A0A3Q0KH68_SCHMA Loading...

Meiosis-specific nuclear structural protein 1

Microtubule inner protein (MIP) part of the dynein-decorated doublet microtubules (DMTs) in cilia axoneme, which is required for motile cilia beating. May play a role in the control of meiotic division and germ cell differentiation through regulation of pairing and recombination during meiosis. Required for sperm flagella assembly. May play a role in the assembly and function of the outer dynein arm-docking complex (ODA-DC). ODA-DC mediates outer dynein arms (ODA) binding onto the axonemal doublet microtubules.

AlphaFold DB , UniProt , Accession A0A3Q0KH68, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 409 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M56.2Low42.4Very low231 Ų231137.2 Ų137.2100%1.13876%0.757SS**  0110.70-68.1-177.6176.400104.6
2T53.1Low42.9Very low111 Ų111129.7 Ų129.768%0.68172%0.721SS**  cis175.5117.833.8140000103.1
3E52.2Low43.3Very low172 Ų172125.5 Ų125.580%0.80471%0.706SS**  79.1142.389.7-74.8-174.1157.900114.3
4V47.9Very low43.9Very low136 Ų136127.1 Ų127.182%0.82471%0.71SS**  trans80.7129.2161.6-155.60000113.5
5A45.6Very low44.6Very low71 Ų71125.9 Ų125.959%0.58770%0.701SS**  cis-163.1147.72700000109.2
6S31.9Very low45.5Very low97 Ų97123.8 Ų123.868%0.67869%0.685SS**  28.6107.511272.80000114.1
7H33.7Very low46.3Very low161 Ų161120.2 Ų120.275%0.74567%0.67SS**  -167.5133.679-95.656.6000109
8T30.5Very low47.1Very low109 Ų109118.6 Ų118.667%0.66966%0.659SS**  trans7.3117.6136.755.30000116.6
9Y32.4Very low48Very low222 Ų222115.3 Ų115.387%0.87165%0.649SS**  -172.387.5127.2-100.6-72.9000110.4
10S39.6Very low49.1Very low69 Ų69115.6 Ų115.648%0.48364%0.643SS.*  trans48.2120.9145.1-149.30000121S12 S13S10-S12 WeakPolarHBondContact CB-OG 3.41Å; S10-S12 PolarHBondContact O-N 3.38Å; S10-S12 PolarHBondContact OG-OG 2.75Å; S10-S13 PolarHBondContact O-N 3.48Å
11P43.3Very low49.8Very low130 Ų130115.4 Ų115.484%0.84464%0.637SS**THydrogen-bonded Turntrans-71.241.2166.534.5-35.2000112.1
12S49Very low50.4Low47 Ų47109.9 Ų109.933%0.32961%0.612SS.*THydrogen-bonded Turntrans-123.6-13.617759.90000111.9S10 E16S10-S12 WeakPolarHBondContact CB-OG 3.41Å; S10-S12 PolarHBondContact O-N 3.38Å; S10-S12 PolarHBondContact OG-OG 2.75Å; S12-E16 VanDerWaalsContact O-CA 3.3Å; S12-E16 WeakPolarHBondContact O-CA 3.49Å; S12-E16 WeakPolarHBondContact O-CB 2.8Å; S12-E16 WeakPolarHBondContact O-CG 3.35Å; S12-E16 PolarHBondContact O-N 3.48Å
13S47.4Very low51.3Low76 Ų76107.5 Ų107.553%0.53160%0.603SS.*Hα-helixtrans-88-37.8-171.9-171.70000114.9S10 S17S10-S13 PolarHBondContact O-N 3.48Å; S13-S17 WeakPolarHBondContact O-CB 3.2Å; S13-S17 PolarHBondContact O-N 2.77Å
14I51.4Low52.3Low147 Ų147106.2 Ų106.275%0.75460%0.595SS**Hα-helixtrans-80.1-38.1173.4-59.8175.3000110.3E16 S17 L18I14-E16 VanDerWaalsContact C-N 3.35Å; I14-S17 WeakPolarHBondContact O-CB 3.26Å; I14-S17 PolarHBondContact O-N 3.46Å; I14-S17 VanDerWaalsContact O-N 3.14Å; I14-L18 PolarHBondContact O-N 2.76Å
15D54.7Low53.5Low109 Ų109103.3 Ų103.358%0.58358%0.577SS**Hα-helixtrans-66.9-31.8168-83.7-27.8000112A19D15-A19 WeakPolarHBondContact O-CA 2.95Å; D15-A19 WeakPolarHBondContact O-CB 3.2Å; D15-A19 PolarHBondContact O-N 3.45Å
16E59.2Low54.7Low93 Ų93105.4 Ų105.444%0.43557%0.574SS.*Hα-helixtrans-68.1-37.3166.3-92.1179.6-166.100111.7S12 I14 K20S12-E16 VanDerWaalsContact O-CA 3.3Å; S12-E16 WeakPolarHBondContact O-CA 3.49Å; S12-E16 WeakPolarHBondContact O-CB 2.8Å; S12-E16 WeakPolarHBondContact O-CG 3.35Å; S12-E16 PolarHBondContact O-N 3.48Å; I14-E16 VanDerWaalsContact C-N 3.35Å; E16-K20 WeakPolarHBondContact O-CA 3.39Å; E16-K20 WeakPolarHBondContact O-CB 3.11Å; E16-K20 VanDerWaalsContact O-CD 3.28Å; E16-K20 WeakPolarHBondContact O-CD 3.48Å; E16-K20 WeakPolarHBondContact O-CG 3.35Å; E16-K20 PolarHBondContact O-N 3.19Å; E16-K20 IonicContact OE2-NZ 3.79Å; E16-K20 PolarHBondContact OE2-NZ 3.48Å
17S58.6Low56.8Low62 Ų62107.6 Ų107.643%0.43457%0.572SS.*Hα-helixtrans-64.2-44.8177.5174.90000110.9S13 I14 K20 Q21S13-S17 WeakPolarHBondContact O-CB 3.2Å; S13-S17 PolarHBondContact O-N 2.77Å; I14-S17 WeakPolarHBondContact O-CB 3.26Å; I14-S17 PolarHBondContact O-N 3.46Å; I14-S17 VanDerWaalsContact O-N 3.14Å; S17-K20 PolarHBondContact O-N 2.82Å; S17-Q21 WeakPolarHBondContact O-CG 3.41Å; S17-Q21 PolarHBondContact O-N 3.22Å
18L61.2Low58.6Low92 Ų92104.9 Ų104.948%0.48256%0.56SS.*Hα-helixtrans-77-37.5179.2-155.480.5000112.3I14 K20 Q21 L22I14-L18 PolarHBondContact O-N 2.76Å; L18-K20 VanDerWaalsContact C-N 3.33Å; L18-Q21 CarbonylContact O-C 3.55Å; L18-Q21 WeakPolarHBondContact O-CA 3.41Å; L18-Q21 WeakPolarHBondContact O-CB 3.44Å; L18-Q21 PolarHBondContact O-N 2.75Å; L18-L22 PolarHBondContact O-N 2.77Å
19A63.9Low60.8Low55 Ų55105 Ų10546%0.45555%0.552SS.*Hα-helixtrans-66.5-33170.500000111.7D15 Q21 L22 A23D15-A19 WeakPolarHBondContact O-CA 2.95Å; D15-A19 WeakPolarHBondContact O-CB 3.2Å; D15-A19 PolarHBondContact O-N 3.45Å; A19-Q21 VanDerWaalsContact C-N 3.32Å; A19-L22 PolarHBondContact O-N 3.45Å; A19-A23 WeakPolarHBondContact O-CB 3.31Å; A19-A23 PolarHBondContact O-N 3.34Å
20K69.8Low63.1Low122 Ų12296.8 Ų96.853%0.5353%0.525SS..Hα-helixtrans-66.3-33.4167-77.4163.9-174.5154.80111.1E16 S17 L18 K24E16-K20 WeakPolarHBondContact O-CA 3.39Å; E16-K20 WeakPolarHBondContact O-CB 3.11Å; E16-K20 VanDerWaalsContact O-CD 3.28Å; E16-K20 WeakPolarHBondContact O-CD 3.48Å; E16-K20 WeakPolarHBondContact O-CG 3.35Å; E16-K20 PolarHBondContact O-N 3.19Å; E16-K20 IonicContact OE2-NZ 3.79Å; E16-K20 PolarHBondContact OE2-NZ 3.48Å; S17-K20 PolarHBondContact O-N 2.82Å; L18-K20 VanDerWaalsContact C-N 3.33Å; K20-K24 VanDerWaalsContact O-CB 3.27Å; K20-K24 WeakPolarHBondContact O-CB 3.46Å; K20-K24 VanDerWaalsContact O-CG 3.24Å; K20-K24 WeakPolarHBondContact O-CG 3.45Å; K20-K24 PolarHBondContact O-N 2.95Å
21Q64Low65Low111 Ų111101.8 Ų101.852%0.51953%0.534SS..Hα-helixtrans-70.5-43.8172-73.7-17610.800112.4S17 L18 A19 K24 V25S17-Q21 WeakPolarHBondContact O-CG 3.41Å; S17-Q21 PolarHBondContact O-N 3.22Å; L18-Q21 CarbonylContact O-C 3.55Å; L18-Q21 WeakPolarHBondContact O-CA 3.41Å; L18-Q21 WeakPolarHBondContact O-CB 3.44Å; L18-Q21 PolarHBondContact O-N 2.75Å; A19-Q21 VanDerWaalsContact C-N 3.32Å; Q21-K24 CarbonylContact O-C 3.6Å; Q21-K24 WeakPolarHBondContact O-CB 3.5Å; Q21-K24 PolarHBondContact O-N 3.39Å; Q21-V25 WeakPolarHBondContact O-CG2 3.34Å; Q21-V25 PolarHBondContact O-N 2.93Å
22L68.8Low66.5Low116 Ų116101.5 Ų101.561%0.60752%0.519SS*.Hα-helixtrans-66.5-40.2174.7-79.7169000112.1L18 A19 K24 V25 H26L18-L22 PolarHBondContact O-N 2.77Å; A19-L22 PolarHBondContact O-N 3.45Å; L22-K24 VanDerWaalsContact C-N 3.31Å; L22-K24 PolarHBondContact O-N 3.34Å; L22-V25 PolarHBondContact O-N 3.44Å; L22-H26 WeakPolarHBondContact O-CB 3.31Å; L22-H26 PolarHBondContact O-N 2.94Å
23A73.3Confident68Low60 Ų60105.5 Ų105.550%0.49653%0.533SS..Hα-helixtrans-64.6-35.8171.700000111.2A19 F27A19-A23 WeakPolarHBondContact O-CB 3.31Å; A19-A23 PolarHBondContact O-N 3.34Å; A23-F27 WeakPolarHBondContact O-CA 3.49Å; A23-F27 WeakPolarHBondContact O-CB 3.07Å; A23-F27 PolarHBondContact O-N 3.47Å
24K71.7Confident69.6Low146 Ų146108.6 Ų108.664%0.63554%0.537SS*.Hα-helixtrans-64.4-44.2169.6-85176.9177.9-178.90111.8K20 Q21 L22 F27 E28K20-K24 VanDerWaalsContact O-CB 3.27Å; K20-K24 WeakPolarHBondContact O-CB 3.46Å; K20-K24 VanDerWaalsContact O-CG 3.24Å; K20-K24 WeakPolarHBondContact O-CG 3.45Å; K20-K24 PolarHBondContact O-N 2.95Å; Q21-K24 CarbonylContact O-C 3.6Å; Q21-K24 WeakPolarHBondContact O-CB 3.5Å; Q21-K24 PolarHBondContact O-N 3.39Å; L22-K24 VanDerWaalsContact C-N 3.31Å; L22-K24 PolarHBondContact O-N 3.34Å; K24-F27 PolarHBondContact O-N 2.91Å; K24-E28 VanDerWaalsContact O-CB 3.3Å; K24-E28 WeakPolarHBondContact O-CB 3.49Å; K24-E28 WeakPolarHBondContact O-CG 3.33Å; K24-E28 PolarHBondContact O-N 3.17Å
25V73.3Confident70.8Confident75 Ų75106.3 Ų106.346%0.45553%0.525SS..Hα-helixtrans-64.6-43.2177.3171.90000111.2Q21 L22 E28 Q29Q21-V25 WeakPolarHBondContact O-CG2 3.34Å; Q21-V25 PolarHBondContact O-N 2.93Å; L22-V25 PolarHBondContact O-N 3.44Å; V25-E28 CarbonylContact O-C 3.57Å; V25-E28 PolarHBondContact O-N 3.38Å; V25-Q29 WeakPolarHBondContact O-CG 3.23Å; V25-Q29 PolarHBondContact O-N 3.08Å
26H71.6Confident72Confident114 Ų114109.5 Ų109.553%0.52853%0.529SS..Hα-helixtrans-68-41.8176-173.6-86.3000111.3L22 E28 Q29 V30L22-H26 WeakPolarHBondContact O-CB 3.31Å; L22-H26 PolarHBondContact O-N 2.94Å; H26-E28 VanDerWaalsContact C-N 3.28Å; H26-E28 PolarHBondContact O-N 2.91Å; H26-Q29 WeakPolarHBondContact O-CB 3.45Å; H26-Q29 PolarHBondContact O-N 2.8Å; H26-Q29 VanDerWaalsContact O-N 3.14Å; H26-V30 VanDerWaalsContact CE1-CG2 3.47Å; H26-V30 WeakPolarHBondContact CE1-CG2 3.4Å; H26-V30 WeakPolarHBondContact O-CB 3.37Å; H26-V30 WeakPolarHBondContact O-CG2 3.27Å; H26-V30 PolarHBondContact O-N 2.8Å
27F74.7Confident72.9Confident143 Ų143111.5 Ų111.563%0.62754%0.538SS*.Hα-helixtrans-62.4-37.9173.1-172.5-96000111A23 K24 R31A23-F27 WeakPolarHBondContact O-CA 3.49Å; A23-F27 WeakPolarHBondContact O-CB 3.07Å; A23-F27 PolarHBondContact O-N 3.47Å; K24-F27 PolarHBondContact O-N 2.91Å; F27-R31 WeakPolarHBondContact O-CA 3.47Å; F27-R31 WeakPolarHBondContact O-CB 3.32Å; F27-R31 PolarHBondContact O-N 3.42Å
28E72.7Confident73.9Confident105 Ų105113.9 Ų113.949%0.49154%0.541SS..Hα-helixtrans-67.5-36.2171.5-80.5-173.1-176.900112.7K24 V25 H26 R31 K32K24-E28 VanDerWaalsContact O-CB 3.3Å; K24-E28 WeakPolarHBondContact O-CB 3.49Å; K24-E28 WeakPolarHBondContact O-CG 3.33Å; K24-E28 PolarHBondContact O-N 3.17Å; V25-E28 CarbonylContact O-C 3.57Å; V25-E28 PolarHBondContact O-N 3.38Å; H26-E28 VanDerWaalsContact C-N 3.28Å; H26-E28 PolarHBondContact O-N 2.91Å; E28-R31 PolarHBondContact O-N 2.72Å; E28-K32 VanDerWaalsContact O-CB 3.23Å; E28-K32 WeakPolarHBondContact O-CB 3.22Å; E28-K32 VanDerWaalsContact O-CG 3.22Å; E28-K32 WeakPolarHBondContact O-CG 3.23Å; E28-K32 PolarHBondContact O-N 3.21Å
29Q76.7Confident74.7Confident110 Ų110114 Ų11451%0.51454%0.541SS..Hα-helixtrans-67.3-46.3173.9-80.8178.1-14.500111.6V25 H26 R31 K32 Q33V25-Q29 WeakPolarHBondContact O-CG 3.23Å; V25-Q29 PolarHBondContact O-N 3.08Å; H26-Q29 WeakPolarHBondContact O-CB 3.45Å; H26-Q29 PolarHBondContact O-N 2.8Å; H26-Q29 VanDerWaalsContact O-N 3.14Å; Q29-R31 VanDerWaalsContact C-N 3.33Å; Q29-K32 CarbonylContact O-C 3.57Å; Q29-K32 PolarHBondContact O-N 2.76Å; Q29-Q33 WeakPolarHBondContact O-CB 3.3Å; Q29-Q33 WeakPolarHBondContact O-CG 3.24Å; Q29-Q33 PolarHBondContact O-N 3.48Å
30V80.5Confident75.2Confident50 Ų50117.3 Ų117.330%0.30355%0.545SS..Hα-helixtrans-63.9-41.3174.4173.40000109.8H26 K32 Q33 K34H26-V30 VanDerWaalsContact CE1-CG2 3.47Å; H26-V30 WeakPolarHBondContact CE1-CG2 3.4Å; H26-V30 WeakPolarHBondContact O-CB 3.37Å; H26-V30 WeakPolarHBondContact O-CG2 3.27Å; H26-V30 PolarHBondContact O-N 2.8Å; V30-K32 PolarHBondContact O-N 2.75Å; V30-Q33 PolarHBondContact O-N 2.76Å; V30-K34 HydrophobicContact CG1-CG 4.4Å; V30-K34 VanDerWaalsContact O-CB 3.31Å; V30-K34 WeakPolarHBondContact O-CB 3.26Å; V30-K34 WeakPolarHBondContact O-CG 3.34Å; V30-K34 PolarHBondContact O-N 3.32Å
31R78.5Confident75.5Confident175 Ų175114.6 Ų114.666%0.6654%0.542SS*.Hα-helixtrans-62.6-41.3173.3-174.2-179177.5-170.3-0111F27 E28 Q29 L35F27-R31 WeakPolarHBondContact O-CA 3.47Å; F27-R31 WeakPolarHBondContact O-CB 3.32Å; F27-R31 PolarHBondContact O-N 3.42Å; E28-R31 PolarHBondContact O-N 2.72Å; Q29-R31 VanDerWaalsContact C-N 3.33Å; R31-L35 WeakPolarHBondContact O-CB 3.44Å; R31-L35 PolarHBondContact O-N 2.73Å
32K76.4Confident76Confident123 Ų123115.1 Ų115.154%0.53554%0.544SS..Hα-helixtrans-67.7-38.2174.9-80.6174.8-177.6172.90112.1E28 Q29 V30 L35 R36E28-K32 VanDerWaalsContact O-CB 3.23Å; E28-K32 WeakPolarHBondContact O-CB 3.22Å; E28-K32 VanDerWaalsContact O-CG 3.22Å; E28-K32 WeakPolarHBondContact O-CG 3.23Å; E28-K32 PolarHBondContact O-N 3.21Å; Q29-K32 CarbonylContact O-C 3.57Å; Q29-K32 PolarHBondContact O-N 2.76Å; V30-K32 PolarHBondContact O-N 2.75Å; K32-L35 PolarHBondContact O-N 3.49Å; K32-R36 WeakPolarHBondContact O-CB 3.5Å; K32-R36 VanDerWaalsContact O-CG 3.26Å; K32-R36 WeakPolarHBondContact O-CG 3.28Å; K32-R36 PolarHBondContact O-N 2.74Å
33Q80.1Confident76.4Confident131 Ų131111.1 Ų111.161%0.61253%0.526SS*.Hα-helixtrans-70-43.1175.2-80.4-174.8-4.900111.4Q29 V30 L35 R36 Q37Q29-Q33 WeakPolarHBondContact O-CB 3.3Å; Q29-Q33 WeakPolarHBondContact O-CG 3.24Å; Q29-Q33 PolarHBondContact O-N 3.48Å; V30-Q33 PolarHBondContact O-N 2.76Å; Q33-L35 VanDerWaalsContact C-N 3.32Å; Q33-R36 CarbonylContact O-C 3.56Å; Q33-R36 PolarHBondContact O-N 3.49Å; Q33-Q37 WeakPolarHBondContact O-CB 3.03Å; Q33-Q37 PolarHBondContact O-N 2.76Å
34K81.3Confident76.7Confident142 Ų142113.8 Ų113.862%0.61753%0.531SS*.Hα-helixtrans-64.2-38.8172.2-75.7-156.4176.6-170.40111.2V30 Q37 K38V30-K34 HydrophobicContact CG1-CG 4.4Å; V30-K34 VanDerWaalsContact O-CB 3.31Å; V30-K34 WeakPolarHBondContact O-CB 3.26Å; V30-K34 WeakPolarHBondContact O-CG 3.34Å; V30-K34 PolarHBondContact O-N 3.32Å; K34-Q37 PolarHBondContact O-N 3.14Å; K34-K38 WeakPolarHBondContact O-CB 3.37Å; K34-K38 PolarHBondContact O-N 2.79Å
35L76.6Confident77.2Confident99 Ų99114.2 Ų114.252%0.51854%0.535SS..Hα-helixtrans-65-40.5172.2-173.867.2000111R31 K32 Q33 K38 I39R31-L35 WeakPolarHBondContact O-CB 3.44Å; R31-L35 PolarHBondContact O-N 2.73Å; K32-L35 PolarHBondContact O-N 3.49Å; Q33-L35 VanDerWaalsContact C-N 3.32Å; L35-K38 PolarHBondContact O-N 3.21Å; L35-I39 HydrophobicContact CD1-CD1 4.48Å; L35-I39 HydrophobicContact CG-CD1 3.99Å; L35-I39 WeakPolarHBondContact O-CB 3.47Å; L35-I39 WeakPolarHBondContact O-CG1 3.48Å; L35-I39 PolarHBondContact O-N 3.43Å
36R79.1Confident77.4Confident176 Ų176113.6 Ų113.666%0.66453%0.528SS*.Hα-helixtrans-66.7-41174-78.9178.3-165.9-132.94.5112.3K32 Q33 K38 I39 K40K32-R36 WeakPolarHBondContact O-CB 3.5Å; K32-R36 VanDerWaalsContact O-CG 3.26Å; K32-R36 WeakPolarHBondContact O-CG 3.28Å; K32-R36 PolarHBondContact O-N 2.74Å; Q33-R36 CarbonylContact O-C 3.56Å; Q33-R36 PolarHBondContact O-N 3.49Å; R36-K38 VanDerWaalsContact C-N 3.32Å; R36-I39 PolarHBondContact O-N 3.31Å; R36-K40 VanDerWaalsContact O-CB 3.31Å; R36-K40 WeakPolarHBondContact O-CB 3.38Å; R36-K40 VanDerWaalsContact O-CG 3.23Å; R36-K40 WeakPolarHBondContact O-CG 3.04Å; R36-K40 PolarHBondContact O-N 2.75Å
37Q79Confident77.8Confident134 Ų134114.7 Ų114.763%0.62653%0.528SS*.Hα-helixtrans-62.4-43.7172.9-85.9-177.7-15.100110.1Q33 K34 K40 S41Q33-Q37 WeakPolarHBondContact O-CB 3.03Å; Q33-Q37 PolarHBondContact O-N 2.76Å; K34-Q37 PolarHBondContact O-N 3.14Å; Q37-K40 WeakPolarHBondContact O-CB 3.06Å; Q37-K40 PolarHBondContact O-N 3.22Å; Q37-S41 WeakPolarHBondContact O-CB 3.49Å; Q37-S41 PolarHBondContact O-N 3.39Å; Q37-S41 PolarHBondContact O-OG 3.46Å; Q37-S41 VanDerWaalsContact O-OG 3.08Å
38K79.7Confident78.2Confident112 Ų112112.8 Ų112.849%0.48752%0.521SS..Hα-helixtrans-62.1-46.2176.3-165.2172.4177.6-179.20111.3K34 L35 R36 K40 S41 E42K34-K38 WeakPolarHBondContact O-CB 3.37Å; K34-K38 PolarHBondContact O-N 2.79Å; L35-K38 PolarHBondContact O-N 3.21Å; R36-K38 VanDerWaalsContact C-N 3.32Å; K38-K40 PolarHBondContact O-N 2.82Å; K38-S41 WeakPolarHBondContact CA-OG 3.37Å; K38-S41 CarbonylContact O-C 3.59Å; K38-S41 PolarHBondContact O-N 2.89Å; K38-S41 PolarHBondContact O-OG 3.36Å; K38-E42 VanDerWaalsContact CE-CD 3.47Å; K38-E42 WeakPolarHBondContact CE-OE1 3.39Å; K38-E42 HydrophobicContact CG-CG 4.28Å; K38-E42 IonicContact NZ-OE1 3.4Å; K38-E42 VanDerWaalsContact O-CB 3.26Å; K38-E42 WeakPolarHBondContact O-CB 3.09Å; K38-E42 WeakPolarHBondContact O-CG 3.34Å; K38-E42 PolarHBondContact O-N 2.89Å
39I76.3Confident78.7Confident94 Ų94112.7 Ų112.748%0.48252%0.523SS..Hα-helixtrans-62.8-40.7173.2-68.9167000111.2L35 R36 S41 E42 S43L35-I39 HydrophobicContact CD1-CD1 4.48Å; L35-I39 HydrophobicContact CG-CD1 3.99Å; L35-I39 WeakPolarHBondContact O-CB 3.47Å; L35-I39 WeakPolarHBondContact O-CG1 3.48Å; L35-I39 PolarHBondContact O-N 3.43Å; R36-I39 PolarHBondContact O-N 3.31Å; I39-S41 VanDerWaalsContact C-N 3.31Å; I39-S41 PolarHBondContact O-N 3.37Å; I39-E42 PolarHBondContact O-N 2.95Å; I39-S43 WeakPolarHBondContact O-CA 3.48Å; I39-S43 WeakPolarHBondContact O-CB 3.5Å; I39-S43 PolarHBondContact O-N 3.42Å
40K75.7Confident79Confident126 Ų126111.7 Ų111.755%0.54852%0.518SS..Hα-helixtrans-63.2-37.8174.6-78.5-179.9175.3-165.70111.8R36 Q37 K38 I46R36-K40 VanDerWaalsContact O-CB 3.31Å; R36-K40 WeakPolarHBondContact O-CB 3.38Å; R36-K40 VanDerWaalsContact O-CG 3.23Å; R36-K40 WeakPolarHBondContact O-CG 3.04Å; R36-K40 PolarHBondContact O-N 2.75Å; Q37-K40 WeakPolarHBondContact O-CB 3.06Å; Q37-K40 PolarHBondContact O-N 3.22Å; K38-K40 PolarHBondContact O-N 2.82Å; K40-I46 HydrophobicContact CB-CG2 4.29Å; K40-I46 HydrophobicContact CG-CG2 4.29Å
41S75Confident79.1Confident65 Ų65113.9 Ų113.946%0.45553%0.528SS..Hα-helixtrans-78.4-32.6178.558.80000113.4Q37 K38 I39 R47Q37-S41 WeakPolarHBondContact O-CB 3.49Å; Q37-S41 PolarHBondContact O-N 3.39Å; Q37-S41 PolarHBondContact O-OG 3.46Å; Q37-S41 VanDerWaalsContact O-OG 3.08Å; K38-S41 WeakPolarHBondContact CA-OG 3.37Å; K38-S41 CarbonylContact O-C 3.59Å; K38-S41 PolarHBondContact O-N 2.89Å; K38-S41 PolarHBondContact O-OG 3.36Å; I39-S41 VanDerWaalsContact C-N 3.31Å; I39-S41 PolarHBondContact O-N 3.37Å; S41-R47 PolarHBondContact O-NH2 2.79Å
42E75.3Confident79.5Confident122 Ų122112.1 Ų112.157%0.5753%0.526SS*.Hα-helixtrans-92.5-25.1-176.9-70.6177.6169.500112.8K38 I39 I44K38-E42 VanDerWaalsContact CE-CD 3.47Å; K38-E42 WeakPolarHBondContact CE-OE1 3.39Å; K38-E42 HydrophobicContact CG-CG 4.28Å; K38-E42 IonicContact NZ-OE1 3.4Å; K38-E42 VanDerWaalsContact O-CB 3.26Å; K38-E42 WeakPolarHBondContact O-CB 3.09Å; K38-E42 WeakPolarHBondContact O-CG 3.34Å; K38-E42 PolarHBondContact O-N 2.89Å; I39-E42 PolarHBondContact O-N 2.95Å; E42-I44 PolarHBondContact O-N 3.21Å
43S77.6Confident79.9Confident32 Ų32110.8 Ų110.822%0.22452%0.524CS..  trans-73.6119.6174.8175.50000110.6I39 E45I39-S43 WeakPolarHBondContact O-CA 3.48Å; I39-S43 WeakPolarHBondContact O-CB 3.5Å; I39-S43 PolarHBondContact O-N 3.42Å; S43-E45 VanDerWaalsContact C-N 3.32Å; S43-E45 PolarHBondContact OG-N 3.44Å
44I78.4Confident80.1Confident116 Ų116112.3 Ų112.360%0.59552%0.524SS*.Hα-helixtrans-64.5-38.6176.3-63.7167.4000110.4E42 I46 R47 E48E42-I44 PolarHBondContact O-N 3.21Å; I44-I46 PolarHBondContact O-N 2.68Å; I44-R47 PolarHBondContact O-N 3.27Å; I44-E48 HydrophobicContact CG2-CG 4.3Å; I44-E48 WeakPolarHBondContact O-CG 3.34Å; I44-E48 PolarHBondContact O-N 2.76Å
45E82Confident80.3Confident155 Ų155109 Ų10972%0.72452%0.519SS*.Hα-helixtrans-61.7-40.6-177.9-63-178.6178.500112.9S43 E48 L49S43-E45 VanDerWaalsContact C-N 3.32Å; S43-E45 PolarHBondContact OG-N 3.44Å; E45-E48 PolarHBondContact O-N 2.78Å; E45-L49 WeakPolarHBondContact O-CB 3.35Å; E45-L49 PolarHBondContact O-N 2.89Å
46I79.1Confident80.8Confident61 Ų61107 Ų10731%0.31352%0.517SS..Hα-helixtrans-65.4-41.7177.7-64.1-78.4000110.3K40 I44 L49 E50K40-I46 HydrophobicContact CB-CG2 4.29Å; K40-I46 HydrophobicContact CG-CG2 4.29Å; I44-I46 PolarHBondContact O-N 2.68Å; I46-L49 PolarHBondContact O-N 2.76Å; I46-E50 PolarHBondContact O-N 3.26Å
47R79.6Confident81.2Confident137 Ų137106.6 Ų106.652%0.51752%0.516SS..Hα-helixtrans-67.3-39.5179.1-162-175.8-59.8169.41.8111.6S41 I44 E50 N51S41-R47 PolarHBondContact O-NH2 2.79Å; I44-R47 PolarHBondContact O-N 3.27Å; R47-E50 PolarHBondContact O-N 2.89Å; R47-N51 WeakPolarHBondContact O-CB 3.37Å; R47-N51 VanDerWaalsContact O-CG 3.28Å; R47-N51 PolarHBondContact O-N 2.91Å; R47-N51 PolarHBondContact O-ND2 2.78Å
48E83.3Confident81.6Confident103 Ų103103.8 Ų103.848%0.48151%0.508SS..Hα-helixtrans-64.1-41.6173.5-74.2-175.6-176.700112.2I44 E45 N51 K52I44-E48 HydrophobicContact CG2-CG 4.3Å; I44-E48 WeakPolarHBondContact O-CG 3.34Å; I44-E48 PolarHBondContact O-N 2.76Å; E45-E48 PolarHBondContact O-N 2.78Å; E48-N51 PolarHBondContact O-N 3.5Å; E48-K52 WeakPolarHBondContact O-CB 3.36Å; E48-K52 WeakPolarHBondContact O-CG 3.45Å; E48-K52 PolarHBondContact O-N 3.2Å
49L83.6Confident82Confident103 Ų103100.9 Ų100.954%0.53951%0.505SS..Hα-helixtrans-63.8-45.5175.6-166.5100.3000111.4E45 I46 N51 K52 L53E45-L49 WeakPolarHBondContact O-CB 3.35Å; E45-L49 PolarHBondContact O-N 2.89Å; I46-L49 PolarHBondContact O-N 2.76Å; L49-N51 VanDerWaalsContact C-N 3.33Å; L49-N51 PolarHBondContact O-N 3.03Å; L49-K52 PolarHBondContact O-N 2.76Å; L49-L53 HydrophobicContact CD2-CD1 4.18Å; L49-L53 HydrophobicContact CG-CD1 4.44Å; L49-L53 WeakPolarHBondContact O-CG 3.35Å; L49-L53 PolarHBondContact O-N 2.85Å
50E81.5Confident82.6Confident89 Ų89103.7 Ų103.742%0.41651%0.513SS..Hα-helixtrans-60.8-41.6175.7-79.5-172.7-178.800111.9I46 R47 L53 R54I46-E50 PolarHBondContact O-N 3.26Å; R47-E50 PolarHBondContact O-N 2.89Å; E50-L53 PolarHBondContact O-N 3.47Å; E50-R54 WeakPolarHBondContact O-CG 3.5Å; E50-R54 PolarHBondContact O-N 2.76Å
51N84Confident83.1Confident96 Ų96103.5 Ų103.551%0.51351%0.514SS..Hα-helixtrans-64.7-41.7175.7-75.8-16.3000112R47 E48 L49 R54 S55R47-N51 WeakPolarHBondContact O-CB 3.37Å; R47-N51 VanDerWaalsContact O-CG 3.28Å; R47-N51 PolarHBondContact O-N 2.91Å; R47-N51 PolarHBondContact O-ND2 2.78Å; E48-N51 PolarHBondContact O-N 3.5Å; L49-N51 VanDerWaalsContact C-N 3.33Å; L49-N51 PolarHBondContact O-N 3.03Å; N51-R54 PolarHBondContact O-N 2.96Å; N51-S55 WeakPolarHBondContact O-CB 3.42Å; N51-S55 PolarHBondContact O-N 3.48Å
52K86.1Confident83.6Confident138 Ų138105.9 Ų105.960%0.652%0.519SS*.Hα-helixtrans-61-44.9174-76.8172.1-177.3167.30111.2E48 L49 S55 A56E48-K52 WeakPolarHBondContact O-CB 3.36Å; E48-K52 WeakPolarHBondContact O-CG 3.45Å; E48-K52 PolarHBondContact O-N 3.2Å; L49-K52 PolarHBondContact O-N 2.76Å; K52-S55 WeakPolarHBondContact CA-OG 2.96Å; K52-S55 PolarHBondContact O-N 3.14Å; K52-S55 PolarHBondContact O-OG 2.91Å; K52-A56 PolarHBondContact O-N 3.48Å
53L85.7Confident84.2Confident95 Ų95106.1 Ų106.150%0.49752%0.523SS..Hα-helixtrans-63.1-44.1176.6-72.1171.4000112L49 E50 S55 A56 Y57L49-L53 HydrophobicContact CD2-CD1 4.18Å; L49-L53 HydrophobicContact CG-CD1 4.44Å; L49-L53 WeakPolarHBondContact O-CG 3.35Å; L49-L53 PolarHBondContact O-N 2.85Å; E50-L53 PolarHBondContact O-N 3.47Å; L53-S55 VanDerWaalsContact C-N 3.33Å; L53-S55 PolarHBondContact O-N 2.89Å; L53-A56 WeakPolarHBondContact O-CB 3.49Å; L53-A56 PolarHBondContact O-N 3.41Å; L53-Y57 VanDerWaalsContact O-CD2 3.26Å; L53-Y57 WeakPolarHBondContact O-CD2 3.26Å; L53-Y57 PolarHBondContact O-N 3.44Å
54R84.4Confident84.7Confident163 Ų163107.3 Ų107.362%0.61554%0.535SS*.Hα-helixtrans-59.4-43.7174-72.3176.1-165-118.55.3111.6E50 N51 A56 Y57 V58E50-R54 WeakPolarHBondContact O-CG 3.5Å; E50-R54 PolarHBondContact O-N 2.76Å; N51-R54 PolarHBondContact O-N 2.96Å; R54-A56 VanDerWaalsContact C-N 3.3Å; R54-A56 PolarHBondContact O-N 3.25Å; R54-Y57 PolarHBondContact O-N 2.9Å; R54-V58 WeakPolarHBondContact O-CG2 3.3Å; R54-V58 PolarHBondContact O-N 3.22Å
55S85.2Confident85.2Confident72 Ų72106.5 Ų106.550%0.50353%0.529SS..Hα-helixtrans-63.2-36.4177.374.70000112.5N51 K52 L53 V58 A59N51-S55 WeakPolarHBondContact O-CB 3.42Å; N51-S55 PolarHBondContact O-N 3.48Å; K52-S55 WeakPolarHBondContact CA-OG 2.96Å; K52-S55 PolarHBondContact O-N 3.14Å; K52-S55 PolarHBondContact O-OG 2.91Å; L53-S55 VanDerWaalsContact C-N 3.33Å; L53-S55 PolarHBondContact O-N 2.89Å; S55-V58 PolarHBondContact O-N 3.01Å; S55-A59 WeakPolarHBondContact O-CB 3.49Å; S55-A59 PolarHBondContact O-N 2.72Å
56A87.4Confident85.5Confident58 Ų58105 Ų10548%0.47952%0.523SS..Hα-helixtrans-67.1-38.617500000112.2K52 L53 R54 A59 K60K52-A56 PolarHBondContact O-N 3.48Å; L53-A56 WeakPolarHBondContact O-CB 3.49Å; L53-A56 PolarHBondContact O-N 3.41Å; R54-A56 VanDerWaalsContact C-N 3.3Å; R54-A56 PolarHBondContact O-N 3.25Å; A56-A59 PolarHBondContact O-N 2.76Å; A56-K60 WeakPolarHBondContact O-CB 3.21Å; A56-K60 PolarHBondContact O-N 3.25Å
57Y87.5Confident86Confident168 Ų168104.6 Ų104.666%0.65953%0.529SS*.Hα-helixtrans-63.7-44.2173.4-84.7-71.1000112.1L53 R54 A59 K60 E61L53-Y57 VanDerWaalsContact O-CD2 3.26Å; L53-Y57 WeakPolarHBondContact O-CD2 3.26Å; L53-Y57 PolarHBondContact O-N 3.44Å; R54-Y57 PolarHBondContact O-N 2.9Å; Y57-A59 VanDerWaalsContact C-N 3.35Å; Y57-A59 PolarHBondContact O-N 2.78Å; Y57-K60 WeakPolarHBondContact O-CB 2.87Å; Y57-K60 PolarHBondContact O-N 3.4Å; Y57-E61 PolarHBondContact O-N 3.02Å
58V87.4Confident86.3Confident75 Ų75104.1 Ų104.146%0.45553%0.533SS..Hα-helixtrans-61.8-43.3175.4173.60000111R54 S55 K60 E61 Q62R54-V58 WeakPolarHBondContact O-CG2 3.3Å; R54-V58 PolarHBondContact O-N 3.22Å; S55-V58 PolarHBondContact O-N 3.01Å; V58-K60 VanDerWaalsContact C-N 3.33Å; V58-K60 PolarHBondContact O-N 2.94Å; V58-E61 PolarHBondContact O-N 3Å; V58-Q62 HydrophobicContact CG1-CG 4.35Å; V58-Q62 WeakPolarHBondContact O-CB 2.96Å; V58-Q62 WeakPolarHBondContact O-CG 3.43Å; V58-Q62 PolarHBondContact O-N 3.44Å
59A86.7Confident86.5Confident50 Ų50106.4 Ų106.441%0.41354%0.541SS..Hα-helixtrans-62.2-39.7176.600000112.1S55 A56 Y57 L63S55-A59 WeakPolarHBondContact O-CB 3.49Å; S55-A59 PolarHBondContact O-N 2.72Å; A56-A59 PolarHBondContact O-N 2.76Å; Y57-A59 VanDerWaalsContact C-N 3.35Å; Y57-A59 PolarHBondContact O-N 2.78Å; A59-L63 WeakPolarHBondContact O-CB 3.48Å; A59-L63 PolarHBondContact O-N 3.01Å
60K88.7Confident86.8Confident153 Ų153109.5 Ų109.567%0.66555%0.546SS*.Hα-helixtrans-62-43.4174.8-175.8-176177.2-175.40111.7A56 Y57 V58 L63 A64A56-K60 WeakPolarHBondContact O-CB 3.21Å; A56-K60 PolarHBondContact O-N 3.25Å; Y57-K60 WeakPolarHBondContact O-CB 2.87Å; Y57-K60 PolarHBondContact O-N 3.4Å; V58-K60 VanDerWaalsContact C-N 3.33Å; V58-K60 PolarHBondContact O-N 2.94Å; K60-L63 PolarHBondContact O-N 3.08Å; K60-A64 PolarHBondContact O-N 2.92Å; K60-A64 VanDerWaalsContact O-N 3.09Å
61E86.4Confident87.1Confident122 Ų122107.7 Ų107.757%0.5755%0.546SS*.Hα-helixtrans-68.1-42.9179.4-169.2173.317800112Y57 V58 L63 A64 Q65Y57-E61 PolarHBondContact O-N 3.02Å; V58-E61 PolarHBondContact O-N 3Å; E61-L63 VanDerWaalsContact C-N 3.28Å; E61-L63 PolarHBondContact O-N 3.45Å; E61-A64 PolarHBondContact O-N 3.38Å; E61-Q65 WeakPolarHBondContact O-CG 3.47Å; E61-Q65 PolarHBondContact O-N 3.09Å
62Q85.1Confident87.3Confident116 Ų116108 Ų10854%0.54255%0.547SS..Hα-helixtrans-59.5-39.7173.7-73.7178.2-700112.1V58 Q65 M66V58-Q62 HydrophobicContact CG1-CG 4.35Å; V58-Q62 WeakPolarHBondContact O-CB 2.96Å; V58-Q62 WeakPolarHBondContact O-CG 3.43Å; V58-Q62 PolarHBondContact O-N 3.44Å; Q62-Q65 PolarHBondContact O-N 3.03Å; Q62-M66 WeakPolarHBondContact O-CB 3.35Å; Q62-M66 WeakPolarHBondContact O-CG 3.33Å; Q62-M66 PolarHBondContact O-N 3.41Å
63L88.8Confident87.4Confident126 Ų126104.4 Ų104.466%0.6654%0.543SS*.Hα-helixtrans-66.8-38.7178.2-156.2149.7000111.5A59 K60 E61 M66 A67A59-L63 WeakPolarHBondContact O-CB 3.48Å; A59-L63 PolarHBondContact O-N 3.01Å; K60-L63 PolarHBondContact O-N 3.08Å; E61-L63 VanDerWaalsContact C-N 3.28Å; E61-L63 PolarHBondContact O-N 3.45Å; L63-M66 PolarHBondContact O-N 3Å; L63-A67 PolarHBondContact O-N 3.47Å
