A0A077ZFI2_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZFI2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 155 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M42.7Very low54.5Low249 Ų249126.3 Ų126.3100%1.22771%0.713SS**  0900-116.3174.3173.800106.4
2E42.4Very low57.1Low196 Ų196118.3 Ų118.392%0.91667%0.666SS**  trans-86.2117.5176.1-95175.5135.700108.5
3M48.6Very low59.5Low167 Ų167114.7 Ų114.782%0.82364%0.64SS**  trans-99.693169.8-71.4-75.2-76.800107.3T5M3-T5 PolarHBondContact O-N 3.4Å
4A51.1Low61.8Low90 Ų90108.6 Ų108.674%0.74462%0.617SS**  trans-74.9102.9173.700000109.6P6A4-P6 VanDerWaalsContact C-CD 3.49Å
5T55.1Low63.7Low120 Ų120101.6 Ų101.674%0.73658%0.576SS**  trans-119.146.7173.148.30000114.8M3M3-T5 PolarHBondContact O-N 3.4Å
6P51.8Low65.4Low79 Ų79102.8 Ų102.851%0.51357%0.569SS.*  trans-104.1-12-170.311.512000116.7A4A4-P6 VanDerWaalsContact C-CD 3.49Å
7N54.7Low67.1Low139 Ų139104.5 Ų104.574%0.74357%0.569SS**Hα-helixtrans-94.9-21.7-163.8-69-8.5000115.9
8V55.4Low68.6Low92 Ų92106.6 Ų106.656%0.55857%0.567SS**Hα-helixtrans-86.2-29.1-176.8-178.10000112.2M12 W69V8-M12 PolarHBondContact O-N 3Å; V8-W69 HydrophobicContact CG1-CE3 4.25Å; V8-W69 HydrophobicContact CG1-CZ3 4.08Å
9S56.7Low69.9Low77 Ų77102.2 Ų102.254%0.53854%0.542SS..Hα-helixtrans-73.8-31.4-178.458.50000113.3D11 E13S9-D11 VanDerWaalsContact C-N 3.32Å; S9-D11 PolarHBondContact O-N 2.86Å; S9-E13 PolarHBondContact O-N 2.82Å
10V58.8Low71.1Confident109 Ų109100 Ų10066%0.66154%0.535SS*.Hα-helixtrans-66.2-36.4-179.9177.70000111.2G14V10-G14 PolarHBondContact O-N 3.5Å
11D82.4Confident72.3Confident71 Ų7196.7 Ų96.738%0.3853%0.525SS..Hα-helixtrans-74.2-43180-162.529.6000111.8S9 E13 G14 L15S9-D11 VanDerWaalsContact C-N 3.32Å; S9-D11 PolarHBondContact O-N 2.86Å; D11-E13 PolarHBondContact O-N 2.78Å; D11-G14 WeakPolarHBondContact O-CA 3.34Å; D11-G14 PolarHBondContact O-N 3.39Å; D11-G14 VanDerWaalsContact O-N 3.09Å; D11-L15 WeakPolarHBondContact O-CG 3.44Å; D11-L15 PolarHBondContact O-N 2.9Å
12M85.8Confident74.9Confident31 Ų3185.4 Ų85.415%0.15347%0.47CS..Hα-helixtrans-63.3-39.6178.9-79.2-60.1-83.800114V8 G14 L15 R16 F66 W69 L70V8-M12 PolarHBondContact O-N 3Å; M12-G14 VanDerWaalsContact C-N 3.31Å; M12-L15 PolarHBondContact O-N 3.31Å; M12-L15 HydrophobicContact SD-CD1 4.19Å; M12-R16 WeakPolarHBondContact O-CB 3.47Å; M12-R16 PolarHBondContact O-N 3.47Å; M12-F66 HydrophobicContact CE-CD2 3.88Å; M12-F66 HydrophobicContact CE-CE2 3.57Å; M12-F66 HydrophobicContact CE-CZ 4.05Å; M12-F66 HydrophobicContact SD-CD2 4.23Å; M12-F66 HydrophobicContact SD-CE2 4.31Å; M12-W69 HydrophobicContact CE-CB 3.67Å; M12-W69 HydrophobicContact CG-CB 4.24Å; M12-W69 HydrophobicContact SD-CB 3.14Å; M12-W69 WeakPolarHBondContact SD-CB 3.44Å; M12-W69 HydrophobicContact SD-CG 3.62Å; M12-L70 HydrophobicContact CE-CD2 4.15Å
13E88.2Confident77.4Confident71 Ų7180.6 Ų80.633%0.33244%0.443SS..Hα-helixtrans-67.9-35175.2-175.357-156.100111.3S9 D11 R16 K17S9-E13 PolarHBondContact O-N 2.82Å; D11-E13 PolarHBondContact O-N 2.78Å; E13-R16 IonicContact OE2-CZ 2.78Å; E13-R16 IonicContact OE2-NH1 2.77Å; E13-R16 PolarHBondContact OE2-NH1 3.26Å; E13-K17 HydrophobicContact CG-CD 4.44Å; E13-K17 WeakPolarHBondContact O-CB 3.45Å; E13-K17 WeakPolarHBondContact O-CG 3.28Å; E13-K17 PolarHBondContact O-N 3.24Å; E13-K17 WeakPolarHBondContact OE1-CE 3.46Å; E13-K17 IonicContact OE1-NZ 3.98Å
14G91.3Very high79.8Confident30 Ų3076 Ų7631%0.30943%0.427SS..Hα-helixtrans-60.7-49.5172.200000112.3V10 D11 M12 K17 R18V10-G14 PolarHBondContact O-N 3.5Å; D11-G14 WeakPolarHBondContact O-CA 3.34Å; D11-G14 PolarHBondContact O-N 3.39Å; D11-G14 VanDerWaalsContact O-N 3.09Å; M12-G14 VanDerWaalsContact C-N 3.31Å; G14-K17 PolarHBondContact O-N 3.39Å; G14-R18 WeakPolarHBondContact O-CG 3.04Å; G14-R18 PolarHBondContact O-N 3.42Å
15L91.1Very high82Confident3 Ų377.3 Ų77.32%0.01641%0.413CS..Hα-helixtrans-60.7-45.7176.3-68174.4000111.9D11 M12 K17 R18 R19 V62 E65 F66D11-L15 WeakPolarHBondContact O-CG 3.44Å; D11-L15 PolarHBondContact O-N 2.9Å; M12-L15 PolarHBondContact O-N 3.31Å; M12-L15 HydrophobicContact SD-CD1 4.19Å; L15-K17 VanDerWaalsContact C-N 3.33Å; L15-K17 PolarHBondContact O-N 3.31Å; L15-R18 PolarHBondContact O-N 3.05Å; L15-R19 VanDerWaalsContact O-CB 3.28Å; L15-R19 WeakPolarHBondContact O-CB 3.43Å; L15-R19 PolarHBondContact O-N 3.08Å; L15-V62 HydrophobicContact CD2-CG1 4.38Å; L15-E65 HydrophobicContact CD1-CG 3.89Å; L15-E65 HydrophobicContact CD2-CB 4.31Å; L15-E65 VanDerWaalsContact CD2-CD 3.42Å; L15-E65 HydrophobicContact CD2-CG 3.93Å; L15-E65 VanDerWaalsContact CD2-OE2 3.3Å; L15-E65 WeakPolarHBondContact CD2-OE2 3.47Å; L15-F66 HydrophobicContact CB-CD2 3.87Å
16R90.9Very high84.1Confident120 Ų12071.6 Ų71.645%0.45338%0.378SS..Hα-helixtrans-58-44.2176.5-175-174-69.5153.6-8112M12 E13 S20 F66M12-R16 WeakPolarHBondContact O-CB 3.47Å; M12-R16 PolarHBondContact O-N 3.47Å; E13-R16 IonicContact OE2-CZ 2.78Å; E13-R16 IonicContact OE2-NH1 2.77Å; E13-R16 PolarHBondContact OE2-NH1 3.26Å; R16-S20 WeakPolarHBondContact O-CB 3.47Å; R16-S20 PolarHBondContact O-N 3.02Å; R16-S20 PolarHBondContact O-OG 3.05Å; R16-F66 HydrophobicContact CB-CE2 4.09Å
17K93.3Very high86.2Confident133 Ų13369 Ų6958%0.57837%0.366SS*.Hα-helixtrans-65.9-45.1176.9-76.9176.1-179.7170.30112.2E13 G14 L15 S20 G21E13-K17 HydrophobicContact CG-CD 4.44Å; E13-K17 WeakPolarHBondContact O-CB 3.45Å; E13-K17 WeakPolarHBondContact O-CG 3.28Å; E13-K17 PolarHBondContact O-N 3.24Å; E13-K17 WeakPolarHBondContact OE1-CE 3.46Å; E13-K17 IonicContact OE1-NZ 3.98Å; G14-K17 PolarHBondContact O-N 3.39Å; L15-K17 VanDerWaalsContact C-N 3.33Å; L15-K17 PolarHBondContact O-N 3.31Å; K17-S20 WeakPolarHBondContact CA-OG 3.3Å; K17-S20 PolarHBondContact O-N 3.34Å; K17-S20 PolarHBondContact O-OG 2.83Å; K17-S20 VanDerWaalsContact O-OG 3.05Å; K17-G21 PolarHBondContact O-N 3.13Å
18R93.7Very high88.3Confident141 Ų14169.6 Ų69.653%0.53236%0.358SS..Hα-helixtrans-60-48.3177.1-74.4178.366.6-149.8-2.4111G14 L15 G21 L22 V62 E65G14-R18 WeakPolarHBondContact O-CG 3.04Å; G14-R18 PolarHBondContact O-N 3.42Å; L15-R18 PolarHBondContact O-N 3.05Å; R18-G21 PolarHBondContact O-N 3.36Å; R18-L22 WeakPolarHBondContact O-CG 3.04Å; R18-L22 PolarHBondContact O-N 3.44Å; R18-V62 HydrophobicContact CB-CG1 4.21Å; R18-E65 IonicContact NH1-OE2 3.01Å
19R94Very high90.4Very high24 Ų2466.8 Ų66.89%0.09134%0.339CS..Hα-helixtrans-60.8-49.7178.5-173.3-17262.5174.15.9112.6L15 G21 L22 R23 F59 V62 E79L15-R19 VanDerWaalsContact O-CB 3.28Å; L15-R19 WeakPolarHBondContact O-CB 3.43Å; L15-R19 PolarHBondContact O-N 3.08Å; R19-G21 VanDerWaalsContact C-N 3.3Å; R19-G21 PolarHBondContact O-N 3.35Å; R19-L22 PolarHBondContact O-N 3.27Å; R19-R23 PolarHBondContact O-N 3.02Å; R19-F59 HydrophobicContact CG-CD2 4.11Å; R19-F59 HydrophobicContact CG-CE2 3.46Å; R19-F59 VanDerWaalsContact CG-CE2 3.46Å; R19-F59 HydrophobicContact CG-CZ 4.03Å; R19-V62 HydrophobicContact CB-CG1 3.85Å; R19-E79 IonicContact CZ-OE1 2.8Å; R19-E79 IonicContact CZ-OE2 3.41Å; R19-E79 IonicContact NH1-OE1 3.08Å; R19-E79 PolarHBondContact NH1-OE1 2.7Å; R19-E79 IonicContact NH1-OE2 2.88Å; R19-E79 PolarHBondContact NH1-OE2 2.89Å; R19-E79 IonicContact NH2-OE1 3.71Å; R19-E79 PolarHBondContact NH2-OE1 3.4Å; R19-E79 IonicContact NH2-OE2 3.85Å; R19-E79 PolarHBondContact NH2-OE2 3.45Å
20S93.5Very high92.3Very high57 Ų5764.3 Ų64.340%0.39932%0.32SS..Hα-helixtrans-64.8-35.417957.90000112.1R16 K17 S24R16-S20 WeakPolarHBondContact O-CB 3.47Å; R16-S20 PolarHBondContact O-N 3.02Å; R16-S20 PolarHBondContact O-OG 3.05Å; K17-S20 WeakPolarHBondContact CA-OG 3.3Å; K17-S20 PolarHBondContact O-N 3.34Å; K17-S20 PolarHBondContact O-OG 2.83Å; K17-S20 VanDerWaalsContact O-OG 3.05Å; S20-S24 WeakPolarHBondContact O-CB 3.39Å; S20-S24 PolarHBondContact O-N 3.3Å; S20-S24 PolarHBondContact O-OG 2.89Å
21G96.9Very high94.2Very high32 Ų3265.3 Ų65.333%0.3332%0.317SS..Hα-helixtrans-62.6-46.217200000112.9K17 R18 R19 S24 R25K17-G21 PolarHBondContact O-N 3.13Å; R18-G21 PolarHBondContact O-N 3.36Å; R19-G21 VanDerWaalsContact C-N 3.3Å; R19-G21 PolarHBondContact O-N 3.35Å; G21-S24 PolarHBondContact O-N 3.46Å; G21-R25 VanDerWaalsContact O-CG 3.3Å; G21-R25 WeakPolarHBondContact O-CG 3.35Å; G21-R25 PolarHBondContact O-N 3.47Å
22L96.8Very high94.9Very high11 Ų1164.1 Ų64.16%0.05831%0.311CS..Hα-helixtrans-61.9-48.7175.2-75167.4000111.4R18 R19 S24 R25 I26 L55 E58 F59 V62R18-L22 WeakPolarHBondContact O-CG 3.04Å; R18-L22 PolarHBondContact O-N 3.44Å; R19-L22 PolarHBondContact O-N 3.27Å; L22-S24 VanDerWaalsContact C-N 3.31Å; L22-S24 PolarHBondContact O-N 3.29Å; L22-R25 PolarHBondContact O-N 3.42Å; L22-R25 VanDerWaalsContact O-N 3.11Å; L22-I26 WeakPolarHBondContact O-CG1 3.43Å; L22-I26 PolarHBondContact O-N 3.22Å; L22-L55 HydrophobicContact CD2-CD2 4.14Å; L22-E58 HydrophobicContact CD1-CB 4.15Å; L22-E58 HydrophobicContact CD2-CB 4.08Å; L22-E58 WeakPolarHBondContact CD2-OE2 3.32Å; L22-F59 HydrophobicContact CB-CB 4.33Å; L22-F59 HydrophobicContact CB-CD2 3.98Å; L22-F59 HydrophobicContact CD1-CB 4.45Å; L22-V62 HydrophobicContact CD1-CB 4.37Å; L22-V62 HydrophobicContact CD1-CG2 3.92Å
