A0A087XSK4_POEFO Loading...

Biogenesis of lysosome-related organelles complex 1 subunit 5

AlphaFold DB , UniProt , Accession A0A087XSK4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 154 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
1M61Low81.2Confident201 Ų201115.2 Ų115.299%0.9960%0.6SS**  0-53.30-161.2168.1-177.600111.4E3 K4 I5M1-E3 VanDerWaalsContact C-N 3.32Å; M1-E3 PolarHBondContact O-N 2.91Å; M1-K4 PolarHBondContact O-N 3.27Å; M1-I5 HydrophobicContact CG-CD1 4.42Å; M1-I5 PolarHBondContact O-N 3.31Å
2M72.1Confident81.1Confident154 Ų154114.1 Ų114.176%0.75959%0.593SS**Hα-helixtrans-57.6-37.3175.8-82.1-66-81.900114.8K4 I5 A6M2-K4 VanDerWaalsContact C-N 3.33Å; M2-K4 PolarHBondContact O-N 3.43Å; M2-I5 PolarHBondContact O-N 3.38Å; M2-A6 WeakPolarHBondContact O-CB 3.48Å; M2-A6 PolarHBondContact O-N 3.34Å
3E82.3Confident81.1Confident173 Ų173114.2 Ų114.281%0.80859%0.589SS**Hα-helixtrans-67.3-33.3-179.1-159.2170.3-154.100113.2M1 K7M1-E3 VanDerWaalsContact C-N 3.32Å; M1-E3 PolarHBondContact O-N 2.91Å; E3-K7 WeakPolarHBondContact O-CB 3.24Å; E3-K7 PolarHBondContact O-N 3.42Å; E3-K7 VanDerWaalsContact O-N 3.1Å
4K83.3Confident80.8Confident160 Ų160110.1 Ų110.170%0.69658%0.575SS**Hα-helixtrans-69-43.4174.6-121.3179.6179.9-175.90111M1 M2 K7 D8M1-K4 PolarHBondContact O-N 3.27Å; M2-K4 VanDerWaalsContact C-N 3.33Å; M2-K4 PolarHBondContact O-N 3.43Å; K4-K7 PolarHBondContact O-N 3.34Å; K4-D8 PolarHBondContact O-N 3.33Å
5I86.6Confident80.3Confident85 Ų85117.3 Ų117.344%0.43659%0.592SS.*Hα-helixtrans-64.8-42.9177.4-64.7166.3000110.7M1 M2 K7 D8 V9M1-I5 HydrophobicContact CG-CD1 4.42Å; M1-I5 PolarHBondContact O-N 3.31Å; M2-I5 PolarHBondContact O-N 3.38Å; I5-K7 VanDerWaalsContact C-N 3.3Å; I5-K7 PolarHBondContact O-N 2.9Å; I5-D8 PolarHBondContact O-N 2.89Å; I5-V9 HydrophobicContact CG2-CG2 4.3Å; I5-V9 WeakPolarHBondContact O-CB 3.23Å; I5-V9 VanDerWaalsContact O-CG2 3.23Å; I5-V9 WeakPolarHBondContact O-CG2 3.45Å; I5-V9 PolarHBondContact O-N 3.3Å
6A86.9Confident80.1Confident67 Ų67118.6 Ų118.655%0.55460%0.6SS**Hα-helixtrans-62.3-38.617700000112.2M2 G10M2-A6 WeakPolarHBondContact O-CB 3.48Å; M2-A6 PolarHBondContact O-N 3.34Å; A6-G10 PolarHBondContact O-N 3.26Å
7K87.2Confident80Confident140 Ų140118.3 Ų118.361%0.60960%0.6SS**Hα-helixtrans-66.3-48.6174.8-168.8179.9-179-177.80111.8E3 K4 I5 V9 G10 D11E3-K7 WeakPolarHBondContact O-CB 3.24Å; E3-K7 PolarHBondContact O-N 3.42Å; E3-K7 VanDerWaalsContact O-N 3.1Å; K4-K7 PolarHBondContact O-N 3.34Å; I5-K7 VanDerWaalsContact C-N 3.3Å; I5-K7 PolarHBondContact O-N 2.9Å; K7-V9 VanDerWaalsContact C-N 3.31Å; K7-V9 PolarHBondContact O-N 3.42Å; K7-G10 PolarHBondContact O-N 2.97Å; K7-D11 WeakPolarHBondContact O-CB 3.46Å; K7-D11 PolarHBondContact O-N 2.86Å
8D87.6Confident79.9Confident89 Ų89114.9 Ų114.948%0.47658%0.583SS.*Hα-helixtrans-62.9-38.6-179.9-67.1-18.9000111.4K4 I5 D11 I12K4-D8 PolarHBondContact O-N 3.33Å; I5-D8 PolarHBondContact O-N 2.89Å; D8-D11 PolarHBondContact O-N 3.29Å; D8-I12 WeakPolarHBondContact O-CB 3.45Å; D8-I12 WeakPolarHBondContact O-CD1 3.49Å; D8-I12 VanDerWaalsContact O-CG1 3.24Å; D8-I12 WeakPolarHBondContact O-CG1 3.28Å; D8-I12 PolarHBondContact O-N 3.1Å
9V86.3Confident80.1Confident88 Ų88115.4 Ų115.453%0.53358%0.583SS.*Hα-helixtrans-68.3-41174.91720000111.6I5 K7 D11 I12 Q13I5-V9 HydrophobicContact CG2-CG2 4.3Å; I5-V9 WeakPolarHBondContact O-CB 3.23Å; I5-V9 VanDerWaalsContact O-CG2 3.23Å; I5-V9 WeakPolarHBondContact O-CG2 3.45Å; I5-V9 PolarHBondContact O-N 3.3Å; K7-V9 VanDerWaalsContact C-N 3.31Å; K7-V9 PolarHBondContact O-N 3.42Å; V9-D11 VanDerWaalsContact C-N 3.34Å; V9-I12 PolarHBondContact O-N 2.99Å; V9-Q13 VanDerWaalsContact O-CB 3.32Å; V9-Q13 WeakPolarHBondContact O-CB 3.39Å; V9-Q13 PolarHBondContact O-N 2.85Å
10G82.3Confident80.2Confident30 Ų30118.7 Ų118.731%0.30959%0.588SS.*Hα-helixtrans-63.4-38.5174.300000112.7A6 K7 Q13 S14A6-G10 PolarHBondContact O-N 3.26Å; K7-G10 PolarHBondContact O-N 2.97Å; G10-Q13 PolarHBondContact O-N 2.88Å; G10-S14 WeakPolarHBondContact O-CB 3.47Å; G10-S14 PolarHBondContact O-N 3.42Å
11D77.2Confident80.3Confident80 Ų80116.9 Ų116.943%0.42859%0.585SS.*Hα-helixtrans-68.5-40.9176.8-75.3-11.9000111.3K7 D8 V9 S14 R15K7-D11 WeakPolarHBondContact O-CB 3.46Å; K7-D11 PolarHBondContact O-N 2.86Å; D8-D11 PolarHBondContact O-N 3.29Å; V9-D11 VanDerWaalsContact C-N 3.34Å; D11-S14 PolarHBondContact O-OG 3.4Å; D11-R15 VanDerWaalsContact O-CG 3.28Å; D11-R15 WeakPolarHBondContact O-CG 3.36Å; D11-R15 PolarHBondContact O-N 2.97Å; D11-R15 VanDerWaalsContact O-N 3.1Å
12I80.4Confident81.4Confident102 Ų102111.8 Ų111.852%0.52357%0.565SS.*Hα-helixtrans-65.4-43.6173.9-69.3165.3000110.7D8 V9 R15 L16D8-I12 WeakPolarHBondContact O-CB 3.45Å; D8-I12 WeakPolarHBondContact O-CD1 3.49Å; D8-I12 VanDerWaalsContact O-CG1 3.24Å; D8-I12 WeakPolarHBondContact O-CG1 3.28Å; D8-I12 PolarHBondContact O-N 3.1Å; V9-I12 PolarHBondContact O-N 2.99Å; I12-R15 PolarHBondContact O-N 3.45Å; I12-L16 HydrophobicContact CG2-CD1 3.72Å; I12-L16 HydrophobicContact CG2-CG 4.37Å; I12-L16 WeakPolarHBondContact O-CB 3.5Å; I12-L16 WeakPolarHBondContact O-CG 3.14Å; I12-L16 PolarHBondContact O-N 2.85Å
13Q81.1Confident82.2Confident116 Ų116109.1 Ų109.154%0.54255%0.553SS.*Hα-helixtrans-61.9-44.7177.6-171.6-155.8-0.100111.3V9 G10 R15 L16 L17V9-Q13 VanDerWaalsContact O-CB 3.32Å; V9-Q13 WeakPolarHBondContact O-CB 3.39Å; V9-Q13 PolarHBondContact O-N 2.85Å; G10-Q13 PolarHBondContact O-N 2.88Å; Q13-R15 VanDerWaalsContact C-N 3.31Å; Q13-R15 PolarHBondContact O-N 3.1Å; Q13-L16 PolarHBondContact O-N 3.38Å; Q13-L17 HydrophobicContact CG-CD1 3.59Å; Q13-L17 HydrophobicContact CG-CG 4.2Å; Q13-L17 WeakPolarHBondContact O-CB 3.32Å; Q13-L17 WeakPolarHBondContact O-CG 2.92Å; Q13-L17 PolarHBondContact O-N 3.19Å
14S76.9Confident82.6Confident56 Ų56103.4 Ų103.439%0.39253%0.532SS..Hα-helixtrans-62.7-40.1177.775.80000111G10 D11 L16 D18G10-S14 WeakPolarHBondContact O-CB 3.47Å; G10-S14 PolarHBondContact O-N 3.42Å; D11-S14 PolarHBondContact O-OG 3.4Å; S14-L16 VanDerWaalsContact C-N 3.33Å; S14-L16 PolarHBondContact O-N 3.43Å; S14-D18 VanDerWaalsContact O-CA 3.25Å; S14-D18 WeakPolarHBondContact O-CA 3.49Å; S14-D18 WeakPolarHBondContact O-CB 3.35Å; S14-D18 PolarHBondContact O-N 2.96Å
15R72.9Confident82.9Confident219 Ų21997.9 Ų97.983%0.82652%0.516SS*.Hα-helixtrans-70.7-28.3178.1-67170.998.3174.67113.5D11 I12 Q13D11-R15 VanDerWaalsContact O-CG 3.28Å; D11-R15 WeakPolarHBondContact O-CG 3.36Å; D11-R15 PolarHBondContact O-N 2.97Å; D11-R15 VanDerWaalsContact O-N 3.1Å; I12-R15 PolarHBondContact O-N 3.45Å; Q13-R15 VanDerWaalsContact C-N 3.31Å; Q13-R15 PolarHBondContact O-N 3.1Å
16L77Confident83.1Confident137 Ų13799.3 Ų99.372%0.71752%0.521SS*.Hα-helixtrans-83.6-33.1177.4-73.4172.9000113.3I12 Q13 S14I12-L16 HydrophobicContact CG2-CD1 3.72Å; I12-L16 HydrophobicContact CG2-CG 4.37Å; I12-L16 WeakPolarHBondContact O-CB 3.5Å; I12-L16 WeakPolarHBondContact O-CG 3.14Å; I12-L16 PolarHBondContact O-N 2.85Å; Q13-L16 PolarHBondContact O-N 3.38Å; S14-L16 VanDerWaalsContact C-N 3.33Å; S14-L16 PolarHBondContact O-N 3.43Å
17L78.7Confident83.3Confident114 Ų114100 Ų10060%0.59752%0.518SS*.Hα-helixtrans-111.6-22.6-171.9-56.9-176.8000113.7Q13 H19Q13-L17 HydrophobicContact CG-CD1 3.59Å; Q13-L17 HydrophobicContact CG-CG 4.2Å; Q13-L17 WeakPolarHBondContact O-CB 3.32Å; Q13-L17 WeakPolarHBondContact O-CG 2.92Å; Q13-L17 PolarHBondContact O-N 3.19Å; L17-H19 PolarHBondContact O-N 2.74Å; L17-H19 VanDerWaalsContact O-N 3.13Å; L17-H19 PolarHBondContact O-ND1 3.03Å
18D79.2Confident83.5Confident57 Ų57100.3 Ų100.331%0.30552%0.515SS..  trans-83.489.1172.3-161.513.3000109.4S14 R20 P21S14-D18 VanDerWaalsContact O-CA 3.25Å; S14-D18 WeakPolarHBondContact O-CA 3.49Å; S14-D18 WeakPolarHBondContact O-CB 3.35Å; S14-D18 PolarHBondContact O-N 2.96Å; D18-R20 PolarHBondContact O-N 3.13Å; D18-R20 VanDerWaalsContact OD1-CB 3.3Å; D18-R20 WeakPolarHBondContact OD1-CB 3.32Å; D18-R20 WeakPolarHBondContact OD1-CG 3.5Å; D18-R20 IonicContact OD1-CZ 3.72Å; D18-R20 PolarHBondContact OD1-N 3.12Å; D18-R20 IonicContact OD1-NE 3.97Å; D18-R20 PolarHBondContact OD1-NE 2.88Å; D18-R20 IonicContact OD1-NH2 3.74Å; D18-R20 IonicContact OD2-NE 2.75Å; D18-P21 WeakPolarHBondContact O-CD 3.25Å
19H81.9Confident83.6Confident125 Ų125101.9 Ų101.958%0.57952%0.516SS*.  trans-75.4-5.5176.250-80.1000112.3L17 V22 I23L17-H19 PolarHBondContact O-N 2.74Å; L17-H19 VanDerWaalsContact O-N 3.13Å; L17-H19 PolarHBondContact O-ND1 3.03Å; H19-V22 PolarHBondContact O-N 2.94Å; H19-V22 VanDerWaalsContact O-N 3.12Å; H19-I23 HydrophobicContact CB-CG1 4.38Å; H19-I23 WeakPolarHBondContact O-CG1 3.3Å; H19-I23 PolarHBondContact O-N 2.9Å
20R83.9Confident83.6Confident180 Ų180103.6 Ų103.668%0.67952%0.516SS*.Hα-helixtrans-52.4-45.7179.7-84-178.9-92-161.6-15.3113.5D18 V22 S24D18-R20 PolarHBondContact O-N 3.13Å; D18-R20 VanDerWaalsContact OD1-CB 3.3Å; D18-R20 WeakPolarHBondContact OD1-CB 3.32Å; D18-R20 WeakPolarHBondContact OD1-CG 3.5Å; D18-R20 IonicContact OD1-CZ 3.72Å; D18-R20 PolarHBondContact OD1-N 3.12Å; D18-R20 IonicContact OD1-NE 3.97Å; D18-R20 PolarHBondContact OD1-NE 2.88Å; D18-R20 IonicContact OD1-NH2 3.74Å; D18-R20 IonicContact OD2-NE 2.75Å; R20-V22 VanDerWaalsContact C-N 3.33Å; R20-V22 PolarHBondContact O-N 3.43Å; R20-S24 WeakPolarHBondContact O-CB 3.41Å; R20-S24 PolarHBondContact O-N 2.7Å
21P82.3Confident83.9Confident82 Ų82104.6 Ų104.653%0.53252%0.516SS..Hα-helixtrans-62.7-39.5178.8-22.935.6000112.8D18 A25D18-P21 WeakPolarHBondContact O-CD 3.25Å; P21-A25 WeakPolarHBondContact O-CB 3.43Å; P21-A25 PolarHBondContact O-N 3.33Å
