X2JHR5_DROME Loading...

Ska2 N-terminal domain-containing protein

AlphaFold DB (Q8MYW2), UniProt , Accession X2JHR5, Species DROME (Drosophila melanogaster, Fruit fly), Gene EG:171D11.5, Length 127 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
1M46.7Very low67.2Low245 Ų245117.9 Ų117.9100%1.20764%0.64SS**  092.60-78.5175.7173.500106.4A3M1-A3 PolarHBondContact O-N 2.96Å
2E45.9Very low69.3Low195 Ų195112.8 Ų112.891%0.91163%0.625SS**  trans-71.5106.3177.6-70.3-176.5161.300108T4E2-T4 PolarHBondContact O-N 3.42Å
3A55.6Low71.2Confident72 Ų72112.4 Ų112.460%0.59562%0.62SS**  trans-64.4116.5168.100000107.2M1M1-A3 PolarHBondContact O-N 2.96Å
4T54.4Low72.9Confident88 Ų88113.1 Ų113.154%0.5462%0.617SS.*  trans-61128.1-179.944.70000109.3E2 G6 Y7E2-T4 PolarHBondContact O-N 3.42Å; T4-G6 PolarHBondContact O-N 3.38Å; T4-Y7 PolarHBondContact O-N 3.37Å
5P64.2Low74.3Confident106 Ų106116.1 Ų116.169%0.68862%0.622SS**Hα-helixtrans-57.7-26-175.417.4-29.1000113.2Y7 Q8 D9P5-Y7 VanDerWaalsContact C-N 3.33Å; P5-Y7 PolarHBondContact O-N 2.9Å; P5-Q8 PolarHBondContact O-N 3.33Å; P5-D9 PolarHBondContact O-N 3.01Å
6G67.1Low75.7Confident42 Ų42113.3 Ų113.343%0.43361%0.614SS.*Hα-helixtrans-64.7-28.8174.600000114.9T4 I10T4-G6 PolarHBondContact O-N 3.38Å; G6-I10 WeakPolarHBondContact O-CD1 3.44Å; G6-I10 VanDerWaalsContact O-CG1 3.24Å; G6-I10 WeakPolarHBondContact O-CG1 3.33Å; G6-I10 PolarHBondContact O-N 3.04Å
7Y70.2Confident77Confident164 Ų164112.1 Ų112.164%0.64361%0.611SS**Hα-helixtrans-76.3-34.8-180-134.7-91.6000112T4 P5 S11T4-Y7 PolarHBondContact O-N 3.37Å; P5-Y7 VanDerWaalsContact C-N 3.33Å; P5-Y7 PolarHBondContact O-N 2.9Å; Y7-S11 PolarHBondContact O-N 3.32Å; Y7-S11 PolarHBondContact O-OG 2.94Å
8Q72.9Confident78Confident134 Ų134109.6 Ų109.663%0.62661%0.608SS**Hα-helixtrans-66.5-38.3176-72-177.2-26.100111.9P5 S11 A12P5-Q8 PolarHBondContact O-N 3.33Å; Q8-S11 PolarHBondContact O-N 3.48Å; Q8-A12 PolarHBondContact O-N 3.28Å
9D81.6Confident79Confident121 Ų121108.5 Ų108.565%0.64760%0.601SS**Hα-helixtrans-66.6-43.3177.4-163.319.2000111.6P5 S11 A12 L13P5-D9 PolarHBondContact O-N 3.01Å; D9-S11 PolarHBondContact O-N 2.97Å; D9-A12 PolarHBondContact O-N 3.28Å; D9-L13 PolarHBondContact O-N 3.3Å
10I91.5Very high79.9Confident87 Ų87105.3 Ų105.345%0.44659%0.589SS.*Hα-helixtrans-59.7-46.8174.1-67164.2000111G6 A12 L13 E14G6-I10 WeakPolarHBondContact O-CD1 3.44Å; G6-I10 VanDerWaalsContact O-CG1 3.24Å; G6-I10 WeakPolarHBondContact O-CG1 3.33Å; G6-I10 PolarHBondContact O-N 3.04Å; I10-A12 VanDerWaalsContact C-N 3.31Å; I10-A12 PolarHBondContact O-N 3.27Å; I10-L13 PolarHBondContact O-N 3.14Å; I10-E14 HydrophobicContact CG2-CG 4.33Å; I10-E14 WeakPolarHBondContact O-CG 3.39Å; I10-E14 PolarHBondContact O-N 2.99Å
11S89.6Confident80.8Confident43 Ų43102.1 Ų102.130%0.30158%0.58SS.*Hα-helixtrans-63.9-33.5178.5-670000113.5Y7 Q8 D9 K15Y7-S11 PolarHBondContact O-N 3.32Å; Y7-S11 PolarHBondContact O-OG 2.94Å; Q8-S11 PolarHBondContact O-N 3.48Å; D9-S11 PolarHBondContact O-N 2.97Å; S11-K15 WeakPolarHBondContact O-CG 3.39Å; S11-K15 PolarHBondContact O-N 3.5Å
12A92.3Very high83.1Confident56 Ų5693.8 Ų93.846%0.46355%0.546SS..Hα-helixtrans-69-42.317500000111.2Q8 D9 I10 K15 S16Q8-A12 PolarHBondContact O-N 3.28Å; D9-A12 PolarHBondContact O-N 3.28Å; I10-A12 VanDerWaalsContact C-N 3.31Å; I10-A12 PolarHBondContact O-N 3.27Å; A12-K15 PolarHBondContact O-N 3.44Å; A12-S16 PolarHBondContact O-N 3.22Å
13L93.6Very high85.6Confident108 Ų10889.4 Ų89.457%0.56553%0.525SS*.Hα-helixtrans-62.3-47.4175.9-177.961.7000111.8D9 I10 K15 S16 V17D9-L13 PolarHBondContact O-N 3.3Å; I10-L13 PolarHBondContact O-N 3.14Å; L13-K15 VanDerWaalsContact C-N 3.31Å; L13-K15 PolarHBondContact O-N 3.42Å; L13-S16 WeakPolarHBondContact O-CB 3.45Å; L13-S16 PolarHBondContact O-N 2.98Å; L13-S16 VanDerWaalsContact O-N 3.09Å; L13-V17 HydrophobicContact CD1-CG2 4.21Å; L13-V17 HydrophobicContact CG-CG2 4.4Å; L13-V17 WeakPolarHBondContact O-CG2 3.37Å; L13-V17 PolarHBondContact O-N 2.95Å
14E94.6Very high87.6Confident122 Ų12291.5 Ų91.557%0.5753%0.526SS*.Hα-helixtrans-56.3-43.7177.6-74.5175.1154.200112I10 V17 A18I10-E14 HydrophobicContact CG2-CG 4.33Å; I10-E14 WeakPolarHBondContact O-CG 3.39Å; I10-E14 PolarHBondContact O-N 2.99Å; E14-V17 PolarHBondContact O-N 3.34Å; E14-A18 WeakPolarHBondContact O-CB 3.42Å; E14-A18 PolarHBondContact O-N 3.04Å
15K94.9Very high89.7Confident158 Ų15894.7 Ų94.769%0.68753%0.529SS*.Hα-helixtrans-63.9-42.1175.5-72.9174.8-176.1177.90112.2S11 A12 L13 A18 N19S11-K15 WeakPolarHBondContact O-CG 3.39Å; S11-K15 PolarHBondContact O-N 3.5Å; A12-K15 PolarHBondContact O-N 3.44Å; L13-K15 VanDerWaalsContact C-N 3.31Å; L13-K15 PolarHBondContact O-N 3.42Å; K15-A18 PolarHBondContact O-N 2.91Å; K15-N19 WeakPolarHBondContact O-CB 3.49Å; K15-N19 PolarHBondContact O-N 3.36Å
16S96.2Very high91.2Very high72 Ų7292.6 Ų92.650%0.50352%0.515SS..Hα-helixtrans-64.2-43.4177.8-172.10000111.7A12 L13 N19 A20A12-S16 PolarHBondContact O-N 3.22Å; L13-S16 WeakPolarHBondContact O-CB 3.45Å; L13-S16 PolarHBondContact O-N 2.98Å; L13-S16 VanDerWaalsContact O-N 3.09Å; S16-N19 PolarHBondContact O-N 3.42Å; S16-A20 WeakPolarHBondContact O-CB 3.46Å; S16-A20 PolarHBondContact O-N 3.48Å
17V97Very high92.7Very high93 Ų9395.7 Ų95.756%0.56452%0.519SS*.Hα-helixtrans-64.4-44.5176.8172.30000111L13 E14 N19 A20 G21L13-V17 HydrophobicContact CD1-CG2 4.21Å; L13-V17 HydrophobicContact CG-CG2 4.4Å; L13-V17 WeakPolarHBondContact O-CG2 3.37Å; L13-V17 PolarHBondContact O-N 2.95Å; E14-V17 PolarHBondContact O-N 3.34Å; V17-N19 VanDerWaalsContact C-N 3.35Å; V17-N19 PolarHBondContact O-N 3.05Å; V17-A20 PolarHBondContact O-N 2.89Å; V17-G21 PolarHBondContact O-N 2.85Å
18A96.1Very high94Very high66 Ų6690.6 Ų90.655%0.54551%0.511SS..Hα-helixtrans-61.3-42.217600000112.2E14 K15 G21 S22E14-A18 WeakPolarHBondContact O-CB 3.42Å; E14-A18 PolarHBondContact O-N 3.04Å; K15-A18 PolarHBondContact O-N 2.91Å; A18-G21 PolarHBondContact O-N 2.93Å; A18-S22 PolarHBondContact O-N 3.31Å
19N97Very high95.1Very high90 Ų9089 Ų8948%0.48150%0.503SS..Hα-helixtrans-63-46174.9-17835.6000111.8K15 S16 V17 G21 S22 Q23K15-N19 WeakPolarHBondContact O-CB 3.49Å; K15-N19 PolarHBondContact O-N 3.36Å; S16-N19 PolarHBondContact O-N 3.42Å; V17-N19 VanDerWaalsContact C-N 3.35Å; V17-N19 PolarHBondContact O-N 3.05Å; N19-G21 VanDerWaalsContact C-N 3.32Å; N19-G21 PolarHBondContact O-N 2.95Å; N19-S22 PolarHBondContact O-N 2.87Å; N19-Q23 PolarHBondContact ND2-NE2 3.3Å; N19-Q23 VanDerWaalsContact ND2-NE2 3.16Å; N19-Q23 WeakPolarHBondContact O-CG 3.41Å; N19-Q23 PolarHBondContact O-N 3.42Å; N19-Q23 PolarHBondContact OD1-NE2 3.18Å; N19-Q23 VanDerWaalsContact OD1-NE2 3.15Å
