtrans-65.5-45.3173-80.6159.9000110.6Y23 E24 K25 E29 L30 D31Y23-L27 WeakPolarHBondContact O-CG 3.37Å; Y23-L27 PolarHBondContact O-N 2.71Å; E24-L27 WeakPolarHBondContact O-CB 3.45Å; E24-L27 PolarHBondContact O-N 3.5Å; E24-L27 VanDerWaalsContact O-N 3.16Å; K25-L27 VanDerWaalsContact C-N 3.32Å; L27-E29 VanDerWaalsContact C-N 3.32Å; L27-E29 PolarHBondContact O-N 2.97Å; L27-L30 WeakPolarHBondContact O-CB 3.16Å; L27-L30 PolarHBondContact O-N 3.19Å; L27-L30 VanDerWaalsContact O-N 3.1Å; L27-D31 PolarHBondContact O-N 3.4Å
28E85.4Confident81.2Confident135 Ų135100.8 Ų100.863%0.63150%0.496SS*.Hα-helixtrans-60.5-39.2173.8-72.1178.1174.600112.7E24 K25 L30 D31 K32E24-E28 PolarHBondContact O-N 3.43Å; K25-E28 PolarHBondContact O-N 2.96Å; E28-L30 VanDerWaalsContact C-N 3.33Å; E28-D31 PolarHBondContact O-N 2.78Å; E28-K32 WeakPolarHBondContact O-CB 3.39Å; E28-K32 PolarHBondContact O-N 2.92Å
29E84.5Confident82.2Confident111 Ų11199.3 Ų99.352%0.51950%0.496SS..Hα-helixtrans-65.8-34.7174.7-74.8173.7-170.800112.4K25 K26 L27 L33K25-E29 WeakPolarHBondContact CE-OE1 3.32Å; K25-E29 WeakPolarHBondContact O-CG 3.46Å; K25-E29 PolarHBondContact O-N 3.46Å; K26-E29 PolarHBondContact O-N 2.89Å; L27-E29 VanDerWaalsContact C-N 3.32Å; L27-E29 PolarHBondContact O-N 2.97Å; E29-L33 WeakPolarHBondContact O-CB 3.42Å; E29-L33 PolarHBondContact O-N 3.15Å; E29-L33 VanDerWaalsContact O-N 3.14Å
30L79.6Confident83.1Confident95 Ų95100.3 Ų100.350%0.49750%0.499SS..Hα-helixtrans-71.7-44.5174.5-75.7169000111.6K26 L27 E28 K32 L33 D34K26-L30 WeakPolarHBondContact O-CB 3.48Å; K26-L30 VanDerWaalsContact O-CG 3.29Å; K26-L30 WeakPolarHBondContact O-CG 3.49Å; K26-L30 PolarHBondContact O-N 3.28Å; L27-L30 WeakPolarHBondContact O-CB 3.16Å; L27-L30 PolarHBondContact O-N 3.19Å; L27-L30 VanDerWaalsContact O-N 3.1Å; E28-L30 VanDerWaalsContact C-N 3.33Å; L30-K32 VanDerWaalsContact C-N 3.28Å; L30-K32 PolarHBondContact O-N 2.87Å; L30-L33 WeakPolarHBondContact O-CB 3.37Å; L30-L33 PolarHBondContact O-N 3.38Å; L30-L33 VanDerWaalsContact O-N 3.08Å; L30-D34 PolarHBondContact O-N 3.41Å
31D85.6Confident83.7Confident97 Ų97101 Ų10152%0.51951%0.507SS..Hα-helixtrans-58.8-42.9176.9-71.4-21.9000110.7L27 E28 L33 D34 E35L27-D31 PolarHBondContact O-N 3.4Å; E28-D31 PolarHBondContact O-N 2.78Å; D31-L33 VanDerWaalsContact C-N 3.35Å; D31-L33 PolarHBondContact O-N 3.25Å; D31-D34 PolarHBondContact O-N 3.32Å; D31-E35 PolarHBondContact O-N 3.04Å
32K87.5Confident84.2Confident134 Ų13499.7 Ų99.758%0.58351%0.51SS*.Hα-helixtrans-65.1-37.1175.7-170.9175.9-179.7-179.10112.8E28 L30 E35 D36E28-K32 WeakPolarHBondContact O-CB 3.39Å; E28-K32 PolarHBondContact O-N 2.92Å; L30-K32 VanDerWaalsContact C-N 3.28Å; L30-K32 PolarHBondContact O-N 2.87Å; K32-E35 PolarHBondContact O-N 3.46Å; K32-D36 PolarHBondContact O-N 2.9Å
33L85Confident84.8Confident87 Ų87105.3 Ų105.346%0.45552%0.52SS..Hα-helixtrans-67-39.9176.2-17468.2000111.2E29 L30 D31 E35 D36 I37E29-L33 WeakPolarHBondContact O-CB 3.42Å; E29-L33 PolarHBondContact O-N 3.15Å; E29-L33 VanDerWaalsContact O-N 3.14Å; L30-L33 WeakPolarHBondContact O-CB 3.37Å; L30-L33 PolarHBondContact O-N 3.38Å; L30-L33 VanDerWaalsContact O-N 3.08Å; D31-L33 VanDerWaalsContact C-N 3.35Å; D31-L33 PolarHBondContact O-N 3.25Å; L33-E35 VanDerWaalsContact C-N 3.34Å; L33-D36 PolarHBondContact O-N 2.99Å; L33-I37 HydrophobicContact CG-CD1 4.06Å; L33-I37 WeakPolarHBondContact O-CB 3.4Å; L33-I37 VanDerWaalsContact O-CG1 3.25Å; L33-I37 WeakPolarHBondContact O-CG1 3.46Å; L33-I37 PolarHBondContact O-N 2.93Å
34D84.8Confident85.2Confident94 Ų94103.5 Ų103.550%0.50352%0.52SS..Hα-helixtrans-65.5-36.9175.7-78.9-9.3000111.6L30 D31 S38L30-D34 PolarHBondContact O-N 3.41Å; D31-D34 PolarHBondContact O-N 3.32Å; D34-S38 WeakPolarHBondContact O-CB 3.02Å; D34-S38 PolarHBondContact O-N 3.18Å; D34-S38 PolarHBondContact O-OG 3.24Å
35E89.6Confident85.5Confident139 Ų139103.5 Ų103.565%0.6553%0.529SS*.Hα-helixtrans-63-45.9170.8-75.4-176.3174.500112.2D31 K32 L33 S38 A39D31-E35 PolarHBondContact O-N 3.04Å; K32-E35 PolarHBondContact O-N 3.46Å; L33-E35 VanDerWaalsContact C-N 3.34Å; E35-S38 PolarHBondContact O-N 2.88Å; E35-A39 WeakPolarHBondContact O-CB 3.48Å; E35-A39 PolarHBondContact O-N 3.09Å
36D87.8Confident85.7Confident87 Ų87100.5 Ų100.547%0.46553%0.527SS..Hα-helixtrans-64.3-42.2178.5-77.8-22.9000111.4K32 L33 A39 D40K32-D36 PolarHBondContact O-N 2.9Å; L33-D36 PolarHBondContact O-N 2.99Å; D36-A39 PolarHBondContact O-N 3.43Å; D36-D40 PolarHBondContact O-N 3.27Å
37I85.5Confident85.7Confident77 Ų7796.9 Ų96.940%0.39552%0.522SS..Hα-helixtrans-60.9-46.9174.2-71167.2000110.2L33 A39 D40 E41L33-I37 HydrophobicContact CG-CD1 4.06Å; L33-I37 WeakPolarHBondContact O-CB 3.4Å; L33-I37 VanDerWaalsContact O-CG1 3.25Å; L33-I37 WeakPolarHBondContact O-CG1 3.46Å; L33-I37 PolarHBondContact O-N 2.93Å; I37-A39 VanDerWaalsContact C-N 3.29Å; I37-A39 PolarHBondContact O-N 2.83Å; I37-D40 PolarHBondContact O-N 3.47Å; I37-E41 HydrophobicContact CG2-CG 4.38Å; I37-E41 WeakPolarHBondContact O-CB 3.32Å; I37-E41 WeakPolarHBondContact O-CG 3.49Å; I37-E41 PolarHBondContact O-N 3.23Å
38S88Confident85.9Confident73 Ų7395.8 Ų95.851%0.5152%0.52SS..Hα-helixtrans-60.9-39.1178.4-62.10000111.9D34 E35 A42D34-S38 WeakPolarHBondContact O-CB 3.02Å; D34-S38 PolarHBondContact O-N 3.18Å; D34-S38 PolarHBondContact O-OG 3.24Å; E35-S38 PolarHBondContact O-N 2.88Å; S38-A42 WeakPolarHBondContact O-CB 3.37Å; S38-A42 PolarHBondContact O-N 3.4Å; S38-A42 VanDerWaalsContact O-N 3.08Å
39A88.2Confident86Confident41 Ų4196.2 Ų96.234%0.33952%0.52SS..Hα-helixtrans-67.7-40.4176.600000112.3E35 D36 I37 A42 R43E35-A39 WeakPolarHBondContact O-CB 3.48Å; E35-A39 PolarHBondContact O-N 3.09Å; D36-A39 PolarHBondContact O-N 3.43Å; I37-A39 VanDerWaalsContact C-N 3.29Å; I37-A39 PolarHBondContact O-N 2.83Å; A39-A42 PolarHBondContact O-N 2.88Å; A39-R43 WeakPolarHBondContact O-CG 3.41Å; A39-R43 PolarHBondContact O-N 3Å
40D85.8Confident86Confident86 Ų8694.8 Ų94.846%0.4651%0.512SS..Hα-helixtrans-72.4-35.6177.8-80.2-12000112.4D36 I37 A42 R43 L44D36-D40 PolarHBondContact O-N 3.27Å; I37-D40 PolarHBondContact O-N 3.47Å; D40-A42 VanDerWaalsContact C-N 3.33Å; D40-A42 PolarHBondContact O-N 3.32Å; D40-R43 PolarHBondContact O-N 2.95Å; D40-R43 IonicContact OD1-CZ 3.99Å; D40-R43 IonicContact OD1-NH1 2.6Å; D40-R43 PolarHBondContact OD1-NH1 3.44Å; D40-L44 WeakPolarHBondContact O-CB 3.5Å; D40-L44 PolarHBondContact O-N 2.99Å
41E87Confident86Confident129 Ų12994 Ų9460%0.60351%0.513SS*.Hα-helixtrans-60.5-42.4169.6-76.2-173.2168.600111.6I37 L44 S45I37-E41 HydrophobicContact CG2-CG 4.38Å; I37-E41 WeakPolarHBondContact O-CB 3.32Å; I37-E41 WeakPolarHBondContact O-CG 3.49Å; I37-E41 PolarHBondContact O-N 3.23Å; E41-L44 PolarHBondContact O-N 2.89Å; E41-S45 WeakPolarHBondContact O-CB 3.29Å; E41-S45 PolarHBondContact O-N 3.46Å
42A88.9Confident85.9Confident63 Ų6393.1 Ų93.152%0.52151%0.514SS..Hα-helixtrans-63.6-41.6175.400000112.1S38 A39 D40 S45 A46S38-A42 WeakPolarHBondContact O-CB 3.37Å; S38-A42 PolarHBondContact O-N 3.4Å; S38-A42 VanDerWaalsContact O-N 3.08Å; A39-A42 PolarHBondContact O-N 2.88Å; D40-A42 VanDerWaalsContact C-N 3.33Å; D40-A42 PolarHBondContact O-N 3.32Å; A42-S45 PolarHBondContact O-N 3.47Å; A42-A46 WeakPolarHBondContact O-CB 3.4Å; A42-A46 PolarHBondContact O-N 3.49Å
43R88.5Confident85.6Confident171 Ų17191.7 Ų91.765%0.64551%0.509SS*.Hα-helixtrans-65-42.9175.1-73.3170.5179.8163-0.4112A39 D40 S45 A46 A47A39-R43 WeakPolarHBondContact O-CG 3.41Å; A39-R43 PolarHBondContact O-N 3Å; D40-R43 PolarHBondContact O-N 2.95Å; D40-R43 IonicContact OD1-CZ 3.99Å; D40-R43 IonicContact OD1-NH1 2.6Å; D40-R43 PolarHBondContact OD1-NH1 3.44Å; R43-S45 VanDerWaalsContact C-N 3.35Å; R43-A46 PolarHBondContact O-N 2.83Å; R43-A47 WeakPolarHBondContact O-CB 3.47Å; R43-A47 PolarHBondContact O-N 3.01Å
44L83.3Confident85.5Confident117 Ų11792.7 Ų92.761%0.61351%0.507SS*.Hα-helixtrans-63.7-42.2177.4-17666000111D40 E41 A47 T48D40-L44 WeakPolarHBondContact O-CB 3.5Å; D40-L44 PolarHBondContact O-N 2.99Å; E41-L44 PolarHBondContact O-N 2.89Å; L44-A47 PolarHBondContact O-N 3.1Å; L44-T48 VanDerWaalsContact O-CB 3.31Å; L44-T48 WeakPolarHBondContact O-CB 3.39Å; L44-T48 PolarHBondContact O-N 3.39Å; L44-T48 PolarHBondContact O-OG1 3.38Å
45S87.2Confident85.4Confident80 Ų8095.1 Ų95.156%0.55951%0.513SS*.Hα-helixtrans-61.7-44.9174.6-176.10000111.7E41 A42 R43 T48 K49E41-S45 WeakPolarHBondContact O-CB 3.29Å; E41-S45 PolarHBondContact O-N 3.46Å; A42-S45 PolarHBondContact O-N 3.47Å; R43-S45 VanDerWaalsContact C-N 3.35Å; S45-T48 PolarHBondContact O-N 2.96Å; S45-K49 WeakPolarHBondContact O-CB 3.29Å; S45-K49 PolarHBondContact O-N 2.92Å
46A87.5Confident85Confident62 Ų6293.4 Ų93.451%0.51251%0.505SS..Hα-helixtrans-63.2-43.2175.800000112.6A42 R43 K49 K50A42-A46 WeakPolarHBondContact O-CB 3.4Å; A42-A46 PolarHBondContact O-N 3.49Å; R43-A46 PolarHBondContact O-N 2.83Å; A46-K49 PolarHBondContact O-N 3.16Å; A46-K50 PolarHBondContact O-N 3.42Å
47A80.4Confident84.7Confident57 Ų5794.4 Ų94.447%0.47151%0.507SS..Hα-helixtrans-64.4-41.8176.300000111.8R43 L44 K50 C51R43-A47 WeakPolarHBondContact O-CB 3.47Å; R43-A47 PolarHBondContact O-N 3.01Å; L44-A47 PolarHBondContact O-N 3.1Å; A47-K50 PolarHBondContact O-N 3.19Å; A47-C51 WeakPolarHBondContact O-CB 3.38Å; A47-C51 PolarHBondContact O-N 3.22Å
48T83.4Confident84.3Confident76 Ų7696.6 Ų96.647%0.46652%0.519SS..Hα-helixtrans-61.6-46.1176.1-58.30000110.6L44 S45 K50 C51 C52L44-T48 VanDerWaalsContact O-CB 3.31Å; L44-T48 WeakPolarHBondContact O-CB 3.39Å; L44-T48 PolarHBondContact O-N 3.39Å; L44-T48 PolarHBondContact O-OG1 3.38Å; S45-T48 PolarHBondContact O-N 2.96Å; T48-K50 VanDerWaalsContact C-N 3.32Å; T48-K50 PolarHBondContact O-N 3.28Å; T48-C51 PolarHBondContact O-N 3.48Å; T48-C52 PolarHBondContact O-N 3.35Å; T48-C52 PolarHBondContact O-SG 3.47Å; T48-C52 VanDerWaalsContact O-SG 3.36Å
49K88.2Confident83.9Confident145 Ų14596.4 Ų96.463%0.6351%0.511SS*.Hα-helixtrans-58.9-43.1176.3-172177.5-178.7179.30112S45 A46 C52 Q53S45-K49 WeakPolarHBondContact O-CB 3.29Å; S45-K49 PolarHBondContact O-N 2.92Å; A46-K49 PolarHBondContact O-N 3.16Å; K49-C52 PolarHBondContact O-N 2.87Å; K49-Q53 WeakPolarHBondContact O-CG 3.33Å; K49-Q53 PolarHBondContact O-N 3.3Å
50K84.1Confident83.5Confident81 Ų8199.6 Ų99.635%0.35252%0.519SS..Hα-helixtrans-66.1-40.2177.2-162.6-179.6-169.4-175.20112.2A46 A47 T48 Q53 W54A46-K50 PolarHBondContact O-N 3.42Å; A47-K50 PolarHBondContact O-N 3.19Å; T48-K50 VanDerWaalsContact C-N 3.32Å; T48-K50 PolarHBondContact O-N 3.28Å; K50-Q53 WeakPolarHBondContact O-CB 3.43Å; K50-Q53 PolarHBondContact O-N 2.98Å; K50-W54 HydrophobicContact CD-CH2 4.15Å; K50-W54 HydrophobicContact CD-CZ2 3.9Å; K50-W54 HydrophobicContact CG-CD2 4.37Å; K50-W54 HydrophobicContact CG-CZ2 4.11Å; K50-W54 PolarHBondContact O-N 2.98Å
51C78.9Confident82.8Confident77 Ų7799.3 Ų99.352%0.5252%0.521SS..Hα-helixtrans-63.3-41.4175.1-170.70000111.6A47 T48 Q53 W54 K55A47-C51 WeakPolarHBondContact O-CB 3.38Å; A47-C51 PolarHBondContact O-N 3.22Å; T48-C51 PolarHBondContact O-N 3.48Å; C51-Q53 PolarHBondContact O-N 3.31Å; C51-W54 PolarHBondContact O-N 3.47Å; C51-K55 WeakPolarHBondContact O-CB 3.32Å; C51-K55 PolarHBondContact O-N 2.88Å
52C85.3Confident82.2Confident80 Ų8098.3 Ų98.354%0.54152%0.519SS..Hα-helixtrans-61.8-40.9173.1-69.10000112.3T48 K49 K55 Q56T48-C52 PolarHBondContact O-N 3.35Å; T48-C52 PolarHBondContact O-SG 3.47Å; T48-C52 VanDerWaalsContact O-SG 3.36Å; K49-C52 PolarHBondContact O-N 2.87Å; C52-K55 PolarHBondContact O-N 2.99Å; C52-Q56 PolarHBondContact O-N 3.37Å
53Q80.8Confident81.7Confident103 Ų103101.7 Ų101.748%0.48152%0.524SS..Hα-helixtrans-62-49.2174.9-74.1173.6-25.300111.8K49 K50 C51 K55 Q56 E57K49-Q53 WeakPolarHBondContact O-CG 3.33Å; K49-Q53 PolarHBondContact O-N 3.3Å; K50-Q53 WeakPolarHBondContact O-CB 3.43Å; K50-Q53 PolarHBondContact O-N 2.98Å; C51-Q53 PolarHBondContact O-N 3.31Å; Q53-K55 VanDerWaalsContact C-N 3.3Å; Q53-K55 PolarHBondContact O-N 3.48Å; Q53-Q56 WeakPolarHBondContact O-CB 3.49Å; Q53-Q56 PolarHBondContact O-N 3.31Å; Q53-Q56 VanDerWaalsContact O-N 3.07Å; Q53-E57 WeakPolarHBondContact O-CG 3.43Å; Q53-E57 PolarHBondContact O-N 3.31Å
54W82.1Confident81Confident109 Ų10995.6 Ų95.641%0.41351%0.508SS..Hα-helixtrans-62.5-36.3177.1-69.3-21.7000113.1K50 C51 Q56 E57 L58 L284K50-W54 HydrophobicContact CD-CH2 4.15Å; K50-W54 HydrophobicContact CD-CZ2 3.9Å; K50-W54 HydrophobicContact CG-CD2 4.37Å; K50-W54 HydrophobicContact CG-CZ2 4.11Å; K50-W54 PolarHBondContact O-N 2.98Å; C51-W54 PolarHBondContact O-N 3.47Å; W54-Q56 VanDerWaalsContact C-N 3.29Å; W54-Q56 PolarHBondContact O-N 2.95Å; W54-E57 PolarHBondContact O-N 2.9Å; W54-L58 VanDerWaalsContact O-CB 3.3Å; W54-L58 WeakPolarHBondContact O-CB 3.47Å; W54-L58 PolarHBondContact O-N 2.88Å; W54-L284 HydrophobicContact CH2-CD1 3.68Å; W54-L284 HydrophobicContact CH2-CD2 3.78Å; W54-L284 HydrophobicContact CH2-CG 4.35Å; W54-L284 HydrophobicContact CZ2-CD1 3.61Å; W54-L284 HydrophobicContact CZ2-CD2 3.97Å; W54-L284 HydrophobicContact CZ2-CG 4.46Å
55K84.1Confident80.3Confident145 Ų14594.2 Ų94.263%0.6350%0.501SS*.Hα-helixtrans-63.5-38.4174.4-170.6175.5-179.1179.40111.2C51 C52 Q53 I59C51-K55 WeakPolarHBondContact O-CB 3.32Å; C51-K55 PolarHBondContact O-N 2.88Å; C52-K55 PolarHBondContact O-N 2.99Å; Q53-K55 VanDerWaalsContact C-N 3.3Å; Q53-K55 PolarHBondContact O-N 3.48Å; K55-I59 HydrophobicContact CG-CD1 4.41Å; K55-I59 WeakPolarHBondContact O-CD1 3.48Å; K55-I59 VanDerWaalsContact O-CG1 3.24Å; K55-I59 WeakPolarHBondContact O-CG1 3.44Å; K55-I59 PolarHBondContact O-N 3.37Å; K55-I59 VanDerWaalsContact O-N 3.13Å
56Q81.3Confident79.8Confident103 Ų10394.1 Ų94.148%0.48150%0.498SS..Hα-helixtrans-68.1-47175.8-171.763.526.600111.6C52 Q53 W54 L58 I59 E60C52-Q56 PolarHBondContact O-N 3.37Å; Q53-Q56 WeakPolarHBondContact O-CB 3.49Å; Q53-Q56 PolarHBondContact O-N 3.31Å; Q53-Q56 VanDerWaalsContact O-N 3.07Å; W54-Q56 VanDerWaalsContact C-N 3.29Å; W54-Q56 PolarHBondContact O-N 2.95Å; Q56-L58 VanDerWaalsContact C-N 3.3Å; Q56-L58 PolarHBondContact O-N 3.31Å; Q56-I59 WeakPolarHBondContact O-CB 3.25Å; Q56-I59 PolarHBondContact O-N 2.79Å; Q56-I59 VanDerWaalsContact O-N 3.15Å; Q56-E60 WeakPolarHBondContact O-CG 3.33Å; Q56-E60 PolarHBondContact O-N 2.98Å
57E80.9Confident79.2Confident108 Ų108100.8 Ų100.851%0.50551%0.51SS..Hα-helixtrans-58.8-41175.4-71.4171.7-172.800111.7Q53 W54 I59 E60 V61Q53-E57 WeakPolarHBondContact O-CG 3.43Å; Q53-E57 PolarHBondContact O-N 3.31Å; W54-E57 PolarHBondContact O-N 2.9Å; E57-I59 VanDerWaalsContact C-N 3.35Å; E57-I59 PolarHBondContact O-N 2.92Å; E57-E60 PolarHBondContact O-N 3.42Å; E57-V61 WeakPolarHBondContact O-CG2 3.46Å; E57-V61 PolarHBondContact O-N 3.47Å
58L76.9Confident78.8Confident123 Ų123103.2 Ų103.264%0.64451%0.513SS*.Hα-helixtrans-63.4-40.9176.6-173.167.7000111.7W54 Q56 E60 V61 D62W54-L58 VanDerWaalsContact O-CB 3.3Å; W54-L58 WeakPolarHBondContact O-CB 3.47Å; W54-L58 PolarHBondContact O-N 2.88Å; Q56-L58 VanDerWaalsContact C-N 3.3Å; Q56-L58 PolarHBondContact O-N 3.31Å; L58-E60 VanDerWaalsContact C-N 3.35Å; L58-V61 PolarHBondContact O-N 3.08Å; L58-D62 VanDerWaalsContact O-CB 3.3Å; L58-D62 WeakPolarHBondContact O-CB 3.35Å; L58-D62 PolarHBondContact O-N 2.9Å
59I79.9Confident78.4Confident68 Ų68108.5 Ų108.535%0.34952%0.524SS..Hα-helixtrans-63.1-42175.2-70.2164000110.6K55 Q56 E57 D62 Q63K55-I59 HydrophobicContact CG-CD1 4.41Å; K55-I59 WeakPolarHBondContact O-CD1 3.48Å; K55-I59 VanDerWaalsContact O-CG1 3.24Å; K55-I59 WeakPolarHBondContact O-CG1 3.44Å; K55-I59 PolarHBondContact O-N 3.37Å; K55-I59 VanDerWaalsContact O-N 3.13Å; Q56-I59 WeakPolarHBondContact O-CB 3.25Å; Q56-I59 PolarHBondContact O-N 2.79Å; Q56-I59 VanDerWaalsContact O-N 3.15Å; E57-I59 VanDerWaalsContact C-N 3.35Å; E57-I59 PolarHBondContact O-N 2.92Å; I59-D62 PolarHBondContact O-N 3.31Å; I59-Q63 HydrophobicContact CG2-CG 4.38Å; I59-Q63 WeakPolarHBondContact O-CB 3.49Å; I59-Q63 VanDerWaalsContact O-CG 3.23Å; I59-Q63 WeakPolarHBondContact O-CG 3.43Å; I59-Q63 PolarHBondContact O-N 3.49Å
60E78.9Confident78Confident109 Ų109106.3 Ų106.351%0.50952%0.523SS..Hα-helixtrans-64.2-43.3178.1-71.7172.7-167.300111.9Q56 E57 L58 Q63 S64Q56-E60 WeakPolarHBondContact O-CG 3.33Å; Q56-E60 PolarHBondContact O-N 2.98Å; E57-E60 PolarHBondContact O-N 3.42Å; L58-E60 VanDerWaalsContact C-N 3.35Å; E60-Q63 PolarHBondContact O-N 3.22Å; E60-S64 WeakPolarHBondContact O-CB 3.43Å; E60-S64 PolarHBondContact O-N 3.43Å
61V72.5Confident77.7Confident80 Ų80109.7 Ų109.749%0.48554%0.535SS..Hα-helixtrans-62.9-46.5174.5172.60000110.7E57 L58 Q63 S64 L65E57-V61 WeakPolarHBondContact O-CG2 3.46Å; E57-V61 PolarHBondContact O-N 3.47Å; L58-V61 PolarHBondContact O-N 3.08Å; V61-Q63 VanDerWaalsContact C-N 3.31Å; V61-Q63 PolarHBondContact O-N 2.99Å; V61-S64 PolarHBondContact O-N 3.07Å; V61-S64 PolarHBondContact O-OG 3.14Å; V61-L65 PolarHBondContact O-N 2.98Å
62D72.7Confident77.3Confident108 Ų108108.1 Ų108.158%0.57853%0.527SS*.Hα-helixtrans-65-34.6-179.1-159.342.6000112.2L58 I59 S64 P66L58-D62 VanDerWaalsContact O-CB 3.3Å; L58-D62 WeakPolarHBondContact O-CB 3.35Å; L58-D62 PolarHBondContact O-N 2.9Å; I59-D62 PolarHBondContact O-N 3.31Å; D62-S64 VanDerWaalsContact C-N 3.34Å; D62-P66 WeakPolarHBondContact O-CD 3.35Å
63Q79.1Confident77.1Confident133 Ų133109 Ų10962%0.62153%0.527SS*.Hα-helixtrans-70-28.3171.9-73.4176.98.400113.3I59 E60 V61I59-Q63 HydrophobicContact CG2-CG 4.38Å; I59-Q63 WeakPolarHBondContact O-CB 3.49Å; I59-Q63 VanDerWaalsContact O-CG 3.23Å; I59-Q63 WeakPolarHBondContact O-CG 3.43Å; I59-Q63 PolarHBondContact O-N 3.49Å; E60-Q63 PolarHBondContact O-N 3.22Å; V61-Q63 VanDerWaalsContact C-N 3.31Å; V61-Q63 PolarHBondContact O-N 2.99Å
64S73.6Confident77.4Confident44 Ų44110.1 Ų110.131%0.30853%0.53SS..Hα-helixtrans-80.3-29.5178.378.40000113.3E60 V61 D62 R67 M68E60-S64 WeakPolarHBondContact O-CB 3.43Å; E60-S64 PolarHBondContact O-N 3.43Å; V61-S64 PolarHBondContact O-N 3.07Å; V61-S64 PolarHBondContact O-OG 3.14Å; D62-S64 VanDerWaalsContact C-N 3.34Å; S64-R67 WeakPolarHBondContact O-CB 3.33Å; S64-R67 PolarHBondContact O-N 3.48Å; S64-R67 VanDerWaalsContact O-N 3.09Å; S64-M68 PolarHBondContact O-N 2.88Å
65L68.7Low77.1Confident87 Ų87109.1 Ų109.146%0.45553%0.532SS..Hα-helixtrans-56.4-46.3-177-85.3170.6000113.5V61 R67 M68 R69V61-L65 PolarHBondContact O-N 2.98Å; L65-R67 VanDerWaalsContact C-N 3.31Å; L65-R67 PolarHBondContact O-N 3.4Å; L65-M68 HydrophobicContact CD2-CE 3.85Å; L65-M68 HydrophobicContact CG-CE 4.37Å; L65-M68 PolarHBondContact O-N 3.37Å; L65-R69 WeakPolarHBondContact O-CB 3.5Å; L65-R69 PolarHBondContact O-N 3.42Å