23R96.2Very high95.5Very high96 Ų9662.7 Ų62.736%0.36230%0.304SS..Hα-helixtrans-55.6-45.3175.8-177.4174.6175.5149.5-7.5111.9R19 R25 I26 G27 F59 D82 L86R19-R23 PolarHBondContact O-N 3.02Å; R23-R25 PolarHBondContact O-N 3.29Å; R23-I26 PolarHBondContact O-N 2.99Å; R23-G27 PolarHBondContact O-N 3.45Å; R23-F59 HydrophobicContact CB-CD2 4.49Å; R23-F59 HydrophobicContact CB-CE2 4Å; R23-D82 IonicContact CZ-OD1 3.27Å; R23-D82 VanDerWaalsContact NH1-CB 3.32Å; R23-D82 PolarHBondContact NH1-O 3.44Å; R23-D82 IonicContact NH1-OD1 3.49Å; R23-D82 PolarHBondContact NH1-OD1 2.78Å; R23-D82 IonicContact NH1-OD2 3.06Å; R23-D82 IonicContact NH2-OD1 3.54Å; R23-D82 PolarHBondContact NH2-OD1 3.35Å; R23-L86 HydrophobicContact CG-CD1 4.43Å; R23-L86 HydrophobicContact CG-CD2 4.35Å
24S97.4Very high95.9Very high70 Ų7064 Ų6449%0.4931%0.31SS..Hα-helixtrans-66.6-34.5178.8-580000113S20 G21 L22 R28S20-S24 WeakPolarHBondContact O-CB 3.39Å; S20-S24 PolarHBondContact O-N 3.3Å; S20-S24 PolarHBondContact O-OG 2.89Å; G21-S24 PolarHBondContact O-N 3.46Å; L22-S24 VanDerWaalsContact C-N 3.31Å; L22-S24 PolarHBondContact O-N 3.29Å; S24-R28 WeakPolarHBondContact O-CG 3.48Å; S24-R28 PolarHBondContact O-N 3.3Å; S24-R28 PolarHBondContact O-NE 3.27Å
25R98.1Very high96.2Very high118 Ų11868 Ų6845%0.44532%0.316SS..Hα-helixtrans-69.1-44.9173.8-72.1170.570.8-1661.3111.1G21 L22 R23 R28 L29 L55G21-R25 VanDerWaalsContact O-CG 3.3Å; G21-R25 WeakPolarHBondContact O-CG 3.35Å; G21-R25 PolarHBondContact O-N 3.47Å; L22-R25 PolarHBondContact O-N 3.42Å; L22-R25 VanDerWaalsContact O-N 3.11Å; R23-R25 PolarHBondContact O-N 3.29Å; R25-R28 PolarHBondContact O-N 3.4Å; R25-L29 WeakPolarHBondContact O-CG 3.3Å; R25-L29 PolarHBondContact O-N 3.07Å; R25-L29 VanDerWaalsContact O-N 3.08Å; R25-L55 HydrophobicContact CB-CD1 3.91Å
26I98.2Very high96.5Very high0 Ų069.3 Ų69.30%032%0.321CS..Hα-helixtrans-60-47.2175.7-66.9164.1000110.1L22 R23 R28 L29 L30 V52 L55 L56 F59 L86 V90L22-I26 WeakPolarHBondContact O-CG1 3.43Å; L22-I26 PolarHBondContact O-N 3.22Å; R23-I26 PolarHBondContact O-N 2.99Å; I26-R28 PolarHBondContact O-N 3.48Å; I26-L29 PolarHBondContact O-N 3.11Å; I26-L29 VanDerWaalsContact O-N 3.1Å; I26-L30 HydrophobicContact CG2-CD1 4Å; I26-L30 HydrophobicContact CG2-CG 4.23Å; I26-L30 WeakPolarHBondContact O-CG 3.36Å; I26-L30 PolarHBondContact O-N 3.4Å; I26-V52 HydrophobicContact CG2-CG1 4.17Å; I26-L55 HydrophobicContact CD1-CB 4.17Å; I26-L55 HydrophobicContact CG1-CB 3.73Å; I26-L55 HydrophobicContact CG1-CD1 4.4Å; I26-L56 HydrophobicContact CD1-CD1 4.43Å; I26-F59 HydrophobicContact CD1-CB 4.01Å; I26-F59 HydrophobicContact CD1-CG 4.39Å; I26-L86 HydrophobicContact CB-CD1 4.33Å; I26-L86 HydrophobicContact CD1-CD2 4.02Å; I26-L86 HydrophobicContact CG2-CD1 3.71Å; I26-L86 HydrophobicContact CG2-CG 4.45Å; I26-V90 HydrophobicContact CG2-CG2 4.18Å
27G97.7Very high96.7Very high25 Ų2565.4 Ų65.426%0.25831%0.309SS..Hα-helixtrans-54.3-49177.400000113R23 L29 L30 E31R23-G27 PolarHBondContact O-N 3.45Å; G27-L29 VanDerWaalsContact C-N 3.33Å; G27-L29 PolarHBondContact O-N 3.03Å; G27-L30 PolarHBondContact O-N 2.84Å; G27-L30 VanDerWaalsContact O-N 3.14Å; G27-E31 WeakPolarHBondContact O-CG 3.49Å; G27-E31 PolarHBondContact O-N 2.67Å
28R98.3Very high96.8Very high151 Ų15163.8 Ų63.857%0.5732%0.315SS*.Hα-helixtrans-62.4-36.3176.4-73.7-176.5-69.4175.3-2.2113.4S24 R25 I26 N32S24-R28 WeakPolarHBondContact O-CG 3.48Å; S24-R28 PolarHBondContact O-N 3.3Å; S24-R28 PolarHBondContact O-NE 3.27Å; R25-R28 PolarHBondContact O-N 3.4Å; I26-R28 PolarHBondContact O-N 3.48Å; R28-N32 PolarHBondContact O-N 2.99Å; R28-N32 VanDerWaalsContact O-N 3.08Å; R28-N32 PolarHBondContact O-ND2 3.48Å
29L98.2Very high96.9Very high32 Ų3262.3 Ų62.317%0.16831%0.314CS..Hα-helixtrans-68.5-38.8174.6-70177.7000111.4R25 I26 G27 N32 V33 T48 L51 V52 L55R25-L29 WeakPolarHBondContact O-CG 3.3Å; R25-L29 PolarHBondContact O-N 3.07Å; R25-L29 VanDerWaalsContact O-N 3.08Å; I26-L29 PolarHBondContact O-N 3.11Å; I26-L29 VanDerWaalsContact O-N 3.1Å; G27-L29 VanDerWaalsContact C-N 3.33Å; G27-L29 PolarHBondContact O-N 3.03Å; L29-N32 WeakPolarHBondContact O-CB 3.43Å; L29-N32 PolarHBondContact O-N 3.26Å; L29-V33 WeakPolarHBondContact O-CG2 3.42Å; L29-V33 PolarHBondContact O-N 2.94Å; L29-T48 HydrophobicContact CB-CG2 4.28Å; L29-T48 HydrophobicContact CD2-CG2 4.01Å; L29-L51 HydrophobicContact CD1-CB 4.1Å; L29-V52 HydrophobicContact CB-CG2 3.5Å; L29-V52 VanDerWaalsContact CB-CG2 3.5Å; L29-V52 HydrophobicContact CD1-CG2 3.89Å; L29-V52 HydrophobicContact CG-CG2 4.36Å; L29-L55 HydrophobicContact CD1-CD1 3.66Å
30L98.2Very high96.8Very high26 Ų2663.3 Ų63.314%0.13633%0.332CS..Hα-helixtrans-64.7-38.8175.8-67.5176.7000112.1I26 G27 N32 V33 E34 L49 V52 A89 V90 A93I26-L30 HydrophobicContact CG2-CD1 4Å; I26-L30 HydrophobicContact CG2-CG 4.23Å; I26-L30 WeakPolarHBondContact O-CG 3.36Å; I26-L30 PolarHBondContact O-N 3.4Å; G27-L30 PolarHBondContact O-N 2.84Å; G27-L30 VanDerWaalsContact O-N 3.14Å; L30-N32 VanDerWaalsContact C-N 3.33Å; L30-V33 WeakPolarHBondContact O-CB 3.24Å; L30-V33 PolarHBondContact O-N 3.42Å; L30-E34 PolarHBondContact O-N 2.6Å; L30-L49 HydrophobicContact CD2-CD2 4.47Å; L30-V52 HydrophobicContact CD2-CG1 4.26Å; L30-V52 HydrophobicContact CD2-CG2 4.31Å; L30-A89 HydrophobicContact CD1-CB 3.98Å; L30-V90 HydrophobicContact CD1-CG2 4.18Å; L30-V90 HydrophobicContact CD2-CG2 4.27Å; L30-A93 HydrophobicContact CD2-CB 3.62Å
31E98.1Very high96.9Very high130 Ų13064.4 Ų64.461%0.60733%0.331SS*.Hα-helixtrans-59.8-43.5170.6-70.6168.1-173.500111.3G27 E34 R35G27-E31 WeakPolarHBondContact O-CG 3.49Å; G27-E31 PolarHBondContact O-N 2.67Å; E31-E34 PolarHBondContact O-N 3.3Å; E31-R35 PolarHBondContact O-N 2.97Å
32N97.8Very high96.6Very high46 Ų4663.2 Ų63.225%0.24632%0.317CS..Hα-helixtrans-63.8-41.1174.6-72.4-29.2000112.3R28 L29 L30 E34 R35 F36 T48R28-N32 PolarHBondContact O-N 2.99Å; R28-N32 VanDerWaalsContact O-N 3.08Å; R28-N32 PolarHBondContact O-ND2 3.48Å; L29-N32 WeakPolarHBondContact O-CB 3.43Å; L29-N32 PolarHBondContact O-N 3.26Å; L30-N32 VanDerWaalsContact C-N 3.33Å; N32-E34 VanDerWaalsContact C-N 3.33Å; N32-E34 PolarHBondContact O-N 3.49Å; N32-R35 WeakPolarHBondContact O-CB 3.49Å; N32-R35 PolarHBondContact O-N 3.01Å; N32-R35 VanDerWaalsContact OD1-CZ 3.28Å; N32-R35 PolarHBondContact OD1-NH1 2.9Å; N32-R35 PolarHBondContact OD1-NH2 3.25Å; N32-R35 VanDerWaalsContact OD1-NH2 3.11Å; N32-F36 HydrophobicContact CB-CD2 4.33Å; N32-F36 HydrophobicContact CB-CE2 3.87Å; N32-F36 HydrophobicContact CB-CZ 4.48Å; N32-F36 WeakPolarHBondContact O-CD2 3.23Å; N32-F36 VanDerWaalsContact O-CG 3.23Å; N32-F36 WeakPolarHBondContact O-CG 3.02Å; N32-F36 PolarHBondContact O-N 3.26Å; N32-T48 HydrophobicContact CB-CG2 4.48Å
33V97.8Very high96.5Very high1 Ų167 Ų671%0.00633%0.334CS..Hα-helixtrans-58.5-46.2175.5168.80000110.6L29 L30 R35 F36 I37 A45 T48 L49 A93L29-V33 WeakPolarHBondContact O-CG2 3.42Å; L29-V33 PolarHBondContact O-N 2.94Å; L30-V33 WeakPolarHBondContact O-CB 3.24Å; L30-V33 PolarHBondContact O-N 3.42Å; V33-R35 VanDerWaalsContact C-N 3.34Å; V33-R35 PolarHBondContact O-N 2.94Å; V33-F36 PolarHBondContact O-N 3.1Å; V33-I37 HydrophobicContact CG1-CD1 3.83Å; V33-I37 WeakPolarHBondContact O-CD1 3.4Å; V33-I37 VanDerWaalsContact O-CG1 3.24Å; V33-I37 WeakPolarHBondContact O-CG1 3.43Å; V33-I37 PolarHBondContact O-N 3.48Å; V33-A45 HydrophobicContact CG1-CB 4.28Å; V33-T48 HydrophobicContact CG2-CG2 3.62Å; V33-L49 HydrophobicContact CG1-CD1 4.19Å; V33-L49 HydrophobicContact CG1-CD2 4.24Å; V33-L49 HydrophobicContact CG1-CG 4.1Å; V33-L49 HydrophobicContact CG2-CD2 4.04Å; V33-L49 HydrophobicContact CG2-CG 3.85Å; V33-A93 HydrophobicContact CG1-CB 4.19Å
34E97.1Very high96.4Very high99 Ų9964.7 Ų64.746%0.46333%0.331SS..Hα-helixtrans-64.3-39.3177.2-176153.8-127.100112.3L30 E31 N32 S38 K96L30-E34 PolarHBondContact O-N 2.6Å; E31-E34 PolarHBondContact O-N 3.3Å; N32-E34 VanDerWaalsContact C-N 3.33Å; N32-E34 PolarHBondContact O-N 3.49Å; E34-S38 WeakPolarHBondContact O-CB 3.47Å; E34-S38 PolarHBondContact O-N 3.36Å; E34-S38 VanDerWaalsContact O-N 3.09Å; E34-S38 PolarHBondContact O-OG 3.05Å; E34-K96 IonicContact OE1-NZ 3.33Å; E34-K96 PolarHBondContact OE1-NZ 2.9Å
