A0A077Z5Q1_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z5Q1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 157 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
1M47.4Very low52.4Low224 Ų224118.1 Ų118.1100%1.10361%0.608SS**  0-22.60-75.9-164.9171.300115.1R3 L4M1-R3 VanDerWaalsContact C-N 3.34Å; M1-R3 PolarHBondContact O-N 3.46Å; M1-L4 PolarHBondContact O-N 2.87Å
2L46.4Very low52.9Low156 Ų156114.8 Ų114.882%0.81760%0.6SS**Hα-helixtrans-62.5-26.4-177.9-75.6159000116.2L4L2-L4 VanDerWaalsContact C-N 3.33Å; L2-L4 PolarHBondContact O-N 3.21Å
3R42.2Very low53.6Low235 Ų235116.3 Ų116.389%0.88760%0.599SS**Hα-helixtrans-71.1-23.5-179.1-73.9-169161.8154.7-1114.5M1M1-R3 VanDerWaalsContact C-N 3.34Å; M1-R3 PolarHBondContact O-N 3.46Å
4L49.9Very low54.2Low126 Ų126110.4 Ų110.466%0.6658%0.581SS**Hα-helixtrans-75.4-35-177.3-162.572.7000112M1 L2 G6 V7 L8M1-L4 PolarHBondContact O-N 2.87Å; L2-L4 VanDerWaalsContact C-N 3.33Å; L2-L4 PolarHBondContact O-N 3.21Å; L4-G6 VanDerWaalsContact C-N 3.35Å; L4-G6 PolarHBondContact O-N 3.26Å; L4-V7 PolarHBondContact O-N 2.84Å; L4-L8 HydrophobicContact CG-CD1 4.49Å; L4-L8 PolarHBondContact O-N 2.88Å
5I52.5Low54.6Low116 Ų116105.9 Ų105.960%0.59556%0.56SS**Hα-helixtrans-66.8-37.3178.9-62.4170.7000110.9V7 L8 S9I5-V7 VanDerWaalsContact C-N 3.35Å; I5-V7 PolarHBondContact O-N 3.23Å; I5-L8 PolarHBondContact O-N 2.84Å; I5-S9 PolarHBondContact O-N 3.16Å; I5-S9 PolarHBondContact O-OG 3.47Å
6G52.7Low54.9Low31 Ų31109.1 Ų109.132%0.3257%0.568SS.*Hα-helixtrans-65.2-34.6177.500000113.7L4 S9 I10L4-G6 VanDerWaalsContact C-N 3.35Å; L4-G6 PolarHBondContact O-N 3.26Å; G6-S9 PolarHBondContact O-OG 2.82Å; G6-I10 VanDerWaalsContact O-CD1 3.23Å; G6-I10 WeakPolarHBondContact O-CD1 3.46Å; G6-I10 WeakPolarHBondContact O-CG1 3.21Å; G6-I10 PolarHBondContact O-N 3.41Å
7V56.1Low55.1Low75 Ų75109.5 Ų109.546%0.45556%0.564SS.*Hα-helixtrans-73.7-39.7177.2179.40000110.8L4 I5 S9 I10 L11L4-V7 PolarHBondContact O-N 2.84Å; I5-V7 VanDerWaalsContact C-N 3.35Å; I5-V7 PolarHBondContact O-N 3.23Å; V7-S9 VanDerWaalsContact C-N 3.31Å; V7-S9 PolarHBondContact O-N 3.16Å; V7-I10 PolarHBondContact O-N 2.94Å; V7-L11 HydrophobicContact CG1-CD1 4.11Å; V7-L11 PolarHBondContact O-N 3.12Å
8L53.2Low55.1Low113 Ų113109.3 Ų109.359%0.59256%0.564SS**Hα-helixtrans-64.8-33176.9-79.7162.1000112.7L4 I5 P12L4-L8 HydrophobicContact CG-CD1 4.49Å; L4-L8 PolarHBondContact O-N 2.88Å; I5-L8 PolarHBondContact O-N 2.84Å; L8-P12 WeakPolarHBondContact O-CD 3.32Å