22V84.1Confident84.2Confident94 Ų94106.4 Ų106.457%0.5752%0.517SS*.Hα-helixtrans-68.8-53.2179.5178.80000110.5H19 R20 S24 A25 E26H19-V22 PolarHBondContact O-N 2.94Å; H19-V22 VanDerWaalsContact O-N 3.12Å; R20-V22 VanDerWaalsContact C-N 3.33Å; R20-V22 PolarHBondContact O-N 3.43Å; V22-S24 VanDerWaalsContact C-N 3.28Å; V22-S24 PolarHBondContact O-N 3.12Å; V22-A25 WeakPolarHBondContact O-CB 3.42Å; V22-A25 PolarHBondContact O-N 2.98Å; V22-A25 VanDerWaalsContact O-N 3.12Å; V22-E26 PolarHBondContact O-N 3.43Å
23I88.4Confident84.3Confident97 Ų97103.5 Ų103.550%0.49750%0.501SS..Hα-helixtrans-58.8-43.1177.6-64.7-65.7000110.7H19 A25 E26 V27H19-I23 HydrophobicContact CB-CG1 4.38Å; H19-I23 WeakPolarHBondContact O-CG1 3.3Å; H19-I23 PolarHBondContact O-N 2.9Å; I23-A25 VanDerWaalsContact C-N 3.31Å; I23-A25 PolarHBondContact O-N 2.74Å; I23-E26 PolarHBondContact O-N 3.25Å; I23-V27 HydrophobicContact CG2-CG2 4.26Å; I23-V27 WeakPolarHBondContact O-CB 2.96Å; I23-V27 VanDerWaalsContact O-CG2 3.23Å; I23-V27 WeakPolarHBondContact O-CG2 3.34Å; I23-V27 PolarHBondContact O-N 3.47Å
24S89.8Confident84.1Confident54 Ų54102.9 Ų102.938%0.37850%0.497SS..Hα-helixtrans-67.1-32.7180-162.90000112.1R20 V22 R28R20-S24 WeakPolarHBondContact O-CB 3.41Å; R20-S24 PolarHBondContact O-N 2.7Å; V22-S24 VanDerWaalsContact C-N 3.28Å; V22-S24 PolarHBondContact O-N 3.12Å; S24-R28 WeakPolarHBondContact O-CG 3.45Å; S24-R28 VanDerWaalsContact O-CZ 3.24Å; S24-R28 PolarHBondContact O-N 2.88Å; S24-R28 VanDerWaalsContact O-N 3.12Å; S24-R28 PolarHBondContact O-NH1 3.26Å; S24-R28 PolarHBondContact OG-NH1 3.28Å
25A89.2Confident84.1Confident43 Ų43106.6 Ų106.636%0.35551%0.508SS..Hα-helixtrans-69.6-44.7172.900000112.1P21 V22 I23 R28 Y29P21-A25 WeakPolarHBondContact O-CB 3.43Å; P21-A25 PolarHBondContact O-N 3.33Å; V22-A25 WeakPolarHBondContact O-CB 3.42Å; V22-A25 PolarHBondContact O-N 2.98Å; V22-A25 VanDerWaalsContact O-N 3.12Å; I23-A25 VanDerWaalsContact C-N 3.31Å; I23-A25 PolarHBondContact O-N 2.74Å; A25-R28 PolarHBondContact O-N 2.89Å; A25-Y29 WeakPolarHBondContact O-CB 3.39Å; A25-Y29 PolarHBondContact O-N 2.82Å
26E91.6Very high84.1Confident116 Ų116102.5 Ų102.554%0.54250%0.498SS..Hα-helixtrans-62.4-41.8175.9-70.9-58.3150.500112V22 I23 R28 Y29 F30V22-E26 PolarHBondContact O-N 3.43Å; I23-E26 PolarHBondContact O-N 3.25Å; E26-R28 PolarHBondContact O-N 3.48Å; E26-Y29 PolarHBondContact O-N 3.24Å; E26-F30 WeakPolarHBondContact O-CB 3.23Å; E26-F30 PolarHBondContact O-N 2.87Å
27V92Very high83.8Confident82 Ų82102.4 Ų102.450%0.49749%0.492SS..Hα-helixtrans-61-45.4174.8169.30000111.1I23 Y29 F30 V31I23-V27 HydrophobicContact CG2-CG2 4.26Å; I23-V27 WeakPolarHBondContact O-CB 2.96Å; I23-V27 VanDerWaalsContact O-CG2 3.23Å; I23-V27 WeakPolarHBondContact O-CG2 3.34Å; I23-V27 PolarHBondContact O-N 3.47Å; V27-Y29 VanDerWaalsContact C-N 3.34Å; V27-Y29 PolarHBondContact O-N 3.36Å; V27-F30 PolarHBondContact O-N 3.32Å; V27-V31 WeakPolarHBondContact O-CG2 3.33Å; V27-V31 PolarHBondContact O-N 3.41Å
28R91.1Very high83.7Confident145 Ų145103.1 Ų103.155%0.54749%0.487SS..Hα-helixtrans-63.3-40.1175.7-77.7-172.4-64.1-82.9-2.6112.3S24 A25 E26 R32S24-R28 WeakPolarHBondContact O-CG 3.45Å; S24-R28 VanDerWaalsContact O-CZ 3.24Å; S24-R28 PolarHBondContact O-N 2.88Å; S24-R28 VanDerWaalsContact O-N 3.12Å; S24-R28 PolarHBondContact O-NH1 3.26Å; S24-R28 PolarHBondContact OG-NH1 3.28Å; A25-R28 PolarHBondContact O-N 2.89Å; E26-R28 PolarHBondContact O-N 3.48Å; R28-R32 WeakPolarHBondContact O-CB 3.47Å; R28-R32 PolarHBondContact O-N 2.97Å
29Y89.1Confident83.8Confident123 Ų123102.3 Ų102.348%0.48249%0.492SS..Hα-helixtrans-63.6-46.2176.6179.7-101.3000111A25 E26 V27 V31 R32 E33A25-Y29 WeakPolarHBondContact O-CB 3.39Å; A25-Y29 PolarHBondContact O-N 2.82Å; E26-Y29 PolarHBondContact O-N 3.24Å; V27-Y29 VanDerWaalsContact C-N 3.34Å; V27-Y29 PolarHBondContact O-N 3.36Å; Y29-V31 PolarHBondContact O-N 2.83Å; Y29-R32 PolarHBondContact O-N 3.49Å; Y29-E33 HydrophobicContact CD1-CG 4.13Å; Y29-E33 HydrophobicContact CD2-CG 4.13Å; Y29-E33 HydrophobicContact CE1-CG 3.69Å; Y29-E33 HydrophobicContact CE2-CG 3.69Å; Y29-E33 HydrophobicContact CG-CG 4.33Å; Y29-E33 VanDerWaalsContact CZ-CG 3.45Å; Y29-E33 WeakPolarHBondContact O-CG 3.36Å; Y29-E33 PolarHBondContact O-N 3.12Å
30F87.4Confident83.9Confident124 Ų124101.2 Ų101.254%0.54449%0.49SS..Hα-helixtrans-57.6-49.8176.4-177.2-92.2000111.9E26 V27 R32 E33 F34E26-F30 WeakPolarHBondContact O-CB 3.23Å; E26-F30 PolarHBondContact O-N 2.87Å; V27-F30 PolarHBondContact O-N 3.32Å; F30-R32 PolarHBondContact O-N 3.45Å; F30-E33 PolarHBondContact O-N 3.37Å; F30-F34 AromaticContact CD2-CD2 3.86Å; F30-F34 HydrophobicContact CD2-CD2 3.86Å; F30-F34 HydrophobicContact CD2-CE2 4.01Å; F30-F34 AromaticContact CE2-CD2 3.73Å; F30-F34 HydrophobicContact CE2-CD2 3.73Å; F30-F34 AromaticContact CE2-CE2 3.74Å; F30-F34 HydrophobicContact CE2-CE2 3.74Å; F30-F34 HydrophobicContact CE2-CG 4.36Å; F30-F34 HydrophobicContact CE2-CZ 4.38Å; F30-F34 HydrophobicContact CG-CD2 4.35Å; F30-F34 HydrophobicContact CZ-CD2 4.1Å; F30-F34 HydrophobicContact CZ-CE2 4.43Å; F30-F34 HydrophobicContact CZ-CG 4.3Å; F30-F34 WeakPolarHBondContact O-CB 3.34Å; F30-F34 PolarHBondContact O-N 2.95Å
31V87.4Confident84Confident50 Ų50100 Ų10030%0.30349%0.486SS..Hα-helixtrans-58.5-46.5176.2169.80000111.2V27 Y29 E33 F34 E35 E36V27-V31 WeakPolarHBondContact O-CG2 3.33Å; V27-V31 PolarHBondContact O-N 3.41Å; Y29-V31 PolarHBondContact O-N 2.83Å; V31-E33 PolarHBondContact O-N 3.45Å; V31-F34 PolarHBondContact O-N 3.35Å; V31-E35 HydrophobicContact CG1-CB 4.49Å; V31-E35 WeakPolarHBondContact O-CA 3.43Å; V31-E35 WeakPolarHBondContact O-CB 3.01Å; V31-E35 PolarHBondContact O-N 2.86Å; V31-E36 PolarHBondContact O-N 3.45Å
32R84.7Confident84.2Confident119 Ų11999.8 Ų99.845%0.44948%0.477SS..Iπ-helixtrans-61.3-44.6177.8-177.9178.293.9-175.95.7112.8R28 Y29 F30 E36 K37R28-R32 WeakPolarHBondContact O-CB 3.47Å; R28-R32 PolarHBondContact O-N 2.97Å; Y29-R32 PolarHBondContact O-N 3.49Å; F30-R32 PolarHBondContact O-N 3.45Å; R32-E36 HydrophobicContact CG-CB 4.35Å; R32-E36 VanDerWaalsContact CG-OE2 3.31Å; R32-E36 WeakPolarHBondContact CG-OE2 3.31Å; R32-E36 WeakPolarHBondContact O-CB 3.39Å; R32-E36 PolarHBondContact O-N 3.31Å; R32-K37 PolarHBondContact O-N 2.99Å
33E81.1Confident84.4Confident40 Ų4099.4 Ų99.419%0.18747%0.471CS..Iπ-helixtrans-72.1-33.4-177.3-66.7-58.6118.700112.7Y29 F30 V31 K37Y29-E33 HydrophobicContact CD1-CG 4.13Å; Y29-E33 HydrophobicContact CD2-CG 4.13Å; Y29-E33 HydrophobicContact CE1-CG 3.69Å; Y29-E33 HydrophobicContact CE2-CG 3.69Å; Y29-E33 HydrophobicContact CG-CG 4.33Å; Y29-E33 VanDerWaalsContact CZ-CG 3.45Å; Y29-E33 WeakPolarHBondContact O-CG 3.36Å; Y29-E33 PolarHBondContact O-N 3.12Å; F30-E33 PolarHBondContact O-N 3.37Å; V31-E33 PolarHBondContact O-N 3.45Å; E33-K37 WeakPolarHBondContact OE1-CD 3.44Å; E33-K37 WeakPolarHBondContact OE1-CE 3.41Å; E33-K37 IonicContact OE1-NZ 3.78Å; E33-K37 PolarHBondContact OE1-NZ 2.91Å; E33-K37 WeakPolarHBondContact OE2-CD 3.35Å; E33-K37 WeakPolarHBondContact OE2-CE 3.48Å; E33-K37 IonicContact OE2-NZ 3.87Å; E33-K37 PolarHBondContact OE2-NZ 3.38Å
34F76.8Confident84.5Confident104 Ų104101 Ų10146%0.45647%0.471SS..Iπ-helixtrans-98.6-35-174.2-81.8-91.9000114.6F30 V31 R38F30-F34 AromaticContact CD2-CD2 3.86Å; F30-F34 HydrophobicContact CD2-CD2 3.86Å; F30-F34 HydrophobicContact CD2-CE2 4.01Å; F30-F34 AromaticContact CE2-CD2 3.73Å; F30-F34 HydrophobicContact CE2-CD2 3.73Å; F30-F34 AromaticContact CE2-CE2 3.74Å; F30-F34 HydrophobicContact CE2-CE2 3.74Å; F30-F34 HydrophobicContact CE2-CG 4.36Å; F30-F34 HydrophobicContact CE2-CZ 4.38Å; F30-F34 HydrophobicContact CG-CD2 4.35Å; F30-F34 HydrophobicContact CZ-CD2 4.1Å; F30-F34 HydrophobicContact CZ-CE2 4.43Å; F30-F34 HydrophobicContact CZ-CG 4.3Å; F30-F34 WeakPolarHBondContact O-CB 3.34Å; F30-F34 PolarHBondContact O-N 2.95Å; V31-F34 PolarHBondContact O-N 3.35Å; F34-R38 WeakPolarHBondContact O-CB 3.19Å; F34-R38 WeakPolarHBondContact O-CD 3.32Å
35E77.6Confident84.7Confident134 Ų134103 Ų10363%0.62648%0.477SS*.Iπ-helixtrans-100.2-47.1-178.4-58.8-174.6167.400111V31 G39V31-E35 HydrophobicContact CG1-CB 4.49Å; V31-E35 WeakPolarHBondContact O-CA 3.43Å; V31-E35 WeakPolarHBondContact O-CB 3.01Å; V31-E35 PolarHBondContact O-N 2.86Å; E35-G39 VanDerWaalsContact O-CA 3.32Å; E35-G39 WeakPolarHBondContact O-CA 3.47Å; E35-G39 PolarHBondContact O-N 3.16Å
36E72.6Confident85Confident132 Ų132106.5 Ų106.562%0.61749%0.489SS*.Iπ-helixtrans-79.2-45.7-173.9-58.1178.8178.600112.8V31 R32 G39V31-E36 PolarHBondContact O-N 3.45Å; R32-E36 HydrophobicContact CG-CB 4.35Å; R32-E36 VanDerWaalsContact CG-OE2 3.31Å; R32-E36 WeakPolarHBondContact CG-OE2 3.31Å; R32-E36 WeakPolarHBondContact O-CB 3.39Å; R32-E36 PolarHBondContact O-N 3.31Å; E36-G39 PolarHBondContact O-N 2.83Å
37K72.2Confident85.3Confident135 Ų135106.6 Ų106.659%0.58749%0.489SS*.THydrogen-bonded Turntrans-70.5-33.8179.8-80.5-169.4177.9173.10113.5R32 E33R32-K37 PolarHBondContact O-N 2.99Å; E33-K37 WeakPolarHBondContact OE1-CD 3.44Å; E33-K37 WeakPolarHBondContact OE1-CE 3.41Å; E33-K37 IonicContact OE1-NZ 3.78Å; E33-K37 PolarHBondContact OE1-NZ 2.91Å; E33-K37 WeakPolarHBondContact OE2-CD 3.35Å; E33-K37 WeakPolarHBondContact OE2-CE 3.48Å; E33-K37 IonicContact OE2-NZ 3.87Å; E33-K37 PolarHBondContact OE2-NZ 3.38Å