35R97.9Very high96.4Very high112 Ų11261.3 Ų61.342%0.42331%0.307SS..Hα-helixtrans-60.3-51.5172.4-172.7-176.569.7-131-9.7111.6E31 N32 V33 I37 S38 E39E31-R35 PolarHBondContact O-N 2.97Å; N32-R35 WeakPolarHBondContact O-CB 3.49Å; N32-R35 PolarHBondContact O-N 3.01Å; N32-R35 VanDerWaalsContact OD1-CZ 3.28Å; N32-R35 PolarHBondContact OD1-NH1 2.9Å; N32-R35 PolarHBondContact OD1-NH2 3.25Å; N32-R35 VanDerWaalsContact OD1-NH2 3.11Å; V33-R35 VanDerWaalsContact C-N 3.34Å; V33-R35 PolarHBondContact O-N 2.94Å; R35-I37 VanDerWaalsContact C-N 3.33Å; R35-I37 PolarHBondContact O-N 3.14Å; R35-S38 CarbonylContact O-C 3.51Å; R35-S38 WeakPolarHBondContact O-CA 3.49Å; R35-S38 WeakPolarHBondContact O-CB 3.4Å; R35-S38 PolarHBondContact O-N 2.94Å; R35-E39 VanDerWaalsContact CD-OE1 3.31Å; R35-E39 WeakPolarHBondContact CD-OE1 3.31Å; R35-E39 HydrophobicContact CG-CG 4.3Å; R35-E39 WeakPolarHBondContact CG-OE1 3.49Å; R35-E39 IonicContact NE-OE1 3.96Å; R35-E39 IonicContact NE-OE2 2.76Å; R35-E39 WeakPolarHBondContact O-CG 3.28Å; R35-E39 PolarHBondContact O-N 3.31Å
36F96.7Very high96.2Very high31 Ų3159 Ų5914%0.13630%0.303CS..Hα-helixtrans-61.9-38.1-179.3-65.8-44.6000112.8N32 V33 S38 E39 G40 Q41 V44 A45 T48N32-F36 HydrophobicContact CB-CD2 4.33Å; N32-F36 HydrophobicContact CB-CE2 3.87Å; N32-F36 HydrophobicContact CB-CZ 4.48Å; N32-F36 WeakPolarHBondContact O-CD2 3.23Å; N32-F36 VanDerWaalsContact O-CG 3.23Å; N32-F36 WeakPolarHBondContact O-CG 3.02Å; N32-F36 PolarHBondContact O-N 3.26Å; V33-F36 PolarHBondContact O-N 3.1Å; F36-S38 VanDerWaalsContact C-N 3.32Å; F36-S38 PolarHBondContact O-N 3.31Å; F36-E39 PolarHBondContact O-N 3.46Å; F36-G40 PolarHBondContact O-N 3.11Å; F36-Q41 HydrophobicContact CB-CB 4.38Å; F36-Q41 CarbonylContact O-C 3.59Å; F36-Q41 WeakPolarHBondContact O-CA 3.18Å; F36-Q41 PolarHBondContact O-N 3.09Å; F36-V44 HydrophobicContact CD1-CB 4.45Å; F36-V44 HydrophobicContact CD1-CG1 3.95Å; F36-V44 HydrophobicContact CD2-CB 4.48Å; F36-V44 HydrophobicContact CD2-CG1 3.83Å; F36-V44 HydrophobicContact CE1-CG1 3.88Å; F36-V44 HydrophobicContact CE2-CG1 3.76Å; F36-V44 HydrophobicContact CG-CB 4.29Å; F36-V44 HydrophobicContact CG-CG1 3.93Å; F36-V44 HydrophobicContact CZ-CG1 3.78Å; F36-A45 HydrophobicContact CB-CB 3.86Å; F36-T48 HydrophobicContact CE2-CG2 4.4Å; F36-T48 VanDerWaalsContact CE2-OG1 3.28Å; F36-T48 WeakPolarHBondContact CE2-OG1 3.45Å
37I95.3Very high96.1Very high38 Ų3864.9 Ų64.920%0.19533%0.331CS..Hα-helixtrans-61.2-43.7173-70165.8000110.7V33 R35 G40 A45 K96 A97 A100V33-I37 HydrophobicContact CG1-CD1 3.83Å; V33-I37 WeakPolarHBondContact O-CD1 3.4Å; V33-I37 VanDerWaalsContact O-CG1 3.24Å; V33-I37 WeakPolarHBondContact O-CG1 3.43Å; V33-I37 PolarHBondContact O-N 3.48Å; R35-I37 VanDerWaalsContact C-N 3.33Å; R35-I37 PolarHBondContact O-N 3.14Å; I37-G40 PolarHBondContact O-N 3.21Å; I37-A45 HydrophobicContact CD1-CB 4.49Å; I37-A45 HydrophobicContact CG1-CB 3.76Å; I37-K96 HydrophobicContact CD1-CB 3.84Å; I37-A97 HydrophobicContact CD1-CB 3.98Å; I37-A97 HydrophobicContact CG1-CB 4.42Å; I37-A100 HydrophobicContact CG2-CB 3.87Å
38S94.7Very high96.1Very high100 Ų10064.4 Ų64.470%0.69932%0.323SS*.Hα-helixtrans-69.7-33.5-179.2-560000112.5E34 R35 F36 G40E34-S38 WeakPolarHBondContact O-CB 3.47Å; E34-S38 PolarHBondContact O-N 3.36Å; E34-S38 VanDerWaalsContact O-N 3.09Å; E34-S38 PolarHBondContact O-OG 3.05Å; R35-S38 CarbonylContact O-C 3.51Å; R35-S38 WeakPolarHBondContact O-CA 3.49Å; R35-S38 WeakPolarHBondContact O-CB 3.4Å; R35-S38 PolarHBondContact O-N 2.94Å; F36-S38 VanDerWaalsContact C-N 3.32Å; F36-S38 PolarHBondContact O-N 3.31Å; S38-G40 PolarHBondContact O-N 3.08Å
39E95.6Very high96.1Very high110 Ų11057.5 Ų57.551%0.51430%0.297SS..THydrogen-bonded Turntrans-77.81.1175.3-70.2170.9176.700113.1R35 F36 Q41R35-E39 VanDerWaalsContact CD-OE1 3.31Å; R35-E39 WeakPolarHBondContact CD-OE1 3.31Å; R35-E39 HydrophobicContact CG-CG 4.3Å; R35-E39 WeakPolarHBondContact CG-OE1 3.49Å; R35-E39 IonicContact NE-OE1 3.96Å; R35-E39 IonicContact NE-OE2 2.76Å; R35-E39 WeakPolarHBondContact O-CG 3.28Å; R35-E39 PolarHBondContact O-N 3.31Å; F36-E39 PolarHBondContact O-N 3.46Å; E39-Q41 VanDerWaalsContact C-N 3.34Å; E39-Q41 HydrophobicContact CB-CG 4.47Å
40G93Very high96Very high45 Ų4562.2 Ų62.246%0.46432%0.318SS..THydrogen-bonded Turntrans74.723.317900000114F36 I37 S38 P42F36-G40 PolarHBondContact O-N 3.11Å; I37-G40 PolarHBondContact O-N 3.21Å; S38-G40 PolarHBondContact O-N 3.08Å; G40-P42 WeakPolarHBondContact O-CD 3.5Å
41Q94Very high95.9Very high80 Ų8065.8 Ų65.837%0.37434%0.337SS..  trans-109.561.6178.3-59.4-175.8-41.700111.4F36 E39 E43 V44 A45F36-Q41 HydrophobicContact CB-CB 4.38Å; F36-Q41 CarbonylContact O-C 3.59Å; F36-Q41 WeakPolarHBondContact O-CA 3.18Å; F36-Q41 PolarHBondContact O-N 3.09Å; E39-Q41 VanDerWaalsContact C-N 3.34Å; E39-Q41 HydrophobicContact CB-CG 4.47Å; Q41-E43 PolarHBondContact O-N 2.78Å; Q41-V44 HydrophobicContact CB-CB 4.14Å; Q41-V44 HydrophobicContact CB-CG2 4.05Å; Q41-V44 PolarHBondContact O-N 3.29Å; Q41-A45 PolarHBondContact O-N 3.39Å
42P92.3Very high95.9Very high6 Ų659.6 Ų59.64%0.03931%0.308CS..Hα-helixtrans-64.3-26.8-177.828.3-35.3000112.9G40 A45 L46 A100 K104G40-P42 WeakPolarHBondContact O-CD 3.5Å; P42-A45 WeakPolarHBondContact O-CB 3.39Å; P42-A45 PolarHBondContact O-N 2.93Å; P42-L46 VanDerWaalsContact O-CG 3.3Å; P42-L46 WeakPolarHBondContact O-CG 3.49Å; P42-L46 PolarHBondContact O-N 3.41Å; P42-A100 HydrophobicContact CB-CB 4.02Å; P42-K104 HydrophobicContact CG-CD 4.24Å
43E93.1Very high95.8Very high91 Ų9160.4 Ų60.443%0.42531%0.312SS..Hα-helixtrans-66.5-46.7177-5881.9-177.900110.9Q41 A45 L46 E47 K104Q41-E43 PolarHBondContact O-N 2.78Å; E43-A45 VanDerWaalsContact C-N 3.29Å; E43-A45 PolarHBondContact O-N 3.37Å; E43-L46 WeakPolarHBondContact O-CB 3.42Å; E43-L46 PolarHBondContact O-N 3.48Å; E43-L46 VanDerWaalsContact O-N 3.11Å; E43-E47 PolarHBondContact O-N 2.83Å; E43-K104 IonicContact OE1-NZ 3.75Å; E43-K104 PolarHBondContact OE1-NZ 2.97Å; E43-K104 IonicContact OE2-NZ 2.89Å; E43-K104 PolarHBondContact OE2-NZ 3.05Å; E43-K104 VanDerWaalsContact OE2-NZ 3.13Å
44V95.5Very high95.8Very high47 Ų4763.8 Ų63.829%0.28533%0.333SS..Hα-helixtrans-64.1-36.2174.6-174.40000111.2F36 Q41 L46 E47 T48F36-V44 HydrophobicContact CD1-CB 4.45Å; F36-V44 HydrophobicContact CD1-CG1 3.95Å; F36-V44 HydrophobicContact CD2-CB 4.48Å; F36-V44 HydrophobicContact CD2-CG1 3.83Å; F36-V44 HydrophobicContact CE1-CG1 3.88Å; F36-V44 HydrophobicContact CE2-CG1 3.76Å; F36-V44 HydrophobicContact CG-CB 4.29Å; F36-V44 HydrophobicContact CG-CG1 3.93Å; F36-V44 HydrophobicContact CZ-CG1 3.78Å; Q41-V44 HydrophobicContact CB-CB 4.14Å; Q41-V44 HydrophobicContact CB-CG2 4.05Å; Q41-V44 PolarHBondContact O-N 3.29Å; V44-L46 VanDerWaalsContact C-N 3.32Å; V44-L46 PolarHBondContact O-N 3.37Å; V44-E47 PolarHBondContact O-N 2.87Å; V44-T48 WeakPolarHBondContact O-CB 3.27Å; V44-T48 PolarHBondContact O-N 3.04Å; V44-T48 PolarHBondContact O-OG1 3.35Å
45A96.8Very high95.8Very high0 Ų059.8 Ų59.80%032%0.315CS..Hα-helixtrans-62.3-38.917400000112.1V33 F36 I37 Q41 P42 E43 L49 A97V33-A45 HydrophobicContact CG1-CB 4.28Å; F36-A45 HydrophobicContact CB-CB 3.86Å; I37-A45 HydrophobicContact CD1-CB 4.49Å; I37-A45 HydrophobicContact CG1-CB 3.76Å; Q41-A45 PolarHBondContact O-N 3.39Å; P42-A45 WeakPolarHBondContact O-CB 3.39Å; P42-A45 PolarHBondContact O-N 2.93Å; E43-A45 VanDerWaalsContact C-N 3.29Å; E43-A45 PolarHBondContact O-N 3.37Å; A45-L49 VanDerWaalsContact O-CG 3.3Å; A45-L49 WeakPolarHBondContact O-CG 3.47Å; A45-L49 PolarHBondContact O-N 2.93Å; A45-L49 VanDerWaalsContact O-N 3.08Å; A45-A97 HydrophobicContact CB-CB 4.4Å
46L94.7Very high95.7Very high70 Ų7054.8 Ų54.837%0.36630%0.297SS..Hα-helixtrans-69.1-44.4176.4-71.5169.4000111.9P42 E43 V44 T48 L49 E50 A97P42-L46 VanDerWaalsContact O-CG 3.3Å; P42-L46 WeakPolarHBondContact O-CG 3.49Å; P42-L46 PolarHBondContact O-N 3.41Å; E43-L46 WeakPolarHBondContact O-CB 3.42Å; E43-L46 PolarHBondContact O-N 3.48Å; E43-L46 VanDerWaalsContact O-N 3.11Å; V44-L46 VanDerWaalsContact C-N 3.32Å; V44-L46 PolarHBondContact O-N 3.37Å; L46-T48 VanDerWaalsContact C-N 3.28Å; L46-T48 PolarHBondContact O-N 3.35Å; L46-L49 HydrophobicContact CD2-CD1 4.34Å; L46-L49 WeakPolarHBondContact O-CA 3.42Å; L46-L49 WeakPolarHBondContact O-CB 3.47Å; L46-L49 PolarHBondContact O-N 3.44Å; L46-E50 PolarHBondContact O-N 3.42Å; L46-A97 HydrophobicContact CD2-CB 3.89Å; L46-A97 HydrophobicContact CG-CB 4.35Å
47E95.8Very high95.7Very high123 Ų12358.9 Ų58.958%0.57532%0.317SS*.Hα-helixtrans-59.2-41.1174-69.3173.8-172.600111.5E43 V44 L49 E50 L51E43-E47 PolarHBondContact O-N 2.83Å; V44-E47 PolarHBondContact O-N 2.87Å; E47-L49 VanDerWaalsContact C-N 3.26Å; E47-L49 PolarHBondContact O-N 3.39Å; E47-E50 WeakPolarHBondContact O-CB 3.46Å; E47-E50 PolarHBondContact O-N 2.93Å; E47-E50 VanDerWaalsContact O-N 3.14Å; E47-L51 PolarHBondContact O-N 3.04Å