66P77.6Confident76.8Confident78 Ų78106.8 Ų106.851%0.50653%0.526SS..Hα-helixtrans-58.1-41.5175-27.334.3000112.9D62 R69 T70D62-P66 WeakPolarHBondContact O-CD 3.35Å; P66-R69 PolarHBondContact O-N 2.89Å; P66-T70 PolarHBondContact O-N 2.97Å; P66-T70 PolarHBondContact O-OG1 2.94Å; P66-T70 VanDerWaalsContact O-OG1 3.06Å
67R74.3Confident77Confident203 Ų203107 Ų10777%0.76653%0.527SS*.Hα-helixtrans-65.3-44178.8-65.4-176.8-179.8-179.91.2111.4S64 L65 R69 T70 Y71S64-R67 WeakPolarHBondContact O-CB 3.33Å; S64-R67 PolarHBondContact O-N 3.48Å; S64-R67 VanDerWaalsContact O-N 3.09Å; L65-R67 VanDerWaalsContact C-N 3.31Å; L65-R67 PolarHBondContact O-N 3.4Å; R67-R69 VanDerWaalsContact C-N 3.33Å; R67-R69 PolarHBondContact O-N 3.08Å; R67-T70 PolarHBondContact O-N 2.94Å; R67-Y71 PolarHBondContact O-N 3.46Å
68M71.1Confident77Confident107 Ų107104.7 Ų104.753%0.52752%0.517SS..Hα-helixtrans-63-40175.2-69.3-165.5-64.400111.7S64 L65 Y71 A72S64-M68 PolarHBondContact O-N 2.88Å; L65-M68 HydrophobicContact CD2-CE 3.85Å; L65-M68 HydrophobicContact CG-CE 4.37Å; L65-M68 PolarHBondContact O-N 3.37Å; M68-Y71 PolarHBondContact O-N 3.37Å; M68-A72 WeakPolarHBondContact O-CB 3.41Å; M68-A72 PolarHBondContact O-N 2.85Å
69R76.5Confident76.9Confident188 Ų188101.6 Ų101.671%0.70951%0.506SS*.Hα-helixtrans-65.2-41.1176-174177-87.4175.1-6111.8L65 P66 R67 A72 N73L65-R69 WeakPolarHBondContact O-CB 3.5Å; L65-R69 PolarHBondContact O-N 3.42Å; P66-R69 PolarHBondContact O-N 2.89Å; R67-R69 VanDerWaalsContact C-N 3.33Å; R67-R69 PolarHBondContact O-N 3.08Å; R69-A72 PolarHBondContact O-N 3.22Å; R69-N73 WeakPolarHBondContact O-CB 3.49Å; R69-N73 VanDerWaalsContact O-CG 3.26Å; R69-N73 PolarHBondContact O-N 3.37Å
70T79.2Confident77Confident99 Ų99103.2 Ų103.261%0.60751%0.512SS*.Hα-helixtrans-61.4-44172.9-59.30000111.4P66 R67 N73 K74P66-T70 PolarHBondContact O-N 2.97Å; P66-T70 PolarHBondContact O-OG1 2.94Å; P66-T70 VanDerWaalsContact O-OG1 3.06Å; R67-T70 PolarHBondContact O-N 2.94Å; T70-N73 PolarHBondContact O-N 3Å; T70-K74 PolarHBondContact O-N 3.3Å
71Y77Confident77.2Confident152 Ų152101.6 Ų101.660%0.59651%0.505SS*.Hα-helixtrans-64.5-42.6177.5-173.9-103.5000112.2R67 M68 K74 L75R67-Y71 PolarHBondContact O-N 3.46Å; M68-Y71 PolarHBondContact O-N 3.37Å; Y71-K74 WeakPolarHBondContact O-CB 3.35Å; Y71-K74 PolarHBondContact O-N 2.73Å; Y71-L75 HydrophobicContact CD1-CD1 3.87Å; Y71-L75 HydrophobicContact CD1-CG 4.39Å; Y71-L75 HydrophobicContact CE1-CD1 3.42Å; Y71-L75 VanDerWaalsContact CE1-CD1 3.42Å; Y71-L75 HydrophobicContact CE1-CG 4.02Å; Y71-L75 PolarHBondContact O-N 3.39Å
72A70Confident77.5Confident44 Ų44102.5 Ų102.536%0.36450%0.503SS..Hα-helixtrans-61.5-44.2175.200000111.9M68 R69 K74 L75 I76M68-A72 WeakPolarHBondContact O-CB 3.41Å; M68-A72 PolarHBondContact O-N 2.85Å; R69-A72 PolarHBondContact O-N 3.22Å; A72-K74 VanDerWaalsContact C-N 3.3Å; A72-K74 PolarHBondContact O-N 3.47Å; A72-L75 PolarHBondContact O-N 3.02Å; A72-I76 WeakPolarHBondContact O-CG1 3.49Å; A72-I76 PolarHBondContact O-N 3.21Å
73N83Confident77.8Confident98 Ų98103.1 Ų103.152%0.52450%0.502SS..Hα-helixtrans-63-37.4175.9-72.2-10.9000112R69 T70 I76 H77R69-N73 WeakPolarHBondContact O-CB 3.49Å; R69-N73 VanDerWaalsContact O-CG 3.26Å; R69-N73 PolarHBondContact O-N 3.37Å; T70-N73 PolarHBondContact O-N 3Å; N73-I76 PolarHBondContact O-N 3.34Å; N73-H77 PolarHBondContact O-N 3.36Å
74K85.8Confident77.9Confident126 Ų126102.4 Ų102.455%0.54850%0.499SS..Hα-helixtrans-63-47.1174.2-171.9-177.1176.5-174.60111.3T70 Y71 A72 I76 H77 D78T70-K74 PolarHBondContact O-N 3.3Å; Y71-K74 WeakPolarHBondContact O-CB 3.35Å; Y71-K74 PolarHBondContact O-N 2.73Å; A72-K74 VanDerWaalsContact C-N 3.3Å; A72-K74 PolarHBondContact O-N 3.47Å; K74-I76 VanDerWaalsContact C-N 3.31Å; K74-I76 PolarHBondContact O-N 2.92Å; K74-H77 PolarHBondContact O-N 3.33Å; K74-H77 VanDerWaalsContact O-N 3.17Å; K74-D78 WeakPolarHBondContact O-CB 3.5Å; K74-D78 PolarHBondContact O-N 3.49Å
75L75.7Confident78.2Confident88 Ų88105.5 Ų105.546%0.46151%0.509SS..Hα-helixtrans-60.8-38.5176.9-75.3175000112.8Y71 A72 S79Y71-L75 HydrophobicContact CD1-CD1 3.87Å; Y71-L75 HydrophobicContact CD1-CG 4.39Å; Y71-L75 HydrophobicContact CE1-CD1 3.42Å; Y71-L75 VanDerWaalsContact CE1-CD1 3.42Å; Y71-L75 HydrophobicContact CE1-CG 4.02Å; Y71-L75 PolarHBondContact O-N 3.39Å; A72-L75 PolarHBondContact O-N 3.02Å; L75-S79 WeakPolarHBondContact O-CB 3.47Å; L75-S79 PolarHBondContact O-N 3.06Å
76I79.2Confident78.6Confident97 Ų97106 Ų10650%0.49751%0.512SS..Hα-helixtrans-63.3-45.2175-68.7165.5000110.4A72 N73 K74 S79 Q80A72-I76 WeakPolarHBondContact O-CG1 3.49Å; A72-I76 PolarHBondContact O-N 3.21Å; N73-I76 PolarHBondContact O-N 3.34Å; K74-I76 VanDerWaalsContact C-N 3.31Å; K74-I76 PolarHBondContact O-N 2.92Å; I76-S79 WeakPolarHBondContact O-CB 3.42Å; I76-S79 PolarHBondContact O-N 2.89Å; I76-Q80 WeakPolarHBondContact O-CG 3.31Å; I76-Q80 PolarHBondContact O-N 3.29Å
77H83.7Confident78.8Confident108 Ų108106.1 Ų106.150%0.551%0.514SS..Hα-helixtrans-64.3-46.1178-17653000112.1N73 K74 S79 Q80 M81N73-H77 PolarHBondContact O-N 3.36Å; K74-H77 PolarHBondContact O-N 3.33Å; K74-H77 VanDerWaalsContact O-N 3.17Å; H77-S79 VanDerWaalsContact C-N 3.27Å; H77-S79 PolarHBondContact O-N 2.89Å; H77-Q80 PolarHBondContact O-N 3.34Å; H77-Q80 VanDerWaalsContact O-N 3.16Å; H77-M81 WeakPolarHBondContact O-CG 3.35Å; H77-M81 PolarHBondContact O-N 3.15Å
78D80.5Confident79.2Confident58 Ų58100.2 Ų100.231%0.3150%0.501SS..Hα-helixtrans-59.7-40.1176.5-65.2-11.4000110.5K74 M81 F82K74-D78 WeakPolarHBondContact O-CB 3.5Å; K74-D78 PolarHBondContact O-N 3.49Å; D78-M81 PolarHBondContact O-N 2.84Å; D78-F82 HydrophobicContact CB-CE2 4.45Å; D78-F82 WeakPolarHBondContact O-CD2 3.39Å; D78-F82 WeakPolarHBondContact O-CG 3.38Å; D78-F82 PolarHBondContact O-N 3.1Å
79S75.6Confident79.6Confident58 Ų5899.1 Ų99.141%0.40650%0.5SS..Hα-helixtrans-62.3-41.9175-169.50000112.9L75 I76 H77 F82 E83L75-S79 WeakPolarHBondContact O-CB 3.47Å; L75-S79 PolarHBondContact O-N 3.06Å; I76-S79 WeakPolarHBondContact O-CB 3.42Å; I76-S79 PolarHBondContact O-N 2.89Å; H77-S79 VanDerWaalsContact C-N 3.27Å; H77-S79 PolarHBondContact O-N 2.89Å; S79-F82 PolarHBondContact O-N 3.32Å; S79-E83 WeakPolarHBondContact O-CG 3.47Å; S79-E83 PolarHBondContact O-N 2.82Å
80Q81.8Confident79.8Confident102 Ų10296.6 Ų96.648%0.47749%0.494SS..Hα-helixtrans-65.2-41.2177.4-72.5172.1-2400111.4I76 H77 F82 E83 E84I76-Q80 WeakPolarHBondContact O-CG 3.31Å; I76-Q80 PolarHBondContact O-N 3.29Å; H77-Q80 PolarHBondContact O-N 3.34Å; H77-Q80 VanDerWaalsContact O-N 3.16Å; Q80-F82 VanDerWaalsContact C-N 3.33Å; Q80-F82 PolarHBondContact O-N 2.93Å; Q80-E83 PolarHBondContact O-N 3.41Å; Q80-E84 PolarHBondContact O-N 3.36Å
81M82.6Confident80.1Confident75 Ų7596.4 Ų96.437%0.36949%0.487SS..Hα-helixtrans-60.1-43.1174.5-69.2-59.8-51.600111.6H77 D78 E83 E84 E85H77-M81 WeakPolarHBondContact O-CG 3.35Å; H77-M81 PolarHBondContact O-N 3.15Å; D78-M81 PolarHBondContact O-N 2.84Å; M81-E83 VanDerWaalsContact C-N 3.35Å; M81-E83 PolarHBondContact O-N 3.39Å; M81-E84 PolarHBondContact O-N 2.86Å; M81-E85 WeakPolarHBondContact O-CG 3.44Å; M81-E85 PolarHBondContact O-N 2.96Å
82F80.3Confident80.2Confident99 Ų9995 Ų9543%0.43449%0.486SS..Hα-helixtrans-65.1-35.1176-70.7-51.2000113.3D78 S79 Q80 L86D78-F82 HydrophobicContact CB-CE2 4.45Å; D78-F82 WeakPolarHBondContact O-CD2 3.39Å; D78-F82 WeakPolarHBondContact O-CG 3.38Å; D78-F82 PolarHBondContact O-N 3.1Å; S79-F82 PolarHBondContact O-N 3.32Å; Q80-F82 VanDerWaalsContact C-N 3.33Å; Q80-F82 PolarHBondContact O-N 2.93Å; F82-L86 VanDerWaalsContact O-CB 3.32Å; F82-L86 WeakPolarHBondContact O-CB 3.37Å; F82-L86 WeakPolarHBondContact O-CG 3.44Å; F82-L86 PolarHBondContact O-N 3.46Å
83E78.4Confident80.6Confident121 Ų12197.3 Ų97.357%0.56549%0.491SS*.Hα-helixtrans-66.3-37.4174.8-74.4175.9-179.200112.1S79 Q80 M81 S87S79-E83 WeakPolarHBondContact O-CG 3.47Å; S79-E83 PolarHBondContact O-N 2.82Å; Q80-E83 PolarHBondContact O-N 3.41Å; M81-E83 VanDerWaalsContact C-N 3.35Å; M81-E83 PolarHBondContact O-N 3.39Å; E83-S87 WeakPolarHBondContact O-CB 3.38Å; E83-S87 PolarHBondContact O-N 3.36Å; E83-S87 PolarHBondContact O-OG 3.28Å
84E81Confident80.7Confident119 Ų11997.8 Ų97.856%0.55649%0.489SS*.Hα-helixtrans-68.5-43.4174.6-71.4179.7-176.900112Q80 M81 S87 T88Q80-E84 PolarHBondContact O-N 3.36Å; M81-E84 PolarHBondContact O-N 2.86Å; E84-S87 PolarHBondContact O-N 3.25Å; E84-T88 PolarHBondContact O-N 2.94Å; E84-T88 PolarHBondContact O-OG1 2.99Å
85E80.1Confident80.7Confident108 Ų10895.5 Ų95.551%0.50548%0.482SS..Hα-helixtrans-61.8-46.7174.8-74.6178178.700111.4M81 S87 T88 V89M81-E85 WeakPolarHBondContact O-CG 3.44Å; M81-E85 PolarHBondContact O-N 2.96Å; E85-S87 VanDerWaalsContact C-N 3.32Å; E85-S87 PolarHBondContact O-N 2.93Å; E85-T88 WeakPolarHBondContact O-CB 3.39Å; E85-T88 PolarHBondContact O-N 2.91Å; E85-V89 WeakPolarHBondContact O-CG2 3.44Å; E85-V89 PolarHBondContact O-N 3.41Å
86L75.9Confident81Confident99 Ų9993.8 Ų93.852%0.51848%0.481SS..Hα-helixtrans-59.4-43.6175.6-82.5167.8000111.5F82 T88 V89 F90F82-L86 VanDerWaalsContact O-CB 3.32Å; F82-L86 WeakPolarHBondContact O-CB 3.37Å; F82-L86 WeakPolarHBondContact O-CG 3.44Å; F82-L86 PolarHBondContact O-N 3.46Å; L86-T88 VanDerWaalsContact C-N 3.28Å; L86-T88 PolarHBondContact O-N 3.01Å; L86-V89 PolarHBondContact O-N 3.31Å; L86-F90 HydrophobicContact CD2-CE2 4.47Å; L86-F90 WeakPolarHBondContact O-CD2 3.37Å; L86-F90 PolarHBondContact O-N 3.5Å
87S82.8Confident81.2Confident79 Ų7994.7 Ų94.755%0.55248%0.483SS*.Hα-helixtrans-60.5-40177.5-62.20000111.7E83 E84 E85 F90 E91E83-S87 WeakPolarHBondContact O-CB 3.38Å; E83-S87 PolarHBondContact O-N 3.36Å; E83-S87 PolarHBondContact O-OG 3.28Å; E84-S87 PolarHBondContact O-N 3.25Å; E85-S87 VanDerWaalsContact C-N 3.32Å; E85-S87 PolarHBondContact O-N 2.93Å; S87-F90 PolarHBondContact O-N 3.31Å; S87-E91 PolarHBondContact O-N 3.39Å; S87-E91 VanDerWaalsContact O-N 3.11Å
88T82.3Confident81.4Confident80 Ų8093.2 Ų93.249%0.49148%0.478SS..Hα-helixtrans-65-43.5175.9-54.70000111.5E84 E85 L86 E91 Q92E84-T88 PolarHBondContact O-N 2.94Å; E84-T88 PolarHBondContact O-OG1 2.99Å; E85-T88 WeakPolarHBondContact O-CB 3.39Å; E85-T88 PolarHBondContact O-N 2.91Å; L86-T88 VanDerWaalsContact C-N 3.28Å; L86-T88 PolarHBondContact O-N 3.01Å; T88-E91 PolarHBondContact O-N 3.24Å; T88-Q92 WeakPolarHBondContact O-CG 3.47Å; T88-Q92 PolarHBondContact O-N 2.91Å
89V80.9Confident81.5Confident83 Ų8395.9 Ų95.950%0.50349%0.492SS..Hα-helixtrans-64.7-40.5177.3172.30000111.5E85 L86 E91 Q92 L93E85-V89 WeakPolarHBondContact O-CG2 3.44Å; E85-V89 PolarHBondContact O-N 3.41Å; L86-V89 PolarHBondContact O-N 3.31Å; V89-E91 PolarHBondContact O-N 3.02Å; V89-Q92 PolarHBondContact O-N 2.95Å; V89-L93 WeakPolarHBondContact O-CB 3.41Å; V89-L93 PolarHBondContact O-N 3.1Å
90F80Confident81.8Confident135 Ų13597.7 Ų97.759%0.59250%0.497SS*.Hα-helixtrans-63.3-39.9175.9-83.9-64.9000112.4L86 S87 L93 K94L86-F90 HydrophobicContact CD2-CE2 4.47Å; L86-F90 WeakPolarHBondContact O-CD2 3.37Å; L86-F90 PolarHBondContact O-N 3.5Å; S87-F90 PolarHBondContact O-N 3.31Å; F90-L93 PolarHBondContact O-N 2.89Å; F90-K94 WeakPolarHBondContact O-CB 3.45Å; F90-K94 PolarHBondContact O-N 3.28Å
91E84.3Confident82Confident96 Ų9697.2 Ų97.245%0.44950%0.495SS..Hα-helixtrans-67.5-39176.2-164.662.4-155.700111.5S87 T88 V89 K94 N95S87-E91 PolarHBondContact O-N 3.39Å; S87-E91 VanDerWaalsContact O-N 3.11Å; T88-E91 PolarHBondContact O-N 3.24Å; V89-E91 PolarHBondContact O-N 3.02Å; E91-K94 PolarHBondContact O-N 3.37Å; E91-N95 VanDerWaalsContact O-CG 3.29Å; E91-N95 PolarHBondContact O-N 3.05Å; E91-N95 PolarHBondContact O-ND2 2.96Å
92Q80.9Confident82.2Confident123 Ų12398.5 Ų98.558%0.57550%0.5SS*.Hα-helixtrans-61.6-43.5172.8-73.3175.7-8.600112.2T88 V89 K94 N95 A96T88-Q92 WeakPolarHBondContact O-CG 3.47Å; T88-Q92 PolarHBondContact O-N 2.91Å; V89-Q92 PolarHBondContact O-N 2.95Å; Q92-K94 VanDerWaalsContact C-N 3.35Å; Q92-K94 PolarHBondContact O-N 3.21Å; Q92-N95 PolarHBondContact O-N 3.2Å; Q92-A96 PolarHBondContact O-N 3.47Å
93L78.3Confident82.3Confident91 Ų9195.4 Ų95.448%0.47650%0.496SS..Hα-helixtrans-60.4-45.9176.8-17966.2000111.1V89 F90 N95 A96 E97V89-L93 WeakPolarHBondContact O-CB 3.41Å; V89-L93 PolarHBondContact O-N 3.1Å; F90-L93 PolarHBondContact O-N 2.89Å; L93-N95 VanDerWaalsContact C-N 3.33Å; L93-N95 PolarHBondContact O-N 3.27Å; L93-A96 WeakPolarHBondContact O-CB 3.48Å; L93-A96 PolarHBondContact O-N 3.22Å; L93-E97 WeakPolarHBondContact O-CG 3.34Å; L93-E97 PolarHBondContact O-N 3.39Å
94K85Confident82.7Confident109 Ų10994.1 Ų94.147%0.47449%0.488SS..Hα-helixtrans-61.2-41.4177.4-175.4-176.3172.8-163.30112.1F90 E91 Q92 E97 I98F90-K94 WeakPolarHBondContact O-CB 3.45Å; F90-K94 PolarHBondContact O-N 3.28Å; E91-K94 PolarHBondContact O-N 3.37Å; Q92-K94 VanDerWaalsContact C-N 3.35Å; Q92-K94 PolarHBondContact O-N 3.21Å; K94-E97 PolarHBondContact O-N 3.41Å; K94-I98 HydrophobicContact CG-CD1 4.48Å; K94-I98 WeakPolarHBondContact O-CG1 3.43Å; K94-I98 PolarHBondContact O-N 2.72Å
95N86Confident83.1Confident77 Ų7795.2 Ų95.241%0.41249%0.491SS..Hα-helixtrans-65-39.8175.3-70.5-30.1000112E91 Q92 L93 I98 L99E91-N95 VanDerWaalsContact O-CG 3.29Å; E91-N95 PolarHBondContact O-N 3.05Å; E91-N95 PolarHBondContact O-ND2 2.96Å; Q92-N95 PolarHBondContact O-N 3.2Å; L93-N95 VanDerWaalsContact C-N 3.33Å; L93-N95 PolarHBondContact O-N 3.27Å; N95-I98 PolarHBondContact O-N 3.26Å; N95-L99 WeakPolarHBondContact O-CG 3.24Å; N95-L99 PolarHBondContact O-N 3.13Å
96A81.5Confident83.5Confident53 Ų5396.8 Ų96.844%0.43850%0.499SS..Hα-helixtrans-65.1-38.1175.200000112.3Q92 L93 L99 N100Q92-A96 PolarHBondContact O-N 3.47Å; L93-A96 WeakPolarHBondContact O-CB 3.48Å; L93-A96 PolarHBondContact O-N 3.22Å; A96-L99 PolarHBondContact O-N 3.48Å; A96-N100 WeakPolarHBondContact O-CB 3.48Å; A96-N100 PolarHBondContact O-N 3.47Å
97E83.4Confident83.9Confident115 Ų11596.8 Ų96.854%0.53750%0.499SS..Hα-helixtrans-63.1-41.9173.9-74.3177.2171.200112L93 K94 N100 E101L93-E97 WeakPolarHBondContact O-CG 3.34Å; L93-E97 PolarHBondContact O-N 3.39Å; K94-E97 PolarHBondContact O-N 3.41Å; E97-N100 PolarHBondContact O-N 3.04Å; E97-E101 PolarHBondContact O-N 3.03Å
98I86.9Confident84.2Confident77 Ų7798.4 Ų98.440%0.39550%0.501SS..Hα-helixtrans-61-49.8175.3-67.9165.6000110.5K94 N95 N100 E101 E102K94-I98 HydrophobicContact CG-CD1 4.48Å; K94-I98 WeakPolarHBondContact O-CG1 3.43Å; K94-I98 PolarHBondContact O-N 2.72Å; N95-I98 PolarHBondContact O-N 3.26Å; I98-N100 VanDerWaalsContact C-N 3.29Å; I98-N100 PolarHBondContact O-N 3.41Å; I98-E101 PolarHBondContact O-N 2.99Å; I98-E102 WeakPolarHBondContact O-CG 3.46Å; I98-E102 PolarHBondContact O-N 3.38Å
99L83.1Confident84.5Confident115 Ų115100.5 Ų100.560%0.60251%0.506SS*.Hα-helixtrans-60.3-38.6178.4-74170.9000112.2N95 A96 E102 G103N95-L99 WeakPolarHBondContact O-CG 3.24Å; N95-L99 PolarHBondContact O-N 3.13Å; A96-L99 PolarHBondContact O-N 3.48Å; L99-E102 PolarHBondContact O-N 3.15Å; L99-G103 PolarHBondContact O-N 3.07Å
100N82Confident84.7Confident95 Ų95101.3 Ų101.351%0.50851%0.507SS..Hα-helixtrans-66.5-40177.1-170.425.6000112A96 E97 I98 G103 K104A96-N100 WeakPolarHBondContact O-CB 3.48Å; A96-N100 PolarHBondContact O-N 3.47Å; E97-N100 PolarHBondContact O-N 3.04Å; I98-N100 VanDerWaalsContact C-N 3.29Å; I98-N100 PolarHBondContact O-N 3.41Å; N100-G103 PolarHBondContact O-N 3.46Å; N100-K104 WeakPolarHBondContact O-CG 3.23Å; N100-K104 PolarHBondContact O-N 3.03Å
101E85.9Confident85Confident93 Ų9399 Ų9944%0.43550%0.498SS..Hα-helixtrans-69.2-34.9175.1-74.3-58.2135.100112.7E97 I98 K104 K105E97-E101 PolarHBondContact O-N 3.03Å; I98-E101 PolarHBondContact O-N 2.99Å; E101-K104 IonicContact OE1-NZ 2.75Å; E101-K104 PolarHBondContact OE1-NZ 3.45Å; E101-K105 WeakPolarHBondContact O-CG 3.49Å; E101-K105 PolarHBondContact O-N 3.36Å
102E87.2Confident85Confident101 Ų10197.1 Ų97.147%0.47250%0.499SS..Hα-helixtrans-63.6-48170.4-72.2175.9170.400111.1I98 L99 K104 K105 E106I98-E102 WeakPolarHBondContact O-CG 3.46Å; I98-E102 PolarHBondContact O-N 3.38Å; L99-E102 PolarHBondContact O-N 3.15Å; E102-K104 VanDerWaalsContact C-N 3.33Å; E102-K104 PolarHBondContact O-N 2.88Å; E102-K105 WeakPolarHBondContact O-CB 3.5Å; E102-K105 PolarHBondContact O-N 2.9Å; E102-K105 VanDerWaalsContact O-N 3.1Å; E102-E106 PolarHBondContact O-N 3.44Å
103G82.7Confident85Confident35 Ų3596.6 Ų96.636%0.36150%0.497SS..Hα-helixtrans-60.7-37.3177.100000113.6L99 N100 E106 L107L99-G103 PolarHBondContact O-N 3.07Å; N100-G103 PolarHBondContact O-N 3.46Å; G103-E106 PolarHBondContact O-N 2.9Å; G103-L107 WeakPolarHBondContact O-CB 3.49Å; G103-L107 PolarHBondContact O-N 3.22Å
104K86.8Confident84.9Confident93 Ų9395.4 Ų95.440%0.40449%0.494SS..Hα-helixtrans-63.2-42.4172.7-76.1177.1-167.8166.60112.4N100 E101 E102 L107 D108N100-K104 WeakPolarHBondContact O-CG 3.23Å; N100-K104 PolarHBondContact O-N 3.03Å; E101-K104 IonicContact OE1-NZ 2.75Å; E101-K104 PolarHBondContact OE1-NZ 3.45Å; E102-K104 VanDerWaalsContact C-N 3.33Å; E102-K104 PolarHBondContact O-N 2.88Å; K104-L107 PolarHBondContact O-N 2.99Å; K104-D108 WeakPolarHBondContact O-CB 3.3Å; K104-D108 PolarHBondContact O-N 3Å
105K89.2Confident84.6Confident142 Ų14297.6 Ų97.662%0.61750%0.499SS*.Hα-helixtrans-63.9-42177.3-72.2172.4-175.6171.10111.7E101 E102 D108 Q109E101-K105 WeakPolarHBondContact O-CG 3.49Å; E101-K105 PolarHBondContact O-N 3.36Å; E102-K105 WeakPolarHBondContact O-CB 3.5Å; E102-K105 PolarHBondContact O-N 2.9Å; E102-K105 VanDerWaalsContact O-N 3.1Å; K105-D108 PolarHBondContact O-N 3.26Å; K105-Q109 WeakPolarHBondContact O-CB 3.39Å; K105-Q109 PolarHBondContact O-N 3.43Å
106E87.7Confident84Confident141 Ų14196.6 Ų96.666%0.65950%0.501SS*.Hα-helixtrans-62.8-42.7175.2-70.9-176.3177.200111.5E102 G103 Q109 L110E102-E106 PolarHBondContact O-N 3.44Å; G103-E106 PolarHBondContact O-N 2.9Å; E106-Q109 PolarHBondContact O-N 3.11Å; E106-L110 WeakPolarHBondContact O-CB 3.5Å; E106-L110 PolarHBondContact O-N 3.17Å
107L85.3Confident83.4Confident100 Ų10098.9 Ų98.952%0.52451%0.509SS..Hα-helixtrans-63.2-45.4176.1-178.163.5000111.9G103 K104 Q109 L110 M111G103-L107 WeakPolarHBondContact O-CB 3.49Å; G103-L107 PolarHBondContact O-N 3.22Å; K104-L107 PolarHBondContact O-N 2.99Å; L107-Q109 VanDerWaalsContact C-N 3.28Å; L107-Q109 PolarHBondContact O-N 3.47Å; L107-L110 PolarHBondContact O-N 3.41Å; L107-M111 HydrophobicContact CD1-CG 4.39Å; L107-M111 HydrophobicContact CG-CG 4.47Å; L107-M111 WeakPolarHBondContact O-CB 3.02Å; L107-M111 VanDerWaalsContact O-CG 3.24Å; L107-M111 WeakPolarHBondContact O-CG 3.3Å; L107-M111 PolarHBondContact O-N 2.89Å
108D88.9Confident82.6Confident113 Ų11399.3 Ų99.360%0.60452%0.515SS*.Hα-helixtrans-61.1-39.5177-77.7-22.2000111.4K104 K105 M111 A112K104-D108 WeakPolarHBondContact O-CB 3.3Å; K104-D108 PolarHBondContact O-N 3Å; K105-D108 PolarHBondContact O-N 3.26Å; D108-M111 PolarHBondContact O-N 3.03Å; D108-A112 PolarHBondContact O-N 2.89Å