9S60.5Low55Low63 Ų63104.3 Ų104.344%0.44154%0.542SS..Hα-helixtrans-75.9-31.5176.463.30000113.1I5 G6 V7 P12 F13I5-S9 PolarHBondContact O-N 3.16Å; I5-S9 PolarHBondContact O-OG 3.47Å; G6-S9 PolarHBondContact O-OG 2.82Å; V7-S9 VanDerWaalsContact C-N 3.31Å; V7-S9 PolarHBondContact O-N 3.16Å; S9-P12 WeakPolarHBondContact O-CD 3.27Å; S9-P12 WeakPolarHBondContact O-CG 3.28Å; S9-F13 WeakPolarHBondContact O-CD2 3.35Å
10I60.5Low55.2Low115 Ų115101.7 Ų101.759%0.5953%0.533SS*.Hα-helixtrans-76.7-31.3-179.1-66.6164.4000112.4G6 V7 F13 G14G6-I10 VanDerWaalsContact O-CD1 3.23Å; G6-I10 WeakPolarHBondContact O-CD1 3.46Å; G6-I10 WeakPolarHBondContact O-CG1 3.21Å; G6-I10 PolarHBondContact O-N 3.41Å; V7-I10 PolarHBondContact O-N 2.94Å; I10-F13 WeakPolarHBondContact O-CB 3.18Å; I10-F13 PolarHBondContact O-N 2.89Å; I10-F13 VanDerWaalsContact O-N 3.14Å; I10-G14 PolarHBondContact O-N 2.86Å
11L55.3Low55Low45 Ų45102 Ų10224%0.23653%0.53CS..Hα-helixtrans-55.8-49.2-178.3-118.6112.9000115V7 F13 G14 V15 L48 V52V7-L11 HydrophobicContact CG1-CD1 4.11Å; V7-L11 PolarHBondContact O-N 3.12Å; L11-F13 VanDerWaalsContact C-N 3.28Å; L11-F13 PolarHBondContact O-N 3.14Å; L11-G14 PolarHBondContact O-N 3.33Å; L11-G14 VanDerWaalsContact O-N 3.17Å; L11-V15 PolarHBondContact O-N 3.48Å; L11-V15 VanDerWaalsContact O-N 3.11Å; L11-L48 HydrophobicContact CD2-CD1 3.86Å; L11-L48 HydrophobicContact CD2-CD2 3.43Å; L11-L48 VanDerWaalsContact CD2-CD2 3.43Å; L11-L48 HydrophobicContact CD2-CG 3.55Å; L11-V52 HydrophobicContact CD1-CG2 3.84Å; L11-V52 HydrophobicContact CD2-CG2 4Å; L11-V52 HydrophobicContact CG-CG2 4.41Å
12P58Low55.1Low78 Ų7893.7 Ų93.751%0.50649%0.493SS..Hα-helixtrans-64.6-32.4176.823.9-33.2000112.2L8 S9 V15 F16L8-P12 WeakPolarHBondContact O-CD 3.32Å; S9-P12 WeakPolarHBondContact O-CD 3.27Å; S9-P12 WeakPolarHBondContact O-CG 3.28Å; P12-V15 PolarHBondContact O-N 3.45Å; P12-F16 VanDerWaalsContact O-CB 3.24Å; P12-F16 WeakPolarHBondContact O-CB 3.28Å; P12-F16 PolarHBondContact O-N 2.79Å
13F62Low55.3Low135 Ų13590.6 Ų90.659%0.59248%0.483SS*.Hα-helixtrans-65.8-40.6172.7-75.4-76.6000111.7S9 I10 L11 V15 F16 F17S9-F13 WeakPolarHBondContact O-CD2 3.35Å; I10-F13 WeakPolarHBondContact O-CB 3.18Å; I10-F13 PolarHBondContact O-N 2.89Å; I10-F13 VanDerWaalsContact O-N 3.14Å; L11-F13 VanDerWaalsContact C-N 3.28Å; L11-F13 PolarHBondContact O-N 3.14Å; F13-V15 PolarHBondContact O-N 2.88Å; F13-F16 PolarHBondContact O-N 2.97Å; F13-F17 WeakPolarHBondContact O-CB 3.14Å; F13-F17 VanDerWaalsContact O-CD2 3.3Å; F13-F17 WeakPolarHBondContact O-CD2 3.33Å; F13-F17 PolarHBondContact O-N 3.49Å