48T97.3Very high95.6Very high14 Ų1461.1 Ų61.19%0.08633%0.327CS..Hα-helixtrans-64.5-33.2176-54.90000111.7L29 N32 V33 F36 V44 L46 E50 L51 V52L29-T48 HydrophobicContact CB-CG2 4.28Å; L29-T48 HydrophobicContact CD2-CG2 4.01Å; N32-T48 HydrophobicContact CB-CG2 4.48Å; V33-T48 HydrophobicContact CG2-CG2 3.62Å; F36-T48 HydrophobicContact CE2-CG2 4.4Å; F36-T48 VanDerWaalsContact CE2-OG1 3.28Å; F36-T48 WeakPolarHBondContact CE2-OG1 3.45Å; V44-T48 WeakPolarHBondContact O-CB 3.27Å; V44-T48 PolarHBondContact O-N 3.04Å; V44-T48 PolarHBondContact O-OG1 3.35Å; L46-T48 VanDerWaalsContact C-N 3.28Å; L46-T48 PolarHBondContact O-N 3.35Å; T48-E50 VanDerWaalsContact C-N 3.31Å; T48-E50 PolarHBondContact O-N 3.22Å; T48-L51 WeakPolarHBondContact O-CB 3.33Å; T48-L51 PolarHBondContact O-N 3.35Å; T48-V52 WeakPolarHBondContact O-CG2 3.49Å; T48-V52 PolarHBondContact O-N 3.09Å; T48-V52 VanDerWaalsContact O-N 3.09Å
49L97.3Very high95.6Very high6 Ų656.5 Ų56.53%0.03130%0.295CS..Hα-helixtrans-68.9-26.1175.3-76.2164.2000113.1L30 V33 A45 L46 E47 V52 D53 A93 K94 A97L30-L49 HydrophobicContact CD2-CD2 4.47Å; V33-L49 HydrophobicContact CG1-CD1 4.19Å; V33-L49 HydrophobicContact CG1-CD2 4.24Å; V33-L49 HydrophobicContact CG1-CG 4.1Å; V33-L49 HydrophobicContact CG2-CD2 4.04Å; V33-L49 HydrophobicContact CG2-CG 3.85Å; A45-L49 VanDerWaalsContact O-CG 3.3Å; A45-L49 WeakPolarHBondContact O-CG 3.47Å; A45-L49 PolarHBondContact O-N 2.93Å; A45-L49 VanDerWaalsContact O-N 3.08Å; L46-L49 HydrophobicContact CD2-CD1 4.34Å; L46-L49 WeakPolarHBondContact O-CA 3.42Å; L46-L49 WeakPolarHBondContact O-CB 3.47Å; L46-L49 PolarHBondContact O-N 3.44Å; E47-L49 VanDerWaalsContact C-N 3.26Å; E47-L49 PolarHBondContact O-N 3.39Å; L49-V52 WeakPolarHBondContact O-CB 3.46Å; L49-V52 PolarHBondContact O-N 2.94Å; L49-D53 PolarHBondContact O-N 3.49Å; L49-A93 HydrophobicContact CD2-CB 4.01Å; L49-K94 HydrophobicContact CD1-CB 4.43Å; L49-K94 HydrophobicContact CD1-CG 4.02Å; L49-K94 HydrophobicContact CD2-CG 3.88Å; L49-K94 HydrophobicContact CG-CG 4.4Å; L49-A97 HydrophobicContact CD1-CB 3.48Å; L49-A97 VanDerWaalsContact CD1-CB 3.48Å
50E96.5Very high95.6Very high131 Ų13156.4 Ų56.461%0.61229%0.289SS*.Hα-helixtrans-68-37.7172.7-62.5179173.300111.5L46 E47 T48 V52 D53 T54L46-E50 PolarHBondContact O-N 3.42Å; E47-E50 WeakPolarHBondContact O-CB 3.46Å; E47-E50 PolarHBondContact O-N 2.93Å; E47-E50 VanDerWaalsContact O-N 3.14Å; T48-E50 VanDerWaalsContact C-N 3.31Å; T48-E50 PolarHBondContact O-N 3.22Å; E50-V52 VanDerWaalsContact C-N 3.34Å; E50-D53 PolarHBondContact O-N 3.35Å; E50-T54 PolarHBondContact O-N 2.96Å; E50-T54 VanDerWaalsContact O-N 3.11Å; E50-T54 PolarHBondContact O-OG1 3.3Å; E50-T54 VanDerWaalsContact O-OG1 3.1Å
51L96.4Very high95.6Very high102 Ų10259.2 Ų59.253%0.53429%0.294SS..Hα-helixtrans-65.7-39.1171.5-61.9178.1000111.6L29 E47 T48 D53 T54 L55L29-L51 HydrophobicContact CD1-CB 4.1Å; E47-L51 PolarHBondContact O-N 3.04Å; T48-L51 WeakPolarHBondContact O-CB 3.33Å; T48-L51 PolarHBondContact O-N 3.35Å; L51-D53 VanDerWaalsContact C-N 3.32Å; L51-D53 PolarHBondContact O-N 3.49Å; L51-T54 PolarHBondContact O-N 2.82Å; L51-L55 PolarHBondContact O-N 3.08Å; L51-L55 VanDerWaalsContact O-N 3.08Å
52V97.7Very high95.5Very high0 Ų055.6 Ų55.60%028%0.277CS..Hα-helixtrans-59.9-43.5173.3170.10000110.8I26 L29 L30 T48 L49 E50 T54 L55 L56 V90I26-V52 HydrophobicContact CG2-CG1 4.17Å; L29-V52 HydrophobicContact CB-CG2 3.5Å; L29-V52 VanDerWaalsContact CB-CG2 3.5Å; L29-V52 HydrophobicContact CD1-CG2 3.89Å; L29-V52 HydrophobicContact CG-CG2 4.36Å; L30-V52 HydrophobicContact CD2-CG1 4.26Å; L30-V52 HydrophobicContact CD2-CG2 4.31Å; T48-V52 WeakPolarHBondContact O-CG2 3.49Å; T48-V52 PolarHBondContact O-N 3.09Å; T48-V52 VanDerWaalsContact O-N 3.09Å; L49-V52 WeakPolarHBondContact O-CB 3.46Å; L49-V52 PolarHBondContact O-N 2.94Å; E50-V52 VanDerWaalsContact C-N 3.34Å; V52-T54 VanDerWaalsContact C-N 3.33Å; V52-T54 PolarHBondContact O-N 3.47Å; V52-L55 PolarHBondContact O-N 3.26Å; V52-L56 VanDerWaalsContact O-CB 3.27Å; V52-L56 WeakPolarHBondContact O-CB 3.3Å; V52-L56 PolarHBondContact O-N 3.44Å; V52-V90 HydrophobicContact CG1-CB 4.34Å; V52-V90 HydrophobicContact CG1-CG1 3.75Å; V52-V90 HydrophobicContact CG1-CG2 3.64Å
53D97Very high95.5Very high62 Ų6255.6 Ų55.633%0.33228%0.277SS..Hα-helixtrans-62.5-40.3178.9-79.6-19.3000112.7L49 E50 L51 L56 M57 K94L49-D53 PolarHBondContact O-N 3.49Å; E50-D53 PolarHBondContact O-N 3.35Å; L51-D53 VanDerWaalsContact C-N 3.32Å; L51-D53 PolarHBondContact O-N 3.49Å; D53-L56 PolarHBondContact O-N 3.3Å; D53-M57 PolarHBondContact O-N 2.85Å; D53-K94 WeakPolarHBondContact OD1-CE 3.36Å; D53-K94 IonicContact OD1-NZ 3.13Å; D53-K94 PolarHBondContact OD1-NZ 3.38Å; D53-K94 WeakPolarHBondContact OD2-CE 3.5Å; D53-K94 IonicContact OD2-NZ 2.6Å; D53-K94 PolarHBondContact OD2-NZ 3.4Å
54T96.7Very high95.3Very high73 Ų7355.2 Ų55.245%0.44828%0.281SS..Hα-helixtrans-61.9-48.1175.6-55.90000111.1E50 L51 V52 L56 M57 E58E50-T54 PolarHBondContact O-N 2.96Å; E50-T54 VanDerWaalsContact O-N 3.11Å; E50-T54 PolarHBondContact O-OG1 3.3Å; E50-T54 VanDerWaalsContact O-OG1 3.1Å; L51-T54 PolarHBondContact O-N 2.82Å; V52-T54 VanDerWaalsContact C-N 3.33Å; V52-T54 PolarHBondContact O-N 3.47Å; T54-L56 VanDerWaalsContact C-N 3.33Å; T54-L56 PolarHBondContact O-N 3.36Å; T54-M57 WeakPolarHBondContact O-CB 3.43Å; T54-M57 PolarHBondContact O-N 3.22Å; T54-E58 PolarHBondContact O-N 2.8Å
55L96.5Very high95.1Very high14 Ų1456.5 Ų56.57%0.07328%0.283CS..Hα-helixtrans-69.6-30.3178.3-66.1-176.3000113L22 R25 I26 L29 L51 V52 M57 E58 F59L22-L55 HydrophobicContact CD2-CD2 4.14Å; R25-L55 HydrophobicContact CB-CD1 3.91Å; I26-L55 HydrophobicContact CD1-CB 4.17Å; I26-L55 HydrophobicContact CG1-CB 3.73Å; I26-L55 HydrophobicContact CG1-CD1 4.4Å; L29-L55 HydrophobicContact CD1-CD1 3.66Å; L51-L55 PolarHBondContact O-N 3.08Å; L51-L55 VanDerWaalsContact O-N 3.08Å; V52-L55 PolarHBondContact O-N 3.26Å; L55-M57 VanDerWaalsContact C-N 3.33Å; L55-E58 PolarHBondContact O-N 3.08Å; L55-F59 WeakPolarHBondContact O-CB 3.46Å; L55-F59 PolarHBondContact O-N 3.5Å
56L96.3Very high94.7Very high8 Ų856.6 Ų56.64%0.04228%0.284CS..Hα-helixtrans-68.1-36.2176.4-174.164.7000111.1I26 V52 D53 T54 F59 R60 L86 E87 V90I26-L56 HydrophobicContact CD1-CD1 4.43Å; V52-L56 VanDerWaalsContact O-CB 3.27Å; V52-L56 WeakPolarHBondContact O-CB 3.3Å; V52-L56 PolarHBondContact O-N 3.44Å; D53-L56 PolarHBondContact O-N 3.3Å; T54-L56 VanDerWaalsContact C-N 3.33Å; T54-L56 PolarHBondContact O-N 3.36Å; L56-F59 PolarHBondContact O-N 3.26Å; L56-R60 WeakPolarHBondContact O-CG 3.42Å; L56-R60 PolarHBondContact O-N 3.37Å; L56-L86 HydrophobicContact CD1-CD2 4.43Å; L56-E87 HydrophobicContact CD1-CG 4.31Å; L56-V90 HydrophobicContact CD2-CB 4.42Å; L56-V90 HydrophobicContact CD2-CG1 4.2Å; L56-V90 HydrophobicContact CD2-CG2 4.32Å
57M96.2Very high94.3Very high116 Ų11656.1 Ų56.157%0.57128%0.28SS*.Hα-helixtrans-61.7-49.9171.9-171.6173.665.200111D53 T54 L55 F59 R60 D61D53-M57 PolarHBondContact O-N 2.85Å; T54-M57 WeakPolarHBondContact O-CB 3.43Å; T54-M57 PolarHBondContact O-N 3.22Å; L55-M57 VanDerWaalsContact C-N 3.33Å; M57-F59 VanDerWaalsContact C-N 3.27Å; M57-F59 PolarHBondContact O-N 3.46Å; M57-R60 PolarHBondContact O-N 3.18Å; M57-R60 VanDerWaalsContact O-N 3.17Å; M57-D61 PolarHBondContact O-N 2.87Å; M57-D61 VanDerWaalsContact O-N 3.11Å
58E95Very high93.9Very high86 Ų8656.9 Ų56.940%0.40229%0.287SS..Hα-helixtrans-59-38.3174.6-68.4-178-17400112.3L22 T54 L55 D61 V62L22-E58 HydrophobicContact CD1-CB 4.15Å; L22-E58 HydrophobicContact CD2-CB 4.08Å; L22-E58 WeakPolarHBondContact CD2-OE2 3.32Å; T54-E58 PolarHBondContact O-N 2.8Å; L55-E58 PolarHBondContact O-N 3.08Å; E58-D61 PolarHBondContact O-N 3.4Å; E58-V62 WeakPolarHBondContact O-CG2 3.33Å; E58-V62 PolarHBondContact O-N 3Å; E58-V62 VanDerWaalsContact O-N 3.11Å
59F94.7Very high93.4Very high3 Ų361.8 Ų61.81%0.01330%0.304CS..Hα-helixtrans-63.6-43.6177.1179.1-88.4000111.7R19 L22 R23 I26 L55 L56 M57 D61 V62 Q63 L86R19-F59 HydrophobicContact CG-CD2 4.11Å; R19-F59 HydrophobicContact CG-CE2 3.46Å; R19-F59 VanDerWaalsContact CG-CE2 3.46Å; R19-F59 HydrophobicContact CG-CZ 4.03Å; L22-F59 HydrophobicContact CB-CB 4.33Å; L22-F59 HydrophobicContact CB-CD2 3.98Å; L22-F59 HydrophobicContact CD1-CB 4.45Å; R23-F59 HydrophobicContact CB-CD2 4.49Å; R23-F59 HydrophobicContact CB-CE2 4Å; I26-F59 HydrophobicContact CD1-CB 4.01Å; I26-F59 HydrophobicContact CD1-CG 4.39Å; L55-F59 WeakPolarHBondContact O-CB 3.46Å; L55-F59 PolarHBondContact O-N 3.5Å; L56-F59 PolarHBondContact O-N 3.26Å; M57-F59 VanDerWaalsContact C-N 3.27Å; M57-F59 PolarHBondContact O-N 3.46Å; F59-D61 VanDerWaalsContact C-N 3.34Å; F59-D61 PolarHBondContact O-N 3.08Å; F59-V62 PolarHBondContact O-N 2.97Å; F59-Q63 HydrophobicContact CE1-CB 4.27Å; F59-Q63 WeakPolarHBondContact O-CB 3.39Å; F59-Q63 PolarHBondContact O-N 2.78Å; F59-L86 HydrophobicContact CD1-CD2 3.87Å; F59-L86 HydrophobicContact CD2-CD2 3.99Å; F59-L86 HydrophobicContact CE1-CD2 3.73Å; F59-L86 HydrophobicContact CE2-CD2 3.85Å; F59-L86 HydrophobicContact CG-CD2 4.01Å; F59-L86 HydrophobicContact CZ-CD2 3.72Å