20A97.6Very high95.8Very high44 Ų4490 Ų9036%0.36450%0.502SS..Hα-helixtrans-59.9-41.8175.600000111.8S16 V17 S22 Q23 L24S16-A20 WeakPolarHBondContact O-CB 3.46Å; S16-A20 PolarHBondContact O-N 3.48Å; V17-A20 PolarHBondContact O-N 2.89Å; A20-S22 PolarHBondContact O-N 3.35Å; A20-Q23 PolarHBondContact O-N 3.46Å; A20-L24 WeakPolarHBondContact O-CB 3.42Å; A20-L24 VanDerWaalsContact O-CG 3.31Å; A20-L24 WeakPolarHBondContact O-CG 3.39Å; A20-L24 PolarHBondContact O-N 2.85Å
21G97.2Very high96.1Very high39 Ų3990.8 Ų90.840%0.40251%0.506SS..Hα-helixtrans-59.8-43.2174.800000113V17 A18 N19 L24 Y25V17-G21 PolarHBondContact O-N 2.85Å; A18-G21 PolarHBondContact O-N 2.93Å; N19-G21 VanDerWaalsContact C-N 3.32Å; N19-G21 PolarHBondContact O-N 2.95Å; G21-L24 PolarHBondContact O-N 3.38Å; G21-Y25 WeakPolarHBondContact O-CB 3.48Å; G21-Y25 PolarHBondContact O-N 3.34Å
22S96.5Very high96.3Very high70 Ų7092.8 Ų92.849%0.4951%0.511SS..Hα-helixtrans-64.8-40.3175.8-177.30000112.5A18 N19 A20 Y25 T26A18-S22 PolarHBondContact O-N 3.31Å; N19-S22 PolarHBondContact O-N 2.87Å; A20-S22 PolarHBondContact O-N 3.35Å; S22-Y25 PolarHBondContact O-N 2.98Å; S22-T26 PolarHBondContact O-N 3.46Å; S22-T26 PolarHBondContact O-OG1 3.21Å
23Q98Very high96.4Very high103 Ų10393 Ų9348%0.48151%0.513SS..Hα-helixtrans-65.8-43.9175.7-70.5179.235.900111.8N19 A20 Y25 T26 M27N19-Q23 PolarHBondContact ND2-NE2 3.3Å; N19-Q23 VanDerWaalsContact ND2-NE2 3.16Å; N19-Q23 WeakPolarHBondContact O-CG 3.41Å; N19-Q23 PolarHBondContact O-N 3.42Å; N19-Q23 PolarHBondContact OD1-NE2 3.18Å; N19-Q23 VanDerWaalsContact OD1-NE2 3.15Å; A20-Q23 PolarHBondContact O-N 3.46Å; Q23-Y25 VanDerWaalsContact C-N 3.34Å; Q23-Y25 PolarHBondContact O-N 2.9Å; Q23-T26 WeakPolarHBondContact O-CB 3.37Å; Q23-T26 PolarHBondContact O-N 3.49Å; Q23-M27 WeakPolarHBondContact O-CG 3.5Å; Q23-M27 PolarHBondContact O-N 3.33Å
24L97.6Very high96.4Very high115 Ų11592.4 Ų92.460%0.60251%0.513SS*.Hα-helixtrans-61.6-41.8175.8-73.3173000111.7A20 G21 T26 M27 A28A20-L24 WeakPolarHBondContact O-CB 3.42Å; A20-L24 VanDerWaalsContact O-CG 3.31Å; A20-L24 WeakPolarHBondContact O-CG 3.39Å; A20-L24 PolarHBondContact O-N 2.85Å; G21-L24 PolarHBondContact O-N 3.38Å; L24-T26 VanDerWaalsContact C-N 3.33Å; L24-T26 PolarHBondContact O-N 2.88Å; L24-M27 PolarHBondContact O-N 3.35Å; L24-A28 WeakPolarHBondContact O-CB 3.38Å; L24-A28 PolarHBondContact O-N 3.3Å
25Y97.2Very high96.2Very high155 Ų15591.7 Ų91.761%0.60851%0.51SS*.Hα-helixtrans-60.8-43.9174.3-172.4-100.1000111.6G21 S22 Q23 M27 A28 H29G21-Y25 WeakPolarHBondContact O-CB 3.48Å; G21-Y25 PolarHBondContact O-N 3.34Å; S22-Y25 PolarHBondContact O-N 2.98Å; Q23-Y25 VanDerWaalsContact C-N 3.34Å; Q23-Y25 PolarHBondContact O-N 2.9Å; Y25-M27 PolarHBondContact O-N 3.38Å; Y25-A28 PolarHBondContact O-N 3.48Å; Y25-H29 AromaticContact CD1-CD2 3.6Å; Y25-H29 AromaticContact CD1-NE2 3.81Å; Y25-H29 AromaticContact CE1-CD2 3.31Å; Y25-H29 WeakPolarHBondContact CE1-CD2 3.38Å; Y25-H29 AromaticContact CE1-NE2 3.06Å; Y25-H29 WeakPolarHBondContact CE1-NE2 3.37Å; Y25-H29 AromaticContact CE2-NE2 3.67Å; Y25-H29 AromaticContact CZ-CD2 3.68Å; Y25-H29 AromaticContact CZ-NE2 2.98Å; Y25-H29 PolarHBondContact O-CD2 2.95Å; Y25-H29 PolarHBondContact O-N 2.98Å; Y25-H29 VanDerWaalsContact O-N 3.13Å; Y25-H29 PolarHBondContact OH-NE2 2.87Å
26T96.8Very high95.9Very high63 Ų6391.4 Ų91.439%0.38751%0.505SS..Hα-helixtrans-63.2-41.1175.6-56.50000111.9S22 Q23 L24 H29 K30S22-T26 PolarHBondContact O-N 3.46Å; S22-T26 PolarHBondContact O-OG1 3.21Å; Q23-T26 WeakPolarHBondContact O-CB 3.37Å; Q23-T26 PolarHBondContact O-N 3.49Å; L24-T26 VanDerWaalsContact C-N 3.33Å; L24-T26 PolarHBondContact O-N 2.88Å; T26-H29 PolarHBondContact O-N 3.22Å; T26-K30 HydrophobicContact CG2-CD 4.41Å; T26-K30 WeakPolarHBondContact O-CG 3.46Å; T26-K30 PolarHBondContact O-N 3.34Å
27M97.4Very high95.4Very high106 Ų10691.5 Ų91.552%0.52251%0.505SS..Hα-helixtrans-65.8-43.4177-74.1175.365.400111.7Q23 L24 Y25 H29 K30 L31Q23-M27 WeakPolarHBondContact O-CG 3.5Å; Q23-M27 PolarHBondContact O-N 3.33Å; L24-M27 PolarHBondContact O-N 3.35Å; Y25-M27 PolarHBondContact O-N 3.38Å; M27-H29 VanDerWaalsContact C-N 3.3Å; M27-H29 PolarHBondContact O-N 3.3Å; M27-K30 PolarHBondContact O-N 3Å; M27-L31 WeakPolarHBondContact O-CB 3.33Å; M27-L31 WeakPolarHBondContact O-CG 3.36Å; M27-L31 PolarHBondContact O-N 2.86Å
28A97.3Very high94.7Very high57 Ų5792.3 Ų92.347%0.47151%0.506SS..Hα-helixtrans-58.1-43.9176.800000111.4L24 Y25 L31 H32L24-A28 WeakPolarHBondContact O-CB 3.38Å; L24-A28 PolarHBondContact O-N 3.3Å; Y25-A28 PolarHBondContact O-N 3.48Å; A28-L31 PolarHBondContact O-N 3.4Å; A28-H32 WeakPolarHBondContact O-CB 3.43Å; A28-H32 PolarHBondContact O-N 3.23Å
29H96.4Very high93.8Very high100 Ų10095.1 Ų95.146%0.46351%0.508SS..Hα-helixtrans-63.5-42.6174.9-81.4-61.6000113.3Y25 T26 M27 H32 A33Y25-H29 AromaticContact CD1-CD2 3.6Å; Y25-H29 AromaticContact CD1-NE2 3.81Å; Y25-H29 AromaticContact CE1-CD2 3.31Å; Y25-H29 WeakPolarHBondContact CE1-CD2 3.38Å; Y25-H29 AromaticContact CE1-NE2 3.06Å; Y25-H29 WeakPolarHBondContact CE1-NE2 3.37Å; Y25-H29 AromaticContact CE2-NE2 3.67Å; Y25-H29 AromaticContact CZ-CD2 3.68Å; Y25-H29 AromaticContact CZ-NE2 2.98Å; Y25-H29 PolarHBondContact O-CD2 2.95Å; Y25-H29 PolarHBondContact O-N 2.98Å; Y25-H29 VanDerWaalsContact O-N 3.13Å; Y25-H29 PolarHBondContact OH-NE2 2.87Å; T26-H29 PolarHBondContact O-N 3.22Å; M27-H29 VanDerWaalsContact C-N 3.3Å; M27-H29 PolarHBondContact O-N 3.3Å; H29-H32 PolarHBondContact O-N 2.94Å; H29-A33 PolarHBondContact O-N 2.98Å
30K97.6Very high92.7Very high143 Ų14395.4 Ų95.462%0.62251%0.506SS*.Hα-helixtrans-66.7-41.7177.8-73.8179.5179-176.70112.2T26 M27 H32 A33 V34T26-K30 HydrophobicContact CG2-CD 4.41Å; T26-K30 WeakPolarHBondContact O-CG 3.46Å; T26-K30 PolarHBondContact O-N 3.34Å; M27-K30 PolarHBondContact O-N 3Å; K30-H32 VanDerWaalsContact C-N 3.34Å; K30-A33 PolarHBondContact O-N 3.47Å; K30-V34 WeakPolarHBondContact O-CG2 3.46Å; K30-V34 PolarHBondContact O-N 3.38Å
31L96.9Very high91.4Very high103 Ų10395.6 Ų95.654%0.53950%0.503SS..Hα-helixtrans-61.2-45.9175-74.8171.7000110.5M27 A28 A33 V34 E35M27-L31 WeakPolarHBondContact O-CB 3.33Å; M27-L31 WeakPolarHBondContact O-CG 3.36Å; M27-L31 PolarHBondContact O-N 2.86Å; A28-L31 PolarHBondContact O-N 3.4Å; L31-A33 VanDerWaalsContact C-N 3.29Å; L31-A33 PolarHBondContact O-N 2.89Å; L31-V34 PolarHBondContact O-N 3.39Å; L31-V34 VanDerWaalsContact O-N 3.07Å; L31-E35 WeakPolarHBondContact O-CG 3.38Å; L31-E35 PolarHBondContact O-N 3.13Å
32H94.4Very high90.2Very high85 Ų8597.3 Ų97.339%0.39451%0.506SS..Hα-helixtrans-60.8-38.1177.1-169.155.4000113A28 H29 K30 E35 R36A28-H32 WeakPolarHBondContact O-CB 3.43Å; A28-H32 PolarHBondContact O-N 3.23Å; H29-H32 PolarHBondContact O-N 2.94Å; K30-H32 VanDerWaalsContact C-N 3.34Å; H32-E35 IonicContact ND1-OE2 3.59Å; H32-R36 PolarHBondContact NE2-NH2 3.32Å; H32-R36 WeakPolarHBondContact O-CB 3.38Å; H32-R36 VanDerWaalsContact O-CG 3.31Å; H32-R36 WeakPolarHBondContact O-CG 3.36Å; H32-R36 PolarHBondContact O-N 2.91Å