14G62.3Low55.7Low33 Ų3386 Ų8634%0.3447%0.472SS..Hα-helixtrans-59.8-45.6175.700000112.6I10 L11 F17 L18I10-G14 PolarHBondContact O-N 2.86Å; L11-G14 PolarHBondContact O-N 3.33Å; L11-G14 VanDerWaalsContact O-N 3.17Å; G14-F17 PolarHBondContact O-N 3.3Å; G14-L18 WeakPolarHBondContact O-CB 3.34Å; G14-L18 PolarHBondContact O-N 3.13Å
15V60.6Low55.8Low43 Ų4385.5 Ų85.526%0.26146%0.461SS..Hα-helixtrans-67.6-39.1176.8179.50000111.5L11 P12 F13 L18 G19 W25L11-V15 PolarHBondContact O-N 3.48Å; L11-V15 VanDerWaalsContact O-N 3.11Å; P12-V15 PolarHBondContact O-N 3.45Å; F13-V15 PolarHBondContact O-N 2.88Å; V15-L18 PolarHBondContact O-N 2.9Å; V15-G19 PolarHBondContact O-N 3.27Å; V15-W25 HydrophobicContact CG1-CZ2 4.45Å
16F58.6Low55.9Low157 Ų15786.8 Ų86.869%0.68946%0.458SS*.Hα-helixtrans-64.2-43.3175.4-171.6-95.8000111.9P12 F13 G19 S20P12-F16 VanDerWaalsContact O-CB 3.24Å; P12-F16 WeakPolarHBondContact O-CB 3.28Å; P12-F16 PolarHBondContact O-N 2.79Å; F13-F16 PolarHBondContact O-N 2.97Å; F16-G19 PolarHBondContact O-N 2.78Å; F16-S20 WeakPolarHBondContact O-CB 3.21Å; F16-S20 PolarHBondContact O-N 3.07Å
17F58.2Low56.1Low117 Ų11793 Ų9351%0.51347%0.472SS..Hα-helixtrans-63.5-48.5174.3-91.5-107.5000110.4F13 G14 G19 S20 F21F13-F17 WeakPolarHBondContact O-CB 3.14Å; F13-F17 VanDerWaalsContact O-CD2 3.3Å; F13-F17 WeakPolarHBondContact O-CD2 3.33Å; F13-F17 PolarHBondContact O-N 3.49Å; G14-F17 PolarHBondContact O-N 3.3Å; F17-G19 VanDerWaalsContact C-N 3.33Å; F17-G19 PolarHBondContact O-N 3.4Å; F17-S20 WeakPolarHBondContact O-CB 3.36Å; F17-S20 PolarHBondContact O-N 3.26Å; F17-S20 PolarHBondContact O-OG 3.44Å; F17-F21 HydrophobicContact CB-CE2 3.98Å; F17-F21 AromaticContact CD1-CE2 3.6Å; F17-F21 HydrophobicContact CD1-CE2 3.6Å; F17-F21 AromaticContact CD1-CZ 3.89Å; F17-F21 HydrophobicContact CD1-CZ 3.89Å; F17-F21 HydrophobicContact CE1-CZ 4.42Å; F17-F21 HydrophobicContact CG-CE2 4.2Å; F17-F21 WeakPolarHBondContact O-CD2 3.23Å; F17-F21 WeakPolarHBondContact O-CE2 3.19Å; F17-F21 PolarHBondContact O-N 3.38Å