64A88.2Confident87.6Confident58 Ų58107.7 Ų107.748%0.47955%0.55SS..Hα-helixtrans-64-45.1173.200000112.1K60 E61 M66 A67 E68K60-A64 PolarHBondContact O-N 2.92Å; K60-A64 VanDerWaalsContact O-N 3.09Å; E61-A64 PolarHBondContact O-N 3.38Å; A64-M66 PolarHBondContact O-N 2.94Å; A64-A67 WeakPolarHBondContact O-CB 3.44Å; A64-A67 PolarHBondContact O-N 2.96Å; A64-E68 PolarHBondContact O-N 3.2Å
65Q88.3Confident87.8Confident99 Ų99104.3 Ų104.346%0.46354%0.544SS..Hα-helixtrans-63.5-38.9176.7-71.2-179.43.600112.6E61 Q62 A67 E68 K69E61-Q65 WeakPolarHBondContact O-CG 3.47Å; E61-Q65 PolarHBondContact O-N 3.09Å; Q62-Q65 PolarHBondContact O-N 3.03Å; Q65-A67 VanDerWaalsContact C-N 3.33Å; Q65-E68 PolarHBondContact O-N 3.37Å; Q65-K69 WeakPolarHBondContact O-CG 3.47Å; Q65-K69 PolarHBondContact O-N 2.95Å
66M88.6Confident88Confident122 Ų122105.5 Ų105.560%0.60154%0.544SS*.Hα-helixtrans-65.3-36.9174.6-78.9-165.3148.200112.2Q62 L63 A64 R70Q62-M66 WeakPolarHBondContact O-CB 3.35Å; Q62-M66 WeakPolarHBondContact O-CG 3.33Å; Q62-M66 PolarHBondContact O-N 3.41Å; L63-M66 PolarHBondContact O-N 3Å; A64-M66 PolarHBondContact O-N 2.94Å; M66-R70 WeakPolarHBondContact O-CB 3.49Å; M66-R70 WeakPolarHBondContact O-CG 3.49Å; M66-R70 PolarHBondContact O-N 3.17Å; M66-R70 VanDerWaalsContact O-N 3.08Å
67A88.9Confident88.1Confident54 Ų54108.9 Ų108.945%0.44655%0.552SS.*Hα-helixtrans-66.1-43.8174.700000111.5L63 A64 Q65 R70 A71L63-A67 PolarHBondContact O-N 3.47Å; A64-A67 WeakPolarHBondContact O-CB 3.44Å; A64-A67 PolarHBondContact O-N 2.96Å; Q65-A67 VanDerWaalsContact C-N 3.33Å; A67-R70 PolarHBondContact O-N 2.98Å; A67-A71 PolarHBondContact O-N 3.33Å
68E85.9Confident88.2Confident127 Ų127104.6 Ų104.659%0.59354%0.543SS*.Hα-helixtrans-63.2-46.1177.1-171.1-179.4-17800112.1A64 Q65 R70 A71 L72A64-E68 PolarHBondContact O-N 3.2Å; Q65-E68 PolarHBondContact O-N 3.37Å; E68-R70 VanDerWaalsContact C-N 3.29Å; E68-R70 PolarHBondContact O-N 3.35Å; E68-A71 PolarHBondContact O-N 2.94Å; E68-A71 VanDerWaalsContact O-N 3.17Å; E68-L72 HydrophobicContact CG-CD1 4.44Å; E68-L72 PolarHBondContact O-N 3.41Å
69K88.5Confident88.2Confident150 Ų150106.6 Ų106.665%0.65255%0.547SS*.Hα-helixtrans-61.4-36.6175.5-75.7-173.8179.1-175.80112.7Q65 A73Q65-K69 WeakPolarHBondContact O-CG 3.47Å; Q65-K69 PolarHBondContact O-N 2.95Å; K69-A73 WeakPolarHBondContact O-CB 3.44Å; K69-A73 PolarHBondContact O-N 3.18Å
70R89.1Confident88.3Confident169 Ų169109.8 Ų109.864%0.63855%0.554SS**Hα-helixtrans-67.4-42.6174.6-78.4179-176.4154.32.2111.4M66 A67 E68 A73 Y74M66-R70 WeakPolarHBondContact O-CB 3.49Å; M66-R70 WeakPolarHBondContact O-CG 3.49Å; M66-R70 PolarHBondContact O-N 3.17Å; M66-R70 VanDerWaalsContact O-N 3.08Å; A67-R70 PolarHBondContact O-N 2.98Å; E68-R70 VanDerWaalsContact C-N 3.29Å; E68-R70 PolarHBondContact O-N 3.35Å; R70-A73 PolarHBondContact O-N 3.11Å; R70-Y74 VanDerWaalsContact O-CD2 3.24Å; R70-Y74 WeakPolarHBondContact O-CD2 3.24Å; R70-Y74 PolarHBondContact O-N 3.29Å
71A87.5Confident88.3Confident50 Ų50105 Ų10541%0.41354%0.542SS..Hα-helixtrans-59.4-49.917600000111.2A67 E68 A73 Y74 D75A67-A71 PolarHBondContact O-N 3.33Å; E68-A71 PolarHBondContact O-N 2.94Å; E68-A71 VanDerWaalsContact O-N 3.17Å; A71-A73 VanDerWaalsContact C-N 3.32Å; A71-A73 PolarHBondContact O-N 2.94Å; A71-Y74 WeakPolarHBondContact O-CB 3.44Å; A71-Y74 PolarHBondContact O-N 3.38Å; A71-Y74 VanDerWaalsContact O-N 3.11Å; A71-D75 PolarHBondContact O-N 3.1Å
72L88.1Confident88.5Confident104 Ų104104.2 Ų104.255%0.54554%0.542SS..Hα-helixtrans-59.9-39.6176.8-71.6171.7000113E68 Y74 D75 L76E68-L72 HydrophobicContact CG-CD1 4.44Å; E68-L72 PolarHBondContact O-N 3.41Å; L72-Y74 VanDerWaalsContact C-N 3.35Å; L72-D75 PolarHBondContact O-N 3.27Å; L72-L76 WeakPolarHBondContact O-CB 3.4Å; L72-L76 PolarHBondContact O-N 3.46Å
73A89.8Confident88.6Confident62 Ų62104.7 Ų104.751%0.51254%0.544SS..Hα-helixtrans-66.3-36.9176.500000112.3K69 R70 A71 M77K69-A73 WeakPolarHBondContact O-CB 3.44Å; K69-A73 PolarHBondContact O-N 3.18Å; R70-A73 PolarHBondContact O-N 3.11Å; A71-A73 VanDerWaalsContact C-N 3.32Å; A71-A73 PolarHBondContact O-N 2.94Å; A73-M77 WeakPolarHBondContact O-CB 3.42Å; A73-M77 PolarHBondContact O-N 3.43Å; A73-M77 VanDerWaalsContact O-N 3.1Å
74Y89.2Confident88.6Confident164 Ų164101 Ų10164%0.64353%0.531SS*.Hα-helixtrans-66.2-45.9173.6-89.8-69.9000111.5R70 A71 L72 L76 M77 T78R70-Y74 VanDerWaalsContact O-CD2 3.24Å; R70-Y74 WeakPolarHBondContact O-CD2 3.24Å; R70-Y74 PolarHBondContact O-N 3.29Å; A71-Y74 WeakPolarHBondContact O-CB 3.44Å; A71-Y74 PolarHBondContact O-N 3.38Å; A71-Y74 VanDerWaalsContact O-N 3.11Å; L72-Y74 VanDerWaalsContact C-N 3.35Å; Y74-L76 PolarHBondContact O-N 3Å; Y74-M77 PolarHBondContact O-N 2.93Å; Y74-T78 WeakPolarHBondContact O-CG2 3.48Å; Y74-T78 PolarHBondContact O-N 2.98Å
75D88.7Confident88.6Confident91 Ų91103.2 Ų103.249%0.48754%0.535SS..Hα-helixtrans-59.6-47.7178.9-66.8-24.4000110.8A71 L72 M77 T78 E79A71-D75 PolarHBondContact O-N 3.1Å; L72-D75 PolarHBondContact O-N 3.27Å; D75-M77 PolarHBondContact O-N 3.34Å; D75-T78 PolarHBondContact O-N 3.29Å; D75-T78 VanDerWaalsContact O-N 3.09Å; D75-T78 PolarHBondContact O-OG1 3.37Å; D75-E79 PolarHBondContact O-N 2.95Å
76L90.2Very high88.6Confident98 Ų98104.4 Ų104.451%0.51354%0.541SS..Hα-helixtrans-59.2-44.4177.5-161.7111.2000112.2L72 Y74 T78 E79 E80L72-L76 WeakPolarHBondContact O-CB 3.4Å; L72-L76 PolarHBondContact O-N 3.46Å; Y74-L76 PolarHBondContact O-N 3Å; L76-T78 VanDerWaalsContact C-N 3.28Å; L76-T78 PolarHBondContact O-N 2.97Å; L76-E79 PolarHBondContact O-N 2.69Å; L76-E80 WeakPolarHBondContact CD2-OE1 3.35Å; L76-E80 WeakPolarHBondContact O-CG 3.39Å; L76-E80 PolarHBondContact O-N 3.09Å
77M89.4Confident88.6Confident129 Ų129103.1 Ų103.164%0.63554%0.536SS*.Hα-helixtrans-62.3-36.5176.9-175.2-179.4176.300111.9A73 Y74 D75 A81A73-M77 WeakPolarHBondContact O-CB 3.42Å; A73-M77 PolarHBondContact O-N 3.43Å; A73-M77 VanDerWaalsContact O-N 3.1Å; Y74-M77 PolarHBondContact O-N 2.93Å; D75-M77 PolarHBondContact O-N 3.34Å; M77-A81 WeakPolarHBondContact O-CB 3.4Å; M77-A81 PolarHBondContact O-N 3.05Å
78T88.3Confident88.5Confident78 Ų78105.4 Ų105.448%0.47954%0.54SS..Hα-helixtrans-70.3-40.1176.960.40000112.5Y74 D75 L76 A81 L82Y74-T78 WeakPolarHBondContact O-CG2 3.48Å; Y74-T78 PolarHBondContact O-N 2.98Å; D75-T78 PolarHBondContact O-N 3.29Å; D75-T78 VanDerWaalsContact O-N 3.09Å; D75-T78 PolarHBondContact O-OG1 3.37Å; L76-T78 VanDerWaalsContact C-N 3.28Å; L76-T78 PolarHBondContact O-N 2.97Å; T78-A81 PolarHBondContact O-N 3.24Å; T78-L82 WeakPolarHBondContact O-CG 3.42Å; T78-L82 PolarHBondContact O-N 3.34Å
79E88.1Confident88.6Confident117 Ų117102.7 Ų102.755%0.54754%0.535SS..Hα-helixtrans-64.9-45.3176.1-70.5-174169.500111.6D75 L76 A81 L82 Q83D75-E79 PolarHBondContact O-N 2.95Å; L76-E79 PolarHBondContact O-N 2.69Å; E79-A81 VanDerWaalsContact C-N 3.33Å; E79-A81 PolarHBondContact O-N 3.39Å; E79-L82 PolarHBondContact O-N 3.48Å; E79-Q83 WeakPolarHBondContact O-CG 3.33Å; E79-Q83 PolarHBondContact O-N 2.92Å
80E88.9Confident88.6Confident117 Ų117101 Ų10155%0.54753%0.53SS..Hα-helixtrans-60-42.1175.5-73.6-179.9170.800111.6L76 L82 Q83 A84L76-E80 WeakPolarHBondContact CD2-OE1 3.35Å; L76-E80 WeakPolarHBondContact O-CG 3.39Å; L76-E80 PolarHBondContact O-N 3.09Å; E80-L82 VanDerWaalsContact C-N 3.35Å; E80-L82 PolarHBondContact O-N 2.93Å; E80-Q83 PolarHBondContact O-N 3.21Å; E80-A84 WeakPolarHBondContact O-CB 3.4Å; E80-A84 PolarHBondContact O-N 3.43Å
81A89.2Confident88.5Confident51 Ų5196.9 Ų96.942%0.42152%0.52SS..Hα-helixtrans-64.6-38.5176.900000112.3M77 T78 E79 N85M77-A81 WeakPolarHBondContact O-CB 3.4Å; M77-A81 PolarHBondContact O-N 3.05Å; T78-A81 PolarHBondContact O-N 3.24Å; E79-A81 VanDerWaalsContact C-N 3.33Å; E79-A81 PolarHBondContact O-N 3.39Å; A81-N85 WeakPolarHBondContact O-CB 3.41Å; A81-N85 VanDerWaalsContact O-CG 3.27Å; A81-N85 PolarHBondContact O-N 2.96Å; A81-N85 PolarHBondContact O-ND2 3.46Å
82L90.4Very high88.4Confident107 Ų10795.8 Ų95.856%0.5651%0.514SS*.Hα-helixtrans-66.7-44.3175.7-74.4174.3000111.8T78 E79 E80 N85 Q86T78-L82 WeakPolarHBondContact O-CG 3.42Å; T78-L82 PolarHBondContact O-N 3.34Å; E79-L82 PolarHBondContact O-N 3.48Å; E80-L82 VanDerWaalsContact C-N 3.35Å; E80-L82 PolarHBondContact O-N 2.93Å; L82-N85 PolarHBondContact O-N 3Å; L82-Q86 WeakPolarHBondContact O-CG 3.31Å; L82-Q86 PolarHBondContact O-N 3.39Å
83Q87.4Confident88.5Confident126 Ų12694.8 Ų94.859%0.58951%0.509SS*.Hα-helixtrans-63.5-42.9177.1-70.8179.311.200111.6E79 E80 N85 Q86 L87E79-Q83 WeakPolarHBondContact O-CG 3.33Å; E79-Q83 PolarHBondContact O-N 2.92Å; E80-Q83 PolarHBondContact O-N 3.21Å; Q83-N85 VanDerWaalsContact C-N 3.35Å; Q83-N85 PolarHBondContact O-N 3.26Å; Q83-Q86 PolarHBondContact O-N 2.96Å; Q83-L87 PolarHBondContact O-N 3.42Å
84A88.3Confident88.4Confident47 Ų4796.2 Ų96.239%0.38851%0.508SS..Hα-helixtrans-61.8-41.817600000112.1E80 L87 N88E80-A84 WeakPolarHBondContact O-CB 3.4Å; E80-A84 PolarHBondContact O-N 3.43Å; A84-L87 PolarHBondContact O-N 3.03Å; A84-N88 WeakPolarHBondContact O-CB 3.4Å; A84-N88 VanDerWaalsContact O-CG 3.26Å; A84-N88 PolarHBondContact O-N 3.43Å; A84-N88 PolarHBondContact O-ND2 3.3Å
85N87.6Confident88.4Confident106 Ų10693.9 Ų93.957%0.56751%0.506SS*.Hα-helixtrans-64.9-40.9176.2-77.3-24.5000112.5A81 L82 Q83 N88 S89A81-N85 WeakPolarHBondContact O-CB 3.41Å; A81-N85 VanDerWaalsContact O-CG 3.27Å; A81-N85 PolarHBondContact O-N 2.96Å; A81-N85 PolarHBondContact O-ND2 3.46Å; L82-N85 PolarHBondContact O-N 3Å; Q83-N85 VanDerWaalsContact C-N 3.35Å; Q83-N85 PolarHBondContact O-N 3.26Å; N85-N88 PolarHBondContact O-N 3.31Å; N85-S89 WeakPolarHBondContact O-CB 3.38Å; N85-S89 PolarHBondContact O-N 2.98Å
86Q88.5Confident88.5Confident123 Ų12393.7 Ų93.758%0.57550%0.504SS*.Hα-helixtrans-63.1-44.9175.9-74.1176.9-0.200111.7L82 Q83 S89 Q90L82-Q86 WeakPolarHBondContact O-CG 3.31Å; L82-Q86 PolarHBondContact O-N 3.39Å; Q83-Q86 PolarHBondContact O-N 2.96Å; Q86-S89 PolarHBondContact O-N 3.46Å; Q86-Q90 WeakPolarHBondContact O-CG 3.35Å; Q86-Q90 PolarHBondContact O-N 3.25Å
87L87.9Confident88.5Confident96 Ų9694.4 Ų94.450%0.50350%0.503SS..Hα-helixtrans-62.7-44.7177.7-176.164.4000111.5Q83 A84 S89 Q90 I91Q83-L87 PolarHBondContact O-N 3.42Å; A84-L87 PolarHBondContact O-N 3.03Å; L87-S89 VanDerWaalsContact C-N 3.32Å; L87-S89 PolarHBondContact O-N 2.97Å; L87-Q90 PolarHBondContact O-N 3.04Å; L87-I91 HydrophobicContact CD1-CD1 4.34Å; L87-I91 HydrophobicContact CG-CD1 3.96Å; L87-I91 VanDerWaalsContact O-CG1 3.31Å; L87-I91 WeakPolarHBondContact O-CG1 3.29Å; L87-I91 PolarHBondContact O-N 2.99Å
88N87.6Confident88.4Confident101 Ų10190.7 Ų90.754%0.5449%0.493SS..Hα-helixtrans-62.8-38177.3-73.7-26.1000112.4A84 N85 G92A84-N88 WeakPolarHBondContact O-CB 3.4Å; A84-N88 VanDerWaalsContact O-CG 3.26Å; A84-N88 PolarHBondContact O-N 3.43Å; A84-N88 PolarHBondContact O-ND2 3.3Å; N85-N88 PolarHBondContact O-N 3.31Å; N88-G92 PolarHBondContact O-N 2.96Å
89S87.9Confident88.4Confident70 Ų7093.1 Ų93.149%0.4950%0.499SS..Hα-helixtrans-63.8-43.7174.9-167.30000111.7N85 Q86 L87 G92 D93N85-S89 WeakPolarHBondContact O-CB 3.38Å; N85-S89 PolarHBondContact O-N 2.98Å; Q86-S89 PolarHBondContact O-N 3.46Å; L87-S89 VanDerWaalsContact C-N 3.32Å; L87-S89 PolarHBondContact O-N 2.97Å; S89-G92 PolarHBondContact O-N 2.98Å; S89-D93 PolarHBondContact O-N 3.4Å
90Q87.5Confident88.5Confident114 Ų11492.5 Ų92.553%0.53350%0.496SS..Hα-helixtrans-64.5-43.5178.3-71.5173.50.900111.9Q86 L87 G92 D93 D94Q86-Q90 WeakPolarHBondContact O-CG 3.35Å; Q86-Q90 PolarHBondContact O-N 3.25Å; L87-Q90 PolarHBondContact O-N 3.04Å; Q90-G92 VanDerWaalsContact C-N 3.29Å; Q90-G92 PolarHBondContact O-N 3.47Å; Q90-D93 PolarHBondContact O-N 3.08Å; Q90-D94 PolarHBondContact O-N 3.26Å
91I88Confident88.5Confident83 Ų8392.4 Ų92.443%0.42650%0.495SS..Hα-helixtrans-60.3-41.9175.1-67.1167.7000110.5L87 D94 L95L87-I91 HydrophobicContact CD1-CD1 4.34Å; L87-I91 HydrophobicContact CG-CD1 3.96Å; L87-I91 VanDerWaalsContact O-CG1 3.31Å; L87-I91 WeakPolarHBondContact O-CG1 3.29Å; L87-I91 PolarHBondContact O-N 2.99Å; I91-D94 PolarHBondContact O-N 3Å; I91-L95 HydrophobicContact CG2-CD1 3.97Å; I91-L95 HydrophobicContact CG2-CG 4.49Å; I91-L95 WeakPolarHBondContact O-CB 3.49Å; I91-L95 VanDerWaalsContact O-CG 3.29Å; I91-L95 WeakPolarHBondContact O-CG 3.5Å; I91-L95 PolarHBondContact O-N 3.47Å
92G86.1Confident88.4Confident28 Ų2893.9 Ų93.929%0.28949%0.493SS..Hα-helixtrans-60-47.5175.200000112.7N88 S89 Q90 D94 L95 I96N88-G92 PolarHBondContact O-N 2.96Å; S89-G92 PolarHBondContact O-N 2.98Å; Q90-G92 VanDerWaalsContact C-N 3.29Å; Q90-G92 PolarHBondContact O-N 3.47Å; G92-D94 PolarHBondContact O-N 3.18Å; G92-L95 PolarHBondContact O-N 2.96Å; G92-I96 VanDerWaalsContact O-CG1 3.31Å; G92-I96 WeakPolarHBondContact O-CG1 3.44Å; G92-I96 PolarHBondContact O-N 3.26Å; G92-I96 VanDerWaalsContact O-N 3.08Å
93D88.9Confident88.4Confident82 Ų8292.5 Ų92.544%0.43949%0.486SS..Hα-helixtrans-63.9-39.9179.1-71.5-23.4000112.4S89 Q90 I96 K97S89-D93 PolarHBondContact O-N 3.4Å; Q90-D93 PolarHBondContact O-N 3.08Å; D93-I96 PolarHBondContact O-N 3.04Å; D93-K97 WeakPolarHBondContact O-CG 3.31Å; D93-K97 PolarHBondContact O-N 3.38Å
94D88.1Confident88.6Confident93 Ų9394.7 Ų94.750%0.49749%0.489SS..Hα-helixtrans-71.7-35.2179.8-71.6-16.7000112.2Q90 I91 G92 K97 A98Q90-D94 PolarHBondContact O-N 3.26Å; I91-D94 PolarHBondContact O-N 3Å; G92-D94 PolarHBondContact O-N 3.18Å; D94-K97 PolarHBondContact O-N 2.96Å; D94-K97 IonicContact OD1-NZ 3.44Å; D94-K97 PolarHBondContact OD1-NZ 3.41Å; D94-A98 WeakPolarHBondContact O-CB 3.29Å; D94-A98 PolarHBondContact O-N 3.35Å
95L90Very high88.6Confident114 Ų11499.2 Ų99.260%0.59750%0.496SS*.Hα-helixtrans-62-43.7170.8-76.6168.3000111.7I91 G92 K97 A98 E99I91-L95 HydrophobicContact CG2-CD1 3.97Å; I91-L95 HydrophobicContact CG2-CG 4.49Å; I91-L95 WeakPolarHBondContact O-CB 3.49Å; I91-L95 VanDerWaalsContact O-CG 3.29Å; I91-L95 WeakPolarHBondContact O-CG 3.5Å; I91-L95 PolarHBondContact O-N 3.47Å; G92-L95 PolarHBondContact O-N 2.96Å; L95-K97 PolarHBondContact O-N 3.48Å; L95-A98 PolarHBondContact O-N 2.96Å; L95-E99 WeakPolarHBondContact O-CB 3.42Å; L95-E99 PolarHBondContact O-N 3.02Å
96I89.9Confident88.7Confident88 Ų88100 Ų10045%0.45149%0.494SS..Hα-helixtrans-62.9-43.4177.5-67.5165000110.8G92 D93 E99 Q100G92-I96 VanDerWaalsContact O-CG1 3.31Å; G92-I96 WeakPolarHBondContact O-CG1 3.44Å; G92-I96 PolarHBondContact O-N 3.26Å; G92-I96 VanDerWaalsContact O-N 3.08Å; D93-I96 PolarHBondContact O-N 3.04Å; I96-E99 PolarHBondContact O-N 3.39Å; I96-Q100 VanDerWaalsContact O-CG 3.32Å; I96-Q100 WeakPolarHBondContact O-CG 3.34Å; I96-Q100 PolarHBondContact O-N 2.95Å
97K89.7Confident88.9Confident113 Ų11399.2 Ų99.249%0.49149%0.49SS..Hα-helixtrans-62.8-44.1177-70.9169.7-163.4155.50111.8D93 D94 L95 E99 Q100 E101D93-K97 WeakPolarHBondContact O-CG 3.31Å; D93-K97 PolarHBondContact O-N 3.38Å; D94-K97 PolarHBondContact O-N 2.96Å; D94-K97 IonicContact OD1-NZ 3.44Å; D94-K97 PolarHBondContact OD1-NZ 3.41Å; L95-K97 PolarHBondContact O-N 3.48Å; K97-E99 VanDerWaalsContact C-N 3.34Å; K97-E99 PolarHBondContact O-N 2.91Å; K97-Q100 PolarHBondContact O-N 3.39Å; K97-E101 PolarHBondContact O-N 3.32Å
98A88.3Confident88.9Confident51 Ų5198 Ų9842%0.42149%0.49SS..Hα-helixtrans-62.2-41.6177.800000111.8D94 L95 E101 E102D94-A98 WeakPolarHBondContact O-CB 3.29Å; D94-A98 PolarHBondContact O-N 3.35Å; L95-A98 PolarHBondContact O-N 2.96Å; A98-E101 PolarHBondContact O-N 3.5Å; A98-E102 PolarHBondContact O-N 3.4Å
99E88.4Confident89.1Confident129 Ų12999.6 Ų99.660%0.60349%0.494SS*.Hα-helixtrans-63.6-42175.6-172.8173.4-160.600111.9L95 I96 K97 E101 E102 I103L95-E99 WeakPolarHBondContact O-CB 3.42Å; L95-E99 PolarHBondContact O-N 3.02Å; I96-E99 PolarHBondContact O-N 3.39Å; K97-E99 VanDerWaalsContact C-N 3.34Å; K97-E99 PolarHBondContact O-N 2.91Å; E99-E101 PolarHBondContact O-N 3.27Å; E99-E102 PolarHBondContact O-N 2.99Å; E99-I103 HydrophobicContact CG-CD1 4.1Å; E99-I103 VanDerWaalsContact O-CG1 3.29Å; E99-I103 WeakPolarHBondContact O-CG1 3.33Å; E99-I103 PolarHBondContact O-N 2.98Å
100Q90.2Very high89.3Confident103 Ų103100.7 Ų100.748%0.48149%0.494SS..Hα-helixtrans-63.3-40.2176.1-73.3177.94.500112.8I96 K97 I103 R104I96-Q100 VanDerWaalsContact O-CG 3.32Å; I96-Q100 WeakPolarHBondContact O-CG 3.34Å; I96-Q100 PolarHBondContact O-N 2.95Å; K97-Q100 PolarHBondContact O-N 3.39Å; Q100-I103 PolarHBondContact O-N 3.27Å; Q100-R104 WeakPolarHBondContact O-CG 3.32Å; Q100-R104 PolarHBondContact O-N 2.92Å
101E88.3Confident89.5Confident115 Ų115100.8 Ų100.854%0.53749%0.494SS..Hα-helixtrans-65.1-41.2175.1-77.4-173.8168.100112.1K97 A98 E99 R104 R105K97-E101 PolarHBondContact O-N 3.32Å; A98-E101 PolarHBondContact O-N 3.5Å; E99-E101 PolarHBondContact O-N 3.27Å; E101-R104 PolarHBondContact O-N 2.89Å; E101-R105 WeakPolarHBondContact O-CG 3.35Å; E101-R105 PolarHBondContact O-N 3.49Å
102E86.9Confident89.7Confident82 Ų82101.6 Ų101.638%0.38350%0.498SS..Hα-helixtrans-64.4-39.8174.8-80.8-62.2132.900112.3A98 E99 R105 K106A98-E102 PolarHBondContact O-N 3.4Å; E99-E102 PolarHBondContact O-N 2.99Å; E102-R105 PolarHBondContact O-N 3.33Å; E102-R105 IonicContact OE1-CZ 3.18Å; E102-R105 IonicContact OE1-NH1 2.91Å; E102-R105 PolarHBondContact OE1-NH1 3.23Å; E102-K106 WeakPolarHBondContact O-CB 3.49Å; E102-K106 WeakPolarHBondContact O-CG 3.41Å; E102-K106 PolarHBondContact O-N 3.33Å
103I91.4Very high90Very high78 Ų78107.6 Ų107.640%0.451%0.512SS..Hα-helixtrans-61.8-44.9173.1-69165.7000110.5E99 Q100 R105 K106 Q107E99-I103 HydrophobicContact CG-CD1 4.1Å; E99-I103 VanDerWaalsContact O-CG1 3.29Å; E99-I103 WeakPolarHBondContact O-CG1 3.33Å; E99-I103 PolarHBondContact O-N 2.98Å; Q100-I103 PolarHBondContact O-N 3.27Å; I103-R105 PolarHBondContact O-N 2.88Å; I103-K106 PolarHBondContact O-N 2.96Å; I103-Q107 HydrophobicContact CG2-CG 4.41Å; I103-Q107 WeakPolarHBondContact O-CB 3.47Å; I103-Q107 VanDerWaalsContact O-CG 3.32Å; I103-Q107 WeakPolarHBondContact O-CG 3.23Å; I103-Q107 PolarHBondContact O-N 2.96Å
104R90.7Very high90.2Very high172 Ų172107.7 Ų107.765%0.64951%0.513SS*.Hα-helixtrans-61.1-44.8176.7-76.5-178.7179.5-176.32.2111.9Q100 E101 K106 Q107 S108Q100-R104 WeakPolarHBondContact O-CG 3.32Å; Q100-R104 PolarHBondContact O-N 2.92Å; E101-R104 PolarHBondContact O-N 2.89Å; R104-K106 PolarHBondContact O-N 3.46Å; R104-Q107 PolarHBondContact O-N 3.42Å; R104-S108 PolarHBondContact O-N 2.93Å; R104-S108 PolarHBondContact O-OG 2.95Å
105R88.8Confident90.4Very high143 Ų143108.4 Ų108.454%0.5451%0.513SS..Hα-helixtrans-59.5-45.7176.3-74.1174.4-179.8176.10.6111.8E101 E102 I103 S108 Q109E101-R105 WeakPolarHBondContact O-CG 3.35Å; E101-R105 PolarHBondContact O-N 3.49Å; E102-R105 PolarHBondContact O-N 3.33Å; E102-R105 IonicContact OE1-CZ 3.18Å; E102-R105 IonicContact OE1-NH1 2.91Å; E102-R105 PolarHBondContact OE1-NH1 3.23Å; I103-R105 PolarHBondContact O-N 2.88Å; R105-S108 PolarHBondContact O-N 3.36Å; R105-Q109 WeakPolarHBondContact O-CG 3.33Å; R105-Q109 PolarHBondContact O-N 3.25Å
106K89.6Confident90.5Very high121 Ų121107.1 Ų107.153%0.52651%0.507SS..Hα-helixtrans-62.3-42.3176-72.7173.9-175.9174.50111.6E102 I103 R104 Q109 I110E102-K106 WeakPolarHBondContact O-CB 3.49Å; E102-K106 WeakPolarHBondContact O-CG 3.41Å; E102-K106 PolarHBondContact O-N 3.33Å; I103-K106 PolarHBondContact O-N 2.96Å; R104-K106 PolarHBondContact O-N 3.46Å; K106-Q109 PolarHBondContact O-N 3.5Å; K106-I110 WeakPolarHBondContact O-CD1 3.32Å; K106-I110 VanDerWaalsContact O-CG1 3.23Å; K106-I110 WeakPolarHBondContact O-CG1 3.48Å; K106-I110 PolarHBondContact O-N 3.38Å
107Q91.7Very high90.6Very high107 Ų107106.2 Ų106.250%0.550%0.503SS..Hα-helixtrans-61.7-45.4175.8-75.1175.4-11.900111.9I103 R104 Q109 I110 Q111I103-Q107 HydrophobicContact CG2-CG 4.41Å; I103-Q107 WeakPolarHBondContact O-CB 3.47Å; I103-Q107 VanDerWaalsContact O-CG 3.32Å; I103-Q107 WeakPolarHBondContact O-CG 3.23Å; I103-Q107 PolarHBondContact O-N 2.96Å; R104-Q107 PolarHBondContact O-N 3.42Å; Q107-Q109 VanDerWaalsContact C-N 3.35Å; Q107-Q109 PolarHBondContact O-N 3.47Å; Q107-I110 PolarHBondContact O-N 2.94Å; Q107-Q111 WeakPolarHBondContact O-CG 3.45Å; Q107-Q111 PolarHBondContact O-N 3.4Å
108S89.7Confident90.8Very high70 Ų70104.5 Ų104.549%0.4950%0.502SS..Hα-helixtrans-63-39.1175.9-60.20000112.5R104 R105 Q111 L112R104-S108 PolarHBondContact O-N 2.93Å; R104-S108 PolarHBondContact O-OG 2.95Å; R105-S108 PolarHBondContact O-N 3.36Å; S108-Q111 PolarHBondContact O-N 3.35Å; S108-L112 WeakPolarHBondContact O-CB 3.38Å; S108-L112 PolarHBondContact O-N 3.17Å
109Q90.6Very high91Very high135 Ų135106.9 Ų106.963%0.63150%0.504SS*.Hα-helixtrans-65.4-39.5174.5-74.2177.37.100112.3R105 K106 Q107 R113R105-Q109 WeakPolarHBondContact O-CG 3.33Å; R105-Q109 PolarHBondContact O-N 3.25Å; K106-Q109 PolarHBondContact O-N 3.5Å; Q107-Q109 VanDerWaalsContact C-N 3.35Å; Q107-Q109 PolarHBondContact O-N 3.47Å; Q109-R113 WeakPolarHBondContact O-CB 3.45Å; Q109-R113 PolarHBondContact O-N 2.89Å
110I92.7Very high91.1Very high94 Ų94105.4 Ų105.448%0.48250%0.499SS..Hα-helixtrans-65.4-42.8175.5-69163.4000110.5K106 Q107 R113 N114K106-I110 WeakPolarHBondContact O-CD1 3.32Å; K106-I110 VanDerWaalsContact O-CG1 3.23Å; K106-I110 WeakPolarHBondContact O-CG1 3.48Å; K106-I110 PolarHBondContact O-N 3.38Å; Q107-I110 PolarHBondContact O-N 2.94Å; I110-R113 PolarHBondContact O-N 3.28Å; I110-N114 WeakPolarHBondContact O-CB 3.34Å; I110-N114 PolarHBondContact O-N 3.14Å; I110-N114 PolarHBondContact O-ND2 3.37Å; I110-N114 PolarHBondContact O-OD1 3Å
111Q92.3Very high91.2Very high115 Ų115105.9 Ų105.954%0.53750%0.503SS..Hα-helixtrans-60.2-50.5175.9-74.1172.1-8.600111.3Q107 S108 R113 N114 E115Q107-Q111 WeakPolarHBondContact O-CG 3.45Å; Q107-Q111 PolarHBondContact O-N 3.4Å; S108-Q111 PolarHBondContact O-N 3.35Å; Q111-R113 VanDerWaalsContact C-N 3.3Å; Q111-R113 PolarHBondContact O-N 3.47Å; Q111-N114 PolarHBondContact O-N 2.9Å; Q111-N114 VanDerWaalsContact O-N 3.14Å; Q111-E115 WeakPolarHBondContact O-CG 3.33Å; Q111-E115 PolarHBondContact O-N 3.5Å
112L91.8Very high91.4Very high100 Ų100106.5 Ų106.552%0.52451%0.506SS..Hα-helixtrans-59.3-41.7177.3-179.863.5000112S108 E115 L116S108-L112 WeakPolarHBondContact O-CB 3.38Å; S108-L112 PolarHBondContact O-N 3.17Å; L112-E115 PolarHBondContact O-N 3.34Å; L112-L116 HydrophobicContact CG-CD1 4.44Å; L112-L116 WeakPolarHBondContact O-CG 3.35Å; L112-L116 PolarHBondContact O-N 2.9Å
113R91.4Very high91.6Very high154 Ų154108 Ų10858%0.58151%0.513SS*.Hα-helixtrans-62.7-44.5176178.8176.8163-111.2-15.7111.6Q109 I110 Q111 E115 L116 D117Q109-R113 WeakPolarHBondContact O-CB 3.45Å; Q109-R113 PolarHBondContact O-N 2.89Å; I110-R113 PolarHBondContact O-N 3.28Å; Q111-R113 VanDerWaalsContact C-N 3.3Å; Q111-R113 PolarHBondContact O-N 3.47Å; R113-E115 VanDerWaalsContact C-N 3.32Å; R113-E115 PolarHBondContact O-N 3.44Å; R113-L116 PolarHBondContact O-N 3.4Å; R113-D117 IonicContact CZ-OD2 3.91Å; R113-D117 IonicContact NE-OD2 2.95Å; R113-D117 IonicContact NH2-OD2 3.82Å; R113-D117 PolarHBondContact O-N 2.89Å
114N93.3Very high91.7Very high84 Ų84108.2 Ų108.245%0.44952%0.518SS..Hα-helixtrans-62.7-40.2177.8-68.4-15.7000111.3I110 Q111 D117 T118I110-N114 WeakPolarHBondContact O-CB 3.34Å; I110-N114 PolarHBondContact O-N 3.14Å; I110-N114 PolarHBondContact O-ND2 3.37Å; I110-N114 PolarHBondContact O-OD1 3Å; Q111-N114 PolarHBondContact O-N 2.9Å; Q111-N114 VanDerWaalsContact O-N 3.14Å; N114-D117 PolarHBondContact O-N 3.18Å; N114-T118 WeakPolarHBondContact O-CG2 3.37Å; N114-T118 PolarHBondContact O-N 2.97Å; N114-T118 PolarHBondContact O-OG1 3.29Å
115E93.2Very high91.8Very high109 Ų109105.1 Ų105.151%0.50951%0.51SS..Hα-helixtrans-61.6-45175-72.8171.1-168.900111.6Q111 L112 R113 T118 Q119Q111-E115 WeakPolarHBondContact O-CG 3.33Å; Q111-E115 PolarHBondContact O-N 3.5Å; L112-E115 PolarHBondContact O-N 3.34Å; R113-E115 VanDerWaalsContact C-N 3.32Å; R113-E115 PolarHBondContact O-N 3.44Å; E115-T118 WeakPolarHBondContact CA-OG1 3.43Å; E115-T118 PolarHBondContact O-N 3.21Å; E115-T118 PolarHBondContact O-OG1 3.41Å; E115-Q119 WeakPolarHBondContact O-CG 3.37Å; E115-Q119 PolarHBondContact O-N 3.36Å
116L92.1Very high92Very high87 Ų87103.5 Ų103.546%0.45551%0.512SS..Hα-helixtrans-62.5-43.1175.1-70.1173000112.1L112 R113 T118 Q119 I120L112-L116 HydrophobicContact CG-CD1 4.44Å; L112-L116 WeakPolarHBondContact O-CG 3.35Å; L112-L116 PolarHBondContact O-N 2.9Å; R113-L116 PolarHBondContact O-N 3.4Å; L116-T118 VanDerWaalsContact C-N 3.31Å; L116-T118 PolarHBondContact O-N 3.04Å; L116-Q119 PolarHBondContact O-N 3.03Å; L116-I120 WeakPolarHBondContact O-CG1 3.39Å; L116-I120 PolarHBondContact O-N 3.01Å
117D92.1Very high92.1Very high68 Ų68106.3 Ų106.336%0.36452%0.519SS..Hα-helixtrans-61.6-40.4176.4-75.1-19.8000110.7R113 N114 I120 M121R113-D117 IonicContact CZ-OD2 3.91Å; R113-D117 IonicContact NE-OD2 2.95Å; R113-D117 IonicContact NH2-OD2 3.82Å; R113-D117 PolarHBondContact O-N 2.89Å; N114-D117 PolarHBondContact O-N 3.18Å; D117-I120 PolarHBondContact O-N 2.66Å; D117-M121 WeakPolarHBondContact O-CG 3.33Å; D117-M121 PolarHBondContact O-N 3.28Å
118T93.7Very high92.1Very high77 Ų77107.6 Ų107.647%0.47252%0.523SS..Hα-helixtrans-63.3-42.5174.753.30000112.7N114 E115 L116 I120 M121 E122N114-T118 WeakPolarHBondContact O-CG2 3.37Å; N114-T118 PolarHBondContact O-N 2.97Å; N114-T118 PolarHBondContact O-OG1 3.29Å; E115-T118 WeakPolarHBondContact CA-OG1 3.43Å; E115-T118 PolarHBondContact O-N 3.21Å; E115-T118 PolarHBondContact O-OG1 3.41Å; L116-T118 VanDerWaalsContact C-N 3.31Å; L116-T118 PolarHBondContact O-N 3.04Å; T118-I120 VanDerWaalsContact C-N 3.33Å; T118-I120 PolarHBondContact O-N 3.28Å; T118-M121 PolarHBondContact O-N 2.9Å; T118-E122 WeakPolarHBondContact O-CG 3.41Å; T118-E122 PolarHBondContact O-N 2.92Å
119Q92.6Very high92.3Very high102 Ų102109.8 Ų109.848%0.47752%0.524SS..Hα-helixtrans-63.1-38.7177.1-70.8175.95.300112.2E115 L116 E122 Q123E115-Q119 WeakPolarHBondContact O-CG 3.37Å; E115-Q119 PolarHBondContact O-N 3.36Å; L116-Q119 PolarHBondContact O-N 3.03Å; Q119-E122 PolarHBondContact O-N 3.25Å; Q119-Q123 WeakPolarHBondContact O-CG 3.45Å; Q119-Q123 PolarHBondContact O-N 3.34Å
120I90.1Very high92.4Very high97 Ų97107.1 Ų107.150%0.49752%0.517SS..Hα-helixtrans-63.8-44.8175.8-68.1168.8000110.1L116 D117 T118 Q123 V124L116-I120 WeakPolarHBondContact O-CG1 3.39Å; L116-I120 PolarHBondContact O-N 3.01Å; D117-I120 PolarHBondContact O-N 2.66Å; T118-I120 VanDerWaalsContact C-N 3.33Å; T118-I120 PolarHBondContact O-N 3.28Å; I120-Q123 PolarHBondContact O-N 3.44Å; I120-V124 HydrophobicContact CG2-CG2 4.49Å; I120-V124 WeakPolarHBondContact O-CG2 3.4Å; I120-V124 PolarHBondContact O-N 2.98Å
121M92.3Very high92.4Very high114 Ų114109.4 Ų109.456%0.56252%0.52SS*.Hα-helixtrans-61.9-44.5177.9-69.8-61.3-67.600111.8D117 T118 Q123 V124 E125D117-M121 WeakPolarHBondContact O-CG 3.33Å; D117-M121 PolarHBondContact O-N 3.28Å; T118-M121 PolarHBondContact O-N 2.9Å; M121-Q123 VanDerWaalsContact C-N 3.34Å; M121-Q123 PolarHBondContact O-N 2.93Å; M121-V124 PolarHBondContact O-N 3.45Å; M121-E125 WeakPolarHBondContact O-CG 3.41Å; M121-E125 PolarHBondContact O-N 3.34Å