38R76Confident85.5Confident129 Ų129107.4 Ų107.449%0.48749%0.491SS..THydrogen-bonded Turntrans-77.3-34.6173-67.5-170.6171.1-159.40.1111.1F34 L40 R41 E42F34-R38 WeakPolarHBondContact O-CB 3.19Å; F34-R38 WeakPolarHBondContact O-CD 3.32Å; R38-L40 PolarHBondContact O-N 2.93Å; R38-R41 WeakPolarHBondContact O-CB 3.42Å; R38-R41 PolarHBondContact O-N 3.46Å; R38-R41 VanDerWaalsContact O-N 3.16Å; R38-E42 IonicContact NH1-OE1 3.3Å
39G80.6Confident85.9Confident41 Ų41105.9 Ų105.942%0.42349%0.493SS..THydrogen-bonded Turntrans52.5-136.1179.600000111.1E35 E36 R41E35-G39 VanDerWaalsContact O-CA 3.32Å; E35-G39 WeakPolarHBondContact O-CA 3.47Å; E35-G39 PolarHBondContact O-N 3.16Å; E36-G39 PolarHBondContact O-N 2.83Å; G39-R41 VanDerWaalsContact C-N 3.32Å; G39-R41 PolarHBondContact O-N 3.49Å
40L83.4Confident86.3Confident102 Ų102104.2 Ų104.253%0.53449%0.493SS..THydrogen-bonded Turntrans-94.225179.2-53.4174.5000112.9R38 E42 I43 R44R38-L40 PolarHBondContact O-N 2.93Å; L40-E42 PolarHBondContact O-N 3.35Å; L40-I43 HydrophobicContact CB-CB 4.43Å; L40-I43 HydrophobicContact CD2-CD1 3.68Å; L40-I43 PolarHBondContact O-N 3.47Å; L40-R44 WeakPolarHBondContact O-CG 3.35Å; L40-R44 PolarHBondContact O-N 3.38Å
41R86.9Confident86.8Confident155 Ų155103.8 Ų103.859%0.58549%0.49SS*.Hα-helixtrans-59.7-49.2-174.5178.4-175.2176.5-157.9-1111.8R38 G39 I43 R44 L45R38-R41 WeakPolarHBondContact O-CB 3.42Å; R38-R41 PolarHBondContact O-N 3.46Å; R38-R41 VanDerWaalsContact O-N 3.16Å; G39-R41 VanDerWaalsContact C-N 3.32Å; G39-R41 PolarHBondContact O-N 3.49Å; R41-I43 VanDerWaalsContact C-N 3.32Å; R41-I43 PolarHBondContact O-N 2.97Å; R41-R44 PolarHBondContact O-N 3.45Å; R41-L45 HydrophobicContact CG-CD1 4.05Å; R41-L45 WeakPolarHBondContact O-CG 3.38Å; R41-L45 PolarHBondContact O-N 2.96Å
42E86.8Confident87.3Confident76 Ų76105.2 Ų105.236%0.35550%0.499SS..Hα-helixtrans-64-39.5-179.3-73.475.6-174.600111.2R38 L40 L45 L46R38-E42 IonicContact NH1-OE1 3.3Å; L40-E42 PolarHBondContact O-N 3.35Å; E42-L45 WeakPolarHBondContact O-CB 3.44Å; E42-L45 PolarHBondContact O-N 2.92Å; E42-L46 WeakPolarHBondContact O-CG 3.36Å; E42-L46 PolarHBondContact O-N 3.11Å
43I88.4Confident87.9Confident86 Ų86102.7 Ų102.744%0.44150%0.497SS..Hα-helixtrans-62.4-50.4176-68.8164.7000110.5L40 R41 L45 L46 E47L40-I43 HydrophobicContact CB-CB 4.43Å; L40-I43 HydrophobicContact CD2-CD1 3.68Å; L40-I43 PolarHBondContact O-N 3.47Å; R41-I43 VanDerWaalsContact C-N 3.32Å; R41-I43 PolarHBondContact O-N 2.97Å; I43-L45 VanDerWaalsContact C-N 3.26Å; I43-L45 PolarHBondContact O-N 3.35Å; I43-L46 PolarHBondContact O-N 2.94Å; I43-L46 VanDerWaalsContact O-N 3.11Å; I43-E47 HydrophobicContact CG2-CG 4.32Å; I43-E47 WeakPolarHBondContact O-CG 3.49Å; I43-E47 PolarHBondContact O-N 3.45Å
44R90.1Very high88.7Confident131 Ų131104.9 Ų104.949%0.49451%0.507SS..Hα-helixtrans-60.1-36.6176.9-71.5-172.9-64.1-99.90.4112.6L40 R41 N48L40-R44 WeakPolarHBondContact O-CG 3.35Å; L40-R44 PolarHBondContact O-N 3.38Å; R41-R44 PolarHBondContact O-N 3.45Å; R44-N48 WeakPolarHBondContact O-CB 3.36Å; R44-N48 PolarHBondContact O-N 3.15Å; R44-N48 PolarHBondContact O-ND2 3.31Å; R44-N48 VanDerWaalsContact O-ND2 3.15Å
45L93.9Very high89.7Confident97 Ų97103.6 Ų103.651%0.50850%0.503SS..Hα-helixtrans-63.9-45.2175.2-78.3166.7000111.2R41 E42 I43 N48 L49R41-L45 HydrophobicContact CG-CD1 4.05Å; R41-L45 WeakPolarHBondContact O-CG 3.38Å; R41-L45 PolarHBondContact O-N 2.96Å; E42-L45 WeakPolarHBondContact O-CB 3.44Å; E42-L45 PolarHBondContact O-N 2.92Å; I43-L45 VanDerWaalsContact C-N 3.26Å; I43-L45 PolarHBondContact O-N 3.35Å; L45-N48 PolarHBondContact O-N 2.85Å; L45-L49 WeakPolarHBondContact O-CB 3.35Å; L45-L49 PolarHBondContact O-N 2.97Å
46L96.3Very high90.6Very high116 Ų116100.2 Ų100.261%0.60749%0.491SS*.Hα-helixtrans-66.5-40.1177.4-70.9172.8000112.2E42 I43 L49 N50E42-L46 WeakPolarHBondContact O-CG 3.36Å; E42-L46 PolarHBondContact O-N 3.11Å; I43-L46 PolarHBondContact O-N 2.94Å; I43-L46 VanDerWaalsContact O-N 3.11Å; L46-L49 PolarHBondContact O-N 2.73Å; L46-N50 WeakPolarHBondContact O-CB 3.33Å; L46-N50 PolarHBondContact O-N 2.91Å
47E96.8Very high91.8Very high117 Ų11798.3 Ų98.355%0.54749%0.485SS..Hα-helixtrans-62-45.4175-73.2171.8162.800111.5I43 N50 K51I43-E47 HydrophobicContact CG2-CG 4.32Å; I43-E47 WeakPolarHBondContact O-CG 3.49Å; I43-E47 PolarHBondContact O-N 3.45Å; E47-N50 PolarHBondContact O-N 3.41Å; E47-K51 WeakPolarHBondContact O-CB 3.3Å; E47-K51 PolarHBondContact O-N 3.31Å
48N97.1Very high93Very high99 Ų9998.1 Ų98.153%0.52949%0.486SS..Hα-helixtrans-63.1-43.7175.6-73.8-27000111.6R44 L45 N50 K51 T52R44-N48 WeakPolarHBondContact O-CB 3.36Å; R44-N48 PolarHBondContact O-N 3.15Å; R44-N48 PolarHBondContact O-ND2 3.31Å; R44-N48 VanDerWaalsContact O-ND2 3.15Å; L45-N48 PolarHBondContact O-N 2.85Å; N48-N50 VanDerWaalsContact C-N 3.35Å; N48-K51 PolarHBondContact O-N 3.29Å; N48-T52 PolarHBondContact O-N 3.14Å; N48-T52 PolarHBondContact O-OG1 3.3Å; N48-T52 VanDerWaalsContact O-OG1 3.14Å
49L97.9Very high93.9Very high114 Ų11498.1 Ų98.160%0.59749%0.492SS*.Hα-helixtrans-60.4-47.1176.8-165.691.8000110.7L45 L46 K51 T52 V53L45-L49 WeakPolarHBondContact O-CB 3.35Å; L45-L49 PolarHBondContact O-N 2.97Å; L46-L49 PolarHBondContact O-N 2.73Å; L49-K51 VanDerWaalsContact C-N 3.31Å; L49-K51 PolarHBondContact O-N 2.98Å; L49-T52 PolarHBondContact O-N 3.26Å; L49-V53 VanDerWaalsContact O-CG2 3.3Å; L49-V53 WeakPolarHBondContact O-CG2 3.41Å; L49-V53 PolarHBondContact O-N 2.9Å
50N97.9Very high94.6Very high88 Ų88102 Ų10247%0.47150%0.5SS..Hα-helixtrans-60.9-42.5178.3-171.957.7000111.3L46 E47 N48 V53 Q54L46-N50 WeakPolarHBondContact O-CB 3.33Å; L46-N50 PolarHBondContact O-N 2.91Å; E47-N50 PolarHBondContact O-N 3.41Å; N48-N50 VanDerWaalsContact C-N 3.35Å; N50-V53 PolarHBondContact O-N 3.37Å; N50-Q54 WeakPolarHBondContact O-CB 2.83Å; N50-Q54 WeakPolarHBondContact O-CG 3.44Å; N50-Q54 PolarHBondContact O-N 3.35Å
51K97.8Very high95.3Very high114 Ų114101.1 Ų101.150%0.49650%0.496SS..Hα-helixtrans-59.5-48.6174.9-179.1178.2171.9179.10111.7E47 N48 L49 V53 Q54 E55E47-K51 WeakPolarHBondContact O-CB 3.3Å; E47-K51 PolarHBondContact O-N 3.31Å; N48-K51 PolarHBondContact O-N 3.29Å; L49-K51 VanDerWaalsContact C-N 3.31Å; L49-K51 PolarHBondContact O-N 2.98Å; K51-V53 VanDerWaalsContact C-N 3.31Å; K51-V53 PolarHBondContact O-N 2.84Å; K51-Q54 PolarHBondContact O-N 2.91Å; K51-E55 WeakPolarHBondContact CE-OE1 3.26Å; K51-E55 HydrophobicContact CG-CG 4.45Å; K51-E55 IonicContact NZ-OE1 2.9Å; K51-E55 WeakPolarHBondContact O-CB 3.37Å; K51-E55 WeakPolarHBondContact O-CG 3.5Å; K51-E55 PolarHBondContact O-N 3.46Å
52T98Very high95.8Very high80 Ų8096.6 Ų96.649%0.49149%0.487SS..Hα-helixtrans-62-39.8177.8-58.30000111.9N48 L49 T56N48-T52 PolarHBondContact O-N 3.14Å; N48-T52 PolarHBondContact O-OG1 3.3Å; N48-T52 VanDerWaalsContact O-OG1 3.14Å; L49-T52 PolarHBondContact O-N 3.26Å; T52-T56 WeakPolarHBondContact O-CB 3.32Å; T52-T56 PolarHBondContact O-N 2.95Å; T52-T56 PolarHBondContact O-OG1 3.43Å
53V98.1Very high96.3Very high67 Ų6795.5 Ų95.541%0.40649%0.491SS..Hα-helixtrans-64.3-44.6176.3169.50000111L49 N50 K51 T56 N57L49-V53 VanDerWaalsContact O-CG2 3.3Å; L49-V53 WeakPolarHBondContact O-CG2 3.41Å; L49-V53 PolarHBondContact O-N 2.9Å; N50-V53 PolarHBondContact O-N 3.37Å; K51-V53 VanDerWaalsContact C-N 3.31Å; K51-V53 PolarHBondContact O-N 2.84Å; V53-T56 PolarHBondContact O-N 3.32Å; V53-N57 WeakPolarHBondContact O-CB 3.33Å; V53-N57 PolarHBondContact O-N 2.82Å
54Q97.9Very high96.7Very high85 Ų8595.7 Ų95.740%0.39749%0.493SS..Hα-helixtrans-63.1-48.9176.8-77.1-179.9-31.900111.8N50 K51 T56 N57 E58N50-Q54 WeakPolarHBondContact O-CB 2.83Å; N50-Q54 WeakPolarHBondContact O-CG 3.44Å; N50-Q54 PolarHBondContact O-N 3.35Å; K51-Q54 PolarHBondContact O-N 2.91Å; Q54-T56 VanDerWaalsContact C-N 3.27Å; Q54-T56 PolarHBondContact O-N 3.1Å; Q54-N57 PolarHBondContact O-N 3.26Å; Q54-E58 VanDerWaalsContact O-CB 3.26Å; Q54-E58 WeakPolarHBondContact O-CB 3.35Å; Q54-E58 WeakPolarHBondContact O-CG 3.48Å; Q54-E58 PolarHBondContact O-N 3.29Å
55E97.5Very high97.1Very high78 Ų7894.4 Ų94.436%0.36450%0.495SS..Iπ-helixtrans-57.5-42.3176.9-73.2172.6173.200111.6K51 Q59 M60K51-E55 WeakPolarHBondContact CE-OE1 3.26Å; K51-E55 HydrophobicContact CG-CG 4.45Å; K51-E55 IonicContact NZ-OE1 2.9Å; K51-E55 WeakPolarHBondContact O-CB 3.37Å; K51-E55 WeakPolarHBondContact O-CG 3.5Å; K51-E55 PolarHBondContact O-N 3.46Å; E55-Q59 WeakPolarHBondContact O-CB 3.29Å; E55-Q59 PolarHBondContact O-N 2.92Å; E55-M60 PolarHBondContact O-N 3.4Å; E55-M60 VanDerWaalsContact O-N 3.1Å
56T97.6Very high97.2Very high62 Ų6296.4 Ų96.438%0.3850%0.502SS..Iπ-helixtrans-66.3-48.3178.7-56.30000111.7T52 V53 Q54 M60 L61T52-T56 WeakPolarHBondContact O-CB 3.32Å; T52-T56 PolarHBondContact O-N 2.95Å; T52-T56 PolarHBondContact O-OG1 3.43Å; V53-T56 PolarHBondContact O-N 3.32Å; Q54-T56 VanDerWaalsContact C-N 3.27Å; Q54-T56 PolarHBondContact O-N 3.1Å; T56-M60 PolarHBondContact O-N 3.2Å; T56-L61 WeakPolarHBondContact O-CB 3.44Å; T56-L61 PolarHBondContact O-N 2.88Å
57N97.2Very high97.3Very high92 Ų9295.3 Ų95.349%0.49249%0.493SS..Iπ-helixtrans-79.7-37.3-172.5-75.7-15.7000113.5V53 Q54 P62V53-N57 WeakPolarHBondContact O-CB 3.33Å; V53-N57 PolarHBondContact O-N 2.82Å; Q54-N57 PolarHBondContact O-N 3.26Å; N57-P62 VanDerWaalsContact O-CD 3.3Å; N57-P62 WeakPolarHBondContact O-CD 3.37Å
58E95.9Very high97.4Very high131 Ų13195.2 Ų95.261%0.61249%0.494SS*.Iπ-helixtrans-93.9-24.2-172.4-60.7178.9-172.500112.5Q54 P62Q54-E58 VanDerWaalsContact O-CB 3.26Å; Q54-E58 WeakPolarHBondContact O-CB 3.35Å; Q54-E58 WeakPolarHBondContact O-CG 3.48Å; Q54-E58 PolarHBondContact O-N 3.29Å; E58-P62 WeakPolarHBondContact O-CG 3.19Å