109Q88.6Confident81.5Confident124 Ų124103 Ų10358%0.57953%0.531SS*.Hα-helixtrans-65.2-45.9175.2-177165.8-4.500111.7K105 E106 L107 M111 A112 E113K105-Q109 WeakPolarHBondContact O-CB 3.39Å; K105-Q109 PolarHBondContact O-N 3.43Å; E106-Q109 PolarHBondContact O-N 3.11Å; L107-Q109 VanDerWaalsContact C-N 3.28Å; L107-Q109 PolarHBondContact O-N 3.47Å; Q109-M111 VanDerWaalsContact C-N 3.31Å; Q109-M111 PolarHBondContact O-N 3.28Å; Q109-A112 WeakPolarHBondContact O-CB 3.31Å; Q109-A112 PolarHBondContact O-N 3.24Å; Q109-A112 VanDerWaalsContact O-N 3.15Å; Q109-E113 PolarHBondContact O-N 3.06Å
110L85.7Confident80.5Confident100 Ų10099.9 Ų99.952%0.52452%0.522SS..Hα-helixtrans-60.8-42.1176.3-161.793.2000111.3E106 L107 A112 E113 V114E106-L110 WeakPolarHBondContact O-CB 3.5Å; E106-L110 PolarHBondContact O-N 3.17Å; L107-L110 PolarHBondContact O-N 3.41Å; L110-A112 VanDerWaalsContact C-N 3.3Å; L110-A112 PolarHBondContact O-N 2.6Å; L110-E113 PolarHBondContact O-N 3.04Å; L110-V114 WeakPolarHBondContact O-CG2 3.38Å; L110-V114 PolarHBondContact O-N 3.39Å
111M85.4Confident79.1Confident85 Ų85102.4 Ų102.442%0.41954%0.536SS..Hα-helixtrans-64.3-34.7176.6-72.7-61.9-61.600112.2L107 D108 Q109 R115L107-M111 HydrophobicContact CD1-CG 4.39Å; L107-M111 HydrophobicContact CG-CG 4.47Å; L107-M111 WeakPolarHBondContact O-CB 3.02Å; L107-M111 VanDerWaalsContact O-CG 3.24Å; L107-M111 WeakPolarHBondContact O-CG 3.3Å; L107-M111 PolarHBondContact O-N 2.89Å; D108-M111 PolarHBondContact O-N 3.03Å; Q109-M111 VanDerWaalsContact C-N 3.31Å; Q109-M111 PolarHBondContact O-N 3.28Å; M111-R115 WeakPolarHBondContact O-CG 3.37Å; M111-R115 PolarHBondContact O-N 3.44Å
112A84.6Confident77.8Confident57 Ų57102 Ų10247%0.47154%0.536SS..Hα-helixtrans-67.7-40.6173.400000111.9D108 Q109 L110 R115 A116D108-A112 PolarHBondContact O-N 2.89Å; Q109-A112 WeakPolarHBondContact O-CB 3.31Å; Q109-A112 PolarHBondContact O-N 3.24Å; Q109-A112 VanDerWaalsContact O-N 3.15Å; L110-A112 VanDerWaalsContact C-N 3.3Å; L110-A112 PolarHBondContact O-N 2.6Å; A112-R115 PolarHBondContact O-N 3.38Å; A112-A116 PolarHBondContact O-N 3.02Å
113E81Confident76.7Confident112 Ų112100.9 Ų100.952%0.52353%0.533SS..Hα-helixtrans-64.2-43.1174.7-70.6176.9-166.900111.9Q109 L110 A116 V117Q109-E113 PolarHBondContact O-N 3.06Å; L110-E113 PolarHBondContact O-N 3.04Å; E113-A116 PolarHBondContact O-N 3.44Å; E113-V117 WeakPolarHBondContact O-CG2 3.47Å; E113-V117 PolarHBondContact O-N 3.35Å; E113-V117 VanDerWaalsContact O-N 3.08Å
114V76.4Confident75.9Confident67 Ų67106.3 Ų106.341%0.40655%0.547SS..Hα-helixtrans-61.7-45.1175.5171.60000110.9L110 A116 V117 D118L110-V114 WeakPolarHBondContact O-CG2 3.38Å; L110-V114 PolarHBondContact O-N 3.39Å; V114-A116 VanDerWaalsContact C-N 3.3Å; V114-A116 PolarHBondContact O-N 2.94Å; V114-V117 WeakPolarHBondContact O-CB 3.49Å; V114-V117 PolarHBondContact O-N 2.96Å; V114-D118 PolarHBondContact O-N 2.9Å
115R77.8Confident75.2Confident154 Ų154109.8 Ų109.858%0.58156%0.564SS**Hα-helixtrans-60.8-39.5174.8-75.6-175.8-149.5171.68.4112.4M111 A112 V117 D118 E119M111-R115 WeakPolarHBondContact O-CG 3.37Å; M111-R115 PolarHBondContact O-N 3.44Å; A112-R115 PolarHBondContact O-N 3.38Å; R115-V117 PolarHBondContact O-N 3.46Å; R115-D118 PolarHBondContact O-N 2.89Å; R115-E119 VanDerWaalsContact O-CB 3.27Å; R115-E119 WeakPolarHBondContact O-CB 3.4Å; R115-E119 WeakPolarHBondContact O-CG 3.37Å; R115-E119 PolarHBondContact O-N 2.7Å
116A74.5Confident74.5Confident57 Ų57107.6 Ų107.647%0.47156%0.557SS.*Hα-helixtrans-64.2-28.8176.400000112.4A112 E113 V114 A120A112-A116 PolarHBondContact O-N 3.02Å; E113-A116 PolarHBondContact O-N 3.44Å; V114-A116 VanDerWaalsContact C-N 3.3Å; V114-A116 PolarHBondContact O-N 2.94Å; A116-A120 VanDerWaalsContact O-CB 3.25Å; A116-A120 WeakPolarHBondContact O-CB 3.39Å; A116-A120 PolarHBondContact O-N 2.8Å
117V68.8Low73.9Confident100 Ų100105.4 Ų105.461%0.60655%0.547SS*.Hα-helixtrans-76.6-38.2172.5174.70000111.7E113 V114 R115 A120E113-V117 WeakPolarHBondContact O-CG2 3.47Å; E113-V117 PolarHBondContact O-N 3.35Å; E113-V117 VanDerWaalsContact O-N 3.08Å; V114-V117 WeakPolarHBondContact O-CB 3.49Å; V114-V117 PolarHBondContact O-N 2.96Å; R115-V117 PolarHBondContact O-N 3.46Å; V117-A120 WeakPolarHBondContact O-CB 3.44Å; V117-A120 PolarHBondContact O-N 3.48Å
118D65.5Low73.6Confident124 Ų124105.1 Ų105.166%0.66354%0.543SS*.Hα-helixtrans-69.8-35.2175.1-73.2-20.2000112V114 R115V114-D118 PolarHBondContact O-N 2.9Å; R115-D118 PolarHBondContact O-N 2.89Å
119E64.2Low73.1Confident154 Ų154102 Ų10272%0.7253%0.533SS*.Hα-helixtrans-80.5-21174.8-73.6177.3-172.100112.8R115 D121R115-E119 VanDerWaalsContact O-CB 3.27Å; R115-E119 WeakPolarHBondContact O-CB 3.4Å; R115-E119 WeakPolarHBondContact O-CG 3.37Å; R115-E119 PolarHBondContact O-N 2.7Å; E119-D121 PolarHBondContact O-N 3.35Å
120A62Low72.8Confident51 Ų51100.1 Ų100.142%0.42153%0.527SS..SBendtrans-66.388161.700000106A116 V117 I122A116-A120 VanDerWaalsContact O-CB 3.25Å; A116-A120 WeakPolarHBondContact O-CB 3.39Å; A116-A120 PolarHBondContact O-N 2.8Å; V117-A120 WeakPolarHBondContact O-CB 3.44Å; V117-A120 PolarHBondContact O-N 3.48Å; A120-I122 PolarHBondContact O-N 3.31Å
121D52.2Low72.6Confident148 Ų14898 Ų9879%0.79152%0.516SS*.  trans-60.767172.7-133-0000107.6E119 D123E119-D121 PolarHBondContact O-N 3.35Å; D121-D123 PolarHBondContact O-N 3.45Å
122I58.7Low72.6Confident85 Ų8597.6 Ų97.644%0.43652%0.515SS..  trans-66.390.3157.3-59.5176.8000101.4A120 F124 M127A120-I122 PolarHBondContact O-N 3.31Å; I122-F124 HydrophobicContact CB-CD2 4.4Å; I122-F124 HydrophobicContact CB-CE2 4.08Å; I122-F124 HydrophobicContact CB-CZ 4.36Å; I122-F124 HydrophobicContact CG2-CD1 4.31Å; I122-F124 HydrophobicContact CG2-CD2 4.29Å; I122-F124 HydrophobicContact CG2-CE1 4.11Å; I122-F124 HydrophobicContact CG2-CE2 4.09Å; I122-F124 HydrophobicContact CG2-CG 4.4Å; I122-F124 HydrophobicContact CG2-CZ 4Å; I122-F124 WeakPolarHBondContact O-CD2 3.42Å; I122-F124 PolarHBondContact O-N 3.03Å; I122-M127 HydrophobicContact CG2-CE 3.69Å
123D64.9Low72.7Confident77 Ų7797.6 Ų97.641%0.41252%0.515SS..  trans-63.486.3177.1-173.4-13.6000106.3D121 E125 Q126 M127D121-D123 PolarHBondContact O-N 3.45Å; D123-E125 PolarHBondContact O-N 3.29Å; D123-E125 WeakPolarHBondContact OD1-CA 3.42Å; D123-E125 WeakPolarHBondContact OD1-CB 3.38Å; D123-E125 PolarHBondContact OD1-N 2.89Å; D123-E125 VanDerWaalsContact OD1-N 3.17Å; D123-Q126 HydrophobicContact CB-CB 3.72Å; D123-Q126 PolarHBondContact O-N 3.14Å; D123-Q126 PolarHBondContact OD1-N 3.24Å; D123-Q126 WeakPolarHBondContact OD2-CB 3.4Å; D123-M127 PolarHBondContact O-N 2.88Å
124F66.8Low72.8Confident149 Ų14998.2 Ų98.265%0.65452%0.522SS*.Hα-helixtrans-62.2-26.2-179.6-79-77.1000109.2I122 Q128I122-F124 HydrophobicContact CB-CD2 4.4Å; I122-F124 HydrophobicContact CB-CE2 4.08Å; I122-F124 HydrophobicContact CB-CZ 4.36Å; I122-F124 HydrophobicContact CG2-CD1 4.31Å; I122-F124 HydrophobicContact CG2-CD2 4.29Å; I122-F124 HydrophobicContact CG2-CE1 4.11Å; I122-F124 HydrophobicContact CG2-CE2 4.09Å; I122-F124 HydrophobicContact CG2-CG 4.4Å; I122-F124 HydrophobicContact CG2-CZ 4Å; I122-F124 WeakPolarHBondContact O-CD2 3.42Å; I122-F124 PolarHBondContact O-N 3.03Å; F124-Q128 WeakPolarHBondContact O-CB 3.38Å; F124-Q128 PolarHBondContact O-N 3.02Å
125E70.8Confident73.2Confident165 Ų16598.7 Ų98.777%0.77152%0.521SS*.Hα-helixtrans-69.8-45.3171.7-63-165.6162.900111.1D123 Q128 A129D123-E125 PolarHBondContact O-N 3.29Å; D123-E125 WeakPolarHBondContact OD1-CA 3.42Å; D123-E125 WeakPolarHBondContact OD1-CB 3.38Å; D123-E125 PolarHBondContact OD1-N 2.89Å; D123-E125 VanDerWaalsContact OD1-N 3.17Å; E125-Q128 CarbonylContact O-C 3.6Å; E125-Q128 PolarHBondContact O-N 2.95Å; E125-A129 VanDerWaalsContact O-CB 3.29Å; E125-A129 WeakPolarHBondContact O-CB 3.38Å; E125-A129 PolarHBondContact O-N 3.02Å
126Q74.9Confident73.6Confident97 Ų9794.9 Ų94.945%0.45352%0.518SS..Hα-helixtrans-64.2-42.7174.2-174.561.349.400111.8D123 Q128 A129 D130D123-Q126 HydrophobicContact CB-CB 3.72Å; D123-Q126 PolarHBondContact O-N 3.14Å; D123-Q126 PolarHBondContact OD1-N 3.24Å; D123-Q126 WeakPolarHBondContact OD2-CB 3.4Å; Q126-Q128 VanDerWaalsContact C-N 3.3Å; Q126-Q128 PolarHBondContact O-N 3.48Å; Q126-A129 PolarHBondContact O-N 3.38Å; Q126-D130 PolarHBondContact NE2-OD1 2.88Å; Q126-D130 WeakPolarHBondContact O-CB 3.46Å; Q126-D130 PolarHBondContact O-N 3.09Å
127M74.4Confident74Confident95 Ų9596 Ų9647%0.46851%0.514SS..Hα-helixtrans-63.3-39.4176.2-170.3179.6-64.900111I122 D123 I131I122-M127 HydrophobicContact CG2-CE 3.69Å; D123-M127 PolarHBondContact O-N 2.88Å; M127-I131 HydrophobicContact CG-CD1 4.33Å; M127-I131 WeakPolarHBondContact O-CB 3.38Å; M127-I131 WeakPolarHBondContact O-CD1 3.41Å; M127-I131 WeakPolarHBondContact O-CG1 3.5Å; M127-I131 PolarHBondContact O-N 3.07Å
128Q79.2Confident74.7Confident94 Ų9494.6 Ų94.644%0.43950%0.5SS..Hα-helixtrans-67.9-39.6174.5-174.36142.700111.4F124 E125 Q126 I131 D132F124-Q128 WeakPolarHBondContact O-CB 3.38Å; F124-Q128 PolarHBondContact O-N 3.02Å; E125-Q128 CarbonylContact O-C 3.6Å; E125-Q128 PolarHBondContact O-N 2.95Å; Q126-Q128 VanDerWaalsContact C-N 3.3Å; Q126-Q128 PolarHBondContact O-N 3.48Å; Q128-I131 WeakPolarHBondContact O-CB 3.37Å; Q128-I131 PolarHBondContact O-N 2.87Å; Q128-D132 PolarHBondContact NE2-OD1 3.18Å; Q128-D132 VanDerWaalsContact NE2-OD1 3.11Å; Q128-D132 PolarHBondContact NE2-OD2 3.3Å; Q128-D132 WeakPolarHBondContact O-CB 3.44Å; Q128-D132 VanDerWaalsContact O-CG 3.27Å; Q128-D132 PolarHBondContact O-N 2.84Å
129A79.8Confident75.5Confident46 Ų4693.2 Ų93.238%0.3849%0.493SS..Hα-helixtrans-63.8-41.2175.300000111.9E125 Q126 I131 D132 A133E125-A129 VanDerWaalsContact O-CB 3.29Å; E125-A129 WeakPolarHBondContact O-CB 3.38Å; E125-A129 PolarHBondContact O-N 3.02Å; Q126-A129 PolarHBondContact O-N 3.38Å; A129-I131 VanDerWaalsContact C-N 3.35Å; A129-D132 PolarHBondContact O-N 2.94Å; A129-A133 WeakPolarHBondContact O-CB 3.3Å; A129-A133 PolarHBondContact O-N 3.47Å
130D81.5Confident76.5Confident85 Ų8592.4 Ų92.446%0.45548%0.483SS..Hα-helixtrans-64-40.8174.5-70.2-12.9000110.9Q126 A133 L134Q126-D130 PolarHBondContact NE2-OD1 2.88Å; Q126-D130 WeakPolarHBondContact O-CB 3.46Å; Q126-D130 PolarHBondContact O-N 3.09Å; D130-A133 PolarHBondContact O-N 3.29Å; D130-L134 WeakPolarHBondContact O-CG 3.43Å; D130-L134 PolarHBondContact O-N 3.06Å
131I80.8Confident77.4Confident56 Ų5692.3 Ų92.329%0.28748%0.475SS..Hα-helixtrans-62.7-46174-72.6165.7000111M127 Q128 A129 A133 L134 I135M127-I131 HydrophobicContact CG-CD1 4.33Å; M127-I131 WeakPolarHBondContact O-CB 3.38Å; M127-I131 WeakPolarHBondContact O-CD1 3.41Å; M127-I131 WeakPolarHBondContact O-CG1 3.5Å; M127-I131 PolarHBondContact O-N 3.07Å; Q128-I131 WeakPolarHBondContact O-CB 3.37Å; Q128-I131 PolarHBondContact O-N 2.87Å; A129-I131 VanDerWaalsContact C-N 3.35Å; I131-A133 VanDerWaalsContact C-N 3.33Å; I131-A133 PolarHBondContact O-N 2.93Å; I131-L134 PolarHBondContact O-N 2.98Å; I131-I135 HydrophobicContact CG2-CD1 3.89Å; I131-I135 WeakPolarHBondContact O-CG1 3.48Å; I131-I135 PolarHBondContact O-N 3.28Å
132D86.7Confident78.6Confident76 Ų7688 Ų8841%0.40646%0.457SS..Hα-helixtrans-68.4-33.5-178.8-70.2-21.8000111.8Q128 A129 I135 S136Q128-D132 PolarHBondContact NE2-OD1 3.18Å; Q128-D132 VanDerWaalsContact NE2-OD1 3.11Å; Q128-D132 PolarHBondContact NE2-OD2 3.3Å; Q128-D132 WeakPolarHBondContact O-CB 3.44Å; Q128-D132 VanDerWaalsContact O-CG 3.27Å; Q128-D132 PolarHBondContact O-N 2.84Å; A129-D132 PolarHBondContact O-N 2.94Å; D132-I135 PolarHBondContact O-N 3.08Å; D132-S136 WeakPolarHBondContact O-CB 3.47Å; D132-S136 PolarHBondContact O-N 2.78Å; D132-S136 PolarHBondContact O-OG 3.22Å
133A85.4Confident79.7Confident58 Ų5887.3 Ų87.348%0.47946%0.459SS..Hα-helixtrans-63.8-44.2170.900000111.6A129 D130 I131 S136 E137A129-A133 WeakPolarHBondContact O-CB 3.3Å; A129-A133 PolarHBondContact O-N 3.47Å; D130-A133 PolarHBondContact O-N 3.29Å; I131-A133 VanDerWaalsContact C-N 3.33Å; I131-A133 PolarHBondContact O-N 2.93Å; A133-S136 PolarHBondContact O-N 3.46Å; A133-E137 PolarHBondContact O-N 2.94Å
134L83.7Confident80.4Confident125 Ų12585 Ų8565%0.65445%0.451SS*.Hα-helixtrans-63.7-40.8175.8-74.1170.6000112.3D130 I131 E137 Q138D130-L134 WeakPolarHBondContact O-CG 3.43Å; D130-L134 PolarHBondContact O-N 3.06Å; I131-L134 PolarHBondContact O-N 2.98Å; L134-E137 PolarHBondContact O-N 3.31Å; L134-Q138 WeakPolarHBondContact O-CB 3.34Å; L134-Q138 PolarHBondContact O-N 3.4Å
135I85.1Confident80.9Confident77 Ų7780 Ų8040%0.39543%0.43SS..Hα-helixtrans-64-42.9175.5-69.3168.5000110.7I131 D132 E137 Q138 N139I131-I135 HydrophobicContact CG2-CD1 3.89Å; I131-I135 WeakPolarHBondContact O-CG1 3.48Å; I131-I135 PolarHBondContact O-N 3.28Å; D132-I135 PolarHBondContact O-N 3.08Å; I135-E137 VanDerWaalsContact C-N 3.33Å; I135-E137 PolarHBondContact O-N 3.37Å; I135-Q138 PolarHBondContact O-N 2.66Å; I135-N139 PolarHBondContact O-N 2.98Å; I135-N139 PolarHBondContact O-ND2 3.49Å
136S84.9Confident81.4Confident74 Ų7477.1 Ų77.152%0.51742%0.419SS..Hα-helixtrans-61.9-42.1177.4-62.50000111.5D132 A133 N139 R140D132-S136 WeakPolarHBondContact O-CB 3.47Å; D132-S136 PolarHBondContact O-N 2.78Å; D132-S136 PolarHBondContact O-OG 3.22Å; A133-S136 PolarHBondContact O-N 3.46Å; S136-N139 PolarHBondContact O-N 3.4Å; S136-R140 PolarHBondContact O-N 2.84Å
137E84.8Confident81.6Confident81 Ų8177.1 Ų77.138%0.37942%0.421SS..Hα-helixtrans-68.7-38.4177.3-167.562.1-176.700112A133 L134 I135 N139 R140 L141A133-E137 PolarHBondContact O-N 2.94Å; L134-E137 PolarHBondContact O-N 3.31Å; I135-E137 VanDerWaalsContact C-N 3.33Å; I135-E137 PolarHBondContact O-N 3.37Å; E137-N139 VanDerWaalsContact C-N 3.33Å; E137-N139 PolarHBondContact O-N 3.33Å; E137-R140 VanDerWaalsContact CD-NE 3.33Å; E137-R140 WeakPolarHBondContact O-CB 3.34Å; E137-R140 PolarHBondContact O-N 2.72Å; E137-R140 IonicContact OE1-CZ 3.32Å; E137-R140 VanDerWaalsContact OE1-CZ 3.32Å; E137-R140 IonicContact OE1-NE 3.13Å; E137-R140 PolarHBondContact OE1-NE 3.38Å; E137-R140 VanDerWaalsContact OE1-NE 3.13Å; E137-R140 IonicContact OE1-NH2 2.68Å; E137-R140 PolarHBondContact OE1-NH2 2.99Å; E137-R140 IonicContact OE2-CZ 3.82Å; E137-R140 IonicContact OE2-NE 2.86Å; E137-R140 PolarHBondContact OE2-NE 2.95Å; E137-R140 IonicContact OE2-NH2 3.92Å; E137-L141 HydrophobicContact CG-CD1 4.45Å; E137-L141 WeakPolarHBondContact O-CB 3.45Å; E137-L141 WeakPolarHBondContact O-CG 3.48Å; E137-L141 PolarHBondContact O-N 3.23Å
138Q81.5Confident81.6Confident70 Ų7073.2 Ų73.233%0.32740%0.403SS..Hα-helixtrans-59.9-42172.1-176.2-178.81.300112L134 I135 R140 L141 S142 L203L134-Q138 WeakPolarHBondContact O-CB 3.34Å; L134-Q138 PolarHBondContact O-N 3.4Å; I135-Q138 PolarHBondContact O-N 2.66Å; Q138-R140 VanDerWaalsContact C-N 3.34Å; Q138-L141 PolarHBondContact O-N 2.94Å; Q138-S142 WeakPolarHBondContact O-CB 3.44Å; Q138-S142 PolarHBondContact O-N 3.3Å; Q138-S142 PolarHBondContact O-OG 3.18Å; Q138-L203 HydrophobicContact CG-CD1 3.97Å
139N83.4Confident81.4Confident94 Ų9471 Ų7150%0.50340%0.398SS..Hα-helixtrans-66.6-37.2176.7-72.8-29.5000111.8I135 S136 E137 S143I135-N139 PolarHBondContact O-N 2.98Å; I135-N139 PolarHBondContact O-ND2 3.49Å; S136-N139 PolarHBondContact O-N 3.4Å; E137-N139 VanDerWaalsContact C-N 3.33Å; E137-N139 PolarHBondContact O-N 3.33Å; N139-S143 WeakPolarHBondContact O-CB 3.5Å; N139-S143 PolarHBondContact O-N 2.94Å; N139-S143 PolarHBondContact O-OG 3.42Å
140R84.9Confident81.4Confident138 Ų13875.3 Ų75.352%0.52141%0.408SS..Hα-helixtrans-64.1-46.6174.6-164.5-173.37376.91.2111.3S136 E137 Q138 S143 A144S136-R140 PolarHBondContact O-N 2.84Å; E137-R140 VanDerWaalsContact CD-NE 3.33Å; E137-R140 WeakPolarHBondContact O-CB 3.34Å; E137-R140 PolarHBondContact O-N 2.72Å; E137-R140 IonicContact OE1-CZ 3.32Å; E137-R140 VanDerWaalsContact OE1-CZ 3.32Å; E137-R140 IonicContact OE1-NE 3.13Å; E137-R140 PolarHBondContact OE1-NE 3.38Å; E137-R140 VanDerWaalsContact OE1-NE 3.13Å; E137-R140 IonicContact OE1-NH2 2.68Å; E137-R140 PolarHBondContact OE1-NH2 2.99Å; E137-R140 IonicContact OE2-CZ 3.82Å; E137-R140 IonicContact OE2-NE 2.86Å; E137-R140 PolarHBondContact OE2-NE 2.95Å; E137-R140 IonicContact OE2-NH2 3.92Å; Q138-R140 VanDerWaalsContact C-N 3.34Å; R140-S143 PolarHBondContact O-N 3.47Å; R140-A144 WeakPolarHBondContact O-CB 3.44Å; R140-A144 PolarHBondContact O-N 2.98Å
141L80.8Confident81.2Confident48 Ų4879.3 Ų79.325%0.25142%0.417SS..Hα-helixtrans-63.5-42.4176.8-70171.5000111.7E137 Q138 S143 A144 Q145 L196E137-L141 HydrophobicContact CG-CD1 4.45Å; E137-L141 WeakPolarHBondContact O-CB 3.45Å; E137-L141 WeakPolarHBondContact O-CG 3.48Å; E137-L141 PolarHBondContact O-N 3.23Å; Q138-L141 PolarHBondContact O-N 2.94Å; L141-S143 VanDerWaalsContact C-N 3.3Å; L141-S143 PolarHBondContact O-N 2.9Å; L141-A144 PolarHBondContact O-N 3.34Å; L141-Q145 WeakPolarHBondContact O-CB 3.44Å; L141-Q145 PolarHBondContact O-N 3.31Å; L141-L196 HydrophobicContact CB-CD2 4.09Å; L141-L196 HydrophobicContact CD2-CD2 3.91Å; L141-L196 HydrophobicContact CG-CD2 4.44Å
142S78.5Confident81Confident59 Ų5978 Ų7841%0.41341%0.41SS..Hα-helixtrans-62-39175.9-59.30000112Q138 Q145 L146Q138-S142 WeakPolarHBondContact O-CB 3.44Å; Q138-S142 PolarHBondContact O-N 3.3Å; Q138-S142 PolarHBondContact O-OG 3.18Å; S142-Q145 PolarHBondContact O-N 3.01Å; S142-L146 PolarHBondContact O-N 3.23Å; S142-L146 VanDerWaalsContact O-N 3.11Å
143S81Confident80.6Confident69 Ų6979 Ų7948%0.48342%0.416SS..Hα-helixtrans-68.8-41.6176-59.30000112N139 R140 L141 L146 I147N139-S143 WeakPolarHBondContact O-CB 3.5Å; N139-S143 PolarHBondContact O-N 2.94Å; N139-S143 PolarHBondContact O-OG 3.42Å; R140-S143 PolarHBondContact O-N 3.47Å; L141-S143 VanDerWaalsContact C-N 3.3Å; L141-S143 PolarHBondContact O-N 2.9Å; S143-L146 PolarHBondContact O-N 3.46Å; S143-I147 WeakPolarHBondContact O-CG1 3.39Å; S143-I147 PolarHBondContact O-N 2.88Å; S143-I147 VanDerWaalsContact O-N 3.08Å
144A79.8Confident80.3Confident29 Ų2979.2 Ų79.224%0.2442%0.418CS..Hα-helixtrans-61.3-43.9173.900000111.3R140 L141 L146 I147 S148R140-A144 WeakPolarHBondContact O-CB 3.44Å; R140-A144 PolarHBondContact O-N 2.98Å; L141-A144 PolarHBondContact O-N 3.34Å; A144-L146 VanDerWaalsContact C-N 3.31Å; A144-L146 PolarHBondContact O-N 3.21Å; A144-I147 PolarHBondContact O-N 3.45Å; A144-I147 VanDerWaalsContact O-N 3.12Å; A144-S148 PolarHBondContact O-N 3.46Å; A144-S148 PolarHBondContact O-OG 2.99Å