18L56Low55.9Low105 Ų10591.6 Ų91.655%0.5547%0.468SS..Hα-helixtrans-56.2-43174.7-93.5147.6000113G14 V15 S20 F21 C22G14-L18 WeakPolarHBondContact O-CB 3.34Å; G14-L18 PolarHBondContact O-N 3.13Å; V15-L18 PolarHBondContact O-N 2.9Å; L18-S20 VanDerWaalsContact C-N 3.28Å; L18-S20 PolarHBondContact O-N 3.04Å; L18-F21 PolarHBondContact O-N 3.38Å; L18-C22 PolarHBondContact O-N 3.45Å
19G53.5Low55.8Low15 Ų1592.6 Ų92.616%0.15546%0.464CS..Hα-helixtrans-68.2-23.8176.800000114.4V15 F16 F17V15-G19 PolarHBondContact O-N 3.27Å; F16-G19 PolarHBondContact O-N 2.78Å; F17-G19 VanDerWaalsContact C-N 3.33Å; F17-G19 PolarHBondContact O-N 3.4Å
20S58.3Low55.8Low51 Ų5197.3 Ų97.336%0.35747%0.472SS..Hα-helixtrans-77.1-31.3176.678.50000113.2F16 F17 L18F16-S20 WeakPolarHBondContact O-CB 3.21Å; F16-S20 PolarHBondContact O-N 3.07Å; F17-S20 WeakPolarHBondContact O-CB 3.36Å; F17-S20 PolarHBondContact O-N 3.26Å; F17-S20 PolarHBondContact O-OG 3.44Å; L18-S20 VanDerWaalsContact C-N 3.28Å; L18-S20 PolarHBondContact O-N 3.04Å
21F51.8Low55.5Low108 Ų10898 Ų9847%0.47447%0.473SS..Hα-helixtrans-95.5-17.4-172.6-61.1-60.9000115.3F17 L18 W94F17-F21 HydrophobicContact CB-CE2 3.98Å; F17-F21 AromaticContact CD1-CE2 3.6Å; F17-F21 HydrophobicContact CD1-CE2 3.6Å; F17-F21 AromaticContact CD1-CZ 3.89Å; F17-F21 HydrophobicContact CD1-CZ 3.89Å; F17-F21 HydrophobicContact CE1-CZ 4.42Å; F17-F21 HydrophobicContact CG-CE2 4.2Å; F17-F21 WeakPolarHBondContact O-CD2 3.23Å; F17-F21 WeakPolarHBondContact O-CE2 3.19Å; F17-F21 PolarHBondContact O-N 3.38Å; L18-F21 PolarHBondContact O-N 3.38Å; F21-W94 AromaticContact CD1-CH2 3.93Å; F21-W94 HydrophobicContact CD1-CH2 3.93Å; F21-W94 AromaticContact CD1-CZ2 3.53Å; F21-W94 HydrophobicContact CD1-CZ2 3.53Å; F21-W94 AromaticContact CE1-CZ2 3.88Å; F21-W94 HydrophobicContact CE1-CZ2 3.88Å
22C48.2Very low55.1Low50 Ų5099.8 Ų99.834%0.33848%0.482SS..  trans-114.6108.3-179.3-154.70000111.2L18 E24 W25 R26L18-C22 PolarHBondContact O-N 3.45Å; C22-E24 PolarHBondContact O-N 3.37Å; C22-W25 HydrophobicContact CB-CB 4.08Å; C22-W25 VanDerWaalsContact O-CB 3.3Å; C22-W25 WeakPolarHBondContact O-CB 3.45Å; C22-W25 PolarHBondContact O-N 3.49Å; C22-R26 PolarHBondContact O-N 3.23Å
23P51.1Low54.5Low92 Ų92105.8 Ų105.860%0.59750%0.495SS*.Hα-helixtrans-63.9-23.9179.324.4-31.7000112.5W25 R26 R27P23-W25 VanDerWaalsContact C-N 3.35Å; P23-R26 WeakPolarHBondContact O-CB 3.35Å; P23-R26 PolarHBondContact O-N 3.01Å; P23-R27 PolarHBondContact O-N 3.49Å