122E93Very high92.5Very high128 Ų128109 Ų10960%0.59852%0.519SS*.Hα-helixtrans-59.3-42.6175.5-72.8176.9176.700112.2T118 Q119 V124 E125 L126T118-E122 WeakPolarHBondContact O-CG 3.41Å; T118-E122 PolarHBondContact O-N 2.92Å; Q119-E122 PolarHBondContact O-N 3.25Å; E122-V124 PolarHBondContact O-N 3.03Å; E122-E125 PolarHBondContact O-N 3.3Å; E122-L126 WeakPolarHBondContact O-CB 3.3Å; E122-L126 PolarHBondContact O-N 3.38Å
123Q91Very high92.5Very high113 Ų113109.9 Ų109.953%0.52852%0.52SS..Hα-helixtrans-65-39175.8-74.1-171.419.500112.6Q119 I120 M121 L126 R127Q119-Q123 WeakPolarHBondContact O-CG 3.45Å; Q119-Q123 PolarHBondContact O-N 3.34Å; I120-Q123 PolarHBondContact O-N 3.44Å; M121-Q123 VanDerWaalsContact C-N 3.34Å; M121-Q123 PolarHBondContact O-N 2.93Å; Q123-L126 PolarHBondContact O-N 2.93Å; Q123-R127 VanDerWaalsContact O-CG 3.31Å; Q123-R127 WeakPolarHBondContact O-CG 3.33Å; Q123-R127 PolarHBondContact O-N 2.89Å
124V92.7Very high92.7Very high82 Ų82108.2 Ų108.250%0.49752%0.517SS..Hα-helixtrans-65.9-42.5176.5170.80000110.6I120 M121 E122 R127 K128I120-V124 HydrophobicContact CG2-CG2 4.49Å; I120-V124 WeakPolarHBondContact O-CG2 3.4Å; I120-V124 PolarHBondContact O-N 2.98Å; M121-V124 PolarHBondContact O-N 3.45Å; E122-V124 PolarHBondContact O-N 3.03Å; V124-R127 PolarHBondContact O-N 3.42Å; V124-K128 WeakPolarHBondContact O-CB 3.49Å; V124-K128 PolarHBondContact O-N 3.47Å
125E92.7Very high92.7Very high107 Ų107107.4 Ų107.450%0.551%0.512SS..Hα-helixtrans-63.3-41.9175.2-73.8-171.6174.100112.2M121 E122 K128 K129M121-E125 WeakPolarHBondContact O-CG 3.41Å; M121-E125 PolarHBondContact O-N 3.34Å; E122-E125 PolarHBondContact O-N 3.3Å; E125-K128 WeakPolarHBondContact O-CB 3.43Å; E125-K128 PolarHBondContact O-N 3.2Å; E125-K129 WeakPolarHBondContact O-CG 3.31Å; E125-K129 PolarHBondContact O-N 3.37Å
126L92.8Very high92.7Very high110 Ų110107.3 Ų107.358%0.57651%0.512SS*.Hα-helixtrans-61.7-45.4175.6-173.366.3000111.1E122 Q123 K128 K129 V130E122-L126 WeakPolarHBondContact O-CB 3.3Å; E122-L126 PolarHBondContact O-N 3.38Å; Q123-L126 PolarHBondContact O-N 2.93Å; L126-K128 VanDerWaalsContact C-N 3.28Å; L126-K128 PolarHBondContact O-N 2.9Å; L126-K129 PolarHBondContact O-N 3.2Å; L126-V130 WeakPolarHBondContact O-CG2 3.45Å; L126-V130 PolarHBondContact O-N 2.92Å
127R92.4Very high92.8Very high179 Ų179107.7 Ų107.768%0.67551%0.514SS*.Hα-helixtrans-59.8-39.3174.7-73173.9-170.2-103.42.7111.9Q123 V124 Y131Q123-R127 VanDerWaalsContact O-CG 3.31Å; Q123-R127 WeakPolarHBondContact O-CG 3.33Å; Q123-R127 PolarHBondContact O-N 2.89Å; V124-R127 PolarHBondContact O-N 3.42Å; R127-Y131 VanDerWaalsContact O-CB 3.3Å; R127-Y131 WeakPolarHBondContact O-CB 3.43Å; R127-Y131 PolarHBondContact O-N 3.38Å
128K92.2Very high92.9Very high134 Ų134109.7 Ų109.758%0.58352%0.52SS*.Hα-helixtrans-64.6-43.2176.4-173.1179.3177.4-176.90111.5V124 E125 L126 Y131 Q132V124-K128 WeakPolarHBondContact O-CB 3.49Å; V124-K128 PolarHBondContact O-N 3.47Å; E125-K128 WeakPolarHBondContact O-CB 3.43Å; E125-K128 PolarHBondContact O-N 3.2Å; L126-K128 VanDerWaalsContact C-N 3.28Å; L126-K128 PolarHBondContact O-N 2.9Å; K128-Y131 PolarHBondContact O-N 3.07Å; K128-Q132 VanDerWaalsContact O-CG 3.29Å; K128-Q132 WeakPolarHBondContact O-CG 3.44Å; K128-Q132 PolarHBondContact O-N 2.91Å
129K93.4Very high92.9Very high116 Ų116111.7 Ų111.750%0.50452%0.524SS..Hα-helixtrans-62.3-49.3175.5-71.8174.7-177172.30111.5E125 L126 Y131 Q132 E133E125-K129 WeakPolarHBondContact O-CG 3.31Å; E125-K129 PolarHBondContact O-N 3.37Å; L126-K129 PolarHBondContact O-N 3.2Å; K129-Y131 VanDerWaalsContact C-N 3.27Å; K129-Y131 PolarHBondContact O-N 2.95Å; K129-Q132 WeakPolarHBondContact O-CB 3.41Å; K129-Q132 PolarHBondContact O-N 3.48Å; K129-E133 WeakPolarHBondContact O-CG 3.44Å; K129-E133 PolarHBondContact O-N 3.46Å
130V92.9Very high92.8Very high80 Ų80111.4 Ų111.449%0.48552%0.523SS..Hα-helixtrans-58.6-40.3176.6172.30000111.4L126 E133 F134L126-V130 WeakPolarHBondContact O-CG2 3.45Å; L126-V130 PolarHBondContact O-N 2.92Å; V130-E133 PolarHBondContact O-N 2.91Å; V130-F134 WeakPolarHBondContact O-CB 3.26Å; V130-F134 PolarHBondContact O-N 2.9Å
131Y92.7Very high93Very high141 Ų141110.8 Ų110.855%0.55352%0.524SS*.Hα-helixtrans-68-37.2176.8-176.9-109.7000112.7R127 K128 K129 F134 L135R127-Y131 VanDerWaalsContact O-CB 3.3Å; R127-Y131 WeakPolarHBondContact O-CB 3.43Å; R127-Y131 PolarHBondContact O-N 3.38Å; K128-Y131 PolarHBondContact O-N 3.07Å; K129-Y131 VanDerWaalsContact C-N 3.27Å; K129-Y131 PolarHBondContact O-N 2.95Å; Y131-F134 HydrophobicContact CD2-CD1 4.48Å; Y131-F134 HydrophobicContact CE2-CD1 4.47Å; Y131-F134 PolarHBondContact O-N 3.45Å; Y131-L135 HydrophobicContact CD1-CD1 4.01Å; Y131-L135 HydrophobicContact CE1-CD1 3.5Å; Y131-L135 VanDerWaalsContact CE1-CD1 3.5Å; Y131-L135 HydrophobicContact CE1-CG 4.11Å; Y131-L135 HydrophobicContact CE2-CG 4.47Å; Y131-L135 WeakPolarHBondContact O-CG 3.46Å; Y131-L135 PolarHBondContact O-N 2.98Å
132Q94.3Very high93Very high107 Ų107109.7 Ų109.750%0.552%0.521SS..Hα-helixtrans-66.3-43.2174.5-74.8174.4-18.500111.8K128 K129 L135 H136K128-Q132 VanDerWaalsContact O-CG 3.29Å; K128-Q132 WeakPolarHBondContact O-CG 3.44Å; K128-Q132 PolarHBondContact O-N 2.91Å; K129-Q132 WeakPolarHBondContact O-CB 3.41Å; K129-Q132 PolarHBondContact O-N 3.48Å; Q132-L135 PolarHBondContact O-N 3.14Å; Q132-H136 PolarHBondContact O-N 2.87Å
133E92.1Very high93Very high119 Ų119109 Ų10956%0.55652%0.518SS*.Hα-helixtrans-59.5-46.3173.1-71.9171.5179.600110.6K129 V130 L135 H136 D137K129-E133 WeakPolarHBondContact O-CG 3.44Å; K129-E133 PolarHBondContact O-N 3.46Å; V130-E133 PolarHBondContact O-N 2.91Å; E133-L135 VanDerWaalsContact C-N 3.34Å; E133-L135 PolarHBondContact O-N 3.03Å; E133-H136 WeakPolarHBondContact O-CB 3.29Å; E133-H136 PolarHBondContact O-N 3.31Å; E133-H136 VanDerWaalsContact O-N 3.13Å; E133-D137 WeakPolarHBondContact O-CB 3.39Å; E133-D137 PolarHBondContact O-N 2.9Å
134F94.3Very high93Very high118 Ų118106.8 Ų106.852%0.51851%0.511SS..Hα-helixtrans-58.6-42.1175.3171.8-99.5000113.2V130 Y131 H136 K138V130-F134 WeakPolarHBondContact O-CB 3.26Å; V130-F134 PolarHBondContact O-N 2.9Å; Y131-F134 HydrophobicContact CD2-CD1 4.48Å; Y131-F134 HydrophobicContact CE2-CD1 4.47Å; Y131-F134 PolarHBondContact O-N 3.45Å; F134-H136 VanDerWaalsContact C-N 3.34Å; F134-K138 VanDerWaalsContact O-CB 3.26Å; F134-K138 WeakPolarHBondContact O-CB 3.49Å; F134-K138 PolarHBondContact O-N 2.94Å
135L94.7Very high93Very high67 Ų67105.8 Ų105.835%0.35151%0.505SS..Hα-helixtrans-65.7-39.2176.4-75.3176.7000111.8Y131 Q132 E133 Q139Y131-L135 HydrophobicContact CD1-CD1 4.01Å; Y131-L135 HydrophobicContact CE1-CD1 3.5Å; Y131-L135 VanDerWaalsContact CE1-CD1 3.5Å; Y131-L135 HydrophobicContact CE1-CG 4.11Å; Y131-L135 HydrophobicContact CE2-CG 4.47Å; Y131-L135 WeakPolarHBondContact O-CG 3.46Å; Y131-L135 PolarHBondContact O-N 2.98Å; Q132-L135 PolarHBondContact O-N 3.14Å; E133-L135 VanDerWaalsContact C-N 3.34Å; E133-L135 PolarHBondContact O-N 3.03Å; L135-Q139 WeakPolarHBondContact O-CG 3.47Å; L135-Q139 PolarHBondContact O-N 3.27Å
136H93.7Very high93.1Very high108 Ų108107 Ų10750%0.551%0.509SS..Hα-helixtrans-64.5-49.2175.8-174.760.4000111.3Q132 E133 F134 K138 Q139 M140Q132-H136 PolarHBondContact O-N 2.87Å; E133-H136 WeakPolarHBondContact O-CB 3.29Å; E133-H136 PolarHBondContact O-N 3.31Å; E133-H136 VanDerWaalsContact O-N 3.13Å; F134-H136 VanDerWaalsContact C-N 3.34Å; H136-K138 VanDerWaalsContact C-N 3.3Å; H136-K138 PolarHBondContact O-N 3.13Å; H136-Q139 WeakPolarHBondContact O-CB 3.34Å; H136-Q139 PolarHBondContact O-N 2.87Å; H136-Q139 VanDerWaalsContact O-N 3.14Å; H136-M140 WeakPolarHBondContact O-CG 3.45Å; H136-M140 PolarHBondContact O-N 3.37Å
137D93.1Very high93Very high94 Ų94108.8 Ų108.850%0.50351%0.508SS..Hα-helixtrans-59.1-42.8176.8-74.1-8.2000111.3E133 Q139 M140 V141E133-D137 WeakPolarHBondContact O-CB 3.39Å; E133-D137 PolarHBondContact O-N 2.9Å; D137-Q139 PolarHBondContact O-N 2.92Å; D137-M140 PolarHBondContact O-N 2.82Å; D137-V141 VanDerWaalsContact O-CG2 3.31Å; D137-V141 WeakPolarHBondContact O-CG2 3.42Å; D137-V141 PolarHBondContact O-N 2.85Å
138K94.1Very high92.9Very high111 Ų111104.3 Ų104.348%0.48350%0.497SS..Hα-helixtrans-60.3-45176-176-179.3177-174.50111.7F134 H136 V141 D142F134-K138 VanDerWaalsContact O-CB 3.26Å; F134-K138 WeakPolarHBondContact O-CB 3.49Å; F134-K138 PolarHBondContact O-N 2.94Å; H136-K138 VanDerWaalsContact C-N 3.3Å; H136-K138 PolarHBondContact O-N 3.13Å; K138-V141 PolarHBondContact O-N 2.95Å; K138-D142 WeakPolarHBondContact O-CB 3.33Å; K138-D142 PolarHBondContact O-N 3.35Å
139Q93.6Very high92.9Very high118 Ų118104 Ų10455%0.55150%0.495SS*.Hα-helixtrans-61.3-44.4176.2-74.7174.9-12.200111.4L135 H136 D137 V141 D142 E143L135-Q139 WeakPolarHBondContact O-CG 3.47Å; L135-Q139 PolarHBondContact O-N 3.27Å; H136-Q139 WeakPolarHBondContact O-CB 3.34Å; H136-Q139 PolarHBondContact O-N 2.87Å; H136-Q139 VanDerWaalsContact O-N 3.14Å; D137-Q139 PolarHBondContact O-N 2.92Å; Q139-V141 VanDerWaalsContact C-N 3.34Å; Q139-V141 PolarHBondContact O-N 3.3Å; Q139-D142 PolarHBondContact O-N 3.44Å; Q139-E143 WeakPolarHBondContact O-CB 3.45Å; Q139-E143 WeakPolarHBondContact O-CG 3.36Å; Q139-E143 PolarHBondContact O-N 3.49Å
140M91.2Very high92.9Very high96 Ų96103.5 Ų103.547%0.47350%0.495SS..Hα-helixtrans-60.7-43.1176.2-69.7-168.172.800111.9H136 D137 E143 V144H136-M140 WeakPolarHBondContact O-CG 3.45Å; H136-M140 PolarHBondContact O-N 3.37Å; D137-M140 PolarHBondContact O-N 2.82Å; M140-E143 PolarHBondContact O-N 2.87Å; M140-V144 VanDerWaalsContact O-CG2 3.29Å; M140-V144 WeakPolarHBondContact O-CG2 3.5Å; M140-V144 PolarHBondContact O-N 3.26Å
141V92.9Very high92.9Very high84 Ų84105.9 Ų105.951%0.50950%0.5SS..Hα-helixtrans-63.8-45.7176.5171.60000110.9D137 K138 Q139 E143 V144 V145D137-V141 VanDerWaalsContact O-CG2 3.31Å; D137-V141 WeakPolarHBondContact O-CG2 3.42Å; D137-V141 PolarHBondContact O-N 2.85Å; K138-V141 PolarHBondContact O-N 2.95Å; Q139-V141 VanDerWaalsContact C-N 3.34Å; Q139-V141 PolarHBondContact O-N 3.3Å; V141-E143 VanDerWaalsContact C-N 3.29Å; V141-E143 PolarHBondContact O-N 3.38Å; V141-V144 PolarHBondContact O-N 3.17Å; V141-V145 HydrophobicContact CG1-CG2 4.34Å; V141-V145 WeakPolarHBondContact O-CG2 3.32Å; V141-V145 PolarHBondContact O-N 3.07Å
142D93.6Very high92.8Very high92 Ų92103.4 Ų103.449%0.49250%0.497SS..Hα-helixtrans-61.2-38.4177.9-75.1-23.7000111.5K138 Q139 V145 K146K138-D142 WeakPolarHBondContact O-CB 3.33Å; K138-D142 PolarHBondContact O-N 3.35Å; Q139-D142 PolarHBondContact O-N 3.44Å; D142-V145 PolarHBondContact O-N 3.38Å; D142-K146 VanDerWaalsContact O-CB 3.32Å; D142-K146 WeakPolarHBondContact O-CB 3.3Å; D142-K146 PolarHBondContact O-N 2.98Å
143E93.4Very high92.6Very high114 Ų114103.7 Ų103.753%0.53350%0.498SS..Hα-helixtrans-66.8-40.2173.7-75.2-179.6-178.200113.1Q139 M140 V141 K146 R147Q139-E143 WeakPolarHBondContact O-CB 3.45Å; Q139-E143 WeakPolarHBondContact O-CG 3.36Å; Q139-E143 PolarHBondContact O-N 3.49Å; M140-E143 PolarHBondContact O-N 2.87Å; V141-E143 VanDerWaalsContact C-N 3.29Å; V141-E143 PolarHBondContact O-N 3.38Å; E143-K146 PolarHBondContact O-N 3.38Å; E143-R147 WeakPolarHBondContact O-CG 3.31Å; E143-R147 PolarHBondContact O-N 3.46Å
144V91.3Very high92.6Very high65 Ų65105 Ų10539%0.39450%0.499SS..Hα-helixtrans-64.1-46.3174.5170.30000110.2M140 V141 K146 R147 I148M140-V144 VanDerWaalsContact O-CG2 3.29Å; M140-V144 WeakPolarHBondContact O-CG2 3.5Å; M140-V144 PolarHBondContact O-N 3.26Å; V141-V144 PolarHBondContact O-N 3.17Å; V144-K146 VanDerWaalsContact C-N 3.32Å; V144-K146 PolarHBondContact O-N 2.97Å; V144-R147 PolarHBondContact O-N 2.89Å; V144-I148 HydrophobicContact CG1-CD1 3.88Å; V144-I148 HydrophobicContact CG1-CG1 4.49Å; V144-I148 WeakPolarHBondContact O-CG1 3.41Å; V144-I148 PolarHBondContact O-N 3.42Å
145V92Very high92.4Very high62 Ų62102.3 Ų102.338%0.37649%0.488SS..Hα-helixtrans-61.6-41.6177.1171.50000111.1V141 D142 I148 K149V141-V145 HydrophobicContact CG1-CG2 4.34Å; V141-V145 WeakPolarHBondContact O-CG2 3.32Å; V141-V145 PolarHBondContact O-N 3.07Å; D142-V145 PolarHBondContact O-N 3.38Å; V145-I148 PolarHBondContact O-N 3.26Å; V145-K149 HydrophobicContact CG1-CD 4.35Å; V145-K149 WeakPolarHBondContact O-CG 3.29Å; V145-K149 PolarHBondContact O-N 3.43Å
146K93.8Very high92Very high132 Ų132104.8 Ų104.857%0.57450%0.498SS*.Hα-helixtrans-62.2-43.1176.1-173.2178.6179.1-177.10111.6D142 E143 V144 K149 Q150D142-K146 VanDerWaalsContact O-CB 3.32Å; D142-K146 WeakPolarHBondContact O-CB 3.3Å; D142-K146 PolarHBondContact O-N 2.98Å; E143-K146 PolarHBondContact O-N 3.38Å; V144-K146 VanDerWaalsContact C-N 3.32Å; V144-K146 PolarHBondContact O-N 2.97Å; K146-K149 PolarHBondContact O-N 3.2Å; K146-Q150 VanDerWaalsContact O-CG 3.3Å; K146-Q150 WeakPolarHBondContact O-CG 3.32Å; K146-Q150 PolarHBondContact O-N 3.38Å
147R92Very high91.9Very high148 Ų148104.4 Ų104.456%0.55850%0.496SS*.Hα-helixtrans-62-45.2175.7-79-174.9-81.4171.7-8.8112.1E143 V144 K149 Q150 E151E143-R147 WeakPolarHBondContact O-CG 3.31Å; E143-R147 PolarHBondContact O-N 3.46Å; V144-R147 PolarHBondContact O-N 2.89Å; R147-K149 PolarHBondContact O-N 2.94Å; R147-Q150 PolarHBondContact O-N 2.95Å; R147-E151 WeakPolarHBondContact O-CB 3.4Å; R147-E151 PolarHBondContact O-N 2.89Å
148I90.7Very high91.7Very high85 Ų85103.8 Ų103.844%0.43649%0.489SS..Hα-helixtrans-60.4-46.4177.5-67.6167.7000110.7V144 V145 Q150 E151 D152V144-I148 HydrophobicContact CG1-CD1 3.88Å; V144-I148 HydrophobicContact CG1-CG1 4.49Å; V144-I148 WeakPolarHBondContact O-CG1 3.41Å; V144-I148 PolarHBondContact O-N 3.42Å; V145-I148 PolarHBondContact O-N 3.26Å; I148-Q150 VanDerWaalsContact C-N 3.32Å; I148-Q150 PolarHBondContact O-N 3.44Å; I148-E151 PolarHBondContact O-N 3.45Å; I148-D152 WeakPolarHBondContact O-CB 3.4Å; I148-D152 PolarHBondContact O-N 3.31Å
149K91.7Very high91.5Very high128 Ų128106.2 Ų106.256%0.55750%0.495SS*.Hα-helixtrans-59.7-42.8177.7-74.1179.9178.6-1790112.3V145 K146 R147 D152 E153V145-K149 HydrophobicContact CG1-CD 4.35Å; V145-K149 WeakPolarHBondContact O-CG 3.29Å; V145-K149 PolarHBondContact O-N 3.43Å; K146-K149 PolarHBondContact O-N 3.2Å; R147-K149 PolarHBondContact O-N 2.94Å; K149-D152 PolarHBondContact O-N 3.21Å; K149-E153 WeakPolarHBondContact O-CB 3.46Å; K149-E153 WeakPolarHBondContact O-CG 3.45Å; K149-E153 PolarHBondContact O-N 2.93Å
150Q93.4Very high91.4Very high104 Ų104106 Ų10649%0.48649%0.494SS..Hα-helixtrans-65.1-40.1177.3-72.4175.2-17.100112.1K146 R147 I148 Y154K146-Q150 VanDerWaalsContact O-CG 3.3Å; K146-Q150 WeakPolarHBondContact O-CG 3.32Å; K146-Q150 PolarHBondContact O-N 3.38Å; R147-Q150 PolarHBondContact O-N 2.95Å; I148-Q150 VanDerWaalsContact C-N 3.32Å; I148-Q150 PolarHBondContact O-N 3.44Å; Q150-Y154 WeakPolarHBondContact O-CB 3.46Å; Q150-Y154 PolarHBondContact O-N 2.97Å
151E92.1Very high91.4Very high130 Ų130107.5 Ų107.561%0.60750%0.498SS*.Hα-helixtrans-66.9-42176.5-171.6165-161.200111.7R147 I148 Y154 E155R147-E151 WeakPolarHBondContact O-CB 3.4Å; R147-E151 PolarHBondContact O-N 2.89Å; I148-E151 PolarHBondContact O-N 3.45Å; E151-Y154 PolarHBondContact O-N 2.84Å; E151-E155 WeakPolarHBondContact O-CB 3.23Å; E151-E155 PolarHBondContact O-N 2.86Å
152D90.6Very high91.2Very high90 Ų90109.2 Ų109.248%0.48150%0.499SS..Hα-helixtrans-61.8-45.2174.6-79.1-19.6000111.8I148 K149 E155 Q156I148-D152 WeakPolarHBondContact O-CB 3.4Å; I148-D152 PolarHBondContact O-N 3.31Å; K149-D152 PolarHBondContact O-N 3.21Å; D152-E155 PolarHBondContact O-N 2.92Å; D152-Q156 WeakPolarHBondContact O-CB 3.35Å; D152-Q156 VanDerWaalsContact O-CG 3.23Å; D152-Q156 WeakPolarHBondContact O-CG 3.36Å; D152-Q156 PolarHBondContact O-N 3.46Å
153E91.1Very high90.9Very high113 Ų113112 Ų11253%0.52851%0.506SS..Hα-helixtrans-61-44175.5-76.6174.2-172.200111.4K149 Q156 Q157K149-E153 WeakPolarHBondContact O-CB 3.46Å; K149-E153 WeakPolarHBondContact O-CG 3.45Å; K149-E153 PolarHBondContact O-N 2.93Å; E153-Q156 PolarHBondContact O-N 3.45Å; E153-Q157 WeakPolarHBondContact O-CG 3.41Å; E153-Q157 PolarHBondContact O-N 3.45Å
154Y91.4Very high90.8Very high146 Ų146111.9 Ų111.957%0.57351%0.506SS*.Hα-helixtrans-64.4-44.9177.8178.9-105000112.3Q150 E151 Q156 Q157 K158Q150-Y154 WeakPolarHBondContact O-CB 3.46Å; Q150-Y154 PolarHBondContact O-N 2.97Å; E151-Y154 PolarHBondContact O-N 2.84Å; Y154-Q156 VanDerWaalsContact C-N 3.33Å; Y154-Q156 PolarHBondContact O-N 2.86Å; Y154-Q157 PolarHBondContact O-N 3.5Å; Y154-K158 WeakPolarHBondContact O-CB 3.23Å; Y154-K158 PolarHBondContact O-N 2.87Å
155E89.9Confident90.8Very high61 Ų61113.4 Ų113.429%0.28551%0.511SS..Hα-helixtrans-66.1-35.2176.5-82.6-65141.900111.9E151 D152 K158 R159E151-E155 WeakPolarHBondContact O-CB 3.23Å; E151-E155 PolarHBondContact O-N 2.86Å; D152-E155 PolarHBondContact O-N 2.92Å; E155-K158 PolarHBondContact O-N 3.28Å; E155-K158 WeakPolarHBondContact OE1-CD 3.37Å; E155-K158 IonicContact OE1-NZ 3.81Å; E155-K158 PolarHBondContact OE1-NZ 3.24Å; E155-K158 IonicContact OE2-NZ 3.92Å; E155-R159 WeakPolarHBondContact O-CB 3.39Å; E155-R159 VanDerWaalsContact O-CG 3.23Å; E155-R159 WeakPolarHBondContact O-CG 3.47Å; E155-R159 PolarHBondContact O-N 2.99Å
156Q87.3Confident90.4Very high119 Ų119114.8 Ų114.856%0.55652%0.516SS*.Hα-helixtrans-62-47.7171.2-76.1178.524.300111.8D152 E153 Y154 K158 R159 Q160D152-Q156 WeakPolarHBondContact O-CB 3.35Å; D152-Q156 VanDerWaalsContact O-CG 3.23Å; D152-Q156 WeakPolarHBondContact O-CG 3.36Å; D152-Q156 PolarHBondContact O-N 3.46Å; E153-Q156 PolarHBondContact O-N 3.45Å; Y154-Q156 VanDerWaalsContact C-N 3.33Å; Y154-Q156 PolarHBondContact O-N 2.86Å; Q156-K158 VanDerWaalsContact C-N 3.34Å; Q156-K158 PolarHBondContact O-N 3.47Å; Q156-R159 PolarHBondContact O-N 3.37Å; Q156-Q160 WeakPolarHBondContact O-CG 3.47Å; Q156-Q160 PolarHBondContact O-N 2.91Å
157Q90.9Very high90.2Very high101 Ų101116.8 Ų116.847%0.47252%0.52SS..Hα-helixtrans-61.4-42.4177.2-71.9178.217.600111.7E153 Y154 R159 Q160 K161E153-Q157 WeakPolarHBondContact O-CG 3.41Å; E153-Q157 PolarHBondContact O-N 3.45Å; Y154-Q157 PolarHBondContact O-N 3.5Å; Q157-R159 PolarHBondContact O-N 3.31Å; Q157-Q160 PolarHBondContact O-N 3.43Å; Q157-K161 WeakPolarHBondContact O-CG 3.37Å; Q157-K161 PolarHBondContact O-N 2.88Å
158K89.7Confident90.1Very high80 Ų80114.8 Ų114.835%0.34852%0.517SS..Hα-helixtrans-62.5-41.3176.1-176.8-178.7172.2-169.90111.8Y154 E155 Q156 K162Y154-K158 WeakPolarHBondContact O-CB 3.23Å; Y154-K158 PolarHBondContact O-N 2.87Å; E155-K158 PolarHBondContact O-N 3.28Å; E155-K158 WeakPolarHBondContact OE1-CD 3.37Å; E155-K158 IonicContact OE1-NZ 3.81Å; E155-K158 PolarHBondContact OE1-NZ 3.24Å; E155-K158 IonicContact OE2-NZ 3.92Å; Q156-K158 VanDerWaalsContact C-N 3.34Å; Q156-K158 PolarHBondContact O-N 3.47Å; K158-K162 WeakPolarHBondContact O-CG 3.42Å; K158-K162 PolarHBondContact O-N 3.25Å
159R89.4Confident90Very high163 Ų163116.6 Ų116.662%0.61552%0.523SS*.Hα-helixtrans-65.1-40.4173.8-73.3172.8-173.4-164.22.6111.8E155 Q156 Q157 K162 K163E155-R159 WeakPolarHBondContact O-CB 3.39Å; E155-R159 VanDerWaalsContact O-CG 3.23Å; E155-R159 WeakPolarHBondContact O-CG 3.47Å; E155-R159 PolarHBondContact O-N 2.99Å; Q156-R159 PolarHBondContact O-N 3.37Å; Q157-R159 PolarHBondContact O-N 3.31Å; R159-K162 PolarHBondContact O-N 2.97Å; R159-K163 WeakPolarHBondContact O-CG 3.44Å; R159-K163 PolarHBondContact O-N 3.32Å
160Q90.8Very high89.7Confident112 Ų112114.4 Ų114.452%0.52352%0.517SS..Hα-helixtrans-62.1-50.2175.1-75.1176.7-5.300111.1Q156 Q157 K162 K163 E164Q156-Q160 WeakPolarHBondContact O-CG 3.47Å; Q156-Q160 PolarHBondContact O-N 2.91Å; Q157-Q160 PolarHBondContact O-N 3.43Å; Q160-K162 VanDerWaalsContact C-N 3.31Å; Q160-K162 PolarHBondContact O-N 3.48Å; Q160-K163 WeakPolarHBondContact O-CB 3.34Å; Q160-K163 PolarHBondContact O-N 2.98Å; Q160-E164 WeakPolarHBondContact O-CG 3.3Å; Q160-E164 PolarHBondContact O-N 2.82Å
161K91.3Very high89.6Confident129 Ų129113 Ų11356%0.56151%0.512SS*.Hα-helixtrans-56.4-42.9175.2-72178.2-179.7179.40112.5Q157 E164 L165Q157-K161 WeakPolarHBondContact O-CG 3.37Å; Q157-K161 PolarHBondContact O-N 2.88Å; K161-E164 PolarHBondContact O-N 2.9Å; K161-L165 WeakPolarHBondContact O-CG 3.39Å; K161-L165 PolarHBondContact O-N 3.04Å
162K89.2Confident89.6Confident119 Ų119112.2 Ų112.252%0.51751%0.509SS..Hα-helixtrans-61.6-43.4174.4-76.4-179.1177.2-171.60112.3K158 R159 Q160 E164 L165 I166K158-K162 WeakPolarHBondContact O-CG 3.42Å; K158-K162 PolarHBondContact O-N 3.25Å; R159-K162 PolarHBondContact O-N 2.97Å; Q160-K162 VanDerWaalsContact C-N 3.31Å; Q160-K162 PolarHBondContact O-N 3.48Å; K162-E164 VanDerWaalsContact C-N 3.32Å; K162-E164 PolarHBondContact O-N 3.35Å; K162-L165 PolarHBondContact O-N 2.9Å; K162-I166 WeakPolarHBondContact O-CB 3.46Å; K162-I166 VanDerWaalsContact O-CG1 3.24Å; K162-I166 WeakPolarHBondContact O-CG1 3.33Å; K162-I166 PolarHBondContact O-N 3.28Å
163K87.3Confident89.5Confident150 Ų150114 Ų11465%0.65251%0.513SS*.Hα-helixtrans-63.9-38.2176.4-73.6176.8179.4-1750111.9R159 Q160 R167R159-K163 WeakPolarHBondContact O-CG 3.44Å; R159-K163 PolarHBondContact O-N 3.32Å; Q160-K163 WeakPolarHBondContact O-CB 3.34Å; Q160-K163 PolarHBondContact O-N 2.98Å; K163-R167 VanDerWaalsContact O-CB 3.3Å; K163-R167 WeakPolarHBondContact O-CB 3.24Å; K163-R167 PolarHBondContact O-N 3.24Å
164E90.5Very high89.3Confident112 Ų112113.5 Ų113.552%0.52351%0.51SS..Hα-helixtrans-66.3-45.1176-72.1171.1178.200111.6Q160 K161 K162 R167 Q168Q160-E164 WeakPolarHBondContact O-CG 3.3Å; Q160-E164 PolarHBondContact O-N 2.82Å; K161-E164 PolarHBondContact O-N 2.9Å; K162-E164 VanDerWaalsContact C-N 3.32Å; K162-E164 PolarHBondContact O-N 3.35Å; E164-R167 PolarHBondContact O-N 2.91Å; E164-Q168 WeakPolarHBondContact O-CG 3.46Å; E164-Q168 PolarHBondContact O-N 2.87Å
165L90.6Very high89.3Confident97 Ų97113 Ų11351%0.50851%0.511SS..Hα-helixtrans-59.9-49.5174.7-72.1171.3000111.4K161 K162 R167 Q168 E169K161-L165 WeakPolarHBondContact O-CG 3.39Å; K161-L165 PolarHBondContact O-N 3.04Å; K162-L165 PolarHBondContact O-N 2.9Å; L165-R167 VanDerWaalsContact C-N 3.27Å; L165-R167 PolarHBondContact O-N 2.9Å; L165-Q168 WeakPolarHBondContact O-CB 3.35Å; L165-Q168 PolarHBondContact O-N 2.9Å; L165-Q168 VanDerWaalsContact O-N 3.13Å; L165-E169 WeakPolarHBondContact O-CG 3.21Å; L165-E169 PolarHBondContact O-N 3.42Å
166I85.3Confident89.3Confident91 Ų91115.8 Ų115.847%0.46752%0.524SS..Hα-helixtrans-60.6-38.9177.2-68166.3000110.8K162 E169 I170K162-I166 WeakPolarHBondContact O-CB 3.46Å; K162-I166 VanDerWaalsContact O-CG1 3.24Å; K162-I166 WeakPolarHBondContact O-CG1 3.33Å; K162-I166 PolarHBondContact O-N 3.28Å; I166-E169 PolarHBondContact O-N 3.5Å; I166-I170 HydrophobicContact CG2-CD1 3.76Å; I166-I170 HydrophobicContact CG2-CG1 4.36Å; I166-I170 WeakPolarHBondContact O-CB 3.47Å; I166-I170 WeakPolarHBondContact O-CG1 3.35Å; I166-I170 PolarHBondContact O-N 3.33Å
167R88.3Confident89.3Confident174 Ų174117.5 Ų117.566%0.65753%0.526SS*.Hα-helixtrans-63.5-44.6175.9-174.8-179.1-68.2-170-3.1111.2K163 E164 L165 E169 I170 D171K163-R167 VanDerWaalsContact O-CB 3.3Å; K163-R167 WeakPolarHBondContact O-CB 3.24Å; K163-R167 PolarHBondContact O-N 3.24Å; E164-R167 PolarHBondContact O-N 2.91Å; L165-R167 VanDerWaalsContact C-N 3.27Å; L165-R167 PolarHBondContact O-N 2.9Å; R167-E169 VanDerWaalsContact C-N 3.35Å; R167-E169 PolarHBondContact O-N 3.4Å; R167-I170 PolarHBondContact O-N 2.94Å; R167-D171 WeakPolarHBondContact O-CB 3.39Å; R167-D171 PolarHBondContact O-N 2.89Å
168Q91.1Very high89.2Confident107 Ų107117.8 Ų117.850%0.553%0.527SS..Hα-helixtrans-62.1-42176.4-71.2173.85.700111.8E164 L165 D171 Q172E164-Q168 WeakPolarHBondContact O-CG 3.46Å; E164-Q168 PolarHBondContact O-N 2.87Å; L165-Q168 WeakPolarHBondContact O-CB 3.35Å; L165-Q168 PolarHBondContact O-N 2.9Å; L165-Q168 VanDerWaalsContact O-N 3.13Å; Q168-D171 PolarHBondContact O-N 3.13Å; Q168-Q172 WeakPolarHBondContact O-CB 3.26Å; Q168-Q172 VanDerWaalsContact O-CG 3.26Å; Q168-Q172 WeakPolarHBondContact O-CG 3.41Å; Q168-Q172 PolarHBondContact O-N 3.33Å
169E87.1Confident89.2Confident122 Ų122120 Ų12057%0.5754%0.539SS*.Hα-helixtrans-62.6-42.6175-71.7173.5176.900111.6L165 I166 R167 Q172 F173L165-E169 WeakPolarHBondContact O-CG 3.21Å; L165-E169 PolarHBondContact O-N 3.42Å; I166-E169 PolarHBondContact O-N 3.5Å; R167-E169 VanDerWaalsContact C-N 3.35Å; R167-E169 PolarHBondContact O-N 3.4Å; E169-Q172 PolarHBondContact O-N 3.49Å; E169-F173 VanDerWaalsContact O-CB 3.32Å; E169-F173 WeakPolarHBondContact O-CB 3.38Å; E169-F173 PolarHBondContact O-N 3.39Å
170I86.1Confident89.2Confident82 Ų82117.5 Ų117.542%0.42153%0.534SS..Hα-helixtrans-63.1-45.6175.3-70.3166.6000110.7I166 R167 Q172 F173 Q174I166-I170 HydrophobicContact CG2-CD1 3.76Å; I166-I170 HydrophobicContact CG2-CG1 4.36Å; I166-I170 WeakPolarHBondContact O-CB 3.47Å; I166-I170 WeakPolarHBondContact O-CG1 3.35Å; I166-I170 PolarHBondContact O-N 3.33Å; R167-I170 PolarHBondContact O-N 2.94Å; I170-Q172 VanDerWaalsContact C-N 3.34Å; I170-Q172 PolarHBondContact O-N 3.44Å; I170-F173 PolarHBondContact O-N 2.88Å; I170-Q174 HydrophobicContact CG2-CG 4.39Å; I170-Q174 WeakPolarHBondContact O-CB 3.29Å; I170-Q174 VanDerWaalsContact O-CG 3.29Å; I170-Q174 WeakPolarHBondContact O-CG 3.22Å; I170-Q174 PolarHBondContact O-N 3.05Å
171D91.3Very high89.1Confident74 Ų74115.2 Ų115.240%0.39652%0.524SS..Hα-helixtrans-65.2-38.9-179.7-68.9-16.2000111.3R167 Q168 K175R167-D171 WeakPolarHBondContact O-CB 3.39Å; R167-D171 PolarHBondContact O-N 2.89Å; Q168-D171 PolarHBondContact O-N 3.13Å; D171-K175 WeakPolarHBondContact O-CG 3.18Å; D171-K175 PolarHBondContact O-N 2.85Å
172Q91.6Very high89.1Confident114 Ų114114.9 Ų114.953%0.53352%0.523SS..Hα-helixtrans-63.9-48.9173.3-75.41744.200111.1Q168 E169 I170 Q174 K175 E176Q168-Q172 WeakPolarHBondContact O-CB 3.26Å; Q168-Q172 VanDerWaalsContact O-CG 3.26Å; Q168-Q172 WeakPolarHBondContact O-CG 3.41Å; Q168-Q172 PolarHBondContact O-N 3.33Å; E169-Q172 PolarHBondContact O-N 3.49Å; I170-Q172 VanDerWaalsContact C-N 3.34Å; I170-Q172 PolarHBondContact O-N 3.44Å; Q172-Q174 VanDerWaalsContact C-N 3.28Å; Q172-Q174 PolarHBondContact O-N 2.88Å; Q172-K175 WeakPolarHBondContact O-CB 3.36Å; Q172-K175 PolarHBondContact O-N 3.12Å; Q172-K175 VanDerWaalsContact O-N 3.12Å; Q172-E176 WeakPolarHBondContact O-CG 3.49Å; Q172-E176 PolarHBondContact O-N 3.33Å
173F89.5Confident89.1Confident128 Ų128111.3 Ų111.356%0.56152%0.515SS*.Hα-helixtrans-61.3-37.4178-175.6-100.7000112.3E169 I170 R177E169-F173 VanDerWaalsContact O-CB 3.32Å; E169-F173 WeakPolarHBondContact O-CB 3.38Å; E169-F173 PolarHBondContact O-N 3.39Å; I170-F173 PolarHBondContact O-N 2.88Å; F173-R177 WeakPolarHBondContact O-CB 3.43Å; F173-R177 PolarHBondContact O-N 2.86Å
174Q87Confident89.1Confident102 Ų102108.7 Ų108.748%0.47751%0.506SS..Hα-helixtrans-64.6-44174.4-76179.411.600111.7I170 Q172 R177 E178I170-Q174 HydrophobicContact CG2-CG 4.39Å; I170-Q174 WeakPolarHBondContact O-CB 3.29Å; I170-Q174 VanDerWaalsContact O-CG 3.29Å; I170-Q174 WeakPolarHBondContact O-CG 3.22Å; I170-Q174 PolarHBondContact O-N 3.05Å; Q172-Q174 VanDerWaalsContact C-N 3.28Å; Q172-Q174 PolarHBondContact O-N 2.88Å; Q174-R177 PolarHBondContact O-N 3.16Å; Q174-E178 WeakPolarHBondContact O-CG 3.32Å; Q174-E178 PolarHBondContact O-N 3.37Å