145Q76.2Confident79.8Confident45 Ų4575 Ų7521%0.2140%0.395CS..Hα-helixtrans-58.1-42.9176.2-161.6173-3.300111.9L141 S142 I147 S148 S149 L196 N197L141-Q145 WeakPolarHBondContact O-CB 3.44Å; L141-Q145 PolarHBondContact O-N 3.31Å; S142-Q145 PolarHBondContact O-N 3.01Å; Q145-I147 PolarHBondContact O-N 3.35Å; Q145-S148 PolarHBondContact O-N 3.09Å; Q145-S149 WeakPolarHBondContact O-CB 3.47Å; Q145-S149 PolarHBondContact O-N 3.39Å; Q145-L196 HydrophobicContact CB-CD1 3.84Å; Q145-L196 HydrophobicContact CG-CB 4.44Å; Q145-L196 HydrophobicContact CG-CD1 3.84Å; Q145-N197 PolarHBondContact NE2-OD1 3.32Å; Q145-N197 VanDerWaalsContact NE2-OD1 3.12Å
146L81.7Confident79.3Confident103 Ų10374.8 Ų74.854%0.53940%0.395SS..Hα-helixtrans-64.7-39177-173.268.1000112.2S142 S143 A144 K150S142-L146 PolarHBondContact O-N 3.23Å; S142-L146 VanDerWaalsContact O-N 3.11Å; S143-L146 PolarHBondContact O-N 3.46Å; A144-L146 VanDerWaalsContact C-N 3.31Å; A144-L146 PolarHBondContact O-N 3.21Å; L146-K150 WeakPolarHBondContact O-CG 3.38Å; L146-K150 PolarHBondContact O-N 3.17Å
147I80.5Confident78.9Confident98 Ų9874 Ų7450%0.50339%0.393SS..Hα-helixtrans-67.5-45.8176.4-67165.9000110.5S143 A144 Q145 K150 R151S143-I147 WeakPolarHBondContact O-CG1 3.39Å; S143-I147 PolarHBondContact O-N 2.88Å; S143-I147 VanDerWaalsContact O-N 3.08Å; A144-I147 PolarHBondContact O-N 3.45Å; A144-I147 VanDerWaalsContact O-N 3.12Å; Q145-I147 PolarHBondContact O-N 3.35Å; I147-K150 PolarHBondContact O-N 3.39Å; I147-R151 PolarHBondContact O-N 3.42Å
148S74.1Confident78.3Confident12 Ų1272 Ų728%0.08439%0.391CS..Hα-helixtrans-62-41.7177.2-70.80000111.4A144 Q145 R151 L152 E192A144-S148 PolarHBondContact O-N 3.46Å; A144-S148 PolarHBondContact O-OG 2.99Å; Q145-S148 PolarHBondContact O-N 3.09Å; S148-R151 WeakPolarHBondContact O-CB 3.04Å; S148-R151 PolarHBondContact O-N 3.23Å; S148-L152 WeakPolarHBondContact O-CB 3.33Å; S148-L152 PolarHBondContact O-N 3.43Å; S148-E192 PolarHBondContact OG-OE2 2.76Å
149S74.5Confident77.6Confident48 Ų4872.2 Ų72.234%0.33639%0.393SS..Hα-helixtrans-60.3-46.3173.4-172.20000112.2Q145 R151 L152 D153Q145-S149 WeakPolarHBondContact O-CB 3.47Å; Q145-S149 PolarHBondContact O-N 3.39Å; S149-R151 VanDerWaalsContact C-N 3.32Å; S149-R151 PolarHBondContact O-N 2.91Å; S149-L152 WeakPolarHBondContact O-CB 3.47Å; S149-L152 PolarHBondContact O-N 3.22Å; S149-D153 PolarHBondContact O-N 2.84Å
150K80.3Confident77Confident137 Ų13775.1 Ų75.160%0.59640%0.404SS*.Hα-helixtrans-64.3-36.2177-75.3179.5179.1-178.80112.7L146 I147 A154L146-K150 WeakPolarHBondContact O-CG 3.38Å; L146-K150 PolarHBondContact O-N 3.17Å; I147-K150 PolarHBondContact O-N 3.39Å; K150-A154 WeakPolarHBondContact O-CB 3.47Å; K150-A154 PolarHBondContact O-N 2.96Å
151R77.3Confident76.3Confident169 Ų16972.5 Ų72.564%0.63841%0.407SS*.Hα-helixtrans-64.9-44.2173.7-81.5-179.8162.5-178.9-4.5111.1I147 S148 S149 D153 A154 L155I147-R151 PolarHBondContact O-N 3.42Å; S148-R151 WeakPolarHBondContact O-CB 3.04Å; S148-R151 PolarHBondContact O-N 3.23Å; S149-R151 VanDerWaalsContact C-N 3.32Å; S149-R151 PolarHBondContact O-N 2.91Å; R151-D153 VanDerWaalsContact C-N 3.33Å; R151-D153 PolarHBondContact O-N 3.26Å; R151-A154 PolarHBondContact O-N 3.23Å; R151-L155 HydrophobicContact CB-CD1 4.47Å; R151-L155 WeakPolarHBondContact O-CD1 3.48Å; R151-L155 PolarHBondContact O-N 2.98Å
152L75.5Confident75.3Confident27 Ų2773.4 Ų73.414%0.14141%0.411CS..Hα-helixtrans-58.8-45.2176.8-172.467.9000111.4S148 S149 A154 L155 N156 V186 V189 I193S148-L152 WeakPolarHBondContact O-CB 3.33Å; S148-L152 PolarHBondContact O-N 3.43Å; S149-L152 WeakPolarHBondContact O-CB 3.47Å; S149-L152 PolarHBondContact O-N 3.22Å; L152-A154 VanDerWaalsContact C-N 3.34Å; L152-A154 PolarHBondContact O-N 3.02Å; L152-L155 PolarHBondContact O-N 2.98Å; L152-N156 WeakPolarHBondContact O-CB 3.4Å; L152-N156 PolarHBondContact O-N 2.98Å; L152-V186 HydrophobicContact CD1-CB 4.3Å; L152-V186 HydrophobicContact CD1-CG1 3.82Å; L152-V186 HydrophobicContact CD1-CG2 4.15Å; L152-V189 HydrophobicContact CB-CG1 4.22Å; L152-V189 HydrophobicContact CD1-CG1 4.32Å; L152-I193 HydrophobicContact CD2-CD1 4.03Å
153D79.5Confident74.3Confident99 Ų9976.6 Ų76.653%0.52943%0.427SS..Hα-helixtrans-61.3-41.8175.8-68.4-27.2000111.9S149 R151 N156 A157S149-D153 PolarHBondContact O-N 2.84Å; R151-D153 VanDerWaalsContact C-N 3.33Å; R151-D153 PolarHBondContact O-N 3.26Å; D153-N156 PolarHBondContact O-N 3.48Å; D153-A157 WeakPolarHBondContact O-CB 3.43Å; D153-A157 PolarHBondContact O-N 2.92Å
154A78.7Confident73.2Confident62 Ų6281.7 Ų81.751%0.51244%0.441SS..Hα-helixtrans-67.5-40.617700000112.7K150 R151 L152 A157 A158K150-A154 WeakPolarHBondContact O-CB 3.47Å; K150-A154 PolarHBondContact O-N 2.96Å; R151-A154 PolarHBondContact O-N 3.23Å; L152-A154 VanDerWaalsContact C-N 3.34Å; L152-A154 PolarHBondContact O-N 3.02Å; A154-A157 PolarHBondContact O-N 3.36Å; A154-A158 WeakPolarHBondContact O-CB 3.44Å; A154-A158 PolarHBondContact O-N 2.96Å
155L73.7Confident71.7Confident36 Ų3688.3 Ų88.319%0.18847%0.47CS..Hα-helixtrans-62.9-45.1174.1-94.394.3000111R151 L152 A157 A158 L159 L182 V186R151-L155 HydrophobicContact CB-CD1 4.47Å; R151-L155 WeakPolarHBondContact O-CD1 3.48Å; R151-L155 PolarHBondContact O-N 2.98Å; L152-L155 PolarHBondContact O-N 2.98Å; L155-A157 VanDerWaalsContact C-N 3.33Å; L155-A157 PolarHBondContact O-N 3.25Å; L155-A158 PolarHBondContact O-N 3.5Å; L155-L159 WeakPolarHBondContact O-CB 3.46Å; L155-L159 PolarHBondContact O-N 3.29Å; L155-L182 HydrophobicContact CB-CD1 4.36Å; L155-L182 HydrophobicContact CD2-CD1 3.26Å; L155-L182 HydrophobicContact CD2-CG 3.65Å; L155-L182 HydrophobicContact CG-CD1 3.54Å; L155-L182 HydrophobicContact CG-CG 4.15Å; L155-V186 HydrophobicContact CB-CG2 4.14Å; L155-V186 HydrophobicContact CD2-CG2 3.64Å
156N74.1Confident70.5Confident72 Ų7287.8 Ų87.839%0.38547%0.471SS..Hα-helixtrans-61.4-42.2176.6-90.3-19.5000111.7L152 D153 L159 Q160L152-N156 WeakPolarHBondContact O-CB 3.4Å; L152-N156 PolarHBondContact O-N 2.98Å; D153-N156 PolarHBondContact O-N 3.48Å; N156-L159 PolarHBondContact O-N 3.26Å; N156-Q160 WeakPolarHBondContact O-CG 3.28Å; N156-Q160 PolarHBondContact O-N 3.38Å
157A76.4Confident69.2Low58 Ų5888.8 Ų88.848%0.47949%0.487SS..Hα-helixtrans-63-41.4174.300000112.1D153 A154 L155 Q160 S161D153-A157 WeakPolarHBondContact O-CB 3.43Å; D153-A157 PolarHBondContact O-N 2.92Å; A154-A157 PolarHBondContact O-N 3.36Å; L155-A157 VanDerWaalsContact C-N 3.33Å; L155-A157 PolarHBondContact O-N 3.25Å; A157-Q160 PolarHBondContact O-N 3.01Å; A157-S161 WeakPolarHBondContact O-CB 3.33Å; A157-S161 PolarHBondContact O-N 3.38Å
158A71.3Confident68Low40 Ų4088 Ų8833%0.33149%0.486SS..Hα-helixtrans-63.7-45.6176.200000111.8A154 L155 Q160 S161 M162A154-A158 WeakPolarHBondContact O-CB 3.44Å; A154-A158 PolarHBondContact O-N 2.96Å; L155-A158 PolarHBondContact O-N 3.5Å; A158-Q160 VanDerWaalsContact C-N 3.33Å; A158-Q160 PolarHBondContact O-N 3.42Å; A158-S161 PolarHBondContact O-N 3.06Å; A158-S161 VanDerWaalsContact O-N 3.13Å; A158-S161 PolarHBondContact O-OG 3.35Å; A158-M162 WeakPolarHBondContact O-CB 3.32Å; A158-M162 PolarHBondContact O-N 2.98Å
159L67.4Low67.2Low73 Ų7394 Ų9438%0.38252%0.517SS..Hα-helixtrans-59.7-42176.5-164.191.7000111.3L155 N156 M162 L182L155-L159 WeakPolarHBondContact O-CB 3.46Å; L155-L159 PolarHBondContact O-N 3.29Å; N156-L159 PolarHBondContact O-N 3.26Å; L159-M162 WeakPolarHBondContact O-CB 3.45Å; L159-M162 PolarHBondContact O-N 2.99Å; L159-L182 HydrophobicContact CB-CD2 4.05Å; L159-L182 HydrophobicContact CD1-CD2 3.74Å
160Q71.8Confident66.6Low155 Ų15597.7 Ų97.772%0.72453%0.533SS*.Hα-helixtrans-66.9-36.1174.8-74-170.32.700112.8N156 A157 A158 M162 V163N156-Q160 WeakPolarHBondContact O-CG 3.28Å; N156-Q160 PolarHBondContact O-N 3.38Å; A157-Q160 PolarHBondContact O-N 3.01Å; A158-Q160 VanDerWaalsContact C-N 3.33Å; A158-Q160 PolarHBondContact O-N 3.42Å; Q160-M162 PolarHBondContact O-N 3.32Å; Q160-V163 WeakPolarHBondContact O-CG2 3.44Å
161S68.5Low65.8Low83 Ų8393.3 Ų93.358%0.5852%0.519SS*.Hα-helixtrans-69.9-24.5177.880.20000113.4A157 A158 V163A157-S161 WeakPolarHBondContact O-CB 3.33Å; A157-S161 PolarHBondContact O-N 3.38Å; A158-S161 PolarHBondContact O-N 3.06Å; A158-S161 VanDerWaalsContact O-N 3.13Å; A158-S161 PolarHBondContact O-OG 3.35Å; S161-V163 PolarHBondContact O-N 3.06Å
162M61.5Low65.1Low68 Ų6888 Ų8834%0.33551%0.506SS..THydrogen-bonded Turntrans-74.8-3.7-178.1-94.5-167.4167.400113.5A158 L159 Q160 K164 F175A158-M162 WeakPolarHBondContact O-CB 3.32Å; A158-M162 PolarHBondContact O-N 2.98Å; L159-M162 WeakPolarHBondContact O-CB 3.45Å; L159-M162 PolarHBondContact O-N 2.99Å; Q160-M162 PolarHBondContact O-N 3.32Å; M162-K164 PolarHBondContact O-N 3.37Å; M162-F175 HydrophobicContact CB-CE2 3.41Å; M162-F175 VanDerWaalsContact CB-CE2 3.41Å; M162-F175 HydrophobicContact CB-CZ 3.65Å; M162-F175 HydrophobicContact CE-CD2 4.48Å; M162-F175 HydrophobicContact CE-CE2 4.49Å; M162-F175 HydrophobicContact CG-CD2 4.37Å; M162-F175 HydrophobicContact CG-CE2 3.53Å; M162-F175 HydrophobicContact CG-CZ 4.25Å; M162-F175 WeakPolarHBondContact O-CE2 3.26Å; M162-F175 WeakPolarHBondContact O-CZ 3.43Å; M162-F175 HydrophobicContact SD-CD2 4.15Å; M162-F175 HydrophobicContact SD-CE2 3.69Å; M162-F175 HydrophobicContact SD-CZ 4.35Å
163V57.4Low65Low125 Ų12590.6 Ų90.676%0.75852%0.519SS*.  trans-70.934177.2-172.90000113.1Q160 S161Q160-V163 WeakPolarHBondContact O-CG2 3.44Å; S161-V163 PolarHBondContact O-N 3.06Å
164K56.6Low64.7Low177 Ų17791.2 Ų91.277%0.7752%0.519SS*.SBendtrans-109119.3169.7-71.1-175.1179.91790109.4M162 P166M162-K164 PolarHBondContact O-N 3.37Å; K164-P166 VanDerWaalsContact O-CD 3.25Å; K164-P166 WeakPolarHBondContact O-CD 3.47Å
165I49.5Very low64.4Low167 Ų16791.1 Ų91.186%0.85651%0.507SS*.  trans-60.2117.5-177.4-57.1172.3000109.9
166P50.9Low64.5Low35 Ų3592.1 Ų92.123%0.22752%0.52CS..  trans-72.1136.9174.2-15.731.3000111.3K164 T168 S171 F175K164-P166 VanDerWaalsContact O-CD 3.25Å; K164-P166 WeakPolarHBondContact O-CD 3.47Å; P166-T168 VanDerWaalsContact C-N 3.28Å; P166-T168 PolarHBondContact O-N 3.06Å; P166-S171 WeakPolarHBondContact CB-OG 3.37Å; P166-F175 HydrophobicContact CG-CB 4.26Å; P166-F175 HydrophobicContact CG-CD2 4.42Å; P166-F175 HydrophobicContact CG-CG 4.23Å
167S53.2Low64.9Low124 Ų12494.2 Ų94.287%0.86753%0.526SS*.SBendtrans-82.69-172.859.10000115.1
168T55.8Low65.1Low81 Ų8193.6 Ų93.650%0.49752%0.521SS..SBendtrans-140.8148.2178.462.90000112P166 D170 S171 T172P166-T168 VanDerWaalsContact C-N 3.28Å; P166-T168 PolarHBondContact O-N 3.06Å; T168-D170 PolarHBondContact O-N 3.16Å; T168-S171 PolarHBondContact N-OG 3.01Å; T168-S171 PolarHBondContact O-N 3.37Å; T168-S171 PolarHBondContact O-OG 3.04Å; T168-S171 VanDerWaalsContact OG1-CB 3.32Å; T168-S171 WeakPolarHBondContact OG1-CB 3.44Å; T168-S171 PolarHBondContact OG1-OG 3.35Å; T168-T172 PolarHBondContact O-N 3.05Å; T168-T172 PolarHBondContact O-OG1 3.35Å
169L57.8Low65.4Low138 Ų13893 Ų9372%0.72351%0.514SS*.Hα-helixtrans-62.9-40.2-177.3-166.971.8000112.3T172 I173L169-T172 WeakPolarHBondContact O-CB 3.4Å; L169-T172 PolarHBondContact O-N 2.98Å; L169-T172 VanDerWaalsContact O-N 3.15Å; L169-I173 PolarHBondContact O-N 3.2Å
170D61.8Low66.1Low126 Ų12696 Ų9667%0.67452%0.524SS*.Hα-helixtrans-65.3-40177.2-74.4-24.8000112.4T168 T172 I173 E174T168-D170 PolarHBondContact O-N 3.16Å; D170-T172 PolarHBondContact O-N 2.95Å; D170-I173 PolarHBondContact O-N 3.32Å; D170-E174 PolarHBondContact O-N 2.93Å
171S63Low66.7Low44 Ų4491.5 Ų91.531%0.30851%0.513SS..Hα-helixtrans-67.3-29.4174.461.50000111.9P166 T168 F175P166-S171 WeakPolarHBondContact CB-OG 3.37Å; T168-S171 PolarHBondContact N-OG 3.01Å; T168-S171 PolarHBondContact O-N 3.37Å; T168-S171 PolarHBondContact O-OG 3.04Å; T168-S171 VanDerWaalsContact OG1-CB 3.32Å; T168-S171 WeakPolarHBondContact OG1-CB 3.44Å; T168-S171 PolarHBondContact OG1-OG 3.35Å; S171-F175 WeakPolarHBondContact O-CB 3.4Å; S171-F175 PolarHBondContact O-N 3.24Å
172T62.5Low67.3Low57 Ų5789.4 Ų89.435%0.3550%0.495SS..Hα-helixtrans-69.9-38174.7-51.50000111.9T168 L169 D170 A176T168-T172 PolarHBondContact O-N 3.05Å; T168-T172 PolarHBondContact O-OG1 3.35Å; L169-T172 WeakPolarHBondContact O-CB 3.4Å; L169-T172 PolarHBondContact O-N 2.98Å; L169-T172 VanDerWaalsContact O-N 3.15Å; D170-T172 PolarHBondContact O-N 2.95Å; T172-A176 WeakPolarHBondContact O-CB 3.32Å; T172-A176 PolarHBondContact O-N 3.45Å
173I72.7Confident68.3Low83 Ų8391.3 Ų91.343%0.42650%0.503SS..Hα-helixtrans-70.1-47177.1-68.2171.5000111.1L169 D170 F175 A176 K177L169-I173 PolarHBondContact O-N 3.2Å; D170-I173 PolarHBondContact O-N 3.32Å; I173-F175 VanDerWaalsContact C-N 3.29Å; I173-F175 PolarHBondContact O-N 3.45Å; I173-A176 PolarHBondContact O-N 3.01Å; I173-A176 VanDerWaalsContact O-N 3.16Å; I173-K177 WeakPolarHBondContact O-CG 3.37Å; I173-K177 PolarHBondContact O-N 3.19Å
174E75.1Confident69.7Low111 Ų11187.6 Ų87.652%0.51948%0.483SS..Hα-helixtrans-64.4-37.4177.3-72.9-56.2128.500111.6D170 K177 A178D170-E174 PolarHBondContact O-N 2.93Å; E174-K177 PolarHBondContact O-N 3.07Å; E174-K177 IonicContact OE1-NZ 2.77Å; E174-K177 PolarHBondContact OE1-NZ 2.99Å; E174-A178 WeakPolarHBondContact O-CB 3.45Å; E174-A178 PolarHBondContact O-N 2.87Å
175F71.8Confident71.1Confident60 Ų6081.4 Ų81.426%0.26346%0.462SS..Hα-helixtrans-60.3-45170.3177.9-91.2000112.4M162 P166 S171 I173 A178 C179M162-F175 HydrophobicContact CB-CE2 3.41Å; M162-F175 VanDerWaalsContact CB-CE2 3.41Å; M162-F175 HydrophobicContact CB-CZ 3.65Å; M162-F175 HydrophobicContact CE-CD2 4.48Å; M162-F175 HydrophobicContact CE-CE2 4.49Å; M162-F175 HydrophobicContact CG-CD2 4.37Å; M162-F175 HydrophobicContact CG-CE2 3.53Å; M162-F175 HydrophobicContact CG-CZ 4.25Å; M162-F175 WeakPolarHBondContact O-CE2 3.26Å; M162-F175 WeakPolarHBondContact O-CZ 3.43Å; M162-F175 HydrophobicContact SD-CD2 4.15Å; M162-F175 HydrophobicContact SD-CE2 3.69Å; M162-F175 HydrophobicContact SD-CZ 4.35Å; P166-F175 HydrophobicContact CG-CB 4.26Å; P166-F175 HydrophobicContact CG-CD2 4.42Å; P166-F175 HydrophobicContact CG-CG 4.23Å; S171-F175 WeakPolarHBondContact O-CB 3.4Å; S171-F175 PolarHBondContact O-N 3.24Å; I173-F175 VanDerWaalsContact C-N 3.29Å; I173-F175 PolarHBondContact O-N 3.45Å; F175-A178 PolarHBondContact O-N 3.48Å; F175-C179 WeakPolarHBondContact CE1-SG 3.46Å; F175-C179 WeakPolarHBondContact O-CB 3.14Å; F175-C179 PolarHBondContact O-N 2.9Å; F175-C179 PolarHBondContact O-SG 3.06Å
176A75.3Confident72.6Confident57 Ų5774.4 Ų74.447%0.47143%0.427SS..Hα-helixtrans-64.3-40.4177.700000112.3T172 I173 C179 F180T172-A176 WeakPolarHBondContact O-CB 3.32Å; T172-A176 PolarHBondContact O-N 3.45Å; I173-A176 PolarHBondContact O-N 3.01Å; I173-A176 VanDerWaalsContact O-N 3.16Å; A176-C179 PolarHBondContact O-N 3.04Å; A176-F180 WeakPolarHBondContact O-CB 3.29Å; A176-F180 PolarHBondContact O-N 3.03Å
177K83.4Confident74.5Confident117 Ų11778.5 Ų78.551%0.50944%0.441SS..Hα-helixtrans-63.2-44.6173.8-71.9178.1-171.5164.50111.8I173 E174 C179 F180 A181I173-K177 WeakPolarHBondContact O-CG 3.37Å; I173-K177 PolarHBondContact O-N 3.19Å; E174-K177 PolarHBondContact O-N 3.07Å; E174-K177 IonicContact OE1-NZ 2.77Å; E174-K177 PolarHBondContact OE1-NZ 2.99Å; K177-C179 VanDerWaalsContact C-N 3.35Å; K177-F180 PolarHBondContact O-N 3.45Å; K177-A181 WeakPolarHBondContact O-CB 3.38Å; K177-A181 PolarHBondContact O-N 3.34Å
178A79.7Confident76.1Confident44 Ų4479.1 Ų79.136%0.36443%0.43SS..Hα-helixtrans-61.1-44.9176.200000111E174 F175 F180 A181 L182E174-A178 WeakPolarHBondContact O-CB 3.45Å; E174-A178 PolarHBondContact O-N 2.87Å; F175-A178 PolarHBondContact O-N 3.48Å; A178-F180 VanDerWaalsContact C-N 3.35Å; A178-F180 PolarHBondContact O-N 2.91Å; A178-A181 PolarHBondContact O-N 3.36Å; A178-L182 VanDerWaalsContact O-CB 3.25Å; A178-L182 WeakPolarHBondContact O-CB 3.48Å; A178-L182 PolarHBondContact O-N 2.96Å
179C76.8Confident77.5Confident27 Ų2776.1 Ų76.118%0.18241%0.412CS..Hα-helixtrans-60.8-42175.2-70.50000112.2F175 A176 K177 L182 Q183F175-C179 WeakPolarHBondContact CE1-SG 3.46Å; F175-C179 WeakPolarHBondContact O-CB 3.14Å; F175-C179 PolarHBondContact O-N 2.9Å; F175-C179 PolarHBondContact O-SG 3.06Å; A176-C179 PolarHBondContact O-N 3.04Å; K177-C179 VanDerWaalsContact C-N 3.35Å; C179-L182 PolarHBondContact O-N 3.21Å; C179-Q183 WeakPolarHBondContact O-CB 3.46Å; C179-Q183 PolarHBondContact O-N 3.29Å
180F82.6Confident78.9Confident138 Ų13874 Ų7461%0.60540%0.399SS*.Hα-helixtrans-67.1-42.5178.6-174.6-94.2000112.7A176 K177 A178 L182 Q183 S184A176-F180 WeakPolarHBondContact O-CB 3.29Å; A176-F180 PolarHBondContact O-N 3.03Å; K177-F180 PolarHBondContact O-N 3.45Å; A178-F180 VanDerWaalsContact C-N 3.35Å; A178-F180 PolarHBondContact O-N 2.91Å; F180-L182 VanDerWaalsContact C-N 3.32Å; F180-Q183 PolarHBondContact O-N 3.46Å; F180-S184 PolarHBondContact O-N 3.05Å; F180-S184 PolarHBondContact O-OG 2.95Å
181A83.9Confident80.2Confident60 Ų6073.5 Ų73.550%0.49640%0.395SS..Hα-helixtrans-63.1-41.8174.700000111.2K177 A178 S184 S185K177-A181 WeakPolarHBondContact O-CB 3.38Å; K177-A181 PolarHBondContact O-N 3.34Å; A178-A181 PolarHBondContact O-N 3.36Å; A181-S184 PolarHBondContact O-N 3.19Å; A181-S185 PolarHBondContact O-N 3.08Å
182L81Confident81.4Confident39 Ų3975.6 Ų75.620%0.20440%0.4CS..Hα-helixtrans-61.8-46.9176.1-159.270.6000111.1L155 L159 A178 C179 F180 S184 S185 V186L155-L182 HydrophobicContact CB-CD1 4.36Å; L155-L182 HydrophobicContact CD2-CD1 3.26Å; L155-L182 HydrophobicContact CD2-CG 3.65Å; L155-L182 HydrophobicContact CG-CD1 3.54Å; L155-L182 HydrophobicContact CG-CG 4.15Å; L159-L182 HydrophobicContact CB-CD2 4.05Å; L159-L182 HydrophobicContact CD1-CD2 3.74Å; A178-L182 VanDerWaalsContact O-CB 3.25Å; A178-L182 WeakPolarHBondContact O-CB 3.48Å; A178-L182 PolarHBondContact O-N 2.96Å; C179-L182 PolarHBondContact O-N 3.21Å; F180-L182 VanDerWaalsContact C-N 3.32Å; L182-S184 VanDerWaalsContact C-N 3.29Å; L182-S184 PolarHBondContact O-N 3.35Å; L182-S185 PolarHBondContact O-N 3.34Å; L182-V186 WeakPolarHBondContact O-CG2 3.37Å; L182-V186 PolarHBondContact O-N 3.38Å
183Q84.5Confident82.5Confident107 Ų10774.3 Ų74.350%0.539%0.391SS..Hα-helixtrans-63.2-34.6177.6-169.3177.511.200112.5C179 F180 K187C179-Q183 WeakPolarHBondContact O-CB 3.46Å; C179-Q183 PolarHBondContact O-N 3.29Å; F180-Q183 PolarHBondContact O-N 3.46Å; Q183-K187 WeakPolarHBondContact O-CG 3.49Å; Q183-K187 PolarHBondContact O-N 3.15Å; Q183-K187 VanDerWaalsContact O-N 3.15Å
184S86.2Confident83.3Confident47 Ų4775 Ų7533%0.32940%0.396SS..Hα-helixtrans-68.7-43.7175.5-57.30000111.2F180 A181 L182 V186 K187 E188F180-S184 PolarHBondContact O-N 3.05Å; F180-S184 PolarHBondContact O-OG 2.95Å; A181-S184 PolarHBondContact O-N 3.19Å; L182-S184 VanDerWaalsContact C-N 3.29Å; L182-S184 PolarHBondContact O-N 3.35Å; S184-V186 PolarHBondContact O-N 2.97Å; S184-K187 PolarHBondContact O-N 3.28Å; S184-E188 PolarHBondContact O-N 3.09Å; S184-E188 VanDerWaalsContact O-N 3.08Å