59Q95.1Very high97.4Very high130 Ų13094.3 Ų94.361%0.60750%0.496SS*.Iπ-helixtrans-115.6-58.3-177.2-54.3178.116.400112E55 P62 A63E55-Q59 WeakPolarHBondContact O-CB 3.29Å; E55-Q59 PolarHBondContact O-N 2.92Å; Q59-P62 WeakPolarHBondContact O-CD 3.35Å; Q59-A63 VanDerWaalsContact O-CB 3.29Å; Q59-A63 WeakPolarHBondContact O-CB 3.39Å; Q59-A63 PolarHBondContact O-N 2.86Å; Q59-A63 VanDerWaalsContact O-N 3.17Å
60M96.3Very high97.4Very high121 Ų12194.6 Ų94.660%0.59649%0.494SS*.Iπ-helixtrans-67.9-45.9-173.2-63.4-168.4126.300112.4E55 T56 A63 N64E55-M60 PolarHBondContact O-N 3.4Å; E55-M60 VanDerWaalsContact O-N 3.1Å; T56-M60 PolarHBondContact O-N 3.2Å; M60-A63 PolarHBondContact O-N 2.6Å; M60-N64 WeakPolarHBondContact O-CB 3.36Å; M60-N64 VanDerWaalsContact O-CG 3.27Å; M60-N64 PolarHBondContact O-N 2.97Å; M60-N64 PolarHBondContact O-ND2 3.49Å
61L97.3Very high97.4Very high85 Ų8595.9 Ų95.945%0.44550%0.496SS..Hα-helixtrans-62.8-49.3-178.6175.666.9000112.3T56 A63 N64 L65T56-L61 WeakPolarHBondContact O-CB 3.44Å; T56-L61 PolarHBondContact O-N 2.88Å; L61-A63 PolarHBondContact O-N 3.34Å; L61-N64 PolarHBondContact O-N 3.4Å; L61-L65 HydrophobicContact CD1-CD1 4.12Å; L61-L65 HydrophobicContact CD1-CG 4.19Å; L61-L65 HydrophobicContact CG-CD1 4.12Å; L61-L65 WeakPolarHBondContact O-CG 3.36Å; L61-L65 PolarHBondContact O-N 3.45Å
62P97.6Very high97.4Very high60 Ų6095.7 Ų95.739%0.3950%0.499SS..Hα-helixtrans-61.9-41.2176.7-27.338.2000113.2N57 E58 Q59 N64 L65 Q66N57-P62 VanDerWaalsContact O-CD 3.3Å; N57-P62 WeakPolarHBondContact O-CD 3.37Å; E58-P62 WeakPolarHBondContact O-CG 3.19Å; Q59-P62 WeakPolarHBondContact O-CD 3.35Å; P62-N64 PolarHBondContact O-N 2.88Å; P62-L65 PolarHBondContact O-N 3.45Å; P62-Q66 WeakPolarHBondContact O-CB 3.43Å; P62-Q66 PolarHBondContact O-N 3.17Å
63A97.4Very high97.4Very high53 Ų5394.4 Ų94.444%0.43849%0.494SS..Hα-helixtrans-61-45.8177.400000111.5Q59 M60 L61 Q66 E67Q59-A63 VanDerWaalsContact O-CB 3.29Å; Q59-A63 WeakPolarHBondContact O-CB 3.39Å; Q59-A63 PolarHBondContact O-N 2.86Å; Q59-A63 VanDerWaalsContact O-N 3.17Å; M60-A63 PolarHBondContact O-N 2.6Å; L61-A63 PolarHBondContact O-N 3.34Å; A63-Q66 PolarHBondContact O-N 3.43Å; A63-E67 WeakPolarHBondContact O-CB 3.37Å; A63-E67 PolarHBondContact O-N 2.86Å
64N97.3Very high97.4Very high90 Ų9094.5 Ų94.548%0.48149%0.492SS..Hα-helixtrans-63.4-42.9177.1-75.2-21.1000112.1M60 L61 P62 Q66 E67 M68M60-N64 WeakPolarHBondContact O-CB 3.36Å; M60-N64 VanDerWaalsContact O-CG 3.27Å; M60-N64 PolarHBondContact O-N 2.97Å; M60-N64 PolarHBondContact O-ND2 3.49Å; L61-N64 PolarHBondContact O-N 3.4Å; P62-N64 PolarHBondContact O-N 2.88Å; N64-Q66 VanDerWaalsContact C-N 3.35Å; N64-E67 PolarHBondContact O-N 3.35Å; N64-M68 WeakPolarHBondContact O-CB 3.48Å; N64-M68 WeakPolarHBondContact O-CG 3.43Å; N64-M68 PolarHBondContact O-N 2.97Å
65L97.4Very high97.5Very high103 Ų10395.4 Ų95.454%0.53950%0.499SS..Hα-helixtrans-63.3-41.7177.3-73.7173.3000111.7L61 P62 S69L61-L65 HydrophobicContact CD1-CD1 4.12Å; L61-L65 HydrophobicContact CD1-CG 4.19Å; L61-L65 HydrophobicContact CG-CD1 4.12Å; L61-L65 WeakPolarHBondContact O-CG 3.36Å; L61-L65 PolarHBondContact O-N 3.45Å; P62-L65 PolarHBondContact O-N 3.45Å; L65-S69 VanDerWaalsContact O-CB 3.29Å; L65-S69 WeakPolarHBondContact O-CB 3.3Å; L65-S69 PolarHBondContact O-N 3.34Å
66Q97.6Very high97.5Very high139 Ų13994.4 Ų94.465%0.6550%0.5SS*.Hα-helixtrans-64.2-46.3176.4-176.4176.7-3.400111.3P62 A63 N64 S69 Q70P62-Q66 WeakPolarHBondContact O-CB 3.43Å; P62-Q66 PolarHBondContact O-N 3.17Å; A63-Q66 PolarHBondContact O-N 3.43Å; N64-Q66 VanDerWaalsContact C-N 3.35Å; Q66-S69 PolarHBondContact O-N 2.92Å; Q66-Q70 WeakPolarHBondContact O-CB 3.27Å; Q66-Q70 PolarHBondContact O-N 3.44Å
67E97.9Very high97.5Very high93 Ų9397 Ų9744%0.43551%0.506SS..Hα-helixtrans-62.9-43.7178.5-170-174.4164.900111.6A63 N64 Q70 K71A63-E67 WeakPolarHBondContact O-CB 3.37Å; A63-E67 PolarHBondContact O-N 2.86Å; N64-E67 PolarHBondContact O-N 3.35Å; E67-Q70 PolarHBondContact O-N 2.97Å; E67-K71 HydrophobicContact CG-CD 4.21Å; E67-K71 WeakPolarHBondContact O-CB 3.5Å; E67-K71 WeakPolarHBondContact O-CG 3.39Å; E67-K71 PolarHBondContact O-N 2.92Å; E67-K71 WeakPolarHBondContact OE1-CE 3.43Å; E67-K71 IonicContact OE1-NZ 2.7Å; E67-K71 PolarHBondContact OE1-NZ 2.92Å
68M97.8Very high97.6Very high115 Ų115101.8 Ų101.857%0.56752%0.517SS*.Hα-helixtrans-60.7-46.1174.7-79.6-175.564.200111.7N64 Q70 K71 L72N64-M68 WeakPolarHBondContact O-CB 3.48Å; N64-M68 WeakPolarHBondContact O-CG 3.43Å; N64-M68 PolarHBondContact O-N 2.97Å; M68-Q70 VanDerWaalsContact C-N 3.31Å; M68-Q70 PolarHBondContact O-N 3.36Å; M68-K71 PolarHBondContact O-N 3.3Å; M68-L72 WeakPolarHBondContact O-CB 3.28Å; M68-L72 VanDerWaalsContact O-CG 3.28Å; M68-L72 WeakPolarHBondContact O-CG 3.36Å; M68-L72 PolarHBondContact O-N 2.95Å
69S97.9Very high97.7Very high80 Ų80101.3 Ų101.356%0.55952%0.518SS*.Hα-helixtrans-58.9-44.1178-177.40000111.5L65 Q66 L72 S73L65-S69 VanDerWaalsContact O-CB 3.29Å; L65-S69 WeakPolarHBondContact O-CB 3.3Å; L65-S69 PolarHBondContact O-N 3.34Å; Q66-S69 PolarHBondContact O-N 2.92Å; S69-L72 PolarHBondContact O-N 3.35Å; S69-S73 WeakPolarHBondContact O-CB 3.29Å; S69-S73 PolarHBondContact O-N 2.97Å
70Q98Very high97.9Very high120 Ų120100.5 Ų100.556%0.56151%0.514SS*.Hα-helixtrans-65.2-46.8177.8-171.3166.87.500112Q66 E67 M68 L72 S73 D74Q66-Q70 WeakPolarHBondContact O-CB 3.27Å; Q66-Q70 PolarHBondContact O-N 3.44Å; E67-Q70 PolarHBondContact O-N 2.97Å; M68-Q70 VanDerWaalsContact C-N 3.31Å; M68-Q70 PolarHBondContact O-N 3.36Å; Q70-L72 VanDerWaalsContact C-N 3.34Å; Q70-L72 PolarHBondContact O-N 2.92Å; Q70-S73 WeakPolarHBondContact O-CB 3.41Å; Q70-S73 PolarHBondContact O-N 3.48Å; Q70-D74 PolarHBondContact O-N 3.28Å
71K97.9Very high98Very high116 Ų11697.2 Ų97.250%0.50451%0.507SS..Hα-helixtrans-60.4-42.6176.5-76.4174.8171171.90112.2E67 M68 D74 I75E67-K71 HydrophobicContact CG-CD 4.21Å; E67-K71 WeakPolarHBondContact O-CB 3.5Å; E67-K71 WeakPolarHBondContact O-CG 3.39Å; E67-K71 PolarHBondContact O-N 2.92Å; E67-K71 WeakPolarHBondContact OE1-CE 3.43Å; E67-K71 IonicContact OE1-NZ 2.7Å; E67-K71 PolarHBondContact OE1-NZ 2.92Å; M68-K71 PolarHBondContact O-N 3.3Å; K71-D74 PolarHBondContact O-N 3.42Å; K71-I75 VanDerWaalsContact O-CG1 3.27Å; K71-I75 WeakPolarHBondContact O-CG1 3.37Å; K71-I75 PolarHBondContact O-N 3.36Å
72L98.2Very high98Very high109 Ų10995.7 Ų95.757%0.57151%0.506SS*.Hα-helixtrans-64.3-41.5176.1-74.3171.9000111.5M68 S69 Q70 D74 I75 S76M68-L72 WeakPolarHBondContact O-CB 3.28Å; M68-L72 VanDerWaalsContact O-CG 3.28Å; M68-L72 WeakPolarHBondContact O-CG 3.36Å; M68-L72 PolarHBondContact O-N 2.95Å; S69-L72 PolarHBondContact O-N 3.35Å; Q70-L72 VanDerWaalsContact C-N 3.34Å; Q70-L72 PolarHBondContact O-N 2.92Å; L72-D74 VanDerWaalsContact C-N 3.34Å; L72-D74 PolarHBondContact O-N 3.08Å; L72-I75 PolarHBondContact O-N 3.47Å; L72-S76 WeakPolarHBondContact O-CB 3.4Å; L72-S76 PolarHBondContact O-N 3.37Å
73S98.2Very high98.1Very high53 Ų5397.1 Ų97.137%0.37151%0.51SS..Hα-helixtrans-58.9-45.1174.6-1700000111.9S69 Q70 S76 K77S69-S73 WeakPolarHBondContact O-CB 3.29Å; S69-S73 PolarHBondContact O-N 2.97Å; Q70-S73 WeakPolarHBondContact O-CB 3.41Å; Q70-S73 PolarHBondContact O-N 3.48Å; S73-S76 PolarHBondContact O-N 2.9Å; S73-K77 WeakPolarHBondContact O-CG 3.31Å; S73-K77 PolarHBondContact O-N 3.19Å
74D98.2Very high98.1Very high69 Ų69100.1 Ų100.137%0.36952%0.515SS..Hα-helixtrans-66.7-40.9179.4-71.8-16.3000112.3Q70 K71 L72 K77 R78Q70-D74 PolarHBondContact O-N 3.28Å; K71-D74 PolarHBondContact O-N 3.42Å; L72-D74 VanDerWaalsContact C-N 3.34Å; L72-D74 PolarHBondContact O-N 3.08Å; D74-K77 PolarHBondContact O-N 3.4Å; D74-R78 VanDerWaalsContact O-CG 3.31Å; D74-R78 WeakPolarHBondContact O-CG 3.43Å; D74-R78 PolarHBondContact O-N 2.96Å; D74-R78 VanDerWaalsContact O-N 3.08Å
75I98.3Very high98.2Very high105 Ų105102 Ų10254%0.53852%0.522SS..Hα-helixtrans-63.1-43.8174.9-69.6166.8000110.4K71 L72 K77 R78 L79K71-I75 VanDerWaalsContact O-CG1 3.27Å; K71-I75 WeakPolarHBondContact O-CG1 3.37Å; K71-I75 PolarHBondContact O-N 3.36Å; L72-I75 PolarHBondContact O-N 3.47Å; I75-K77 PolarHBondContact O-N 3.49Å; I75-R78 PolarHBondContact O-N 3.05Å; I75-L79 WeakPolarHBondContact O-CB 3.4Å; I75-L79 PolarHBondContact O-N 2.87Å
76S98.4Very high98.2Very high56 Ų5699.7 Ų99.739%0.39252%0.519SS..Hα-helixtrans-58.9-48.1178.3-162.60000111.5L72 S73 R78 L79 E80L72-S76 WeakPolarHBondContact O-CB 3.4Å; L72-S76 PolarHBondContact O-N 3.37Å; S73-S76 PolarHBondContact O-N 2.9Å; S76-R78 VanDerWaalsContact C-N 3.34Å; S76-R78 PolarHBondContact O-N 3.34Å; S76-L79 WeakPolarHBondContact O-CB 3.49Å; S76-L79 PolarHBondContact O-N 2.91Å; S76-E80 WeakPolarHBondContact O-CG 3.44Å; S76-E80 PolarHBondContact O-N 3.46Å
77K98.3Very high98.2Very high118 Ų11897.5 Ų97.551%0.51351%0.508SS..Hα-helixtrans-61.4-41.3178-69.5170.3-171167.20112.4S73 D74 I75 L79 A81S73-K77 WeakPolarHBondContact O-CG 3.31Å; S73-K77 PolarHBondContact O-N 3.19Å; D74-K77 PolarHBondContact O-N 3.4Å; I75-K77 PolarHBondContact O-N 3.49Å; K77-L79 VanDerWaalsContact C-N 3.34Å; K77-A81 WeakPolarHBondContact O-CB 3.42Å; K77-A81 PolarHBondContact O-N 2.99Å
78R98.4Very high98.2Very high192 Ų192100.2 Ų100.273%0.72552%0.515SS*.Hα-helixtrans-65.2-39.9176.8-72.7175.4-174.1-163.33.1111.5D74 I75 S76 A81 A82D74-R78 VanDerWaalsContact O-CG 3.31Å; D74-R78 WeakPolarHBondContact O-CG 3.43Å; D74-R78 PolarHBondContact O-N 2.96Å; D74-R78 VanDerWaalsContact O-N 3.08Å; I75-R78 PolarHBondContact O-N 3.05Å; S76-R78 VanDerWaalsContact C-N 3.34Å; S76-R78 PolarHBondContact O-N 3.34Å; R78-A81 PolarHBondContact O-N 3.21Å; R78-A82 WeakPolarHBondContact O-CB 3.35Å; R78-A82 PolarHBondContact O-N 2.92Å