33A94.2Very high88.9Confident62 Ų6299.9 Ų99.951%0.51251%0.511SS..Hα-helixtrans-65.9-38.7174.600000112.4H29 K30 L31 S37H29-A33 PolarHBondContact O-N 2.98Å; K30-A33 PolarHBondContact O-N 3.47Å; L31-A33 VanDerWaalsContact C-N 3.29Å; L31-A33 PolarHBondContact O-N 2.89Å; A33-S37 PolarHBondContact O-N 3.28Å
34V93.4Very high87.8Confident95 Ų95100.4 Ų100.458%0.57651%0.514SS*.Hα-helixtrans-67.9-43.7175.6171.30000111.2K30 L31 R36 S37 L38K30-V34 WeakPolarHBondContact O-CG2 3.46Å; K30-V34 PolarHBondContact O-N 3.38Å; L31-V34 PolarHBondContact O-N 3.39Å; L31-V34 VanDerWaalsContact O-N 3.07Å; V34-R36 PolarHBondContact O-N 3.36Å; V34-S37 PolarHBondContact O-N 2.9Å; V34-L38 WeakPolarHBondContact O-CB 3.35Å; V34-L38 PolarHBondContact O-N 3.18Å
35E91.5Very high86.7Confident107 Ų107100.7 Ų100.750%0.551%0.512SS..Hα-helixtrans-56.2-49.9175.4-72.8169.7166.200110.9L31 H32 S37 L38 E39L31-E35 WeakPolarHBondContact O-CG 3.38Å; L31-E35 PolarHBondContact O-N 3.13Å; H32-E35 IonicContact ND1-OE2 3.59Å; E35-S37 VanDerWaalsContact C-N 3.34Å; E35-S37 PolarHBondContact O-N 3.29Å; E35-L38 PolarHBondContact O-N 2.92Å; E35-E39 WeakPolarHBondContact O-CG 3.48Å; E35-E39 PolarHBondContact O-N 3.21Å
36R88.1Confident85.5Confident152 Ų15298.6 Ų98.657%0.57451%0.509SS*.Hα-helixtrans-58.6-42.6176.1-75.8-84.5179.290.92.6112.8H32 V34 Q40H32-R36 PolarHBondContact NE2-NH2 3.32Å; H32-R36 WeakPolarHBondContact O-CB 3.38Å; H32-R36 VanDerWaalsContact O-CG 3.31Å; H32-R36 WeakPolarHBondContact O-CG 3.36Å; H32-R36 PolarHBondContact O-N 2.91Å; V34-R36 PolarHBondContact O-N 3.36Å; R36-Q40 PolarHBondContact O-N 2.86Å; R36-Q40 VanDerWaalsContact O-N 3.17Å
37S84.5Confident84.7Confident73 Ų73100.6 Ų100.651%0.5152%0.518SS..Hα-helixtrans-67.3-40178.3-172.50000111.5A33 V34 E35 Q40 T41A33-S37 PolarHBondContact O-N 3.28Å; V34-S37 PolarHBondContact O-N 2.9Å; E35-S37 VanDerWaalsContact C-N 3.34Å; E35-S37 PolarHBondContact O-N 3.29Å; S37-Q40 PolarHBondContact O-N 2.97Å; S37-T41 WeakPolarHBondContact O-CB 3.47Å; S37-T41 PolarHBondContact O-N 2.88Å; S37-T41 PolarHBondContact O-OG1 3.24Å
38L82.2Confident84Confident111 Ų111101.7 Ų101.758%0.58152%0.521SS*.Hα-helixtrans-66-45.2179.1-173.165.7000110.6V34 E35 Q40 T41 T42V34-L38 WeakPolarHBondContact O-CB 3.35Å; V34-L38 PolarHBondContact O-N 3.18Å; E35-L38 PolarHBondContact O-N 2.92Å; L38-Q40 PolarHBondContact O-N 3.03Å; L38-T41 PolarHBondContact O-N 3.32Å; L38-T42 HydrophobicContact CD1-CG2 4.12Å; L38-T42 HydrophobicContact CG-CG2 4.23Å; L38-T42 WeakPolarHBondContact O-CB 3.22Å; L38-T42 VanDerWaalsContact O-CG2 3.27Å; L38-T42 WeakPolarHBondContact O-CG2 3.5Å; L38-T42 PolarHBondContact O-N 3.31Å; L38-T42 PolarHBondContact O-OG1 2.74Å
39E77.4Confident83.4Confident124 Ų124104 Ų10458%0.57952%0.524SS*.Hα-helixtrans-55.7-49175.2-74.2172.8178.400111.6E35 T42 M43E35-E39 WeakPolarHBondContact O-CG 3.48Å; E35-E39 PolarHBondContact O-N 3.21Å; E39-T42 PolarHBondContact O-N 3.39Å; E39-T42 PolarHBondContact O-OG1 3.37Å; E39-M43 PolarHBondContact O-N 2.9Å; E39-M43 VanDerWaalsContact O-N 3.09Å
40Q74.7Confident82.8Confident96 Ų96104.4 Ų104.445%0.44953%0.526SS..Hα-helixtrans-61.6-49178.6-170.467.228.900112R36 S37 L38 M43 E44R36-Q40 PolarHBondContact O-N 2.86Å; R36-Q40 VanDerWaalsContact O-N 3.17Å; S37-Q40 PolarHBondContact O-N 2.97Å; L38-Q40 PolarHBondContact O-N 3.03Å; Q40-M43 PolarHBondContact O-N 3.04Å; Q40-E44 PolarHBondContact NE2-OE1 3.43Å; Q40-E44 WeakPolarHBondContact O-CG 3.31Å; Q40-E44 PolarHBondContact O-N 3.02Å; Q40-E44 VanDerWaalsContact O-N 3.1Å
41T71.2Confident82.2Confident49 Ų49100.8 Ų100.830%0.30152%0.516SS..Hα-helixtrans-64.8-41.9-179-59.30000111.8S37 L38 M43 Q45S37-T41 WeakPolarHBondContact O-CB 3.47Å; S37-T41 PolarHBondContact O-N 2.88Å; S37-T41 PolarHBondContact O-OG1 3.24Å; L38-T41 PolarHBondContact O-N 3.32Å; T41-M43 PolarHBondContact O-N 3.44Å; T41-Q45 VanDerWaalsContact CG2-CD 3.41Å; T41-Q45 HydrophobicContact CG2-CG 4.07Å; T41-Q45 VanDerWaalsContact CG2-NE2 3.31Å; T41-Q45 WeakPolarHBondContact O-CB 3.5Å; T41-Q45 VanDerWaalsContact O-CG 3.22Å; T41-Q45 WeakPolarHBondContact O-CG 3.44Å; T41-Q45 PolarHBondContact O-N 3.16Å
42T71.5Confident81.9Confident75 Ų75100.3 Ų100.346%0.4651%0.513SS..Hα-helixtrans-64.6-40.1178.853.70000112.2L38 E39 M46L38-T42 HydrophobicContact CD1-CG2 4.12Å; L38-T42 HydrophobicContact CG-CG2 4.23Å; L38-T42 WeakPolarHBondContact O-CB 3.22Å; L38-T42 VanDerWaalsContact O-CG2 3.27Å; L38-T42 WeakPolarHBondContact O-CG2 3.5Å; L38-T42 PolarHBondContact O-N 3.31Å; L38-T42 PolarHBondContact O-OG1 2.74Å; E39-T42 PolarHBondContact O-N 3.39Å; E39-T42 PolarHBondContact O-OG1 3.37Å; T42-M46 WeakPolarHBondContact O-CB 3.42Å; T42-M46 PolarHBondContact O-N 2.92Å
43M68.1Low81.8Confident123 Ų123101.8 Ų101.861%0.60652%0.52SS*.Hα-helixtrans-71.4-42-179.2-162.9167.470.900112E39 Q40 T41 D47E39-M43 PolarHBondContact O-N 2.9Å; E39-M43 VanDerWaalsContact O-N 3.09Å; Q40-M43 PolarHBondContact O-N 3.04Å; T41-M43 PolarHBondContact O-N 3.44Å; M43-D47 PolarHBondContact O-N 3.03Å
44E74.9Confident81.7Confident115 Ų115104.1 Ų104.154%0.53752%0.524SS..Hα-helixtrans-67.6-43.2177-70.7176.7170.900112.3Q40 E48Q40-E44 PolarHBondContact NE2-OE1 3.43Å; Q40-E44 WeakPolarHBondContact O-CG 3.31Å; Q40-E44 PolarHBondContact O-N 3.02Å; Q40-E44 VanDerWaalsContact O-N 3.1Å; E44-E48 PolarHBondContact O-N 3.07Å; E44-E48 VanDerWaalsContact O-N 3.1Å
45Q74.9Confident81.7Confident121 Ų121104.5 Ų104.557%0.56552%0.522SS*.Hα-helixtrans-72.5-32.6179.4-70.8-179.4-9.100112.8T41 M49T41-Q45 VanDerWaalsContact CG2-CD 3.41Å; T41-Q45 HydrophobicContact CG2-CG 4.07Å; T41-Q45 VanDerWaalsContact CG2-NE2 3.31Å; T41-Q45 WeakPolarHBondContact O-CB 3.5Å; T41-Q45 VanDerWaalsContact O-CG 3.22Å; T41-Q45 WeakPolarHBondContact O-CG 3.44Å; T41-Q45 PolarHBondContact O-N 3.16Å; Q45-M49 VanDerWaalsContact O-CB 3.27Å; Q45-M49 WeakPolarHBondContact O-CB 3.39Å; Q45-M49 PolarHBondContact O-N 3.35Å
46M72.4Confident81.7Confident110 Ų110105.4 Ų105.454%0.54253%0.526SS..Hα-helixtrans-66.1-43.8176.1-172.8175.677.100110.6T42 M49 E50T42-M46 WeakPolarHBondContact O-CB 3.42Å; T42-M46 PolarHBondContact O-N 2.92Å; M46-M49 PolarHBondContact O-N 3.45Å; M46-E50 WeakPolarHBondContact O-CB 3.38Å; M46-E50 VanDerWaalsContact O-CG 3.29Å; M46-E50 WeakPolarHBondContact O-CG 3.24Å; M46-E50 PolarHBondContact O-N 3.17Å
47D80.3Confident82.1Confident106 Ų106100.5 Ų100.557%0.56752%0.515SS*.Hα-helixtrans-63-43.5175.4-166.537.6000111.4M43 V51M43-D47 PolarHBondContact O-N 3.03Å; D47-V51 WeakPolarHBondContact O-CB 3.41Å; D47-V51 WeakPolarHBondContact O-CG2 3.4Å; D47-V51 PolarHBondContact O-N 3.03Å