185S84.6Confident84.1Confident48 Ų4874.6 Ų74.634%0.33640%0.397SS..Hα-helixtrans-64.4-37.9175.5-176.50000112.6A181 L182 K187 E188 V189A181-S185 PolarHBondContact O-N 3.08Å; L182-S185 PolarHBondContact O-N 3.34Å; S185-K187 VanDerWaalsContact C-N 3.35Å; S185-K187 PolarHBondContact O-N 3.37Å; S185-E188 PolarHBondContact O-N 3.32Å; S185-V189 WeakPolarHBondContact O-CG2 3.34Å; S185-V189 PolarHBondContact O-N 3.48Å
186V82.9Confident84.9Confident20 Ų2072.4 Ų72.412%0.12139%0.387CS..Hα-helixtrans-57.6-47.8172.3164.50000110.8L152 L155 L182 S184 E188 V189 E190L152-V186 HydrophobicContact CD1-CB 4.3Å; L152-V186 HydrophobicContact CD1-CG1 3.82Å; L152-V186 HydrophobicContact CD1-CG2 4.15Å; L155-V186 HydrophobicContact CB-CG2 4.14Å; L155-V186 HydrophobicContact CD2-CG2 3.64Å; L182-V186 WeakPolarHBondContact O-CG2 3.37Å; L182-V186 PolarHBondContact O-N 3.38Å; S184-V186 PolarHBondContact O-N 2.97Å; V186-E188 VanDerWaalsContact C-N 3.34Å; V186-E188 PolarHBondContact O-N 2.88Å; V186-V189 PolarHBondContact O-N 3.19Å; V186-E190 HydrophobicContact CG1-CG 4.37Å; V186-E190 WeakPolarHBondContact O-CG 3.34Å; V186-E190 PolarHBondContact O-N 3.42Å
187K88.9Confident85.5Confident120 Ų12073.1 Ų73.152%0.52238%0.384SS..Hα-helixtrans-62.1-38.4178.4-76.6-179.5178.1-178.90113.1Q183 S184 S185 E190 L191Q183-K187 WeakPolarHBondContact O-CG 3.49Å; Q183-K187 PolarHBondContact O-N 3.15Å; Q183-K187 VanDerWaalsContact O-N 3.15Å; S184-K187 PolarHBondContact O-N 3.28Å; S185-K187 VanDerWaalsContact C-N 3.35Å; S185-K187 PolarHBondContact O-N 3.37Å; K187-E190 PolarHBondContact O-N 3.33Å; K187-L191 WeakPolarHBondContact O-CG 3.48Å; K187-L191 PolarHBondContact O-N 2.99Å
188E88.3Confident85.9Confident137 Ų13774 Ų7464%0.6439%0.387SS*.Hα-helixtrans-63.8-43.6175.9-74.1175.9176.800111.6S184 S185 V186 L191 E192S184-E188 PolarHBondContact O-N 3.09Å; S184-E188 VanDerWaalsContact O-N 3.08Å; S185-E188 PolarHBondContact O-N 3.32Å; V186-E188 VanDerWaalsContact C-N 3.34Å; V186-E188 PolarHBondContact O-N 2.88Å; E188-L191 PolarHBondContact O-N 3.17Å; E188-E192 PolarHBondContact O-N 3Å
189V84.2Confident86.4Confident19 Ų1976 Ų7612%0.11539%0.389CS..Hα-helixtrans-66.1-38176.2172.40000111.6L152 S185 V186 L191 E192 I193L152-V189 HydrophobicContact CB-CG1 4.22Å; L152-V189 HydrophobicContact CD1-CG1 4.32Å; S185-V189 WeakPolarHBondContact O-CG2 3.34Å; S185-V189 PolarHBondContact O-N 3.48Å; V186-V189 PolarHBondContact O-N 3.19Å; V189-L191 VanDerWaalsContact C-N 3.33Å; V189-L191 PolarHBondContact O-N 2.97Å; V189-E192 PolarHBondContact O-N 3.05Å; V189-I193 HydrophobicContact CG1-CD1 3.84Å; V189-I193 HydrophobicContact CG1-CG1 4.36Å; V189-I193 WeakPolarHBondContact O-CB 3.44Å; V189-I193 VanDerWaalsContact O-CG1 3.3Å; V189-I193 WeakPolarHBondContact O-CG1 3.4Å; V189-I193 PolarHBondContact O-N 2.94Å
190E87.9Confident87Confident94 Ų9477.8 Ų77.844%0.43940%0.397SS..Hα-helixtrans-61.9-39.7174.4-75.2174.6164.900112.1V186 K187 N194V186-E190 HydrophobicContact CG1-CG 4.37Å; V186-E190 WeakPolarHBondContact O-CG 3.34Å; V186-E190 PolarHBondContact O-N 3.42Å; K187-E190 PolarHBondContact O-N 3.33Å; E190-N194 WeakPolarHBondContact O-CB 3.35Å; E190-N194 VanDerWaalsContact O-CG 3.32Å; E190-N194 PolarHBondContact O-N 3.25Å; E190-N194 PolarHBondContact O-ND2 3.21Å
191L88.9Confident87.4Confident114 Ų11474.1 Ų74.160%0.59739%0.392SS*.Hα-helixtrans-65.7-45174.5-72.3170.6000111.5K187 E188 V189 I193 N194 D195K187-L191 WeakPolarHBondContact O-CG 3.48Å; K187-L191 PolarHBondContact O-N 2.99Å; E188-L191 PolarHBondContact O-N 3.17Å; V189-L191 VanDerWaalsContact C-N 3.33Å; V189-L191 PolarHBondContact O-N 2.97Å; L191-I193 VanDerWaalsContact C-N 3.34Å; L191-I193 PolarHBondContact O-N 3.05Å; L191-N194 PolarHBondContact O-N 3.5Å; L191-D195 PolarHBondContact O-N 3.42Å
192E88.7Confident87.7Confident89 Ų8976.5 Ų76.542%0.41639%0.393SS..Hα-helixtrans-60.1-43.1176.3-171.7-177.4-155.500111.7S148 E188 V189 N194 D195 L196S148-E192 PolarHBondContact OG-OE2 2.76Å; E188-E192 PolarHBondContact O-N 3Å; V189-E192 PolarHBondContact O-N 3.05Å; E192-N194 VanDerWaalsContact C-N 3.34Å; E192-N194 PolarHBondContact O-N 3.24Å; E192-D195 PolarHBondContact O-N 2.92Å; E192-L196 HydrophobicContact CG-CD1 4.12Å; E192-L196 WeakPolarHBondContact O-CB 3.39Å; E192-L196 VanDerWaalsContact O-CG 3.29Å; E192-L196 WeakPolarHBondContact O-CG 3.49Å; E192-L196 PolarHBondContact O-N 3.25Å
193I85.8Confident88Confident29 Ų2977.9 Ų77.915%0.14940%0.4CS..Hα-helixtrans-62.7-40.9175.9-72.1169.5000111.1L152 V189 L191 L196 N197L152-I193 HydrophobicContact CD2-CD1 4.03Å; V189-I193 HydrophobicContact CG1-CD1 3.84Å; V189-I193 HydrophobicContact CG1-CG1 4.36Å; V189-I193 WeakPolarHBondContact O-CB 3.44Å; V189-I193 VanDerWaalsContact O-CG1 3.3Å; V189-I193 WeakPolarHBondContact O-CG1 3.4Å; V189-I193 PolarHBondContact O-N 2.94Å; L191-I193 VanDerWaalsContact C-N 3.34Å; L191-I193 PolarHBondContact O-N 3.05Å; I193-L196 PolarHBondContact O-N 3.4Å; I193-N197 WeakPolarHBondContact O-CB 3.33Å; I193-N197 PolarHBondContact O-N 2.9Å; I193-N197 PolarHBondContact O-ND2 3.01Å
194N89.5Confident88.2Confident99 Ų9977.2 Ų77.253%0.52940%0.399SS..Hα-helixtrans-64.9-41.2177.4-78.1-32.1000112.2E190 L191 E192 N197 K198E190-N194 WeakPolarHBondContact O-CB 3.35Å; E190-N194 VanDerWaalsContact O-CG 3.32Å; E190-N194 PolarHBondContact O-N 3.25Å; E190-N194 PolarHBondContact O-ND2 3.21Å; L191-N194 PolarHBondContact O-N 3.5Å; E192-N194 VanDerWaalsContact C-N 3.34Å; E192-N194 PolarHBondContact O-N 3.24Å; N194-N197 PolarHBondContact O-N 2.96Å; N194-K198 WeakPolarHBondContact O-CB 3.37Å; N194-K198 PolarHBondContact O-N 3.34Å
195D90.5Very high88.4Confident101 Ų10177.8 Ų77.854%0.5441%0.406SS..Hα-helixtrans-65.6-42.6175.7-77.2-21.1000111.7L191 E192 N197 K198 Q199L191-D195 PolarHBondContact O-N 3.42Å; E192-D195 PolarHBondContact O-N 2.92Å; D195-N197 PolarHBondContact O-N 3.37Å; D195-K198 WeakPolarHBondContact O-CB 3.34Å; D195-K198 PolarHBondContact O-N 3.49Å; D195-Q199 WeakPolarHBondContact O-CG 3.35Å; D195-Q199 PolarHBondContact O-N 3.4Å
196L88.3Confident88.6Confident14 Ų1480.5 Ų80.57%0.07342%0.416CS..Hα-helixtrans-63.3-41.1174.9-72.3168.8000112.2L141 Q145 E192 I193 K198 Q199 N200L141-L196 HydrophobicContact CB-CD2 4.09Å; L141-L196 HydrophobicContact CD2-CD2 3.91Å; L141-L196 HydrophobicContact CG-CD2 4.44Å; Q145-L196 HydrophobicContact CB-CD1 3.84Å; Q145-L196 HydrophobicContact CG-CB 4.44Å; Q145-L196 HydrophobicContact CG-CD1 3.84Å; E192-L196 HydrophobicContact CG-CD1 4.12Å; E192-L196 WeakPolarHBondContact O-CB 3.39Å; E192-L196 VanDerWaalsContact O-CG 3.29Å; E192-L196 WeakPolarHBondContact O-CG 3.49Å; E192-L196 PolarHBondContact O-N 3.25Å; I193-L196 PolarHBondContact O-N 3.4Å; L196-K198 VanDerWaalsContact C-N 3.3Å; L196-K198 PolarHBondContact O-N 3.11Å; L196-Q199 PolarHBondContact O-N 3.45Å; L196-N200 WeakPolarHBondContact O-CB 3.46Å; L196-N200 PolarHBondContact O-N 2.89Å
197N89.4Confident88.8Confident73 Ų7386.5 Ų86.539%0.3944%0.441SS..Hα-helixtrans-62.7-38.8175-76.1-24.4000111.7Q145 I193 N194 D195 N200 A201Q145-N197 PolarHBondContact NE2-OD1 3.32Å; Q145-N197 VanDerWaalsContact NE2-OD1 3.12Å; I193-N197 WeakPolarHBondContact O-CB 3.33Å; I193-N197 PolarHBondContact O-N 2.9Å; I193-N197 PolarHBondContact O-ND2 3.01Å; N194-N197 PolarHBondContact O-N 2.96Å; D195-N197 PolarHBondContact O-N 3.37Å; N197-N200 PolarHBondContact O-N 3.04Å; N197-A201 WeakPolarHBondContact O-CB 3.33Å; N197-A201 PolarHBondContact O-N 2.9Å
198K91.7Very high88.9Confident135 Ų13585.1 Ų85.159%0.58744%0.439SS*.Hα-helixtrans-64.8-43.5175.2-173.2-179.5178.1-175.80111.7N194 D195 L196 A201 Q202N194-K198 WeakPolarHBondContact O-CB 3.37Å; N194-K198 PolarHBondContact O-N 3.34Å; D195-K198 WeakPolarHBondContact O-CB 3.34Å; D195-K198 PolarHBondContact O-N 3.49Å; L196-K198 VanDerWaalsContact C-N 3.3Å; L196-K198 PolarHBondContact O-N 3.11Å; K198-A201 PolarHBondContact O-N 3.23Å; K198-Q202 WeakPolarHBondContact O-CG 3.45Å; K198-Q202 PolarHBondContact O-N 3.33Å; K198-Q202 VanDerWaalsContact O-N 3.17Å
199Q90Very high89Confident86 Ų8684 Ų8440%0.40243%0.434SS..Hα-helixtrans-64.3-42.2175.7-70.9176.62.200112D195 L196 A201 Q202 L203D195-Q199 WeakPolarHBondContact O-CG 3.35Å; D195-Q199 PolarHBondContact O-N 3.4Å; L196-Q199 PolarHBondContact O-N 3.45Å; Q199-A201 VanDerWaalsContact C-N 3.33Å; Q199-A201 PolarHBondContact O-N 3.39Å; Q199-Q202 WeakPolarHBondContact O-CB 3.45Å; Q199-Q202 PolarHBondContact O-N 2.95Å; Q199-Q202 VanDerWaalsContact O-N 3.15Å; Q199-L203 PolarHBondContact O-N 2.89Å
200N88.4Confident88.9Confident65 Ų6590.8 Ų90.835%0.34846%0.458SS..Hα-helixtrans-63.6-39.5178-165.230.3000111.8L196 N197 Q202 L203 I204L196-N200 WeakPolarHBondContact O-CB 3.46Å; L196-N200 PolarHBondContact O-N 2.89Å; N197-N200 PolarHBondContact O-N 3.04Å; N200-Q202 VanDerWaalsContact C-N 3.32Å; N200-Q202 PolarHBondContact O-N 3.4Å; N200-L203 PolarHBondContact O-N 2.68Å; N200-I204 WeakPolarHBondContact O-CG1 3.41Å; N200-I204 PolarHBondContact O-N 3.02Å
201A91.4Very high88.8Confident60 Ų6089.7 Ų89.750%0.49646%0.46SS..Hα-helixtrans-61.5-38.8173.600000112.4N197 K198 Q199 A205N197-A201 WeakPolarHBondContact O-CB 3.33Å; N197-A201 PolarHBondContact O-N 2.9Å; K198-A201 PolarHBondContact O-N 3.23Å; Q199-A201 VanDerWaalsContact C-N 3.33Å; Q199-A201 PolarHBondContact O-N 3.39Å; A201-A205 PolarHBondContact O-N 3.1Å; A201-A205 VanDerWaalsContact O-N 3.16Å
202Q91Very high88.9Confident110 Ų11091.6 Ų91.651%0.51446%0.464SS..Hα-helixtrans-66.2-41.7175-70.5173.4-17.200112.1K198 Q199 N200 I204 A205 L206K198-Q202 WeakPolarHBondContact O-CG 3.45Å; K198-Q202 PolarHBondContact O-N 3.33Å; K198-Q202 VanDerWaalsContact O-N 3.17Å; Q199-Q202 WeakPolarHBondContact O-CB 3.45Å; Q199-Q202 PolarHBondContact O-N 2.95Å; Q199-Q202 VanDerWaalsContact O-N 3.15Å; N200-Q202 VanDerWaalsContact C-N 3.32Å; N200-Q202 PolarHBondContact O-N 3.4Å; Q202-I204 PolarHBondContact O-N 3.4Å; Q202-A205 PolarHBondContact O-N 3.33Å; Q202-L206 WeakPolarHBondContact O-CG 3.35Å; Q202-L206 PolarHBondContact O-N 2.87Å
203L86.4Confident88.7Confident69 Ų6992.7 Ų92.736%0.36147%0.472SS..Hα-helixtrans-64-39.1176.8-75.3170.2000112.6Q138 Q199 N200 L206 K207Q138-L203 HydrophobicContact CG-CD1 3.97Å; Q199-L203 PolarHBondContact O-N 2.89Å; N200-L203 PolarHBondContact O-N 2.68Å; L203-L206 PolarHBondContact O-N 3Å; L203-K207 WeakPolarHBondContact O-CB 3.43Å; L203-K207 PolarHBondContact O-N 2.99Å
204I89.7Confident88.5Confident93 Ų9394.5 Ų94.548%0.47748%0.484SS..Hα-helixtrans-61.6-45.4174.3-68.3166.5000110.3N200 Q202 L206 K207 D208N200-I204 WeakPolarHBondContact O-CG1 3.41Å; N200-I204 PolarHBondContact O-N 3.02Å; Q202-I204 PolarHBondContact O-N 3.4Å; I204-L206 PolarHBondContact O-N 3.19Å; I204-K207 WeakPolarHBondContact O-CB 3.49Å; I204-K207 PolarHBondContact O-N 3.44Å; I204-D208 PolarHBondContact O-N 3.29Å
205A90.3Very high88.3Confident58 Ų5892.2 Ų92.248%0.47948%0.479SS..Hα-helixtrans-61.6-43.6177.600000112.5A201 Q202 K207 D208 E209A201-A205 PolarHBondContact O-N 3.1Å; A201-A205 VanDerWaalsContact O-N 3.16Å; Q202-A205 PolarHBondContact O-N 3.33Å; A205-K207 VanDerWaalsContact C-N 3.34Å; A205-K207 PolarHBondContact O-N 3.08Å; A205-D208 PolarHBondContact O-N 3.17Å; A205-E209 PolarHBondContact O-N 3.19Å
206L88.1Confident88Confident105 Ų10591.1 Ų91.155%0.5548%0.479SS..Hα-helixtrans-64.8-36.5176.2-72.6172.1000112.3Q202 L203 I204 E209 R210Q202-L206 WeakPolarHBondContact O-CG 3.35Å; Q202-L206 PolarHBondContact O-N 2.87Å; L203-L206 PolarHBondContact O-N 3Å; I204-L206 PolarHBondContact O-N 3.19Å; L206-E209 PolarHBondContact O-N 3.49Å; L206-R210 WeakPolarHBondContact O-CB 3.39Å; L206-R210 PolarHBondContact O-N 2.9Å
207K88.2Confident87.8Confident146 Ų14696.6 Ų96.664%0.63550%0.499SS*.Hα-helixtrans-64.1-43.8175.1-175.3-178.8177.1-177.80111.4L203 I204 A205 E209 R210 S211L203-K207 WeakPolarHBondContact O-CB 3.43Å; L203-K207 PolarHBondContact O-N 2.99Å; I204-K207 WeakPolarHBondContact O-CB 3.49Å; I204-K207 PolarHBondContact O-N 3.44Å; A205-K207 VanDerWaalsContact C-N 3.34Å; A205-K207 PolarHBondContact O-N 3.08Å; K207-E209 VanDerWaalsContact C-N 3.34Å; K207-R210 PolarHBondContact O-N 3.37Å; K207-S211 PolarHBondContact O-N 3.32Å; K207-S211 PolarHBondContact O-OG 2.96Å
208D89.7Confident87.5Confident91 Ų9197.1 Ų97.149%0.48750%0.499SS..Hα-helixtrans-64.7-39.4176.7-75.4-11.5000111.7I204 A205 S211 K212I204-D208 PolarHBondContact O-N 3.29Å; A205-D208 PolarHBondContact O-N 3.17Å; D208-S211 PolarHBondContact O-N 3.38Å; D208-K212 WeakPolarHBondContact O-CG 3.46Å; D208-K212 PolarHBondContact O-N 2.94Å; D208-K212 VanDerWaalsContact O-N 3.11Å
209E90.2Very high87.4Confident113 Ų11396.7 Ų96.753%0.52850%0.497SS..Hα-helixtrans-63.1-44.8173.9-171.8171.8-16900111.7A205 L206 K207 S211 K212 L213A205-E209 PolarHBondContact O-N 3.19Å; L206-E209 PolarHBondContact O-N 3.49Å; K207-E209 VanDerWaalsContact C-N 3.34Å; E209-S211 PolarHBondContact O-N 3.01Å; E209-K212 WeakPolarHBondContact O-CB 3.27Å; E209-K212 PolarHBondContact O-N 2.94Å; E209-K212 VanDerWaalsContact O-N 3.15Å; E209-L213 WeakPolarHBondContact O-CG 3.46Å; E209-L213 PolarHBondContact O-N 3.05Å
210R82Confident86.9Confident162 Ų16295.1 Ų95.161%0.61150%0.499SS*.Hα-helixtrans-58.4-45.7174.1-178.3-176.1175.5-1641.4111.8L206 K207 K212 L213 V214L206-R210 WeakPolarHBondContact O-CB 3.39Å; L206-R210 PolarHBondContact O-N 2.9Å; K207-R210 PolarHBondContact O-N 3.37Å; R210-K212 VanDerWaalsContact C-N 3.26Å; R210-K212 PolarHBondContact O-N 3.27Å; R210-L213 PolarHBondContact O-N 3.49Å; R210-L213 VanDerWaalsContact O-N 3.17Å; R210-V214 HydrophobicContact CG-CG2 4.34Å; R210-V214 WeakPolarHBondContact O-CG2 3.37Å; R210-V214 PolarHBondContact O-N 2.9Å
211S87.6Confident86.5Confident71 Ų7198.3 Ų98.350%0.49751%0.506SS..Hα-helixtrans-59.8-37.8177.5-740000112.1K207 D208 E209 A215K207-S211 PolarHBondContact O-N 3.32Å; K207-S211 PolarHBondContact O-OG 2.96Å; D208-S211 PolarHBondContact O-N 3.38Å; E209-S211 PolarHBondContact O-N 3.01Å; S211-A215 WeakPolarHBondContact O-CB 3.37Å; S211-A215 PolarHBondContact O-N 2.96Å; S211-A215 VanDerWaalsContact O-N 3.09Å
212K90.4Very high86.2Confident155 Ų155101.3 Ų101.367%0.67451%0.51SS*.Hα-helixtrans-65.9-43.6173.6-69169.5-174.7171.50112.1D208 E209 R210 A215 S216D208-K212 WeakPolarHBondContact O-CG 3.46Å; D208-K212 PolarHBondContact O-N 2.94Å; D208-K212 VanDerWaalsContact O-N 3.11Å; E209-K212 WeakPolarHBondContact O-CB 3.27Å; E209-K212 PolarHBondContact O-N 2.94Å; E209-K212 VanDerWaalsContact O-N 3.15Å; R210-K212 VanDerWaalsContact C-N 3.26Å; R210-K212 PolarHBondContact O-N 3.27Å; K212-A215 PolarHBondContact O-N 3.44Å; K212-S216 WeakPolarHBondContact O-CB 3.43Å; K212-S216 PolarHBondContact O-N 2.88Å
213L84.2Confident85.9Confident111 Ų111104.6 Ų104.658%0.58152%0.518SS*.Hα-helixtrans-64.4-43178.2-70.9174.2000112.2E209 R210 S216 R217E209-L213 WeakPolarHBondContact O-CG 3.46Å; E209-L213 PolarHBondContact O-N 3.05Å; R210-L213 PolarHBondContact O-N 3.49Å; R210-L213 VanDerWaalsContact O-N 3.17Å; L213-S216 PolarHBondContact O-N 3.4Å; L213-R217 WeakPolarHBondContact O-CB 3.4Å; L213-R217 PolarHBondContact O-N 3.36Å
214V80.9Confident85.4Confident68 Ų68106.7 Ų106.741%0.41253%0.529SS..Hα-helixtrans-61.5-45.7176171.80000110.9R210 S216 R217 E218R210-V214 HydrophobicContact CG-CG2 4.34Å; R210-V214 WeakPolarHBondContact O-CG2 3.37Å; R210-V214 PolarHBondContact O-N 2.9Å; V214-S216 VanDerWaalsContact C-N 3.32Å; V214-S216 PolarHBondContact O-N 3.36Å; V214-R217 PolarHBondContact O-N 3.43Å; V214-E218 PolarHBondContact O-N 3.02Å
215A86.2Confident84.9Confident51 Ų51105.3 Ų105.342%0.42153%0.531SS..Hα-helixtrans-63.4-36.9176.600000112.6S211 K212 K219S211-A215 WeakPolarHBondContact O-CB 3.37Å; S211-A215 PolarHBondContact O-N 2.96Å; S211-A215 VanDerWaalsContact O-N 3.09Å; K212-A215 PolarHBondContact O-N 3.44Å; A215-K219 WeakPolarHBondContact O-CG 3.46Å; A215-K219 PolarHBondContact O-N 3.06Å
216S85.1Confident84.7Confident77 Ų77107.2 Ų107.254%0.53853%0.533SS..Hα-helixtrans-67.3-41.7175.3-169.30000112K212 L213 V214 K219 A220K212-S216 WeakPolarHBondContact O-CB 3.43Å; K212-S216 PolarHBondContact O-N 2.88Å; L213-S216 PolarHBondContact O-N 3.4Å; V214-S216 VanDerWaalsContact C-N 3.32Å; V214-S216 PolarHBondContact O-N 3.36Å; S216-K219 PolarHBondContact O-N 3.01Å; S216-A220 PolarHBondContact O-N 2.93Å
217R82.9Confident84.4Confident130 Ų130105.4 Ų105.449%0.49153%0.526SS..Hα-helixtrans-63-44176.8-172.9-174.775.6176.22.5111.7L213 V214 K219 A220 R221L213-R217 WeakPolarHBondContact O-CB 3.4Å; L213-R217 PolarHBondContact O-N 3.36Å; V214-R217 PolarHBondContact O-N 3.43Å; R217-K219 VanDerWaalsContact C-N 3.35Å; R217-K219 PolarHBondContact O-N 3.36Å; R217-A220 WeakPolarHBondContact O-CB 3.43Å; R217-A220 PolarHBondContact O-N 3.21Å; R217-A220 VanDerWaalsContact O-N 3.11Å; R217-R221 PolarHBondContact O-N 3.29Å
218E83.8Confident83.8Confident84 Ų84101.2 Ų101.239%0.39352%0.515SS..Hα-helixtrans-64.5-42.4-179.4-157.458.2-148.900111.2V214 A220 R221 E222V214-E218 PolarHBondContact O-N 3.02Å; E218-A220 VanDerWaalsContact C-N 3.27Å; E218-A220 PolarHBondContact O-N 2.92Å; E218-R221 PolarHBondContact O-N 3.34Å; E218-R221 VanDerWaalsContact O-N 3.16Å; E218-R221 IonicContact OE2-NH1 3.94Å; E218-E222 PolarHBondContact O-N 3.11Å
219K88.9Confident83.6Confident125 Ų12599.7 Ų99.754%0.54351%0.511SS..Hα-helixtrans-59.5-35.8171.4-74.2177.7179.8-179.20113.2A215 S216 R217 R223A215-K219 WeakPolarHBondContact O-CG 3.46Å; A215-K219 PolarHBondContact O-N 3.06Å; S216-K219 PolarHBondContact O-N 3.01Å; R217-K219 VanDerWaalsContact C-N 3.35Å; R217-K219 PolarHBondContact O-N 3.36Å; K219-R223 VanDerWaalsContact O-CG 3.27Å; K219-R223 WeakPolarHBondContact O-CG 3.48Å; K219-R223 PolarHBondContact O-N 2.95Å
220A79.1Confident83.6Confident54 Ų5499.8 Ų99.845%0.44651%0.51SS..Hα-helixtrans-69-40.4176.400000111.8S216 R217 E218 R223 L224S216-A220 PolarHBondContact O-N 2.93Å; R217-A220 WeakPolarHBondContact O-CB 3.43Å; R217-A220 PolarHBondContact O-N 3.21Å; R217-A220 VanDerWaalsContact O-N 3.11Å; E218-A220 VanDerWaalsContact C-N 3.27Å; E218-A220 PolarHBondContact O-N 2.92Å; A220-R223 PolarHBondContact O-N 3.37Å; A220-L224 PolarHBondContact O-N 2.92Å
221R79.9Confident83.5Confident131 Ų13197.6 Ų97.649%0.49451%0.507SS..Hα-helixtrans-64.3-44175.4-73.4178.4172.7178.7-7.8112.5R217 E218 R223 L224 A225R217-R221 PolarHBondContact O-N 3.29Å; E218-R221 PolarHBondContact O-N 3.34Å; E218-R221 VanDerWaalsContact O-N 3.16Å; E218-R221 IonicContact OE2-NH1 3.94Å; R221-R223 VanDerWaalsContact C-N 3.3Å; R221-R223 PolarHBondContact O-N 3.14Å; R221-L224 PolarHBondContact O-N 3.38Å; R221-A225 WeakPolarHBondContact O-CB 3.42Å; R221-A225 PolarHBondContact O-N 3.43Å