79L98.4Very high98.3Very high120 Ų12099.1 Ų99.163%0.62851%0.514SS*.Hα-helixtrans-65.5-45.7177.4-177.362.8000111.3I75 S76 K77 A81 A82 N83I75-L79 WeakPolarHBondContact O-CB 3.4Å; I75-L79 PolarHBondContact O-N 2.87Å; S76-L79 WeakPolarHBondContact O-CB 3.49Å; S76-L79 PolarHBondContact O-N 2.91Å; K77-L79 VanDerWaalsContact C-N 3.34Å; L79-A81 VanDerWaalsContact C-N 3.35Å; L79-A81 PolarHBondContact O-N 3.34Å; L79-A82 PolarHBondContact O-N 2.98Å; L79-N83 WeakPolarHBondContact O-CB 3.46Å; L79-N83 PolarHBondContact O-N 2.89Å
80E98.5Very high98.2Very high114 Ų114101.8 Ų101.853%0.53352%0.518SS..Hα-helixtrans-58.3-45.5175.1-75.8169.2-164.500111.8S76 A82 N83 H84S76-E80 WeakPolarHBondContact O-CG 3.44Å; S76-E80 PolarHBondContact O-N 3.46Å; E80-A82 PolarHBondContact O-N 3.49Å; E80-N83 PolarHBondContact O-N 3.26Å; E80-H84 PolarHBondContact O-N 3.42Å
81A98.4Very high98.2Very high52 Ų52100.7 Ų100.743%0.4351%0.513SS..Hα-helixtrans-62.1-44.2176.700000112.1K77 R78 L79 N83 H84 M85K77-A81 WeakPolarHBondContact O-CB 3.42Å; K77-A81 PolarHBondContact O-N 2.99Å; R78-A81 PolarHBondContact O-N 3.21Å; L79-A81 VanDerWaalsContact C-N 3.35Å; L79-A81 PolarHBondContact O-N 3.34Å; A81-N83 VanDerWaalsContact C-N 3.32Å; A81-N83 PolarHBondContact O-N 3.34Å; A81-H84 PolarHBondContact O-N 3.28Å; A81-M85 WeakPolarHBondContact O-CG 3.46Å; A81-M85 PolarHBondContact O-N 3.45Å
82A98.4Very high98.2Very high53 Ų53102.2 Ų102.244%0.43852%0.515SS..Hα-helixtrans-62.5-40.1176.500000111.7R78 L79 E80 M85 A86R78-A82 WeakPolarHBondContact O-CB 3.35Å; R78-A82 PolarHBondContact O-N 2.92Å; L79-A82 PolarHBondContact O-N 2.98Å; E80-A82 PolarHBondContact O-N 3.49Å; A82-M85 PolarHBondContact O-N 3.03Å; A82-A86 PolarHBondContact O-N 3.15Å
83N98.4Very high98.1Very high89 Ų89103.5 Ų103.548%0.47652%0.518SS..Hα-helixtrans-64.3-46.8177.9-162.658.4000111.4L79 E80 A81 M85 A86 E87L79-N83 WeakPolarHBondContact O-CB 3.46Å; L79-N83 PolarHBondContact O-N 2.89Å; E80-N83 PolarHBondContact O-N 3.26Å; A81-N83 VanDerWaalsContact C-N 3.32Å; A81-N83 PolarHBondContact O-N 3.34Å; N83-M85 VanDerWaalsContact C-N 3.29Å; N83-M85 PolarHBondContact O-N 2.92Å; N83-A86 WeakPolarHBondContact O-CB 3.47Å; N83-A86 PolarHBondContact O-N 3.37Å; N83-A86 VanDerWaalsContact O-N 3.13Å; N83-E87 PolarHBondContact ND2-OE1 3.27Å; N83-E87 WeakPolarHBondContact O-CG 3.33Å; N83-E87 PolarHBondContact O-N 2.96Å
84H98.5Very high97.9Very high117 Ų117104.6 Ų104.654%0.54252%0.52SS..Hα-helixtrans-61.1-36.1174.1-81.9-43.1000113.3E80 A81 E87 R88E80-H84 PolarHBondContact O-N 3.42Å; A81-H84 PolarHBondContact O-N 3.28Å; H84-E87 IonicContact CE1-OE2 2.74Å; H84-E87 IonicContact ND1-OE2 3.76Å; H84-E87 PolarHBondContact ND1-OE2 3.47Å; H84-E87 VanDerWaalsContact ND1-OE2 3.09Å; H84-R88 WeakPolarHBondContact O-CB 3.41Å; H84-R88 VanDerWaalsContact O-CG 3.25Å; H84-R88 WeakPolarHBondContact O-CG 3.31Å; H84-R88 PolarHBondContact O-N 3.07Å
85M98.3Very high97.9Very high128 Ų128106.1 Ų106.163%0.63153%0.525SS*.Hα-helixtrans-65.1-43174-73.7-179.963.800111.6A81 A82 N83 R88 V89A81-M85 WeakPolarHBondContact O-CG 3.46Å; A81-M85 PolarHBondContact O-N 3.45Å; A82-M85 PolarHBondContact O-N 3.03Å; N83-M85 VanDerWaalsContact C-N 3.29Å; N83-M85 PolarHBondContact O-N 2.92Å; M85-R88 PolarHBondContact O-N 3.37Å; M85-V89 WeakPolarHBondContact O-CG2 3.42Å; M85-V89 PolarHBondContact O-N 2.91Å
86A98.1Very high97.7Very high56 Ų56103.8 Ų103.846%0.46352%0.521SS..Hα-helixtrans-62-47.217700000111.6A82 N83 R88 V89 Q90A82-A86 PolarHBondContact O-N 3.15Å; N83-A86 WeakPolarHBondContact O-CB 3.47Å; N83-A86 PolarHBondContact O-N 3.37Å; N83-A86 VanDerWaalsContact O-N 3.13Å; A86-R88 VanDerWaalsContact C-N 3.31Å; A86-R88 PolarHBondContact O-N 3.13Å; A86-V89 PolarHBondContact O-N 2.94Å; A86-V89 VanDerWaalsContact O-N 3.15Å; A86-Q90 PolarHBondContact O-N 2.97Å
87E98.3Very high97.5Very high93 Ų93107.2 Ų107.244%0.43553%0.53SS..Hα-helixtrans-56.5-44.8175.2-72.9168.9177.700111.6N83 H84 V89 Q90 Q91N83-E87 PolarHBondContact ND2-OE1 3.27Å; N83-E87 WeakPolarHBondContact O-CG 3.33Å; N83-E87 PolarHBondContact O-N 2.96Å; H84-E87 IonicContact CE1-OE2 2.74Å; H84-E87 IonicContact ND1-OE2 3.76Å; H84-E87 PolarHBondContact ND1-OE2 3.47Å; H84-E87 VanDerWaalsContact ND1-OE2 3.09Å; E87-V89 PolarHBondContact O-N 2.75Å; E87-Q90 PolarHBondContact O-N 3.33Å; E87-Q91 WeakPolarHBondContact O-CB 3.46Å; E87-Q91 PolarHBondContact O-N 3.48Å
88R98.1Very high97.4Very high150 Ų150106.6 Ų106.657%0.56653%0.53SS*.Hα-helixtrans-64.8-37.5177.7-76.5179.565-170.70.5113.1H84 M85 A86 R92H84-R88 WeakPolarHBondContact O-CB 3.41Å; H84-R88 VanDerWaalsContact O-CG 3.25Å; H84-R88 WeakPolarHBondContact O-CG 3.31Å; H84-R88 PolarHBondContact O-N 3.07Å; M85-R88 PolarHBondContact O-N 3.37Å; A86-R88 VanDerWaalsContact C-N 3.31Å; A86-R88 PolarHBondContact O-N 3.13Å; R88-R92 VanDerWaalsContact O-CG 3.31Å; R88-R92 WeakPolarHBondContact O-CG 3.31Å; R88-R92 PolarHBondContact O-N 3.4Å; R88-R92 VanDerWaalsContact O-N 3.16Å
89V98.1Very high97.2Very high91 Ų91100.3 Ų100.355%0.55252%0.515SS*.Hα-helixtrans-66.7-47.8176.3169.40000109.8M85 A86 E87 Q91 R92 E93M85-V89 WeakPolarHBondContact O-CG2 3.42Å; M85-V89 PolarHBondContact O-N 2.91Å; A86-V89 PolarHBondContact O-N 2.94Å; A86-V89 VanDerWaalsContact O-N 3.15Å; E87-V89 PolarHBondContact O-N 2.75Å; V89-Q91 VanDerWaalsContact C-N 3.33Å; V89-Q91 PolarHBondContact O-N 2.95Å; V89-R92 PolarHBondContact O-N 2.92Å; V89-E93 PolarHBondContact O-N 2.99Å
90Q97.4Very high97Very high137 Ų13798.8 Ų98.864%0.6451%0.511SS*.Hα-helixtrans-59.2-43.3178-174.8178.71.200112A86 E87 R92 E93 L94A86-Q90 PolarHBondContact O-N 2.97Å; E87-Q90 PolarHBondContact O-N 3.33Å; Q90-R92 PolarHBondContact O-N 3.35Å; Q90-E93 PolarHBondContact O-N 3.32Å; Q90-L94 PolarHBondContact O-N 2.93Å
91Q97.5Very high96.8Very high96 Ų9699.1 Ų99.145%0.44951%0.512SS..Hα-helixtrans-62.6-43.6178-177.659.527.100111.9E87 V89 E93 L94 E95E87-Q91 WeakPolarHBondContact O-CB 3.46Å; E87-Q91 PolarHBondContact O-N 3.48Å; V89-Q91 VanDerWaalsContact C-N 3.33Å; V89-Q91 PolarHBondContact O-N 2.95Å; Q91-E93 VanDerWaalsContact C-N 3.33Å; Q91-E93 PolarHBondContact O-N 3.03Å; Q91-L94 PolarHBondContact O-N 3.47Å; Q91-E95 WeakPolarHBondContact CG-OE1 3.37Å; Q91-E95 PolarHBondContact NE2-OE1 3.16Å; Q91-E95 WeakPolarHBondContact O-CG 3.43Å; Q91-E95 PolarHBondContact O-N 2.99Å
92R96.8Very high96.6Very high149 Ų149102.1 Ų102.156%0.56252%0.52SS*.Hα-helixtrans-64.2-38.8177.4-76.8173.4173.4179.6-4.9112.4R88 V89 Q90 E95 A96R88-R92 VanDerWaalsContact O-CG 3.31Å; R88-R92 WeakPolarHBondContact O-CG 3.31Å; R88-R92 PolarHBondContact O-N 3.4Å; R88-R92 VanDerWaalsContact O-N 3.16Å; V89-R92 PolarHBondContact O-N 2.92Å; Q90-R92 PolarHBondContact O-N 3.35Å; R92-E95 PolarHBondContact O-N 3.49Å; R92-A96 VanDerWaalsContact O-CB 3.31Å; R92-A96 WeakPolarHBondContact O-CB 3.25Å; R92-A96 PolarHBondContact O-N 3.47Å
93E96.1Very high96.4Very high135 Ų135105.6 Ų105.663%0.63153%0.528SS*.Hα-helixtrans-63.6-44.1176.5-175170.5-158.200111.1V89 Q90 Q91 A96 Q97V89-E93 PolarHBondContact O-N 2.99Å; Q90-E93 PolarHBondContact O-N 3.32Å; Q91-E93 VanDerWaalsContact C-N 3.33Å; Q91-E93 PolarHBondContact O-N 3.03Å; E93-A96 PolarHBondContact O-N 3.34Å; E93-Q97 WeakPolarHBondContact O-CB 3.37Å; E93-Q97 PolarHBondContact O-N 3.46Å
94L96.1Very high96.3Very high77 Ų77103.9 Ų103.940%0.40353%0.526SS..Hα-helixtrans-61-46.3175.8-176.265.4000112.1Q90 Q91 Q97 Q98Q90-L94 PolarHBondContact O-N 2.93Å; Q91-L94 PolarHBondContact O-N 3.47Å; L94-Q97 PolarHBondContact O-N 3.03Å; L94-Q98 WeakPolarHBondContact O-CG 3.39Å; L94-Q98 PolarHBondContact O-N 3.33Å
95E96.1Very high96.1Very high101 Ų101102.7 Ų102.747%0.47252%0.523SS..Hα-helixtrans-62.3-43177.3-74.1169.8-169.800111.9Q91 R92 Q98 S99Q91-E95 WeakPolarHBondContact CG-OE1 3.37Å; Q91-E95 PolarHBondContact NE2-OE1 3.16Å; Q91-E95 WeakPolarHBondContact O-CG 3.43Å; Q91-E95 PolarHBondContact O-N 2.99Å; R92-E95 PolarHBondContact O-N 3.49Å; E95-Q98 PolarHBondContact O-N 3.23Å; E95-S99 WeakPolarHBondContact O-CB 3.47Å; E95-S99 PolarHBondContact O-N 3.12Å
96A95.3Very high95.9Very high55 Ų55102.3 Ų102.346%0.45552%0.521SS..Hα-helixtrans-63.8-41.4177.100000111.7R92 E93 S99 T100R92-A96 VanDerWaalsContact O-CB 3.31Å; R92-A96 WeakPolarHBondContact O-CB 3.25Å; R92-A96 PolarHBondContact O-N 3.47Å; E93-A96 PolarHBondContact O-N 3.34Å; A96-S99 PolarHBondContact O-N 3.4Å; A96-T100 WeakPolarHBondContact O-CB 3.35Å; A96-T100 PolarHBondContact O-N 2.89Å; A96-T100 PolarHBondContact O-OG1 3.45Å
97Q94.8Very high95.8Very high128 Ų128105.9 Ų105.960%0.59853%0.529SS*.Hα-helixtrans-63.7-46.2176.6-170.7-179.89.400111.5E93 L94 S99 T100 Q101E93-Q97 WeakPolarHBondContact O-CB 3.37Å; E93-Q97 PolarHBondContact O-N 3.46Å; L94-Q97 PolarHBondContact O-N 3.03Å; Q97-S99 PolarHBondContact O-N 3.09Å; Q97-T100 PolarHBondContact O-N 2.97Å; Q97-Q101 PolarHBondContact O-N 2.92Å
98Q94.4Very high95.8Very high106 Ų106107.3 Ų107.350%0.49553%0.534SS..Hα-helixtrans-61.4-43.2176-73.3178.8-1.800111.8L94 E95 T100 Q101 L102L94-Q98 WeakPolarHBondContact O-CG 3.39Å; L94-Q98 PolarHBondContact O-N 3.33Å; E95-Q98 PolarHBondContact O-N 3.23Å; Q98-T100 PolarHBondContact O-N 2.99Å; Q98-Q101 PolarHBondContact O-N 3.3Å; Q98-L102 WeakPolarHBondContact O-CG 3.49Å; Q98-L102 PolarHBondContact O-N 3.48Å