175K91.6Very high88.9Confident135 Ų135109.4 Ų109.459%0.58751%0.507SS*.Hα-helixtrans-62-48.7175.4-73.8175.3-178.1179.40112D171 Q172 R177 E178 E179D171-K175 WeakPolarHBondContact O-CG 3.18Å; D171-K175 PolarHBondContact O-N 2.85Å; Q172-K175 WeakPolarHBondContact O-CB 3.36Å; Q172-K175 PolarHBondContact O-N 3.12Å; Q172-K175 VanDerWaalsContact O-N 3.12Å; K175-R177 VanDerWaalsContact C-N 3.28Å; K175-R177 PolarHBondContact O-N 2.87Å; K175-E178 PolarHBondContact O-N 3.35Å; K175-E178 VanDerWaalsContact O-N 3.16Å; K175-E179 WeakPolarHBondContact O-CB 3.48Å; K175-E179 WeakPolarHBondContact O-CG 3.5Å; K175-E179 PolarHBondContact O-N 2.9Å
176E89.4Confident88.9Confident121 Ų121110.2 Ų110.257%0.56551%0.508SS*.Hα-helixtrans-59-41.4176.8-72.1176.9-179.800111.3Q172 E179 H180Q172-E176 WeakPolarHBondContact O-CG 3.49Å; Q172-E176 PolarHBondContact O-N 3.33Å; E176-E179 PolarHBondContact O-N 2.88Å; E176-H180 WeakPolarHBondContact O-CB 3.43Å; E176-H180 PolarHBondContact O-N 2.9Å
177R86.9Confident89.1Confident155 Ų155110 Ų11059%0.58551%0.508SS*.Hα-helixtrans-65.4-42.2176-176.3174.1-177.8178.11.5112.2F173 Q174 K175 H180 I181F173-R177 WeakPolarHBondContact O-CB 3.43Å; F173-R177 PolarHBondContact O-N 2.86Å; Q174-R177 PolarHBondContact O-N 3.16Å; K175-R177 VanDerWaalsContact C-N 3.28Å; K175-R177 PolarHBondContact O-N 2.87Å; R177-H180 PolarHBondContact O-N 3.24Å; R177-I181 HydrophobicContact CG-CD1 3.93Å; R177-I181 WeakPolarHBondContact O-CB 3.39Å; R177-I181 VanDerWaalsContact O-CG1 3.22Å; R177-I181 WeakPolarHBondContact O-CG1 3.47Å; R177-I181 PolarHBondContact O-N 3.39Å
178E89.2Confident89Confident106 Ų106106.3 Ų106.350%0.49550%0.501SS..Hα-helixtrans-64.1-41.3175.5-77.3-176.5-171.500111.9Q174 K175 I181 K182Q174-E178 WeakPolarHBondContact O-CG 3.32Å; Q174-E178 PolarHBondContact O-N 3.37Å; K175-E178 PolarHBondContact O-N 3.35Å; K175-E178 VanDerWaalsContact O-N 3.16Å; E178-I181 PolarHBondContact O-N 2.88Å; E178-K182 WeakPolarHBondContact O-CB 3.38Å; E178-K182 VanDerWaalsContact O-CG 3.22Å; E178-K182 WeakPolarHBondContact O-CG 3.44Å; E178-K182 PolarHBondContact O-N 3.42Å
179E90.3Very high88.9Confident128 Ų128107.5 Ų107.560%0.59850%0.504SS*.Hα-helixtrans-62.7-43.4174.4-73.7175.5-175.500111.1K175 E176 K182 A183K175-E179 WeakPolarHBondContact O-CB 3.48Å; K175-E179 WeakPolarHBondContact O-CG 3.5Å; K175-E179 PolarHBondContact O-N 2.9Å; E176-E179 PolarHBondContact O-N 2.88Å; E179-K182 PolarHBondContact O-N 2.89Å; E179-A183 WeakPolarHBondContact O-CB 3.44Å; E179-A183 PolarHBondContact O-N 2.82Å
180H88.4Confident89Confident110 Ų110107.7 Ų107.751%0.50950%0.503SS..Hα-helixtrans-61.7-47174.9-168.3-85.4000111.8E176 R177 K182 A183 E184E176-H180 WeakPolarHBondContact O-CB 3.43Å; E176-H180 PolarHBondContact O-N 2.9Å; R177-H180 PolarHBondContact O-N 3.24Å; H180-K182 VanDerWaalsContact C-N 3.29Å; H180-K182 PolarHBondContact O-N 2.82Å; H180-A183 PolarHBondContact O-N 3.5Å; H180-E184 IonicContact CE1-OE1 3.56Å; H180-E184 PolarHBondContact CE1-OE1 3.3Å; H180-E184 IonicContact CE1-OE2 2.8Å; H180-E184 IonicContact ND1-OE1 2.8Å; H180-E184 IonicContact ND1-OE2 3.81Å; H180-E184 WeakPolarHBondContact O-CB 3.22Å; H180-E184 WeakPolarHBondContact O-CG 3.25Å; H180-E184 PolarHBondContact O-N 2.98Å
181I89.4Confident89.1Confident64 Ų64109.7 Ų109.733%0.32851%0.511SS..Hα-helixtrans-62.7-38.4177.4-69.5166.3000110.8R177 E178 K185R177-I181 HydrophobicContact CG-CD1 3.93Å; R177-I181 WeakPolarHBondContact O-CB 3.39Å; R177-I181 VanDerWaalsContact O-CG1 3.22Å; R177-I181 WeakPolarHBondContact O-CG1 3.47Å; R177-I181 PolarHBondContact O-N 3.39Å; E178-I181 PolarHBondContact O-N 2.88Å; I181-K185 HydrophobicContact CG2-CD 4.18Å; I181-K185 WeakPolarHBondContact O-CB 3.35Å; I181-K185 VanDerWaalsContact O-CG 3.25Å; I181-K185 WeakPolarHBondContact O-CG 3.26Å; I181-K185 PolarHBondContact O-N 3.27Å
182K90.2Very high88.9Confident121 Ų121111.1 Ų111.153%0.52652%0.518SS..Hα-helixtrans-65.6-46.8175.4-75.6168.6-173.5165.80110.9E178 E179 H180 E184 K185 E186E178-K182 WeakPolarHBondContact O-CB 3.38Å; E178-K182 VanDerWaalsContact O-CG 3.22Å; E178-K182 WeakPolarHBondContact O-CG 3.44Å; E178-K182 PolarHBondContact O-N 3.42Å; E179-K182 PolarHBondContact O-N 2.89Å; H180-K182 VanDerWaalsContact C-N 3.29Å; H180-K182 PolarHBondContact O-N 2.82Å; K182-E184 PolarHBondContact O-N 3.26Å; K182-K185 PolarHBondContact O-N 3.39Å; K182-E186 WeakPolarHBondContact O-CG 3.46Å; K182-E186 PolarHBondContact O-N 2.84Å
183A90.9Very high88.7Confident44 Ų44111.8 Ų111.836%0.36452%0.521SS..Hα-helixtrans-61.7-43.1177.400000111.9E179 H180 E186 N187E179-A183 WeakPolarHBondContact O-CB 3.44Å; E179-A183 PolarHBondContact O-N 2.82Å; H180-A183 PolarHBondContact O-N 3.5Å; A183-E186 PolarHBondContact O-N 3.44Å; A183-N187 WeakPolarHBondContact O-CB 3.44Å; A183-N187 VanDerWaalsContact O-CG 3.24Å; A183-N187 PolarHBondContact O-N 3.29Å; A183-N187 PolarHBondContact O-ND2 2.83Å
184E86.4Confident88.8Confident96 Ų96108.6 Ų108.645%0.44952%0.518SS..Hα-helixtrans-61.7-44.4173.9-78.9-174.7146.800111.8H180 K182 E186 N187 L188H180-E184 IonicContact CE1-OE1 3.56Å; H180-E184 PolarHBondContact CE1-OE1 3.3Å; H180-E184 IonicContact CE1-OE2 2.8Å; H180-E184 IonicContact ND1-OE1 2.8Å; H180-E184 IonicContact ND1-OE2 3.81Å; H180-E184 WeakPolarHBondContact O-CB 3.22Å; H180-E184 WeakPolarHBondContact O-CG 3.25Å; H180-E184 PolarHBondContact O-N 2.98Å; K182-E184 PolarHBondContact O-N 3.26Å; E184-E186 VanDerWaalsContact C-N 3.32Å; E184-E186 PolarHBondContact O-N 3.28Å; E184-N187 PolarHBondContact O-N 2.95Å; E184-L188 WeakPolarHBondContact O-CB 3.39Å; E184-L188 WeakPolarHBondContact O-CG 3.37Å; E184-L188 PolarHBondContact O-N 3.39Å
185K86.6Confident88.7Confident127 Ų127107.7 Ų107.755%0.55252%0.519SS*.Hα-helixtrans-62.4-38.8175.9-77.4175.9-179.5179.90112.1I181 K182 K189I181-K185 HydrophobicContact CG2-CD 4.18Å; I181-K185 WeakPolarHBondContact O-CB 3.35Å; I181-K185 VanDerWaalsContact O-CG 3.25Å; I181-K185 WeakPolarHBondContact O-CG 3.26Å; I181-K185 PolarHBondContact O-N 3.27Å; K182-K185 PolarHBondContact O-N 3.39Å; K185-K189 WeakPolarHBondContact O-CB 3.34Å; K185-K189 VanDerWaalsContact O-CG 3.26Å; K185-K189 WeakPolarHBondContact O-CG 3.28Å; K185-K189 PolarHBondContact O-N 3.32Å
186E90.7Very high88.5Confident114 Ų114105.9 Ų105.953%0.53352%0.516SS..Hα-helixtrans-67.7-41.4175.2-75.2-175.2179.700112.2K182 A183 E184 K189 K190K182-E186 WeakPolarHBondContact O-CG 3.46Å; K182-E186 PolarHBondContact O-N 2.84Å; A183-E186 PolarHBondContact O-N 3.44Å; E184-E186 VanDerWaalsContact C-N 3.32Å; E184-E186 PolarHBondContact O-N 3.28Å; E186-K189 PolarHBondContact O-N 3.49Å; E186-K190 WeakPolarHBondContact O-CG 3.38Å; E186-K190 PolarHBondContact O-N 3.28Å
187N88.3Confident88.5Confident86 Ų86102.6 Ų102.646%0.4651%0.51SS..Hα-helixtrans-62.9-46.6175.2-71.4-19.4000111A183 E184 K189 K190 E191A183-N187 WeakPolarHBondContact O-CB 3.44Å; A183-N187 VanDerWaalsContact O-CG 3.24Å; A183-N187 PolarHBondContact O-N 3.29Å; A183-N187 PolarHBondContact O-ND2 2.83Å; E184-N187 PolarHBondContact O-N 2.95Å; N187-K189 VanDerWaalsContact C-N 3.31Å; N187-K189 PolarHBondContact O-N 2.97Å; N187-K190 WeakPolarHBondContact O-CB 3.4Å; N187-K190 PolarHBondContact O-N 3.35Å; N187-K190 VanDerWaalsContact O-N 3.15Å; N187-E191 WeakPolarHBondContact O-CG 3.44Å; N187-E191 PolarHBondContact O-N 3.49Å
188L87.2Confident88.5Confident96 Ų96102.2 Ų102.250%0.50351%0.51SS..Hα-helixtrans-60.4-39.7174.8-75.5171.3000112.1E184 E191 L192E184-L188 WeakPolarHBondContact O-CB 3.39Å; E184-L188 WeakPolarHBondContact O-CG 3.37Å; E184-L188 PolarHBondContact O-N 3.39Å; L188-E191 PolarHBondContact O-N 3.14Å; L188-L192 WeakPolarHBondContact O-CB 3.27Å; L188-L192 VanDerWaalsContact O-CG 3.25Å; L188-L192 WeakPolarHBondContact O-CG 3.25Å; L188-L192 PolarHBondContact O-N 2.83Å
189K88.4Confident88.4Confident132 Ų132100 Ų10057%0.57450%0.503SS*.Hα-helixtrans-61.7-45.1174.2-78.9175.8-179.7-1750111.5K185 E186 N187 E191 L192 E193K185-K189 WeakPolarHBondContact O-CB 3.34Å; K185-K189 VanDerWaalsContact O-CG 3.26Å; K185-K189 WeakPolarHBondContact O-CG 3.28Å; K185-K189 PolarHBondContact O-N 3.32Å; E186-K189 PolarHBondContact O-N 3.49Å; N187-K189 VanDerWaalsContact C-N 3.31Å; N187-K189 PolarHBondContact O-N 2.97Å; K189-E191 VanDerWaalsContact C-N 3.35Å; K189-E191 PolarHBondContact O-N 3.15Å; K189-L192 PolarHBondContact O-N 3.4Å; K189-E193 WeakPolarHBondContact O-CB 3.35Å; K189-E193 VanDerWaalsContact O-CG 3.28Å; K189-E193 WeakPolarHBondContact O-CG 3.31Å; K189-E193 PolarHBondContact O-N 2.86Å
190K90.2Very high88.3Confident126 Ų12696.1 Ų96.155%0.54849%0.493SS..Hα-helixtrans-63.1-40.2176.4-70.7171.7-175.8169.70111.9E186 N187 E193 A194E186-K190 WeakPolarHBondContact O-CG 3.38Å; E186-K190 PolarHBondContact O-N 3.28Å; N187-K190 WeakPolarHBondContact O-CB 3.4Å; N187-K190 PolarHBondContact O-N 3.35Å; N187-K190 VanDerWaalsContact O-N 3.15Å; K190-E193 PolarHBondContact O-N 3.42Å; K190-A194 WeakPolarHBondContact O-CB 3.27Å; K190-A194 PolarHBondContact O-N 3.41Å
191E86.7Confident88.3Confident124 Ų12497.7 Ų97.758%0.57950%0.498SS*.Hα-helixtrans-65.1-44.9175-72.9-17617500111.6N187 L188 K189 E193 A194 V195N187-E191 WeakPolarHBondContact O-CG 3.44Å; N187-E191 PolarHBondContact O-N 3.49Å; L188-E191 PolarHBondContact O-N 3.14Å; K189-E191 VanDerWaalsContact C-N 3.35Å; K189-E191 PolarHBondContact O-N 3.15Å; E191-E193 PolarHBondContact O-N 2.91Å; E191-A194 WeakPolarHBondContact O-CB 3.47Å; E191-A194 PolarHBondContact O-N 3.18Å; E191-V195 VanDerWaalsContact O-CG2 3.31Å; E191-V195 WeakPolarHBondContact O-CG2 3.5Å; E191-V195 PolarHBondContact O-N 2.81Å
192L87.1Confident88.1Confident105 Ų10598.1 Ų98.155%0.5550%0.498SS..Hα-helixtrans-62.1-42.1175.1-74.6171.5000111.8L188 K189 A194 V195 N196L188-L192 WeakPolarHBondContact O-CB 3.27Å; L188-L192 VanDerWaalsContact O-CG 3.25Å; L188-L192 WeakPolarHBondContact O-CG 3.25Å; L188-L192 PolarHBondContact O-N 2.83Å; K189-L192 PolarHBondContact O-N 3.4Å; L192-A194 VanDerWaalsContact C-N 3.33Å; L192-A194 PolarHBondContact O-N 3.37Å; L192-V195 PolarHBondContact O-N 2.84Å; L192-N196 VanDerWaalsContact O-CB 3.27Å; L192-N196 WeakPolarHBondContact O-CB 3.38Å; L192-N196 PolarHBondContact O-N 2.85Å; L192-N196 PolarHBondContact O-ND2 3.45Å
193E89.4Confident87.8Confident128 Ų12896.2 Ų96.260%0.59849%0.494SS*.Hα-helixtrans-60.9-41.6173.4-75.8171.1-168.700111.5K189 K190 E191 N196 A197K189-E193 WeakPolarHBondContact O-CB 3.35Å; K189-E193 VanDerWaalsContact O-CG 3.28Å; K189-E193 WeakPolarHBondContact O-CG 3.31Å; K189-E193 PolarHBondContact O-N 2.86Å; K190-E193 PolarHBondContact O-N 3.42Å; E191-E193 PolarHBondContact O-N 2.91Å; E193-N196 PolarHBondContact O-N 2.9Å; E193-A197 VanDerWaalsContact O-CB 3.31Å; E193-A197 WeakPolarHBondContact O-CB 3.45Å; E193-A197 PolarHBondContact O-N 2.83Å
194A90.1Very high87.6Confident61 Ų6198.5 Ų98.550%0.50450%0.5SS..Hα-helixtrans-65.7-4217600000112.3K190 E191 L192 A197 Y198K190-A194 WeakPolarHBondContact O-CB 3.27Å; K190-A194 PolarHBondContact O-N 3.41Å; E191-A194 WeakPolarHBondContact O-CB 3.47Å; E191-A194 PolarHBondContact O-N 3.18Å; L192-A194 VanDerWaalsContact C-N 3.33Å; L192-A194 PolarHBondContact O-N 3.37Å; A194-A197 PolarHBondContact O-N 2.87Å; A194-Y198 WeakPolarHBondContact O-CB 3.25Å; A194-Y198 PolarHBondContact O-N 2.88Å
195V85.3Confident87.6Confident82 Ų8298.3 Ų98.350%0.49750%0.499SS..Hα-helixtrans-64.7-43.4175171.90000110.6E191 L192 Y198 T199E191-V195 VanDerWaalsContact O-CG2 3.31Å; E191-V195 WeakPolarHBondContact O-CG2 3.5Å; E191-V195 PolarHBondContact O-N 2.81Å; L192-V195 PolarHBondContact O-N 2.84Å; V195-Y198 PolarHBondContact O-N 2.92Å; V195-T199 HydrophobicContact CG1-CG2 4.3Å; V195-T199 WeakPolarHBondContact O-CB 3.4Å; V195-T199 VanDerWaalsContact O-CG2 3.31Å; V195-T199 WeakPolarHBondContact O-CG2 3.34Å; V195-T199 PolarHBondContact O-N 3.34Å; V195-T199 PolarHBondContact O-OG1 3.05Å
196N87.2Confident87.4Confident97 Ų9797 Ų9752%0.51950%0.495SS..Hα-helixtrans-64.5-41177-71.5-18.4000111.6L192 E193 Y198 T199 A200L192-N196 VanDerWaalsContact O-CB 3.27Å; L192-N196 WeakPolarHBondContact O-CB 3.38Å; L192-N196 PolarHBondContact O-N 2.85Å; L192-N196 PolarHBondContact O-ND2 3.45Å; E193-N196 PolarHBondContact O-N 2.9Å; N196-Y198 VanDerWaalsContact C-N 3.35Å; N196-T199 VanDerWaalsContact CA-OG1 3.25Å; N196-T199 WeakPolarHBondContact CA-OG1 3.46Å; N196-T199 PolarHBondContact O-OG1 3.28Å; N196-A200 VanDerWaalsContact O-CB 3.27Å; N196-A200 WeakPolarHBondContact O-CB 3.31Å; N196-A200 PolarHBondContact O-N 3.48Å
197A89.3Confident87Confident53 Ų5397.4 Ų97.444%0.43850%0.496SS..Hα-helixtrans-65.2-39.2174.500000111.9E193 A194 K201E193-A197 VanDerWaalsContact O-CB 3.31Å; E193-A197 WeakPolarHBondContact O-CB 3.45Å; E193-A197 PolarHBondContact O-N 2.83Å; A194-A197 PolarHBondContact O-N 2.87Å; A197-K201 WeakPolarHBondContact O-CG 3.45Å; A197-K201 PolarHBondContact O-N 2.78Å
198Y86.6Confident87Confident147 Ų14799.2 Ų99.258%0.57651%0.506SS*.Hα-helixtrans-67.8-45176.9-177.8-96.1000112.2A194 V195 N196 K201 K202A194-Y198 WeakPolarHBondContact O-CB 3.25Å; A194-Y198 PolarHBondContact O-N 2.88Å; V195-Y198 PolarHBondContact O-N 2.92Å; N196-Y198 VanDerWaalsContact C-N 3.35Å; Y198-K201 WeakPolarHBondContact O-CB 3.31Å; Y198-K201 PolarHBondContact O-N 3.08Å; Y198-K202 HydrophobicContact CD1-CG 4.11Å; Y198-K202 HydrophobicContact CE1-CD 4.42Å; Y198-K202 HydrophobicContact CE1-CG 3.66Å; Y198-K202 WeakPolarHBondContact O-CG 3.45Å; Y198-K202 PolarHBondContact O-N 3.3Å; Y198-K202 WeakPolarHBondContact OH-CE 3.36Å
199T88.1Confident86.8Confident59 Ų5999.6 Ų99.636%0.36251%0.507SS..Hα-helixtrans-63.2-45.2176.6490000111V195 N196 K201 K202 D203V195-T199 HydrophobicContact CG1-CG2 4.3Å; V195-T199 WeakPolarHBondContact O-CB 3.4Å; V195-T199 VanDerWaalsContact O-CG2 3.31Å; V195-T199 WeakPolarHBondContact O-CG2 3.34Å; V195-T199 PolarHBondContact O-N 3.34Å; V195-T199 PolarHBondContact O-OG1 3.05Å; N196-T199 VanDerWaalsContact CA-OG1 3.25Å; N196-T199 WeakPolarHBondContact CA-OG1 3.46Å; N196-T199 PolarHBondContact O-OG1 3.28Å; T199-K201 VanDerWaalsContact C-N 3.32Å; T199-K201 PolarHBondContact O-N 2.81Å; T199-K202 CarbonylContact O-C 3.59Å; T199-K202 PolarHBondContact O-N 2.97Å; T199-K202 VanDerWaalsContact O-N 3.08Å; T199-D203 WeakPolarHBondContact O-CB 3.25Å; T199-D203 PolarHBondContact O-N 3.34Å
200A87.9Confident86.6Confident47 Ų4799.3 Ų99.339%0.38851%0.506SS..Hα-helixtrans-59.1-40.7174.300000112.6N196 N204N196-A200 VanDerWaalsContact O-CB 3.27Å; N196-A200 WeakPolarHBondContact O-CB 3.31Å; N196-A200 PolarHBondContact O-N 3.48Å; A200-N204 WeakPolarHBondContact O-CB 3.26Å; A200-N204 PolarHBondContact O-N 2.9Å; A200-N204 PolarHBondContact O-ND2 2.89Å
201K87.5Confident86.4Confident142 Ų14295.8 Ų95.862%0.61750%0.5SS*.Hα-helixtrans-62.5-45.1173-77.9178.4-180-178.20111.8A197 Y198 T199 N204 E205A197-K201 WeakPolarHBondContact O-CG 3.45Å; A197-K201 PolarHBondContact O-N 2.78Å; Y198-K201 WeakPolarHBondContact O-CB 3.31Å; Y198-K201 PolarHBondContact O-N 3.08Å; T199-K201 VanDerWaalsContact C-N 3.32Å; T199-K201 PolarHBondContact O-N 2.81Å; K201-N204 PolarHBondContact O-N 3.26Å; K201-E205 WeakPolarHBondContact O-CG 3.29Å; K201-E205 PolarHBondContact O-N 3.31Å
202K85.8Confident86.4Confident73 Ų7392.5 Ų92.532%0.31749%0.494SS..Hα-helixtrans-64.9-40.2178.4-77-72.8164-151.30112.4Y198 T199 E205 Q206Y198-K202 HydrophobicContact CD1-CG 4.11Å; Y198-K202 HydrophobicContact CE1-CD 4.42Å; Y198-K202 HydrophobicContact CE1-CG 3.66Å; Y198-K202 WeakPolarHBondContact O-CG 3.45Å; Y198-K202 PolarHBondContact O-N 3.3Å; Y198-K202 WeakPolarHBondContact OH-CE 3.36Å; T199-K202 CarbonylContact O-C 3.59Å; T199-K202 PolarHBondContact O-N 2.97Å; T199-K202 VanDerWaalsContact O-N 3.08Å; K202-E205 IonicContact NZ-OE1 3.89Å; K202-E205 IonicContact NZ-OE2 3.64Å; K202-E205 PolarHBondContact NZ-OE2 3.35Å; K202-E205 PolarHBondContact O-N 2.88Å; K202-Q206 WeakPolarHBondContact O-CB 3.3Å; K202-Q206 WeakPolarHBondContact O-CG 3.49Å; K202-Q206 PolarHBondContact O-N 3.49Å
203D84.6Confident86.3Confident82 Ų8291.7 Ų91.744%0.43949%0.489SS..Hα-helixtrans-64.8-41.9175.8-72.6-16.7000110.8T199 Q206 Q207T199-D203 WeakPolarHBondContact O-CB 3.25Å; T199-D203 PolarHBondContact O-N 3.34Å; D203-Q206 PolarHBondContact O-N 3.27Å; D203-Q207 WeakPolarHBondContact O-CB 3.34Å; D203-Q207 VanDerWaalsContact O-CG 3.25Å; D203-Q207 WeakPolarHBondContact O-CG 3.43Å; D203-Q207 PolarHBondContact O-N 3.46Å
204N87.3Confident86.1Confident92 Ų9291.8 Ų91.849%0.49249%0.488SS..Hα-helixtrans-62.5-44.6173.7-72.8-20.9000111.9A200 K201 Q206 Q207 L208A200-N204 WeakPolarHBondContact O-CB 3.26Å; A200-N204 PolarHBondContact O-N 2.9Å; A200-N204 PolarHBondContact O-ND2 2.89Å; K201-N204 PolarHBondContact O-N 3.26Å; N204-Q206 VanDerWaalsContact C-N 3.34Å; N204-Q206 PolarHBondContact O-N 2.79Å; N204-Q207 PolarHBondContact O-N 3.3Å; N204-L208 VanDerWaalsContact O-CG 3.3Å; N204-L208 WeakPolarHBondContact O-CG 3.38Å; N204-L208 PolarHBondContact O-N 3.34Å
205E84.6Confident85.8Confident92 Ų9291.5 Ų91.543%0.4348%0.482SS..Hα-helixtrans-58.2-46.3173.8-74.8173.9-174.600111.3K201 K202 Q207 L208 I209K201-E205 WeakPolarHBondContact O-CG 3.29Å; K201-E205 PolarHBondContact O-N 3.31Å; K202-E205 IonicContact NZ-OE1 3.89Å; K202-E205 IonicContact NZ-OE2 3.64Å; K202-E205 PolarHBondContact NZ-OE2 3.35Å; K202-E205 PolarHBondContact O-N 2.88Å; E205-Q207 PolarHBondContact O-N 2.88Å; E205-L208 PolarHBondContact O-N 2.74Å; E205-I209 VanDerWaalsContact O-CG1 3.29Å; E205-I209 WeakPolarHBondContact O-CG1 3.48Å; E205-I209 PolarHBondContact O-N 2.78Å
206Q83Confident85.7Confident99 Ų9996.2 Ų96.246%0.46349%0.491SS..Hα-helixtrans-64.7-38.8177.3-74-174.315.400112.4K202 D203 N204 I209 K210K202-Q206 WeakPolarHBondContact O-CB 3.3Å; K202-Q206 WeakPolarHBondContact O-CG 3.49Å; K202-Q206 PolarHBondContact O-N 3.49Å; D203-Q206 PolarHBondContact O-N 3.27Å; N204-Q206 VanDerWaalsContact C-N 3.34Å; N204-Q206 PolarHBondContact O-N 2.79Å; Q206-I209 PolarHBondContact O-N 2.83Å; Q206-K210 WeakPolarHBondContact O-CB 3.31Å; Q206-K210 VanDerWaalsContact O-CG 3.25Å; Q206-K210 WeakPolarHBondContact O-CG 3.43Å; Q206-K210 PolarHBondContact O-N 2.82Å
207Q83.2Confident85.4Confident122 Ų12296.6 Ų96.657%0.5749%0.489SS*.Hα-helixtrans-65.2-40.8175.6-7618018.800111.2D203 N204 E205 K210 A211D203-Q207 WeakPolarHBondContact O-CB 3.34Å; D203-Q207 VanDerWaalsContact O-CG 3.25Å; D203-Q207 WeakPolarHBondContact O-CG 3.43Å; D203-Q207 PolarHBondContact O-N 3.46Å; N204-Q207 PolarHBondContact O-N 3.3Å; E205-Q207 PolarHBondContact O-N 2.88Å; Q207-K210 PolarHBondContact O-N 2.93Å; Q207-A211 VanDerWaalsContact O-CB 3.26Å; Q207-A211 WeakPolarHBondContact O-CB 3.25Å; Q207-A211 PolarHBondContact O-N 2.92Å
208L86.9Confident85.2Confident125 Ų12598.9 Ų98.965%0.65449%0.491SS*.Hα-helixtrans-63.3-43.6174.1-71.5171.8000111.6N204 E205 A211 A212N204-L208 VanDerWaalsContact O-CG 3.3Å; N204-L208 WeakPolarHBondContact O-CG 3.38Å; N204-L208 PolarHBondContact O-N 3.34Å; E205-L208 PolarHBondContact O-N 2.74Å; L208-A211 PolarHBondContact O-N 3.11Å; L208-A212 WeakPolarHBondContact O-CB 3.33Å; L208-A212 PolarHBondContact O-N 2.9Å
209I84.2Confident84.9Confident103 Ų10397.4 Ų97.453%0.52849%0.489SS..Hα-helixtrans-62.1-47175-67.4165000110.3E205 Q206 A211 A212 I213E205-I209 VanDerWaalsContact O-CG1 3.29Å; E205-I209 WeakPolarHBondContact O-CG1 3.48Å; E205-I209 PolarHBondContact O-N 2.78Å; Q206-I209 PolarHBondContact O-N 2.83Å; I209-A211 VanDerWaalsContact C-N 3.32Å; I209-A211 PolarHBondContact O-N 3.33Å; I209-A212 PolarHBondContact O-N 3.43Å; I209-I213 HydrophobicContact CG2-CD1 3.83Å; I209-I213 HydrophobicContact CG2-CG1 4.44Å; I209-I213 VanDerWaalsContact O-CG1 3.3Å; I209-I213 WeakPolarHBondContact O-CG1 3.14Å; I209-I213 PolarHBondContact O-N 2.87Å
210K84.2Confident84.7Confident126 Ų12698.1 Ų98.155%0.54849%0.49SS..Hα-helixtrans-61.3-40.3176.8-75.9172.7-179.1172.30111.5Q206 Q207 I213 K214Q206-K210 WeakPolarHBondContact O-CB 3.31Å; Q206-K210 VanDerWaalsContact O-CG 3.25Å; Q206-K210 WeakPolarHBondContact O-CG 3.43Å; Q206-K210 PolarHBondContact O-N 2.82Å; Q207-K210 PolarHBondContact O-N 2.93Å; K210-I213 PolarHBondContact O-N 3.25Å; K210-K214 WeakPolarHBondContact O-CB 3.38Å; K210-K214 VanDerWaalsContact O-CG 3.31Å; K210-K214 WeakPolarHBondContact O-CG 3.49Å; K210-K214 PolarHBondContact O-N 3.39Å
211A86Confident84.6Confident53 Ų53101.3 Ų101.344%0.43850%0.497SS..Hα-helixtrans-65.1-42.117600000111.6Q207 L208 I209 K214 S215Q207-A211 VanDerWaalsContact O-CB 3.26Å; Q207-A211 WeakPolarHBondContact O-CB 3.25Å; Q207-A211 PolarHBondContact O-N 2.92Å; L208-A211 PolarHBondContact O-N 3.11Å; I209-A211 VanDerWaalsContact C-N 3.32Å; I209-A211 PolarHBondContact O-N 3.33Å; A211-K214 PolarHBondContact O-N 3.43Å; A211-S215 WeakPolarHBondContact O-CB 3.3Å; A211-S215 PolarHBondContact O-N 2.93Å; A211-S215 PolarHBondContact O-OG 3.31Å
212A86.6Confident84.5Confident54 Ų54100.3 Ų100.345%0.44649%0.493SS..Hα-helixtrans-66-37.6175.700000112.6L208 I209 S215 R216L208-A212 WeakPolarHBondContact O-CB 3.33Å; L208-A212 PolarHBondContact O-N 2.9Å; I209-A212 PolarHBondContact O-N 3.43Å; A212-S215 WeakPolarHBondContact CA-OG 3.49Å; A212-S215 PolarHBondContact O-OG 2.88Å; A212-R216 WeakPolarHBondContact O-CB 3.41Å; A212-R216 PolarHBondContact O-N 3.03Å
213I85.1Confident84.4Confident88 Ų88101.6 Ų101.645%0.45150%0.502SS..Hα-helixtrans-65.1-46.6173.1-68.2167.5000109.9I209 K210 R216 Q217I209-I213 HydrophobicContact CG2-CD1 3.83Å; I209-I213 HydrophobicContact CG2-CG1 4.44Å; I209-I213 VanDerWaalsContact O-CG1 3.3Å; I209-I213 WeakPolarHBondContact O-CG1 3.14Å; I209-I213 PolarHBondContact O-N 2.87Å; K210-I213 PolarHBondContact O-N 3.25Å; I213-R216 PolarHBondContact O-N 2.9Å; I213-Q217 HydrophobicContact CG2-CG 4.38Å; I213-Q217 WeakPolarHBondContact O-CB 3.46Å; I213-Q217 WeakPolarHBondContact O-CG 3.4Å; I213-Q217 PolarHBondContact O-N 3.32Å
214K83.9Confident84.3Confident131 Ų131103.4 Ų103.457%0.5751%0.508SS*.Hα-helixtrans-60.7-46.5177-76.5-179.2177.2-170.20112K210 A211 R216 Q217 E218K210-K214 WeakPolarHBondContact O-CB 3.38Å; K210-K214 VanDerWaalsContact O-CG 3.31Å; K210-K214 WeakPolarHBondContact O-CG 3.49Å; K210-K214 PolarHBondContact O-N 3.39Å; A211-K214 PolarHBondContact O-N 3.43Å; K214-R216 VanDerWaalsContact C-N 3.27Å; K214-R216 PolarHBondContact O-N 3.32Å; K214-Q217 WeakPolarHBondContact O-CB 3.49Å; K214-Q217 PolarHBondContact O-N 2.84Å; K214-Q217 VanDerWaalsContact O-N 3.11Å; K214-E218 WeakPolarHBondContact O-CG 3.44Å; K214-E218 PolarHBondContact O-N 3.41Å
215S85.5Confident84.1Confident54 Ų54104 Ų10438%0.37851%0.511SS..Hα-helixtrans-63-3617868.40000112A211 A212 H219A211-S215 WeakPolarHBondContact O-CB 3.3Å; A211-S215 PolarHBondContact O-N 2.93Å; A211-S215 PolarHBondContact O-OG 3.31Å; A212-S215 WeakPolarHBondContact CA-OG 3.49Å; A212-S215 PolarHBondContact O-OG 2.88Å; S215-H219 PolarHBondContact O-N 3Å; S215-H219 PolarHBondContact O-ND1 2.97Å
216R82.2Confident84.2Confident182 Ų182104.2 Ų104.269%0.68751%0.513SS*.Hα-helixtrans-67.7-41.6173.3-175.4177.9179.61790.4111.6A212 I213 K214 H219 I220A212-R216 WeakPolarHBondContact O-CB 3.41Å; A212-R216 PolarHBondContact O-N 3.03Å; I213-R216 PolarHBondContact O-N 2.9Å; K214-R216 VanDerWaalsContact C-N 3.27Å; K214-R216 PolarHBondContact O-N 3.32Å; R216-H219 PolarHBondContact O-N 2.77Å; R216-I220 HydrophobicContact CG-CD1 4.1Å; R216-I220 VanDerWaalsContact O-CG1 3.28Å; R216-I220 WeakPolarHBondContact O-CG1 3.5Å; R216-I220 PolarHBondContact O-N 3.03Å
217Q81.9Confident84.2Confident104 Ų104104.1 Ų104.149%0.48652%0.515SS..Hα-helixtrans-62.1-46.9174.9-76.5174.2-24.500110.9I213 K214 H219 I220 E221I213-Q217 HydrophobicContact CG2-CG 4.38Å; I213-Q217 WeakPolarHBondContact O-CB 3.46Å; I213-Q217 WeakPolarHBondContact O-CG 3.4Å; I213-Q217 PolarHBondContact O-N 3.32Å; K214-Q217 WeakPolarHBondContact O-CB 3.49Å; K214-Q217 PolarHBondContact O-N 2.84Å; K214-Q217 VanDerWaalsContact O-N 3.11Å; Q217-H219 VanDerWaalsContact C-N 3.28Å; Q217-H219 PolarHBondContact O-N 2.83Å; Q217-I220 CarbonylContact O-C 3.54Å; Q217-I220 WeakPolarHBondContact O-CA 3.35Å; Q217-I220 WeakPolarHBondContact O-CB 3.24Å; Q217-I220 PolarHBondContact O-N 2.94Å; Q217-E221 WeakPolarHBondContact O-CG 3.47Å; Q217-E221 PolarHBondContact O-N 3.3Å
218E84.8Confident84.3Confident101 Ų10199.7 Ų99.747%0.47250%0.501SS..Hα-helixtrans-59.8-37.1174.8-71.3171.7-168.400112.2K214 K222K214-E218 WeakPolarHBondContact O-CG 3.44Å; K214-E218 PolarHBondContact O-N 3.41Å; E218-K222 WeakPolarHBondContact O-CB 3.28Å; E218-K222 VanDerWaalsContact O-CG 3.24Å; E218-K222 WeakPolarHBondContact O-CG 3.32Å; E218-K222 PolarHBondContact O-N 3.42Å
219H80.7Confident84.2Confident116 Ų116100.1 Ų100.154%0.53750%0.498SS..Hα-helixtrans-67.1-40.1173.1-82.550.5000112S215 R216 Q217 L223S215-H219 PolarHBondContact O-N 3Å; S215-H219 PolarHBondContact O-ND1 2.97Å; R216-H219 PolarHBondContact O-N 2.77Å; Q217-H219 VanDerWaalsContact C-N 3.28Å; Q217-H219 PolarHBondContact O-N 2.83Å; H219-L223 WeakPolarHBondContact O-CB 3.27Å; H219-L223 VanDerWaalsContact O-CG 3.27Å; H219-L223 WeakPolarHBondContact O-CG 3.47Å; H219-L223 PolarHBondContact O-N 3.27Å
220I84Confident84.1Confident74 Ų74102.4 Ų102.438%0.37950%0.5SS..Hα-helixtrans-65.3-44.3175.6-69.4165.5000110.3R216 Q217 L223 Q224R216-I220 HydrophobicContact CG-CD1 4.1Å; R216-I220 VanDerWaalsContact O-CG1 3.28Å; R216-I220 WeakPolarHBondContact O-CG1 3.5Å; R216-I220 PolarHBondContact O-N 3.03Å; Q217-I220 CarbonylContact O-C 3.54Å; Q217-I220 WeakPolarHBondContact O-CA 3.35Å; Q217-I220 WeakPolarHBondContact O-CB 3.24Å; Q217-I220 PolarHBondContact O-N 2.94Å; I220-L223 CarbonylContact O-C 3.49Å; I220-L223 PolarHBondContact O-N 3.39Å; I220-Q224 HydrophobicContact CG2-CG 4.29Å; I220-Q224 WeakPolarHBondContact O-CB 3.48Å; I220-Q224 VanDerWaalsContact O-CG 3.3Å; I220-Q224 WeakPolarHBondContact O-CG 3.47Å; I220-Q224 PolarHBondContact O-N 3.37Å
221E84.7Confident84.1Confident114 Ų114101.7 Ų101.753%0.53350%0.502SS..Hα-helixtrans-61.6-45.4176.7-76.3177.6179.900111Q217 L223 Q224 D225Q217-E221 WeakPolarHBondContact O-CG 3.47Å; Q217-E221 PolarHBondContact O-N 3.3Å; E221-L223 VanDerWaalsContact C-N 3.33Å; E221-L223 PolarHBondContact O-N 2.99Å; E221-Q224 CarbonylContact O-C 3.59Å; E221-Q224 WeakPolarHBondContact O-CB 3.3Å; E221-Q224 PolarHBondContact O-N 2.87Å; E221-Q224 VanDerWaalsContact O-N 3.12Å; E221-D225 WeakPolarHBondContact O-CB 3.42Å; E221-D225 PolarHBondContact O-N 3.38Å
222K85.5Confident84Confident122 Ų122104 Ų10453%0.5351%0.506SS..Hα-helixtrans-59-43.4173.6-74.9172.8-176.2176.60112.3E218 Q224 D225 E226E218-K222 WeakPolarHBondContact O-CB 3.28Å; E218-K222 VanDerWaalsContact O-CG 3.24Å; E218-K222 WeakPolarHBondContact O-CG 3.32Å; E218-K222 PolarHBondContact O-N 3.42Å; K222-Q224 VanDerWaalsContact C-N 3.34Å; K222-D225 PolarHBondContact O-N 3.12Å; K222-E226 WeakPolarHBondContact O-CB 3.31Å; K222-E226 VanDerWaalsContact O-CG 3.31Å; K222-E226 WeakPolarHBondContact O-CG 3.22Å; K222-E226 PolarHBondContact O-N 2.97Å