60R94.4Very high92.8Very high107 Ų10762.3 Ų62.340%0.40431%0.307SS..Hα-helixtrans-63.4-38.7177.9-74.5169.7172.5175.6-2112.2L56 M57 Q63 T64 E87L56-R60 WeakPolarHBondContact O-CG 3.42Å; L56-R60 PolarHBondContact O-N 3.37Å; M57-R60 PolarHBondContact O-N 3.18Å; M57-R60 VanDerWaalsContact O-N 3.17Å; R60-Q63 PolarHBondContact O-N 2.76Å; R60-T64 WeakPolarHBondContact O-CB 3.36Å; R60-T64 PolarHBondContact O-N 2.95Å; R60-T64 PolarHBondContact O-OG1 3.01Å; R60-E87 IonicContact CZ-OE1 2.74Å; R60-E87 IonicContact CZ-OE2 2.67Å; R60-E87 IonicContact NE-OE1 2.62Å; R60-E87 PolarHBondContact NE-OE1 3.4Å; R60-E87 IonicContact NE-OE2 3.77Å; R60-E87 IonicContact NH2-OE1 3.97Å; R60-E87 PolarHBondContact NH2-OE1 2.96Å; R60-E87 VanDerWaalsContact NH2-OE1 3.08Å; R60-E87 IonicContact NH2-OE2 3.97Å; R60-E87 PolarHBondContact NH2-OE2 3.11Å
61D93.5Very high92.3Very high105 Ų10562.5 Ų62.556%0.56132%0.317SS*.Hα-helixtrans-63.2-49.2175.9-66.9-20.5000110.9M57 E58 F59 Q63 T64 E65M57-D61 PolarHBondContact O-N 2.87Å; M57-D61 VanDerWaalsContact O-N 3.11Å; E58-D61 PolarHBondContact O-N 3.4Å; F59-D61 VanDerWaalsContact C-N 3.34Å; F59-D61 PolarHBondContact O-N 3.08Å; D61-Q63 VanDerWaalsContact C-N 3.35Å; D61-Q63 PolarHBondContact O-N 3.3Å; D61-T64 PolarHBondContact O-N 3.2Å; D61-E65 PolarHBondContact O-N 3.19Å; D61-E65 VanDerWaalsContact O-N 3.09Å
62V92.3Very high92Very high3 Ų361 Ų612%0.01831%0.31CS..Hα-helixtrans-65.8-37.2177.7177.10000111.9L15 R18 R19 L22 E58 F59 E65 F66L15-V62 HydrophobicContact CD2-CG1 4.38Å; R18-V62 HydrophobicContact CB-CG1 4.21Å; R19-V62 HydrophobicContact CB-CG1 3.85Å; L22-V62 HydrophobicContact CD1-CB 4.37Å; L22-V62 HydrophobicContact CD1-CG2 3.92Å; E58-V62 WeakPolarHBondContact O-CG2 3.33Å; E58-V62 PolarHBondContact O-N 3Å; E58-V62 VanDerWaalsContact O-N 3.11Å; F59-V62 PolarHBondContact O-N 2.97Å; V62-E65 PolarHBondContact O-N 3.44Å; V62-F66 WeakPolarHBondContact O-CB 3.39Å; V62-F66 PolarHBondContact O-N 3.11Å
63Q91.1Very high91.6Very high6 Ų666.7 Ų66.73%0.02834%0.336CS..Hα-helixtrans-64-44.4176.617965.324.300111F59 R60 D61 E65 F66 E67 E79F59-Q63 HydrophobicContact CE1-CB 4.27Å; F59-Q63 WeakPolarHBondContact O-CB 3.39Å; F59-Q63 PolarHBondContact O-N 2.78Å; R60-Q63 PolarHBondContact O-N 2.76Å; D61-Q63 VanDerWaalsContact C-N 3.35Å; D61-Q63 PolarHBondContact O-N 3.3Å; Q63-E65 VanDerWaalsContact C-N 3.33Å; Q63-E65 PolarHBondContact O-N 2.87Å; Q63-F66 PolarHBondContact O-N 3.45Å; Q63-E67 HydrophobicContact CG-CG 4.46Å; Q63-E67 WeakPolarHBondContact CG-OE1 3.3Å; Q63-E67 PolarHBondContact NE2-OE1 3.11Å; Q63-E67 WeakPolarHBondContact O-CB 3.44Å; Q63-E67 WeakPolarHBondContact O-CG 3.41Å; Q63-E67 PolarHBondContact O-N 3.17Å; Q63-E79 PolarHBondContact NE2-O 3.39Å
64T90.5Very high91.2Very high83 Ų8369.8 Ų69.851%0.50935%0.353SS..Hα-helixtrans-59.7-45.5176.7-57.40000110.7R60 D61 E67 L68R60-T64 WeakPolarHBondContact O-CB 3.36Å; R60-T64 PolarHBondContact O-N 2.95Å; R60-T64 PolarHBondContact O-OG1 3.01Å; D61-T64 PolarHBondContact O-N 3.2Å; T64-E67 PolarHBondContact O-N 3.07Å; T64-L68 WeakPolarHBondContact O-CG 3.36Å; T64-L68 PolarHBondContact O-N 3.41Å
65E90.4Very high90.9Very high74 Ų7470.8 Ų70.835%0.34636%0.355SS..Hα-helixtrans-61.4-44.9175.7-167.5176.8-177.100111.4L15 R18 D61 V62 Q63 E67 L68L15-E65 HydrophobicContact CD1-CG 3.89Å; L15-E65 HydrophobicContact CD2-CB 4.31Å; L15-E65 VanDerWaalsContact CD2-CD 3.42Å; L15-E65 HydrophobicContact CD2-CG 3.93Å; L15-E65 VanDerWaalsContact CD2-OE2 3.3Å; L15-E65 WeakPolarHBondContact CD2-OE2 3.47Å; R18-E65 IonicContact NH1-OE2 3.01Å; D61-E65 PolarHBondContact O-N 3.19Å; D61-E65 VanDerWaalsContact O-N 3.09Å; V62-E65 PolarHBondContact O-N 3.44Å; Q63-E65 VanDerWaalsContact C-N 3.33Å; Q63-E65 PolarHBondContact O-N 2.87Å; E65-E67 PolarHBondContact O-N 2.74Å; E65-L68 PolarHBondContact O-N 2.86Å
66F87.6Confident90.4Very high2 Ų272.8 Ų72.81%0.00936%0.363CS..Hα-helixtrans-62.5-42.5178.5-170.1-100.8000112.9M12 L15 R16 V62 Q63 L68 W69 L70 E79M12-F66 HydrophobicContact CE-CD2 3.88Å; M12-F66 HydrophobicContact CE-CE2 3.57Å; M12-F66 HydrophobicContact CE-CZ 4.05Å; M12-F66 HydrophobicContact SD-CD2 4.23Å; M12-F66 HydrophobicContact SD-CE2 4.31Å; L15-F66 HydrophobicContact CB-CD2 3.87Å; R16-F66 HydrophobicContact CB-CE2 4.09Å; V62-F66 WeakPolarHBondContact O-CB 3.39Å; V62-F66 PolarHBondContact O-N 3.11Å; Q63-F66 PolarHBondContact O-N 3.45Å; F66-L68 VanDerWaalsContact C-N 3.31Å; F66-L68 PolarHBondContact O-N 3.42Å; F66-W69 PolarHBondContact O-N 3.49Å; F66-L70 HydrophobicContact CD1-CD1 3.89Å; F66-L70 HydrophobicContact CD1-CG 4.15Å; F66-L70 HydrophobicContact CE1-CD1 3.76Å; F66-L70 HydrophobicContact CE1-CD2 3.9Å; F66-L70 HydrophobicContact CE1-CG 3.98Å; F66-L70 HydrophobicContact CZ-CD2 4.19Å; F66-L70 PolarHBondContact O-N 3.31Å; F66-E79 HydrophobicContact CE1-CG 4.06Å
67E86.7Confident90.2Very high60 Ų6077 Ų7728%0.2839%0.385SS..Hα-helixtrans-64-32.6178.9-76.1175.6-165.300113.3Q63 T64 E65 W69 L70 K76Q63-E67 HydrophobicContact CG-CG 4.46Å; Q63-E67 WeakPolarHBondContact CG-OE1 3.3Å; Q63-E67 PolarHBondContact NE2-OE1 3.11Å; Q63-E67 WeakPolarHBondContact O-CB 3.44Å; Q63-E67 WeakPolarHBondContact O-CG 3.41Å; Q63-E67 PolarHBondContact O-N 3.17Å; T64-E67 PolarHBondContact O-N 3.07Å; E65-E67 PolarHBondContact O-N 2.74Å; E67-W69 PolarHBondContact O-N 2.95Å; E67-L70 PolarHBondContact O-N 3.33Å; E67-K76 VanDerWaalsContact O-CE 3.29Å; E67-K76 WeakPolarHBondContact O-CE 3.3Å; E67-K76 PolarHBondContact O-NZ 3.38Å
68L87.2Confident89.9Confident139 Ų13977 Ų7773%0.72838%0.384SS*.Hα-helixtrans-63-33.3175.7-72.6171.5000112.1T64 E65 F66T64-L68 WeakPolarHBondContact O-CG 3.36Å; T64-L68 PolarHBondContact O-N 3.41Å; E65-L68 PolarHBondContact O-N 2.86Å; F66-L68 VanDerWaalsContact C-N 3.31Å; F66-L68 PolarHBondContact O-N 3.42Å
69W86.1Confident89.6Confident118 Ų11874.1 Ų74.145%0.44737%0.371SS..Hα-helixtrans-88.2-16.3-179-69.9111.7000114.2V8 M12 F66 E67V8-W69 HydrophobicContact CG1-CE3 4.25Å; V8-W69 HydrophobicContact CG1-CZ3 4.08Å; M12-W69 HydrophobicContact CE-CB 3.67Å; M12-W69 HydrophobicContact CG-CB 4.24Å; M12-W69 HydrophobicContact SD-CB 3.14Å; M12-W69 WeakPolarHBondContact SD-CB 3.44Å; M12-W69 HydrophobicContact SD-CG 3.62Å; F66-W69 PolarHBondContact O-N 3.49Å; E67-W69 PolarHBondContact O-N 2.95Å
70L85.5Confident89.4Confident17 Ų1778 Ų789%0.08939%0.391CS..  trans-69.5135.1173.4-69175.6000109.8M12 F66 E67 L75 K76 E79M12-L70 HydrophobicContact CE-CD2 4.15Å; F66-L70 HydrophobicContact CD1-CD1 3.89Å; F66-L70 HydrophobicContact CD1-CG 4.15Å; F66-L70 HydrophobicContact CE1-CD1 3.76Å; F66-L70 HydrophobicContact CE1-CD2 3.9Å; F66-L70 HydrophobicContact CE1-CG 3.98Å; F66-L70 HydrophobicContact CZ-CD2 4.19Å; F66-L70 PolarHBondContact O-N 3.31Å; E67-L70 PolarHBondContact O-N 3.33Å; L70-L75 HydrophobicContact CD2-CB 4.38Å; L70-K76 HydrophobicContact CB-CD 4.27Å; L70-K76 VanDerWaalsContact CB-CE 3.49Å; L70-K76 HydrophobicContact CB-CG 3.57Å; L70-K76 HydrophobicContact CD1-CG 3.88Å; L70-K76 HydrophobicContact CG-CG 4.4Å; L70-K76 WeakPolarHBondContact O-CE 3.38Å; L70-K76 PolarHBondContact O-NZ 2.89Å; L70-E79 HydrophobicContact CD1-CB 4.23Å; L70-E79 HydrophobicContact CD1-CG 4.05Å
71T85.7Confident89.3Confident134 Ų13477.9 Ų77.982%0.82240%0.395SS*.  trans-110.1-29.5173.9530000112
72D90.5Very high89.2Confident71 Ų7174.5 Ų74.538%0.3838%0.377SS..  trans-77.3124.5176.8-174.1-62.1000111N74 L75 K76D72-N74 WeakPolarHBondContact OD1-CA 3.38Å; D72-N74 WeakPolarHBondContact OD1-CB 3.43Å; D72-N74 PolarHBondContact OD1-N 3.33Å; D72-L75 HydrophobicContact CB-CB 4.03Å; D72-L75 HydrophobicContact CB-CD1 3.87Å; D72-L75 HydrophobicContact CB-CG 3.98Å; D72-L75 PolarHBondContact OD1-N 3.11Å; D72-K76 WeakPolarHBondContact O-CG 3.21Å; D72-K76 PolarHBondContact O-N 2.85Å
73Q89.6Confident89.2Confident119 Ų11974.9 Ų74.956%0.55638%0.379SS*.Hα-helixtrans-70.9-36.7-177.8-68-63.6-39.400113.1L75 K76 D77Q73-L75 VanDerWaalsContact C-N 3.3Å; Q73-L75 PolarHBondContact O-N 2.87Å; Q73-K76 WeakPolarHBondContact O-CB 3.43Å; Q73-K76 PolarHBondContact O-N 3.1Å; Q73-K76 VanDerWaalsContact O-N 3.16Å; Q73-D77 PolarHBondContact O-N 3.36Å
74N89.5Confident89.3Confident128 Ų12878 Ų7868%0.68440%0.399SS*.Hα-helixtrans-66.6-38.3178.1-65-36.9000110.5D72 H78D72-N74 WeakPolarHBondContact OD1-CA 3.38Å; D72-N74 WeakPolarHBondContact OD1-CB 3.43Å; D72-N74 PolarHBondContact OD1-N 3.33Å; N74-H78 WeakPolarHBondContact O-CB 3.34Å; N74-H78 PolarHBondContact O-N 3.14Å