99S94.6Very high95.7Very high59 Ų59105.8 Ų105.841%0.41354%0.536SS..Hα-helixtrans-60.6-44.8177-175.40000111.8E95 A96 Q97 Q101 L102 Q103E95-S99 WeakPolarHBondContact O-CB 3.47Å; E95-S99 PolarHBondContact O-N 3.12Å; A96-S99 PolarHBondContact O-N 3.4Å; Q97-S99 PolarHBondContact O-N 3.09Å; S99-Q101 VanDerWaalsContact C-N 3.35Å; S99-Q101 PolarHBondContact O-N 2.99Å; S99-L102 PolarHBondContact O-N 3.37Å; S99-Q103 WeakPolarHBondContact O-CG 3.47Å; S99-Q103 PolarHBondContact O-N 3.31Å
100T94.5Very high95.6Very high89 Ų89108.2 Ų108.255%0.54654%0.539SS..Hα-helixtrans-62.9-42.7177.7-52.40000111.1A96 Q97 Q98 Q103 A104A96-T100 WeakPolarHBondContact O-CB 3.35Å; A96-T100 PolarHBondContact O-N 2.89Å; A96-T100 PolarHBondContact O-OG1 3.45Å; Q97-T100 PolarHBondContact O-N 2.97Å; Q98-T100 PolarHBondContact O-N 2.99Å; T100-Q103 PolarHBondContact O-N 3.48Å; T100-A104 PolarHBondContact O-N 2.87Å
101Q95.3Very high95.6Very high121 Ų121107.8 Ų107.857%0.56554%0.537SS*.Hα-helixtrans-64.3-40.6177.2-171.7176.25.700112.2Q97 Q98 S99 A104 N105Q97-Q101 PolarHBondContact O-N 2.92Å; Q98-Q101 PolarHBondContact O-N 3.3Å; S99-Q101 VanDerWaalsContact C-N 3.35Å; S99-Q101 PolarHBondContact O-N 2.99Å; Q101-A104 PolarHBondContact O-N 3Å; Q101-N105 WeakPolarHBondContact O-CB 3.37Å; Q101-N105 VanDerWaalsContact O-CG 3.26Å; Q101-N105 PolarHBondContact O-N 2.99Å; Q101-N105 PolarHBondContact O-ND2 3.42Å
102L94.1Very high95.5Very high114 Ų114106.9 Ų106.960%0.59754%0.535SS*.Hα-helixtrans-62.3-43174.7-74.7170.3000111.6Q98 S99 N105 M106Q98-L102 WeakPolarHBondContact O-CG 3.49Å; Q98-L102 PolarHBondContact O-N 3.48Å; S99-L102 PolarHBondContact O-N 3.37Å; L102-N105 PolarHBondContact O-N 3.5Å; L102-M106 WeakPolarHBondContact O-CG 3.4Å; L102-M106 PolarHBondContact O-N 2.94Å
103Q94.8Very high95.6Very high126 Ų126107 Ų10759%0.58954%0.536SS*.Hα-helixtrans-61.2-48.5176.3-75.3179.3-8.900111.7S99 T100 N105 M106 E107S99-Q103 WeakPolarHBondContact O-CG 3.47Å; S99-Q103 PolarHBondContact O-N 3.31Å; T100-Q103 PolarHBondContact O-N 3.48Å; Q103-N105 VanDerWaalsContact C-N 3.31Å; Q103-N105 PolarHBondContact O-N 3.29Å; Q103-M106 WeakPolarHBondContact O-CB 3.46Å; Q103-M106 PolarHBondContact O-N 2.89Å; Q103-M106 VanDerWaalsContact O-N 3.12Å; Q103-E107 PolarHBondContact O-N 3.41Å
104A95.4Very high95.6Very high53 Ų53103.3 Ų103.344%0.43853%0.528SS..Hα-helixtrans-58.9-41.917700000112.2T100 Q101 M106 E107 K108T100-A104 PolarHBondContact O-N 2.87Å; Q101-A104 PolarHBondContact O-N 3Å; A104-M106 PolarHBondContact O-N 3.36Å; A104-E107 PolarHBondContact O-N 2.93Å; A104-K108 PolarHBondContact O-N 3.37Å
105N95Very high95.7Very high92 Ų92106.2 Ų106.249%0.49254%0.54SS..Hα-helixtrans-63.9-40.1175.7-73.5-18.7000112.3Q101 L102 Q103 L109Q101-N105 WeakPolarHBondContact O-CB 3.37Å; Q101-N105 VanDerWaalsContact O-CG 3.26Å; Q101-N105 PolarHBondContact O-N 2.99Å; Q101-N105 PolarHBondContact O-ND2 3.42Å; L102-N105 PolarHBondContact O-N 3.5Å; Q103-N105 VanDerWaalsContact C-N 3.31Å; Q103-N105 PolarHBondContact O-N 3.29Å; N105-L109 WeakPolarHBondContact O-CB 3.39Å; N105-L109 PolarHBondContact O-N 3.36Å
106M93.8Very high95.8Very high120 Ų120106 Ų10659%0.59154%0.538SS*.Hα-helixtrans-66.3-39176.5-74.9-174.272.900112.3L102 Q103 A104 L109 K110L102-M106 WeakPolarHBondContact O-CG 3.4Å; L102-M106 PolarHBondContact O-N 2.94Å; Q103-M106 WeakPolarHBondContact O-CB 3.46Å; Q103-M106 PolarHBondContact O-N 2.89Å; Q103-M106 VanDerWaalsContact O-N 3.12Å; A104-M106 PolarHBondContact O-N 3.36Å; M106-L109 PolarHBondContact O-N 3.05Å; M106-K110 WeakPolarHBondContact O-CG 3.42Å; M106-K110 PolarHBondContact O-N 3.15Å; M106-K110 VanDerWaalsContact O-N 3.11Å
107E96.1Very high95.8Very high132 Ų132107.5 Ų107.562%0.61754%0.538SS*.Hα-helixtrans-63.4-48.2176.2-122.6164.9-163.200110.9Q103 A104 L109 K110 E111Q103-E107 PolarHBondContact O-N 3.41Å; A104-E107 PolarHBondContact O-N 2.93Å; E107-L109 VanDerWaalsContact C-N 3.33Å; E107-L109 PolarHBondContact O-N 3.43Å; E107-K110 WeakPolarHBondContact O-CB 3.39Å; E107-K110 PolarHBondContact O-N 3.08Å; E107-K110 VanDerWaalsContact O-N 3.08Å; E107-E111 PolarHBondContact O-N 3.04Å
108K96.8Very high96Very high123 Ų123109.3 Ų109.354%0.53554%0.543SS..Hα-helixtrans-57.2-45.7174.7-173-178.1177.4-176.70112.2A104 K110 E111 D112A104-K108 PolarHBondContact O-N 3.37Å; K108-K110 VanDerWaalsContact C-N 3.25Å; K108-K110 PolarHBondContact O-N 3.45Å; K108-E111 WeakPolarHBondContact O-CB 3.5Å; K108-E111 PolarHBondContact O-N 3.23Å; K108-E111 VanDerWaalsContact O-N 3.15Å; K108-D112 WeakPolarHBondContact O-CB 3.24Å; K108-D112 VanDerWaalsContact O-CG 3.27Å; K108-D112 PolarHBondContact O-N 2.93Å
109L96.3Very high96.1Very high118 Ų118108 Ų10862%0.61854%0.537SS*.Hα-helixtrans-61.2-35.5178.5-175.467.8000112.2N105 M106 E107 W113N105-L109 WeakPolarHBondContact O-CB 3.39Å; N105-L109 PolarHBondContact O-N 3.36Å; M106-L109 PolarHBondContact O-N 3.05Å; E107-L109 VanDerWaalsContact C-N 3.33Å; E107-L109 PolarHBondContact O-N 3.43Å; L109-W113 VanDerWaalsContact O-CB 3.24Å; L109-W113 WeakPolarHBondContact O-CB 3.37Å; L109-W113 PolarHBondContact O-N 3.11Å
110K96.3Very high96.2Very high142 Ų142109.5 Ų109.562%0.61754%0.538SS*.Hα-helixtrans-67.4-41.2175.5-73.6173.2-179.2176.30111.8M106 E107 K108 W113 A114M106-K110 WeakPolarHBondContact O-CG 3.42Å; M106-K110 PolarHBondContact O-N 3.15Å; M106-K110 VanDerWaalsContact O-N 3.11Å; E107-K110 WeakPolarHBondContact O-CB 3.39Å; E107-K110 PolarHBondContact O-N 3.08Å; E107-K110 VanDerWaalsContact O-N 3.08Å; K108-K110 VanDerWaalsContact C-N 3.25Å; K108-K110 PolarHBondContact O-N 3.45Å; K110-W113 PolarHBondContact O-N 2.94Å; K110-A114 WeakPolarHBondContact O-CB 3.5Å; K110-A114 PolarHBondContact O-N 2.97Å
111E96.9Very high96.3Very high127 Ų127111 Ų11159%0.59354%0.539SS*.Hα-helixtrans-62.4-51.8175-69.9177.7167.800110.5E107 K108 W113 A114 E115E107-E111 PolarHBondContact O-N 3.04Å; K108-E111 WeakPolarHBondContact O-CB 3.5Å; K108-E111 PolarHBondContact O-N 3.23Å; K108-E111 VanDerWaalsContact O-N 3.15Å; E111-W113 PolarHBondContact O-N 2.87Å; E111-A114 WeakPolarHBondContact O-CB 3.48Å; E111-A114 PolarHBondContact O-N 3.3Å; E111-E115 PolarHBondContact O-N 2.96Å
112D97.1Very high96.5Very high77 Ų77110.2 Ų110.241%0.41253%0.531SS..Hα-helixtrans-55.4-40.8176.8-67.4-16.8000111K108 F116K108-D112 WeakPolarHBondContact O-CB 3.24Å; K108-D112 VanDerWaalsContact O-CG 3.27Å; K108-D112 PolarHBondContact O-N 2.93Å; D112-F116 WeakPolarHBondContact O-CB 3.47Å; D112-F116 PolarHBondContact O-N 2.99Å
113W96.9Very high96.6Very high151 Ų151108 Ų10857%0.57252%0.519SS*.Hα-helixtrans-69-38.9177.3-171.5-109.5000113.1L109 K110 E111 F116 L117L109-W113 VanDerWaalsContact O-CB 3.24Å; L109-W113 WeakPolarHBondContact O-CB 3.37Å; L109-W113 PolarHBondContact O-N 3.11Å; K110-W113 PolarHBondContact O-N 2.94Å; E111-W113 PolarHBondContact O-N 2.87Å; W113-F116 AromaticContact CE3-CD1 3.99Å; W113-F116 HydrophobicContact CE3-CD1 3.99Å; W113-F116 HydrophobicContact CH2-CD1 4.11Å; W113-F116 HydrophobicContact CH2-CE1 4.08Å; W113-F116 AromaticContact CZ3-CD1 3.73Å; W113-F116 HydrophobicContact CZ3-CD1 3.73Å; W113-F116 AromaticContact CZ3-CE1 3.98Å; W113-F116 HydrophobicContact CZ3-CE1 3.98Å; W113-F116 PolarHBondContact O-N 3.01Å; W113-L117 HydrophobicContact CZ2-CD2 4.33Å; W113-L117 WeakPolarHBondContact O-CG 3.49Å; W113-L117 PolarHBondContact O-N 3.24Å
114A97.4Very high96.7Very high58 Ų58108.4 Ų108.448%0.47952%0.519SS..Hα-helixtrans-65.9-41.7176.600000111.4K110 E111 L117 K118K110-A114 WeakPolarHBondContact O-CB 3.5Å; K110-A114 PolarHBondContact O-N 2.97Å; E111-A114 WeakPolarHBondContact O-CB 3.48Å; E111-A114 PolarHBondContact O-N 3.3Å; A114-L117 PolarHBondContact O-N 3.39Å; A114-K118 WeakPolarHBondContact O-CB 3.39Å; A114-K118 PolarHBondContact O-N 3.27Å
115E97.4Very high96.8Very high139 Ų139110.9 Ų110.965%0.6552%0.521SS*.Hα-helixtrans-61.8-45.4173.3-70.8-170.5169.800111.4E111 L117 K118 E119E111-E115 PolarHBondContact O-N 2.96Å; E115-L117 PolarHBondContact O-N 2.99Å; E115-K118 PolarHBondContact O-N 3.03Å; E115-E119 PolarHBondContact O-N 3.43Å
116F97.6Very high96.9Very high97 Ų97110.5 Ų110.543%0.42552%0.517SS..Hα-helixtrans-57.7-48.3175.8174.9-102.2000112.1D112 W113 K118 E119 Q120D112-F116 WeakPolarHBondContact O-CB 3.47Å; D112-F116 PolarHBondContact O-N 2.99Å; W113-F116 AromaticContact CE3-CD1 3.99Å; W113-F116 HydrophobicContact CE3-CD1 3.99Å; W113-F116 HydrophobicContact CH2-CD1 4.11Å; W113-F116 HydrophobicContact CH2-CE1 4.08Å; W113-F116 AromaticContact CZ3-CD1 3.73Å; W113-F116 HydrophobicContact CZ3-CD1 3.73Å; W113-F116 AromaticContact CZ3-CE1 3.98Å; W113-F116 HydrophobicContact CZ3-CE1 3.98Å; W113-F116 PolarHBondContact O-N 3.01Å; F116-K118 VanDerWaalsContact C-N 3.33Å; F116-K118 PolarHBondContact O-N 3.43Å; F116-E119 PolarHBondContact O-N 2.94Å; F116-Q120 HydrophobicContact CD1-CG 4.15Å; F116-Q120 HydrophobicContact CD2-CG 4.36Å; F116-Q120 HydrophobicContact CE1-CG 3.65Å; F116-Q120 HydrophobicContact CE2-CG 3.89Å; F116-Q120 HydrophobicContact CG-CG 4.48Å; F116-Q120 HydrophobicContact CZ-CG 3.51Å; F116-Q120 WeakPolarHBondContact O-CG 3.46Å; F116-Q120 PolarHBondContact O-N 2.75Å
117L97.3Very high97Very high86 Ų86109.1 Ų109.145%0.4551%0.514SS..Hα-helixtrans-62.3-39.5178.8-74.5177.7000112.5W113 A114 E115 E119 Q120 Q121W113-L117 HydrophobicContact CZ2-CD2 4.33Å; W113-L117 WeakPolarHBondContact O-CG 3.49Å; W113-L117 PolarHBondContact O-N 3.24Å; A114-L117 PolarHBondContact O-N 3.39Å; E115-L117 PolarHBondContact O-N 2.99Å; L117-E119 VanDerWaalsContact C-N 3.33Å; L117-Q120 PolarHBondContact O-N 3.23Å; L117-Q121 PolarHBondContact O-N 2.7Å