223L84.1Confident84Confident99 Ų99106.7 Ų106.752%0.51851%0.509SS..Hα-helixtrans-64.8-38.4175.2-74.5169.1000111.8H219 I220 E221 E226 L227H219-L223 WeakPolarHBondContact O-CB 3.27Å; H219-L223 VanDerWaalsContact O-CG 3.27Å; H219-L223 WeakPolarHBondContact O-CG 3.47Å; H219-L223 PolarHBondContact O-N 3.27Å; I220-L223 CarbonylContact O-C 3.49Å; I220-L223 PolarHBondContact O-N 3.39Å; E221-L223 VanDerWaalsContact C-N 3.33Å; E221-L223 PolarHBondContact O-N 2.99Å; L223-E226 PolarHBondContact O-N 2.86Å; L223-L227 WeakPolarHBondContact O-CB 3.3Å; L223-L227 WeakPolarHBondContact O-CG 3.48Å; L223-L227 PolarHBondContact O-N 2.9Å
224Q81.4Confident84Confident120 Ų120107.9 Ų107.956%0.56151%0.511SS*.Hα-helixtrans-66.6-40.7175.5-76.3177.4-9.500111.5I220 E221 K222 L227 G228I220-Q224 HydrophobicContact CG2-CG 4.29Å; I220-Q224 WeakPolarHBondContact O-CB 3.48Å; I220-Q224 VanDerWaalsContact O-CG 3.3Å; I220-Q224 WeakPolarHBondContact O-CG 3.47Å; I220-Q224 PolarHBondContact O-N 3.37Å; E221-Q224 CarbonylContact O-C 3.59Å; E221-Q224 WeakPolarHBondContact O-CB 3.3Å; E221-Q224 PolarHBondContact O-N 2.87Å; E221-Q224 VanDerWaalsContact O-N 3.12Å; K222-Q224 VanDerWaalsContact C-N 3.34Å; Q224-L227 PolarHBondContact O-N 2.78Å; Q224-G228 PolarHBondContact O-N 2.74Å
225D84.7Confident83.8Confident105 Ų105106.4 Ų106.456%0.56151%0.506SS*.Hα-helixtrans-64.7-42.3174.5-77.9-15.2000111.4E221 K222 G228 K229E221-D225 WeakPolarHBondContact O-CB 3.42Å; E221-D225 PolarHBondContact O-N 3.38Å; K222-D225 PolarHBondContact O-N 3.12Å; D225-G228 PolarHBondContact O-N 3.39Å; D225-K229 WeakPolarHBondContact O-CB 3.37Å; D225-K229 VanDerWaalsContact O-CG 3.3Å; D225-K229 WeakPolarHBondContact O-CG 3.46Å; D225-K229 PolarHBondContact O-N 3.24Å
226E85.5Confident83.7Confident97 Ų97110.1 Ų110.145%0.45352%0.516SS..Hα-helixtrans-63.5-44.2174.1-75.5176.6-169.200111.8K222 L223 K229 R230K222-E226 WeakPolarHBondContact O-CB 3.31Å; K222-E226 VanDerWaalsContact O-CG 3.31Å; K222-E226 WeakPolarHBondContact O-CG 3.22Å; K222-E226 PolarHBondContact O-N 2.97Å; L223-E226 PolarHBondContact O-N 2.86Å; E226-K229 PolarHBondContact O-N 2.84Å; E226-R230 WeakPolarHBondContact O-CG 3.45Å; E226-R230 PolarHBondContact O-N 3.46Å
227L83.3Confident83.9Confident97 Ų97105.6 Ų105.651%0.50850%0.502SS..Hα-helixtrans-64.9-40.1174.9-74.9171.6000111.6L223 Q224 R230 L231L223-L227 WeakPolarHBondContact O-CB 3.3Å; L223-L227 WeakPolarHBondContact O-CG 3.48Å; L223-L227 PolarHBondContact O-N 2.9Å; Q224-L227 PolarHBondContact O-N 2.78Å; L227-R230 PolarHBondContact O-N 2.87Å; L227-L231 WeakPolarHBondContact O-CB 3.33Å; L227-L231 WeakPolarHBondContact O-CG 3.47Å; L227-L231 PolarHBondContact O-N 3.44Å
228G84.5Confident84Confident28 Ų28110 Ų11029%0.28951%0.514SS..Hα-helixtrans-61.8-44.8175.600000111.6Q224 D225 L231 L232Q224-G228 PolarHBondContact O-N 2.74Å; D225-G228 PolarHBondContact O-N 3.39Å; G228-L231 PolarHBondContact O-N 2.78Å; G228-L232 WeakPolarHBondContact O-CB 3.33Å; G228-L232 WeakPolarHBondContact O-CG 3.22Å; G228-L232 PolarHBondContact O-N 2.88Å
229K85.9Confident83.9Confident135 Ų135111.5 Ų111.559%0.58752%0.519SS*.Hα-helixtrans-60.9-46.5173.3-74.2172-175.3173.60111.8D225 E226 L231 L232 E233D225-K229 WeakPolarHBondContact O-CB 3.37Å; D225-K229 VanDerWaalsContact O-CG 3.3Å; D225-K229 WeakPolarHBondContact O-CG 3.46Å; D225-K229 PolarHBondContact O-N 3.24Å; E226-K229 PolarHBondContact O-N 2.84Å; K229-L231 VanDerWaalsContact C-N 3.33Å; K229-L231 PolarHBondContact O-N 3.49Å; K229-L232 PolarHBondContact O-N 3.5Å; K229-E233 WeakPolarHBondContact O-CB 3.33Å; K229-E233 WeakPolarHBondContact O-CG 3.29Å; K229-E233 PolarHBondContact O-N 2.88Å
230R82.3Confident84.1Confident151 Ų151111.3 Ų111.357%0.5752%0.519SS*.Hα-helixtrans-62.7-38.4176.4-73.5179.4-175.4168.36.7112.6E226 L227 E233 K234E226-R230 WeakPolarHBondContact O-CG 3.45Å; E226-R230 PolarHBondContact O-N 3.46Å; L227-R230 PolarHBondContact O-N 2.87Å; R230-E233 PolarHBondContact O-N 3.32Å; R230-K234 WeakPolarHBondContact O-CB 3.47Å; R230-K234 VanDerWaalsContact O-CG 3.22Å; R230-K234 WeakPolarHBondContact O-CG 3.46Å; R230-K234 PolarHBondContact O-N 3.39Å
231L83.2Confident84.2Confident111 Ų111112.2 Ų112.258%0.58153%0.528SS*.Hα-helixtrans-65.8-44.8175.1-79.6167.4000110.9L227 G228 K229 E233 K234 E235L227-L231 WeakPolarHBondContact O-CB 3.33Å; L227-L231 WeakPolarHBondContact O-CG 3.47Å; L227-L231 PolarHBondContact O-N 3.44Å; G228-L231 PolarHBondContact O-N 2.78Å; K229-L231 VanDerWaalsContact C-N 3.33Å; K229-L231 PolarHBondContact O-N 3.49Å; L231-E233 PolarHBondContact O-N 3.43Å; L231-K234 CarbonylContact O-C 3.55Å; L231-K234 PolarHBondContact O-N 3.26Å; L231-E235 WeakPolarHBondContact O-CB 3.36Å; L231-E235 WeakPolarHBondContact O-CG 3.26Å; L231-E235 PolarHBondContact O-N 2.81Å
232L85.1Confident84.2Confident101 Ų101110.9 Ų110.953%0.52952%0.522SS..Hα-helixtrans-63-40.3175.4-73.7171.5000112.2G228 K229 E235 K236G228-L232 WeakPolarHBondContact O-CB 3.33Å; G228-L232 WeakPolarHBondContact O-CG 3.22Å; G228-L232 PolarHBondContact O-N 2.88Å; K229-L232 PolarHBondContact O-N 3.5Å; L232-E235 PolarHBondContact O-N 3.32Å; L232-K236 WeakPolarHBondContact O-CB 3.45Å; L232-K236 VanDerWaalsContact O-CG 3.29Å; L232-K236 WeakPolarHBondContact O-CG 3.45Å; L232-K236 PolarHBondContact O-N 2.81Å
233E85.7Confident84.1Confident110 Ų110110.8 Ų110.851%0.51452%0.523SS..Hα-helixtrans-61.7-46.8172.5-75167.7-177.800110.9K229 R230 L231 E235 K236 E237K229-E233 WeakPolarHBondContact O-CB 3.33Å; K229-E233 WeakPolarHBondContact O-CG 3.29Å; K229-E233 PolarHBondContact O-N 2.88Å; R230-E233 PolarHBondContact O-N 3.32Å; L231-E233 PolarHBondContact O-N 3.43Å; E233-E235 VanDerWaalsContact C-N 3.32Å; E233-E235 PolarHBondContact O-N 3.31Å; E233-K236 WeakPolarHBondContact O-CB 3.4Å; E233-K236 PolarHBondContact O-N 2.93Å; E233-E237 WeakPolarHBondContact O-CG 3.36Å; E233-E237 PolarHBondContact O-N 2.83Å
234K85.6Confident84.2Confident113 Ų113111.3 Ų111.349%0.49153%0.525SS..Hα-helixtrans-63-36.7175.8-74.8-75161.5-147.30112.8R230 L231 E237 R238R230-K234 WeakPolarHBondContact O-CB 3.47Å; R230-K234 VanDerWaalsContact O-CG 3.22Å; R230-K234 WeakPolarHBondContact O-CG 3.46Å; R230-K234 PolarHBondContact O-N 3.39Å; L231-K234 CarbonylContact O-C 3.55Å; L231-K234 PolarHBondContact O-N 3.26Å; K234-E237 WeakPolarHBondContact CD-OE2 3.38Å; K234-E237 IonicContact NZ-OE1 2.67Å; K234-E237 IonicContact NZ-OE2 3.83Å; K234-E237 PolarHBondContact NZ-OE2 3.18Å; K234-R238 WeakPolarHBondContact O-CB 3.31Å; K234-R238 VanDerWaalsContact O-CG 3.26Å; K234-R238 WeakPolarHBondContact O-CG 3.48Å; K234-R238 PolarHBondContact O-N 2.89Å
235E80.3Confident84.3Confident100 Ų100112.5 Ų112.547%0.46752%0.524SS..Hα-helixtrans-68.8-38.7174.1-78-176.2177.400111.8L231 L232 E233 R238 K239L231-E235 WeakPolarHBondContact O-CB 3.36Å; L231-E235 WeakPolarHBondContact O-CG 3.26Å; L231-E235 PolarHBondContact O-N 2.81Å; L232-E235 PolarHBondContact O-N 3.32Å; E233-E235 VanDerWaalsContact C-N 3.32Å; E233-E235 PolarHBondContact O-N 3.31Å; E235-R238 PolarHBondContact O-N 3.41Å; E235-K239 WeakPolarHBondContact O-CB 3.35Å; E235-K239 VanDerWaalsContact O-CG 3.31Å; E235-K239 WeakPolarHBondContact O-CG 3.38Å; E235-K239 PolarHBondContact O-N 3.38Å
236K82.1Confident84.2Confident132 Ų132112.8 Ų112.857%0.57452%0.522SS*.Hα-helixtrans-62.8-49.5172.3-75.1175.5-179-176.30111.1L232 E233 R238 K239 E240L232-K236 WeakPolarHBondContact O-CB 3.45Å; L232-K236 VanDerWaalsContact O-CG 3.29Å; L232-K236 WeakPolarHBondContact O-CG 3.45Å; L232-K236 PolarHBondContact O-N 2.81Å; E233-K236 WeakPolarHBondContact O-CB 3.4Å; E233-K236 PolarHBondContact O-N 2.93Å; K236-R238 VanDerWaalsContact C-N 3.27Å; K236-R238 PolarHBondContact O-N 2.78Å; K236-K239 PolarHBondContact O-N 2.9Å; K236-E240 WeakPolarHBondContact O-CG 3.44Å; K236-E240 PolarHBondContact O-N 3.23Å
237E86.1Confident84.1Confident87 Ų87111.7 Ų111.741%0.40752%0.522SS..Hα-helixtrans-55.4-43.3174.3-72.5174.6-17300111.3E233 K234 E240 V241E233-E237 WeakPolarHBondContact O-CG 3.36Å; E233-E237 PolarHBondContact O-N 2.83Å; K234-E237 WeakPolarHBondContact CD-OE2 3.38Å; K234-E237 IonicContact NZ-OE1 2.67Å; K234-E237 IonicContact NZ-OE2 3.83Å; K234-E237 PolarHBondContact NZ-OE2 3.18Å; E237-E240 PolarHBondContact O-N 2.68Å; E237-V241 WeakPolarHBondContact O-CB 3.26Å; E237-V241 VanDerWaalsContact O-CG2 3.26Å; E237-V241 WeakPolarHBondContact O-CG2 3.39Å; E237-V241 PolarHBondContact O-N 3.07Å
238R83.4Confident84.2Confident196 Ų196111 Ų11174%0.7452%0.518SS*.Hα-helixtrans-63.8-41.7176.1-79.2179.2177.8-1530.2112.4K234 E235 K236 V241 E242K234-R238 WeakPolarHBondContact O-CB 3.31Å; K234-R238 VanDerWaalsContact O-CG 3.26Å; K234-R238 WeakPolarHBondContact O-CG 3.48Å; K234-R238 PolarHBondContact O-N 2.89Å; E235-R238 PolarHBondContact O-N 3.41Å; K236-R238 VanDerWaalsContact C-N 3.27Å; K236-R238 PolarHBondContact O-N 2.78Å; R238-V241 PolarHBondContact O-N 2.84Å; R238-E242 WeakPolarHBondContact O-CB 3.4Å; R238-E242 PolarHBondContact O-N 3.35Å
239K82.8Confident84.3Confident133 Ų133113.3 Ų113.358%0.57852%0.523SS*.Hα-helixtrans-65.1-44.8176.2-75.3174.3-178.5176.80111E235 K236 V241 E242 E243E235-K239 WeakPolarHBondContact O-CB 3.35Å; E235-K239 VanDerWaalsContact O-CG 3.31Å; E235-K239 WeakPolarHBondContact O-CG 3.38Å; E235-K239 PolarHBondContact O-N 3.38Å; K236-K239 PolarHBondContact O-N 2.9Å; K239-V241 VanDerWaalsContact C-N 3.34Å; K239-V241 PolarHBondContact O-N 3.24Å; K239-E242 PolarHBondContact O-N 3.4Å; K239-E243 WeakPolarHBondContact O-CB 3.2Å; K239-E243 VanDerWaalsContact O-CG 3.31Å; K239-E243 WeakPolarHBondContact O-CG 3.46Å; K239-E243 PolarHBondContact O-N 2.77Å
240E85Confident84.4Confident113 Ų113112 Ų11253%0.52852%0.523SS..Hα-helixtrans-59.6-44.2175.5-71.8171.5-168.100111.2K236 E237 E243 I244K236-E240 WeakPolarHBondContact O-CG 3.44Å; K236-E240 PolarHBondContact O-N 3.23Å; E237-E240 PolarHBondContact O-N 2.68Å; E240-E243 PolarHBondContact O-N 3.41Å; E240-I244 WeakPolarHBondContact O-CB 3.36Å; E240-I244 WeakPolarHBondContact O-CD1 3.44Å; E240-I244 WeakPolarHBondContact O-CG1 3.47Å; E240-I244 PolarHBondContact O-N 3.45Å
241V87.3Confident84.5Confident93 Ų93110 Ų11056%0.56452%0.52SS*.Hα-helixtrans-64.2-40.7175.3170.10000111.7E237 R238 K239 I244 R245E237-V241 WeakPolarHBondContact O-CB 3.26Å; E237-V241 VanDerWaalsContact O-CG2 3.26Å; E237-V241 WeakPolarHBondContact O-CG2 3.39Å; E237-V241 PolarHBondContact O-N 3.07Å; R238-V241 PolarHBondContact O-N 2.84Å; K239-V241 VanDerWaalsContact C-N 3.34Å; K239-V241 PolarHBondContact O-N 3.24Å; V241-I244 PolarHBondContact O-N 3.47Å; V241-R245 WeakPolarHBondContact O-CB 3.31Å; V241-R245 PolarHBondContact O-N 3.17Å
242E83.3Confident84.6Confident86 Ų86109 Ų10940%0.40251%0.512SS..Hα-helixtrans-70.4-36.3178.4-163.564.1-156.400111.7R238 K239 R245 Q246R238-E242 WeakPolarHBondContact O-CB 3.4Å; R238-E242 PolarHBondContact O-N 3.35Å; K239-E242 PolarHBondContact O-N 3.4Å; E242-R245 WeakPolarHBondContact O-CB 3.28Å; E242-R245 PolarHBondContact O-N 2.77Å; E242-R245 IonicContact OE2-NH1 2.74Å; E242-Q246 WeakPolarHBondContact O-CB 3.39Å; E242-Q246 VanDerWaalsContact O-CG 3.29Å; E242-Q246 WeakPolarHBondContact O-CG 3.39Å; E242-Q246 PolarHBondContact O-N 2.85Å
243E85.3Confident84.6Confident120 Ų120107.5 Ų107.556%0.56151%0.505SS*.Hα-helixtrans-61.6-47.7170.9-76173.5-169.200110.4K239 E240 R245 Q246 T247K239-E243 WeakPolarHBondContact O-CB 3.2Å; K239-E243 VanDerWaalsContact O-CG 3.31Å; K239-E243 WeakPolarHBondContact O-CG 3.46Å; K239-E243 PolarHBondContact O-N 2.77Å; E240-E243 PolarHBondContact O-N 3.41Å; E243-R245 VanDerWaalsContact C-N 3.27Å; E243-R245 PolarHBondContact O-N 2.88Å; E243-Q246 PolarHBondContact O-N 3.18Å; E243-Q246 VanDerWaalsContact O-N 3.17Å; E243-T247 WeakPolarHBondContact O-CG2 3.29Å; E243-T247 PolarHBondContact O-N 2.91Å; E243-T247 PolarHBondContact O-OG1 2.86Å
244I85.6Confident84.7Confident109 Ų109106.7 Ų106.756%0.55950%0.504SS*.Hα-helixtrans-58.5-41.3174.4-69.1164000110.7E240 V241 T247 L248E240-I244 WeakPolarHBondContact O-CB 3.36Å; E240-I244 WeakPolarHBondContact O-CD1 3.44Å; E240-I244 WeakPolarHBondContact O-CG1 3.47Å; E240-I244 PolarHBondContact O-N 3.45Å; V241-I244 PolarHBondContact O-N 3.47Å; I244-T247 VanDerWaalsContact C-OG1 3.32Å; I244-T247 VanDerWaalsContact CA-OG1 3.28Å; I244-T247 WeakPolarHBondContact CA-OG1 3.49Å; I244-T247 PolarHBondContact O-N 2.96Å; I244-T247 PolarHBondContact O-OG1 3.4Å; I244-L248 WeakPolarHBondContact O-CB 3.45Å; I244-L248 PolarHBondContact O-N 3.3Å
245R83.5Confident84.6Confident146 Ų146106.1 Ų106.155%0.55150%0.501SS*.Hα-helixtrans-64.7-43.1177.2-171.3-177.4-175.1-172.51.6111.6V241 E242 E243 L248 I249V241-R245 WeakPolarHBondContact O-CB 3.31Å; V241-R245 PolarHBondContact O-N 3.17Å; E242-R245 WeakPolarHBondContact O-CB 3.28Å; E242-R245 PolarHBondContact O-N 2.77Å; E242-R245 IonicContact OE2-NH1 2.74Å; E243-R245 VanDerWaalsContact C-N 3.27Å; E243-R245 PolarHBondContact O-N 2.88Å; R245-L248 PolarHBondContact O-N 3.46Å; R245-I249 HydrophobicContact CG-CD1 4.22Å; R245-I249 VanDerWaalsContact O-CG1 3.29Å; R245-I249 WeakPolarHBondContact O-CG1 3.35Å; R245-I249 PolarHBondContact O-N 2.83Å
246Q82Confident84.8Confident111 Ų111106.5 Ų106.552%0.51950%0.501SS..Hα-helixtrans-63.8-43.8175.7-73.1174.715.300111.2E242 E243 L248 I249 L250E242-Q246 WeakPolarHBondContact O-CB 3.39Å; E242-Q246 VanDerWaalsContact O-CG 3.29Å; E242-Q246 WeakPolarHBondContact O-CG 3.39Å; E242-Q246 PolarHBondContact O-N 2.85Å; E243-Q246 PolarHBondContact O-N 3.18Å; E243-Q246 VanDerWaalsContact O-N 3.17Å; Q246-L248 VanDerWaalsContact C-N 3.32Å; Q246-L248 PolarHBondContact O-N 3.29Å; Q246-I249 PolarHBondContact O-N 3.27Å; Q246-L250 WeakPolarHBondContact O-CG 3.34Å; Q246-L250 PolarHBondContact O-N 2.95Å
247T84Confident85Confident73 Ų73103.3 Ų103.345%0.44849%0.49SS..Hα-helixtrans-62.4-40.5175.254.40000111.6E243 I244 L250 E251E243-T247 WeakPolarHBondContact O-CG2 3.29Å; E243-T247 PolarHBondContact O-N 2.91Å; E243-T247 PolarHBondContact O-OG1 2.86Å; I244-T247 VanDerWaalsContact C-OG1 3.32Å; I244-T247 VanDerWaalsContact CA-OG1 3.28Å; I244-T247 WeakPolarHBondContact CA-OG1 3.49Å; I244-T247 PolarHBondContact O-N 2.96Å; I244-T247 PolarHBondContact O-OG1 3.4Å; T247-L250 PolarHBondContact O-N 3.45Å; T247-E251 WeakPolarHBondContact O-CB 3.48Å; T247-E251 WeakPolarHBondContact O-CG 3.36Å; T247-E251 PolarHBondContact O-N 3.47Å
248L85.9Confident84.9Confident82 Ų82105.8 Ų105.843%0.42950%0.495SS..Hα-helixtrans-63.6-43.7176.8-177.266.7000111.3I244 R245 Q246 L250 E251 E252I244-L248 WeakPolarHBondContact O-CB 3.45Å; I244-L248 PolarHBondContact O-N 3.3Å; R245-L248 PolarHBondContact O-N 3.46Å; Q246-L248 VanDerWaalsContact C-N 3.32Å; Q246-L248 PolarHBondContact O-N 3.29Å; L248-L250 VanDerWaalsContact C-N 3.32Å; L248-L250 PolarHBondContact O-N 3.34Å; L248-E251 PolarHBondContact O-N 3.38Å; L248-E252 HydrophobicContact CD1-CG 4.46Å; L248-E252 HydrophobicContact CG-CG 4.42Å; L248-E252 WeakPolarHBondContact O-CB 3.45Å; L248-E252 VanDerWaalsContact O-CG 3.3Å; L248-E252 WeakPolarHBondContact O-CG 3.39Å; L248-E252 PolarHBondContact O-N 2.8Å
249I86.8Confident84.9Confident77 Ų77101.5 Ų101.540%0.39548%0.484SS..Hα-helixtrans-61.3-42.4176.2-69.9165.6000110.8R245 Q246 E252 N253R245-I249 HydrophobicContact CG-CD1 4.22Å; R245-I249 VanDerWaalsContact O-CG1 3.29Å; R245-I249 WeakPolarHBondContact O-CG1 3.35Å; R245-I249 PolarHBondContact O-N 2.83Å; Q246-I249 PolarHBondContact O-N 3.27Å; I249-E252 PolarHBondContact O-N 3.27Å; I249-N253 WeakPolarHBondContact O-CB 3.32Å; I249-N253 PolarHBondContact O-N 3.41Å; I249-N253 PolarHBondContact O-ND2 3.27Å
250L86.8Confident85.1Confident109 Ų109100.6 Ų100.657%0.57148%0.482SS*.Hα-helixtrans-63.4-46176-70.6172.1000111.3Q246 T247 L248 E252 N253 D254Q246-L250 WeakPolarHBondContact O-CG 3.34Å; Q246-L250 PolarHBondContact O-N 2.95Å; T247-L250 PolarHBondContact O-N 3.45Å; L248-L250 VanDerWaalsContact C-N 3.32Å; L248-L250 PolarHBondContact O-N 3.34Å; L250-E252 PolarHBondContact O-N 2.85Å; L250-N253 PolarHBondContact O-N 2.82Å; L250-D254 WeakPolarHBondContact O-CB 3.36Å; L250-D254 PolarHBondContact O-N 2.93Å
251E85.5Confident85Confident108 Ų108103.2 Ų103.251%0.50549%0.487SS..Hα-helixtrans-64.1-38.8176.8-75-173.718000113T247 L248 D254 K255T247-E251 WeakPolarHBondContact O-CB 3.48Å; T247-E251 WeakPolarHBondContact O-CG 3.36Å; T247-E251 PolarHBondContact O-N 3.47Å; L248-E251 PolarHBondContact O-N 3.38Å; E251-D254 PolarHBondContact O-N 2.86Å; E251-K255 WeakPolarHBondContact O-CB 3.44Å; E251-K255 VanDerWaalsContact O-CG 3.3Å; E251-K255 WeakPolarHBondContact O-CG 3.44Å; E251-K255 PolarHBondContact O-N 3.23Å
252E84.6Confident84.7Confident91 Ų91104.5 Ų104.543%0.42549%0.486SS..Hα-helixtrans-64.1-42.5174.2-78.4-179.4178.900111.1L248 I249 L250 K255 K256L248-E252 HydrophobicContact CD1-CG 4.46Å; L248-E252 HydrophobicContact CG-CG 4.42Å; L248-E252 WeakPolarHBondContact O-CB 3.45Å; L248-E252 VanDerWaalsContact O-CG 3.3Å; L248-E252 WeakPolarHBondContact O-CG 3.39Å; L248-E252 PolarHBondContact O-N 2.8Å; I249-E252 PolarHBondContact O-N 3.27Å; L250-E252 PolarHBondContact O-N 2.85Å; E252-K255 PolarHBondContact O-N 3.48Å; E252-K256 WeakPolarHBondContact O-CG 3.48Å; E252-K256 PolarHBondContact O-N 2.93Å
253N85.5Confident84.9Confident69 Ų69104.9 Ų104.937%0.36949%0.491SS..Hα-helixtrans-65.8-41.9174.7-71.5-24.6000111.3I249 L250 K255 K256 I257I249-N253 WeakPolarHBondContact O-CB 3.32Å; I249-N253 PolarHBondContact O-N 3.41Å; I249-N253 PolarHBondContact O-ND2 3.27Å; L250-N253 PolarHBondContact O-N 2.82Å; N253-K255 VanDerWaalsContact C-N 3.33Å; N253-K255 PolarHBondContact O-N 2.79Å; N253-K256 WeakPolarHBondContact O-CB 3.3Å; N253-K256 PolarHBondContact O-N 2.84Å; N253-I257 VanDerWaalsContact O-CG1 3.28Å; N253-I257 WeakPolarHBondContact O-CG1 3.26Å; N253-I257 PolarHBondContact O-N 3.22Å
254D86.5Confident84.9Confident93 Ų93104.6 Ų104.650%0.49749%0.49SS..Hα-helixtrans-65.1-36.3175.3-78.7-13.6000112.1L250 E251 R258L250-D254 WeakPolarHBondContact O-CB 3.36Å; L250-D254 PolarHBondContact O-N 2.93Å; E251-D254 PolarHBondContact O-N 2.86Å; D254-R258 WeakPolarHBondContact O-CB 3.49Å; D254-R258 WeakPolarHBondContact O-CG 3.28Å; D254-R258 PolarHBondContact O-N 3.48Å
255K84.7Confident84.6Confident101 Ų101107.4 Ų107.444%0.43949%0.494SS..Hα-helixtrans-63.6-47.6170.5-79.9177.7-176.1173.80110.9E251 E252 N253 I257 R258 E259E251-K255 WeakPolarHBondContact O-CB 3.44Å; E251-K255 VanDerWaalsContact O-CG 3.3Å; E251-K255 WeakPolarHBondContact O-CG 3.44Å; E251-K255 PolarHBondContact O-N 3.23Å; E252-K255 PolarHBondContact O-N 3.48Å; N253-K255 VanDerWaalsContact C-N 3.33Å; N253-K255 PolarHBondContact O-N 2.79Å; K255-I257 VanDerWaalsContact C-N 3.33Å; K255-I257 PolarHBondContact O-N 2.81Å; K255-R258 CarbonylContact O-C 3.52Å; K255-R258 WeakPolarHBondContact O-CB 3.46Å; K255-R258 PolarHBondContact O-N 3.35Å; K255-R258 VanDerWaalsContact O-N 3.1Å; K255-E259 WeakPolarHBondContact O-CG 3.29Å; K255-E259 PolarHBondContact O-N 2.95Å
256K83.7Confident84.8Confident108 Ų108103.9 Ų103.947%0.4749%0.485SS..Hα-helixtrans-58.1-44.3175.5-74.6172.7-176.2170.30111.8E252 N253 R258 E259 E260E252-K256 WeakPolarHBondContact O-CG 3.48Å; E252-K256 PolarHBondContact O-N 2.93Å; N253-K256 WeakPolarHBondContact O-CB 3.3Å; N253-K256 PolarHBondContact O-N 2.84Å; K256-R258 VanDerWaalsContact C-N 3.32Å; K256-R258 PolarHBondContact O-N 3.19Å; K256-E259 PolarHBondContact O-N 3.48Å; K256-E260 WeakPolarHBondContact O-CB 3.3Å; K256-E260 VanDerWaalsContact O-CG 3.29Å; K256-E260 WeakPolarHBondContact O-CG 3.35Å; K256-E260 PolarHBondContact O-N 3.3Å
257I86.4Confident85Confident65 Ų65101.9 Ų101.933%0.33348%0.481SS..Hα-helixtrans-63.2-39.8176.2-68.5165.2000110.8N253 K255 R261N253-I257 VanDerWaalsContact O-CG1 3.28Å; N253-I257 WeakPolarHBondContact O-CG1 3.26Å; N253-I257 PolarHBondContact O-N 3.22Å; K255-I257 VanDerWaalsContact C-N 3.33Å; K255-I257 PolarHBondContact O-N 2.81Å; I257-R261 WeakPolarHBondContact O-CB 3.4Å; I257-R261 VanDerWaalsContact O-CG 3.26Å; I257-R261 WeakPolarHBondContact O-CG 3.29Å; I257-R261 PolarHBondContact O-N 3.44Å
258R83.4Confident85.1Confident138 Ų138102.8 Ų102.852%0.52148%0.483SS..Hα-helixtrans-64.2-47174.4-79.1-173.6-75168.9-9.2111.8D254 K255 K256 E260 R261 E262D254-R258 WeakPolarHBondContact O-CB 3.49Å; D254-R258 WeakPolarHBondContact O-CG 3.28Å; D254-R258 PolarHBondContact O-N 3.48Å; K255-R258 CarbonylContact O-C 3.52Å; K255-R258 WeakPolarHBondContact O-CB 3.46Å; K255-R258 PolarHBondContact O-N 3.35Å; K255-R258 VanDerWaalsContact O-N 3.1Å; K256-R258 VanDerWaalsContact C-N 3.32Å; K256-R258 PolarHBondContact O-N 3.19Å; R258-E260 VanDerWaalsContact C-N 3.34Å; R258-E260 PolarHBondContact O-N 2.8Å; R258-R261 WeakPolarHBondContact O-CB 3.48Å; R258-R261 PolarHBondContact O-N 3.1Å; R258-E262 WeakPolarHBondContact O-CB 3.37Å; R258-E262 WeakPolarHBondContact O-CG 3.28Å; R258-E262 PolarHBondContact O-N 3.16Å
259E84.9Confident85.1Confident107 Ų107102.6 Ų102.650%0.548%0.482SS..Hα-helixtrans-61.5-41.4176.3-72.6173.2-176.400111.4K255 K256 E262 N263K255-E259 WeakPolarHBondContact O-CG 3.29Å; K255-E259 PolarHBondContact O-N 2.95Å; K256-E259 PolarHBondContact O-N 3.48Å; E259-E262 PolarHBondContact O-N 2.89Å; E259-N263 WeakPolarHBondContact O-CB 3.21Å; E259-N263 PolarHBondContact O-N 2.92Å; E259-N263 PolarHBondContact O-ND2 2.78Å
260E85.5Confident85.1Confident113 Ų113102.4 Ų102.453%0.52848%0.481SS..Hα-helixtrans-62.2-42.8173.8-77174.9-178.300111.6K256 R258 N263 Q264K256-E260 WeakPolarHBondContact O-CB 3.3Å; K256-E260 VanDerWaalsContact O-CG 3.29Å; K256-E260 WeakPolarHBondContact O-CG 3.35Å; K256-E260 PolarHBondContact O-N 3.3Å; R258-E260 VanDerWaalsContact C-N 3.34Å; R258-E260 PolarHBondContact O-N 2.8Å; E260-N263 PolarHBondContact O-N 3.49Å; E260-Q264 WeakPolarHBondContact O-CB 3.34Å; E260-Q264 WeakPolarHBondContact O-CG 3.4Å; E260-Q264 PolarHBondContact O-N 3.41Å
261R83.5Confident85Confident168 Ų168101.7 Ų101.763%0.63448%0.478SS*.Hα-helixtrans-64.8-42.4174.7-74173.8-172.4172.95.7112I257 R258 Q264 W265I257-R261 WeakPolarHBondContact O-CB 3.4Å; I257-R261 VanDerWaalsContact O-CG 3.26Å; I257-R261 WeakPolarHBondContact O-CG 3.29Å; I257-R261 PolarHBondContact O-N 3.44Å; R258-R261 WeakPolarHBondContact O-CB 3.48Å; R258-R261 PolarHBondContact O-N 3.1Å; R261-Q264 PolarHBondContact O-N 3.4Å; R261-W265 WeakPolarHBondContact O-CB 3.23Å; R261-W265 PolarHBondContact O-N 2.89Å
262E82Confident85Confident120 Ų120102.7 Ų102.756%0.56148%0.483SS*.Hα-helixtrans-63.5-44175.1-76177.5-172.900110.9R258 E259 W265 I266R258-E262 WeakPolarHBondContact O-CB 3.37Å; R258-E262 WeakPolarHBondContact O-CG 3.28Å; R258-E262 PolarHBondContact O-N 3.16Å; E259-E262 PolarHBondContact O-N 2.89Å; E262-W265 CarbonylContact O-C 3.48Å; E262-W265 WeakPolarHBondContact O-CB 3.46Å; E262-W265 PolarHBondContact O-N 2.8Å; E262-W265 VanDerWaalsContact O-N 3.16Å; E262-I266 WeakPolarHBondContact O-CB 3.38Å; E262-I266 VanDerWaalsContact O-CG1 3.23Å; E262-I266 WeakPolarHBondContact O-CG1 3.28Å; E262-I266 PolarHBondContact O-N 3.42Å
263N86.2Confident85Confident94 Ų94106 Ų10650%0.50349%0.492SS..Hα-helixtrans-65.4-39.8175.9-73.4-32000111.9E259 E260 W265 I266 T267E259-N263 WeakPolarHBondContact O-CB 3.21Å; E259-N263 PolarHBondContact O-N 2.92Å; E259-N263 PolarHBondContact O-ND2 2.78Å; E260-N263 PolarHBondContact O-N 3.49Å; N263-W265 VanDerWaalsContact C-N 3.31Å; N263-I266 PolarHBondContact O-N 2.77Å; N263-T267 WeakPolarHBondContact O-CB 3.33Å; N263-T267 VanDerWaalsContact O-CG2 3.26Å; N263-T267 WeakPolarHBondContact O-CG2 3.33Å; N263-T267 PolarHBondContact O-N 2.83Å; N263-T267 PolarHBondContact O-OG1 3.37Å
264Q85.6Confident85.1Confident115 Ų115108.7 Ų108.754%0.53750%0.5SS..Hα-helixtrans-63-40.2171.6-76.417412.400111E260 R261 T267 N268E260-Q264 WeakPolarHBondContact O-CB 3.34Å; E260-Q264 WeakPolarHBondContact O-CG 3.4Å; E260-Q264 PolarHBondContact O-N 3.41Å; R261-Q264 PolarHBondContact O-N 3.4Å; Q264-T267 VanDerWaalsContact CA-OG1 3.28Å; Q264-T267 WeakPolarHBondContact CA-OG1 3.45Å; Q264-T267 PolarHBondContact O-N 2.76Å; Q264-T267 PolarHBondContact O-OG1 3.16Å; Q264-N268 VanDerWaalsContact O-CB 3.28Å; Q264-N268 WeakPolarHBondContact O-CB 3.26Å; Q264-N268 PolarHBondContact O-N 2.84Å; Q264-N268 PolarHBondContact O-ND2 3.3Å; Q264-N268 VanDerWaalsContact O-ND2 3.16Å
265W80.6Confident85.1Confident167 Ų167110.1 Ų110.163%0.63351%0.507SS*.Hα-helixtrans-66.4-43.5175.7-17580.8000111.9R261 E262 N263 N268 L269R261-W265 WeakPolarHBondContact O-CB 3.23Å; R261-W265 PolarHBondContact O-N 2.89Å; E262-W265 CarbonylContact O-C 3.48Å; E262-W265 WeakPolarHBondContact O-CB 3.46Å; E262-W265 PolarHBondContact O-N 2.8Å; E262-W265 VanDerWaalsContact O-N 3.16Å; N263-W265 VanDerWaalsContact C-N 3.31Å; W265-N268 PolarHBondContact O-N 3.41Å; W265-L269 HydrophobicContact CH2-CD2 4.13Å; W265-L269 HydrophobicContact CZ3-CD2 4.26Å; W265-L269 WeakPolarHBondContact O-CB 3.22Å; W265-L269 PolarHBondContact O-N 2.79Å
266I86.2Confident85.1Confident72 Ų72113.3 Ų113.337%0.36952%0.517SS..Hα-helixtrans-63.3-43.6175.1-69164.6000110.8E262 N263 L269 N270E262-I266 WeakPolarHBondContact O-CB 3.38Å; E262-I266 VanDerWaalsContact O-CG1 3.23Å; E262-I266 WeakPolarHBondContact O-CG1 3.28Å; E262-I266 PolarHBondContact O-N 3.42Å; N263-I266 PolarHBondContact O-N 2.77Å; I266-L269 PolarHBondContact O-N 3.41Å; I266-N270 VanDerWaalsContact O-CB 3.28Å; I266-N270 WeakPolarHBondContact O-CB 3.35Å; I266-N270 VanDerWaalsContact O-CG 3.24Å; I266-N270 PolarHBondContact O-N 2.81Å; I266-N270 PolarHBondContact O-ND2 3.07Å
267T85.8Confident85.3Confident70 Ų70111.9 Ų111.943%0.42951%0.512SS..Hα-helixtrans-65.8-41.5177.250.70000111.1N263 Q264 N270 N271N263-T267 WeakPolarHBondContact O-CB 3.33Å; N263-T267 VanDerWaalsContact O-CG2 3.26Å; N263-T267 WeakPolarHBondContact O-CG2 3.33Å; N263-T267 PolarHBondContact O-N 2.83Å; N263-T267 PolarHBondContact O-OG1 3.37Å; Q264-T267 VanDerWaalsContact CA-OG1 3.28Å; Q264-T267 WeakPolarHBondContact CA-OG1 3.45Å; Q264-T267 PolarHBondContact O-N 2.76Å; Q264-T267 PolarHBondContact O-OG1 3.16Å; T267-N270 PolarHBondContact O-N 2.81Å; T267-N271 VanDerWaalsContact O-CB 3.32Å; T267-N271 WeakPolarHBondContact O-CB 3.48Å; T267-N271 PolarHBondContact O-N 3.36Å; T267-N271 PolarHBondContact O-ND2 3.36Å; T267-N271 PolarHBondContact O-OD1 2.86Å
268N86.6Confident85.2Confident92 Ų92113.2 Ų113.249%0.49252%0.52SS..Hα-helixtrans-62.2-43.6173.1-73.3-25000112.2Q264 W265 N271 Q272Q264-N268 VanDerWaalsContact O-CB 3.28Å; Q264-N268 WeakPolarHBondContact O-CB 3.26Å; Q264-N268 PolarHBondContact O-N 2.84Å; Q264-N268 PolarHBondContact O-ND2 3.3Å; Q264-N268 VanDerWaalsContact O-ND2 3.16Å; W265-N268 PolarHBondContact O-N 3.41Å; N268-N271 PolarHBondContact O-N 3.35Å; N268-Q272 WeakPolarHBondContact O-CB 3.3Å; N268-Q272 WeakPolarHBondContact O-CG 3.19Å; N268-Q272 PolarHBondContact O-N 3.48Å