48E82Confident82.6Confident128 Ų128102.8 Ų102.860%0.59852%0.519SS*.Hα-helixtrans-64-43176.4-171.5175.8-171.200112.5E44 V51 L52E44-E48 PolarHBondContact O-N 3.07Å; E44-E48 VanDerWaalsContact O-N 3.1Å; E48-V51 PolarHBondContact O-N 3.43Å; E48-L52 HydrophobicContact CG-CD1 4.39Å; E48-L52 VanDerWaalsContact O-CG 3.32Å; E48-L52 WeakPolarHBondContact O-CG 3.26Å; E48-L52 PolarHBondContact O-N 3.48Å
49M84.5Confident83.2Confident107 Ų107100.5 Ų100.553%0.52751%0.512SS..Hα-helixtrans-65.2-46.9178.1-174.866.67100111.7Q45 M46 V51 L52 E53Q45-M49 VanDerWaalsContact O-CB 3.27Å; Q45-M49 WeakPolarHBondContact O-CB 3.39Å; Q45-M49 PolarHBondContact O-N 3.35Å; M46-M49 PolarHBondContact O-N 3.45Å; M49-V51 VanDerWaalsContact C-N 3.27Å; M49-V51 PolarHBondContact O-N 2.9Å; M49-L52 PolarHBondContact O-N 3.35Å; M49-L52 VanDerWaalsContact O-N 3.1Å; M49-E53 WeakPolarHBondContact O-CG 3.44Å; M49-E53 PolarHBondContact O-N 3.46Å
50E83.6Confident84.1Confident107 Ų10799.8 Ų99.850%0.551%0.509SS..Hα-helixtrans-59.9-39.5177.1-75.1179.9-170.500111.3M46 L54M46-E50 WeakPolarHBondContact O-CB 3.38Å; M46-E50 VanDerWaalsContact O-CG 3.29Å; M46-E50 WeakPolarHBondContact O-CG 3.24Å; M46-E50 PolarHBondContact O-N 3.17Å; E50-L54 VanDerWaalsContact O-CB 3.27Å; E50-L54 WeakPolarHBondContact O-CB 3.29Å; E50-L54 PolarHBondContact O-N 2.95Å
51V85.9Confident85.2Confident68 Ų6899.7 Ų99.741%0.41252%0.515SS..Hα-helixtrans-65.5-41174.1170.40000111.6D47 E48 M49 L54 L55D47-V51 WeakPolarHBondContact O-CB 3.41Å; D47-V51 WeakPolarHBondContact O-CG2 3.4Å; D47-V51 PolarHBondContact O-N 3.03Å; E48-V51 PolarHBondContact O-N 3.43Å; M49-V51 VanDerWaalsContact C-N 3.27Å; M49-V51 PolarHBondContact O-N 2.9Å; V51-L54 PolarHBondContact O-N 3.41Å; V51-L55 HydrophobicContact CG1-CD1 4.01Å; V51-L55 HydrophobicContact CG1-CG 4.43Å; V51-L55 WeakPolarHBondContact O-CB 3.5Å; V51-L55 VanDerWaalsContact O-CG 3.25Å; V51-L55 WeakPolarHBondContact O-CG 3.37Å; V51-L55 PolarHBondContact O-N 3.28Å
52L90.1Very high86.4Confident92 Ų92100.3 Ų100.348%0.48252%0.519SS..Hα-helixtrans-65-45.2176.5-74.2172.9000112.1E48 M49 L54 L55 E56E48-L52 HydrophobicContact CG-CD1 4.39Å; E48-L52 VanDerWaalsContact O-CG 3.32Å; E48-L52 WeakPolarHBondContact O-CG 3.26Å; E48-L52 PolarHBondContact O-N 3.48Å; M49-L52 PolarHBondContact O-N 3.35Å; M49-L52 VanDerWaalsContact O-N 3.1Å; L52-L54 VanDerWaalsContact C-N 3.3Å; L52-L54 PolarHBondContact O-N 2.93Å; L52-L55 PolarHBondContact O-N 3.19Å; L52-E56 WeakPolarHBondContact O-CB 3.48Å; L52-E56 PolarHBondContact O-N 3.45Å
53E92.6Very high87.6Confident117 Ų117100.5 Ų100.555%0.54752%0.517SS..Hα-helixtrans-60.7-40.9174.4-71.9-177-179.300111.2M49 E56 S57M49-E53 WeakPolarHBondContact O-CG 3.44Å; M49-E53 PolarHBondContact O-N 3.46Å; E53-E56 PolarHBondContact O-N 3.41Å; E53-S57 WeakPolarHBondContact O-CB 3.43Å; E53-S57 PolarHBondContact O-N 3.37Å; E53-S57 PolarHBondContact O-OG 2.94Å
54L92.3Very high89Confident111 Ų111101 Ų10158%0.58152%0.518SS*.Hα-helixtrans-62.7-44.3174.4-179.362.5000111.5E50 V51 L52 E56 S57 M58E50-L54 VanDerWaalsContact O-CB 3.27Å; E50-L54 WeakPolarHBondContact O-CB 3.29Å; E50-L54 PolarHBondContact O-N 2.95Å; V51-L54 PolarHBondContact O-N 3.41Å; L52-L54 VanDerWaalsContact C-N 3.3Å; L52-L54 PolarHBondContact O-N 2.93Å; L54-E56 VanDerWaalsContact C-N 3.34Å; L54-S57 PolarHBondContact O-N 2.98Å; L54-S57 PolarHBondContact O-OG 3.46Å; L54-M58 VanDerWaalsContact O-CB 3.27Å; L54-M58 WeakPolarHBondContact O-CB 3.37Å; L54-M58 PolarHBondContact O-N 2.85Å
55L92.2Very high90.1Very high102 Ų102102.3 Ų102.353%0.53452%0.519SS..Hα-helixtrans-64.8-37.9177-72.6169.4000112.2V51 L52 M58 S59V51-L55 HydrophobicContact CG1-CD1 4.01Å; V51-L55 HydrophobicContact CG1-CG 4.43Å; V51-L55 WeakPolarHBondContact O-CB 3.5Å; V51-L55 VanDerWaalsContact O-CG 3.25Å; V51-L55 WeakPolarHBondContact O-CG 3.37Å; V51-L55 PolarHBondContact O-N 3.28Å; L52-L55 PolarHBondContact O-N 3.19Å; L55-M58 PolarHBondContact O-N 3.09Å; L55-S59 WeakPolarHBondContact O-CB 3.42Å; L55-S59 PolarHBondContact O-N 2.84Å
56E93.3Very high91.2Very high127 Ų127101.6 Ų101.659%0.59352%0.515SS*.Hα-helixtrans-63.7-51.6174.3-176166.9-155.900110.7L52 E53 L54 M58 S59 E60L52-E56 WeakPolarHBondContact O-CB 3.48Å; L52-E56 PolarHBondContact O-N 3.45Å; E53-E56 PolarHBondContact O-N 3.41Å; L54-E56 VanDerWaalsContact C-N 3.34Å; E56-M58 VanDerWaalsContact C-N 3.27Å; E56-M58 PolarHBondContact O-N 2.87Å; E56-S59 WeakPolarHBondContact O-CA 3.45Å; E56-S59 VanDerWaalsContact O-CB 3.27Å; E56-S59 WeakPolarHBondContact O-CB 3.48Å; E56-S59 PolarHBondContact O-N 3.09Å; E56-E60 WeakPolarHBondContact O-CG 3.45Å; E56-E60 PolarHBondContact O-N 3.25Å
57S94.8Very high92.4Very high48 Ų48100.9 Ų100.934%0.33651%0.514SS..Hα-helixtrans-59.1-38.2176.573.40000112.4E53 L54 E60 V61E53-S57 WeakPolarHBondContact O-CB 3.43Å; E53-S57 PolarHBondContact O-N 3.37Å; E53-S57 PolarHBondContact O-OG 2.94Å; L54-S57 PolarHBondContact O-N 2.98Å; L54-S57 PolarHBondContact O-OG 3.46Å; S57-E60 PolarHBondContact O-N 2.93Å; S57-V61 VanDerWaalsContact O-CG2 3.29Å; S57-V61 WeakPolarHBondContact O-CG2 3.35Å; S57-V61 PolarHBondContact O-N 3.44Å
58M95Very high93.3Very high121 Ų121100.4 Ų100.460%0.59651%0.511SS*.Hα-helixtrans-68.3-35.1176.4-174.2172.2171.400112.1L54 L55 E56 T62L54-M58 VanDerWaalsContact O-CB 3.27Å; L54-M58 WeakPolarHBondContact O-CB 3.37Å; L54-M58 PolarHBondContact O-N 2.85Å; L55-M58 PolarHBondContact O-N 3.09Å; E56-M58 VanDerWaalsContact C-N 3.27Å; E56-M58 PolarHBondContact O-N 2.87Å; M58-T62 WeakPolarHBondContact O-CB 3.33Å; M58-T62 PolarHBondContact O-N 3.25Å; M58-T62 PolarHBondContact O-OG1 3.26Å
59S95.2Very high94.1Very high64 Ų64100.9 Ų100.945%0.44851%0.507SS..Hα-helixtrans-65.2-44.4172.1-175.40000111.3L55 E56 T62 N63L55-S59 WeakPolarHBondContact O-CB 3.42Å; L55-S59 PolarHBondContact O-N 2.84Å; E56-S59 WeakPolarHBondContact O-CA 3.45Å; E56-S59 VanDerWaalsContact O-CB 3.27Å; E56-S59 WeakPolarHBondContact O-CB 3.48Å; E56-S59 PolarHBondContact O-N 3.09Å; S59-T62 WeakPolarHBondContact O-CB 3.27Å; S59-T62 PolarHBondContact O-N 3.03Å; S59-N63 PolarHBondContact O-N 3.25Å; S59-N63 PolarHBondContact O-ND2 2.89Å
60E97.1Very high94.7Very high109 Ų109101.7 Ų101.751%0.50951%0.507SS..Hα-helixtrans-59.5-51.4174.6-69.6-176.516400111.6E56 S57 T62 N63 E64E56-E60 WeakPolarHBondContact O-CG 3.45Å; E56-E60 PolarHBondContact O-N 3.25Å; S57-E60 PolarHBondContact O-N 2.93Å; E60-T62 PolarHBondContact O-N 3.44Å; E60-N63 WeakPolarHBondContact O-CB 3.36Å; E60-N63 PolarHBondContact O-N 3.02Å; E60-E64 WeakPolarHBondContact O-CG 3.29Å; E60-E64 PolarHBondContact O-N 2.95Å