75L88.8Confident89.6Confident93 Ų9377.7 Ų77.749%0.48739%0.394SS..Hα-helixtrans-64.5-42.9171.9-68.3-179.9000110.9L70 D72 Q73 D77 H78 E79L70-L75 HydrophobicContact CD2-CB 4.38Å; D72-L75 HydrophobicContact CB-CB 4.03Å; D72-L75 HydrophobicContact CB-CD1 3.87Å; D72-L75 HydrophobicContact CB-CG 3.98Å; D72-L75 PolarHBondContact OD1-N 3.11Å; Q73-L75 VanDerWaalsContact C-N 3.3Å; Q73-L75 PolarHBondContact O-N 2.87Å; L75-D77 PolarHBondContact O-N 2.97Å; L75-H78 PolarHBondContact O-N 3.38Å; L75-E79 WeakPolarHBondContact O-CB 3.49Å; L75-E79 WeakPolarHBondContact O-CG 3.37Å; L75-E79 PolarHBondContact O-N 3.08Å
76K87.2Confident89.8Confident57 Ų5774.8 Ų74.825%0.24838%0.381CS..Hα-helixtrans-57.7-48.8174.7-76.3-174.7179.3-172.10112.5E67 L70 D72 Q73 H78 E79 L80E67-K76 VanDerWaalsContact O-CE 3.29Å; E67-K76 WeakPolarHBondContact O-CE 3.3Å; E67-K76 PolarHBondContact O-NZ 3.38Å; L70-K76 HydrophobicContact CB-CD 4.27Å; L70-K76 VanDerWaalsContact CB-CE 3.49Å; L70-K76 HydrophobicContact CB-CG 3.57Å; L70-K76 HydrophobicContact CD1-CG 3.88Å; L70-K76 HydrophobicContact CG-CG 4.4Å; L70-K76 WeakPolarHBondContact O-CE 3.38Å; L70-K76 PolarHBondContact O-NZ 2.89Å; D72-K76 WeakPolarHBondContact O-CG 3.21Å; D72-K76 PolarHBondContact O-N 2.85Å; Q73-K76 WeakPolarHBondContact O-CB 3.43Å; Q73-K76 PolarHBondContact O-N 3.1Å; Q73-K76 VanDerWaalsContact O-N 3.16Å; K76-H78 VanDerWaalsContact C-N 3.34Å; K76-H78 PolarHBondContact O-N 2.99Å; K76-E79 PolarHBondContact O-N 3.38Å; K76-L80 WeakPolarHBondContact O-CB 3.35Å; K76-L80 PolarHBondContact O-N 3.2Å
77D90.9Very high90.2Very high95 Ų9577.6 Ų77.651%0.50839%0.394SS..Hα-helixtrans-63.5-41.2-178.3-70.8-18.2000111.7Q73 L75 L80 Q81Q73-D77 PolarHBondContact O-N 3.36Å; L75-D77 PolarHBondContact O-N 2.97Å; D77-L80 PolarHBondContact O-N 2.93Å; D77-Q81 WeakPolarHBondContact O-CB 3.36Å; D77-Q81 PolarHBondContact O-N 3.28Å
78H90.6Very high90.7Very high116 Ų11678.6 Ų78.654%0.53740%0.401SS..Hα-helixtrans-61.1-46.4174.5-177.6-71.9000111.7N74 L75 K76 L80 Q81 D82N74-H78 WeakPolarHBondContact O-CB 3.34Å; N74-H78 PolarHBondContact O-N 3.14Å; L75-H78 PolarHBondContact O-N 3.38Å; K76-H78 VanDerWaalsContact C-N 3.34Å; K76-H78 PolarHBondContact O-N 2.99Å; H78-L80 VanDerWaalsContact C-N 3.33Å; H78-L80 PolarHBondContact O-N 3.2Å; H78-Q81 PolarHBondContact O-N 3.45Å; H78-D82 IonicContact CE1-OD2 3.23Å; H78-D82 PolarHBondContact CE1-OD2 3.47Å; H78-D82 IonicContact ND1-OD2 2.77Å; H78-D82 PolarHBondContact ND1-OD2 2.91Å; H78-D82 WeakPolarHBondContact O-CB 3.37Å; H78-D82 PolarHBondContact O-N 3.09Å
79E89.1Confident91.2Very high27 Ų2773.8 Ų73.813%0.12638%0.381CS..Hα-helixtrans-70.6-32.3-177.2-63.9-72.6-162.200112R19 Q63 F66 L70 L75 K76 D82 S83R19-E79 IonicContact CZ-OE1 2.8Å; R19-E79 IonicContact CZ-OE2 3.41Å; R19-E79 IonicContact NH1-OE1 3.08Å; R19-E79 PolarHBondContact NH1-OE1 2.7Å; R19-E79 IonicContact NH1-OE2 2.88Å; R19-E79 PolarHBondContact NH1-OE2 2.89Å; R19-E79 IonicContact NH2-OE1 3.71Å; R19-E79 PolarHBondContact NH2-OE1 3.4Å; R19-E79 IonicContact NH2-OE2 3.85Å; R19-E79 PolarHBondContact NH2-OE2 3.45Å; Q63-E79 PolarHBondContact NE2-O 3.39Å; F66-E79 HydrophobicContact CE1-CG 4.06Å; L70-E79 HydrophobicContact CD1-CB 4.23Å; L70-E79 HydrophobicContact CD1-CG 4.05Å; L75-E79 WeakPolarHBondContact O-CB 3.49Å; L75-E79 WeakPolarHBondContact O-CG 3.37Å; L75-E79 PolarHBondContact O-N 3.08Å; K76-E79 PolarHBondContact O-N 3.38Å; E79-D82 WeakPolarHBondContact O-CB 3.38Å; E79-S83 PolarHBondContact O-N 3.22Å; E79-S83 VanDerWaalsContact O-N 3.12Å
80L89.3Confident91.7Very high85 Ų8568.3 Ų68.345%0.44536%0.361SS..Hα-helixtrans-66.1-45.9170.8-17864.8000111.1K76 D77 H78 D82 S83 V84K76-L80 WeakPolarHBondContact O-CB 3.35Å; K76-L80 PolarHBondContact O-N 3.2Å; D77-L80 PolarHBondContact O-N 2.93Å; H78-L80 VanDerWaalsContact C-N 3.33Å; H78-L80 PolarHBondContact O-N 3.2Å; L80-D82 VanDerWaalsContact C-N 3.29Å; L80-D82 PolarHBondContact O-N 3.25Å; L80-S83 WeakPolarHBondContact O-CB 3.5Å; L80-S83 PolarHBondContact O-N 3.43Å; L80-S83 VanDerWaalsContact O-N 3.14Å; L80-V84 WeakPolarHBondContact O-CG2 3.5Å; L80-V84 PolarHBondContact O-N 3.49Å
81Q92.9Very high92.2Very high103 Ų10371.7 Ų71.748%0.48138%0.382SS..Hα-helixtrans-59.7-42.2176.5-175.461.15700111.3D77 H78 S83 V84 D85D77-Q81 WeakPolarHBondContact O-CB 3.36Å; D77-Q81 PolarHBondContact O-N 3.28Å; H78-Q81 PolarHBondContact O-N 3.45Å; Q81-S83 VanDerWaalsContact C-N 3.29Å; Q81-S83 PolarHBondContact O-N 2.8Å; Q81-V84 PolarHBondContact O-N 2.91Å; Q81-D85 PolarHBondContact NE2-OD1 3.43Å; Q81-D85 PolarHBondContact O-N 3.43Å
82D91.5Very high92.8Very high35 Ų3571.1 Ų71.119%0.18737%0.368CS..Hα-helixtrans-59.1-38.8175.3-97.8-37.4000112.9R23 H78 E79 L80 L86R23-D82 IonicContact CZ-OD1 3.27Å; R23-D82 VanDerWaalsContact NH1-CB 3.32Å; R23-D82 PolarHBondContact NH1-O 3.44Å; R23-D82 IonicContact NH1-OD1 3.49Å; R23-D82 PolarHBondContact NH1-OD1 2.78Å; R23-D82 IonicContact NH1-OD2 3.06Å; R23-D82 IonicContact NH2-OD1 3.54Å; R23-D82 PolarHBondContact NH2-OD1 3.35Å; H78-D82 IonicContact CE1-OD2 3.23Å; H78-D82 PolarHBondContact CE1-OD2 3.47Å; H78-D82 IonicContact ND1-OD2 2.77Å; H78-D82 PolarHBondContact ND1-OD2 2.91Å; H78-D82 WeakPolarHBondContact O-CB 3.37Å; H78-D82 PolarHBondContact O-N 3.09Å; E79-D82 WeakPolarHBondContact O-CB 3.38Å; L80-D82 VanDerWaalsContact C-N 3.29Å; L80-D82 PolarHBondContact O-N 3.25Å; D82-L86 PolarHBondContact O-N 2.86Å
83S91.8Very high93Very high10 Ų1068.3 Ų68.37%0.0736%0.355CS..Hα-helixtrans-67.1-46.5174-172.90000111.4E79 L80 Q81 D85 L86 E87E79-S83 PolarHBondContact O-N 3.22Å; E79-S83 VanDerWaalsContact O-N 3.12Å; L80-S83 WeakPolarHBondContact O-CB 3.5Å; L80-S83 PolarHBondContact O-N 3.43Å; L80-S83 VanDerWaalsContact O-N 3.14Å; Q81-S83 VanDerWaalsContact C-N 3.29Å; Q81-S83 PolarHBondContact O-N 2.8Å; S83-D85 VanDerWaalsContact C-N 3.34Å; S83-D85 PolarHBondContact O-N 3.47Å; S83-L86 WeakPolarHBondContact O-CB 3.33Å; S83-L86 PolarHBondContact O-N 3.37Å; S83-E87 WeakPolarHBondContact O-CG 3.5Å; S83-E87 PolarHBondContact O-N 2.92Å
84V93.6Very high93.3Very high71 Ų7165.6 Ų65.643%0.4334%0.341SS..Hα-helixtrans-59.8-43178.2170.20000111.6L80 Q81 L86 E87 L88L80-V84 WeakPolarHBondContact O-CG2 3.5Å; L80-V84 PolarHBondContact O-N 3.49Å; Q81-V84 PolarHBondContact O-N 2.91Å; V84-L86 VanDerWaalsContact C-N 3.31Å; V84-L86 PolarHBondContact O-N 3.27Å; V84-E87 PolarHBondContact O-N 3.33Å; V84-L88 WeakPolarHBondContact O-CB 3.28Å; V84-L88 PolarHBondContact O-N 2.91Å
85D96.4Very high93.6Very high77 Ų7762.3 Ų62.341%0.41233%0.332SS..Hα-helixtrans-63-40.2178.5-74.4-11.9000111.6Q81 S83 A89Q81-D85 PolarHBondContact NE2-OD1 3.43Å; Q81-D85 PolarHBondContact O-N 3.43Å; S83-D85 VanDerWaalsContact C-N 3.34Å; S83-D85 PolarHBondContact O-N 3.47Å; D85-A89 WeakPolarHBondContact O-CB 3.45Å; D85-A89 PolarHBondContact O-N 2.91Å
86L95.3Very high93.8Very high14 Ų1463 Ų637%0.07333%0.331CS..Hα-helixtrans-63.8-48174.8-176.663.1000111.3R23 I26 L56 F59 D82 S83 V84 L88 A89 V90R23-L86 HydrophobicContact CG-CD1 4.43Å; R23-L86 HydrophobicContact CG-CD2 4.35Å; I26-L86 HydrophobicContact CB-CD1 4.33Å; I26-L86 HydrophobicContact CD1-CD2 4.02Å; I26-L86 HydrophobicContact CG2-CD1 3.71Å; I26-L86 HydrophobicContact CG2-CG 4.45Å; L56-L86 HydrophobicContact CD1-CD2 4.43Å; F59-L86 HydrophobicContact CD1-CD2 3.87Å; F59-L86 HydrophobicContact CD2-CD2 3.99Å; F59-L86 HydrophobicContact CE1-CD2 3.73Å; F59-L86 HydrophobicContact CE2-CD2 3.85Å; F59-L86 HydrophobicContact CG-CD2 4.01Å; F59-L86 HydrophobicContact CZ-CD2 3.72Å; D82-L86 PolarHBondContact O-N 2.86Å; S83-L86 WeakPolarHBondContact O-CB 3.33Å; S83-L86 PolarHBondContact O-N 3.37Å; V84-L86 VanDerWaalsContact C-N 3.31Å; V84-L86 PolarHBondContact O-N 3.27Å; L86-L88 VanDerWaalsContact C-N 3.33Å; L86-L88 PolarHBondContact O-N 2.8Å; L86-A89 WeakPolarHBondContact O-CB 3.47Å; L86-A89 PolarHBondContact O-N 2.77Å; L86-V90 WeakPolarHBondContact O-CG2 2.75Å; L86-V90 PolarHBondContact O-N 2.85Å; L86-V90 VanDerWaalsContact O-N 3.07Å
87E95.9Very high94.1Very high61 Ų6160.2 Ų60.229%0.28532%0.319SS..Hα-helixtrans-60.9-42.6177.8-69.8-155.3-173.200112.1L56 R60 S83 V84 A89 V90 V91L56-E87 HydrophobicContact CD1-CG 4.31Å; R60-E87 IonicContact CZ-OE1 2.74Å; R60-E87 IonicContact CZ-OE2 2.67Å; R60-E87 IonicContact NE-OE1 2.62Å; R60-E87 PolarHBondContact NE-OE1 3.4Å; R60-E87 IonicContact NE-OE2 3.77Å; R60-E87 IonicContact NH2-OE1 3.97Å; R60-E87 PolarHBondContact NH2-OE1 2.96Å; R60-E87 VanDerWaalsContact NH2-OE1 3.08Å; R60-E87 IonicContact NH2-OE2 3.97Å; R60-E87 PolarHBondContact NH2-OE2 3.11Å; S83-E87 WeakPolarHBondContact O-CG 3.5Å; S83-E87 PolarHBondContact O-N 2.92Å; V84-E87 PolarHBondContact O-N 3.33Å; E87-A89 VanDerWaalsContact C-N 3.3Å; E87-A89 PolarHBondContact O-N 3.47Å; E87-V90 PolarHBondContact O-N 3.5Å; E87-V91 WeakPolarHBondContact O-CG2 3.29Å; E87-V91 PolarHBondContact O-N 3.12Å