222E84.9Confident83.1Confident124 Ų12497 Ų9758%0.57951%0.507SS*.Hα-helixtrans-59.4-41.5175-74.4176.3175.600111.8E218 L226E218-E222 PolarHBondContact O-N 3.11Å; E222-L226 WeakPolarHBondContact O-CB 3.24Å; E222-L226 PolarHBondContact O-N 3.27Å
223R86.1Confident83.1Confident179 Ų17995.6 Ų95.668%0.67550%0.502SS*.Hα-helixtrans-64-45.9175.9-74.1172.2-176.4177.60112K219 A220 R221 L226 T227K219-R223 VanDerWaalsContact O-CG 3.27Å; K219-R223 WeakPolarHBondContact O-CG 3.48Å; K219-R223 PolarHBondContact O-N 2.95Å; A220-R223 PolarHBondContact O-N 3.37Å; R221-R223 VanDerWaalsContact C-N 3.3Å; R221-R223 PolarHBondContact O-N 3.14Å; R223-L226 PolarHBondContact O-N 3Å; R223-T227 WeakPolarHBondContact O-CG2 3.46Å; R223-T227 PolarHBondContact O-N 2.92Å; R223-T227 PolarHBondContact O-OG1 3.17Å
224L75.5Confident83.1Confident113 Ų11395.9 Ų95.959%0.59250%0.504SS*.Hα-helixtrans-61.7-45.9178.5-177.566000111.4A220 R221 L226 T227 S228A220-L224 PolarHBondContact O-N 2.92Å; R221-L224 PolarHBondContact O-N 3.38Å; L224-L226 VanDerWaalsContact C-N 3.29Å; L224-L226 PolarHBondContact O-N 3.1Å; L224-T227 WeakPolarHBondContact CA-OG1 3.42Å; L224-T227 PolarHBondContact O-N 3.19Å; L224-T227 PolarHBondContact O-OG1 3.41Å; L224-S228 WeakPolarHBondContact O-CB 3.38Å; L224-S228 PolarHBondContact O-N 2.98Å; L224-S228 PolarHBondContact O-OG 2.98Å; L224-S228 VanDerWaalsContact O-OG 3.14Å
225A78.6Confident83.4Confident63 Ų6398 Ų9852%0.52151%0.512SS..Hα-helixtrans-60.7-40.6176.600000111.8R221 S229R221-A225 WeakPolarHBondContact O-CB 3.42Å; R221-A225 PolarHBondContact O-N 3.43Å; A225-S229 WeakPolarHBondContact O-CB 3.42Å; A225-S229 PolarHBondContact O-N 3Å
226L86.3Confident83.6Confident99 Ų99102.6 Ų102.652%0.51852%0.523SS..Hα-helixtrans-67-41.4177.2-174.568.8000112.5E222 R223 L224 K230E222-L226 WeakPolarHBondContact O-CB 3.24Å; E222-L226 PolarHBondContact O-N 3.27Å; R223-L226 PolarHBondContact O-N 3Å; L224-L226 VanDerWaalsContact C-N 3.29Å; L224-L226 PolarHBondContact O-N 3.1Å; L226-K230 WeakPolarHBondContact O-CG 3.44Å; L226-K230 PolarHBondContact O-N 3.36Å; L226-K230 VanDerWaalsContact O-N 3.11Å
227T81.2Confident83.9Confident66 Ų66102.7 Ų102.741%0.40552%0.52SS..Hα-helixtrans-67.3-46.2178.150.50000111R223 L224 S229 K230 E231R223-T227 WeakPolarHBondContact O-CG2 3.46Å; R223-T227 PolarHBondContact O-N 2.92Å; R223-T227 PolarHBondContact O-OG1 3.17Å; L224-T227 WeakPolarHBondContact CA-OG1 3.42Å; L224-T227 PolarHBondContact O-N 3.19Å; L224-T227 PolarHBondContact O-OG1 3.41Å; T227-S229 VanDerWaalsContact C-N 3.32Å; T227-S229 PolarHBondContact O-N 3.18Å; T227-K230 PolarHBondContact O-N 3.34Å; T227-K230 VanDerWaalsContact O-N 3.14Å; T227-E231 WeakPolarHBondContact O-CG 3.35Å; T227-E231 PolarHBondContact O-N 2.94Å
228S77Confident84Confident58 Ų58102.1 Ų102.141%0.40652%0.523SS..Hα-helixtrans-63-37177.3-60.10000112.5L224 A232L224-S228 WeakPolarHBondContact O-CB 3.38Å; L224-S228 PolarHBondContact O-N 2.98Å; L224-S228 PolarHBondContact O-OG 2.98Å; L224-S228 VanDerWaalsContact O-OG 3.14Å; S228-A232 WeakPolarHBondContact O-CB 3.38Å; S228-A232 PolarHBondContact O-N 2.94Å
229S84.5Confident84Confident59 Ų59103.3 Ų103.341%0.41353%0.528SS..Hα-helixtrans-63.8-41.8174.1-171.50000112.1A225 T227 A232 E233A225-S229 WeakPolarHBondContact O-CB 3.42Å; A225-S229 PolarHBondContact O-N 3Å; T227-S229 VanDerWaalsContact C-N 3.32Å; T227-S229 PolarHBondContact O-N 3.18Å; S229-A232 PolarHBondContact O-N 3.27Å; S229-E233 WeakPolarHBondContact O-CG 3.48Å; S229-E233 PolarHBondContact O-N 3.16Å
230K90.6Very high84.1Confident116 Ų116102.8 Ų102.850%0.50453%0.53SS..Hα-helixtrans-68.3-41.4178-74.8177.1178.3-1760112.1L226 T227 E233 L234L226-K230 WeakPolarHBondContact O-CG 3.44Å; L226-K230 PolarHBondContact O-N 3.36Å; L226-K230 VanDerWaalsContact O-N 3.11Å; T227-K230 PolarHBondContact O-N 3.34Å; T227-K230 VanDerWaalsContact O-N 3.14Å; K230-E233 PolarHBondContact O-N 2.95Å; K230-L234 WeakPolarHBondContact O-CG 3.46Å; K230-L234 PolarHBondContact O-N 3.44Å
231E80.1Confident84.6Confident115 Ų115104.9 Ų104.954%0.53753%0.533SS..Hα-helixtrans-61.9-43.9175.3-74.3166.4-174.100111.1T227 E233 L234 L235T227-E231 WeakPolarHBondContact O-CG 3.35Å; T227-E231 PolarHBondContact O-N 2.94Å; E231-E233 VanDerWaalsContact C-N 3.34Å; E231-E233 PolarHBondContact O-N 2.75Å; E231-L234 PolarHBondContact O-N 2.9Å; E231-L235 WeakPolarHBondContact O-CG 3.36Å; E231-L235 PolarHBondContact O-N 3.5Å
232A79.6Confident85.1Confident60 Ų60102.9 Ų102.950%0.49653%0.532SS..Hα-helixtrans-62.6-38.6175.700000112.7S228 S229 K236S228-A232 WeakPolarHBondContact O-CB 3.38Å; S228-A232 PolarHBondContact O-N 2.94Å; S229-A232 PolarHBondContact O-N 3.27Å; A232-K236 WeakPolarHBondContact O-CB 3.49Å; A232-K236 PolarHBondContact O-N 2.88Å; A232-K236 VanDerWaalsContact O-N 3.08Å
233E89Confident85.2Confident125 Ų125102 Ų10258%0.58453%0.528SS*.Hα-helixtrans-65.6-43.1174.4-76.4176.5175.700112.3S229 K230 E231 K236 T237S229-E233 WeakPolarHBondContact O-CG 3.48Å; S229-E233 PolarHBondContact O-N 3.16Å; K230-E233 PolarHBondContact O-N 2.95Å; E231-E233 VanDerWaalsContact C-N 3.34Å; E231-E233 PolarHBondContact O-N 2.75Å; E233-K236 PolarHBondContact O-N 3.28Å; E233-T237 PolarHBondContact O-N 3.05Å; E233-T237 PolarHBondContact O-OG1 3.43Å
234L85.9Confident85.5Confident116 Ų11697 Ų9761%0.60752%0.517SS*.Hα-helixtrans-62.4-48.6177.1-74.4170.6000111.8K230 E231 K236 T237 E238K230-L234 WeakPolarHBondContact O-CG 3.46Å; K230-L234 PolarHBondContact O-N 3.44Å; E231-L234 PolarHBondContact O-N 2.9Å; L234-K236 VanDerWaalsContact C-N 3.26Å; L234-K236 PolarHBondContact O-N 3.14Å; L234-T237 WeakPolarHBondContact CA-OG1 3.43Å; L234-T237 PolarHBondContact O-N 3.47Å; L234-T237 VanDerWaalsContact O-N 3.1Å; L234-T237 PolarHBondContact O-OG1 2.94Å; L234-E238 PolarHBondContact O-N 3.2Å
235L85.8Confident86.2Confident113 Ų11396.8 Ų96.859%0.59251%0.513SS*.Hα-helixtrans-59.7-38.7177.1-72.7173000111.7E231 E238 E239E231-L235 WeakPolarHBondContact O-CG 3.36Å; E231-L235 PolarHBondContact O-N 3.5Å; L235-E238 PolarHBondContact O-N 3.11Å; L235-E239 WeakPolarHBondContact O-CB 3.47Å; L235-E239 PolarHBondContact O-N 3.27Å
236K90.7Very high86.6Confident148 Ų14897.1 Ų97.164%0.64351%0.509SS*.Hα-helixtrans-65.4-38.7176.2-173.6177.9-178.8-179.80112.3A232 E233 L234 M240A232-K236 WeakPolarHBondContact O-CB 3.49Å; A232-K236 PolarHBondContact O-N 2.88Å; A232-K236 VanDerWaalsContact O-N 3.08Å; E233-K236 PolarHBondContact O-N 3.28Å; L234-K236 VanDerWaalsContact C-N 3.26Å; L234-K236 PolarHBondContact O-N 3.14Å; K236-M240 PolarHBondContact O-N 3.41Å; K236-M240 VanDerWaalsContact O-N 3.17Å
237T90.7Very high86.9Confident79 Ų7996.8 Ų96.849%0.48551%0.51SS..Hα-helixtrans-67.2-42.7175.5510000111.9E233 L234 M240 D241E233-T237 PolarHBondContact O-N 3.05Å; E233-T237 PolarHBondContact O-OG1 3.43Å; L234-T237 WeakPolarHBondContact CA-OG1 3.43Å; L234-T237 PolarHBondContact O-N 3.47Å; L234-T237 VanDerWaalsContact O-N 3.1Å; L234-T237 PolarHBondContact O-OG1 2.94Å; T237-M240 WeakPolarHBondContact O-CB 3.39Å; T237-M240 PolarHBondContact O-N 3.25Å; T237-D241 PolarHBondContact O-N 2.86Å
238E85.4Confident87.4Confident117 Ų11799.8 Ų99.855%0.54752%0.518SS..Hα-helixtrans-65-41.1177.5-174.2172.7-167.300111.9L234 L235 M240 D241 L242L234-E238 PolarHBondContact O-N 3.2Å; L235-E238 PolarHBondContact O-N 3.11Å; E238-M240 VanDerWaalsContact C-N 3.31Å; E238-M240 PolarHBondContact O-N 3.31Å; E238-D241 PolarHBondContact O-N 3.32Å; E238-L242 HydrophobicContact CG-CD1 4.28Å; E238-L242 WeakPolarHBondContact O-CB 3.47Å; E238-L242 WeakPolarHBondContact O-CG 3.5Å; E238-L242 PolarHBondContact O-N 3.43Å
239E85.1Confident88.1Confident109 Ų109102 Ų10251%0.50952%0.524SS..Hα-helixtrans-58-44.3173.6-171.4-170169.500111.3L235 D241 L242 Q243L235-E239 WeakPolarHBondContact O-CB 3.47Å; L235-E239 PolarHBondContact O-N 3.27Å; E239-D241 PolarHBondContact O-N 2.9Å; E239-L242 PolarHBondContact O-N 2.87Å; E239-Q243 WeakPolarHBondContact O-CB 3.27Å; E239-Q243 VanDerWaalsContact O-CG 3.26Å; E239-Q243 WeakPolarHBondContact O-CG 3.08Å; E239-Q243 PolarHBondContact O-N 2.97Å; E239-Q243 PolarHBondContact OE1-NE2 2.98Å
240M91.2Very high88.4Confident115 Ų115104.8 Ų104.857%0.56753%0.529SS*.Hα-helixtrans-63.3-40.9178.1-118.3-178.259.900112.5K236 T237 E238 T244K236-M240 PolarHBondContact O-N 3.41Å; K236-M240 VanDerWaalsContact O-N 3.17Å; T237-M240 WeakPolarHBondContact O-CB 3.39Å; T237-M240 PolarHBondContact O-N 3.25Å; E238-M240 VanDerWaalsContact C-N 3.31Å; E238-M240 PolarHBondContact O-N 3.31Å; M240-T244 PolarHBondContact O-N 3.09Å; M240-T244 PolarHBondContact O-OG1 3.4Å
241D89.1Confident88.5Confident97 Ų97105.2 Ų105.252%0.51953%0.533SS..Hα-helixtrans-67-43.6177.8-76.7-16.1000111.3T237 E238 E239 T244 Q245T237-D241 PolarHBondContact O-N 2.86Å; E238-D241 PolarHBondContact O-N 3.32Å; E239-D241 PolarHBondContact O-N 2.9Å; D241-T244 WeakPolarHBondContact O-CB 3.25Å; D241-T244 PolarHBondContact O-N 3.32Å; D241-Q245 WeakPolarHBondContact O-CG 3.34Å; D241-Q245 PolarHBondContact O-N 3.11Å
242L89.1Confident89.2Confident90 Ų90104.9 Ų104.947%0.47153%0.531SS..Hα-helixtrans-63.5-43.2175.4-72.4173.9000111.9E238 E239 T244 Q245 V246E238-L242 HydrophobicContact CG-CD1 4.28Å; E238-L242 WeakPolarHBondContact O-CB 3.47Å; E238-L242 WeakPolarHBondContact O-CG 3.5Å; E238-L242 PolarHBondContact O-N 3.43Å; E239-L242 PolarHBondContact O-N 2.87Å; L242-T244 VanDerWaalsContact C-N 3.27Å; L242-T244 PolarHBondContact O-N 2.97Å; L242-Q245 PolarHBondContact O-N 2.95Å; L242-V246 WeakPolarHBondContact O-CG2 3.33Å; L242-V246 PolarHBondContact O-N 3.36Å
243Q88Confident89.7Confident106 Ų106109.3 Ų109.350%0.49554%0.535SS..Hα-helixtrans-58.8-41.4174.6-75.3178.312.800111.4E239 V246 V247E239-Q243 WeakPolarHBondContact O-CB 3.27Å; E239-Q243 VanDerWaalsContact O-CG 3.26Å; E239-Q243 WeakPolarHBondContact O-CG 3.08Å; E239-Q243 PolarHBondContact O-N 2.97Å; E239-Q243 PolarHBondContact OE1-NE2 2.98Å; Q243-V246 PolarHBondContact O-N 3Å; Q243-V247 WeakPolarHBondContact O-CG2 3.2Å; Q243-V247 PolarHBondContact O-N 3.23Å; Q243-V247 VanDerWaalsContact O-N 3.09Å
244T91.6Very high89.9Confident73 Ų73106.7 Ų106.745%0.44853%0.525SS..Hα-helixtrans-64.2-42.3176.8-58.50000111.8M240 D241 L242 V247 K248M240-T244 PolarHBondContact O-N 3.09Å; M240-T244 PolarHBondContact O-OG1 3.4Å; D241-T244 WeakPolarHBondContact O-CB 3.25Å; D241-T244 PolarHBondContact O-N 3.32Å; L242-T244 VanDerWaalsContact C-N 3.27Å; L242-T244 PolarHBondContact O-N 2.97Å; T244-V247 PolarHBondContact O-N 3.15Å; T244-K248 PolarHBondContact O-N 3.45Å
245Q90Very high90.1Very high109 Ų109105.6 Ų105.651%0.50952%0.519SS..Hα-helixtrans-64.6-42.7176.2-71178.949.300112.1D241 L242 V247 K248 L249D241-Q245 WeakPolarHBondContact O-CG 3.34Å; D241-Q245 PolarHBondContact O-N 3.11Å; L242-Q245 PolarHBondContact O-N 2.95Å; Q245-V247 VanDerWaalsContact C-N 3.28Å; Q245-V247 PolarHBondContact O-N 3.17Å; Q245-K248 PolarHBondContact O-N 3.41Å; Q245-L249 WeakPolarHBondContact O-CG 3.43Å; Q245-L249 PolarHBondContact O-N 3.15Å
246V88.9Confident90.2Very high70 Ų70104.6 Ų104.642%0.42451%0.514SS..Hα-helixtrans-60.6-38.2176.6168.60000111.6L242 Q243 K250L242-V246 WeakPolarHBondContact O-CG2 3.33Å; L242-V246 PolarHBondContact O-N 3.36Å; Q243-V246 PolarHBondContact O-N 3Å; V246-K250 HydrophobicContact CG1-CD 4.18Å; V246-K250 WeakPolarHBondContact O-CB 3.36Å; V246-K250 VanDerWaalsContact O-CG 3.29Å; V246-K250 WeakPolarHBondContact O-CG 3.44Å; V246-K250 PolarHBondContact O-N 3.42Å
247V92.4Very high90.3Very high91 Ų91105 Ų10555%0.55252%0.515SS*.Hα-helixtrans-63.9-46.1175.71710000111Q243 T244 Q245 K250 E251Q243-V247 WeakPolarHBondContact O-CG2 3.2Å; Q243-V247 PolarHBondContact O-N 3.23Å; Q243-V247 VanDerWaalsContact O-N 3.09Å; T244-V247 PolarHBondContact O-N 3.15Å; Q245-V247 VanDerWaalsContact C-N 3.28Å; Q245-V247 PolarHBondContact O-N 3.17Å; V247-K250 PolarHBondContact O-N 3.42Å; V247-E251 PolarHBondContact O-N 2.99Å; V247-E251 VanDerWaalsContact O-N 3.15Å
248K91.2Very high90.4Very high129 Ų129106.6 Ų106.656%0.56152%0.518SS*.Hα-helixtrans-60.1-47.7177.2-70.5178.9179.5178.70112.3T244 Q245 K250 E251 E252T244-K248 PolarHBondContact O-N 3.45Å; Q245-K248 PolarHBondContact O-N 3.41Å; K248-K250 VanDerWaalsContact C-N 3.29Å; K248-K250 PolarHBondContact O-N 3.38Å; K248-E251 WeakPolarHBondContact O-CB 3.49Å; K248-E251 PolarHBondContact O-N 2.96Å; K248-E251 VanDerWaalsContact O-N 3.08Å; K248-E252 PolarHBondContact O-N 3.41Å
249L90.6Very high90.6Very high105 Ų105102.9 Ų102.955%0.5551%0.507SS..Hα-helixtrans-62.5-35.7178.5-70.6172.8000112.5Q245 E251 R253Q245-L249 WeakPolarHBondContact O-CG 3.43Å; Q245-L249 PolarHBondContact O-N 3.15Å; L249-E251 VanDerWaalsContact C-N 3.32Å; L249-R253 VanDerWaalsContact O-CB 3.28Å; L249-R253 WeakPolarHBondContact O-CB 3.48Å; L249-R253 PolarHBondContact O-N 2.88Å
250K91.9Very high90.8Very high117 Ų117100.4 Ų100.451%0.50951%0.505SS..Hα-helixtrans-64.3-37.8174.4-79.4173.5-179.61740112.1V246 V247 K248 N254V246-K250 HydrophobicContact CG1-CD 4.18Å; V246-K250 WeakPolarHBondContact O-CB 3.36Å; V246-K250 VanDerWaalsContact O-CG 3.29Å; V246-K250 WeakPolarHBondContact O-CG 3.44Å; V246-K250 PolarHBondContact O-N 3.42Å; V247-K250 PolarHBondContact O-N 3.42Å; K248-K250 VanDerWaalsContact C-N 3.29Å; K248-K250 PolarHBondContact O-N 3.38Å; K250-N254 PolarHBondContact O-N 3.33Å; K250-N254 PolarHBondContact O-ND2 3.02Å; K250-N254 PolarHBondContact O-OD1 2.9Å
251E92.9Very high90.9Very high126 Ų126100.2 Ų100.259%0.58950%0.503SS*.Hα-helixtrans-68.6-48.1176.9-172165.5-171.500111.3V247 K248 L249 R253 N254 I255V247-E251 PolarHBondContact O-N 2.99Å; V247-E251 VanDerWaalsContact O-N 3.15Å; K248-E251 WeakPolarHBondContact O-CB 3.49Å; K248-E251 PolarHBondContact O-N 2.96Å; K248-E251 VanDerWaalsContact O-N 3.08Å; L249-E251 VanDerWaalsContact C-N 3.32Å; E251-R253 VanDerWaalsContact C-N 3.34Å; E251-R253 PolarHBondContact O-N 2.9Å; E251-N254 WeakPolarHBondContact O-CB 3.47Å; E251-N254 PolarHBondContact O-N 3.43Å; E251-I255 HydrophobicContact CG-CD1 4.38Å; E251-I255 WeakPolarHBondContact O-CG1 3.07Å; E251-I255 PolarHBondContact O-N 2.99Å
252E93.3Very high91Very high108 Ų108102.1 Ų102.151%0.50550%0.503SS..Hα-helixtrans-57.7-44.5175.1-71.6171.8-174.300112.1K248 N254 I255 L256K248-E252 PolarHBondContact O-N 3.41Å; E252-N254 VanDerWaalsContact C-N 3.28Å; E252-N254 PolarHBondContact O-N 3.33Å; E252-I255 PolarHBondContact O-N 3.48Å; E252-L256 WeakPolarHBondContact O-CG 3.36Å; E252-L256 PolarHBondContact O-N 3.25Å
253R92Very high91.1Very high152 Ų152100.7 Ų100.757%0.57450%0.504SS*.Hα-helixtrans-57.8-40.3174.6-174.1-152.868.3177.8-0.5112L249 E251 K257L249-R253 VanDerWaalsContact O-CB 3.28Å; L249-R253 WeakPolarHBondContact O-CB 3.48Å; L249-R253 PolarHBondContact O-N 2.88Å; E251-R253 VanDerWaalsContact C-N 3.34Å; E251-R253 PolarHBondContact O-N 2.9Å; R253-K257 WeakPolarHBondContact O-CB 3.49Å; R253-K257 PolarHBondContact O-N 3.34Å
254N91.4Very high91.2Very high70 Ų7099.9 Ų99.937%0.37450%0.5SS..Hα-helixtrans-68-42.3178.7-69.4-18.3000111.2K250 E251 E252 L256 K257 E258K250-N254 PolarHBondContact O-N 3.33Å; K250-N254 PolarHBondContact O-ND2 3.02Å; K250-N254 PolarHBondContact O-OD1 2.9Å; E251-N254 WeakPolarHBondContact O-CB 3.47Å; E251-N254 PolarHBondContact O-N 3.43Å; E252-N254 VanDerWaalsContact C-N 3.28Å; E252-N254 PolarHBondContact O-N 3.33Å; N254-L256 VanDerWaalsContact C-N 3.34Å; N254-L256 PolarHBondContact O-N 2.92Å; N254-K257 PolarHBondContact O-N 3.07Å; N254-E258 WeakPolarHBondContact O-CG 3.45Å; N254-E258 PolarHBondContact O-N 3.42Å
255I91.5Very high91.2Very high93 Ų93100.3 Ų100.348%0.47750%0.5SS..Hα-helixtrans-58.7-45.9175.6-66.1167.3000110.8E251 E252 E258 A259E251-I255 HydrophobicContact CG-CD1 4.38Å; E251-I255 WeakPolarHBondContact O-CG1 3.07Å; E251-I255 PolarHBondContact O-N 2.99Å; E252-I255 PolarHBondContact O-N 3.48Å; I255-E258 PolarHBondContact O-N 3.02Å; I255-A259 WeakPolarHBondContact O-CB 3.35Å; I255-A259 PolarHBondContact O-N 3.22Å
256L88.3Confident91.4Very high93 Ų9398.5 Ų98.549%0.48750%0.496SS..Hα-helixtrans-64.8-39.8177.9-72174.8000112.3E252 N254 E258 A259 A260E252-L256 WeakPolarHBondContact O-CG 3.36Å; E252-L256 PolarHBondContact O-N 3.25Å; N254-L256 VanDerWaalsContact C-N 3.34Å; N254-L256 PolarHBondContact O-N 2.92Å; L256-E258 VanDerWaalsContact C-N 3.33Å; L256-E258 PolarHBondContact O-N 3.45Å; L256-A259 PolarHBondContact O-N 2.97Å; L256-A260 WeakPolarHBondContact O-CB 3.48Å; L256-A260 PolarHBondContact O-N 2.91Å
257K91.9Very high91.5Very high155 Ų155100.1 Ų100.167%0.67450%0.498SS*.Hα-helixtrans-61.3-42.2176.1-172.9179179.1-178.20111.8R253 N254 Q261R253-K257 WeakPolarHBondContact O-CB 3.49Å; R253-K257 PolarHBondContact O-N 3.34Å; N254-K257 PolarHBondContact O-N 3.07Å; K257-Q261 PolarHBondContact O-N 3.08Å
258E92.5Very high91.5Very high114 Ų11498.1 Ų98.153%0.53349%0.49SS..Hα-helixtrans-67.3-38.8175.1-69.3179-175.200112.3N254 I255 L256 Q261 R262N254-E258 WeakPolarHBondContact O-CG 3.45Å; N254-E258 PolarHBondContact O-N 3.42Å; I255-E258 PolarHBondContact O-N 3.02Å; L256-E258 VanDerWaalsContact C-N 3.33Å; L256-E258 PolarHBondContact O-N 3.45Å; E258-Q261 PolarHBondContact O-N 2.93Å; E258-R262 WeakPolarHBondContact O-CG 3.43Å; E258-R262 PolarHBondContact O-N 3.39Å; E258-R262 IonicContact OE2-NH1 3.86Å
259A91Very high91.5Very high38 Ų3897.7 Ų97.731%0.31449%0.49SS..Hα-helixtrans-63-43.7175.500000112I255 L256 Q261 R262 A263I255-A259 WeakPolarHBondContact O-CB 3.35Å; I255-A259 PolarHBondContact O-N 3.22Å; L256-A259 PolarHBondContact O-N 2.97Å; A259-Q261 VanDerWaalsContact C-N 3.34Å; A259-Q261 PolarHBondContact O-N 2.76Å; A259-R262 PolarHBondContact O-N 3.2Å; A259-A263 PolarHBondContact O-N 3.49Å
260A89.2Confident91.5Very high58 Ų5897 Ų9748%0.47949%0.487SS..Hα-helixtrans-61.2-42.3174.900000111.7L256 R262 A263 E264L256-A260 WeakPolarHBondContact O-CB 3.48Å; L256-A260 PolarHBondContact O-N 2.91Å; A260-R262 PolarHBondContact O-N 3.16Å; A260-A263 PolarHBondContact O-N 3Å; A260-E264 PolarHBondContact O-N 3.01Å
261Q92.3Very high91.6Very high111 Ų11197.3 Ų97.352%0.51949%0.485SS..Hα-helixtrans-63-42176.1-17360.851.500112.1K257 E258 A259 A263 E264 N265K257-Q261 PolarHBondContact O-N 3.08Å; E258-Q261 PolarHBondContact O-N 2.93Å; A259-Q261 VanDerWaalsContact C-N 3.34Å; A259-Q261 PolarHBondContact O-N 2.76Å; Q261-A263 VanDerWaalsContact C-N 3.34Å; Q261-A263 PolarHBondContact O-N 3.28Å; Q261-E264 PolarHBondContact O-N 3.25Å; Q261-N265 PolarHBondContact NE2-OD1 2.84Å; Q261-N265 VanDerWaalsContact O-CG 3.25Å; Q261-N265 PolarHBondContact O-N 2.97Å; Q261-N265 PolarHBondContact O-OD1 3.41Å