269L85.9Confident85.3Confident78 Ų78112.9 Ų112.941%0.40852%0.52SS..Hα-helixtrans-63.4-43.4176.1-170.275.4000111.3W265 I266 N271 Q272 R273W265-L269 HydrophobicContact CH2-CD2 4.13Å; W265-L269 HydrophobicContact CZ3-CD2 4.26Å; W265-L269 WeakPolarHBondContact O-CB 3.22Å; W265-L269 PolarHBondContact O-N 2.79Å; I266-L269 PolarHBondContact O-N 3.41Å; L269-N271 VanDerWaalsContact C-N 3.35Å; L269-Q272 PolarHBondContact O-N 3.31Å; L269-R273 VanDerWaalsContact O-CB 3.3Å; L269-R273 WeakPolarHBondContact O-CB 3.3Å; L269-R273 PolarHBondContact O-N 2.81Å
270N86.5Confident85.4Confident72 Ų72114.2 Ų114.239%0.38552%0.524SS..Hα-helixtrans-64.5-39.2175.5-76.8-25.9000111.6I266 T267 R273 K274I266-N270 VanDerWaalsContact O-CB 3.28Å; I266-N270 WeakPolarHBondContact O-CB 3.35Å; I266-N270 VanDerWaalsContact O-CG 3.24Å; I266-N270 PolarHBondContact O-N 2.81Å; I266-N270 PolarHBondContact O-ND2 3.07Å; T267-N270 PolarHBondContact O-N 2.81Å; N270-R273 PolarHBondContact O-N 2.89Å; N270-K274 WeakPolarHBondContact O-CB 3.32Å; N270-K274 VanDerWaalsContact O-CG 3.29Å; N270-K274 WeakPolarHBondContact O-CG 3.27Å; N270-K274 PolarHBondContact O-N 3.32Å
271N85.7Confident85.4Confident94 Ų94114.6 Ų114.650%0.50353%0.526SS..Hα-helixtrans-67-41.5175.8-70.6-18.7000111.3T267 N268 L269 K274 L275T267-N271 VanDerWaalsContact O-CB 3.32Å; T267-N271 WeakPolarHBondContact O-CB 3.48Å; T267-N271 PolarHBondContact O-N 3.36Å; T267-N271 PolarHBondContact O-ND2 3.36Å; T267-N271 PolarHBondContact O-OD1 2.86Å; N268-N271 PolarHBondContact O-N 3.35Å; L269-N271 VanDerWaalsContact C-N 3.35Å; N271-K274 PolarHBondContact O-N 2.81Å; N271-L275 VanDerWaalsContact O-CB 3.3Å; N271-L275 WeakPolarHBondContact O-CB 3.49Å; N271-L275 PolarHBondContact O-N 3.37Å
272Q84.3Confident85.5Confident130 Ų130111.3 Ų111.361%0.60752%0.518SS*.Hα-helixtrans-63.7-42.3173.3-75.3178.7-400111.8N268 L269 L275 Y276N268-Q272 WeakPolarHBondContact O-CB 3.3Å; N268-Q272 WeakPolarHBondContact O-CG 3.19Å; N268-Q272 PolarHBondContact O-N 3.48Å; L269-Q272 PolarHBondContact O-N 3.31Å; Q272-L275 PolarHBondContact O-N 2.85Å; Q272-Y276 WeakPolarHBondContact O-CB 3.28Å; Q272-Y276 PolarHBondContact O-N 3.26Å
273R86Confident85.7Confident160 Ų160109.7 Ų109.760%0.60451%0.512SS*.Hα-helixtrans-62.8-48175.9-177-179.7175175.13.2111.2L269 N270 L275 Y276 E277L269-R273 VanDerWaalsContact O-CB 3.3Å; L269-R273 WeakPolarHBondContact O-CB 3.3Å; L269-R273 PolarHBondContact O-N 2.81Å; N270-R273 PolarHBondContact O-N 2.89Å; R273-L275 VanDerWaalsContact C-N 3.34Å; R273-L275 PolarHBondContact O-N 3.48Å; R273-Y276 WeakPolarHBondContact O-CB 3.37Å; R273-Y276 PolarHBondContact O-N 3.16Å; R273-Y276 VanDerWaalsContact O-N 3.16Å; R273-E277 HydrophobicContact CG-CG 4.45Å; R273-E277 IonicContact CZ-OE1 3.59Å; R273-E277 IonicContact NE-OE1 2.82Å; R273-E277 PolarHBondContact NE-OE1 2.91Å; R273-E277 IonicContact NH2-OE1 2.97Å; R273-E277 PolarHBondContact NH2-OE1 3.4Å; R273-E277 WeakPolarHBondContact O-CB 3.35Å; R273-E277 WeakPolarHBondContact O-CG 3.45Å; R273-E277 PolarHBondContact O-N 2.73Å
274K86.2Confident85.7Confident126 Ų126109.9 Ų109.955%0.54851%0.513SS..Hα-helixtrans-58.1-46174.1-77.7179.4179.6-176.30111.1N270 N271 Y276 E277 D278N270-K274 WeakPolarHBondContact O-CB 3.32Å; N270-K274 VanDerWaalsContact O-CG 3.29Å; N270-K274 WeakPolarHBondContact O-CG 3.27Å; N270-K274 PolarHBondContact O-N 3.32Å; N271-K274 PolarHBondContact O-N 2.81Å; K274-Y276 VanDerWaalsContact C-N 3.28Å; K274-Y276 PolarHBondContact O-N 2.81Å; K274-E277 CarbonylContact O-C 3.53Å; K274-E277 PolarHBondContact O-N 2.81Å; K274-E277 VanDerWaalsContact O-N 3.16Å; K274-D278 WeakPolarHBondContact O-CB 3.48Å; K274-D278 PolarHBondContact O-N 3.16Å
275L86.7Confident85.7Confident122 Ų122109 Ų10964%0.63951%0.511SS*.Hα-helixtrans-60.1-38.4176.5-176.166.4000112.2N271 Q272 R273 Y279N271-L275 VanDerWaalsContact O-CB 3.3Å; N271-L275 WeakPolarHBondContact O-CB 3.49Å; N271-L275 PolarHBondContact O-N 3.37Å; Q272-L275 PolarHBondContact O-N 2.85Å; R273-L275 VanDerWaalsContact C-N 3.34Å; R273-L275 PolarHBondContact O-N 3.48Å; L275-Y279 WeakPolarHBondContact O-CB 3.46Å; L275-Y279 PolarHBondContact O-N 3.47Å
276Y86.3Confident85.8Confident168 Ų168106 Ų10666%0.65950%0.503SS*.Hα-helixtrans-70.4-40175.5-170.4-93.7000112.3Q272 R273 K274 Y279 K280Q272-Y276 WeakPolarHBondContact O-CB 3.28Å; Q272-Y276 PolarHBondContact O-N 3.26Å; R273-Y276 WeakPolarHBondContact O-CB 3.37Å; R273-Y276 PolarHBondContact O-N 3.16Å; R273-Y276 VanDerWaalsContact O-N 3.16Å; K274-Y276 VanDerWaalsContact C-N 3.28Å; K274-Y276 PolarHBondContact O-N 2.81Å; Y276-Y279 PolarHBondContact O-N 3.4Å; Y276-K280 VanDerWaalsContact O-CB 3.27Å; Y276-K280 WeakPolarHBondContact O-CB 3.29Å; Y276-K280 PolarHBondContact O-N 2.89Å
277E87.6Confident85.7Confident79 Ų79106.6 Ų106.637%0.36950%0.504SS..Hα-helixtrans-63-49.8173.6-74170.5178.400110.4R273 K274 Y279 K280 E281R273-E277 HydrophobicContact CG-CG 4.45Å; R273-E277 IonicContact CZ-OE1 3.59Å; R273-E277 IonicContact NE-OE1 2.82Å; R273-E277 PolarHBondContact NE-OE1 2.91Å; R273-E277 IonicContact NH2-OE1 2.97Å; R273-E277 PolarHBondContact NH2-OE1 3.4Å; R273-E277 WeakPolarHBondContact O-CB 3.35Å; R273-E277 WeakPolarHBondContact O-CG 3.45Å; R273-E277 PolarHBondContact O-N 2.73Å; K274-E277 CarbonylContact O-C 3.53Å; K274-E277 PolarHBondContact O-N 2.81Å; K274-E277 VanDerWaalsContact O-N 3.16Å; E277-Y279 VanDerWaalsContact C-N 3.34Å; E277-Y279 PolarHBondContact O-N 3.48Å; E277-K280 CarbonylContact O-C 3.59Å; E277-K280 WeakPolarHBondContact O-CB 3.34Å; E277-K280 PolarHBondContact O-N 2.9Å; E277-K280 VanDerWaalsContact O-N 3.13Å; E277-E281 WeakPolarHBondContact O-CB 3.46Å; E277-E281 WeakPolarHBondContact O-CG 3.49Å; E277-E281 PolarHBondContact O-N 3.13Å
278D84.7Confident85.7Confident92 Ų92107.9 Ų107.949%0.49251%0.505SS..Hα-helixtrans-58.9-42.3174.8-67.2-15.8000111.5K274 E281 Q282K274-D278 WeakPolarHBondContact O-CB 3.48Å; K274-D278 PolarHBondContact O-N 3.16Å; D278-E281 PolarHBondContact O-N 2.9Å; D278-Q282 VanDerWaalsContact O-CB 3.3Å; D278-Q282 WeakPolarHBondContact O-CB 3.3Å; D278-Q282 PolarHBondContact O-N 3.39Å
279Y85.1Confident85.4Confident131 Ų131108.9 Ų108.951%0.51451%0.507SS..Hα-helixtrans-65.5-40.6176.1179.6-109.5000111.9L275 Y276 E277 Q282 L283L275-Y279 WeakPolarHBondContact O-CB 3.46Å; L275-Y279 PolarHBondContact O-N 3.47Å; Y276-Y279 PolarHBondContact O-N 3.4Å; E277-Y279 VanDerWaalsContact C-N 3.34Å; E277-Y279 PolarHBondContact O-N 3.48Å; Y279-Q282 PolarHBondContact O-N 2.79Å; Y279-L283 HydrophobicContact CD1-CD1 3.92Å; Y279-L283 HydrophobicContact CE1-CD1 3.4Å; Y279-L283 VanDerWaalsContact CE1-CD1 3.4Å; Y279-L283 HydrophobicContact CE1-CG 4.21Å; Y279-L283 HydrophobicContact CE2-CD1 4.48Å; Y279-L283 HydrophobicContact CE2-CG 4.45Å; Y279-L283 WeakPolarHBondContact O-CB 3.31Å; Y279-L283 WeakPolarHBondContact O-CG 3.31Å; Y279-L283 PolarHBondContact O-N 3.41Å
280K87Confident85.2Confident135 Ų135110.7 Ų110.759%0.58751%0.511SS*.Hα-helixtrans-65.9-42175.3-175.3-177.1177-173.40111.1Y276 E277 L283 L284Y276-K280 VanDerWaalsContact O-CB 3.27Å; Y276-K280 WeakPolarHBondContact O-CB 3.29Å; Y276-K280 PolarHBondContact O-N 2.89Å; E277-K280 CarbonylContact O-C 3.59Å; E277-K280 WeakPolarHBondContact O-CB 3.34Å; E277-K280 PolarHBondContact O-N 2.9Å; E277-K280 VanDerWaalsContact O-N 3.13Å; K280-L283 PolarHBondContact O-N 3.32Å; K280-L284 WeakPolarHBondContact O-CB 3.4Å; K280-L284 PolarHBondContact O-N 2.78Å
281E85.6Confident85.1Confident121 Ų121111.1 Ų111.157%0.56551%0.511SS*.Hα-helixtrans-62.9-44.2173.5-74.6-175.4-177.300111E277 D278 L283 L284 L285E277-E281 WeakPolarHBondContact O-CB 3.46Å; E277-E281 WeakPolarHBondContact O-CG 3.49Å; E277-E281 PolarHBondContact O-N 3.13Å; D278-E281 PolarHBondContact O-N 2.9Å; E281-L283 VanDerWaalsContact C-N 3.33Å; E281-L283 PolarHBondContact O-N 2.83Å; E281-L284 CarbonylContact O-C 3.54Å; E281-L284 PolarHBondContact O-N 2.85Å; E281-L284 VanDerWaalsContact O-N 3.15Å; E281-L285 WeakPolarHBondContact O-CB 3.43Å; E281-L285 VanDerWaalsContact O-CG 3.3Å; E281-L285 WeakPolarHBondContact O-CG 3.4Å; E281-L285 PolarHBondContact O-N 3.41Å
282Q84.3Confident84.9Confident100 Ų100110.8 Ų110.847%0.46751%0.508SS..Hα-helixtrans-62.5-39.5176.2-166.8-173.128.100111.9D278 Y279 K286D278-Q282 VanDerWaalsContact O-CB 3.3Å; D278-Q282 WeakPolarHBondContact O-CB 3.3Å; D278-Q282 PolarHBondContact O-N 3.39Å; Y279-Q282 PolarHBondContact O-N 2.79Å; Q282-K286 VanDerWaalsContact O-CB 3.31Å; Q282-K286 WeakPolarHBondContact O-CB 3.37Å; Q282-K286 VanDerWaalsContact O-CG 3.31Å; Q282-K286 WeakPolarHBondContact O-CG 3.37Å; Q282-K286 PolarHBondContact O-N 3.37Å
283L85.8Confident84.8Confident85 Ų85110 Ų11045%0.44551%0.505SS..Hα-helixtrans-64.4-42.3172.9-81.3172.1000111.7Y279 K280 E281 K286 E287Y279-L283 HydrophobicContact CD1-CD1 3.92Å; Y279-L283 HydrophobicContact CE1-CD1 3.4Å; Y279-L283 VanDerWaalsContact CE1-CD1 3.4Å; Y279-L283 HydrophobicContact CE1-CG 4.21Å; Y279-L283 HydrophobicContact CE2-CD1 4.48Å; Y279-L283 HydrophobicContact CE2-CG 4.45Å; Y279-L283 WeakPolarHBondContact O-CB 3.31Å; Y279-L283 WeakPolarHBondContact O-CG 3.31Å; Y279-L283 PolarHBondContact O-N 3.41Å; K280-L283 PolarHBondContact O-N 3.32Å; E281-L283 VanDerWaalsContact C-N 3.33Å; E281-L283 PolarHBondContact O-N 2.83Å; L283-K286 PolarHBondContact O-N 2.96Å; L283-E287 WeakPolarHBondContact O-CB 3.3Å; L283-E287 PolarHBondContact O-N 2.77Å
284L87.8Confident84.6Confident99 Ų99107.8 Ų107.852%0.51850%0.499SS..Hα-helixtrans-66.7-41.4178.5-160.7119.8000111.3K280 E281 E287 Q288K280-L284 WeakPolarHBondContact O-CB 3.4Å; K280-L284 PolarHBondContact O-N 2.78Å; E281-L284 CarbonylContact O-C 3.54Å; E281-L284 PolarHBondContact O-N 2.85Å; E281-L284 VanDerWaalsContact O-N 3.15Å; L284-E287 PolarHBondContact O-N 2.78Å; L284-Q288 WeakPolarHBondContact O-CB 3.43Å; L284-Q288 VanDerWaalsContact O-CG 3.27Å; L284-Q288 WeakPolarHBondContact O-CG 3.27Å; L284-Q288 PolarHBondContact O-N 3.36Å
285L85.3Confident84.5Confident95 Ų95107.3 Ų107.350%0.49750%0.499SS..Hα-helixtrans-64.7-41.7173.3-73.1171.6000111.5E281 E287 Q288 Q289E281-L285 WeakPolarHBondContact O-CB 3.43Å; E281-L285 VanDerWaalsContact O-CG 3.3Å; E281-L285 WeakPolarHBondContact O-CG 3.4Å; E281-L285 PolarHBondContact O-N 3.41Å; L285-E287 VanDerWaalsContact C-N 3.34Å; L285-Q288 PolarHBondContact O-N 3.15Å; L285-Q289 WeakPolarHBondContact O-CB 3.48Å; L285-Q289 VanDerWaalsContact O-CG 3.28Å; L285-Q289 WeakPolarHBondContact O-CG 3.44Å; L285-Q289 PolarHBondContact O-N 2.86Å
286K83Confident84.1Confident106 Ų106106.3 Ų106.346%0.46149%0.491SS..Hα-helixtrans-64.5-38.1173.6-81.8179.8178.2176.80112.1Q282 L283 K290Q282-K286 VanDerWaalsContact O-CB 3.31Å; Q282-K286 WeakPolarHBondContact O-CB 3.37Å; Q282-K286 VanDerWaalsContact O-CG 3.31Å; Q282-K286 WeakPolarHBondContact O-CG 3.37Å; Q282-K286 PolarHBondContact O-N 3.37Å; L283-K286 PolarHBondContact O-N 2.96Å; K286-K290 WeakPolarHBondContact O-CB 3.37Å; K286-K290 WeakPolarHBondContact O-CG 3.23Å; K286-K290 PolarHBondContact O-N 3.46Å
287E84.3Confident83.9Confident84 Ų84101 Ų10139%0.39348%0.482SS..Hα-helixtrans-69.7-43.1175.3-171.158.9-150.600110.4L283 L284 L285 Q289 K290 Q291L283-E287 WeakPolarHBondContact O-CB 3.3Å; L283-E287 PolarHBondContact O-N 2.77Å; L284-E287 PolarHBondContact O-N 2.78Å; L285-E287 VanDerWaalsContact C-N 3.34Å; E287-Q289 VanDerWaalsContact C-N 3.34Å; E287-Q289 PolarHBondContact O-N 3.18Å; E287-K290 CarbonylContact O-C 3.56Å; E287-K290 WeakPolarHBondContact O-CB 3.33Å; E287-K290 PolarHBondContact O-N 2.76Å; E287-Q291 WeakPolarHBondContact O-CB 3.49Å; E287-Q291 VanDerWaalsContact O-CG 3.23Å; E287-Q291 WeakPolarHBondContact O-CG 3.26Å; E287-Q291 PolarHBondContact O-N 3.38Å; E287-Q291 PolarHBondContact OE1-NE2 3.38Å
288Q84.3Confident83.7Confident96 Ų96101.2 Ų101.245%0.44949%0.485SS..Hα-helixtrans-59.2-44.3172.4-76.4176.5-10.200111.5L284 L285 Q291 I292L284-Q288 WeakPolarHBondContact O-CB 3.43Å; L284-Q288 VanDerWaalsContact O-CG 3.27Å; L284-Q288 WeakPolarHBondContact O-CG 3.27Å; L284-Q288 PolarHBondContact O-N 3.36Å; L285-Q288 PolarHBondContact O-N 3.15Å; Q288-Q291 PolarHBondContact O-N 3.32Å; Q288-I292 WeakPolarHBondContact O-CB 3.17Å; Q288-I292 VanDerWaalsContact O-CG1 3.26Å; Q288-I292 WeakPolarHBondContact O-CG1 3.23Å; Q288-I292 PolarHBondContact O-N 2.83Å
289Q80.2Confident83.5Confident114 Ų114103.2 Ų103.253%0.53349%0.492SS..Hα-helixtrans-59.9-46.4173.1-79176.3-12.200111L285 E287 Q291 I292 E293L285-Q289 WeakPolarHBondContact O-CB 3.48Å; L285-Q289 VanDerWaalsContact O-CG 3.28Å; L285-Q289 WeakPolarHBondContact O-CG 3.44Å; L285-Q289 PolarHBondContact O-N 2.86Å; E287-Q289 VanDerWaalsContact C-N 3.34Å; E287-Q289 PolarHBondContact O-N 3.18Å; Q289-Q291 VanDerWaalsContact C-N 3.3Å; Q289-Q291 PolarHBondContact O-N 3.18Å; Q289-I292 CarbonylContact O-C 3.55Å; Q289-I292 PolarHBondContact O-N 2.78Å; Q289-E293 VanDerWaalsContact O-CB 3.32Å; Q289-E293 WeakPolarHBondContact O-CB 3.49Å; Q289-E293 VanDerWaalsContact O-CG 3.28Å; Q289-E293 WeakPolarHBondContact O-CG 3.28Å; Q289-E293 PolarHBondContact O-N 2.73Å
290K83.3Confident83.2Confident115 Ų115102 Ų10250%0.549%0.493SS..Hα-helixtrans-61.7-35.7174.1-80.2179.8177.5179.50113.1K286 E287 K294K286-K290 WeakPolarHBondContact O-CB 3.37Å; K286-K290 WeakPolarHBondContact O-CG 3.23Å; K286-K290 PolarHBondContact O-N 3.46Å; E287-K290 CarbonylContact O-C 3.56Å; E287-K290 WeakPolarHBondContact O-CB 3.33Å; E287-K290 PolarHBondContact O-N 2.76Å; K290-K294 VanDerWaalsContact O-CB 3.23Å; K290-K294 WeakPolarHBondContact O-CB 3.28Å; K290-K294 WeakPolarHBondContact O-CG 3.17Å; K290-K294 PolarHBondContact O-N 2.79Å
291Q83.1Confident82.6Confident82 Ų82102.8 Ų102.838%0.38349%0.492SS..Hα-helixtrans-71.5-40.4176.8-67.9-64.5-23.900110.7E287 Q288 Q289 K294 Q295E287-Q291 WeakPolarHBondContact O-CB 3.49Å; E287-Q291 VanDerWaalsContact O-CG 3.23Å; E287-Q291 WeakPolarHBondContact O-CG 3.26Å; E287-Q291 PolarHBondContact O-N 3.38Å; E287-Q291 PolarHBondContact OE1-NE2 3.38Å; Q288-Q291 PolarHBondContact O-N 3.32Å; Q289-Q291 VanDerWaalsContact C-N 3.3Å; Q289-Q291 PolarHBondContact O-N 3.18Å; Q291-K294 PolarHBondContact O-N 3.36Å; Q291-Q295 WeakPolarHBondContact O-CB 3.25Å; Q291-Q295 VanDerWaalsContact O-CG 3.25Å; Q291-Q295 WeakPolarHBondContact O-CG 3.34Å; Q291-Q295 PolarHBondContact O-N 2.79Å
292I82.7Confident82.4Confident86 Ų86101.4 Ų101.444%0.44149%0.489SS..Hα-helixtrans-63.3-50.3172.5-68.2165000109.4Q288 Q289 K294 Q295 E296Q288-I292 WeakPolarHBondContact O-CB 3.17Å; Q288-I292 VanDerWaalsContact O-CG1 3.26Å; Q288-I292 WeakPolarHBondContact O-CG1 3.23Å; Q288-I292 PolarHBondContact O-N 2.83Å; Q289-I292 CarbonylContact O-C 3.55Å; Q289-I292 PolarHBondContact O-N 2.78Å; I292-K294 VanDerWaalsContact C-N 3.29Å; I292-K294 PolarHBondContact O-N 3.02Å; I292-Q295 CarbonylContact O-C 3.57Å; I292-Q295 WeakPolarHBondContact O-CA 3.26Å; I292-Q295 WeakPolarHBondContact O-CB 3.47Å; I292-Q295 PolarHBondContact O-N 2.69Å; I292-E296 HydrophobicContact CG2-CG 4.17Å; I292-E296 WeakPolarHBondContact CG2-OE1 3.08Å; I292-E296 WeakPolarHBondContact O-CB 3.46Å; I292-E296 WeakPolarHBondContact O-CG 3.46Å; I292-E296 PolarHBondContact O-N 2.74Å
293E81.3Confident82.1Confident115 Ų115103.8 Ų103.854%0.53750%0.495SS..Hα-helixtrans-58.8-38.5175.3-75.2173.9-177.700111.9Q289 A297Q289-E293 VanDerWaalsContact O-CB 3.32Å; Q289-E293 WeakPolarHBondContact O-CB 3.49Å; Q289-E293 VanDerWaalsContact O-CG 3.28Å; Q289-E293 WeakPolarHBondContact O-CG 3.28Å; Q289-E293 PolarHBondContact O-N 2.73Å; E293-A297 WeakPolarHBondContact O-CA 3.32Å; E293-A297 WeakPolarHBondContact O-CB 3.04Å; E293-A297 PolarHBondContact O-N 3.25Å
294K81.8Confident81.7Confident113 Ų113103.3 Ų103.349%0.49149%0.491SS..Hα-helixtrans-66.9-41.4172.4-81.2172.7-177.1173.70111.5K290 Q291 I292 A297 L298K290-K294 VanDerWaalsContact O-CB 3.23Å; K290-K294 WeakPolarHBondContact O-CB 3.28Å; K290-K294 WeakPolarHBondContact O-CG 3.17Å; K290-K294 PolarHBondContact O-N 2.79Å; Q291-K294 PolarHBondContact O-N 3.36Å; I292-K294 VanDerWaalsContact C-N 3.29Å; I292-K294 PolarHBondContact O-N 3.02Å; K294-A297 PolarHBondContact O-N 3.42Å; K294-L298 VanDerWaalsContact O-CB 3.26Å; K294-L298 WeakPolarHBondContact O-CB 3.46Å; K294-L298 WeakPolarHBondContact O-CG 3.31Å; K294-L298 PolarHBondContact O-N 2.7Å
295Q83.6Confident81.2Confident116 Ų116102 Ų10254%0.54248%0.484SS..Hα-helixtrans-67.6-41.1177-77.2179.7200111.2Q291 I292 L298 Q299Q291-Q295 WeakPolarHBondContact O-CB 3.25Å; Q291-Q295 VanDerWaalsContact O-CG 3.25Å; Q291-Q295 WeakPolarHBondContact O-CG 3.34Å; Q291-Q295 PolarHBondContact O-N 2.79Å; I292-Q295 CarbonylContact O-C 3.57Å; I292-Q295 WeakPolarHBondContact O-CA 3.26Å; I292-Q295 WeakPolarHBondContact O-CB 3.47Å; I292-Q295 PolarHBondContact O-N 2.69Å; Q295-L298 CarbonylContact O-C 3.58Å; Q295-L298 PolarHBondContact O-N 2.78Å; Q295-Q299 WeakPolarHBondContact O-CB 3.39Å; Q295-Q299 VanDerWaalsContact O-CG 3.26Å; Q295-Q299 WeakPolarHBondContact O-CG 3.13Å; Q295-Q299 PolarHBondContact O-N 3.39Å
296E79.5Confident81Confident101 Ų10199.6 Ų99.647%0.47248%0.478SS..Hα-helixtrans-65.2-44.7172.7-73.4179177.200110.3I292 L298 Q299 I300I292-E296 HydrophobicContact CG2-CG 4.17Å; I292-E296 WeakPolarHBondContact CG2-OE1 3.08Å; I292-E296 WeakPolarHBondContact O-CB 3.46Å; I292-E296 WeakPolarHBondContact O-CG 3.46Å; I292-E296 PolarHBondContact O-N 2.74Å; E296-L298 VanDerWaalsContact C-N 3.29Å; E296-L298 PolarHBondContact O-N 3.3Å; E296-Q299 CarbonylContact O-C 3.48Å; E296-Q299 PolarHBondContact O-N 2.76Å; E296-Q299 VanDerWaalsContact O-N 3.16Å; E296-I300 VanDerWaalsContact O-CB 3.31Å; E296-I300 WeakPolarHBondContact O-CB 3.36Å; E296-I300 WeakPolarHBondContact O-CG1 3.49Å; E296-I300 PolarHBondContact O-N 3.48Å
297A81.3Confident80.7Confident57 Ų5798.8 Ų98.847%0.47148%0.475SS..Hα-helixtrans-64.1-34.517400000111.8E293 K294 R301E293-A297 WeakPolarHBondContact O-CA 3.32Å; E293-A297 WeakPolarHBondContact O-CB 3.04Å; E293-A297 PolarHBondContact O-N 3.25Å; K294-A297 PolarHBondContact O-N 3.42Å; A297-R301 WeakPolarHBondContact O-CA 3.34Å; A297-R301 WeakPolarHBondContact O-CB 3.5Å; A297-R301 PolarHBondContact O-N 3.36Å
298L83Confident80.2Confident83 Ų8399.9 Ų99.944%0.43548%0.478SS..Hα-helixtrans-71.6-38.2171.8-76.6173000111.6K294 Q295 E296 R301 N302K294-L298 VanDerWaalsContact O-CB 3.26Å; K294-L298 WeakPolarHBondContact O-CB 3.46Å; K294-L298 WeakPolarHBondContact O-CG 3.31Å; K294-L298 PolarHBondContact O-N 2.7Å; Q295-L298 CarbonylContact O-C 3.58Å; Q295-L298 PolarHBondContact O-N 2.78Å; E296-L298 VanDerWaalsContact C-N 3.29Å; E296-L298 PolarHBondContact O-N 3.3Å; L298-R301 PolarHBondContact O-N 3.31Å; L298-N302 WeakPolarHBondContact O-CA 3.17Å; L298-N302 WeakPolarHBondContact O-CB 3.26Å; L298-N302 PolarHBondContact O-N 3.43Å; L298-N302 PolarHBondContact O-ND2 2.7Å; L298-N302 PolarHBondContact O-OD1 2.71Å
299Q81.5Confident80Confident133 Ų133101.5 Ų101.562%0.62149%0.486SS*.Hα-helixtrans-68-42.2175.1-78.6-1794.100110.7Q295 E296 N302 Y303Q295-Q299 WeakPolarHBondContact O-CB 3.39Å; Q295-Q299 VanDerWaalsContact O-CG 3.26Å; Q295-Q299 WeakPolarHBondContact O-CG 3.13Å; Q295-Q299 PolarHBondContact O-N 3.39Å; E296-Q299 CarbonylContact O-C 3.48Å; E296-Q299 PolarHBondContact O-N 2.76Å; E296-Q299 VanDerWaalsContact O-N 3.16Å; Q299-N302 PolarHBondContact O-N 2.72Å; Q299-Y303 WeakPolarHBondContact O-CA 3.33Å; Q299-Y303 WeakPolarHBondContact O-CB 3.3Å; Q299-Y303 PolarHBondContact O-N 3.16Å
300I77.8Confident79.7Confident107 Ų107102.3 Ų102.355%0.54949%0.489SS..Hα-helixtrans-65.4-44172.7-67.2164.2000109.3E296 Y303 M304E296-I300 VanDerWaalsContact O-CB 3.31Å; E296-I300 WeakPolarHBondContact O-CB 3.36Å; E296-I300 WeakPolarHBondContact O-CG1 3.49Å; E296-I300 PolarHBondContact O-N 3.48Å; I300-Y303 PolarHBondContact O-N 3.16Å; I300-M304 HydrophobicContact CG2-CG 4.16Å; I300-M304 WeakPolarHBondContact O-CB 3.25Å; I300-M304 WeakPolarHBondContact O-CG 3.18Å; I300-M304 PolarHBondContact O-N 3.49Å
301R75.6Confident79.2Confident151 Ų151100.1 Ų100.157%0.5748%0.483SS*.Hα-helixtrans-62.8-44175.6178.9-177.5175.4-141.8-2.2111.2A297 L298 M304 L305A297-R301 WeakPolarHBondContact O-CA 3.34Å; A297-R301 WeakPolarHBondContact O-CB 3.5Å; A297-R301 PolarHBondContact O-N 3.36Å; L298-R301 PolarHBondContact O-N 3.31Å; R301-M304 PolarHBondContact O-N 2.73Å; R301-L305 HydrophobicContact CG-CD1 3.93Å; R301-L305 HydrophobicContact CG-CG 4.34Å; R301-L305 VanDerWaalsContact O-CB 3.25Å; R301-L305 WeakPolarHBondContact O-CB 3.12Å; R301-L305 VanDerWaalsContact O-CG 3.22Å; R301-L305 WeakPolarHBondContact O-CG 3.06Å; R301-L305 PolarHBondContact O-N 2.73Å
302N81.1Confident78.8Confident91 Ų91102.6 Ų102.649%0.48749%0.493SS..Hα-helixtrans-70.9-37.5179-70.1-11.2000110.9L298 Q299 L305 A306L298-N302 WeakPolarHBondContact O-CA 3.17Å; L298-N302 WeakPolarHBondContact O-CB 3.26Å; L298-N302 PolarHBondContact O-N 3.43Å; L298-N302 PolarHBondContact O-ND2 2.7Å; L298-N302 PolarHBondContact O-OD1 2.71Å; Q299-N302 PolarHBondContact O-N 2.72Å; N302-L305 PolarHBondContact O-N 3.41Å; N302-A306 WeakPolarHBondContact O-CA 3.01Å; N302-A306 WeakPolarHBondContact O-CB 3.22Å; N302-A306 PolarHBondContact O-N 2.7Å
303Y77.9Confident78.4Confident151 Ų151106 Ų10659%0.59250%0.5SS*.Hα-helixtrans-65.8-41.6172.4176.1-99.3000110.7Q299 I300 K307Q299-Y303 WeakPolarHBondContact O-CA 3.33Å; Q299-Y303 WeakPolarHBondContact O-CB 3.3Å; Q299-Y303 PolarHBondContact O-N 3.16Å; I300-Y303 PolarHBondContact O-N 3.16Å; Y303-K307 HydrophobicContact CE1-CD 4.39Å; Y303-K307 WeakPolarHBondContact O-CA 3.17Å; Y303-K307 WeakPolarHBondContact O-CB 3.12Å; Y303-K307 PolarHBondContact O-N 3.3Å
304M77.5Confident78.1Confident75 Ų75104.6 Ų104.637%0.36950%0.496SS..Hα-helixtrans-70.2-37.6175.4-73-66.7-67.100111.6I300 R301 F308I300-M304 HydrophobicContact CG2-CG 4.16Å; I300-M304 WeakPolarHBondContact O-CB 3.25Å; I300-M304 WeakPolarHBondContact O-CG 3.18Å; I300-M304 PolarHBondContact O-N 3.49Å; R301-M304 PolarHBondContact O-N 2.73Å; M304-F308 HydrophobicContact CB-CE2 4.4Å; M304-F308 HydrophobicContact CE-CE1 4.43Å; M304-F308 HydrophobicContact CE-CE2 3.96Å; M304-F308 HydrophobicContact CE-CZ 3.7Å; M304-F308 VanDerWaalsContact O-CB 3.28Å; M304-F308 WeakPolarHBondContact O-CB 3.28Å; M304-F308 WeakPolarHBondContact O-CD2 3.46Å; M304-F308 WeakPolarHBondContact O-CG 3.05Å; M304-F308 PolarHBondContact O-N 3.46Å
305L76.7Confident77.7Confident71 Ų71104.9 Ų104.937%0.37250%0.499SS..Hα-helixtrans-68.6-45.5173.9-77.8171.8000111R301 N302 K307 F308 E309R301-L305 HydrophobicContact CG-CD1 3.93Å; R301-L305 HydrophobicContact CG-CG 4.34Å; R301-L305 VanDerWaalsContact O-CB 3.25Å; R301-L305 WeakPolarHBondContact O-CB 3.12Å; R301-L305 VanDerWaalsContact O-CG 3.22Å; R301-L305 WeakPolarHBondContact O-CG 3.06Å; R301-L305 PolarHBondContact O-N 2.73Å; N302-L305 PolarHBondContact O-N 3.41Å; L305-K307 VanDerWaalsContact C-N 3.31Å; L305-K307 PolarHBondContact O-N 2.72Å; L305-F308 CarbonylContact O-C 3.58Å; L305-F308 PolarHBondContact O-N 3.41Å; L305-F308 VanDerWaalsContact O-N 3.16Å; L305-E309 WeakPolarHBondContact O-CB 3.09Å; L305-E309 VanDerWaalsContact O-CG 3.3Å; L305-E309 WeakPolarHBondContact O-CG 3.5Å; L305-E309 PolarHBondContact O-N 2.74Å
306A81Confident77.2Confident45 Ų45105 Ų10537%0.37250%0.499SS..Hα-helixtrans-62.6-40.4173.800000110.7N302 E309 E310N302-A306 WeakPolarHBondContact O-CA 3.01Å; N302-A306 WeakPolarHBondContact O-CB 3.22Å; N302-A306 PolarHBondContact O-N 2.7Å; A306-E309 CarbonylContact O-C 3.6Å; A306-E309 PolarHBondContact O-N 2.73Å; A306-E310 VanDerWaalsContact O-CB 3.29Å; A306-E310 WeakPolarHBondContact O-CB 3.46Å; A306-E310 WeakPolarHBondContact O-CG 3.15Å; A306-E310 PolarHBondContact O-N 2.71Å
307K77.1Confident77Confident89 Ų89102.9 Ų102.939%0.38749%0.489SS..Hα-helixtrans-66-38.5172.5-173.9177.5179.4-177.40111.4Y303 L305 D311Y303-K307 HydrophobicContact CE1-CD 4.39Å; Y303-K307 WeakPolarHBondContact O-CA 3.17Å; Y303-K307 WeakPolarHBondContact O-CB 3.12Å; Y303-K307 PolarHBondContact O-N 3.3Å; L305-K307 VanDerWaalsContact C-N 3.31Å; L305-K307 PolarHBondContact O-N 2.72Å; K307-D311 WeakPolarHBondContact O-CA 3.12Å; K307-D311 WeakPolarHBondContact O-CB 3.44Å; K307-D311 PolarHBondContact O-N 2.78Å
308F73.8Confident76.6Confident107 Ų107104.8 Ų104.847%0.46949%0.489SS..Hα-helixtrans-72.3-28.7174.1-73.6-43.1000112.7M304 L305 K312M304-F308 HydrophobicContact CB-CE2 4.4Å; M304-F308 HydrophobicContact CE-CE1 4.43Å; M304-F308 HydrophobicContact CE-CE2 3.96Å; M304-F308 HydrophobicContact CE-CZ 3.7Å; M304-F308 VanDerWaalsContact O-CB 3.28Å; M304-F308 WeakPolarHBondContact O-CB 3.28Å; M304-F308 WeakPolarHBondContact O-CD2 3.46Å; M304-F308 WeakPolarHBondContact O-CG 3.05Å; M304-F308 PolarHBondContact O-N 3.46Å; L305-F308 CarbonylContact O-C 3.58Å; L305-F308 PolarHBondContact O-N 3.41Å; L305-F308 VanDerWaalsContact O-N 3.16Å; F308-K312 WeakPolarHBondContact O-CB 3.13Å; F308-K312 WeakPolarHBondContact O-CG 3.2Å; F308-K312 PolarHBondContact O-N 2.69Å
309E79.4Confident76.2Confident130 Ų130105.5 Ų105.561%0.60749%0.493SS*.Hα-helixtrans-76-38.9173.2-77.4175.1-176.200110.8L305 A306 R313L305-E309 WeakPolarHBondContact O-CB 3.09Å; L305-E309 VanDerWaalsContact O-CG 3.3Å; L305-E309 WeakPolarHBondContact O-CG 3.5Å; L305-E309 PolarHBondContact O-N 2.74Å; A306-E309 CarbonylContact O-C 3.6Å; A306-E309 PolarHBondContact O-N 2.73Å; E309-R313 WeakPolarHBondContact O-CA 3.46Å; E309-R313 WeakPolarHBondContact O-CB 3.2Å; E309-R313 WeakPolarHBondContact O-CG 3.5Å; E309-R313 PolarHBondContact O-N 2.76Å
310E75.4Confident75.8Confident130 Ų130105.5 Ų105.561%0.60749%0.493SS*.Hα-helixtrans-65.7-46169.4-79.9-169170.100110.5A306 R313 L314A306-E310 VanDerWaalsContact O-CB 3.29Å; A306-E310 WeakPolarHBondContact O-CB 3.46Å; A306-E310 WeakPolarHBondContact O-CG 3.15Å; A306-E310 PolarHBondContact O-N 2.71Å; E310-R313 CarbonylContact O-C 3.54Å; E310-R313 PolarHBondContact O-N 3.43Å; E310-L314 VanDerWaalsContact O-CB 3.23Å; E310-L314 WeakPolarHBondContact O-CB 3.37Å; E310-L314 WeakPolarHBondContact O-CG 3.29Å; E310-L314 PolarHBondContact O-N 2.69Å
311D73.2Confident75.6Confident70 Ų70105.8 Ų105.837%0.37449%0.49SS..Hα-helixtrans-64.5-42.6176-73.7-19.6000109.5K307 L314 E315K307-D311 WeakPolarHBondContact O-CA 3.12Å; K307-D311 WeakPolarHBondContact O-CB 3.44Å; K307-D311 PolarHBondContact O-N 2.78Å; D311-L314 CarbonylContact O-C 3.54Å; D311-L314 PolarHBondContact O-N 2.72Å; D311-E315 WeakPolarHBondContact O-CA 3.21Å; D311-E315 WeakPolarHBondContact O-CB 3.23Å; D311-E315 PolarHBondContact O-N 3.22Å
312K73.3Confident75.3Confident134 Ų134105 Ų10558%0.58349%0.487SS*.Hα-helixtrans-66.3-36.8172.7-82.7178.3179.2-179.30112.6F308 E315 Q316F308-K312 WeakPolarHBondContact O-CB 3.13Å; F308-K312 WeakPolarHBondContact O-CG 3.2Å; F308-K312 PolarHBondContact O-N 2.69Å; K312-E315 PolarHBondContact O-N 3.35Å; K312-Q316 VanDerWaalsContact O-CB 3.23Å; K312-Q316 WeakPolarHBondContact O-CB 3.16Å; K312-Q316 WeakPolarHBondContact O-CG 3.18Å; K312-Q316 PolarHBondContact O-N 2.69Å