61V97.6Very high95.5Very high93 Ų93100.5 Ų100.556%0.56451%0.505SS*.Hα-helixtrans-57.7-39.1176.5170.40000111.3S57 Y65S57-V61 VanDerWaalsContact O-CG2 3.29Å; S57-V61 WeakPolarHBondContact O-CG2 3.35Å; S57-V61 PolarHBondContact O-N 3.44Å; V61-Y65 WeakPolarHBondContact O-CB 3.49Å; V61-Y65 PolarHBondContact O-N 3.03Å
62T95.5Very high96Very high63 Ų63101.1 Ų101.139%0.38751%0.505SS..Hα-helixtrans-63.4-44.1175.6-62.30000111.4M58 S59 E60 Y65 Q66M58-T62 WeakPolarHBondContact O-CB 3.33Å; M58-T62 PolarHBondContact O-N 3.25Å; M58-T62 PolarHBondContact O-OG1 3.26Å; S59-T62 WeakPolarHBondContact O-CB 3.27Å; S59-T62 PolarHBondContact O-N 3.03Å; E60-T62 PolarHBondContact O-N 3.44Å; T62-Y65 PolarHBondContact O-N 3.28Å; T62-Q66 WeakPolarHBondContact O-CG 3.46Å; T62-Q66 PolarHBondContact O-N 3.36Å
63N97.3Very high96.4Very high79 Ų79104 Ų10442%0.42251%0.509SS..Hα-helixtrans-65.9-44177.9-72-31.9000111.8S59 E60 Y65 Q66 N67S59-N63 PolarHBondContact O-N 3.25Å; S59-N63 PolarHBondContact O-ND2 2.89Å; E60-N63 WeakPolarHBondContact O-CB 3.36Å; E60-N63 PolarHBondContact O-N 3.02Å; N63-Y65 VanDerWaalsContact C-N 3.34Å; N63-Y65 PolarHBondContact O-N 2.88Å; N63-Q66 PolarHBondContact O-N 3.44Å; N63-N67 PolarHBondContact O-N 2.91Å; N63-N67 PolarHBondContact O-ND2 2.94Å
64E98Very high96.7Very high134 Ų134103.9 Ų103.963%0.62651%0.509SS*.Hα-helixtrans-59.6-43.9175.1-72.5-172175.700111.7E60 Q66 N67 L68E60-E64 WeakPolarHBondContact O-CG 3.29Å; E60-E64 PolarHBondContact O-N 2.95Å; E64-Q66 VanDerWaalsContact C-N 3.34Å; E64-Q66 PolarHBondContact O-N 2.86Å; E64-N67 PolarHBondContact O-N 3.34Å; E64-L68 WeakPolarHBondContact O-CB 3.46Å; E64-L68 PolarHBondContact O-N 2.77Å
65Y98Very high97Very high141 Ų141102.3 Ų102.355%0.55350%0.503SS*.Hα-helixtrans-61.7-40.7175.3179.3-104000112.3V61 T62 N63 L68 R69V61-Y65 WeakPolarHBondContact O-CB 3.49Å; V61-Y65 PolarHBondContact O-N 3.03Å; T62-Y65 PolarHBondContact O-N 3.28Å; N63-Y65 VanDerWaalsContact C-N 3.34Å; N63-Y65 PolarHBondContact O-N 2.88Å; Y65-L68 PolarHBondContact O-N 2.98Å; Y65-R69 HydrophobicContact CD1-CG 4.48Å; Y65-R69 HydrophobicContact CE1-CG 4.09Å; Y65-R69 HydrophobicContact CE2-CG 4.43Å; Y65-R69 WeakPolarHBondContact O-CG 3.4Å; Y65-R69 PolarHBondContact O-N 2.89Å
66Q97.6Very high97.3Very high106 Ų106101.7 Ų101.750%0.49550%0.498SS..Hα-helixtrans-64.4-41.5175.9-72.8179.816.200112.3T62 N63 E64 R69 K70T62-Q66 WeakPolarHBondContact O-CG 3.46Å; T62-Q66 PolarHBondContact O-N 3.36Å; N63-Q66 PolarHBondContact O-N 3.44Å; E64-Q66 VanDerWaalsContact C-N 3.34Å; E64-Q66 PolarHBondContact O-N 2.86Å; Q66-R69 PolarHBondContact O-N 3.47Å; Q66-K70 PolarHBondContact O-N 3.2Å; Q66-K70 VanDerWaalsContact O-N 3.09Å
67N98.2Very high97.6Very high96 Ų9699.4 Ų99.451%0.51349%0.487SS..Hα-helixtrans-63.3-47.9174.7-72.3-27000111N63 E64 R69 K70 D71N63-N67 PolarHBondContact O-N 2.91Å; N63-N67 PolarHBondContact O-ND2 2.94Å; E64-N67 PolarHBondContact O-N 3.34Å; N67-R69 VanDerWaalsContact C-N 3.27Å; N67-R69 PolarHBondContact O-N 3.1Å; N67-K70 WeakPolarHBondContact O-CA 3.29Å; N67-K70 VanDerWaalsContact O-CB 3.26Å; N67-K70 WeakPolarHBondContact O-CB 3.27Å; N67-K70 PolarHBondContact O-N 2.88Å; N67-D71 PolarHBondContact O-N 2.86Å
68L98.5Very high97.8Very high96 Ų96101.8 Ų101.850%0.50350%0.496SS..Hα-helixtrans-57.3-40.1176-177.661.9000112E64 Y65 K70 D71 I72E64-L68 WeakPolarHBondContact O-CB 3.46Å; E64-L68 PolarHBondContact O-N 2.77Å; Y65-L68 PolarHBondContact O-N 2.98Å; L68-K70 VanDerWaalsContact C-N 3.29Å; L68-K70 PolarHBondContact O-N 3.45Å; L68-D71 PolarHBondContact O-N 2.83Å; L68-I72 HydrophobicContact CD1-CD1 4.36Å; L68-I72 HydrophobicContact CD1-CG1 4.49Å; L68-I72 HydrophobicContact CG-CD1 4.1Å; L68-I72 WeakPolarHBondContact O-CB 3.27Å; L68-I72 VanDerWaalsContact O-CG1 3.29Å; L68-I72 WeakPolarHBondContact O-CG1 3.25Å; L68-I72 PolarHBondContact O-N 2.89Å
69R98.4Very high97.9Very high138 Ų138101.6 Ų101.652%0.52149%0.493SS..Hα-helixtrans-65.2-29.2173.6-76.8-176.968-166.95.9113.4Y65 Q66 N67 R73Y65-R69 HydrophobicContact CD1-CG 4.48Å; Y65-R69 HydrophobicContact CE1-CG 4.09Å; Y65-R69 HydrophobicContact CE2-CG 4.43Å; Y65-R69 WeakPolarHBondContact O-CG 3.4Å; Y65-R69 PolarHBondContact O-N 2.89Å; Q66-R69 PolarHBondContact O-N 3.47Å; N67-R69 VanDerWaalsContact C-N 3.27Å; N67-R69 PolarHBondContact O-N 3.1Å; R69-R73 WeakPolarHBondContact O-CG 3.46Å; R69-R73 PolarHBondContact O-N 3.37Å; R69-R73 PolarHBondContact O-NE 2.94Å; R69-R73 VanDerWaalsContact O-NE 3.09Å
70K98.3Very high98.1Very high123 Ų123104.4 Ų104.454%0.53549%0.494SS..Hα-helixtrans-72.6-46.8173.7-175.6-174.6171.2-169.20110Q66 N67 L68 I72 R73 E74Q66-K70 PolarHBondContact O-N 3.2Å; Q66-K70 VanDerWaalsContact O-N 3.09Å; N67-K70 WeakPolarHBondContact O-CA 3.29Å; N67-K70 VanDerWaalsContact O-CB 3.26Å; N67-K70 WeakPolarHBondContact O-CB 3.27Å; N67-K70 PolarHBondContact O-N 2.88Å; L68-K70 VanDerWaalsContact C-N 3.29Å; L68-K70 PolarHBondContact O-N 3.45Å; K70-I72 PolarHBondContact O-N 2.91Å; K70-R73 WeakPolarHBondContact O-CB 3.32Å; K70-R73 PolarHBondContact O-N 3.39Å; K70-E74 PolarHBondContact O-N 3.39Å
71D98.6Very high98.2Very high82 Ų82103.1 Ų103.144%0.43949%0.491SS..Hα-helixtrans-62.3-42.6-179.5-62.8-8.8000111.5N67 L68 R73 E74 V75N67-D71 PolarHBondContact O-N 2.86Å; L68-D71 PolarHBondContact O-N 2.83Å; D71-R73 VanDerWaalsContact C-N 3.29Å; D71-R73 PolarHBondContact O-N 3.39Å; D71-E74 WeakPolarHBondContact O-CB 3.27Å; D71-E74 PolarHBondContact O-N 3.1Å; D71-E74 VanDerWaalsContact O-N 3.17Å; D71-V75 WeakPolarHBondContact O-CG2 3.21Å; D71-V75 PolarHBondContact O-N 2.98Å
72I98.5Very high98.2Very high82 Ų82102.8 Ų102.842%0.42149%0.489SS..Hα-helixtrans-58.9-41.3174.3-71.4169.1000111.2L68 K70 E74 V75 Q76L68-I72 HydrophobicContact CD1-CD1 4.36Å; L68-I72 HydrophobicContact CD1-CG1 4.49Å; L68-I72 HydrophobicContact CG-CD1 4.1Å; L68-I72 WeakPolarHBondContact O-CB 3.27Å; L68-I72 VanDerWaalsContact O-CG1 3.29Å; L68-I72 WeakPolarHBondContact O-CG1 3.25Å; L68-I72 PolarHBondContact O-N 2.89Å; K70-I72 PolarHBondContact O-N 2.91Å; I72-E74 VanDerWaalsContact C-N 3.34Å; I72-V75 PolarHBondContact O-N 2.93Å; I72-Q76 HydrophobicContact CG2-CG 4.45Å; I72-Q76 WeakPolarHBondContact O-CB 3.19Å; I72-Q76 VanDerWaalsContact O-CG 3.24Å; I72-Q76 WeakPolarHBondContact O-CG 3.41Å; I72-Q76 PolarHBondContact O-N 2.9Å
73R98.5Very high98.4Very high152 Ų152102.6 Ų102.657%0.57449%0.49SS*.Hα-helixtrans-65.6-38.2178.1-77.7-178.2-73.7165-3111.8R69 K70 D71 Q76 Q77R69-R73 WeakPolarHBondContact O-CG 3.46Å; R69-R73 PolarHBondContact O-N 3.37Å; R69-R73 PolarHBondContact O-NE 2.94Å; R69-R73 VanDerWaalsContact O-NE 3.09Å; K70-R73 WeakPolarHBondContact O-CB 3.32Å; K70-R73 PolarHBondContact O-N 3.39Å; D71-R73 VanDerWaalsContact C-N 3.29Å; D71-R73 PolarHBondContact O-N 3.39Å; R73-Q76 PolarHBondContact O-N 3.42Å; R73-Q77 PolarHBondContact O-N 2.96Å