262R91.1Very high91.6Very high136 Ų13694.7 Ų94.751%0.51348%0.475SS..Hα-helixtrans-60.8-43.2174.5-73.5-172.5-65.8-94.31.9111.6E258 A259 A260 N265 T266E258-R262 WeakPolarHBondContact O-CG 3.43Å; E258-R262 PolarHBondContact O-N 3.39Å; E258-R262 IonicContact OE2-NH1 3.86Å; A259-R262 PolarHBondContact O-N 3.2Å; A260-R262 PolarHBondContact O-N 3.16Å; R262-N265 PolarHBondContact O-N 3.47Å; R262-T266 PolarHBondContact O-N 3.26Å; R262-T266 PolarHBondContact O-OG1 2.76Å
263A90.6Very high91.6Very high60 Ų6094.9 Ų94.950%0.49648%0.477SS..Hα-helixtrans-62.7-42.8178.500000112.5A259 A260 Q261 T266 K267A259-A263 PolarHBondContact O-N 3.49Å; A260-A263 PolarHBondContact O-N 3Å; Q261-A263 VanDerWaalsContact C-N 3.34Å; Q261-A263 PolarHBondContact O-N 3.28Å; A263-T266 PolarHBondContact O-N 2.67Å; A263-K267 WeakPolarHBondContact O-CB 3.45Å; A263-K267 PolarHBondContact O-N 3.11Å
264E90.3Very high91.5Very high89 Ų8992.6 Ų92.642%0.41647%0.473SS..Hα-helixtrans-65.6-36.8175.9-82.1-62.7139.700112.5A260 Q261 K267 A268A260-E264 PolarHBondContact O-N 3.01Å; Q261-E264 PolarHBondContact O-N 3.25Å; E264-K267 PolarHBondContact O-N 3.47Å; E264-K267 IonicContact OE1-NZ 2.9Å; E264-K267 PolarHBondContact OE1-NZ 3.07Å; E264-K267 IonicContact OE2-NZ 3.7Å; E264-A268 PolarHBondContact O-N 2.79Å
265N92.9Very high91.6Very high82 Ų8295.6 Ų95.644%0.43949%0.485SS..Hα-helixtrans-63.2-48.2173.5-67.7-7000111.3Q261 R262 K267 A268 E269Q261-N265 PolarHBondContact NE2-OD1 2.84Å; Q261-N265 VanDerWaalsContact O-CG 3.25Å; Q261-N265 PolarHBondContact O-N 2.97Å; Q261-N265 PolarHBondContact O-OD1 3.41Å; R262-N265 PolarHBondContact O-N 3.47Å; N265-K267 VanDerWaalsContact C-N 3.29Å; N265-K267 PolarHBondContact O-N 2.85Å; N265-A268 WeakPolarHBondContact O-CB 3.41Å; N265-A268 PolarHBondContact O-N 2.86Å; N265-E269 PolarHBondContact O-N 3.17Å
266T92.7Very high91.6Very high71 Ų7196.9 Ų96.944%0.43649%0.487SS..Hα-helixtrans-61.3-37.8176.7-59.10000112R262 A263 A268 E269 L270R262-T266 PolarHBondContact O-N 3.26Å; R262-T266 PolarHBondContact O-OG1 2.76Å; A263-T266 PolarHBondContact O-N 2.67Å; T266-A268 VanDerWaalsContact C-N 3.31Å; T266-A268 PolarHBondContact O-N 2.63Å; T266-E269 PolarHBondContact O-N 3.02Å; T266-L270 HydrophobicContact CG2-CD1 4.21Å; T266-L270 WeakPolarHBondContact O-CB 3.44Å; T266-L270 WeakPolarHBondContact O-CG 3.4Å; T266-L270 PolarHBondContact O-N 3.43Å
267K91.6Very high91.8Very high105 Ų10597.7 Ų97.746%0.45749%0.486SS..Hα-helixtrans-65.2-32.9174.5179.4-177.9168.9-169.10112.6A263 E264 N265 R271A263-K267 WeakPolarHBondContact O-CB 3.45Å; A263-K267 PolarHBondContact O-N 3.11Å; E264-K267 PolarHBondContact O-N 3.47Å; E264-K267 IonicContact OE1-NZ 2.9Å; E264-K267 PolarHBondContact OE1-NZ 3.07Å; E264-K267 IonicContact OE2-NZ 3.7Å; N265-K267 VanDerWaalsContact C-N 3.29Å; N265-K267 PolarHBondContact O-N 2.85Å; K267-R271 WeakPolarHBondContact O-CG 3.33Å; K267-R271 PolarHBondContact O-N 3.12Å; K267-R271 PolarHBondContact O-NE 2.87Å
268A91.6Very high91.8Very high48 Ų4895.9 Ų95.940%0.39748%0.48SS..Hα-helixtrans-69.4-43.617300000111.4E264 N265 T266 L270 R271 D272E264-A268 PolarHBondContact O-N 2.79Å; N265-A268 WeakPolarHBondContact O-CB 3.41Å; N265-A268 PolarHBondContact O-N 2.86Å; T266-A268 VanDerWaalsContact C-N 3.31Å; T266-A268 PolarHBondContact O-N 2.63Å; A268-L270 PolarHBondContact O-N 3.43Å; A268-R271 PolarHBondContact O-N 3.43Å; A268-D272 PolarHBondContact O-N 3.3Å; A268-D272 VanDerWaalsContact O-N 3.09Å
269E92.3Very high91.9Very high121 Ų12193.5 Ų93.557%0.56548%0.48SS*.Hα-helixtrans-61-42.2175.4-68.5170.8175.400112.2N265 T266 R271 D272 M273N265-E269 PolarHBondContact O-N 3.17Å; T266-E269 PolarHBondContact O-N 3.02Å; E269-R271 VanDerWaalsContact C-N 3.33Å; E269-R271 PolarHBondContact O-N 3.45Å; E269-D272 PolarHBondContact O-N 3.17Å; E269-M273 WeakPolarHBondContact O-CG 3.39Å; E269-M273 PolarHBondContact O-N 3.15Å
270L91.3Very high92Very high90 Ų9094.9 Ų94.947%0.47148%0.484SS..Hα-helixtrans-61.5-40.7175.5-76.3167.4000112.1T266 A268 M273 E274T266-L270 HydrophobicContact CG2-CD1 4.21Å; T266-L270 WeakPolarHBondContact O-CB 3.44Å; T266-L270 WeakPolarHBondContact O-CG 3.4Å; T266-L270 PolarHBondContact O-N 3.43Å; A268-L270 PolarHBondContact O-N 3.43Å; L270-M273 HydrophobicContact CD2-CE 3.75Å; L270-M273 HydrophobicContact CG-CE 4.32Å; L270-M273 PolarHBondContact O-N 2.91Å; L270-E274 WeakPolarHBondContact O-CG 3.34Å; L270-E274 PolarHBondContact O-N 2.85Å
271R92.3Very high92Very high124 Ų12495.7 Ų95.747%0.46848%0.48SS..Hα-helixtrans-62.6-45.3175.8-79.9-177-83.5173.8-6.4112.1K267 A268 E269 M273 E274 E275K267-R271 WeakPolarHBondContact O-CG 3.33Å; K267-R271 PolarHBondContact O-N 3.12Å; K267-R271 PolarHBondContact O-NE 2.87Å; A268-R271 PolarHBondContact O-N 3.43Å; E269-R271 VanDerWaalsContact C-N 3.33Å; E269-R271 PolarHBondContact O-N 3.45Å; R271-M273 VanDerWaalsContact C-N 3.34Å; R271-M273 PolarHBondContact O-N 3.26Å; R271-E274 PolarHBondContact O-N 2.83Å; R271-E275 WeakPolarHBondContact O-CG 3.44Å; R271-E275 PolarHBondContact O-N 3.43Å
272D92.8Very high92Very high71 Ų7192.5 Ų92.538%0.3847%0.473SS..Hα-helixtrans-62-40.7176176.863000111.9A268 E269 E275 K276A268-D272 PolarHBondContact O-N 3.3Å; A268-D272 VanDerWaalsContact O-N 3.09Å; E269-D272 PolarHBondContact O-N 3.17Å; D272-E275 PolarHBondContact O-N 2.96Å; D272-K276 WeakPolarHBondContact O-CG 3.29Å; D272-K276 PolarHBondContact O-N 3.38Å; D272-K276 IonicContact OD1-NZ 2.94Å; D272-K276 VanDerWaalsContact OD2-CE 3.3Å; D272-K276 WeakPolarHBondContact OD2-CE 3.37Å; D272-K276 IonicContact OD2-NZ 3.9Å; D272-K276 PolarHBondContact OD2-NZ 2.9Å
273M93.4Very high92.2Very high111 Ų11191.4 Ų91.455%0.54747%0.468SS..Hα-helixtrans-64.7-40.3174.2-73.6-167.6-70.200112.5E269 L270 R271 K276 K277E269-M273 WeakPolarHBondContact O-CG 3.39Å; E269-M273 PolarHBondContact O-N 3.15Å; L270-M273 HydrophobicContact CD2-CE 3.75Å; L270-M273 HydrophobicContact CG-CE 4.32Å; L270-M273 PolarHBondContact O-N 2.91Å; R271-M273 VanDerWaalsContact C-N 3.34Å; R271-M273 PolarHBondContact O-N 3.26Å; M273-K276 PolarHBondContact O-N 3.01Å; M273-K277 WeakPolarHBondContact O-CB 3.49Å; M273-K277 PolarHBondContact O-N 3.47Å
274E90.3Very high92.2Very high104 Ų10490 Ų9049%0.48645%0.453SS..Hα-helixtrans-63-44.3174.5-77.7-175.115700111.7L270 R271 K277 H278L270-E274 WeakPolarHBondContact O-CG 3.34Å; L270-E274 PolarHBondContact O-N 2.85Å; R271-E274 PolarHBondContact O-N 2.83Å; E274-K277 WeakPolarHBondContact O-CB 3.49Å; E274-K277 PolarHBondContact O-N 2.86Å; E274-H278 PolarHBondContact O-N 3.31Å; E274-H278 PolarHBondContact O-ND1 2.95Å
275E93.2Very high92.3Very high134 Ų13490.9 Ų90.963%0.62646%0.457SS*.Hα-helixtrans-60-46.7176.3-74.3177-16900111.5R271 D272 K277 H278 A279R271-E275 WeakPolarHBondContact O-CG 3.44Å; R271-E275 PolarHBondContact O-N 3.43Å; D272-E275 PolarHBondContact O-N 2.96Å; E275-K277 VanDerWaalsContact C-N 3.31Å; E275-K277 PolarHBondContact O-N 3.44Å; E275-H278 PolarHBondContact O-N 3.32Å; E275-A279 PolarHBondContact O-N 3.47Å
276K93Very high92.4Very high120 Ų12091.2 Ų91.252%0.52246%0.458SS..Hα-helixtrans-59.7-39.7174.8-75.6170179.4162.40112.7D272 M273 T280D272-K276 WeakPolarHBondContact O-CG 3.29Å; D272-K276 PolarHBondContact O-N 3.38Å; D272-K276 IonicContact OD1-NZ 2.94Å; D272-K276 VanDerWaalsContact OD2-CE 3.3Å; D272-K276 WeakPolarHBondContact OD2-CE 3.37Å; D272-K276 IonicContact OD2-NZ 3.9Å; D272-K276 PolarHBondContact OD2-NZ 2.9Å; M273-K276 PolarHBondContact O-N 3.01Å; K276-T280 WeakPolarHBondContact O-CB 3.48Å; K276-T280 PolarHBondContact O-N 3.01Å; K276-T280 PolarHBondContact O-OG1 3.23Å
277K92.6Very high92.4Very high110 Ų11092.1 Ų92.148%0.47846%0.458SS..Hα-helixtrans-61.9-49.1175.1-176.6-171.871.8-175.30110.9M273 E274 E275 A279 T280 I281M273-K277 WeakPolarHBondContact O-CB 3.49Å; M273-K277 PolarHBondContact O-N 3.47Å; E274-K277 WeakPolarHBondContact O-CB 3.49Å; E274-K277 PolarHBondContact O-N 2.86Å; E275-K277 VanDerWaalsContact C-N 3.31Å; E275-K277 PolarHBondContact O-N 3.44Å; K277-A279 PolarHBondContact O-N 3.31Å; K277-T280 PolarHBondContact O-N 2.97Å; K277-I281 HydrophobicContact CG-CD1 4.07Å; K277-I281 WeakPolarHBondContact O-CG1 3.43Å; K277-I281 PolarHBondContact O-N 3.42Å
278H91.6Very high92.3Very high117 Ų11792.4 Ų92.454%0.54246%0.463SS..Hα-helixtrans-61.7-43178.9-73.784.5000111.9E274 E275 T280 I281 A282E274-H278 PolarHBondContact O-N 3.31Å; E274-H278 PolarHBondContact O-ND1 2.95Å; E275-H278 PolarHBondContact O-N 3.32Å; H278-T280 VanDerWaalsContact C-N 3.3Å; H278-T280 PolarHBondContact O-N 3.31Å; H278-I281 PolarHBondContact O-N 3.48Å; H278-A282 PolarHBondContact O-N 2.88Å
279A94.1Very high92.3Very high64 Ų6497.3 Ų97.353%0.52947%0.471SS..Hα-helixtrans-60.8-39.8175.200000112.2E275 K277 R283E275-A279 PolarHBondContact O-N 3.47Å; K277-A279 PolarHBondContact O-N 3.31Å; A279-R283 PolarHBondContact O-N 3.33Å; A279-R283 VanDerWaalsContact O-N 3.08Å
280T92.7Very high92.3Very high66 Ų6695.1 Ų95.141%0.40547%0.469SS..Hα-helixtrans-66.6-43.9177.2-59.30000111.8K276 K277 H278 R283 L284K276-T280 WeakPolarHBondContact O-CB 3.48Å; K276-T280 PolarHBondContact O-N 3.01Å; K276-T280 PolarHBondContact O-OG1 3.23Å; K277-T280 PolarHBondContact O-N 2.97Å; H278-T280 VanDerWaalsContact C-N 3.3Å; H278-T280 PolarHBondContact O-N 3.31Å; T280-R283 PolarHBondContact O-N 3.47Å; T280-L284 HydrophobicContact CG2-CD1 4.29Å; T280-L284 WeakPolarHBondContact O-CG 3.45Å; T280-L284 PolarHBondContact O-N 2.94Å
281I89.6Confident92.2Very high76 Ų7693.2 Ų93.239%0.3947%0.466SS..Hα-helixtrans-59-49.7175.8-70.1168.7000110K277 H278 R283 L284 E285K277-I281 HydrophobicContact CG-CD1 4.07Å; K277-I281 WeakPolarHBondContact O-CG1 3.43Å; K277-I281 PolarHBondContact O-N 3.42Å; H278-I281 PolarHBondContact O-N 3.48Å; I281-R283 VanDerWaalsContact C-N 3.28Å; I281-R283 PolarHBondContact O-N 2.82Å; I281-L284 PolarHBondContact O-N 2.76Å; I281-E285 HydrophobicContact CG2-CG 4.26Å; I281-E285 WeakPolarHBondContact O-CG 3.43Å; I281-E285 PolarHBondContact O-N 3.44Å
282A92.5Very high91.9Very high44 Ų4490.5 Ų90.536%0.36447%0.466SS..Hα-helixtrans-58.7-38.9179.200000112.7H278 N286H278-A282 PolarHBondContact O-N 2.88Å; A282-N286 PolarHBondContact O-N 3.22Å; A282-N286 VanDerWaalsContact O-N 3.14Å; A282-N286 PolarHBondContact O-ND2 2.85Å
283R95.1Very high91.9Very high113 Ų11391.1 Ų91.143%0.42648%0.476SS..Hα-helixtrans-62.6-47.3173.9-174.8-175.460.274.49.3111.5A279 T280 I281 N286 E287A279-R283 PolarHBondContact O-N 3.33Å; A279-R283 VanDerWaalsContact O-N 3.08Å; T280-R283 PolarHBondContact O-N 3.47Å; I281-R283 VanDerWaalsContact C-N 3.28Å; I281-R283 PolarHBondContact O-N 2.82Å; R283-N286 PolarHBondContact O-N 3.42Å; R283-E287 IonicContact CZ-OE1 3.73Å; R283-E287 IonicContact NH1-OE1 2.66Å; R283-E287 PolarHBondContact NH1-OE1 3.5Å; R283-E287 IonicContact NH1-OE2 3.73Å; R283-E287 PolarHBondContact NH1-OE2 3.43Å; R283-E287 WeakPolarHBondContact O-CG 3.38Å; R283-E287 PolarHBondContact O-N 3.21Å
284L91.3Very high91.7Very high31 Ų3189.6 Ų89.616%0.16247%0.474CS..Hα-helixtrans-64.4-39.6179.7-69.5175.1000112.2W54 T280 I281 N286 E287 I288W54-L284 HydrophobicContact CH2-CD1 3.68Å; W54-L284 HydrophobicContact CH2-CD2 3.78Å; W54-L284 HydrophobicContact CH2-CG 4.35Å; W54-L284 HydrophobicContact CZ2-CD1 3.61Å; W54-L284 HydrophobicContact CZ2-CD2 3.97Å; W54-L284 HydrophobicContact CZ2-CG 4.46Å; T280-L284 HydrophobicContact CG2-CD1 4.29Å; T280-L284 WeakPolarHBondContact O-CG 3.45Å; T280-L284 PolarHBondContact O-N 2.94Å; I281-L284 PolarHBondContact O-N 2.76Å; L284-N286 VanDerWaalsContact C-N 3.32Å; L284-N286 PolarHBondContact O-N 3.26Å; L284-E287 PolarHBondContact O-N 2.84Å; L284-I288 VanDerWaalsContact O-CG1 3.31Å; L284-I288 WeakPolarHBondContact O-CG1 3.32Å; L284-I288 PolarHBondContact O-N 2.99Å
285E91.4Very high91.4Very high107 Ų10789.7 Ų89.750%0.548%0.476SS..Hα-helixtrans-61.2-40.8175-72.6177.3163.600112I281 I288 R289I281-E285 HydrophobicContact CG2-CG 4.26Å; I281-E285 WeakPolarHBondContact O-CG 3.43Å; I281-E285 PolarHBondContact O-N 3.44Å; E285-I288 PolarHBondContact O-N 2.93Å; E285-R289 WeakPolarHBondContact O-CB 3.49Å; E285-R289 PolarHBondContact O-N 3.46Å
286N94.2Very high91.2Very high88 Ų8888.9 Ų88.947%0.47147%0.472SS..Hα-helixtrans-65.4-41.2174.7-75.4-26.5000111.9A282 R283 L284 R289 S290A282-N286 PolarHBondContact O-N 3.22Å; A282-N286 VanDerWaalsContact O-N 3.14Å; A282-N286 PolarHBondContact O-ND2 2.85Å; R283-N286 PolarHBondContact O-N 3.42Å; L284-N286 VanDerWaalsContact C-N 3.32Å; L284-N286 PolarHBondContact O-N 3.26Å; N286-R289 PolarHBondContact O-N 3.18Å; N286-R289 PolarHBondContact OD1-NH1 3.29Å; N286-S290 PolarHBondContact O-N 2.96Å
287E92.9Very high90.9Very high91 Ų9185.7 Ų85.743%0.42547%0.468SS..Hα-helixtrans-61.9-45.6175.2-75.3171.7-174.100111.7R283 L284 R289 S290 A291R283-E287 IonicContact CZ-OE1 3.73Å; R283-E287 IonicContact NH1-OE1 2.66Å; R283-E287 PolarHBondContact NH1-OE1 3.5Å; R283-E287 IonicContact NH1-OE2 3.73Å; R283-E287 PolarHBondContact NH1-OE2 3.43Å; R283-E287 WeakPolarHBondContact O-CG 3.38Å; R283-E287 PolarHBondContact O-N 3.21Å; L284-E287 PolarHBondContact O-N 2.84Å; E287-R289 VanDerWaalsContact C-N 3.34Å; E287-R289 PolarHBondContact O-N 3.02Å; E287-S290 PolarHBondContact O-N 2.87Å; E287-A291 WeakPolarHBondContact O-CB 3.38Å; E287-A291 PolarHBondContact O-N 3.28Å
288I89.7Confident90.5Very high110 Ų11085 Ų8556%0.56447%0.469SS*.Hα-helixtrans-60.7-44175.9-71167.2000110.8L284 E285 S290 A291 S292L284-I288 VanDerWaalsContact O-CG1 3.31Å; L284-I288 WeakPolarHBondContact O-CG1 3.32Å; L284-I288 PolarHBondContact O-N 2.99Å; E285-I288 PolarHBondContact O-N 2.93Å; I288-S290 VanDerWaalsContact C-N 3.34Å; I288-S290 PolarHBondContact O-N 3.33Å; I288-A291 PolarHBondContact O-N 2.97Å; I288-S292 WeakPolarHBondContact O-CB 3.44Å; I288-S292 PolarHBondContact O-N 3.07Å; I288-S292 PolarHBondContact O-OG 2.87Å
289R92.1Very high90Very high151 Ų15182.5 Ų82.557%0.5746%0.464SS*.Hα-helixtrans-61.9-43.1178.1-165.1-174-56127.98.8111.4E285 N286 E287 S292 S293E285-R289 WeakPolarHBondContact O-CB 3.49Å; E285-R289 PolarHBondContact O-N 3.46Å; N286-R289 PolarHBondContact O-N 3.18Å; N286-R289 PolarHBondContact OD1-NH1 3.29Å; E287-R289 VanDerWaalsContact C-N 3.34Å; E287-R289 PolarHBondContact O-N 3.02Å; R289-S292 PolarHBondContact O-N 3Å; R289-S293 PolarHBondContact O-N 3.5Å; R289-S293 VanDerWaalsContact O-N 3.11Å
290S92.6Very high89.8Confident76 Ų7682.7 Ų82.753%0.53145%0.454SS..Hα-helixtrans-62.4-48.2175.4-169.50000111.5N286 E287 I288 S292 S293 T294N286-S290 PolarHBondContact O-N 2.96Å; E287-S290 PolarHBondContact O-N 2.87Å; I288-S290 VanDerWaalsContact C-N 3.34Å; I288-S290 PolarHBondContact O-N 3.33Å; S290-S292 VanDerWaalsContact C-N 3.32Å; S290-S292 PolarHBondContact O-N 3.23Å; S290-S293 WeakPolarHBondContact O-CB 3.49Å; S290-S293 PolarHBondContact O-N 3.12Å; S290-S293 VanDerWaalsContact O-N 3.17Å; S290-T294 PolarHBondContact O-N 3.42Å; S290-T294 PolarHBondContact O-OG1 3.48Å
291A88Confident89.5Confident49 Ų4984.4 Ų84.441%0.40546%0.46SS..Hα-helixtrans-61.2-4117900000112E287 I288 S293 T294 I295E287-A291 WeakPolarHBondContact O-CB 3.38Å; E287-A291 PolarHBondContact O-N 3.28Å; I288-A291 PolarHBondContact O-N 2.97Å; A291-S293 VanDerWaalsContact C-N 3.31Å; A291-S293 PolarHBondContact O-N 3.08Å; A291-T294 PolarHBondContact O-N 3.36Å; A291-I295 WeakPolarHBondContact O-CG1 3.43Å; A291-I295 PolarHBondContact O-N 2.85Å
292S87.6Confident89.1Confident67 Ų6784.3 Ų84.347%0.46946%0.463SS..Hα-helixtrans-61.8-39.6176.2-57.80000111.9I288 R289 S290 I295 H296I288-S292 WeakPolarHBondContact O-CB 3.44Å; I288-S292 PolarHBondContact O-N 3.07Å; I288-S292 PolarHBondContact O-OG 2.87Å; R289-S292 PolarHBondContact O-N 3Å; S290-S292 VanDerWaalsContact C-N 3.32Å; S290-S292 PolarHBondContact O-N 3.23Å; S292-I295 PolarHBondContact O-N 2.85Å; S292-H296 WeakPolarHBondContact O-CB 3.36Å; S292-H296 PolarHBondContact O-N 3.42Å
293S92Very high88.8Confident85 Ų8588.1 Ų88.159%0.59447%0.471SS*.Hα-helixtrans-63.4-44.3174.4-171.20000111.8R289 S290 A291 H296 A297R289-S293 PolarHBondContact O-N 3.5Å; R289-S293 VanDerWaalsContact O-N 3.11Å; S290-S293 WeakPolarHBondContact O-CB 3.49Å; S290-S293 PolarHBondContact O-N 3.12Å; S290-S293 VanDerWaalsContact O-N 3.17Å; A291-S293 VanDerWaalsContact C-N 3.31Å; A291-S293 PolarHBondContact O-N 3.08Å; S293-H296 PolarHBondContact O-N 2.91Å; S293-A297 PolarHBondContact O-N 3.29Å
294T89.9Confident88.4Confident79 Ų7988.5 Ų88.549%0.48548%0.478SS..Hα-helixtrans-61.9-45.1175.8-56.10000112S290 A291 H296 A297 L298S290-T294 PolarHBondContact O-N 3.42Å; S290-T294 PolarHBondContact O-OG1 3.48Å; A291-T294 PolarHBondContact O-N 3.36Å; T294-H296 VanDerWaalsContact C-N 3.29Å; T294-H296 PolarHBondContact O-N 3.32Å; T294-A297 PolarHBondContact O-N 3.11Å; T294-L298 HydrophobicContact CG2-CD1 4.34Å; T294-L298 WeakPolarHBondContact O-CG 3.35Å; T294-L298 PolarHBondContact O-N 2.86Å
295I84.4Confident88.2Confident105 Ų10594.5 Ų94.554%0.53850%0.498SS..Hα-helixtrans-58.9-43.9175.9-70.3167.6000110.3A291 S292 A297 L298 C299A291-I295 WeakPolarHBondContact O-CG1 3.43Å; A291-I295 PolarHBondContact O-N 2.85Å; S292-I295 PolarHBondContact O-N 2.85Å; I295-A297 PolarHBondContact O-N 3.26Å; I295-L298 PolarHBondContact O-N 3.2Å; I295-C299 PolarHBondContact O-N 2.86Å; I295-C299 PolarHBondContact O-SG 3.19Å; I295-C299 VanDerWaalsContact O-SG 3.36Å
296H87.3Confident87.7Confident118 Ų11892.8 Ų92.855%0.54649%0.492SS..Hα-helixtrans-61.1-44.3177.6-171.567.9000112.1S292 S293 T294 L298 C299 E300S292-H296 WeakPolarHBondContact O-CB 3.36Å; S292-H296 PolarHBondContact O-N 3.42Å; S293-H296 PolarHBondContact O-N 2.91Å; T294-H296 VanDerWaalsContact C-N 3.29Å; T294-H296 PolarHBondContact O-N 3.32Å; H296-L298 VanDerWaalsContact C-N 3.35Å; H296-L298 PolarHBondContact O-N 3.4Å; H296-C299 WeakPolarHBondContact O-CB 3.3Å; H296-C299 PolarHBondContact O-N 2.94Å; H296-E300 PolarHBondContact O-N 3.48Å; H296-E300 VanDerWaalsContact O-N 3.1Å
297A88.1Confident87.3Confident53 Ų5391.2 Ų91.244%0.43849%0.492SS..Hα-helixtrans-61.3-41.2175.900000112.5S293 T294 I295 E300 L301S293-A297 PolarHBondContact O-N 3.29Å; T294-A297 PolarHBondContact O-N 3.11Å; I295-A297 PolarHBondContact O-N 3.26Å; A297-E300 PolarHBondContact O-N 3.29Å; A297-L301 WeakPolarHBondContact O-CG 3.43Å; A297-L301 PolarHBondContact O-N 2.9Å
298L83.3Confident87Confident96 Ų9690.8 Ų90.850%0.50350%0.496SS..Hα-helixtrans-63.8-41.7175.2-72171.9000112T294 I295 H296 E300 L301 V302T294-L298 HydrophobicContact CG2-CD1 4.34Å; T294-L298 WeakPolarHBondContact O-CG 3.35Å; T294-L298 PolarHBondContact O-N 2.86Å; I295-L298 PolarHBondContact O-N 3.2Å; H296-L298 VanDerWaalsContact C-N 3.35Å; H296-L298 PolarHBondContact O-N 3.4Å; L298-E300 VanDerWaalsContact C-N 3.3Å; L298-E300 PolarHBondContact O-N 3.05Å; L298-L301 HydrophobicContact CD2-CD1 4.44Å; L298-L301 PolarHBondContact O-N 2.98Å; L298-V302 WeakPolarHBondContact O-CG2 3.43Å; L298-V302 PolarHBondContact O-N 3.44Å