313R75Confident75Confident156 Ų156105.7 Ų105.759%0.58949%0.487SS*.Hα-helixtrans-66.2-43.5173.6-95.2-163.264.6163.2-1.5110.4E309 E310 E315 Q316 E317E309-R313 WeakPolarHBondContact O-CA 3.46Å; E309-R313 WeakPolarHBondContact O-CB 3.2Å; E309-R313 WeakPolarHBondContact O-CG 3.5Å; E309-R313 PolarHBondContact O-N 2.76Å; E310-R313 CarbonylContact O-C 3.54Å; E310-R313 PolarHBondContact O-N 3.43Å; R313-E315 VanDerWaalsContact C-N 3.32Å; R313-Q316 PolarHBondContact O-N 3.44Å; R313-E317 IonicContact CZ-OE1 2.9Å; R313-E317 IonicContact NE-OE1 3.95Å; R313-E317 PolarHBondContact NE-OE1 3.46Å; R313-E317 IonicContact NH2-OE1 3.71Å; R313-E317 PolarHBondContact NH2-OE1 3.27Å; R313-E317 WeakPolarHBondContact O-CB 3.23Å; R313-E317 WeakPolarHBondContact O-CG 3.48Å; R313-E317 PolarHBondContact O-N 2.71Å
314L74.2Confident74.9Confident87 Ų87103.4 Ų103.446%0.45548%0.484SS..Hα-helixtrans-67.6-35.9176.2-74.7172.2000110.5E310 D311 E317 E318E310-L314 VanDerWaalsContact O-CB 3.23Å; E310-L314 WeakPolarHBondContact O-CB 3.37Å; E310-L314 WeakPolarHBondContact O-CG 3.29Å; E310-L314 PolarHBondContact O-N 2.69Å; D311-L314 CarbonylContact O-C 3.54Å; D311-L314 PolarHBondContact O-N 2.72Å; L314-E317 CarbonylContact O-C 3.48Å; L314-E317 PolarHBondContact O-N 2.71Å; L314-E318 WeakPolarHBondContact O-CA 3.13Å; L314-E318 WeakPolarHBondContact O-CB 3.5Å; L314-E318 VanDerWaalsContact O-CG 3.26Å; L314-E318 WeakPolarHBondContact O-CG 3.26Å; L314-E318 PolarHBondContact O-N 2.72Å
315E74.3Confident74.9Confident118 Ų118105.4 Ų105.455%0.55149%0.491SS*.Hα-helixtrans-72.5-39176.2-153.5177.5-153.100110.4D311 K312 R313 E318 L319D311-E315 WeakPolarHBondContact O-CA 3.21Å; D311-E315 WeakPolarHBondContact O-CB 3.23Å; D311-E315 PolarHBondContact O-N 3.22Å; K312-E315 PolarHBondContact O-N 3.35Å; R313-E315 VanDerWaalsContact C-N 3.32Å; E315-E318 CarbonylContact O-C 3.59Å; E315-E318 PolarHBondContact O-N 3.44Å; E315-L319 WeakPolarHBondContact O-CB 3.13Å; E315-L319 WeakPolarHBondContact O-CG 3.02Å; E315-L319 PolarHBondContact O-N 3.4Å
316Q72.1Confident74.8Confident118 Ų118108.4 Ų108.455%0.55150%0.503SS*.Hα-helixtrans-65.1-45.7169.7-78.1176.1-3.400111K312 R313 E318 L319 E320K312-Q316 VanDerWaalsContact O-CB 3.23Å; K312-Q316 WeakPolarHBondContact O-CB 3.16Å; K312-Q316 WeakPolarHBondContact O-CG 3.18Å; K312-Q316 PolarHBondContact O-N 2.69Å; R313-Q316 PolarHBondContact O-N 3.44Å; Q316-E318 VanDerWaalsContact C-N 3.3Å; Q316-E318 PolarHBondContact O-N 2.8Å; Q316-L319 CarbonylContact O-C 3.58Å; Q316-L319 PolarHBondContact O-N 2.66Å; Q316-E320 VanDerWaalsContact O-CB 3.24Å; Q316-E320 WeakPolarHBondContact O-CB 3.1Å; Q316-E320 VanDerWaalsContact O-CG 3.26Å; Q316-E320 WeakPolarHBondContact O-CG 3.47Å; Q316-E320 PolarHBondContact O-N 2.71Å
317E75Confident74.6Confident57 Ų57110.5 Ų110.527%0.26651%0.506SS..Hα-helixtrans-65.9-32.6175.1-76176.5-159.400111.1R313 L314 K321R313-E317 IonicContact CZ-OE1 2.9Å; R313-E317 IonicContact NE-OE1 3.95Å; R313-E317 PolarHBondContact NE-OE1 3.46Å; R313-E317 IonicContact NH2-OE1 3.71Å; R313-E317 PolarHBondContact NH2-OE1 3.27Å; R313-E317 WeakPolarHBondContact O-CB 3.23Å; R313-E317 WeakPolarHBondContact O-CG 3.48Å; R313-E317 PolarHBondContact O-N 2.71Å; L314-E317 CarbonylContact O-C 3.48Å; L314-E317 PolarHBondContact O-N 2.71Å; E317-K321 WeakPolarHBondContact O-CA 3.13Å; E317-K321 WeakPolarHBondContact O-CB 3.2Å; E317-K321 VanDerWaalsContact O-CD 3.3Å; E317-K321 WeakPolarHBondContact O-CD 3.24Å; E317-K321 WeakPolarHBondContact O-CG 3.26Å; E317-K321 PolarHBondContact O-N 3.4Å; E317-K321 IonicContact OE2-NZ 2.81Å
318E73.6Confident74.5Confident97 Ų97110.7 Ų110.745%0.45351%0.508SS..Hα-helixtrans-75.1-37173.6-86.7-164.3-174.100111.5L314 E315 Q316 K321 R322L314-E318 WeakPolarHBondContact O-CA 3.13Å; L314-E318 WeakPolarHBondContact O-CB 3.5Å; L314-E318 VanDerWaalsContact O-CG 3.26Å; L314-E318 WeakPolarHBondContact O-CG 3.26Å; L314-E318 PolarHBondContact O-N 2.72Å; E315-E318 CarbonylContact O-C 3.59Å; E315-E318 PolarHBondContact O-N 3.44Å; Q316-E318 VanDerWaalsContact C-N 3.3Å; Q316-E318 PolarHBondContact O-N 2.8Å; E318-K321 CarbonylContact O-C 3.52Å; E318-K321 PolarHBondContact O-N 2.8Å; E318-R322 WeakPolarHBondContact O-CA 3.47Å; E318-R322 WeakPolarHBondContact O-CB 3.16Å; E318-R322 WeakPolarHBondContact O-CG 3.45Å; E318-R322 PolarHBondContact O-N 2.69Å; E318-R322 IonicContact OE2-CZ 3.89Å; E318-R322 IonicContact OE2-NH2 3.56Å; E318-R322 PolarHBondContact OE2-NH2 3.38Å
319L74.6Confident74.6Confident99 Ų99112.8 Ų112.852%0.51851%0.514SS..Hα-helixtrans-68.3-41.1173-77.6168.1000110.2E315 Q316 R322 H323E315-L319 WeakPolarHBondContact O-CB 3.13Å; E315-L319 WeakPolarHBondContact O-CG 3.02Å; E315-L319 PolarHBondContact O-N 3.4Å; Q316-L319 CarbonylContact O-C 3.58Å; Q316-L319 PolarHBondContact O-N 2.66Å; L319-R322 PolarHBondContact O-N 2.73Å; L319-H323 WeakPolarHBondContact O-CA 3.41Å; L319-H323 WeakPolarHBondContact O-CB 3.3Å; L319-H323 PolarHBondContact O-N 3.48Å
320E72.4Confident74.3Confident133 Ų133109.1 Ų109.162%0.62151%0.506SS*.Hα-helixtrans-66.2-42.5171.6-76.3179.6-178.300110.7Q316 H323 L324Q316-E320 VanDerWaalsContact O-CB 3.24Å; Q316-E320 WeakPolarHBondContact O-CB 3.1Å; Q316-E320 VanDerWaalsContact O-CG 3.26Å; Q316-E320 WeakPolarHBondContact O-CG 3.47Å; Q316-E320 PolarHBondContact O-N 2.71Å; E320-H323 PolarHBondContact O-N 2.67Å; E320-L324 WeakPolarHBondContact O-CA 3.47Å; E320-L324 WeakPolarHBondContact O-CB 3.25Å; E320-L324 PolarHBondContact O-N 3.47Å
321K73.8Confident74.3Confident113 Ų113107.4 Ų107.449%0.49150%0.501SS..Hα-helixtrans-67.5-35.4173.4-77.1163.7-170.6161.40111.7E317 E318 K325E317-K321 WeakPolarHBondContact O-CA 3.13Å; E317-K321 WeakPolarHBondContact O-CB 3.2Å; E317-K321 VanDerWaalsContact O-CD 3.3Å; E317-K321 WeakPolarHBondContact O-CD 3.24Å; E317-K321 WeakPolarHBondContact O-CG 3.26Å; E317-K321 PolarHBondContact O-N 3.4Å; E317-K321 IonicContact OE2-NZ 2.81Å; E318-K321 CarbonylContact O-C 3.52Å; E318-K321 PolarHBondContact O-N 2.8Å; K321-K325 WeakPolarHBondContact O-CA 3.15Å; K321-K325 WeakPolarHBondContact O-CB 3.14Å; K321-K325 VanDerWaalsContact O-CG 3.25Å; K321-K325 WeakPolarHBondContact O-CG 3.16Å; K321-K325 PolarHBondContact O-N 2.71Å
322R70.5Confident74.5Confident134 Ų134109.2 Ų109.251%0.50651%0.507SS..Hα-helixtrans-71-40173.9-80178.7-141.6171.88.2110.3E318 L319 Q326E318-R322 WeakPolarHBondContact O-CA 3.47Å; E318-R322 WeakPolarHBondContact O-CB 3.16Å; E318-R322 WeakPolarHBondContact O-CG 3.45Å; E318-R322 PolarHBondContact O-N 2.69Å; E318-R322 IonicContact OE2-CZ 3.89Å; E318-R322 IonicContact OE2-NH2 3.56Å; E318-R322 PolarHBondContact OE2-NH2 3.38Å; L319-R322 PolarHBondContact O-N 2.73Å; R322-Q326 WeakPolarHBondContact O-CA 3.45Å; R322-Q326 WeakPolarHBondContact O-CB 3.13Å; R322-Q326 WeakPolarHBondContact O-CG 3.03Å; R322-Q326 PolarHBondContact O-N 2.73Å
323H74Confident74.6Confident106 Ų106105.1 Ų105.149%0.49150%0.498SS..Hα-helixtrans-68.5-42.8175.4-178-87.4000110.6L319 E320 Q326 M327L319-H323 WeakPolarHBondContact O-CA 3.41Å; L319-H323 WeakPolarHBondContact O-CB 3.3Å; L319-H323 PolarHBondContact O-N 3.48Å; E320-H323 PolarHBondContact O-N 2.67Å; H323-Q326 CarbonylContact O-C 3.6Å; H323-Q326 PolarHBondContact O-N 3.34Å; H323-M327 VanDerWaalsContact CE1-CE 3.45Å; H323-M327 WeakPolarHBondContact CE1-CE 3.35Å; H323-M327 VanDerWaalsContact O-CB 3.25Å; H323-M327 WeakPolarHBondContact O-CB 3.19Å; H323-M327 WeakPolarHBondContact O-CG 3.25Å; H323-M327 PolarHBondContact O-N 2.77Å
324L76.3Confident74.5Confident102 Ų102103 Ų10353%0.53450%0.495SS..Hα-helixtrans-66.1-45.5175-165.976.1000110.2E320 Q326 M327 E328E320-L324 WeakPolarHBondContact O-CA 3.47Å; E320-L324 WeakPolarHBondContact O-CB 3.25Å; E320-L324 PolarHBondContact O-N 3.47Å; L324-Q326 PolarHBondContact O-N 2.72Å; L324-M327 CarbonylContact O-C 3.6Å; L324-M327 WeakPolarHBondContact O-CB 3.43Å; L324-M327 PolarHBondContact O-N 3.06Å; L324-E328 WeakPolarHBondContact O-CB 3.1Å; L324-E328 VanDerWaalsContact O-CG 3.25Å; L324-E328 WeakPolarHBondContact O-CG 3.48Å; L324-E328 PolarHBondContact O-N 2.71Å
325K77.1Confident74.7Confident118 Ų118105.3 Ų105.351%0.51350%0.501SS..Hα-helixtrans-64-37.7172.6-80.3-177.9176.7-177.90112.2K321 M327 E328 Y329K321-K325 WeakPolarHBondContact O-CA 3.15Å; K321-K325 WeakPolarHBondContact O-CB 3.14Å; K321-K325 VanDerWaalsContact O-CG 3.25Å; K321-K325 WeakPolarHBondContact O-CG 3.16Å; K321-K325 PolarHBondContact O-N 2.71Å; K325-M327 VanDerWaalsContact C-N 3.34Å; K325-E328 PolarHBondContact O-N 2.7Å; K325-Y329 HydrophobicContact CB-CD2 4.32Å; K325-Y329 HydrophobicContact CB-CE2 4.2Å; K325-Y329 VanDerWaalsContact O-CB 3.26Å; K325-Y329 WeakPolarHBondContact O-CB 3.12Å; K325-Y329 WeakPolarHBondContact O-CD2 3.25Å; K325-Y329 VanDerWaalsContact O-CG 3.27Å; K325-Y329 PolarHBondContact O-N 3.48Å
326Q75.5Confident74.9Confident133 Ų133104.7 Ų104.762%0.62150%0.501SS*.Hα-helixtrans-67.5-37.1173.8-81.8175.6300111.1R322 H323 L324 A330R322-Q326 WeakPolarHBondContact O-CA 3.45Å; R322-Q326 WeakPolarHBondContact O-CB 3.13Å; R322-Q326 WeakPolarHBondContact O-CG 3.03Å; R322-Q326 PolarHBondContact O-N 2.73Å; H323-Q326 CarbonylContact O-C 3.6Å; H323-Q326 PolarHBondContact O-N 3.34Å; L324-Q326 PolarHBondContact O-N 2.72Å; Q326-A330 WeakPolarHBondContact O-CA 3.5Å; Q326-A330 WeakPolarHBondContact O-CB 3.48Å; Q326-A330 PolarHBondContact O-N 3.4Å
327M75Confident75.1Confident89 Ų89104.6 Ų104.644%0.43850%0.504SS..Hα-helixtrans-70-37.6172.9-76.7-69.5-161.700111.3H323 L324 K325 A330 N331H323-M327 VanDerWaalsContact CE1-CE 3.45Å; H323-M327 WeakPolarHBondContact CE1-CE 3.35Å; H323-M327 VanDerWaalsContact O-CB 3.25Å; H323-M327 WeakPolarHBondContact O-CB 3.19Å; H323-M327 WeakPolarHBondContact O-CG 3.25Å; H323-M327 PolarHBondContact O-N 2.77Å; L324-M327 CarbonylContact O-C 3.6Å; L324-M327 WeakPolarHBondContact O-CB 3.43Å; L324-M327 PolarHBondContact O-N 3.06Å; K325-M327 VanDerWaalsContact C-N 3.34Å; M327-A330 PolarHBondContact O-N 3.2Å; M327-N331 WeakPolarHBondContact O-CA 3.26Å; M327-N331 WeakPolarHBondContact O-CB 2.95Å; M327-N331 PolarHBondContact O-N 2.67Å; M327-N331 PolarHBondContact O-ND2 2.74Å
328E75.5Confident75.3Confident93 Ų93105.5 Ų105.544%0.43551%0.51SS..Hα-helixtrans-66.1-50.1173-76.2170.5173.900109.7L324 K325 A330 N331 E332L324-E328 WeakPolarHBondContact O-CB 3.1Å; L324-E328 VanDerWaalsContact O-CG 3.25Å; L324-E328 WeakPolarHBondContact O-CG 3.48Å; L324-E328 PolarHBondContact O-N 2.71Å; K325-E328 PolarHBondContact O-N 2.7Å; E328-A330 VanDerWaalsContact C-N 3.31Å; E328-A330 PolarHBondContact O-N 2.74Å; E328-N331 CarbonylContact O-C 3.54Å; E328-N331 PolarHBondContact O-N 3.44Å; E328-E332 VanDerWaalsContact O-CB 3.23Å; E328-E332 WeakPolarHBondContact O-CB 3.07Å; E328-E332 VanDerWaalsContact O-CG 3.27Å; E328-E332 WeakPolarHBondContact O-CG 3.47Å; E328-E332 PolarHBondContact O-N 3.41Å
329Y75.7Confident75.5Confident152 Ų152104.8 Ų104.860%0.59651%0.506SS*.Hα-helixtrans-62.2-36.5172.8-72.9-51.3000112K325 A333K325-Y329 HydrophobicContact CB-CD2 4.32Å; K325-Y329 HydrophobicContact CB-CE2 4.2Å; K325-Y329 VanDerWaalsContact O-CB 3.26Å; K325-Y329 WeakPolarHBondContact O-CB 3.12Å; K325-Y329 WeakPolarHBondContact O-CD2 3.25Å; K325-Y329 VanDerWaalsContact O-CG 3.27Å; K325-Y329 PolarHBondContact O-N 3.48Å; Y329-A333 WeakPolarHBondContact O-CA 3Å; Y329-A333 WeakPolarHBondContact O-CB 3.44Å; Y329-A333 PolarHBondContact O-N 2.66Å
330A74.4Confident75.6Confident52 Ų52106.4 Ų106.443%0.4351%0.509SS..Hα-helixtrans-69.6-39.8174.600000110.8Q326 M327 E328 H334Q326-A330 WeakPolarHBondContact O-CA 3.5Å; Q326-A330 WeakPolarHBondContact O-CB 3.48Å; Q326-A330 PolarHBondContact O-N 3.4Å; M327-A330 PolarHBondContact O-N 3.2Å; E328-A330 VanDerWaalsContact C-N 3.31Å; E328-A330 PolarHBondContact O-N 2.74Å; A330-H334 WeakPolarHBondContact O-CA 3.22Å; A330-H334 WeakPolarHBondContact O-CB 3.27Å; A330-H334 PolarHBondContact O-N 2.72Å
331N75.5Confident75.7Confident95 Ų95109.2 Ų109.251%0.50851%0.514SS..Hα-helixtrans-71.4-38.2176.3-75.7-29.3000111.6M327 E328 H334 K335M327-N331 WeakPolarHBondContact O-CA 3.26Å; M327-N331 WeakPolarHBondContact O-CB 2.95Å; M327-N331 PolarHBondContact O-N 2.67Å; M327-N331 PolarHBondContact O-ND2 2.74Å; E328-N331 CarbonylContact O-C 3.54Å; E328-N331 PolarHBondContact O-N 3.44Å; N331-H334 CarbonylContact O-C 3.58Å; N331-H334 PolarHBondContact O-N 3.19Å; N331-K335 VanDerWaalsContact O-CB 3.27Å; N331-K335 WeakPolarHBondContact O-CB 3.28Å; N331-K335 VanDerWaalsContact O-CG 3.22Å; N331-K335 WeakPolarHBondContact O-CG 3.48Å; N331-K335 PolarHBondContact O-N 3.44Å
332E76.3Confident75.9Confident107 Ų107109.1 Ų109.150%0.552%0.515SS..Hα-helixtrans-69.9-44.5174.1-76.3-177.9173.800110E328 H334 K335 L336E328-E332 VanDerWaalsContact O-CB 3.23Å; E328-E332 WeakPolarHBondContact O-CB 3.07Å; E328-E332 VanDerWaalsContact O-CG 3.27Å; E328-E332 WeakPolarHBondContact O-CG 3.47Å; E328-E332 PolarHBondContact O-N 3.41Å; E332-H334 VanDerWaalsContact C-N 3.3Å; E332-H334 PolarHBondContact O-N 2.78Å; E332-K335 CarbonylContact O-C 3.57Å; E332-K335 PolarHBondContact O-N 3.44Å; E332-L336 VanDerWaalsContact O-CB 3.29Å; E332-L336 WeakPolarHBondContact O-CB 3.21Å; E332-L336 WeakPolarHBondContact O-CG 3.29Å; E332-L336 PolarHBondContact O-N 2.78Å
333A75.9Confident76.2Confident48 Ų48109.4 Ų109.440%0.39752%0.517SS..Hα-helixtrans-62.7-38171.900000111.2Y329 L336 L337Y329-A333 WeakPolarHBondContact O-CA 3Å; Y329-A333 WeakPolarHBondContact O-CB 3.44Å; Y329-A333 PolarHBondContact O-N 2.66Å; A333-L336 PolarHBondContact O-N 3.43Å; A333-L337 VanDerWaalsContact O-CB 3.27Å; A333-L337 WeakPolarHBondContact O-CB 3.33Å; A333-L337 PolarHBondContact O-N 3.32Å
334H73.2Confident76.5Confident112 Ų112108.6 Ų108.652%0.51952%0.515SS..Hα-helixtrans-70.7-38.5175.5-163.8-32000111.4A330 N331 E332 L337 I338A330-H334 WeakPolarHBondContact O-CA 3.22Å; A330-H334 WeakPolarHBondContact O-CB 3.27Å; A330-H334 PolarHBondContact O-N 2.72Å; N331-H334 CarbonylContact O-C 3.58Å; N331-H334 PolarHBondContact O-N 3.19Å; E332-H334 VanDerWaalsContact C-N 3.3Å; E332-H334 PolarHBondContact O-N 2.78Å; H334-L337 PolarHBondContact O-N 3.19Å; H334-I338 VanDerWaalsContact ND1-CD1 3.28Å; H334-I338 WeakPolarHBondContact ND1-CD1 3.27Å; H334-I338 WeakPolarHBondContact ND1-CG1 3.24Å; H334-I338 WeakPolarHBondContact O-CB 3.27Å; H334-I338 VanDerWaalsContact O-CG1 3.26Å; H334-I338 WeakPolarHBondContact O-CG1 3.23Å; H334-I338 PolarHBondContact O-N 2.74Å
335K77.5Confident76.5Confident135 Ų135108.6 Ų108.659%0.58751%0.513SS*.Hα-helixtrans-62.7-46.7170.9-80.9175.5-178.3179.80110.3N331 E332 L337 I338 E339N331-K335 VanDerWaalsContact O-CB 3.27Å; N331-K335 WeakPolarHBondContact O-CB 3.28Å; N331-K335 VanDerWaalsContact O-CG 3.22Å; N331-K335 WeakPolarHBondContact O-CG 3.48Å; N331-K335 PolarHBondContact O-N 3.44Å; E332-K335 CarbonylContact O-C 3.57Å; E332-K335 PolarHBondContact O-N 3.44Å; K335-L337 VanDerWaalsContact C-N 3.3Å; K335-L337 PolarHBondContact O-N 2.76Å; K335-I338 CarbonylContact O-C 3.55Å; K335-I338 PolarHBondContact O-N 3.28Å; K335-E339 WeakPolarHBondContact O-CB 3.26Å; K335-E339 WeakPolarHBondContact O-CG 3.43Å; K335-E339 PolarHBondContact O-N 3.33Å
336L79.2Confident76.6Confident105 Ų105108 Ų10855%0.5551%0.513SS..Hα-helixtrans-63.5-34.4174.7-72.2171.7000111.8E332 A333 K340E332-L336 VanDerWaalsContact O-CB 3.29Å; E332-L336 WeakPolarHBondContact O-CB 3.21Å; E332-L336 WeakPolarHBondContact O-CG 3.29Å; E332-L336 PolarHBondContact O-N 2.78Å; A333-L336 PolarHBondContact O-N 3.43Å; L336-K340 WeakPolarHBondContact O-CA 3.31Å; L336-K340 WeakPolarHBondContact O-CB 3.37Å; L336-K340 PolarHBondContact O-N 2.83Å
337L75.8Confident76.8Confident117 Ų117107.2 Ų107.261%0.61351%0.509SS*.Hα-helixtrans-69.4-42.4172.4-104.2150.7000111.6A333 H334 K335 K340 R341A333-L337 VanDerWaalsContact O-CB 3.27Å; A333-L337 WeakPolarHBondContact O-CB 3.33Å; A333-L337 PolarHBondContact O-N 3.32Å; H334-L337 PolarHBondContact O-N 3.19Å; K335-L337 VanDerWaalsContact C-N 3.3Å; K335-L337 PolarHBondContact O-N 2.76Å; L337-K340 PolarHBondContact O-N 3.4Å; L337-R341 VanDerWaalsContact O-CB 3.24Å; L337-R341 WeakPolarHBondContact O-CB 3.33Å; L337-R341 PolarHBondContact O-N 3.47Å
338I78.7Confident77Confident75 Ų75110.2 Ų110.239%0.38552%0.516SS..Hα-helixtrans-64.1-48.1174.6-72.4164.6000109.6H334 K335 K340 R341 Q342H334-I338 VanDerWaalsContact ND1-CD1 3.28Å; H334-I338 WeakPolarHBondContact ND1-CD1 3.27Å; H334-I338 WeakPolarHBondContact ND1-CG1 3.24Å; H334-I338 WeakPolarHBondContact O-CB 3.27Å; H334-I338 VanDerWaalsContact O-CG1 3.26Å; H334-I338 WeakPolarHBondContact O-CG1 3.23Å; H334-I338 PolarHBondContact O-N 2.74Å; K335-I338 CarbonylContact O-C 3.55Å; K335-I338 PolarHBondContact O-N 3.28Å; I338-K340 VanDerWaalsContact C-N 3.34Å; I338-K340 PolarHBondContact O-N 3.17Å; I338-R341 CarbonylContact O-C 3.58Å; I338-R341 PolarHBondContact O-N 3.49Å; I338-Q342 HydrophobicContact CG2-CG 4.32Å; I338-Q342 WeakPolarHBondContact O-CB 3.15Å; I338-Q342 VanDerWaalsContact O-CG 3.3Å; I338-Q342 WeakPolarHBondContact O-CG 3.27Å; I338-Q342 PolarHBondContact O-N 2.73Å
339E78.7Confident77.1Confident82 Ų82110.7 Ų110.738%0.38352%0.518SS..Hα-helixtrans-61-42.8175.5-77.2-179.2-164.700111K335 R341 Q342 R343K335-E339 WeakPolarHBondContact O-CB 3.26Å; K335-E339 WeakPolarHBondContact O-CG 3.43Å; K335-E339 PolarHBondContact O-N 3.33Å; E339-R341 VanDerWaalsContact C-N 3.34Å; E339-Q342 PolarHBondContact O-N 2.72Å; E339-R343 WeakPolarHBondContact O-CB 3.06Å; E339-R343 VanDerWaalsContact O-CG 3.31Å; E339-R343 WeakPolarHBondContact O-CG 3.48Å; E339-R343 PolarHBondContact O-N 2.73Å; E339-R343 IonicContact OE2-NH2 3.14Å
340K76.1Confident77.3Confident133 Ų133108.8 Ų108.858%0.57852%0.515SS*.Hα-helixtrans-64.6-40174.8-175.1175.7-177.1178.50110.8L336 L337 I338 R343 I344L336-K340 WeakPolarHBondContact O-CA 3.31Å; L336-K340 WeakPolarHBondContact O-CB 3.37Å; L336-K340 PolarHBondContact O-N 2.83Å; L337-K340 PolarHBondContact O-N 3.4Å; I338-K340 VanDerWaalsContact C-N 3.34Å; I338-K340 PolarHBondContact O-N 3.17Å; K340-R343 PolarHBondContact O-N 2.8Å; K340-I344 HydrophobicContact CG-CD1 3.86Å; K340-I344 HydrophobicContact CG-CG1 4.4Å; K340-I344 WeakPolarHBondContact O-CB 3.34Å; K340-I344 WeakPolarHBondContact O-CG1 3.18Å; K340-I344 PolarHBondContact O-N 3.42Å
341R75Confident77.6Confident193 Ų193108.8 Ų108.873%0.72852%0.515SS*.Hα-helixtrans-67.6-38.3176.3-149.7176.1-157.2-174.94.9111.1L337 I338 E339 M345L337-R341 VanDerWaalsContact O-CB 3.24Å; L337-R341 WeakPolarHBondContact O-CB 3.33Å; L337-R341 PolarHBondContact O-N 3.47Å; I338-R341 CarbonylContact O-C 3.58Å; I338-R341 PolarHBondContact O-N 3.49Å; E339-R341 VanDerWaalsContact C-N 3.34Å; R341-M345 VanDerWaalsContact O-CB 3.27Å; R341-M345 WeakPolarHBondContact O-CB 3.37Å; R341-M345 WeakPolarHBondContact O-CG 3.27Å; R341-M345 PolarHBondContact O-N 2.76Å
342Q78.7Confident77.9Confident110 Ų110109.7 Ų109.751%0.51452%0.515SS..Hα-helixtrans-66.8-43.7173.4-76.1175.9-7.300111.2I338 E339 M345 Q346I338-Q342 HydrophobicContact CG2-CG 4.32Å; I338-Q342 WeakPolarHBondContact O-CB 3.15Å; I338-Q342 VanDerWaalsContact O-CG 3.3Å; I338-Q342 WeakPolarHBondContact O-CG 3.27Å; I338-Q342 PolarHBondContact O-N 2.73Å; E339-Q342 PolarHBondContact O-N 2.72Å; Q342-M345 PolarHBondContact O-N 3.22Å; Q342-Q346 VanDerWaalsContact O-CB 3.27Å; Q342-Q346 WeakPolarHBondContact O-CB 3.3Å; Q342-Q346 WeakPolarHBondContact O-CG 3.16Å; Q342-Q346 PolarHBondContact O-N 3.42Å
343R77Confident78Confident141 Ų141111.6 Ų111.653%0.53252%0.521SS..Hα-helixtrans-62.3-47173.6-75.3-173-141.2-177.65.9111E339 K340 M345 Q346 E347E339-R343 WeakPolarHBondContact O-CB 3.06Å; E339-R343 VanDerWaalsContact O-CG 3.31Å; E339-R343 WeakPolarHBondContact O-CG 3.48Å; E339-R343 PolarHBondContact O-N 2.73Å; E339-R343 IonicContact OE2-NH2 3.14Å; K340-R343 PolarHBondContact O-N 2.8Å; R343-M345 VanDerWaalsContact C-N 3.32Å; R343-M345 PolarHBondContact O-N 2.81Å; R343-Q346 CarbonylContact O-C 3.59Å; R343-Q346 PolarHBondContact O-N 2.71Å; R343-E347 VanDerWaalsContact O-CB 3.24Å; R343-E347 WeakPolarHBondContact O-CB 3.09Å; R343-E347 VanDerWaalsContact O-CG 3.23Å; R343-E347 WeakPolarHBondContact O-CG 3.24Å; R343-E347 PolarHBondContact O-N 2.78Å
344I78.6Confident78.3Confident88 Ų88115.6 Ų115.645%0.45153%0.531SS..Hα-helixtrans-62.4-40.5176-69.8167.6000110.8K340 Y348K340-I344 HydrophobicContact CG-CD1 3.86Å; K340-I344 HydrophobicContact CG-CG1 4.4Å; K340-I344 WeakPolarHBondContact O-CB 3.34Å; K340-I344 WeakPolarHBondContact O-CG1 3.18Å; K340-I344 PolarHBondContact O-N 3.42Å; I344-Y348 WeakPolarHBondContact O-CB 3.23Å; I344-Y348 PolarHBondContact O-N 2.75Å
345M77.5Confident78.6Confident102 Ų102114.8 Ų114.850%0.50253%0.531SS..Hα-helixtrans-66.8-40.9175.6-76-67.6-65.900111.6R341 Q342 R343 Y348 E349R341-M345 VanDerWaalsContact O-CB 3.27Å; R341-M345 WeakPolarHBondContact O-CB 3.37Å; R341-M345 WeakPolarHBondContact O-CG 3.27Å; R341-M345 PolarHBondContact O-N 2.76Å; Q342-M345 PolarHBondContact O-N 3.22Å; R343-M345 VanDerWaalsContact C-N 3.32Å; R343-M345 PolarHBondContact O-N 2.81Å; M345-Y348 PolarHBondContact O-N 2.74Å; M345-E349 WeakPolarHBondContact O-CB 3.31Å; M345-E349 VanDerWaalsContact O-CG 3.31Å; M345-E349 WeakPolarHBondContact O-CG 3.36Å; M345-E349 PolarHBondContact O-N 3.32Å
346Q79.2Confident78.6Confident107 Ų107111.7 Ų111.750%0.552%0.521SS..Hα-helixtrans-66.3-43.9175.3-76.5173.2-4.400111.3Q342 R343 Y348 E349 Q350Q342-Q346 VanDerWaalsContact O-CB 3.27Å; Q342-Q346 WeakPolarHBondContact O-CB 3.3Å; Q342-Q346 WeakPolarHBondContact O-CG 3.16Å; Q342-Q346 PolarHBondContact O-N 3.42Å; R343-Q346 CarbonylContact O-C 3.59Å; R343-Q346 PolarHBondContact O-N 2.71Å; Q346-Y348 VanDerWaalsContact C-N 3.33Å; Q346-E349 PolarHBondContact O-N 2.93Å; Q346-Q350 VanDerWaalsContact O-CB 3.24Å; Q346-Q350 WeakPolarHBondContact O-CB 3.2Å; Q346-Q350 WeakPolarHBondContact O-CG 3.15Å; Q346-Q350 PolarHBondContact O-N 2.74Å
347E79.1Confident78.7Confident115 Ų115109 Ų10954%0.53751%0.514SS..Hα-helixtrans-63-40.3173.8-76170.5-171.300110.4R343 Q350 A351R343-E347 VanDerWaalsContact O-CB 3.24Å; R343-E347 WeakPolarHBondContact O-CB 3.09Å; R343-E347 VanDerWaalsContact O-CG 3.23Å; R343-E347 WeakPolarHBondContact O-CG 3.24Å; R343-E347 PolarHBondContact O-N 2.78Å; E347-Q350 PolarHBondContact O-N 2.84Å; E347-A351 WeakPolarHBondContact O-CB 3.21Å; E347-A351 PolarHBondContact O-N 3.38Å
348Y79Confident78.8Confident152 Ų152108.2 Ų108.260%0.59651%0.507SS*.Hα-helixtrans-66.9-42.4174.8-178.3-97.1000111.6I344 M345 Q346 K352I344-Y348 WeakPolarHBondContact O-CB 3.23Å; I344-Y348 PolarHBondContact O-N 2.75Å; M345-Y348 PolarHBondContact O-N 2.74Å; Q346-Y348 VanDerWaalsContact C-N 3.33Å; Y348-K352 WeakPolarHBondContact O-CB 3.24Å; Y348-K352 PolarHBondContact O-N 3.47Å
349E78.9Confident78.8Confident103 Ų103109.9 Ų109.948%0.48151%0.511SS..Hα-helixtrans-66.1-40174.9-77.8178.8-17700112.1M345 Q346 K353M345-E349 WeakPolarHBondContact O-CB 3.31Å; M345-E349 VanDerWaalsContact O-CG 3.31Å; M345-E349 WeakPolarHBondContact O-CG 3.36Å; M345-E349 PolarHBondContact O-N 3.32Å; Q346-E349 PolarHBondContact O-N 2.93Å; E349-K353 WeakPolarHBondContact O-CB 3.27Å; E349-K353 VanDerWaalsContact O-CG 3.27Å; E349-K353 WeakPolarHBondContact O-CG 3.41Å; E349-K353 PolarHBondContact O-N 3.32Å
350Q78.6Confident78.8Confident113 Ų113112.1 Ų112.153%0.52852%0.522SS..Hα-helixtrans-66.4-51.2174.8-77.5176.3-5.400110.5Q346 E347 K352 K353 E354Q346-Q350 VanDerWaalsContact O-CB 3.24Å; Q346-Q350 WeakPolarHBondContact O-CB 3.2Å; Q346-Q350 WeakPolarHBondContact O-CG 3.15Å; Q346-Q350 PolarHBondContact O-N 2.74Å; E347-Q350 PolarHBondContact O-N 2.84Å; Q350-K352 VanDerWaalsContact C-N 3.27Å; Q350-K352 PolarHBondContact O-N 3.44Å; Q350-K353 CarbonylContact O-C 3.59Å; Q350-K353 WeakPolarHBondContact O-CA 3.36Å; Q350-K353 WeakPolarHBondContact O-CB 3.19Å; Q350-K353 PolarHBondContact O-N 3.47Å; Q350-K353 VanDerWaalsContact O-N 3.08Å; Q350-E354 WeakPolarHBondContact O-CB 3.45Å; Q350-E354 WeakPolarHBondContact O-CG 3.46Å; Q350-E354 PolarHBondContact O-N 2.88Å
351A82.1Confident78.8Confident52 Ų52113.5 Ų113.543%0.4352%0.523SS..Hα-helixtrans-61-35.7177.100000111.8E347 L355E347-A351 WeakPolarHBondContact O-CB 3.21Å; E347-A351 PolarHBondContact O-N 3.38Å; A351-L355 WeakPolarHBondContact O-CB 3.5Å; A351-L355 PolarHBondContact O-N 3.41Å
352K80.2Confident79.1Confident114 Ų114107.6 Ų107.650%0.49651%0.505SS..Hα-helixtrans-67.1-44.6173.3-172.8178.2178.3-1770111.3Y348 Q350 L355 D356Y348-K352 WeakPolarHBondContact O-CB 3.24Å; Y348-K352 PolarHBondContact O-N 3.47Å; Q350-K352 VanDerWaalsContact C-N 3.27Å; Q350-K352 PolarHBondContact O-N 3.44Å; K352-L355 PolarHBondContact O-N 2.81Å; K352-D356 WeakPolarHBondContact O-CB 3.21Å; K352-D356 VanDerWaalsContact O-CG 3.28Å; K352-D356 PolarHBondContact O-N 3.31Å
353K79.8Confident79.1Confident147 Ų147108.1 Ų108.164%0.63951%0.511SS*.Hα-helixtrans-62.3-41.5174.5-77.3174.5-178.3175.70112.1E349 Q350 D356 A357E349-K353 WeakPolarHBondContact O-CB 3.27Å; E349-K353 VanDerWaalsContact O-CG 3.27Å; E349-K353 WeakPolarHBondContact O-CG 3.41Å; E349-K353 PolarHBondContact O-N 3.32Å; Q350-K353 CarbonylContact O-C 3.59Å; Q350-K353 WeakPolarHBondContact O-CA 3.36Å; Q350-K353 WeakPolarHBondContact O-CB 3.19Å; Q350-K353 PolarHBondContact O-N 3.47Å; Q350-K353 VanDerWaalsContact O-N 3.08Å; K353-D356 PolarHBondContact O-N 2.75Å; K353-A357 WeakPolarHBondContact O-CB 3.38Å; K353-A357 PolarHBondContact O-N 2.83Å
354E80.9Confident79.1Confident131 Ų131106.7 Ų106.761%0.61251%0.51SS*.Hα-helixtrans-66.4-44.7176-74.8177-179.800111.1Q350 D356 A357 E358Q350-E354 WeakPolarHBondContact O-CB 3.45Å; Q350-E354 WeakPolarHBondContact O-CG 3.46Å; Q350-E354 PolarHBondContact O-N 2.88Å; E354-D356 VanDerWaalsContact C-N 3.33Å; E354-D356 PolarHBondContact O-N 3.08Å; E354-A357 PolarHBondContact O-N 3.3Å; E354-E358 WeakPolarHBondContact O-CB 3.39Å; E354-E358 PolarHBondContact O-N 2.98Å
355L80.3Confident79Confident96 Ų96107.9 Ų107.950%0.50351%0.514SS..Hα-helixtrans-61.6-42.6175.5-172.783.9000111.3A351 K352 K359A351-L355 WeakPolarHBondContact O-CB 3.5Å; A351-L355 PolarHBondContact O-N 3.41Å; K352-L355 PolarHBondContact O-N 2.81Å; L355-K359 HydrophobicContact CG-CD 4.43Å; L355-K359 WeakPolarHBondContact O-CB 3.2Å; L355-K359 WeakPolarHBondContact O-CG 3.27Å; L355-K359 PolarHBondContact O-N 2.74Å
356D77.9Confident79Confident70 Ų70109.5 Ų109.537%0.37452%0.518SS..Hα-helixtrans-69.3-38.4178.1-71.1-23.1000111.1K352 K353 E354 Q360K352-D356 WeakPolarHBondContact O-CB 3.21Å; K352-D356 VanDerWaalsContact O-CG 3.28Å; K352-D356 PolarHBondContact O-N 3.31Å; K353-D356 PolarHBondContact O-N 2.75Å; E354-D356 VanDerWaalsContact C-N 3.33Å; E354-D356 PolarHBondContact O-N 3.08Å; D356-Q360 WeakPolarHBondContact O-CG 3.33Å; D356-Q360 PolarHBondContact O-N 2.87Å
357A81.6Confident78.9Confident49 Ų49111.8 Ų111.841%0.40552%0.522SS..Hα-helixtrans-66.2-41.1173.300000112.3K353 E354 Q360 R361K353-A357 WeakPolarHBondContact O-CB 3.38Å; K353-A357 PolarHBondContact O-N 2.83Å; E354-A357 PolarHBondContact O-N 3.3Å; A357-Q360 PolarHBondContact O-N 3.38Å; A357-R361 WeakPolarHBondContact O-CG 3.21Å; A357-R361 PolarHBondContact O-N 2.79Å