88L97.5Very high94.2Very high80 Ų8062.2 Ų62.242%0.41932%0.323SS..Hα-helixtrans-61.9-39.1176.5-178.560.4000111.6V84 L86 V91 K92V84-L88 WeakPolarHBondContact O-CB 3.28Å; V84-L88 PolarHBondContact O-N 2.91Å; L86-L88 VanDerWaalsContact C-N 3.33Å; L86-L88 PolarHBondContact O-N 2.8Å; L88-V91 PolarHBondContact O-N 3.38Å; L88-K92 HydrophobicContact CD1-CG 4.46Å; L88-K92 HydrophobicContact CG-CD 4.26Å; L88-K92 WeakPolarHBondContact O-CB 3.45Å; L88-K92 VanDerWaalsContact O-CG 3.3Å; L88-K92 WeakPolarHBondContact O-CG 3.44Å; L88-K92 PolarHBondContact O-N 3.41Å
89A97.1Very high94.2Very high38 Ų3858.8 Ų58.831%0.31432%0.315SS..Hα-helixtrans-62.4-43.517500000111.7L30 D85 L86 E87 K92 A93L30-A89 HydrophobicContact CD1-CB 3.98Å; D85-A89 WeakPolarHBondContact O-CB 3.45Å; D85-A89 PolarHBondContact O-N 2.91Å; L86-A89 WeakPolarHBondContact O-CB 3.47Å; L86-A89 PolarHBondContact O-N 2.77Å; E87-A89 VanDerWaalsContact C-N 3.3Å; E87-A89 PolarHBondContact O-N 3.47Å; A89-K92 PolarHBondContact O-N 2.96Å; A89-A93 WeakPolarHBondContact O-CB 3.36Å; A89-A93 PolarHBondContact O-N 2.94Å
90V96.4Very high94.2Very high3 Ų358.3 Ų58.32%0.01832%0.316CS..Hα-helixtrans-62-46.4175.6176.10000111.2I26 L30 V52 L56 L86 E87 K92 A93 K94I26-V90 HydrophobicContact CG2-CG2 4.18Å; L30-V90 HydrophobicContact CD1-CG2 4.18Å; L30-V90 HydrophobicContact CD2-CG2 4.27Å; V52-V90 HydrophobicContact CG1-CB 4.34Å; V52-V90 HydrophobicContact CG1-CG1 3.75Å; V52-V90 HydrophobicContact CG1-CG2 3.64Å; L56-V90 HydrophobicContact CD2-CB 4.42Å; L56-V90 HydrophobicContact CD2-CG1 4.2Å; L56-V90 HydrophobicContact CD2-CG2 4.32Å; L86-V90 WeakPolarHBondContact O-CG2 2.75Å; L86-V90 PolarHBondContact O-N 2.85Å; L86-V90 VanDerWaalsContact O-N 3.07Å; E87-V90 PolarHBondContact O-N 3.5Å; V90-K92 PolarHBondContact O-N 3.29Å; V90-A93 PolarHBondContact O-N 3.38Å; V90-K94 HydrophobicContact CG1-CD 4.49Å; V90-K94 WeakPolarHBondContact O-CG 3.04Å; V90-K94 PolarHBondContact O-N 3.35Å
91V97.2Very high93.8Very high89 Ų8955.4 Ų55.454%0.53931%0.306SS..Hα-helixtrans-60.9-43.9178171.10000111.5E87 L88 A93 K94 A95E87-V91 WeakPolarHBondContact O-CG2 3.29Å; E87-V91 PolarHBondContact O-N 3.12Å; L88-V91 PolarHBondContact O-N 3.38Å; V91-A93 PolarHBondContact O-N 3.14Å; V91-K94 PolarHBondContact O-N 3.4Å; V91-A95 PolarHBondContact O-N 3.48Å
92K97.3Very high93.1Very high122 Ų12257.2 Ų57.253%0.5331%0.312SS..Hα-helixtrans-60.8-43.6175.6-76.4172.5178.6172.40111.5L88 A89 V90 A95 K96L88-K92 HydrophobicContact CD1-CG 4.46Å; L88-K92 HydrophobicContact CG-CD 4.26Å; L88-K92 WeakPolarHBondContact O-CB 3.45Å; L88-K92 VanDerWaalsContact O-CG 3.3Å; L88-K92 WeakPolarHBondContact O-CG 3.44Å; L88-K92 PolarHBondContact O-N 3.41Å; A89-K92 PolarHBondContact O-N 2.96Å; V90-K92 PolarHBondContact O-N 3.29Å; K92-A95 PolarHBondContact O-N 2.87Å; K92-K96 WeakPolarHBondContact O-CG 3.43Å; K92-K96 PolarHBondContact O-N 3.19Å
93A95.8Very high91.7Very high12 Ų1263.9 Ų63.910%0.09934%0.335CS..Hα-helixtrans-63.3-43.7177.500000111.9L30 V33 L49 A89 V90 V91 A95 K96 A97L30-A93 HydrophobicContact CD2-CB 3.62Å; V33-A93 HydrophobicContact CG1-CB 4.19Å; L49-A93 HydrophobicContact CD2-CB 4.01Å; A89-A93 WeakPolarHBondContact O-CB 3.36Å; A89-A93 PolarHBondContact O-N 2.94Å; V90-A93 PolarHBondContact O-N 3.38Å; V91-A93 PolarHBondContact O-N 3.14Å; A93-A95 VanDerWaalsContact C-N 3.33Å; A93-A95 PolarHBondContact O-N 3.26Å; A93-K96 PolarHBondContact O-N 3.2Å; A93-A97 WeakPolarHBondContact O-CB 3.44Å; A93-A97 PolarHBondContact O-N 2.62Å
94K95.5Very high90Very high61 Ų6168.2 Ų68.227%0.26535%0.352SS..Hα-helixtrans-59-43173.4-70.7-174.9-177.4-170.90112.6L49 D53 V90 V91 A97 K98L49-K94 HydrophobicContact CD1-CB 4.43Å; L49-K94 HydrophobicContact CD1-CG 4.02Å; L49-K94 HydrophobicContact CD2-CG 3.88Å; L49-K94 HydrophobicContact CG-CG 4.4Å; D53-K94 WeakPolarHBondContact OD1-CE 3.36Å; D53-K94 IonicContact OD1-NZ 3.13Å; D53-K94 PolarHBondContact OD1-NZ 3.38Å; D53-K94 WeakPolarHBondContact OD2-CE 3.5Å; D53-K94 IonicContact OD2-NZ 2.6Å; D53-K94 PolarHBondContact OD2-NZ 3.4Å; V90-K94 HydrophobicContact CG1-CD 4.49Å; V90-K94 WeakPolarHBondContact O-CG 3.04Å; V90-K94 PolarHBondContact O-N 3.35Å; V91-K94 PolarHBondContact O-N 3.4Å; K94-A97 PolarHBondContact O-N 2.88Å; K94-K98 WeakPolarHBondContact O-CB 3.14Å; K94-K98 WeakPolarHBondContact O-CG 3.33Å; K94-K98 PolarHBondContact O-N 2.77Å
95A94.9Very high88.1Confident60 Ų6072.1 Ų72.150%0.49637%0.366SS..Hα-helixtrans-63.9-44.3177.400000111.7V91 K92 A93 K98 A99V91-A95 PolarHBondContact O-N 3.48Å; K92-A95 PolarHBondContact O-N 2.87Å; A93-A95 VanDerWaalsContact C-N 3.33Å; A93-A95 PolarHBondContact O-N 3.26Å; A95-K98 PolarHBondContact O-N 3.27Å; A95-A99 WeakPolarHBondContact O-CB 3.36Å; A95-A99 PolarHBondContact O-N 2.92Å
96K94.7Very high86Confident106 Ų10676.2 Ų76.246%0.46138%0.382SS..Hα-helixtrans-60.1-47.7175.1-73.7179.8173.3-178.40111.7E34 I37 K92 A93 A99 A100E34-K96 IonicContact OE1-NZ 3.33Å; E34-K96 PolarHBondContact OE1-NZ 2.9Å; I37-K96 HydrophobicContact CD1-CB 3.84Å; K92-K96 WeakPolarHBondContact O-CG 3.43Å; K92-K96 PolarHBondContact O-N 3.19Å; A93-K96 PolarHBondContact O-N 3.2Å; K96-A99 PolarHBondContact O-N 3.45Å; K96-A100 WeakPolarHBondContact O-CB 3.41Å; K96-A100 PolarHBondContact O-N 2.91Å
97A93.2Very high84Confident0 Ų081.1 Ų81.10%041%0.413CS..Hα-helixtrans-61.6-45.7179.600000112I37 A45 L46 L49 A93 K94 A99 A100 G101I37-A97 HydrophobicContact CD1-CB 3.98Å; I37-A97 HydrophobicContact CG1-CB 4.42Å; A45-A97 HydrophobicContact CB-CB 4.4Å; L46-A97 HydrophobicContact CD2-CB 3.89Å; L46-A97 HydrophobicContact CG-CB 4.35Å; L49-A97 HydrophobicContact CD1-CB 3.48Å; L49-A97 VanDerWaalsContact CD1-CB 3.48Å; A93-A97 WeakPolarHBondContact O-CB 3.44Å; A93-A97 PolarHBondContact O-N 2.62Å; K94-A97 PolarHBondContact O-N 2.88Å; A97-A99 VanDerWaalsContact C-N 3.34Å; A97-A99 PolarHBondContact O-N 3.41Å; A97-A100 PolarHBondContact O-N 3.06Å; A97-G101 PolarHBondContact O-N 3.23Å
98K91.7Very high81.7Confident137 Ų13783.1 Ų83.160%0.59643%0.43SS*.Hα-helixtrans-61.7-39.9175.7-74.3-179.2179.7-175.90112.5K94 A95 K102K94-K98 WeakPolarHBondContact O-CB 3.14Å; K94-K98 WeakPolarHBondContact O-CG 3.33Å; K94-K98 PolarHBondContact O-N 2.77Å; A95-K98 PolarHBondContact O-N 3.27Å; K98-K102 WeakPolarHBondContact O-CG 3.17Å; K98-K102 PolarHBondContact O-N 2.94Å
99A91.8Very high78.8Confident44 Ų4484.9 Ų84.936%0.36444%0.444SS..Hα-helixtrans-67.3-37.6176.700000112A95 K96 A97 K102 R103A95-A99 WeakPolarHBondContact O-CB 3.36Å; A95-A99 PolarHBondContact O-N 2.92Å; K96-A99 PolarHBondContact O-N 3.45Å; A97-A99 VanDerWaalsContact C-N 3.34Å; A97-A99 PolarHBondContact O-N 3.41Å; A99-K102 PolarHBondContact O-N 3.34Å; A99-R103 PolarHBondContact O-N 2.95Å
100A89.1Confident76.1Confident17 Ų1789.6 Ų89.614%0.1447%0.469CS..Hα-helixtrans-66-41.4176.800000112.2I37 P42 K96 A97 K102 R103I37-A100 HydrophobicContact CG2-CB 3.87Å; P42-A100 HydrophobicContact CB-CB 4.02Å; K96-A100 WeakPolarHBondContact O-CB 3.41Å; K96-A100 PolarHBondContact O-N 2.91Å; A97-A100 PolarHBondContact O-N 3.06Å; A100-K102 PolarHBondContact O-N 3.39Å; A100-R103 PolarHBondContact O-N 3.26Å
101G80.8Confident73.7Confident24 Ų2495.3 Ų95.325%0.24750%0.503CS..Hα-helixtrans-59.2-44.2174.700000112.9A97 R103 K104 E105A97-G101 PolarHBondContact O-N 3.23Å; G101-R103 VanDerWaalsContact C-N 3.32Å; G101-R103 PolarHBondContact O-N 3.31Å; G101-K104 PolarHBondContact O-N 3.09Å; G101-E105 PolarHBondContact O-N 3.38Å
102K77.6Confident71.1Confident140 Ų14094.3 Ų94.361%0.60950%0.504SS*.Hα-helixtrans-64.4-31.9178.6-70.5-178.2179.2-171.30113.8K98 A99 A100 K104 E105 Q106K98-K102 WeakPolarHBondContact O-CG 3.17Å; K98-K102 PolarHBondContact O-N 2.94Å; A99-K102 PolarHBondContact O-N 3.34Å; A100-K102 PolarHBondContact O-N 3.39Å; K102-K104 VanDerWaalsContact C-N 3.33Å; K102-E105 PolarHBondContact O-N 2.99Å; K102-Q106 PolarHBondContact O-N 3.5Å; K102-Q106 VanDerWaalsContact O-N 3.08Å
103R62.6Low68.8Low175 Ų17593.8 Ų93.866%0.6651%0.513SS*.Hα-helixtrans-67.5-34.8178.2-73.3-178.9-168.3158.72.3112.1A99 A100 G101 E105 Q106 T107A99-R103 PolarHBondContact O-N 2.95Å; A100-R103 PolarHBondContact O-N 3.26Å; G101-R103 VanDerWaalsContact C-N 3.32Å; G101-R103 PolarHBondContact O-N 3.31Å; R103-E105 VanDerWaalsContact C-N 3.31Å; R103-Q106 PolarHBondContact O-N 2.87Å; R103-T107 PolarHBondContact O-N 2.85Å; R103-T107 PolarHBondContact O-OG1 3.41Å
104K55.7Low66.5Low102 Ų102101.4 Ų101.444%0.44355%0.547SS..Hα-helixtrans-68.1-34.2177.1-158.1174.3175.1-173.20111.5P42 E43 G101 K102 T108P42-K104 HydrophobicContact CG-CD 4.24Å; E43-K104 IonicContact OE1-NZ 3.75Å; E43-K104 PolarHBondContact OE1-NZ 2.97Å; E43-K104 IonicContact OE2-NZ 2.89Å; E43-K104 PolarHBondContact OE2-NZ 3.05Å; E43-K104 VanDerWaalsContact OE2-NZ 3.13Å; G101-K104 PolarHBondContact O-N 3.09Å; K102-K104 VanDerWaalsContact C-N 3.33Å; K104-T108 PolarHBondContact O-OG1 3.24Å; K104-T108 VanDerWaalsContact O-OG1 3.05Å