299C82.3Confident86.5Confident63 Ų6389 Ų8943%0.42649%0.486SS..Hα-helixtrans-58.4-41.6174.7-74.20000112I295 H296 V302 K303I295-C299 PolarHBondContact O-N 2.86Å; I295-C299 PolarHBondContact O-SG 3.19Å; I295-C299 VanDerWaalsContact O-SG 3.36Å; H296-C299 WeakPolarHBondContact O-CB 3.3Å; H296-C299 PolarHBondContact O-N 2.94Å; C299-V302 PolarHBondContact O-N 3.01Å; C299-K303 WeakPolarHBondContact O-CG 3.46Å; C299-K303 PolarHBondContact O-N 3.32Å
300E88.6Confident86.1Confident68 Ų6887.8 Ų87.832%0.31849%0.487SS..Hα-helixtrans-66.8-39.5176.1-67.6-53.4125.400112.3H296 A297 L298 V302 K303 Q304H296-E300 PolarHBondContact O-N 3.48Å; H296-E300 VanDerWaalsContact O-N 3.1Å; A297-E300 PolarHBondContact O-N 3.29Å; L298-E300 VanDerWaalsContact C-N 3.3Å; L298-E300 PolarHBondContact O-N 3.05Å; E300-V302 PolarHBondContact O-N 2.98Å; E300-K303 PolarHBondContact O-N 3.44Å; E300-K303 IonicContact OE1-NZ 2.6Å; E300-K303 PolarHBondContact OE1-NZ 3.19Å; E300-K303 IonicContact OE2-NZ 2.83Å; E300-Q304 WeakPolarHBondContact O-CG 3.29Å; E300-Q304 PolarHBondContact O-N 3.42Å
301L87.7Confident85.6Confident102 Ų10287.5 Ų87.553%0.53449%0.485SS..Hα-helixtrans-62.4-41.5173.3-72.9171.4000112.2A297 L298 Q304 R305A297-L301 WeakPolarHBondContact O-CG 3.43Å; A297-L301 PolarHBondContact O-N 2.9Å; L298-L301 HydrophobicContact CD2-CD1 4.44Å; L298-L301 PolarHBondContact O-N 2.98Å; L301-Q304 PolarHBondContact O-N 2.9Å; L301-R305 WeakPolarHBondContact O-CB 3.4Å; L301-R305 PolarHBondContact O-N 3.33Å
302V80.8Confident85.2Confident74 Ų7489.6 Ų89.645%0.44849%0.49SS..Hα-helixtrans-63.1-42.8175.8170.40000111L298 C299 E300 Q304 R305 N306L298-V302 WeakPolarHBondContact O-CG2 3.43Å; L298-V302 PolarHBondContact O-N 3.44Å; C299-V302 PolarHBondContact O-N 3.01Å; E300-V302 PolarHBondContact O-N 2.98Å; V302-Q304 VanDerWaalsContact C-N 3.35Å; V302-Q304 PolarHBondContact O-N 3.42Å; V302-R305 PolarHBondContact O-N 2.89Å; V302-N306 WeakPolarHBondContact O-CB 3.47Å; V302-N306 VanDerWaalsContact O-CG 3.3Å; V302-N306 PolarHBondContact O-N 3.46Å
303K86Confident84.9Confident124 Ų12489.7 Ų89.754%0.53949%0.487SS..Hα-helixtrans-58.8-45.7174.2-73.6174.6-174.9169.90111.7C299 E300 N306 A307C299-K303 WeakPolarHBondContact O-CG 3.46Å; C299-K303 PolarHBondContact O-N 3.32Å; E300-K303 PolarHBondContact O-N 3.44Å; E300-K303 IonicContact OE1-NZ 2.6Å; E300-K303 PolarHBondContact OE1-NZ 3.19Å; E300-K303 IonicContact OE2-NZ 2.83Å; K303-N306 PolarHBondContact O-N 2.95Å; K303-A307 PolarHBondContact O-N 2.83Å
304Q85.8Confident84.4Confident121 Ų12191.3 Ų91.357%0.56549%0.486SS*.Hα-helixtrans-62.1-43.9177.5-72.3175.72.400112.3E300 L301 V302 A307 T308E300-Q304 WeakPolarHBondContact O-CG 3.29Å; E300-Q304 PolarHBondContact O-N 3.42Å; L301-Q304 PolarHBondContact O-N 2.9Å; V302-Q304 VanDerWaalsContact C-N 3.35Å; V302-Q304 PolarHBondContact O-N 3.42Å; Q304-A307 PolarHBondContact O-N 2.92Å; Q304-T308 PolarHBondContact O-N 3.39Å; Q304-T308 PolarHBondContact O-OG1 2.68Å; Q304-T308 VanDerWaalsContact O-OG1 3.1Å
305R86.6Confident84Confident157 Ų15790.1 Ų90.159%0.59248%0.48SS*.Hα-helixtrans-58.1-48.4174.9179.4-169.6170.9-1410.4111.1L301 V302 A307 T308 I309L301-R305 WeakPolarHBondContact O-CB 3.4Å; L301-R305 PolarHBondContact O-N 3.33Å; V302-R305 PolarHBondContact O-N 2.89Å; R305-A307 VanDerWaalsContact C-N 3.35Å; R305-A307 PolarHBondContact O-N 3.19Å; R305-T308 PolarHBondContact O-N 3.13Å; R305-T308 VanDerWaalsContact O-N 3.15Å; R305-I309 HydrophobicContact CG-CD1 3.96Å; R305-I309 WeakPolarHBondContact O-CG1 3.43Å; R305-I309 PolarHBondContact O-N 3.07Å
306N82.8Confident83.9Confident71 Ų7189.9 Ų89.938%0.3848%0.48SS..Hα-helixtrans-61.7-43.2-179.5-71.9-6.6000111.4V302 K303 T308 I309 E310V302-N306 WeakPolarHBondContact O-CB 3.47Å; V302-N306 VanDerWaalsContact O-CG 3.3Å; V302-N306 PolarHBondContact O-N 3.46Å; K303-N306 PolarHBondContact O-N 2.95Å; N306-T308 VanDerWaalsContact C-N 3.28Å; N306-T308 PolarHBondContact O-N 3.41Å; N306-I309 PolarHBondContact O-N 2.96Å; N306-E310 WeakPolarHBondContact O-CG 3.44Å; N306-E310 PolarHBondContact O-N 3.46Å
307A84.2Confident83.6Confident56 Ų5688.6 Ų88.646%0.46348%0.476SS..Hα-helixtrans-60-37.8175.200000112.6K303 Q304 R305 S311K303-A307 PolarHBondContact O-N 2.83Å; Q304-A307 PolarHBondContact O-N 2.92Å; R305-A307 VanDerWaalsContact C-N 3.35Å; R305-A307 PolarHBondContact O-N 3.19Å; A307-S311 WeakPolarHBondContact O-CB 3.46Å; A307-S311 PolarHBondContact O-N 2.88Å
308T86.9Confident83.4Confident81 Ų8192 Ų9250%0.49748%0.482SS..Hα-helixtrans-69.1-42.2176.3-58.30000111.8Q304 R305 N306 S311 N312Q304-T308 PolarHBondContact O-N 3.39Å; Q304-T308 PolarHBondContact O-OG1 2.68Å; Q304-T308 VanDerWaalsContact O-OG1 3.1Å; R305-T308 PolarHBondContact O-N 3.13Å; R305-T308 VanDerWaalsContact O-N 3.15Å; N306-T308 VanDerWaalsContact C-N 3.28Å; N306-T308 PolarHBondContact O-N 3.41Å; T308-S311 PolarHBondContact O-N 3.26Å; T308-N312 WeakPolarHBondContact O-CB 3.11Å; T308-N312 VanDerWaalsContact O-CG 3.26Å; T308-N312 PolarHBondContact O-N 3.15Å
309I80.4Confident83.2Confident73 Ų7392.3 Ų92.337%0.37448%0.482SS..Hα-helixtrans-62-47.3176.1-68.9170000110.5R305 N306 S311 N312 V313R305-I309 HydrophobicContact CG-CD1 3.96Å; R305-I309 WeakPolarHBondContact O-CG1 3.43Å; R305-I309 PolarHBondContact O-N 3.07Å; N306-I309 PolarHBondContact O-N 2.96Å; I309-S311 VanDerWaalsContact C-N 3.33Å; I309-S311 PolarHBondContact O-N 2.91Å; I309-N312 PolarHBondContact O-N 3.22Å; I309-V313 HydrophobicContact CG2-CG2 4.23Å; I309-V313 WeakPolarHBondContact O-CB 3.5Å; I309-V313 WeakPolarHBondContact O-CG2 3.49Å; I309-V313 PolarHBondContact O-N 3.41Å
310E81.9Confident83.1Confident125 Ų12593.2 Ų93.258%0.58449%0.485SS*.Hα-helixtrans-58-45.8177.9-76.4176.4-173.200111.6N306 N312 V313 Q314N306-E310 WeakPolarHBondContact O-CG 3.44Å; N306-E310 PolarHBondContact O-N 3.46Å; E310-N312 PolarHBondContact O-N 3.49Å; E310-V313 PolarHBondContact O-N 3.07Å; E310-Q314 WeakPolarHBondContact O-CB 3.38Å; E310-Q314 WeakPolarHBondContact O-CG 3.49Å; E310-Q314 PolarHBondContact O-N 3.29Å
311S83Confident82.7Confident70 Ų7092.4 Ų92.449%0.4948%0.483SS..Hα-helixtrans-57.9-48.1175.2-176.80000112A307 T308 I309 V313 Q314 S315A307-S311 WeakPolarHBondContact O-CB 3.46Å; A307-S311 PolarHBondContact O-N 2.88Å; T308-S311 PolarHBondContact O-N 3.26Å; I309-S311 VanDerWaalsContact C-N 3.33Å; I309-S311 PolarHBondContact O-N 2.91Å; S311-V313 PolarHBondContact O-N 3.31Å; S311-Q314 PolarHBondContact O-N 3.4Å; S311-S315 PolarHBondContact O-N 3.43Å
312N80.5Confident82.5Confident93 Ų9392.1 Ų92.150%0.49748%0.481SS..Hα-helixtrans-64.4-41179.4-70.8-12.4000112.2T308 I309 E310 S315 L316T308-N312 WeakPolarHBondContact O-CB 3.11Å; T308-N312 VanDerWaalsContact O-CG 3.26Å; T308-N312 PolarHBondContact O-N 3.15Å; I309-N312 PolarHBondContact O-N 3.22Å; E310-N312 PolarHBondContact O-N 3.49Å; N312-S315 PolarHBondContact O-N 3.25Å; N312-L316 WeakPolarHBondContact O-CG 3.45Å; N312-L316 PolarHBondContact O-N 3.37Å
313V80.7Confident82.5Confident69 Ų6992.9 Ų92.942%0.41848%0.481SS..Hα-helixtrans-64.9-42.4176.4169.60000110.9I309 E310 S311 S315 L316 I317I309-V313 HydrophobicContact CG2-CG2 4.23Å; I309-V313 WeakPolarHBondContact O-CB 3.5Å; I309-V313 WeakPolarHBondContact O-CG2 3.49Å; I309-V313 PolarHBondContact O-N 3.41Å; E310-V313 PolarHBondContact O-N 3.07Å; S311-V313 PolarHBondContact O-N 3.31Å; V313-S315 VanDerWaalsContact C-N 3.34Å; V313-S315 PolarHBondContact O-N 3.08Å; V313-L316 PolarHBondContact O-N 3.47Å; V313-I317 HydrophobicContact CG1-CD1 3.8Å; V313-I317 HydrophobicContact CG1-CG1 4.37Å; V313-I317 VanDerWaalsContact O-CG1 3.29Å; V313-I317 WeakPolarHBondContact O-CG1 3.35Å; V313-I317 PolarHBondContact O-N 3.2Å
314Q81Confident82.1Confident120 Ų12093 Ų9356%0.56148%0.478SS*.Hα-helixtrans-61.1-43175.3-75.9179.93.700111.8E310 S311 I317 Q318E310-Q314 WeakPolarHBondContact O-CB 3.38Å; E310-Q314 WeakPolarHBondContact O-CG 3.49Å; E310-Q314 PolarHBondContact O-N 3.29Å; S311-Q314 PolarHBondContact O-N 3.4Å; Q314-I317 PolarHBondContact O-N 2.9Å; Q314-Q318 WeakPolarHBondContact O-CG 3.35Å; Q314-Q318 PolarHBondContact O-N 2.71Å
315S81.6Confident81.8Confident53 Ų5391.5 Ų91.537%0.37147%0.474SS..Hα-helixtrans-59.6-46.6175.1-165.10000111.5S311 N312 V313 I317 Q318 E319S311-S315 PolarHBondContact O-N 3.43Å; N312-S315 PolarHBondContact O-N 3.25Å; V313-S315 VanDerWaalsContact C-N 3.34Å; V313-S315 PolarHBondContact O-N 3.08Å; S315-I317 PolarHBondContact O-N 3.05Å; S315-Q318 WeakPolarHBondContact O-CB 3.45Å; S315-Q318 PolarHBondContact O-N 3.13Å; S315-E319 PolarHBondContact O-N 3.4Å
316L82.3Confident81.4Confident101 Ų10189.6 Ų89.653%0.52947%0.472SS..Hα-helixtrans-63.6-39.6177-75.1168.9000112.6N312 V313 Q318 E319 V320N312-L316 WeakPolarHBondContact O-CG 3.45Å; N312-L316 PolarHBondContact O-N 3.37Å; V313-L316 PolarHBondContact O-N 3.47Å; L316-Q318 VanDerWaalsContact C-N 3.31Å; L316-Q318 PolarHBondContact O-N 2.87Å; L316-E319 PolarHBondContact O-N 2.86Å; L316-V320 WeakPolarHBondContact O-CB 2.99Å; L316-V320 VanDerWaalsContact O-CG2 3.32Å; L316-V320 WeakPolarHBondContact O-CG2 3.12Å; L316-V320 PolarHBondContact O-N 3.39Å
317I81.5Confident81Confident90 Ų9091 Ų9146%0.46248%0.479SS..Hα-helixtrans-62.2-41.6175.3-72167.6000110.5V313 Q314 S315 V320 N321V313-I317 HydrophobicContact CG1-CD1 3.8Å; V313-I317 HydrophobicContact CG1-CG1 4.37Å; V313-I317 VanDerWaalsContact O-CG1 3.29Å; V313-I317 WeakPolarHBondContact O-CG1 3.35Å; V313-I317 PolarHBondContact O-N 3.2Å; Q314-I317 PolarHBondContact O-N 2.9Å; S315-I317 PolarHBondContact O-N 3.05Å; I317-V320 PolarHBondContact O-N 3.4Å; I317-N321 WeakPolarHBondContact O-CB 3.47Å; I317-N321 PolarHBondContact O-N 3.25Å; I317-N321 PolarHBondContact O-ND2 2.77Å
318Q82.5Confident80.4Confident124 Ų12493.8 Ų93.858%0.57948%0.482SS*.Hα-helixtrans-61.1-47.1175.3-72.6175.11.700111.1Q314 S315 L316 V320 N321 I322Q314-Q318 WeakPolarHBondContact O-CG 3.35Å; Q314-Q318 PolarHBondContact O-N 2.71Å; S315-Q318 WeakPolarHBondContact O-CB 3.45Å; S315-Q318 PolarHBondContact O-N 3.13Å; L316-Q318 VanDerWaalsContact C-N 3.31Å; L316-Q318 PolarHBondContact O-N 2.87Å; Q318-V320 PolarHBondContact O-N 2.99Å; Q318-N321 PolarHBondContact O-N 2.89Å; Q318-I322 WeakPolarHBondContact O-CG1 3.46Å; Q318-I322 PolarHBondContact O-N 3.2Å
319E79.3Confident79.5Confident104 Ų10495.6 Ų95.649%0.48649%0.485SS..Hα-helixtrans-58.7-46175.6-72.5174.6-167.700112.1S315 L316 N321 I322 I323S315-E319 PolarHBondContact O-N 3.4Å; L316-E319 PolarHBondContact O-N 2.86Å; E319-N321 VanDerWaalsContact C-N 3.33Å; E319-N321 PolarHBondContact O-N 3.48Å; E319-I322 PolarHBondContact O-N 2.91Å; E319-I323 WeakPolarHBondContact O-CG1 3.34Å; E319-I323 PolarHBondContact O-N 3.41Å
320V80.6Confident78.6Confident81 Ų8198.8 Ų98.849%0.49150%0.503SS..Hα-helixtrans-63.7-38.8177.51690000111.7L316 I317 Q318 I323 R324L316-V320 WeakPolarHBondContact O-CB 2.99Å; L316-V320 VanDerWaalsContact O-CG2 3.32Å; L316-V320 WeakPolarHBondContact O-CG2 3.12Å; L316-V320 PolarHBondContact O-N 3.39Å; I317-V320 PolarHBondContact O-N 3.4Å; Q318-V320 PolarHBondContact O-N 2.99Å; V320-I323 PolarHBondContact O-N 3.4Å; V320-R324 WeakPolarHBondContact O-CB 3.44Å; V320-R324 PolarHBondContact O-N 2.9Å
321N80.8Confident77.3Confident52 Ų5298 Ų9828%0.27851%0.506SS..Hα-helixtrans-65.9-41.6176.3-73.3-26.4000111.2I317 Q318 E319 I323 R324 D325I317-N321 WeakPolarHBondContact O-CB 3.47Å; I317-N321 PolarHBondContact O-N 3.25Å; I317-N321 PolarHBondContact O-ND2 2.77Å; Q318-N321 PolarHBondContact O-N 2.89Å; E319-N321 VanDerWaalsContact C-N 3.33Å; E319-N321 PolarHBondContact O-N 3.48Å; N321-I323 PolarHBondContact O-N 2.96Å; N321-R324 WeakPolarHBondContact O-CB 3.25Å; N321-R324 PolarHBondContact O-N 3.3Å; N321-R324 PolarHBondContact OD1-NH1 2.91Å; N321-R324 PolarHBondContact OD1-NH2 3.4Å; N321-R324 VanDerWaalsContact OD1-NH2 3.09Å; N321-D325 VanDerWaalsContact O-CG 3.24Å; N321-D325 PolarHBondContact O-N 3.38Å
322I83.4Confident75.7Confident95 Ų95100.4 Ų100.449%0.48751%0.508SS..Hα-helixtrans-57.8-49.5174.2-68.6164.5000110.2Q318 E319 R324 D325 E326Q318-I322 WeakPolarHBondContact O-CG1 3.46Å; Q318-I322 PolarHBondContact O-N 3.2Å; E319-I322 PolarHBondContact O-N 2.91Å; I322-R324 VanDerWaalsContact C-N 3.31Å; I322-R324 PolarHBondContact O-N 3.27Å; I322-D325 PolarHBondContact O-N 2.91Å; I322-E326 HydrophobicContact CG2-CG 4.48Å; I322-E326 WeakPolarHBondContact O-CB 3.42Å; I322-E326 VanDerWaalsContact O-CG 3.32Å; I322-E326 WeakPolarHBondContact O-CG 3.25Å; I322-E326 PolarHBondContact O-N 3.16Å
323I80.7Confident73.9Confident91 Ų91101 Ų10147%0.46752%0.517SS..Hα-helixtrans-60.8-40.8177.5-66.2166.3000111.2E319 V320 N321 E326 L327E319-I323 WeakPolarHBondContact O-CG1 3.34Å; E319-I323 PolarHBondContact O-N 3.41Å; V320-I323 PolarHBondContact O-N 3.4Å; N321-I323 PolarHBondContact O-N 2.96Å; I323-E326 PolarHBondContact O-N 2.87Å; I323-L327 HydrophobicContact CG2-CD1 4.05Å; I323-L327 WeakPolarHBondContact O-CB 3.01Å; I323-L327 WeakPolarHBondContact O-CG 3.37Å; I323-L327 PolarHBondContact O-N 3.33Å
324R77.7Confident72.1Confident125 Ų125103.5 Ų103.547%0.47254%0.538SS..Hα-helixtrans-61.9-46.1177.5-174.3-165.5-60.113910111.2V320 N321 I322 L327 Q328V320-R324 WeakPolarHBondContact O-CB 3.44Å; V320-R324 PolarHBondContact O-N 2.9Å; N321-R324 WeakPolarHBondContact O-CB 3.25Å; N321-R324 PolarHBondContact O-N 3.3Å; N321-R324 PolarHBondContact OD1-NH1 2.91Å; N321-R324 PolarHBondContact OD1-NH2 3.4Å; N321-R324 VanDerWaalsContact OD1-NH2 3.09Å; I322-R324 VanDerWaalsContact C-N 3.31Å; I322-R324 PolarHBondContact O-N 3.27Å; R324-L327 PolarHBondContact O-N 3.45Å; R324-Q328 PolarHBondContact O-N 3.29Å
325D80Confident70.4Confident90 Ų90104.9 Ų104.948%0.48155%0.549SS..Hα-helixtrans-65.8-41.6-179.4-67.1-11.7000110.4N321 I322 L327 Q328 E329N321-D325 VanDerWaalsContact O-CG 3.24Å; N321-D325 PolarHBondContact O-N 3.38Å; I322-D325 PolarHBondContact O-N 2.91Å; D325-L327 VanDerWaalsContact C-N 3.34Å; D325-L327 PolarHBondContact O-N 3.45Å; D325-Q328 PolarHBondContact O-N 2.91Å; D325-E329 PolarHBondContact O-N 3.02Å
326E78.5Confident68.4Low118 Ų118105.6 Ų105.655%0.55156%0.564SS**Hα-helixtrans-58.8-42.3172.7-73.5176.8175.400112.2I322 I323 E329 L330I322-E326 HydrophobicContact CG2-CG 4.48Å; I322-E326 WeakPolarHBondContact O-CB 3.42Å; I322-E326 VanDerWaalsContact O-CG 3.32Å; I322-E326 WeakPolarHBondContact O-CG 3.25Å; I322-E326 PolarHBondContact O-N 3.16Å; I323-E326 PolarHBondContact O-N 2.87Å; E326-E329 PolarHBondContact O-N 2.85Å; E326-L330 WeakPolarHBondContact O-CG 3.35Å; E326-L330 PolarHBondContact O-N 3.4Å
327L74.5Confident66.2Low101 Ų101108.9 Ų108.953%0.52958%0.582SS.*Hα-helixtrans-68.9-35.4175.4-74.2170.8000112.9I323 R324 D325 L330 T331I323-L327 HydrophobicContact CG2-CD1 4.05Å; I323-L327 WeakPolarHBondContact O-CB 3.01Å; I323-L327 WeakPolarHBondContact O-CG 3.37Å; I323-L327 PolarHBondContact O-N 3.33Å; R324-L327 PolarHBondContact O-N 3.45Å; D325-L327 VanDerWaalsContact C-N 3.34Å; D325-L327 PolarHBondContact O-N 3.45Å; L327-L330 HydrophobicContact CD2-CD1 4.47Å; L327-L330 PolarHBondContact O-N 2.96Å; L327-T331 PolarHBondContact O-N 3.15Å; L327-T331 PolarHBondContact O-OG1 3.04Å
328Q71.1Confident64.1Low113 Ų113112 Ų11253%0.52860%0.598SS.*Hα-helixtrans-65.6-41.3174.8-81.7-172-9.900111.8R324 D325 L330 T331 K332R324-Q328 PolarHBondContact O-N 3.29Å; D325-Q328 PolarHBondContact O-N 2.91Å; Q328-L330 VanDerWaalsContact C-N 3.27Å; Q328-L330 PolarHBondContact O-N 2.92Å; Q328-T331 WeakPolarHBondContact CA-OG1 3.46Å; Q328-T331 CarbonylContact O-C 3.54Å; Q328-T331 PolarHBondContact O-N 3.29Å; Q328-T331 VanDerWaalsContact O-N 3.15Å; Q328-T331 PolarHBondContact O-OG1 3.06Å; Q328-K332 PolarHBondContact O-N 3.43Å
329E67.5Low61.6Low119 Ų119117.7 Ų117.756%0.55663%0.631SS**Hα-helixtrans-62.2-34.6173.6-71.2-61.515500112.2D325 E326 T331 K332D325-E329 PolarHBondContact O-N 3.02Å; E326-E329 PolarHBondContact O-N 2.85Å; E329-T331 VanDerWaalsContact C-N 3.34Å; E329-K332 WeakPolarHBondContact OE1-CE 3.35Å; E329-K332 IonicContact OE1-NZ 3.89Å; E329-K332 PolarHBondContact OE1-NZ 2.83Å; E329-K332 WeakPolarHBondContact OE2-CD 3.14Å; E329-K332 WeakPolarHBondContact OE2-CE 3.48Å; E329-K332 IonicContact OE2-NZ 2.84Å; E329-K332 PolarHBondContact OE2-NZ 3.31Å
330L62.7Low60.8Low141 Ų141118.4 Ų118.474%0.73864%0.639SS**Hα-helixtrans-73.1-23.2175.3-72.2168.1000113.9E326 L327 Q328E326-L330 WeakPolarHBondContact O-CG 3.35Å; E326-L330 PolarHBondContact O-N 3.4Å; L327-L330 HydrophobicContact CD2-CD1 4.47Å; L327-L330 PolarHBondContact O-N 2.96Å; Q328-L330 VanDerWaalsContact C-N 3.27Å; Q328-L330 PolarHBondContact O-N 2.92Å
331T54.3Low59.7Low108 Ų108120.3 Ų120.366%0.66365%0.646SS**Hα-helixtrans-103-1.8-178.844.70000113.7L327 Q328 E329 P333L327-T331 PolarHBondContact O-N 3.15Å; L327-T331 PolarHBondContact O-OG1 3.04Å; Q328-T331 WeakPolarHBondContact CA-OG1 3.46Å; Q328-T331 CarbonylContact O-C 3.54Å; Q328-T331 PolarHBondContact O-N 3.29Å; Q328-T331 VanDerWaalsContact O-N 3.15Å; Q328-T331 PolarHBondContact O-OG1 3.06Å; E329-T331 VanDerWaalsContact C-N 3.34Å; T331-P333 WeakPolarHBondContact O-CD 3.32Å
332K49.4Very low58.5Low121 Ų121124.1 Ų124.153%0.52667%0.667SS.*SBendtrans-56.3123.7167-83.1-179.2-172.1167.30108.8Q328 E329 S334Q328-K332 PolarHBondContact O-N 3.43Å; E329-K332 WeakPolarHBondContact OE1-CE 3.35Å; E329-K332 IonicContact OE1-NZ 3.89Å; E329-K332 PolarHBondContact OE1-NZ 2.83Å; E329-K332 WeakPolarHBondContact OE2-CD 3.14Å; E329-K332 WeakPolarHBondContact OE2-CE 3.48Å; E329-K332 IonicContact OE2-NZ 2.84Å; E329-K332 PolarHBondContact OE2-NZ 3.31Å; K332-S334 PolarHBondContact O-N 2.69Å; K332-S334 VanDerWaalsContact O-N 3.15Å
333P42.9Very low57.1Low104 Ų104125.8 Ų125.868%0.67568%0.677SS**  trans-57.6125.5171.2-12.725.3000106.9T331 D335T331-P333 WeakPolarHBondContact O-CD 3.32Å; P333-D335 PolarHBondContact O-N 2.77Å
334S43Very low55.6Low123 Ų123128 Ų12886%0.8669%0.691SS**  trans-65.878165.2170.20000107.7K332 G336K332-S334 PolarHBondContact O-N 2.69Å; K332-S334 VanDerWaalsContact O-N 3.15Å; S334-G336 PolarHBondContact O-N 3.41Å
335D43.5Very low54.1Low149 Ų149128.2 Ų128.280%0.79771%0.705SS**  trans-64.9127.1165.4-85.8-22.4000108.3P333P333-D335 PolarHBondContact O-N 2.77Å
336G41Very low52.3Low67 Ų67130.9 Ų130.969%0.69172%0.721SS**  trans97.866.3150.200000116.5S334S334-G336 PolarHBondContact O-N 3.41Å
337N35Very low50.3Low171 Ų171131.9 Ų131.991%0.91473%0.734SS**  trans-99.475.6140.2-141.49.4000107.1
338I37.5Very low48.2Very low154 Ų154134.5 Ų134.579%0.7975%0.751SS**  trans-138.598.3161.9-55.9179.7000106
339L31.2Very low46.2Very low244 Ų244136.5 Ų136.5100%1.27777%0.772SS**  trans66.70171.6-82.3152000119

Retrieved 339 of 339 residues in 206.4 ms (Link to these results)