74E98.6Very high98.4Very high115 Ų115101.8 Ų101.854%0.53749%0.49SS..Hα-helixtrans-65.7-47.1175.9-175172.3173.700111.4K70 D71 I72 Q76 Q77 L78K70-E74 PolarHBondContact O-N 3.39Å; D71-E74 WeakPolarHBondContact O-CB 3.27Å; D71-E74 PolarHBondContact O-N 3.1Å; D71-E74 VanDerWaalsContact O-N 3.17Å; I72-E74 VanDerWaalsContact C-N 3.34Å; E74-Q76 VanDerWaalsContact C-N 3.31Å; E74-Q76 PolarHBondContact O-N 3.01Å; E74-Q77 WeakPolarHBondContact O-CA 3.38Å; E74-Q77 WeakPolarHBondContact O-CB 3.27Å; E74-Q77 PolarHBondContact O-N 2.83Å; E74-L78 HydrophobicContact CG-CD1 4.35Å; E74-L78 WeakPolarHBondContact O-CG 3.4Å; E74-L78 PolarHBondContact O-N 3.48Å
75V98.7Very high98.5Very high77 Ų7798 Ų9847%0.46748%0.479SS..Hα-helixtrans-58.2-43.8174.9170.90000111.2D71 I72 Q77 L78 Q79D71-V75 WeakPolarHBondContact O-CG2 3.21Å; D71-V75 PolarHBondContact O-N 2.98Å; I72-V75 PolarHBondContact O-N 2.93Å; V75-Q77 VanDerWaalsContact C-N 3.29Å; V75-Q77 PolarHBondContact O-N 2.93Å; V75-L78 PolarHBondContact O-N 3.1Å; V75-Q79 HydrophobicContact CG1-CG 4.46Å; V75-Q79 WeakPolarHBondContact O-CB 3.22Å; V75-Q79 VanDerWaalsContact O-CG 3.31Å; V75-Q79 WeakPolarHBondContact O-CG 3.43Å; V75-Q79 PolarHBondContact O-N 3.21Å
76Q98.5Very high98.5Very high89 Ų8996 Ų9642%0.41648%0.476SS..Hα-helixtrans-62.6-35.5176-75175.9-9.900112.5I72 R73 E74 R80I72-Q76 HydrophobicContact CG2-CG 4.45Å; I72-Q76 WeakPolarHBondContact O-CB 3.19Å; I72-Q76 VanDerWaalsContact O-CG 3.24Å; I72-Q76 WeakPolarHBondContact O-CG 3.41Å; I72-Q76 PolarHBondContact O-N 2.9Å; R73-Q76 PolarHBondContact O-N 3.42Å; E74-Q76 VanDerWaalsContact C-N 3.31Å; E74-Q76 PolarHBondContact O-N 3.01Å; Q76-R80 WeakPolarHBondContact O-CG 3.04Å; Q76-R80 PolarHBondContact O-N 3.22Å; Q76-R80 VanDerWaalsContact O-N 3.16Å; Q76-R80 PolarHBondContact O-NH1 3.49Å
77Q98.6Very high98.5Very high80 Ų8097.9 Ų97.937%0.37448%0.479SS..Hα-helixtrans-67.7-47.9175-176.755.342.500111.1R73 E74 V75 Q79 R80 D81R73-Q77 PolarHBondContact O-N 2.96Å; E74-Q77 WeakPolarHBondContact O-CA 3.38Å; E74-Q77 WeakPolarHBondContact O-CB 3.27Å; E74-Q77 PolarHBondContact O-N 2.83Å; V75-Q77 VanDerWaalsContact C-N 3.29Å; V75-Q77 PolarHBondContact O-N 2.93Å; Q77-Q79 VanDerWaalsContact C-N 3.28Å; Q77-Q79 PolarHBondContact O-N 3.47Å; Q77-R80 WeakPolarHBondContact O-CB 3.39Å; Q77-R80 PolarHBondContact O-N 2.92Å; Q77-R80 VanDerWaalsContact OE1-NE 3.1Å; Q77-D81 PolarHBondContact NE2-OD1 2.99Å; Q77-D81 PolarHBondContact NE2-OD2 3.44Å; Q77-D81 PolarHBondContact O-N 3.34Å
78L98.8Very high98.6Very high97 Ų97100.5 Ų100.551%0.50848%0.483SS..Hα-helixtrans-57.1-41.9175.4-71.2169.3000112E74 V75 R80 D81 V82E74-L78 HydrophobicContact CG-CD1 4.35Å; E74-L78 WeakPolarHBondContact O-CG 3.4Å; E74-L78 PolarHBondContact O-N 3.48Å; V75-L78 PolarHBondContact O-N 3.1Å; L78-R80 VanDerWaalsContact C-N 3.34Å; L78-R80 PolarHBondContact O-N 2.85Å; L78-D81 PolarHBondContact O-N 3.21Å; L78-V82 WeakPolarHBondContact O-CG2 3.33Å; L78-V82 PolarHBondContact O-N 3.48Å
79Q98.6Very high98.6Very high117 Ų117101.6 Ų101.655%0.54749%0.486SS..Hα-helixtrans-60.3-40.9174.8-76.5177.3-18.600112.5V75 Q77 S83V75-Q79 HydrophobicContact CG1-CG 4.46Å; V75-Q79 WeakPolarHBondContact O-CB 3.22Å; V75-Q79 VanDerWaalsContact O-CG 3.31Å; V75-Q79 WeakPolarHBondContact O-CG 3.43Å; V75-Q79 PolarHBondContact O-N 3.21Å; Q77-Q79 VanDerWaalsContact C-N 3.28Å; Q77-Q79 PolarHBondContact O-N 3.47Å; Q79-S83 VanDerWaalsContact O-CB 3.22Å; Q79-S83 WeakPolarHBondContact O-CB 3.38Å; Q79-S83 PolarHBondContact O-N 3.41Å; Q79-S83 PolarHBondContact O-OG 3.07Å
80R98.5Very high98.6Very high124 Ų12499.5 Ų99.547%0.46848%0.483SS..Hα-helixtrans-63.9-43.2175-74.6-174.9-70.3-89.45.1111.4Q76 Q77 L78 S83 S84Q76-R80 WeakPolarHBondContact O-CG 3.04Å; Q76-R80 PolarHBondContact O-N 3.22Å; Q76-R80 VanDerWaalsContact O-N 3.16Å; Q76-R80 PolarHBondContact O-NH1 3.49Å; Q77-R80 WeakPolarHBondContact O-CB 3.39Å; Q77-R80 PolarHBondContact O-N 2.92Å; Q77-R80 VanDerWaalsContact OE1-NE 3.1Å; L78-R80 VanDerWaalsContact C-N 3.34Å; L78-R80 PolarHBondContact O-N 2.85Å; R80-S83 PolarHBondContact O-N 3.09Å; R80-S84 WeakPolarHBondContact O-CB 3.37Å; R80-S84 PolarHBondContact O-N 3.32Å
81D98.6Very high98.6Very high82 Ų82100.3 Ų100.344%0.43948%0.482SS..Hα-helixtrans-66.9-46.7-177.6-65.6-24.5000111.2Q77 L78 S83 S84 S85Q77-D81 PolarHBondContact NE2-OD1 2.99Å; Q77-D81 PolarHBondContact NE2-OD2 3.44Å; Q77-D81 PolarHBondContact O-N 3.34Å; L78-D81 PolarHBondContact O-N 3.21Å; D81-S83 PolarHBondContact O-N 2.71Å; D81-S84 WeakPolarHBondContact O-CB 3.37Å; D81-S84 PolarHBondContact O-N 2.84Å; D81-S85 WeakPolarHBondContact O-CB 3.44Å; D81-S85 PolarHBondContact O-N 3.47Å
82V98.5Very high98.6Very high86 Ų8698.7 Ų98.752%0.52148%0.478SS..Hα-helixtrans-60.8-45.1174172.50000110.9L78 S84 S85 I86L78-V82 WeakPolarHBondContact O-CG2 3.33Å; L78-V82 PolarHBondContact O-N 3.48Å; V82-S84 VanDerWaalsContact C-N 3.29Å; V82-S84 PolarHBondContact O-N 3.17Å; V82-S85 WeakPolarHBondContact O-CB 3.4Å; V82-S85 PolarHBondContact O-N 2.83Å; V82-I86 HydrophobicContact CG1-CD1 3.78Å; V82-I86 HydrophobicContact CG1-CG1 4.37Å; V82-I86 WeakPolarHBondContact O-CG1 3.43Å; V82-I86 PolarHBondContact O-N 2.92Å
83S98.6Very high98.6Very high59 Ų59101 Ų10141%0.41349%0.488SS..Hα-helixtrans-63-34.7177.4-62.60000112.8Q79 R80 D81 R87Q79-S83 VanDerWaalsContact O-CB 3.22Å; Q79-S83 WeakPolarHBondContact O-CB 3.38Å; Q79-S83 PolarHBondContact O-N 3.41Å; Q79-S83 PolarHBondContact O-OG 3.07Å; R80-S83 PolarHBondContact O-N 3.09Å; D81-S83 PolarHBondContact O-N 2.71Å; S83-R87 WeakPolarHBondContact O-CG 3.31Å; S83-R87 PolarHBondContact O-N 3.39Å; S83-R87 PolarHBondContact O-NE 3.16Å
84S98.6Very high98.6Very high61 Ų6199 Ų9943%0.42749%0.485SS..Hα-helixtrans-68.6-45.7174.2-170.30000111.1R80 D81 V82 R87 Y88R80-S84 WeakPolarHBondContact O-CB 3.37Å; R80-S84 PolarHBondContact O-N 3.32Å; D81-S84 WeakPolarHBondContact O-CB 3.37Å; D81-S84 PolarHBondContact O-N 2.84Å; V82-S84 VanDerWaalsContact C-N 3.29Å; V82-S84 PolarHBondContact O-N 3.17Å; S84-R87 PolarHBondContact O-N 3.05Å; S84-Y88 PolarHBondContact O-N 3.15Å
85S98.7Very high98.5Very high56 Ų5699.9 Ų99.939%0.39249%0.489SS..Hα-helixtrans-59.5-48.5177.9-175.60000111.9D81 V82 R87 Y88 Q89D81-S85 WeakPolarHBondContact O-CB 3.44Å; D81-S85 PolarHBondContact O-N 3.47Å; V82-S85 WeakPolarHBondContact O-CB 3.4Å; V82-S85 PolarHBondContact O-N 2.83Å; S85-R87 VanDerWaalsContact C-N 3.35Å; S85-R87 PolarHBondContact O-N 3.01Å; S85-Y88 WeakPolarHBondContact O-CB 3.4Å; S85-Y88 PolarHBondContact O-N 3.3Å; S85-Y88 VanDerWaalsContact O-N 3.13Å; S85-Q89 WeakPolarHBondContact O-CG 3.31Å; S85-Q89 PolarHBondContact O-N 3.19Å