358E77.8Confident78.7Confident100 Ų100110.6 Ų110.647%0.46752%0.519SS..Hα-helixtrans-69.3-38.9177.9-164.963.3-158.600110.7E354 Q360 R361 I362E354-E358 WeakPolarHBondContact O-CB 3.39Å; E354-E358 PolarHBondContact O-N 2.98Å; E358-Q360 VanDerWaalsContact C-N 3.31Å; E358-Q360 PolarHBondContact O-N 3.24Å; E358-R361 PolarHBondContact O-N 3.29Å; E358-I362 HydrophobicContact CG-CD1 4.08Å; E358-I362 WeakPolarHBondContact O-CB 3.41Å; E358-I362 VanDerWaalsContact O-CG1 3.27Å; E358-I362 WeakPolarHBondContact O-CG1 3.45Å; E358-I362 PolarHBondContact O-N 2.82Å
359K78.2Confident78.7Confident109 Ų109107.7 Ų107.747%0.47452%0.516SS..Hα-helixtrans-60.5-41.9170.3-78.4171.7-176.9169.90111.5L355 L363L355-K359 HydrophobicContact CG-CD 4.43Å; L355-K359 WeakPolarHBondContact O-CB 3.2Å; L355-K359 WeakPolarHBondContact O-CG 3.27Å; L355-K359 PolarHBondContact O-N 2.74Å; K359-L363 WeakPolarHBondContact O-CB 3.24Å; K359-L363 WeakPolarHBondContact O-CD1 3.5Å; K359-L363 VanDerWaalsContact O-CG 3.24Å; K359-L363 WeakPolarHBondContact O-CG 3.32Å; K359-L363 PolarHBondContact O-N 2.87Å
360Q77.5Confident78.6Confident130 Ų130105.5 Ų105.561%0.60751%0.506SS*.Hα-helixtrans-64.3-44.7175-75.3-169-1.800111.5D356 A357 E358 L363 E364D356-Q360 WeakPolarHBondContact O-CG 3.33Å; D356-Q360 PolarHBondContact O-N 2.87Å; A357-Q360 PolarHBondContact O-N 3.38Å; E358-Q360 VanDerWaalsContact C-N 3.31Å; E358-Q360 PolarHBondContact O-N 3.24Å; Q360-L363 PolarHBondContact O-N 3.46Å; Q360-E364 PolarHBondContact O-N 2.96Å
361R77.8Confident78.6Confident162 Ų162104.9 Ų104.961%0.61150%0.504SS*.Hα-helixtrans-59-49.1174.3-78.8-166.4172.8-146.50.3112.7A357 E358 L363 E364 E365A357-R361 WeakPolarHBondContact O-CG 3.21Å; A357-R361 PolarHBondContact O-N 2.79Å; E358-R361 PolarHBondContact O-N 3.29Å; R361-L363 VanDerWaalsContact C-N 3.28Å; R361-L363 PolarHBondContact O-N 3.24Å; R361-E364 CarbonylContact O-C 3.58Å; R361-E364 PolarHBondContact O-N 3.03Å; R361-E364 VanDerWaalsContact O-N 3.16Å; R361-E365 WeakPolarHBondContact O-CB 3.31Å; R361-E365 WeakPolarHBondContact O-CG 3.41Å; R361-E365 PolarHBondContact O-N 3.13Å
362I79.4Confident78.3Confident68 Ų68107.4 Ų107.435%0.34951%0.506SS..Hα-helixtrans-63.4-36.6178.8-68.7169.2000110.7E358 K366E358-I362 HydrophobicContact CG-CD1 4.08Å; E358-I362 WeakPolarHBondContact O-CB 3.41Å; E358-I362 VanDerWaalsContact O-CG1 3.27Å; E358-I362 WeakPolarHBondContact O-CG1 3.45Å; E358-I362 PolarHBondContact O-N 2.82Å; I362-K366 HydrophobicContact CG2-CD 4.13Å; I362-K366 HydrophobicContact CG2-CG 4.46Å; I362-K366 VanDerWaalsContact O-CB 3.31Å; I362-K366 WeakPolarHBondContact O-CB 3.42Å; I362-K366 VanDerWaalsContact O-CG 3.25Å; I362-K366 WeakPolarHBondContact O-CG 3.49Å; I362-K366 PolarHBondContact O-N 3.48Å
363L79.5Confident78.3Confident122 Ų122104 Ų10464%0.63949%0.49SS*.Hα-helixtrans-66-42.3174.3-78.7165.9000111.6K359 Q360 R361 R367K359-L363 WeakPolarHBondContact O-CB 3.24Å; K359-L363 WeakPolarHBondContact O-CD1 3.5Å; K359-L363 VanDerWaalsContact O-CG 3.24Å; K359-L363 WeakPolarHBondContact O-CG 3.32Å; K359-L363 PolarHBondContact O-N 2.87Å; Q360-L363 PolarHBondContact O-N 3.46Å; R361-L363 VanDerWaalsContact C-N 3.28Å; R361-L363 PolarHBondContact O-N 3.24Å; L363-R367 WeakPolarHBondContact O-CB 3.35Å; L363-R367 PolarHBondContact O-N 2.9Å
364E77.3Confident77.8Confident110 Ų110100.8 Ų100.851%0.51448%0.477SS..Hα-helixtrans-66.4-45.2175.4-83.6167.715100112.3Q360 R361 K366 R367 I368Q360-E364 PolarHBondContact O-N 2.96Å; R361-E364 CarbonylContact O-C 3.58Å; R361-E364 PolarHBondContact O-N 3.03Å; R361-E364 VanDerWaalsContact O-N 3.16Å; E364-K366 PolarHBondContact O-N 2.75Å; E364-R367 WeakPolarHBondContact O-CB 3.32Å; E364-R367 PolarHBondContact O-N 3.16Å; E364-R367 VanDerWaalsContact O-N 3.13Å; E364-I368 VanDerWaalsContact O-CG1 3.32Å; E364-I368 WeakPolarHBondContact O-CG1 3.25Å; E364-I368 PolarHBondContact O-N 3.37Å
365E76.3Confident77.6Confident113 Ų11398.8 Ų98.853%0.52847%0.468SS..Hα-helixtrans-59.8-45.9174.8-77.9-176.8172.700111.5R361 R367 I368 V369R361-E365 WeakPolarHBondContact O-CB 3.31Å; R361-E365 WeakPolarHBondContact O-CG 3.41Å; R361-E365 PolarHBondContact O-N 3.13Å; E365-R367 VanDerWaalsContact C-N 3.26Å; E365-R367 PolarHBondContact O-N 3.29Å; E365-I368 PolarHBondContact O-N 2.93Å; E365-V369 WeakPolarHBondContact O-CB 3.25Å; E365-V369 VanDerWaalsContact O-CG2 3.3Å; E365-V369 WeakPolarHBondContact O-CG2 3.3Å; E365-V369 PolarHBondContact O-N 2.67Å
366K77.4Confident77.3Confident137 Ų13798.4 Ų98.460%0.59647%0.466SS*.Hα-helixtrans-61.7-36.7175.6-77.5178-179.4179.30111.7I362 E364 E370I362-K366 HydrophobicContact CG2-CD 4.13Å; I362-K366 HydrophobicContact CG2-CG 4.46Å; I362-K366 VanDerWaalsContact O-CB 3.31Å; I362-K366 WeakPolarHBondContact O-CB 3.42Å; I362-K366 VanDerWaalsContact O-CG 3.25Å; I362-K366 WeakPolarHBondContact O-CG 3.49Å; I362-K366 PolarHBondContact O-N 3.48Å; E364-K366 PolarHBondContact O-N 2.75Å; K366-E370 WeakPolarHBondContact O-CB 3.44Å; K366-E370 PolarHBondContact O-N 2.74Å; K366-E370 VanDerWaalsContact O-N 3.08Å
367R76.5Confident77.1Confident155 Ų15595.9 Ų95.959%0.58545%0.452SS*.Hα-helixtrans-63.4-47.6175-152.9-169.780.9-163.7-5.1111L363 E364 E365 E370 E371L363-R367 WeakPolarHBondContact O-CB 3.35Å; L363-R367 PolarHBondContact O-N 2.9Å; E364-R367 WeakPolarHBondContact O-CB 3.32Å; E364-R367 PolarHBondContact O-N 3.16Å; E364-R367 VanDerWaalsContact O-N 3.13Å; E365-R367 VanDerWaalsContact C-N 3.26Å; E365-R367 PolarHBondContact O-N 3.29Å; R367-E370 PolarHBondContact O-N 2.97Å; R367-E371 IonicContact CZ-OE1 2.68Å; R367-E371 IonicContact NE-OE1 3.46Å; R367-E371 PolarHBondContact NE-OE1 3.08Å; R367-E371 IonicContact NH2-OE1 3.32Å; R367-E371 WeakPolarHBondContact O-CB 3.44Å; R367-E371 VanDerWaalsContact O-CG 3.25Å; R367-E371 WeakPolarHBondContact O-CG 3.46Å; R367-E371 PolarHBondContact O-N 2.99Å
368I76.7Confident76.5Confident90 Ų90101 Ų10146%0.46246%0.461SS..Hα-helixtrans-63.8-45.2178.7-66.6165.3000111.6E364 E365 E370 E371 E372E364-I368 VanDerWaalsContact O-CG1 3.32Å; E364-I368 WeakPolarHBondContact O-CG1 3.25Å; E364-I368 PolarHBondContact O-N 3.37Å; E365-I368 PolarHBondContact O-N 2.93Å; I368-E370 VanDerWaalsContact C-N 3.31Å; I368-E370 PolarHBondContact O-N 2.81Å; I368-E371 WeakPolarHBondContact O-CB 3.46Å; I368-E371 PolarHBondContact O-N 3.42Å; I368-E372 WeakPolarHBondContact O-CB 3.49Å; I368-E372 PolarHBondContact O-N 3.41Å
369V77.5Confident76.2Confident90 Ų90101.5 Ų101.555%0.54546%0.463SS..Hα-helixtrans-63.2-39.4179.2169.40000111E365 R373E365-V369 WeakPolarHBondContact O-CB 3.25Å; E365-V369 VanDerWaalsContact O-CG2 3.3Å; E365-V369 WeakPolarHBondContact O-CG2 3.3Å; E365-V369 PolarHBondContact O-N 2.67Å; V369-R373 WeakPolarHBondContact O-CB 3.24Å; V369-R373 PolarHBondContact O-N 2.8Å
370E76.8Confident75.6Confident58 Ų58100.5 Ų100.527%0.27146%0.461SS..Hα-helixtrans-70.6-36.9177.4-144.870.4-15700111.5K366 R367 I368 R373 Q374 R394K366-E370 WeakPolarHBondContact O-CB 3.44Å; K366-E370 PolarHBondContact O-N 2.74Å; K366-E370 VanDerWaalsContact O-N 3.08Å; R367-E370 PolarHBondContact O-N 2.97Å; I368-E370 VanDerWaalsContact C-N 3.31Å; I368-E370 PolarHBondContact O-N 2.81Å; E370-R373 IonicContact OE1-CZ 3.52Å; E370-R373 IonicContact OE1-NH1 3.99Å; E370-R373 PolarHBondContact OE1-NH1 3.49Å; E370-Q374 WeakPolarHBondContact O-CG 3.37Å; E370-Q374 PolarHBondContact O-N 3.1Å; E370-R394 VanDerWaalsContact CD-NH1 3.31Å; E370-R394 IonicContact OE1-CZ 2.74Å; E370-R394 IonicContact OE1-NH1 3.74Å; E370-R394 PolarHBondContact OE1-NH1 3.25Å; E370-R394 IonicContact OE2-CZ 3.63Å; E370-R394 IonicContact OE2-NH1 3.55Å; E370-R394 PolarHBondContact OE2-NH1 3.49Å
371E78.3Confident74.9Confident100 Ų10094.4 Ų94.447%0.46743%0.432SS..Hα-helixtrans-60-50.7171.6-73.4167-161.800111.6R367 I368 Q374 H375R367-E371 IonicContact CZ-OE1 2.68Å; R367-E371 IonicContact NE-OE1 3.46Å; R367-E371 PolarHBondContact NE-OE1 3.08Å; R367-E371 IonicContact NH2-OE1 3.32Å; R367-E371 WeakPolarHBondContact O-CB 3.44Å; R367-E371 VanDerWaalsContact O-CG 3.25Å; R367-E371 WeakPolarHBondContact O-CG 3.46Å; R367-E371 PolarHBondContact O-N 2.99Å; I368-E371 WeakPolarHBondContact O-CB 3.46Å; I368-E371 PolarHBondContact O-N 3.42Å; E371-Q374 PolarHBondContact O-N 3.3Å; E371-H375 PolarHBondContact O-N 3.39Å
372E77.2Confident74.1Confident104 Ų10489.8 Ų89.849%0.48642%0.42SS..Hα-helixtrans-65.7-39.4177.1-83.6-66.3158.400112.5I368 Q374 H375 L376I368-E372 WeakPolarHBondContact O-CB 3.49Å; I368-E372 PolarHBondContact O-N 3.41Å; E372-Q374 VanDerWaalsContact C-N 3.32Å; E372-Q374 PolarHBondContact O-N 3.46Å; E372-H375 CarbonylContact O-C 3.59Å; E372-H375 WeakPolarHBondContact O-CA 3.4Å; E372-H375 WeakPolarHBondContact O-CB 3.37Å; E372-H375 PolarHBondContact O-N 2.84Å; E372-L376 PolarHBondContact O-N 3.36Å
373R80.4Confident73.2Confident43 Ų4393.3 Ų93.316%0.16244%0.439CS..Hα-helixtrans-59.8-45.4175.7176.7-179.7166.6-93.7-23.4110.6V369 E370 H375 L377 I392 E398V369-R373 WeakPolarHBondContact O-CB 3.24Å; V369-R373 PolarHBondContact O-N 2.8Å; E370-R373 IonicContact OE1-CZ 3.52Å; E370-R373 IonicContact OE1-NH1 3.99Å; E370-R373 PolarHBondContact OE1-NH1 3.49Å; R373-H375 VanDerWaalsContact C-N 3.28Å; R373-H375 PolarHBondContact O-N 3.23Å; R373-L377 HydrophobicContact CG-CD1 4.18Å; R373-L377 WeakPolarHBondContact O-CB 3.46Å; R373-L377 VanDerWaalsContact O-CG 3.24Å; R373-L377 WeakPolarHBondContact O-CG 3.07Å; R373-L377 PolarHBondContact O-N 2.9Å; R373-L377 VanDerWaalsContact O-N 3.12Å; R373-I392 PolarHBondContact NH2-O 3.13Å; R373-E398 IonicContact CZ-OE1 3.9Å; R373-E398 VanDerWaalsContact CZ-OE1 3.29Å; R373-E398 IonicContact CZ-OE2 3.29Å; R373-E398 IonicContact NH1-OE1 2.68Å; R373-E398 PolarHBondContact NH1-OE1 3.42Å; R373-E398 IonicContact NH1-OE2 3.25Å; R373-E398 PolarHBondContact NH1-OE2 2.98Å; R373-E398 VanDerWaalsContact NH2-CD 3.31Å; R373-E398 IonicContact NH2-OE1 2.81Å; R373-E398 PolarHBondContact NH2-OE1 3.26Å; R373-E398 IonicContact NH2-OE2 3.71Å; R373-E398 PolarHBondContact NH2-OE2 3.29Å
374Q69.5Low72.3Confident79 Ų7991.4 Ų91.437%0.36943%0.429SS..Hα-helixtrans-64.6-34.9174.3-72-177.44.800111.7E370 E371 E372 R378E370-Q374 WeakPolarHBondContact O-CG 3.37Å; E370-Q374 PolarHBondContact O-N 3.1Å; E371-Q374 PolarHBondContact O-N 3.3Å; E372-Q374 VanDerWaalsContact C-N 3.32Å; E372-Q374 PolarHBondContact O-N 3.46Å; Q374-R378 WeakPolarHBondContact O-CG 3.44Å; Q374-R378 PolarHBondContact O-N 3.25Å; Q374-R378 VanDerWaalsContact O-N 3.11Å
375H76.9Confident71.6Confident89 Ų8989.1 Ų89.141%0.41242%0.416SS..Hα-helixtrans-64.1-50.8176-168-7000113E371 E372 R373 L377 R378 Q379E371-H375 PolarHBondContact O-N 3.39Å; E372-H375 CarbonylContact O-C 3.59Å; E372-H375 WeakPolarHBondContact O-CA 3.4Å; E372-H375 WeakPolarHBondContact O-CB 3.37Å; E372-H375 PolarHBondContact O-N 2.84Å; R373-H375 VanDerWaalsContact C-N 3.28Å; R373-H375 PolarHBondContact O-N 3.23Å; H375-L377 VanDerWaalsContact C-N 3.28Å; H375-L377 PolarHBondContact O-N 3.32Å; H375-R378 WeakPolarHBondContact O-CB 3.34Å; H375-R378 PolarHBondContact O-N 2.7Å; H375-R378 VanDerWaalsContact O-N 3.13Å; H375-Q379 PolarHBondContact CE1-NE2 3.36Å; H375-Q379 PolarHBondContact O-N 3.43Å; H375-Q379 VanDerWaalsContact O-N 3.12Å
376L73.7Confident71Confident89 Ų8990.8 Ų90.847%0.46643%0.429SS..Hα-helixtrans-60.2-39.6178.2-87.4162.7000111.8E372 R378 Q379 H380E372-L376 PolarHBondContact O-N 3.36Å; L376-R378 VanDerWaalsContact C-N 3.34Å; L376-R378 PolarHBondContact O-N 3.12Å; L376-Q379 PolarHBondContact O-N 3.1Å; L376-H380 PolarHBondContact O-CD2 2.68Å; L376-H380 PolarHBondContact O-N 2.8Å
377L72.4Confident70.3Confident16 Ų1691.8 Ų91.88%0.08444%0.435CS..Hα-helixtrans-64.4-39.2176.3-71.5171.2000111.7R373 H375 Q379 A381 I392 F393 L402R373-L377 HydrophobicContact CG-CD1 4.18Å; R373-L377 WeakPolarHBondContact O-CB 3.46Å; R373-L377 VanDerWaalsContact O-CG 3.24Å; R373-L377 WeakPolarHBondContact O-CG 3.07Å; R373-L377 PolarHBondContact O-N 2.9Å; R373-L377 VanDerWaalsContact O-N 3.12Å; H375-L377 VanDerWaalsContact C-N 3.28Å; H375-L377 PolarHBondContact O-N 3.32Å; L377-Q379 PolarHBondContact O-N 2.82Å; L377-A381 WeakPolarHBondContact O-CB 3.31Å; L377-A381 PolarHBondContact O-N 3.47Å; L377-I392 HydrophobicContact CD2-CG2 3.28Å; L377-I392 HydrophobicContact CG-CG2 4.48Å; L377-F393 HydrophobicContact CD1-CD1 4.31Å; L377-F393 HydrophobicContact CD1-CE1 4.31Å; L377-F393 HydrophobicContact CD2-CE1 4.09Å; L377-L402 HydrophobicContact CB-CD1 3.61Å
378R69.1Low69.6Low158 Ų15887 Ų8760%0.59642%0.421SS*.Hα-helixtrans-63.1-38.3173.8-72.3174.3-170.8174.56.4113.5Q374 H375 L376 L402Q374-R378 WeakPolarHBondContact O-CG 3.44Å; Q374-R378 PolarHBondContact O-N 3.25Å; Q374-R378 VanDerWaalsContact O-N 3.11Å; H375-R378 WeakPolarHBondContact O-CB 3.34Å; H375-R378 PolarHBondContact O-N 2.7Å; H375-R378 VanDerWaalsContact O-N 3.13Å; L376-R378 VanDerWaalsContact C-N 3.34Å; L376-R378 PolarHBondContact O-N 3.12Å; R378-L402 VanDerWaalsContact CA-CD2 3.46Å; R378-L402 HydrophobicContact CB-CD2 4.1Å; R378-L402 HydrophobicContact CG-CD2 3.6Å
379Q72.4Confident69.2Low109 Ų10987.2 Ų87.251%0.50943%0.428SS..Hα-helixtrans-75.8-41.4-177.2-73.9-178-1800113.4H375 L376 L377H375-Q379 PolarHBondContact CE1-NE2 3.36Å; H375-Q379 PolarHBondContact O-N 3.43Å; H375-Q379 VanDerWaalsContact O-N 3.12Å; L376-Q379 PolarHBondContact O-N 3.1Å; L377-Q379 PolarHBondContact O-N 2.82Å
380H66.2Low68.4Low89 Ų8993.5 Ų93.541%0.41245%0.448SS..Hα-helixtrans-101.3-21.2-169.7-66-63.5000114.3L376 N382 N383 L384L376-H380 PolarHBondContact O-CD2 2.68Å; L376-H380 PolarHBondContact O-N 2.8Å; H380-N382 PolarHBondContact O-N 3.05Å; H380-N382 VanDerWaalsContact O-N 3.15Å; H380-N383 PolarHBondContact O-N 3.02Å; H380-L384 HydrophobicContact CB-CD1 4.18Å; H380-L384 PolarHBondContact O-N 3.12Å; H380-L384 VanDerWaalsContact O-N 3.08Å
381A60.8Low68Low2 Ų294 Ų942%0.01747%0.469CS..Hα-helixtrans-56.5-36.4-17800000111.1L377 N383 W385 L402L377-A381 WeakPolarHBondContact O-CB 3.31Å; L377-A381 PolarHBondContact O-N 3.47Å; A381-N383 PolarHBondContact O-N 2.81Å; A381-W385 HydrophobicContact CB-CE3 3.94Å; A381-W385 HydrophobicContact CB-CZ3 3.74Å; A381-W385 VanDerWaalsContact O-CE3 3.3Å; A381-W385 PolarHBondContact O-N 3.2Å; A381-L402 HydrophobicContact CB-CD2 4.42Å
382N61.3Low67.6Low64 Ų6491.7 Ų91.734%0.34246%0.46SS..Hα-helixtrans-63.9-38178.6-75.48.9000114.2H380 F405 T406H380-N382 PolarHBondContact O-N 3.05Å; H380-N382 VanDerWaalsContact O-N 3.15Å; N382-F405 PolarHBondContact ND2-O 3.29Å; N382-F405 VanDerWaalsContact OD1-CB 3.23Å; N382-F405 WeakPolarHBondContact OD1-CB 3.23Å; N382-F405 PolarHBondContact OD1-O 2.98Å; N382-T406 HydrophobicContact CB-CG2 4.34Å; N382-T406 WeakPolarHBondContact OD1-CG2 3.36Å
383N62.2Low67.1Low142 Ų14288.6 Ų88.676%0.75945%0.445SS*.Hα-helixtrans-91.2-13.8-175.3-72.1-12.2000113.6H380 A381H380-N383 PolarHBondContact O-N 3.02Å; A381-N383 PolarHBondContact O-N 2.81Å
384L60Low66.7Low82 Ų8295 Ų9543%0.42947%0.469SS..Hα-helixtrans-12313.2-174.4-78.4136000113.9H380 N386 H387 L388H380-L384 HydrophobicContact CB-CD1 4.18Å; H380-L384 PolarHBondContact O-N 3.12Å; H380-L384 VanDerWaalsContact O-N 3.08Å; L384-N386 VanDerWaalsContact C-N 3.28Å; L384-N386 PolarHBondContact O-N 2.99Å; L384-N386 VanDerWaalsContact O-N 3.11Å; L384-H387 CarbonylContact O-C 3.5Å; L384-H387 PolarHBondContact O-N 3.46Å; L384-L388 HydrophobicContact CB-CD1 3.83Å; L384-L388 HydrophobicContact CB-CG 3.96Å; L384-L388 WeakPolarHBondContact O-CD1 3.36Å; L384-L388 VanDerWaalsContact O-CG 3.29Å; L384-L388 WeakPolarHBondContact O-CG 3.34Å; L384-L388 PolarHBondContact O-N 3.19Å
385W61.7Low66.7Low62 Ų6293.6 Ų93.624%0.23547%0.468CS..THydrogen-bonded Turntrans-51.6-39.7-172.2-155-88.6000114.4A381 F393 Y399 L402 K403 T406A381-W385 HydrophobicContact CB-CE3 3.94Å; A381-W385 HydrophobicContact CB-CZ3 3.74Å; A381-W385 VanDerWaalsContact O-CE3 3.3Å; A381-W385 PolarHBondContact O-N 3.2Å; W385-F393 HydrophobicContact CH2-CZ 4.36Å; W385-Y399 HydrophobicContact CZ2-CE2 4.33Å; W385-L402 HydrophobicContact CH2-CB 4.36Å; W385-L402 HydrophobicContact CZ3-CB 4.23Å; W385-L402 WeakPolarHBondContact CZ3-O 2.96Å; W385-K403 HydrophobicContact CH2-CB 3.63Å; W385-K403 HydrophobicContact CH2-CG 4.19Å; W385-K403 VanDerWaalsContact CH2-N 3.28Å; W385-K403 HydrophobicContact CZ2-CB 3.59Å; W385-K403 HydrophobicContact CZ2-CD 4.34Å; W385-K403 HydrophobicContact CZ2-CG 3.64Å; W385-T406 HydrophobicContact CB-CG2 4.4Å; W385-T406 HydrophobicContact CD2-CG2 3.96Å; W385-T406 HydrophobicContact CE3-CG2 3.61Å; W385-T406 HydrophobicContact CG-CG2 4.27Å; W385-T406 HydrophobicContact CZ3-CG2 4.36Å
386N63.3Low66.2Low149 Ų14997.5 Ų97.580%0.79748%0.484SS*.THydrogen-bonded Turntrans-83.4-8.5-178.9-67.3-19.4000114L384L384-N386 VanDerWaalsContact C-N 3.28Å; L384-N386 PolarHBondContact O-N 2.99Å; L384-N386 VanDerWaalsContact O-N 3.11Å
387H62.9Low65.9Low157 Ų157100.2 Ų100.273%0.72749%0.494SS*.THydrogen-bonded Turntrans-125.29.7-175.9-64.911.2000112.6L384 P389L384-H387 CarbonylContact O-C 3.5Å; L384-H387 PolarHBondContact O-N 3.46Å; H387-P389 WeakPolarHBondContact O-CD 3.48Å
388L61.8Low65.5Low55 Ų55100.4 Ų100.429%0.28849%0.494SS..PPolyproline II helixtrans-80.3123.4178.1-85.5146.4000111.2L384 I392L384-L388 HydrophobicContact CB-CD1 3.83Å; L384-L388 HydrophobicContact CB-CG 3.96Å; L384-L388 WeakPolarHBondContact O-CD1 3.36Å; L384-L388 VanDerWaalsContact O-CG 3.29Å; L384-L388 WeakPolarHBondContact O-CG 3.34Å; L384-L388 PolarHBondContact O-N 3.19Å; L388-I392 HydrophobicContact CB-CD1 4.04Å; L388-I392 HydrophobicContact CD2-CD1 3.29Å; L388-I392 HydrophobicContact CG-CD1 4.26Å
389P68.3Low65.3Low95 Ų9597.7 Ų97.762%0.61749%0.485SS*.PPolyproline II helixtrans-60.8151.4177.54.9-12.7000113.9H387 G391 I392H387-P389 WeakPolarHBondContact O-CD 3.48Å; P389-G391 PolarHBondContact O-N 3.24Å; P389-I392 HydrophobicContact CB-CD1 4.44Å; P389-I392 HydrophobicContact CG-CD1 3.87Å; P389-I392 VanDerWaalsContact O-CD1 3.31Å; P389-I392 WeakPolarHBondContact O-CD1 3.37Å; P389-I392 WeakPolarHBondContact O-CG1 3.44Å
390K61.4Low65.1Low221 Ų22198.1 Ų98.196%0.96149%0.487SS*.THydrogen-bonded Turntrans-63.4128.7175-77.3178.9176.1-178.80110.4
391G67.7Low65.1Low70 Ų7097.6 Ų97.672%0.72249%0.493SS*.THydrogen-bonded Turntrans113.34.1171.300000116.8P389 F393P389-G391 PolarHBondContact O-N 3.24Å; G391-F393 VanDerWaalsContact C-N 3.32Å; G391-F393 PolarHBondContact O-N 3.11Å
392I70Confident65.2Low51 Ų5198 Ų9826%0.26250%0.495SS..  trans-74.3-25.9-176.5-59.2171.2000112.3R373 L377 L388 P389R373-I392 PolarHBondContact NH2-O 3.13Å; L377-I392 HydrophobicContact CD2-CG2 3.28Å; L377-I392 HydrophobicContact CG-CG2 4.48Å; L388-I392 HydrophobicContact CB-CD1 4.04Å; L388-I392 HydrophobicContact CD2-CD1 3.29Å; L388-I392 HydrophobicContact CG-CD1 4.26Å; P389-I392 HydrophobicContact CB-CD1 4.44Å; P389-I392 HydrophobicContact CG-CD1 3.87Å; P389-I392 VanDerWaalsContact O-CD1 3.31Å; P389-I392 WeakPolarHBondContact O-CD1 3.37Å; P389-I392 WeakPolarHBondContact O-CG1 3.44Å
393F66.4Low65.1Low39 Ų3999.9 Ų99.917%0.17150%0.5CS..  trans-90.6122171.1-55.1-68000108.9L377 W385 G391 E398 Y399 L402L377-F393 HydrophobicContact CD1-CD1 4.31Å; L377-F393 HydrophobicContact CD1-CE1 4.31Å; L377-F393 HydrophobicContact CD2-CE1 4.09Å; W385-F393 HydrophobicContact CH2-CZ 4.36Å; G391-F393 VanDerWaalsContact C-N 3.32Å; G391-F393 PolarHBondContact O-N 3.11Å; F393-E398 HydrophobicContact CB-CB 4.15Å; F393-E398 HydrophobicContact CD1-CB 4.17Å; F393-E398 HydrophobicContact CD1-CG 4.44Å; F393-Y399 AromaticContact CD2-CD2 3.47Å; F393-Y399 HydrophobicContact CD2-CD2 3.47Å; F393-Y399 VanDerWaalsContact CD2-CD2 3.47Å; F393-Y399 HydrophobicContact CD2-CE2 4.37Å; F393-Y399 HydrophobicContact CD2-CG 4.29Å; F393-Y399 AromaticContact CE2-CD2 3.74Å; F393-Y399 HydrophobicContact CE2-CD2 3.74Å; F393-Y399 HydrophobicContact CE2-CE2 4.35Å; F393-Y399 HydrophobicContact CG-CD2 4.22Å; F393-L402 HydrophobicContact CD1-CD1 4.1Å; F393-L402 HydrophobicContact CE1-CB 4.12Å; F393-L402 HydrophobicContact CE1-CD1 3.42Å; F393-L402 VanDerWaalsContact CE1-CD1 3.42Å; F393-L402 HydrophobicContact CE1-CG 4.4Å; F393-L402 HydrophobicContact CZ-CB 4.38Å; F393-L402 HydrophobicContact CZ-CD1 4.35Å
394R72.1Confident64.7Low176 Ų176100.9 Ų100.966%0.66450%0.5SS*.SBendtrans-81-27.8-177.1-82.3-175.6-177.1173.3-3.3112.3E370 E398E370-R394 VanDerWaalsContact CD-NH1 3.31Å; E370-R394 IonicContact OE1-CZ 2.74Å; E370-R394 IonicContact OE1-NH1 3.74Å; E370-R394 PolarHBondContact OE1-NH1 3.25Å; E370-R394 IonicContact OE2-CZ 3.63Å; E370-R394 IonicContact OE2-NH1 3.55Å; E370-R394 PolarHBondContact OE2-NH1 3.49Å; R394-E398 PolarHBondContact N-OE2 3.22Å
395S69.3Low64.2Low51 Ų51103.2 Ų103.236%0.35751%0.507SS..SBendtrans-123.4152.8175.1177.10000110.1E397 E398 Y399S395-E397 PolarHBondContact O-N 3.02Å; S395-E397 PolarHBondContact OG-N 3.39Å; S395-E397 PolarHBondContact OG-OE2 3.05Å; S395-E398 WeakPolarHBondContact O-CB 3.21Å; S395-E398 PolarHBondContact O-N 3.26Å; S395-E398 VanDerWaalsContact O-N 3.1Å; S395-Y399 PolarHBondContact O-N 3.15Å
396K66.5Low63.1Low171 Ų171102.5 Ų102.574%0.74351%0.51SS*.Hα-helixtrans-56.4-32.8170.6-121.4178.1179.1-176.60111.4E398 Y399 E400K396-E398 VanDerWaalsContact C-N 3.33Å; K396-E398 PolarHBondContact O-N 3.3Å; K396-Y399 PolarHBondContact O-N 3.4Å; K396-E400 PolarHBondContact O-N 2.83Å; K396-E400 VanDerWaalsContact O-N 3.1Å
397E67.6Low61.7Low145 Ų145101.3 Ų101.368%0.67851%0.511SS*.Hα-helixtrans-64.7-34.3177.3-64.1167.3161.900112.7S395 S401S395-E397 PolarHBondContact O-N 3.02Å; S395-E397 PolarHBondContact OG-N 3.39Å; S395-E397 PolarHBondContact OG-OE2 3.05Å; E397-S401 WeakPolarHBondContact O-CB 3.29Å; E397-S401 PolarHBondContact O-N 2.9Å; E397-S401 VanDerWaalsContact O-N 3.12Å; E397-S401 PolarHBondContact O-OG 3.11Å
398E64.2Low60.4Low21 Ų21102.3 Ų102.310%0.09852%0.516CS..Hα-helixtrans-73.4-34.9177.9-132.6177.7-165.200111.6R373 F393 R394 S395 K396R373-E398 IonicContact CZ-OE1 3.9Å; R373-E398 VanDerWaalsContact CZ-OE1 3.29Å; R373-E398 IonicContact CZ-OE2 3.29Å; R373-E398 IonicContact NH1-OE1 2.68Å; R373-E398 PolarHBondContact NH1-OE1 3.42Å; R373-E398 IonicContact NH1-OE2 3.25Å; R373-E398 PolarHBondContact NH1-OE2 2.98Å; R373-E398 VanDerWaalsContact NH2-CD 3.31Å; R373-E398 IonicContact NH2-OE1 2.81Å; R373-E398 PolarHBondContact NH2-OE1 3.26Å; R373-E398 IonicContact NH2-OE2 3.71Å; R373-E398 PolarHBondContact NH2-OE2 3.29Å; F393-E398 HydrophobicContact CB-CB 4.15Å; F393-E398 HydrophobicContact CD1-CB 4.17Å; F393-E398 HydrophobicContact CD1-CG 4.44Å; R394-E398 PolarHBondContact N-OE2 3.22Å; S395-E398 WeakPolarHBondContact O-CB 3.21Å; S395-E398 PolarHBondContact O-N 3.26Å; S395-E398 VanDerWaalsContact O-N 3.1Å; K396-E398 VanDerWaalsContact C-N 3.33Å; K396-E398 PolarHBondContact O-N 3.3Å
399Y66.3Low59Low100 Ų100111.3 Ų111.339%0.39257%0.565SS.*Hα-helixtrans-68.8-42.9175.6179.4-101.3000111.9W385 F393 S395 K396 K403W385-Y399 HydrophobicContact CZ2-CE2 4.33Å; F393-Y399 AromaticContact CD2-CD2 3.47Å; F393-Y399 HydrophobicContact CD2-CD2 3.47Å; F393-Y399 VanDerWaalsContact CD2-CD2 3.47Å; F393-Y399 HydrophobicContact CD2-CE2 4.37Å; F393-Y399 HydrophobicContact CD2-CG 4.29Å; F393-Y399 AromaticContact CE2-CD2 3.74Å; F393-Y399 HydrophobicContact CE2-CD2 3.74Å; F393-Y399 HydrophobicContact CE2-CE2 4.35Å; F393-Y399 HydrophobicContact CG-CD2 4.22Å; S395-Y399 PolarHBondContact O-N 3.15Å; K396-Y399 PolarHBondContact O-N 3.4Å; Y399-K403 HydrophobicContact CE1-CD 4.09Å; Y399-K403 WeakPolarHBondContact O-CB 3.35Å; Y399-K403 PolarHBondContact O-N 3.41Å
400E67.4Low58.5Low118 Ų118112.2 Ų112.255%0.55156%0.562SS**Hα-helixtrans-68.1-42.3179.2-71.8-178.6-178.800111.7K396 L402 K403 H404K396-E400 PolarHBondContact O-N 2.83Å; K396-E400 VanDerWaalsContact O-N 3.1Å; E400-L402 PolarHBondContact O-N 3.05Å; E400-K403 PolarHBondContact O-N 3.08Å; E400-H404 PolarHBondContact O-CD2 3.05Å
401S66.7Low58.4Low78 Ų78106.4 Ų106.455%0.54554%0.541SS..Hα-helixtrans-61.9-27.4-178-60.30000114.3E397E397-S401 WeakPolarHBondContact O-CB 3.29Å; E397-S401 PolarHBondContact O-N 2.9Å; E397-S401 VanDerWaalsContact O-N 3.12Å; E397-S401 PolarHBondContact O-OG 3.11Å
402L62.1Low57.9Low10 Ų10108.4 Ų108.45%0.05253%0.531CS..Hα-helixtrans-102-24-175.8-77.5160.7000113.8L377 R378 A381 W385 F393 E400 H404 F405L377-L402 HydrophobicContact CB-CD1 3.61Å; R378-L402 VanDerWaalsContact CA-CD2 3.46Å; R378-L402 HydrophobicContact CB-CD2 4.1Å; R378-L402 HydrophobicContact CG-CD2 3.6Å; A381-L402 HydrophobicContact CB-CD2 4.42Å; W385-L402 HydrophobicContact CH2-CB 4.36Å; W385-L402 HydrophobicContact CZ3-CB 4.23Å; W385-L402 WeakPolarHBondContact CZ3-O 2.96Å; F393-L402 HydrophobicContact CD1-CD1 4.1Å; F393-L402 HydrophobicContact CE1-CB 4.12Å; F393-L402 HydrophobicContact CE1-CD1 3.42Å; F393-L402 VanDerWaalsContact CE1-CD1 3.42Å; F393-L402 HydrophobicContact CE1-CG 4.4Å; F393-L402 HydrophobicContact CZ-CB 4.38Å; F393-L402 HydrophobicContact CZ-CD1 4.35Å; E400-L402 PolarHBondContact O-N 3.05Å; L402-H404 PolarHBondContact O-N 3.18Å; L402-F405 PolarHBondContact O-N 3.48Å
403K58.6Low57.2Low105 Ų105111.8 Ų111.846%0.45755%0.547SS..Hα-helixtrans-62.5-28.7175.4-171.4174.2178.8-177.10112.3W385 Y399 E400 F405 T406W385-K403 HydrophobicContact CH2-CB 3.63Å; W385-K403 HydrophobicContact CH2-CG 4.19Å; W385-K403 VanDerWaalsContact CH2-N 3.28Å; W385-K403 HydrophobicContact CZ2-CB 3.59Å; W385-K403 HydrophobicContact CZ2-CD 4.34Å; W385-K403 HydrophobicContact CZ2-CG 3.64Å; Y399-K403 HydrophobicContact CE1-CD 4.09Å; Y399-K403 WeakPolarHBondContact O-CB 3.35Å; Y399-K403 PolarHBondContact O-N 3.41Å; E400-K403 PolarHBondContact O-N 3.08Å; K403-F405 PolarHBondContact O-N 3.12Å; K403-T406 PolarHBondContact O-OG1 3.09Å
404H53.8Low56.6Low163 Ų163116.4 Ų116.476%0.75557%0.571SS**THydrogen-bonded Turntrans-73.3-7.3179.8-76.1-63.9000115E400 L402E400-H404 PolarHBondContact O-CD2 3.05Å; L402-H404 PolarHBondContact O-N 3.18Å
405F50.1Low55.5Low130 Ų130112.4 Ų112.457%0.5756%0.564SS**THydrogen-bonded Turntrans-90.33.5176.9-81.5-81.2000114.7N382 L402 K403N382-F405 PolarHBondContact ND2-O 3.29Å; N382-F405 VanDerWaalsContact OD1-CB 3.23Å; N382-F405 WeakPolarHBondContact OD1-CB 3.23Å; N382-F405 PolarHBondContact OD1-O 2.98Å; L402-F405 PolarHBondContact O-N 3.48Å; K403-F405 PolarHBondContact O-N 3.12Å
406T38.3Very low54.6Low48 Ų48116.8 Ų116.829%0.29458%0.579SS.*SBendtrans-111.917-170.8530000117.6N382 W385 K403N382-T406 HydrophobicContact CB-CG2 4.34Å; N382-T406 WeakPolarHBondContact OD1-CG2 3.36Å; W385-T406 HydrophobicContact CB-CG2 4.4Å; W385-T406 HydrophobicContact CD2-CG2 3.96Å; W385-T406 HydrophobicContact CE3-CG2 3.61Å; W385-T406 HydrophobicContact CG-CG2 4.27Å; W385-T406 HydrophobicContact CZ3-CG2 4.36Å; K403-T406 PolarHBondContact O-OG1 3.09Å
407C34.7Very low53.6Low123 Ų123112.6 Ų112.683%0.83157%0.567SS**SBendtrans-130.920.1177.2-75.80000115.1
408E35.2Very low52.5Low179 Ų179109.9 Ų109.984%0.83656%0.557SS**  trans-139.3102.6170.7-67.9-17616800109.7
409N32.3Very low51.4Low244 Ų244118 Ų118100%1.30560%0.599SS**  trans55.10162.4-65.2-29.8000121.9

Retrieved 409 of 409 residues in 254.1 ms (Link to these results)

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