105E53.7Low64.2Low153 Ų153103.7 Ų103.772%0.71557%0.568SS**Hα-helixtrans-70.3-37.5174.1-155.8172.7-167.400112.1G101 K102 R103G101-E105 PolarHBondContact O-N 3.38Å; K102-E105 PolarHBondContact O-N 2.99Å; R103-E105 VanDerWaalsContact C-N 3.31Å
106Q53.1Low61.7Low162 Ų162106.1 Ų106.176%0.75758%0.58SS**Hα-helixtrans-76-24176.7-75.4-176.9-10.700114.7K102 R103 T108K102-Q106 PolarHBondContact O-N 3.5Å; K102-Q106 VanDerWaalsContact O-N 3.08Å; R103-Q106 PolarHBondContact O-N 2.87Å; Q106-T108 VanDerWaalsContact C-N 3.3Å
107T52.6Low59.2Low117 Ų117106.9 Ų106.972%0.71859%0.594SS**Hα-helixtrans-82.9-12.2-178.7-47.40000112.1R103R103-T107 PolarHBondContact O-N 2.85Å; R103-T107 PolarHBondContact O-OG1 3.41Å
108T46.8Very low57.2Low104 Ų104112.7 Ų112.764%0.63863%0.629SS**SBendtrans-102.274.8178.5-43.70000109.8K104 Q106K104-T108 PolarHBondContact O-OG1 3.24Å; K104-T108 VanDerWaalsContact O-OG1 3.05Å; Q106-T108 VanDerWaalsContact C-N 3.3Å
109T38Very low55Low116 Ų116112 Ų11271%0.71264%0.638SS**  trans161.378.8151.9-61.40000108.6V111T109-V111 HydrophobicContact CG2-CG2 4.37Å
110V40.1Very low52.7Low138 Ų138112.7 Ų112.784%0.83665%0.65SS**  trans-109.579.2147.4179.30000105.3A112V110-A112 VanDerWaalsContact C-N 3.32Å; V110-A112 PolarHBondContact O-N 2.98Å
111V44.9Very low50.3Low123 Ų123117.3 Ų117.375%0.74568%0.679SS**  trans-73.8102.3153.31770000103.7T109T109-V111 HydrophobicContact CG2-CG2 4.37Å
112A44Very low48.7Very low67 Ų67123.8 Ų123.855%0.55471%0.708SS**  trans-51.4130.7167.300000107V110 E114V110-A112 VanDerWaalsContact C-N 3.32Å; V110-A112 PolarHBondContact O-N 2.98Å; A112-E114 PolarHBondContact O-N 3.46Å
113P48.8Very low46.9Very low112 Ų112120.3 Ų120.373%0.72771%0.712SS**  trans-58.1113.4170.923.8-29.6000106P115P113-P115 VanDerWaalsContact O-CD 3.28Å; P113-P115 WeakPolarHBondContact O-CD 3.37Å; P113-P115 VanDerWaalsContact O-N 3.11Å
114E47.3Very low45.5Very low172 Ų172117.3 Ų117.380%0.80472%0.717SS**  trans-54.2122.5167.2-101-155.1127.900106A112 C116A112-E114 PolarHBondContact O-N 3.46Å; E114-C116 VanDerWaalsContact C-N 3.25Å; E114-C116 PolarHBondContact O-N 3.03Å
115P47Very low44.8Very low109 Ų109123.1 Ų123.171%0.70874%0.738SS**  trans-6895.2171.126.4-28.5000106.6P113 T117P113-P115 VanDerWaalsContact O-CD 3.28Å; P113-P115 WeakPolarHBondContact O-CD 3.37Å; P113-P115 VanDerWaalsContact O-N 3.11Å; P115-T117 PolarHBondContact O-N 2.87Å; P115-T117 PolarHBondContact O-OG1 3.42Å
116C41.8Very low44.3Very low110 Ų110127.1 Ų127.174%0.74375%0.747SS**  trans-59.995.2163.7-68.90000107E114 V118E114-C116 VanDerWaalsContact C-N 3.25Å; E114-C116 PolarHBondContact O-N 3.03Å; C116-V118 VanDerWaalsContact C-N 3.3Å; C116-V118 PolarHBondContact O-N 3.48Å
117T43.5Very low44Very low122 Ų122126.1 Ų126.175%0.74875%0.746SS**  trans-77.189.2175.3-51.30000106.2P115 P119P115-T117 PolarHBondContact O-N 2.87Å; P115-T117 PolarHBondContact O-OG1 3.42Å; T117-P119 WeakPolarHBondContact O-CD 3.42Å
118V49.9Very low43.6Very low122 Ų122126.9 Ų126.974%0.73975%0.745SS**  trans-75.1121.7165.7-169.30000106.2C116 G120C116-V118 VanDerWaalsContact C-N 3.3Å; C116-V118 PolarHBondContact O-N 3.48Å; V118-G120 VanDerWaalsContact C-N 3.28Å; V118-G120 PolarHBondContact O-N 3.16Å
119P45.3Very low43.6Very low123 Ų123129 Ų12980%0.79975%0.748SS**  trans-7289.2175.3-2.117.5000108.4T117T117-P119 WeakPolarHBondContact O-CD 3.42Å
120G43.8Very low44Very low59 Ų59127.6 Ų127.661%0.60875%0.748SS**  trans-90122.3168.900000109.4V118 N122V118-G120 VanDerWaalsContact C-N 3.28Å; V118-G120 PolarHBondContact O-N 3.16Å; G120-N122 PolarHBondContact O-N 3.03Å
121P40.1Very low44.2Very low114 Ų114128.4 Ų128.474%0.7475%0.745SS**SBendtrans-70.7127169.530.2-28.1000107.4
122N46.2Very low44.4Very low160 Ų160132.4 Ų132.486%0.85675%0.748SS**SBendtrans87.9104.3171.3-47.6-24000116.7G120G120-N122 PolarHBondContact O-N 3.03Å
123G39.2Very low44.1Very low67 Ų67138.8 Ų138.869%0.69176%0.758SS**  trans75.688.4135.900000118.7
124S33.2Very low44Very low112 Ų112139.9 Ų139.978%0.78376%0.758SS**  trans52.896.3141.8179.10000119.2
125Y41.6Very low43.8Very low224 Ų224137 Ų13788%0.87876%0.757SS**  trans-147115.9143.3-72.8-78.6000110.5
126R43.5Very low43.7Very low237 Ų237139.8 Ų139.889%0.89476%0.76SS**  trans-84.2104.5164.3-95.2-171.5179.2-162.90.6108L128R126-L128 PolarHBondContact O-N 3.45Å
127N46.4Very low44Very low141 Ų141143.7 Ų143.775%0.75477%0.772SS**  trans-75.7112164.6-90-36000108.9
128L44.5Very low44.2Very low133 Ų133143.3 Ų143.370%0.69677%0.774SS**  trans-93104.4164.8-78.4165.8000107.9R126 A130R126-L128 PolarHBondContact O-N 3.45Å; L128-A130 PolarHBondContact O-N 2.8Å
129Q47.8Very low43.7Very low148 Ų148140.2 Ų140.269%0.69277%0.768SS**  trans-77115.5164.5-83.9178.818.700108.6
130A45.1Very low43.5Very low87 Ų87142.5 Ų142.572%0.71977%0.771SS**  trans-101.9115.1166.200000108.5L128L128-A130 PolarHBondContact O-N 2.8Å
131M44.2Very low43.2Very low155 Ų155146.7 Ų146.776%0.76478%0.78SS**  trans-83.5123.2167.7-68.5-176-174.500108.5
132Y49.5Very low43.6Very low206 Ų206145.5 Ų145.581%0.80877%0.774SS**  trans-108.4127.7174-136.6-92.3000109.8
133W38.7Very low43.4Very low201 Ų201146.6 Ų146.676%0.76177%0.771SS**  trans-96.7106.2174.6-72.2100.8000109.6
134N46.1Very low43.7Very low136 Ų136150.7 Ų150.773%0.72778%0.776SS**  trans-92.394.8168.5-86.2-22.4000109.5H136N134-H136 PolarHBondContact O-N 3.45Å
135S42.5Very low44.3Very low112 Ų112151.1 Ų151.178%0.78377%0.774SS**  trans-84.395.1171.2-61.40000109.9
136H44Very low44.5Very low167 Ų167149.6 Ų149.677%0.77377%0.768SS**  trans-75.5135.4165.1-103.5-86.4000110N134 S138N134-H136 PolarHBondContact O-N 3.45Å; H136-S138 PolarHBondContact O-N 3.48Å
137L48.7Very low44.6Very low191 Ų191146.2 Ų146.2100%176%0.764SS**SBendtrans-6112.8-177-88.9149.2000116.4
138S47.9Very low44.5Very low114 Ų114145.2 Ų145.280%0.79776%0.759SS**SBendtrans-131.538.8-167.8-173.90000114.8H136H136-S138 PolarHBondContact O-N 3.48Å
139G39.7Very low44.7Very low58 Ų58143.2 Ų143.260%0.59875%0.752SS**  trans100134.7175.400000112.6N141G139-N141 PolarHBondContact O-N 3.2Å
140I40.5Very low44.6Very low171 Ų171146.6 Ų146.688%0.87776%0.759SS**  trans-72.699.8-173.2-48.4167.3000107.8
141N38Very low44.6Very low147 Ų147147.3 Ų147.379%0.78675%0.754SS**  trans-118.195167.3-157.4-12.3000108.2G139 K143G139-N141 PolarHBondContact O-N 3.2Å; N141-K143 PolarHBondContact O-N 2.77Å
142S47.5Very low44.4Very low88 Ų88145.3 Ų145.362%0.61576%0.755SS**  trans-84.9102.6-174.5-49.40000110.1
143K43.6Very low43.9Very low184 Ų184142 Ų14280%0.876%0.756SS**  trans-104.3125.8163.8-91.3-175.5176.3178.60110N141 V145N141-K143 PolarHBondContact O-N 2.77Å; K143-V145 PolarHBondContact O-N 2.9Å
144L45Very low44.3Very low152 Ų152138.7 Ų138.780%0.79676%0.759SS**  trans-65.7122.7170.2-113124.3000109.3Y146L144-Y146 HydrophobicContact CD2-CD2 4.19Å; L144-Y146 HydrophobicContact CD2-CE2 3.71Å
145V46Very low44.6Very low122 Ų122143.6 Ų143.674%0.73978%0.783SS**  trans-119.2115.8170.1-178.70000107.6K143 M147K143-V145 PolarHBondContact O-N 2.9Å; V145-M147 HydrophobicContact CG1-CG 4.48Å
146Y45.3Very low44.7Very low192 Ų192145.2 Ų145.275%0.75378%0.783SS**  trans-80.5122.9171-87.9-94.5000109.1L144L144-Y146 HydrophobicContact CD2-CD2 4.19Å; L144-Y146 HydrophobicContact CD2-CE2 3.71Å
147M46.5Very low44.7Very low165 Ų165144 Ų14481%0.81378%0.784SS**  trans-117.4126.7163.2-72.1-15386.400109.8V145 V149V145-M147 HydrophobicContact CG1-CG 4.48Å; M147-V149 PolarHBondContact O-N 2.84Å
148D43.9Very low44.5Very low121 Ų121141.4 Ų141.465%0.64777%0.772SS**  trans-80.1109.8170.2-173.422.2000108.3
149V48.3Very low44.3Very low90 Ų90143 Ų14355%0.54577%0.77SS.*  trans-100.498177.2-177.10000108.3M147 T151M147-V149 PolarHBondContact O-N 2.84Å; V149-T151 HydrophobicContact CG1-CG2 4.45Å; V149-T151 PolarHBondContact O-N 3.22Å
150R44.7Very low44.6Very low219 Ų219148.3 Ų148.383%0.82678%0.781SS**  trans-78.4102.6168.6-73-174.2-174.8-168.60110
151T46.5Very low44.9Very low102 Ų102146.8 Ų146.863%0.62678%0.775SS**  trans-96.6112.3162.4310000109.6V149V149-T151 HydrophobicContact CG1-CG2 4.45Å; V149-T151 PolarHBondContact O-N 3.22Å
152S38.9Very low45.4Very low113 Ų113146.8 Ų146.879%0.7977%0.774SS**  trans-83.2118.3168.3-57.30000108.1
153V40Very low45.2Very low136 Ų136151.3 Ų151.382%0.82479%0.786SS**  trans-104.1108.7166.6-176.70000106.7
154T46.9Very low45.3Very low133 Ų133148.6 Ų148.682%0.81679%0.785SS**  trans-78.6128169.6-38.30000107.9
155L52Low45.4Very low238 Ų238148.3 Ų148.3100%1.24678%0.784SS**  trans-59.50172.3-89.2156.7000112.2

Retrieved 155 of 155 residues in 63.5 ms (Link to these results)