86I98.5Very high98.5Very high97 Ų97100.5 Ų100.550%0.49749%0.493SS..Hα-helixtrans-59.3-45.3177.3-68.9169.9000110.9V82 Y88 Q89 M90V82-I86 HydrophobicContact CG1-CD1 3.78Å; V82-I86 HydrophobicContact CG1-CG1 4.37Å; V82-I86 WeakPolarHBondContact O-CG1 3.43Å; V82-I86 PolarHBondContact O-N 2.92Å; I86-Y88 VanDerWaalsContact C-N 3.31Å; I86-Y88 PolarHBondContact O-N 3.01Å; I86-Q89 PolarHBondContact O-N 2.84Å; I86-M90 WeakPolarHBondContact O-CB 3.47Å; I86-M90 PolarHBondContact O-N 3.05Å
87R98.5Very high98.5Very high147 Ų147102.8 Ų102.856%0.55550%0.502SS*.Hα-helixtrans-62.7-37177.1-77.7-178.6-73.4161.1-5.6112.5S83 S84 S85 R91S83-R87 WeakPolarHBondContact O-CG 3.31Å; S83-R87 PolarHBondContact O-N 3.39Å; S83-R87 PolarHBondContact O-NE 3.16Å; S84-R87 PolarHBondContact O-N 3.05Å; S85-R87 VanDerWaalsContact C-N 3.35Å; S85-R87 PolarHBondContact O-N 3.01Å; R87-R91 WeakPolarHBondContact O-CG 3.43Å; R87-R91 PolarHBondContact O-N 3.18Å; R87-R91 PolarHBondContact O-NE 3.5Å
88Y98.7Very high98.5Very high150 Ų150103.9 Ų103.959%0.58851%0.507SS*.Hα-helixtrans-66.8-50174.8176.3-96000111.5S84 S85 I86 M90 R91 S92S84-Y88 PolarHBondContact O-N 3.15Å; S85-Y88 WeakPolarHBondContact O-CB 3.4Å; S85-Y88 PolarHBondContact O-N 3.3Å; S85-Y88 VanDerWaalsContact O-N 3.13Å; I86-Y88 VanDerWaalsContact C-N 3.31Å; I86-Y88 PolarHBondContact O-N 3.01Å; Y88-M90 VanDerWaalsContact C-N 3.32Å; Y88-M90 PolarHBondContact O-N 3.42Å; Y88-R91 PolarHBondContact O-N 3.46Å; Y88-S92 PolarHBondContact O-N 2.81Å
89Q98.6Very high98.4Very high120 Ų120102.2 Ų102.256%0.56150%0.501SS*.Hα-helixtrans-59-42.6178.7-71.2179.1-4.200111.8S85 I86 R91 S92 M93S85-Q89 WeakPolarHBondContact O-CG 3.31Å; S85-Q89 PolarHBondContact O-N 3.19Å; I86-Q89 PolarHBondContact O-N 2.84Å; Q89-R91 PolarHBondContact O-N 3.4Å; Q89-S92 PolarHBondContact O-N 3.48Å; Q89-M93 WeakPolarHBondContact O-CB 3.4Å; Q89-M93 PolarHBondContact O-N 2.95Å
90M98.4Very high98.4Very high93 Ų93101.4 Ų101.446%0.45850%0.5SS..Hα-helixtrans-61.6-43.8176.6-172.4179.769.500112.2I86 Y88 M93 Q94I86-M90 WeakPolarHBondContact O-CB 3.47Å; I86-M90 PolarHBondContact O-N 3.05Å; Y88-M90 VanDerWaalsContact C-N 3.32Å; Y88-M90 PolarHBondContact O-N 3.42Å; M90-M93 PolarHBondContact O-N 3.43Å; M90-Q94 WeakPolarHBondContact O-CG 3.42Å; M90-Q94 PolarHBondContact O-N 3.43Å
91R98.5Very high98.3Very high141 Ų141101.9 Ų101.953%0.53251%0.505SS..Hα-helixtrans-62.5-44.6175.6-76.4-176.1-71.4171.8-1.3111.7R87 Y88 Q89 M93 Q94 Q95R87-R91 WeakPolarHBondContact O-CG 3.43Å; R87-R91 PolarHBondContact O-N 3.18Å; R87-R91 PolarHBondContact O-NE 3.5Å; Y88-R91 PolarHBondContact O-N 3.46Å; Q89-R91 PolarHBondContact O-N 3.4Å; R91-M93 VanDerWaalsContact C-N 3.33Å; R91-M93 PolarHBondContact O-N 3.13Å; R91-Q94 PolarHBondContact O-N 3.39Å; R91-Q95 WeakPolarHBondContact O-CG 3.43Å; R91-Q95 PolarHBondContact O-N 3.26Å
92S98.4Very high98.2Very high48 Ų48103.5 Ų103.534%0.33651%0.51SS..Hα-helixtrans-60.5-42.5176.4-175.40000111.9Y88 Q89 Q95 T96Y88-S92 PolarHBondContact O-N 2.81Å; Q89-S92 PolarHBondContact O-N 3.48Å; S92-Q95 PolarHBondContact O-N 2.98Å; S92-T96 WeakPolarHBondContact O-CB 3.48Å; S92-T96 PolarHBondContact O-N 3.04Å; S92-T96 PolarHBondContact O-OG1 2.9Å
93M98.4Very high98.1Very high130 Ų130107.7 Ų107.764%0.6452%0.517SS*.Hα-helixtrans-63-44.5176.6-172.6-178.173.300111.6Q89 M90 R91 Q95 T96 F97Q89-M93 WeakPolarHBondContact O-CB 3.4Å; Q89-M93 PolarHBondContact O-N 2.95Å; M90-M93 PolarHBondContact O-N 3.43Å; R91-M93 VanDerWaalsContact C-N 3.33Å; R91-M93 PolarHBondContact O-N 3.13Å; M93-Q95 PolarHBondContact O-N 3.48Å; M93-T96 PolarHBondContact O-N 3.06Å; M93-F97 WeakPolarHBondContact O-CB 3.43Å; M93-F97 PolarHBondContact O-N 3.46Å
94Q98.4Very high97.9Very high110 Ų110109 Ų10951%0.51452%0.518SS..Hα-helixtrans-61.5-42.8176.6-73.8173.4-18.100112.2M90 R91 F97 H98M90-Q94 WeakPolarHBondContact O-CG 3.42Å; M90-Q94 PolarHBondContact O-N 3.43Å; R91-Q94 PolarHBondContact O-N 3.39Å; Q94-F97 PolarHBondContact O-N 2.89Å; Q94-H98 WeakPolarHBondContact O-CB 3.46Å; Q94-H98 PolarHBondContact O-N 2.86Å
95Q98.3Very high97.7Very high134 Ų134108.2 Ų108.263%0.62652%0.516SS*.Hα-helixtrans-63.4-43.7176.1-73.2174.8-17.500111.9R91 S92 M93 H98 T99R91-Q95 WeakPolarHBondContact O-CG 3.43Å; R91-Q95 PolarHBondContact O-N 3.26Å; S92-Q95 PolarHBondContact O-N 2.98Å; M93-Q95 PolarHBondContact O-N 3.48Å; Q95-H98 PolarHBondContact O-N 3.42Å; Q95-T99 WeakPolarHBondContact O-CB 3.34Å; Q95-T99 PolarHBondContact O-N 3.37Å; Q95-T99 PolarHBondContact O-OG1 3.27Å
96T98.3Very high97.4Very high89 Ų89109 Ų10955%0.54652%0.521SS..Hα-helixtrans-62.2-46.3176.8-56.80000110.8S92 M93 H98 T99 L100S92-T96 WeakPolarHBondContact O-CB 3.48Å; S92-T96 PolarHBondContact O-N 3.04Å; S92-T96 PolarHBondContact O-OG1 2.9Å; M93-T96 PolarHBondContact O-N 3.06Å; T96-H98 PolarHBondContact O-N 3.09Å; T96-T99 PolarHBondContact O-N 3.3Å; T96-L100 WeakPolarHBondContact O-CB 3.45Å; T96-L100 PolarHBondContact O-N 3.46Å
97F98.4Very high97Very high137 Ų137107.9 Ų107.960%0.60152%0.522SS*.Hα-helixtrans-59.5-45.6175.6176.9-99.6000112M93 Q94 T99 L100 K101M93-F97 WeakPolarHBondContact O-CB 3.43Å; M93-F97 PolarHBondContact O-N 3.46Å; Q94-F97 PolarHBondContact O-N 2.89Å; F97-T99 VanDerWaalsContact C-N 3.34Å; F97-T99 PolarHBondContact O-N 3.43Å; F97-L100 PolarHBondContact O-N 2.86Å; F97-K101 HydrophobicContact CE1-CD 4.41Å; F97-K101 WeakPolarHBondContact O-CB 3.06Å; F97-K101 PolarHBondContact O-N 2.95Å
98H98Very high96.4Very high104 Ų104107 Ų10748%0.48152%0.524SS..Hα-helixtrans-62-43.1178.1-16488.3000111.6Q94 Q95 T96 K101 Q102Q94-H98 WeakPolarHBondContact O-CB 3.46Å; Q94-H98 PolarHBondContact O-N 2.86Å; Q95-H98 PolarHBondContact O-N 3.42Å; T96-H98 PolarHBondContact O-N 3.09Å; H98-K101 PolarHBondContact O-N 2.97Å; H98-Q102 PolarHBondContact CD2-NE2 3.38Å; H98-Q102 PolarHBondContact NE2-NE2 3.42Å; H98-Q102 WeakPolarHBondContact O-CG 3.31Å; H98-Q102 PolarHBondContact O-N 3.22Å
99T97.7Very high95.5Very high62 Ų62108 Ų10838%0.3853%0.531SS..Hα-helixtrans-61.3-45.8176.1-57.70000111.4Q95 T96 F97 Q102 R103Q95-T99 WeakPolarHBondContact O-CB 3.34Å; Q95-T99 PolarHBondContact O-N 3.37Å; Q95-T99 PolarHBondContact O-OG1 3.27Å; T96-T99 PolarHBondContact O-N 3.3Å; F97-T99 VanDerWaalsContact C-N 3.34Å; F97-T99 PolarHBondContact O-N 3.43Å; T99-Q102 PolarHBondContact O-N 3.05Å; T99-R103 WeakPolarHBondContact O-CG 3.35Å; T99-R103 PolarHBondContact O-N 3.44Å
100L97.8Very high94.2Very high100 Ų100105.1 Ų105.152%0.52453%0.534SS..Hα-helixtrans-62.7-44.7177.5-175.263.1000111.5T96 F97 Q102 R103 I104T96-L100 WeakPolarHBondContact O-CB 3.45Å; T96-L100 PolarHBondContact O-N 3.46Å; F97-L100 PolarHBondContact O-N 2.86Å; L100-Q102 VanDerWaalsContact C-N 3.34Å; L100-Q102 PolarHBondContact O-N 2.88Å; L100-R103 PolarHBondContact O-N 2.96Å; L100-I104 HydrophobicContact CD1-CD1 4.47Å; L100-I104 HydrophobicContact CG-CD1 4.12Å; L100-I104 WeakPolarHBondContact O-CG1 3.36Å; L100-I104 PolarHBondContact O-N 3.39Å