118K97.6Very high97.1Very high165 Ų165107 Ų10772%0.71751%0.507SS*.Hα-helixtrans-61.6-43.1175.7-174.9-179.2177.7-175.20111.3A114 E115 F116 Q121 R122A114-K118 WeakPolarHBondContact O-CB 3.39Å; A114-K118 PolarHBondContact O-N 3.27Å; E115-K118 PolarHBondContact O-N 3.03Å; F116-K118 VanDerWaalsContact C-N 3.33Å; F116-K118 PolarHBondContact O-N 3.43Å; K118-Q121 PolarHBondContact O-N 3.45Å; K118-R122 PolarHBondContact O-N 2.89Å
119E97.4Very high97.1Very high79 Ų79106.4 Ų106.437%0.36951%0.506SS..Hα-helixtrans-68-40.4177.1-176.157.5-161.900112.1E115 F116 L117 Q121 R122 L123E115-E119 PolarHBondContact O-N 3.43Å; F116-E119 PolarHBondContact O-N 2.94Å; L117-E119 VanDerWaalsContact C-N 3.33Å; E119-Q121 VanDerWaalsContact C-N 3.29Å; E119-Q121 PolarHBondContact O-N 2.99Å; E119-R122 WeakPolarHBondContact O-CB 3.37Å; E119-R122 PolarHBondContact O-N 2.91Å; E119-R122 IonicContact OE1-CZ 2.6Å; E119-R122 VanDerWaalsContact OE1-CZ 3.3Å; E119-R122 IonicContact OE1-NE 3.65Å; E119-R122 PolarHBondContact OE1-NE 3.39Å; E119-R122 VanDerWaalsContact OE1-NE 3.08Å; E119-R122 IonicContact OE1-NH2 3.89Å; E119-R122 PolarHBondContact OE1-NH2 3.31Å; E119-R122 IonicContact OE2-CZ 3.84Å; E119-R122 IonicContact OE2-NE 3.09Å; E119-R122 PolarHBondContact OE2-NE 2.92Å; E119-L123 HydrophobicContact CG-CD1 4.29Å; E119-L123 WeakPolarHBondContact O-CG 3.19Å; E119-L123 PolarHBondContact O-N 3.4Å
120Q96.9Very high97Very high91 Ų91106.6 Ų106.643%0.42550%0.504SS..Hα-helixtrans-60.3-39.8173.9-71.4-56.1-70.300112.2F116 L117 K124F116-Q120 HydrophobicContact CD1-CG 4.15Å; F116-Q120 HydrophobicContact CD2-CG 4.36Å; F116-Q120 HydrophobicContact CE1-CG 3.65Å; F116-Q120 HydrophobicContact CE2-CG 3.89Å; F116-Q120 HydrophobicContact CG-CG 4.48Å; F116-Q120 HydrophobicContact CZ-CG 3.51Å; F116-Q120 WeakPolarHBondContact O-CG 3.46Å; F116-Q120 PolarHBondContact O-N 2.75Å; L117-Q120 PolarHBondContact O-N 3.23Å; Q120-K124 WeakPolarHBondContact O-CB 3.41Å; Q120-K124 PolarHBondContact O-N 2.94Å
121Q96.8Very high97Very high119 Ų119105.8 Ų105.856%0.55650%0.502SS*.Hα-helixtrans-65.9-44.6175.5179.4161.6-7.100111.7L117 K118 E119 L123 K124 E125L117-Q121 PolarHBondContact O-N 2.7Å; K118-Q121 PolarHBondContact O-N 3.45Å; E119-Q121 VanDerWaalsContact C-N 3.29Å; E119-Q121 PolarHBondContact O-N 2.99Å; Q121-L123 VanDerWaalsContact C-N 3.34Å; Q121-L123 PolarHBondContact O-N 3.08Å; Q121-K124 WeakPolarHBondContact O-CB 3.39Å; Q121-K124 PolarHBondContact O-N 2.94Å; Q121-E125 HydrophobicContact CG-CG 4.45Å; Q121-E125 WeakPolarHBondContact CG-OE1 3.48Å; Q121-E125 PolarHBondContact NE2-OE1 3.36Å; Q121-E125 WeakPolarHBondContact O-CG 3.48Å; Q121-E125 PolarHBondContact O-N 3.2Å
122R97.8Very high97Very high106 Ų106102.6 Ų102.640%0.450%0.498SS..Hα-helixtrans-56.7-47.8176-169.5-163.27069.20.7111.6K118 E119 K124 E125 E126K118-R122 PolarHBondContact O-N 2.89Å; E119-R122 WeakPolarHBondContact O-CB 3.37Å; E119-R122 PolarHBondContact O-N 2.91Å; E119-R122 IonicContact OE1-CZ 2.6Å; E119-R122 VanDerWaalsContact OE1-CZ 3.3Å; E119-R122 IonicContact OE1-NE 3.65Å; E119-R122 PolarHBondContact OE1-NE 3.39Å; E119-R122 VanDerWaalsContact OE1-NE 3.08Å; E119-R122 IonicContact OE1-NH2 3.89Å; E119-R122 PolarHBondContact OE1-NH2 3.31Å; E119-R122 IonicContact OE2-CZ 3.84Å; E119-R122 IonicContact OE2-NE 3.09Å; E119-R122 PolarHBondContact OE2-NE 2.92Å; R122-K124 VanDerWaalsContact C-N 3.33Å; R122-K124 PolarHBondContact O-N 2.69Å; R122-E125 PolarHBondContact O-N 3.43Å; R122-E126 IonicContact CZ-OE2 2.7Å; R122-E126 IonicContact NH1-OE2 2.99Å; R122-E126 PolarHBondContact NH1-OE2 3.01Å; R122-E126 IonicContact NH2-OE2 3.08Å; R122-E126 PolarHBondContact O-N 2.97Å
123L97.6Very high97Very high67 Ų67104.4 Ų104.435%0.35150%0.502SS..Hα-helixtrans-62.4-40178.3-73.5169.7000112E119 Q121 E126 V127E119-L123 HydrophobicContact CG-CD1 4.29Å; E119-L123 WeakPolarHBondContact O-CG 3.19Å; E119-L123 PolarHBondContact O-N 3.4Å; Q121-L123 VanDerWaalsContact C-N 3.34Å; Q121-L123 PolarHBondContact O-N 3.08Å; L123-E126 PolarHBondContact O-N 3.34Å; L123-V127 WeakPolarHBondContact O-CG2 3.33Å; L123-V127 PolarHBondContact O-N 3.43Å; L123-V127 VanDerWaalsContact O-N 3.08Å
124K96.8Very high96.9Very high134 Ų13499.3 Ų99.358%0.58349%0.492SS*.Hα-helixtrans-62.6-47.2175.5-176.3-170.8170.8-169.50111.4Q120 Q121 R122 E126 V127 D128Q120-K124 WeakPolarHBondContact O-CB 3.41Å; Q120-K124 PolarHBondContact O-N 2.94Å; Q121-K124 WeakPolarHBondContact O-CB 3.39Å; Q121-K124 PolarHBondContact O-N 2.94Å; R122-K124 VanDerWaalsContact C-N 3.33Å; R122-K124 PolarHBondContact O-N 2.69Å; K124-E126 VanDerWaalsContact C-N 3.29Å; K124-E126 PolarHBondContact O-N 3.08Å; K124-V127 PolarHBondContact O-N 3.46Å; K124-D128 WeakPolarHBondContact O-CB 3.46Å; K124-D128 PolarHBondContact O-N 3.03Å
125E96.7Very high96.8Very high105 Ų105100.1 Ų100.149%0.49149%0.491SS..Hα-helixtrans-60.9-39.7179.1-72.6170.1-173.200111.6Q121 R122 D128 E129Q121-E125 HydrophobicContact CG-CG 4.45Å; Q121-E125 WeakPolarHBondContact CG-OE1 3.48Å; Q121-E125 PolarHBondContact NE2-OE1 3.36Å; Q121-E125 WeakPolarHBondContact O-CG 3.48Å; Q121-E125 PolarHBondContact O-N 3.2Å; R122-E125 PolarHBondContact O-N 3.43Å; E125-D128 PolarHBondContact O-N 3.4Å; E125-E129 WeakPolarHBondContact O-CB 3.41Å; E125-E129 PolarHBondContact O-N 2.96Å
126E96.7Very high96.6Very high85 Ų8595.1 Ų95.140%0.39748%0.477SS..Hα-helixtrans-61.1-47.4174.9-175.6169.9-166.600111.9R122 L123 K124 E129 E130R122-E126 IonicContact CZ-OE2 2.7Å; R122-E126 IonicContact NH1-OE2 2.99Å; R122-E126 PolarHBondContact NH1-OE2 3.01Å; R122-E126 IonicContact NH2-OE2 3.08Å; R122-E126 PolarHBondContact O-N 2.97Å; L123-E126 PolarHBondContact O-N 3.34Å; K124-E126 VanDerWaalsContact C-N 3.29Å; K124-E126 PolarHBondContact O-N 3.08Å; E126-E129 PolarHBondContact O-N 3.27Å; E126-E130 WeakPolarHBondContact O-CG 3.38Å; E126-E130 PolarHBondContact O-N 3.45Å
127V97.6Very high96.5Very high90 Ų9096.1 Ų96.155%0.54548%0.483SS..Hα-helixtrans-64-42.9176.3171.90000111.7L123 K124 E129 E130 H131L123-V127 WeakPolarHBondContact O-CG2 3.33Å; L123-V127 PolarHBondContact O-N 3.43Å; L123-V127 VanDerWaalsContact O-N 3.08Å; K124-V127 PolarHBondContact O-N 3.46Å; V127-E129 VanDerWaalsContact C-N 3.31Å; V127-E129 PolarHBondContact O-N 3.13Å; V127-E130 PolarHBondContact O-N 2.9Å; V127-H131 VanDerWaalsContact O-CB 3.29Å; V127-H131 WeakPolarHBondContact O-CB 3.46Å; V127-H131 PolarHBondContact O-N 3.45Å
128D97Very high96.4Very high87 Ų8796.4 Ų96.447%0.46548%0.484SS..Hα-helixtrans-62.5-39.4178.1-76.4-22.7000110.9K124 E125 A132K124-D128 WeakPolarHBondContact O-CB 3.46Å; K124-D128 PolarHBondContact O-N 3.03Å; E125-D128 PolarHBondContact O-N 3.4Å; D128-A132 WeakPolarHBondContact O-CB 3.41Å; D128-A132 PolarHBondContact O-N 2.96Å
129E96.3Very high96.1Very high111 Ų11191.9 Ų91.952%0.51947%0.473SS..Hα-helixtrans-67.5-45.9176.3-168.5-174.8159.500112.1E125 E126 V127 H131 A132 K133E125-E129 WeakPolarHBondContact O-CB 3.41Å; E125-E129 PolarHBondContact O-N 2.96Å; E126-E129 PolarHBondContact O-N 3.27Å; V127-E129 VanDerWaalsContact C-N 3.31Å; V127-E129 PolarHBondContact O-N 3.13Å; E129-H131 VanDerWaalsContact C-N 3.34Å; E129-H131 PolarHBondContact O-N 2.97Å; E129-A132 PolarHBondContact O-N 3.31Å; E129-K133 WeakPolarHBondContact O-CG 3.29Å; E129-K133 PolarHBondContact O-N 3.49Å; E129-K133 WeakPolarHBondContact OE1-CE 3.34Å; E129-K133 IonicContact OE1-NZ 2.69Å; E129-K133 PolarHBondContact OE1-NZ 3.4Å
130E96Very high95.9Very high122 Ų12291.8 Ų91.857%0.5748%0.478SS*.Hα-helixtrans-60-44.3174.9-75.9-171165.200111.7E126 V127 K133 A134E126-E130 WeakPolarHBondContact O-CG 3.38Å; E126-E130 PolarHBondContact O-N 3.45Å; V127-E130 PolarHBondContact O-N 2.9Å; E130-K133 PolarHBondContact O-N 2.89Å; E130-A134 PolarHBondContact O-N 3.33Å
131H96Very high95.6Very high125 Ų12595.8 Ų95.858%0.57949%0.489SS*.Hα-helixtrans-62.2-44.6176.7179.9-92.2000111.4V127 E129 K133 A134 V135V127-H131 VanDerWaalsContact O-CB 3.29Å; V127-H131 WeakPolarHBondContact O-CB 3.46Å; V127-H131 PolarHBondContact O-N 3.45Å; E129-H131 VanDerWaalsContact C-N 3.34Å; E129-H131 PolarHBondContact O-N 2.97Å; H131-K133 VanDerWaalsContact C-N 3.34Å; H131-K133 PolarHBondContact O-N 3.41Å; H131-A134 PolarHBondContact O-N 2.95Å; H131-V135 WeakPolarHBondContact O-CG2 3.33Å; H131-V135 PolarHBondContact O-N 3.39Å
132A96.3Very high95.3Very high61 Ų6197 Ų9750%0.50449%0.493SS..Hα-helixtrans-60.8-4217700000112.2D128 E129 G136D128-A132 WeakPolarHBondContact O-CB 3.41Å; D128-A132 PolarHBondContact O-N 2.96Å; E129-A132 PolarHBondContact O-N 3.31Å; A132-G136 PolarHBondContact O-N 2.93Å
133K96.1Very high94.9Very high115 Ų11595 Ų9550%0.549%0.494SS..Hα-helixtrans-60.3-50.8174-74.3172-174.9161.20111.3E129 E130 H131 V135 G136 E137E129-K133 WeakPolarHBondContact O-CG 3.29Å; E129-K133 PolarHBondContact O-N 3.49Å; E129-K133 WeakPolarHBondContact OE1-CE 3.34Å; E129-K133 IonicContact OE1-NZ 2.69Å; E129-K133 PolarHBondContact OE1-NZ 3.4Å; E130-K133 PolarHBondContact O-N 2.89Å; H131-K133 VanDerWaalsContact C-N 3.34Å; H131-K133 PolarHBondContact O-N 3.41Å; K133-V135 PolarHBondContact O-N 3.46Å; K133-G136 PolarHBondContact O-N 2.88Å; K133-G136 VanDerWaalsContact O-N 3.13Å; K133-E137 WeakPolarHBondContact O-CG 3.48Å; K133-E137 PolarHBondContact O-N 2.76Å
134A95.4Very high94.5Very high44 Ų4496.8 Ų96.836%0.36450%0.501SS..Hα-helixtrans-59.6-44.1-179.800000112.4E130 H131 E137 I138E130-A134 PolarHBondContact O-N 3.33Å; H131-A134 PolarHBondContact O-N 2.95Å; A134-E137 PolarHBondContact O-N 3.4Å; A134-I138 WeakPolarHBondContact O-CB 3.36Å; A134-I138 VanDerWaalsContact O-CG1 3.25Å; A134-I138 WeakPolarHBondContact O-CG1 3.43Å; A134-I138 PolarHBondContact O-N 2.9Å