101K97.2Very high92.5Very high134 Ų134111.2 Ų111.258%0.58355%0.552SS**Hα-helixtrans-58.5-44.1176.5-174.2179.5179.7179.30111.8F97 H98 I104 A105F97-K101 HydrophobicContact CE1-CD 4.41Å; F97-K101 WeakPolarHBondContact O-CB 3.06Å; F97-K101 PolarHBondContact O-N 2.95Å; H98-K101 PolarHBondContact O-N 2.97Å; K101-I104 PolarHBondContact O-N 3.47Å; K101-A105 WeakPolarHBondContact O-CB 3.35Å; K101-A105 PolarHBondContact O-N 3.23Å
102Q96Very high90.7Very high116 Ų116113.3 Ų113.354%0.54257%0.565SS.*Hα-helixtrans-62.9-43.2176.3-73.5-179.2-9.900112.2H98 T99 L100 I104 A105 S106H98-Q102 PolarHBondContact CD2-NE2 3.38Å; H98-Q102 PolarHBondContact NE2-NE2 3.42Å; H98-Q102 WeakPolarHBondContact O-CG 3.31Å; H98-Q102 PolarHBondContact O-N 3.22Å; T99-Q102 PolarHBondContact O-N 3.05Å; L100-Q102 VanDerWaalsContact C-N 3.34Å; L100-Q102 PolarHBondContact O-N 2.88Å; Q102-I104 PolarHBondContact O-N 3.41Å; Q102-A105 PolarHBondContact O-N 3.37Å; Q102-S106 PolarHBondContact O-N 2.9Å; Q102-S106 PolarHBondContact O-OG 3.45Å
103R95.9Very high88.6Confident174 Ų174120 Ų12066%0.65759%0.588SS**Hα-helixtrans-62.7-40177-73.1-179.3-179.9-170.70.7112.8T99 L100 S106 S107T99-R103 WeakPolarHBondContact O-CG 3.35Å; T99-R103 PolarHBondContact O-N 3.44Å; L100-R103 PolarHBondContact O-N 2.96Å; R103-S106 PolarHBondContact O-OG 3.21Å; R103-S107 WeakPolarHBondContact O-CB 3.36Å; R103-S107 PolarHBondContact O-N 3.01Å
104I95Very high86.3Confident85 Ų85118.8 Ų118.844%0.43659%0.589SS.*Hα-helixtrans-65.3-47176-67.2167.7000110.1L100 K101 Q102 S106 S107 Q108L100-I104 HydrophobicContact CD1-CD1 4.47Å; L100-I104 HydrophobicContact CG-CD1 4.12Å; L100-I104 WeakPolarHBondContact O-CG1 3.36Å; L100-I104 PolarHBondContact O-N 3.39Å; K101-I104 PolarHBondContact O-N 3.47Å; Q102-I104 PolarHBondContact O-N 3.41Å; I104-S106 VanDerWaalsContact C-N 3.34Å; I104-S106 PolarHBondContact O-N 3.25Å; I104-S107 PolarHBondContact O-N 3.05Å; I104-Q108 WeakPolarHBondContact O-CG 3.35Å; I104-Q108 PolarHBondContact O-N 3.28Å
105A94Very high84.1Confident46 Ų46123.1 Ų123.138%0.3861%0.609SS.*Hα-helixtrans-62.4-38.7179.700000112.7K101 Q102 K109K101-A105 WeakPolarHBondContact O-CB 3.35Å; K101-A105 PolarHBondContact O-N 3.23Å; Q102-A105 PolarHBondContact O-N 3.37Å; A105-K109 WeakPolarHBondContact O-CG 3.24Å; A105-K109 PolarHBondContact O-N 2.92Å; A105-K109 VanDerWaalsContact O-N 3.14Å
106S92.4Very high81.8Confident73 Ų73126 Ų12651%0.5162%0.62SS.*Hα-helixtrans-70-39.6175.964.90000112.3Q102 R103 I104 Q108 K109 G110Q102-S106 PolarHBondContact O-N 2.9Å; Q102-S106 PolarHBondContact O-OG 3.45Å; R103-S106 PolarHBondContact O-OG 3.21Å; I104-S106 VanDerWaalsContact C-N 3.34Å; I104-S106 PolarHBondContact O-N 3.25Å; S106-Q108 PolarHBondContact O-N 3.34Å; S106-K109 PolarHBondContact O-N 2.98Å; S106-G110 PolarHBondContact O-N 3.23Å
107S90.3Very high79.3Confident72 Ų72124.8 Ų124.850%0.50363%0.625SS.*Hα-helixtrans-62.2-40.7174.6-175.70000112.2R103 I104 G110 R111R103-S107 WeakPolarHBondContact O-CB 3.36Å; R103-S107 PolarHBondContact O-N 3.01Å; I104-S107 PolarHBondContact O-N 3.05Å; S107-G110 PolarHBondContact O-N 3.44Å; S107-R111 PolarHBondContact O-N 3.47Å
108Q86.7Confident77.1Confident128 Ų128126.6 Ų126.660%0.59864%0.64SS**Hα-helixtrans-66-37.3175.2-72.9-178-1.300112.8I104 S106 G110 R111I104-Q108 WeakPolarHBondContact O-CG 3.35Å; I104-Q108 PolarHBondContact O-N 3.28Å; S106-Q108 PolarHBondContact O-N 3.34Å; Q108-G110 VanDerWaalsContact C-N 3.34Å; Q108-R111 PolarHBondContact O-N 3.23Å
109K78.5Confident75.1Confident172 Ų172129.8 Ų129.875%0.74866%0.661SS**Hα-helixtrans-65.2-37173.6-74.6-179.8-179.9-175.40112.1A105 S106 R111 K112A105-K109 WeakPolarHBondContact O-CG 3.24Å; A105-K109 PolarHBondContact O-N 2.92Å; A105-K109 VanDerWaalsContact O-N 3.14Å; S106-K109 PolarHBondContact O-N 2.98Å; K109-R111 VanDerWaalsContact C-N 3.27Å; K109-R111 PolarHBondContact O-N 2.96Å; K109-K112 PolarHBondContact O-N 3.04Å
110G72.1Confident72.9Confident59 Ų59130.3 Ų130.361%0.60868%0.679SS**Hα-helixtrans-64.2-27.9176.900000114.2S106 S107 Q108S106-G110 PolarHBondContact O-N 3.23Å; S107-G110 PolarHBondContact O-N 3.44Å; Q108-G110 VanDerWaalsContact C-N 3.34Å
111R61.8Low70.7Confident222 Ų222130.8 Ų130.884%0.83870%0.697SS**THydrogen-bonded Turntrans-82.1-13178.1-81.1-176171.1173.1-2.2115S107 Q108 K109S107-R111 PolarHBondContact O-N 3.47Å; Q108-R111 PolarHBondContact O-N 3.23Å; K109-R111 VanDerWaalsContact C-N 3.27Å; K109-R111 PolarHBondContact O-N 2.96Å
112K60.4Low68.7Low185 Ų185127.8 Ų127.880%0.80470%0.704SS**THydrogen-bonded Turntrans-97.721.1-177-69.5-163.6176.4-170.90114.8K109K109-K112 PolarHBondContact O-N 3.04Å
113K54.7Low67Low188 Ų188128.8 Ų128.882%0.81772%0.718SS**  trans-67.1134.2169.4-96.3-174.3176.3-177.50109.6
114P50.4Low64.9Low104 Ų104123.2 Ų123.268%0.67572%0.715SS**  trans-76.2136.9-162.430.9-34.2000111.4K116P114-K116 VanDerWaalsContact C-N 3.29Å; P114-K116 PolarHBondContact O-N 3.19Å
115E51.3Low63.2Low201 Ų201127.4 Ų127.494%0.93974%0.736SS**  trans-55.296.9153.6-79.7175.812800108.3
116K50.6Low61Low195 Ų195133.9 Ų133.985%0.84876%0.758SS**  trans-111.575.8150-83.5-166.9174.2-173.70106.7P114P114-K116 VanDerWaalsContact C-N 3.29Å; P114-K116 PolarHBondContact O-N 3.19Å
117G47.1Very low58.5Low64 Ų64143 Ų14366%0.6679%0.792SS**  trans-89.1113.515200000106.1
118L51.7Low56.9Low175 Ų175146.5 Ų146.592%0.91681%0.807SS**  52.971.283-70.8165000111.1
119D54.9Low55.3Low170 Ų170147.5 Ų147.591%0.90982%0.818SS**  trans-141.6127159.3-102.2-24.4000110.1
120G52.5Low54Low74 Ų74146.1 Ų146.176%0.76382%0.822SS**  trans94.464.6154.200000118.1G122G120-G122 VanDerWaalsContact C-N 3.25Å; G120-G122 PolarHBondContact O-N 3.05Å
121A51.7Low53Low110 Ų110151.2 Ų151.291%0.90983%0.834SS**  trans-65.788151.300000109.3
122G55.3Low52.4Low70 Ų70146.8 Ų146.872%0.72283%0.834SS**  trans-95.797172.800000111.3G120 G124G120-G122 VanDerWaalsContact C-N 3.25Å; G120-G122 PolarHBondContact O-N 3.05Å; G122-G124 PolarHBondContact O-N 3.18Å
123V59.6Low51.9Low138 Ų138144.3 Ų144.384%0.83684%0.836SS**  trans-6.7113.8146.6-176.30000112.3
124G52Low51.7Low57 Ų57141.1 Ų141.159%0.58884%0.837SS**  79.710170.500000110.4G122G122-G124 PolarHBondContact O-N 3.18Å
125I59.4Low51.8Low173 Ų173144 Ų14489%0.88785%0.85SS**  trans170.2128.6131-82.3156.1000108.8
126H48Very low51.8Low181 Ų181139.3 Ų139.384%0.83884%0.842SS**  trans-77.2154.6175.7-120.5-104.3000110.5
127E39.2Very low51.9Low264 Ų264134.2 Ų134.2100%1.23484%0.842SS**  trans81.40164.7-128.9174.9156.700118.5

Retrieved 127 of 127 residues in 87.9 ms (Link to these results)