135V95.4Very high94Very high75 Ų7597.1 Ų97.146%0.45550%0.503SS..Hα-helixtrans-63.6-41.6175.7171.60000111.3H131 K133 I138 S139H131-V135 WeakPolarHBondContact O-CG2 3.33Å; H131-V135 PolarHBondContact O-N 3.39Å; K133-V135 PolarHBondContact O-N 3.46Å; V135-I138 PolarHBondContact O-N 3.32Å; V135-S139 WeakPolarHBondContact O-CB 3.44Å; V135-S139 PolarHBondContact O-N 2.94Å
136G94.4Very high93.4Very high34 Ų3499.3 Ų99.335%0.35151%0.511SS..Hα-helixtrans-61.5-44.2176.300000112.8A132 K133 S139 T140A132-G136 PolarHBondContact O-N 2.93Å; K133-G136 PolarHBondContact O-N 2.88Å; K133-G136 VanDerWaalsContact O-N 3.13Å; G136-S139 PolarHBondContact O-N 3.41Å; G136-T140 WeakPolarHBondContact O-CB 3.49Å; G136-T140 PolarHBondContact O-N 3.31Å; G136-T140 PolarHBondContact O-OG1 3.43Å
137E94.8Very high92.8Very high118 Ų118102.3 Ų102.355%0.55152%0.522SS*.Hα-helixtrans-61.6-46.7175.2-72.6-179.6-17300111.8K133 A134 S139 T140 R141K133-E137 WeakPolarHBondContact O-CG 3.48Å; K133-E137 PolarHBondContact O-N 2.76Å; A134-E137 PolarHBondContact O-N 3.4Å; E137-S139 PolarHBondContact O-N 3.39Å; E137-T140 PolarHBondContact O-N 3.25Å; E137-R141 WeakPolarHBondContact O-CG 3.46Å; E137-R141 PolarHBondContact O-N 2.86Å
138I94.4Very high92.1Very high92 Ų92101.8 Ų101.847%0.47252%0.516SS..Hα-helixtrans-59-48.9177.1-71.4168.3000110.4A134 V135 T140 R141 F142A134-I138 WeakPolarHBondContact O-CB 3.36Å; A134-I138 VanDerWaalsContact O-CG1 3.25Å; A134-I138 WeakPolarHBondContact O-CG1 3.43Å; A134-I138 PolarHBondContact O-N 2.9Å; V135-I138 PolarHBondContact O-N 3.32Å; I138-T140 VanDerWaalsContact C-N 3.3Å; I138-T140 PolarHBondContact O-N 2.97Å; I138-R141 PolarHBondContact O-N 3.06Å; I138-F142 HydrophobicContact CG2-CD2 3.53Å; I138-F142 HydrophobicContact CG2-CE2 3.48Å; I138-F142 VanDerWaalsContact CG2-CE2 3.48Å; I138-F142 VanDerWaalsContact O-CD2 3.24Å; I138-F142 WeakPolarHBondContact O-CD2 3.38Å; I138-F142 PolarHBondContact O-N 2.97Å
139S92.9Very high91.1Very high69 Ų69102.9 Ų102.948%0.48352%0.522SS..Hα-helixtrans-61.5-39-179.9-159.10000112.2V135 G136 E137 F142 S143V135-S139 WeakPolarHBondContact O-CB 3.44Å; V135-S139 PolarHBondContact O-N 2.94Å; G136-S139 PolarHBondContact O-N 3.41Å; E137-S139 PolarHBondContact O-N 3.39Å; S139-F142 PolarHBondContact O-N 2.95Å; S139-S143 WeakPolarHBondContact O-CB 3.41Å; S139-S143 PolarHBondContact O-N 2.93Å; S139-S143 PolarHBondContact O-OG 2.92Å
140T92.4Very high90.1Very high77 Ų77102 Ų10247%0.47252%0.523SS..Hα-helixtrans-61.6-51.4174.2-54.80000111G136 E137 I138 F142 S143 E144G136-T140 WeakPolarHBondContact O-CB 3.49Å; G136-T140 PolarHBondContact O-N 3.31Å; G136-T140 PolarHBondContact O-OG1 3.43Å; E137-T140 PolarHBondContact O-N 3.25Å; I138-T140 VanDerWaalsContact C-N 3.3Å; I138-T140 PolarHBondContact O-N 2.97Å; T140-F142 VanDerWaalsContact C-N 3.33Å; T140-F142 PolarHBondContact O-N 3Å; T140-S143 WeakPolarHBondContact O-CB 3.41Å; T140-S143 PolarHBondContact O-N 3.47Å; T140-E144 WeakPolarHBondContact O-CG 3.25Å; T140-E144 PolarHBondContact O-N 3.04Å
141R90.8Very high88.7Confident176 Ų176103.1 Ų103.166%0.66453%0.529SS*.Hα-helixtrans-58.3-41.9177.4-73-179.4-178.6-171.94.4112.8E137 I138 S143 K145E137-R141 WeakPolarHBondContact O-CG 3.46Å; E137-R141 PolarHBondContact O-N 2.86Å; I138-R141 PolarHBondContact O-N 3.06Å; R141-S143 VanDerWaalsContact C-N 3.34Å; R141-K145 WeakPolarHBondContact O-CB 3.47Å; R141-K145 PolarHBondContact O-N 2.94Å
142F90.6Very high87Confident145 Ų145105.8 Ų105.864%0.63654%0.539SS*.Hα-helixtrans-64.4-39.8175.7-87.2-69.5000111.9I138 S139 T140 K146I138-F142 HydrophobicContact CG2-CD2 3.53Å; I138-F142 HydrophobicContact CG2-CE2 3.48Å; I138-F142 VanDerWaalsContact CG2-CE2 3.48Å; I138-F142 VanDerWaalsContact O-CD2 3.24Å; I138-F142 WeakPolarHBondContact O-CD2 3.38Å; I138-F142 PolarHBondContact O-N 2.97Å; S139-F142 PolarHBondContact O-N 2.95Å; T140-F142 VanDerWaalsContact C-N 3.33Å; T140-F142 PolarHBondContact O-N 3Å; F142-K146 VanDerWaalsContact O-CB 3.28Å; F142-K146 WeakPolarHBondContact O-CB 3.24Å; F142-K146 PolarHBondContact O-N 3.35Å
143S88.5Confident85Confident62 Ų62107.5 Ų107.543%0.43455%0.547SS..Hα-helixtrans-66.3-41.5178.3-62.40000112.4S139 T140 R141 K146 K147S139-S143 WeakPolarHBondContact O-CB 3.41Å; S139-S143 PolarHBondContact O-N 2.93Å; S139-S143 PolarHBondContact O-OG 2.92Å; T140-S143 WeakPolarHBondContact O-CB 3.41Å; T140-S143 PolarHBondContact O-N 3.47Å; R141-S143 VanDerWaalsContact C-N 3.34Å; S143-K146 PolarHBondContact O-N 3.49Å; S143-K147 WeakPolarHBondContact O-CG 3.28Å; S143-K147 PolarHBondContact O-N 3.01Å
144E89.2Confident82.6Confident106 Ų106112 Ų11250%0.49558%0.576SS.*Hα-helixtrans-61.3-53.6173.5-71.6170.7170.300111.1T140 K146 K147 D148T140-E144 WeakPolarHBondContact O-CG 3.25Å; T140-E144 PolarHBondContact O-N 3.04Å; E144-K146 PolarHBondContact O-N 3.18Å; E144-K147 WeakPolarHBondContact O-CA 3.49Å; E144-K147 WeakPolarHBondContact O-CB 3.44Å; E144-K147 PolarHBondContact O-N 2.92Å; E144-D148 PolarHBondContact O-N 2.93Å
145K86.3Confident82Confident140 Ų140115.5 Ų115.561%0.60959%0.587SS**Hα-helixtrans-58.7-35.1178.5-166171.8-174.11770112.5R141 D148 L149R141-K145 WeakPolarHBondContact O-CB 3.47Å; R141-K145 PolarHBondContact O-N 2.94Å; K145-D148 PolarHBondContact O-N 3.41Å; K145-L149 HydrophobicContact CG-CD1 4.46Å; K145-L149 WeakPolarHBondContact O-CB 3.49Å; K145-L149 WeakPolarHBondContact O-CD1 3.18Å; K145-L149 WeakPolarHBondContact O-CG 3.41Å; K145-L149 PolarHBondContact O-N 3.03Å
146K83.8Confident81.3Confident152 Ų152117.6 Ų117.666%0.66159%0.594SS**Hα-helixtrans-65.6-40.1173.7-171.8179.7-179.5-1800111.8F142 S143 E144 V150F142-K146 VanDerWaalsContact O-CB 3.28Å; F142-K146 WeakPolarHBondContact O-CB 3.24Å; F142-K146 PolarHBondContact O-N 3.35Å; S143-K146 PolarHBondContact O-N 3.49Å; E144-K146 PolarHBondContact O-N 3.18Å; K146-V150 VanDerWaalsContact O-CG2 3.29Å; K146-V150 WeakPolarHBondContact O-CG2 3.42Å; K146-V150 PolarHBondContact O-N 2.98Å
147K84.6Confident80.6Confident147 Ų147122.2 Ų122.264%0.63961%0.607SS**Hα-helixtrans-65.4-44.3174.2-72.8176.6-179176.70111.5S143 E144 L149 V150 Q151S143-K147 WeakPolarHBondContact O-CG 3.28Å; S143-K147 PolarHBondContact O-N 3.01Å; E144-K147 WeakPolarHBondContact O-CA 3.49Å; E144-K147 WeakPolarHBondContact O-CB 3.44Å; E144-K147 PolarHBondContact O-N 2.92Å; K147-L149 VanDerWaalsContact C-N 3.33Å; K147-L149 PolarHBondContact O-N 2.92Å; K147-V150 WeakPolarHBondContact O-CB 3.41Å; K147-V150 PolarHBondContact O-N 3.31Å; K147-V150 VanDerWaalsContact O-N 3.12Å; K147-Q151 PolarHBondContact O-N 3.19Å
148D83.3Confident79.7Confident79 Ų79122.5 Ų122.542%0.42261%0.611SS.*Hα-helixtrans-60.1-44.7177.3-63.3-17000110.8E144 K145 V150 Q151 F152E144-D148 PolarHBondContact O-N 2.93Å; K145-D148 PolarHBondContact O-N 3.41Å; D148-V150 VanDerWaalsContact C-N 3.28Å; D148-V150 PolarHBondContact O-N 3.12Å; D148-Q151 CarbonylContact O-C 3.59Å; D148-Q151 WeakPolarHBondContact O-CA 3.37Å; D148-Q151 WeakPolarHBondContact O-CB 3.29Å; D148-Q151 PolarHBondContact O-N 3.5Å; D148-F152 WeakPolarHBondContact O-CD2 3.49Å; D148-F152 PolarHBondContact O-N 3.44Å
149L75.7Confident78.8Confident111 Ų111124.4 Ų124.458%0.58162%0.619SS**Hα-helixtrans-56.1-40.6174.4-84.6158.5000112.7K145 K147 Q151 F152 S153K145-L149 HydrophobicContact CG-CD1 4.46Å; K145-L149 WeakPolarHBondContact O-CB 3.49Å; K145-L149 WeakPolarHBondContact O-CD1 3.18Å; K145-L149 WeakPolarHBondContact O-CG 3.41Å; K145-L149 PolarHBondContact O-N 3.03Å; K147-L149 VanDerWaalsContact C-N 3.33Å; K147-L149 PolarHBondContact O-N 2.92Å; L149-Q151 VanDerWaalsContact C-N 3.35Å; L149-F152 PolarHBondContact O-N 2.97Å; L149-S153 PolarHBondContact O-N 3.48Å; L149-S153 PolarHBondContact O-OG 2.65Å
150V74.5Confident77.9Confident91 Ų91128.1 Ų128.155%0.55263%0.628SS**Hα-helixtrans-69.6-32.4176.6174.10000111.5K146 K147 D148 S153K146-V150 VanDerWaalsContact O-CG2 3.29Å; K146-V150 WeakPolarHBondContact O-CG2 3.42Å; K146-V150 PolarHBondContact O-N 2.98Å; K147-V150 WeakPolarHBondContact O-CB 3.41Å; K147-V150 PolarHBondContact O-N 3.31Å; K147-V150 VanDerWaalsContact O-N 3.12Å; D148-V150 VanDerWaalsContact C-N 3.28Å; D148-V150 PolarHBondContact O-N 3.12Å; V150-S153 WeakPolarHBondContact CA-OG 3.5Å; V150-S153 PolarHBondContact O-OG 3.29Å
151Q68.4Low76.8Confident146 Ų146131.7 Ų131.768%0.68264%0.639SS**Hα-helixtrans-73.7-29.4173.9-72.4-172.9-17.300113.4K147 D148 L149K147-Q151 PolarHBondContact O-N 3.19Å; D148-Q151 CarbonylContact O-C 3.59Å; D148-Q151 WeakPolarHBondContact O-CA 3.37Å; D148-Q151 WeakPolarHBondContact O-CB 3.29Å; D148-Q151 PolarHBondContact O-N 3.5Å; L149-Q151 VanDerWaalsContact C-N 3.35Å
152F60.2Low75.7Confident181 Ų181128.3 Ų128.379%0.79464%0.638SS**THydrogen-bonded Turntrans-83.5-4.7175.2-79.5-70.8000114.5D148 L149D148-F152 WeakPolarHBondContact O-CD2 3.49Å; D148-F152 PolarHBondContact O-N 3.44Å; L149-F152 PolarHBondContact O-N 2.97Å
153S53.4Low74.5Confident97 Ų97126.9 Ų126.968%0.67864%0.638SS**THydrogen-bonded Turntrans-109.217.2179.739.10000114.2L149 V150L149-S153 PolarHBondContact O-N 3.48Å; L149-S153 PolarHBondContact O-OG 2.65Å; V150-S153 WeakPolarHBondContact CA-OG 3.5Å; V150-S153 PolarHBondContact O-OG 3.29Å
154L46.3Very low73.2Confident211 Ų211132.8 Ų132.8100%1.10566%0.656SS**  trans-110.50161-85.8159.4000109.2

Retrieved 154 of 154 residues in 137.2 ms (Link to these results)