24E49.6Very low53.8Low139 Ų139108.4 Ų108.465%0.6551%0.506SS*.Hα-helixtrans-66.7-34.9171.8-70.1179.1145.200112C22 R26 R27 A28C22-E24 PolarHBondContact O-N 3.37Å; E24-R26 VanDerWaalsContact C-N 3.32Å; E24-R27 WeakPolarHBondContact O-CB 3.4Å; E24-R27 PolarHBondContact O-N 2.89Å; E24-R27 VanDerWaalsContact O-N 3.16Å; E24-A28 WeakPolarHBondContact O-CB 3.39Å; E24-A28 PolarHBondContact O-N 3.34Å
25W52.9Low52.9Low115 Ų115112.9 Ų112.944%0.43652%0.522SS..Hα-helixtrans-65.5-38.1171.2-164.5-89.8000111.2V15 C22 P23 R27 A28 W29V15-W25 HydrophobicContact CG1-CZ2 4.45Å; C22-W25 HydrophobicContact CB-CB 4.08Å; C22-W25 VanDerWaalsContact O-CB 3.3Å; C22-W25 WeakPolarHBondContact O-CB 3.45Å; C22-W25 PolarHBondContact O-N 3.49Å; P23-W25 VanDerWaalsContact C-N 3.35Å; W25-R27 PolarHBondContact O-N 2.81Å; W25-A28 PolarHBondContact O-N 3.33Å; W25-W29 WeakPolarHBondContact O-CB 3.32Å; W25-W29 PolarHBondContact O-N 3.36Å
26R54.5Low51.6Low143 Ų143113.7 Ų113.754%0.5454%0.539SS..Hα-helixtrans-68.1-23.1174.7-141.1-174.5-68.4-170.3-0.5112.9C22 P23 E24 R30C22-R26 PolarHBondContact O-N 3.23Å; P23-R26 WeakPolarHBondContact O-CB 3.35Å; P23-R26 PolarHBondContact O-N 3.01Å; E24-R26 VanDerWaalsContact C-N 3.32Å; R26-R30 WeakPolarHBondContact O-CG 3.49Å; R26-R30 PolarHBondContact O-N 3.48Å; R26-R30 PolarHBondContact O-NE 3.32Å
27R56.2Low50.8Low161 Ų161110 Ų11061%0.60852%0.523SS*.Hα-helixtrans-80.3-48.3169.7-72.4-178.7-173170.20.8110.9P23 E24 W25 W29 R30 H31P23-R27 PolarHBondContact O-N 3.49Å; E24-R27 WeakPolarHBondContact O-CB 3.4Å; E24-R27 PolarHBondContact O-N 2.89Å; E24-R27 VanDerWaalsContact O-N 3.16Å; W25-R27 PolarHBondContact O-N 2.81Å; R27-W29 VanDerWaalsContact C-N 3.34Å; R27-W29 PolarHBondContact O-N 3.45Å; R27-R30 WeakPolarHBondContact O-CB 3.41Å; R27-R30 PolarHBondContact O-N 2.98Å; R27-R30 VanDerWaalsContact O-N 3.14Å; R27-H31 PolarHBondContact O-CD2 3.46Å; R27-H31 PolarHBondContact O-N 2.66Å
28A53.4Low49.8Very low45 Ų45108.3 Ų108.337%0.37254%0.538SS..Hα-helixtrans-59.1-43.7176.400000111.7E24 W25 R30 H31 L32E24-A28 WeakPolarHBondContact O-CB 3.39Å; E24-A28 PolarHBondContact O-N 3.34Å; W25-A28 PolarHBondContact O-N 3.33Å; A28-R30 VanDerWaalsContact C-N 3.34Å; A28-R30 PolarHBondContact O-N 3.46Å; A28-H31 CarbonylContact O-C 3.6Å; A28-H31 PolarHBondContact O-N 2.93Å; A28-L32 VanDerWaalsContact O-CB 3.3Å; A28-L32 WeakPolarHBondContact O-CB 3.24Å; A28-L32 WeakPolarHBondContact O-CD1 3.29Å; A28-L32 PolarHBondContact O-N 2.94Å
29W51.3Low48.8Very low135 Ų135111.2 Ų111.251%0.51155%0.549SS..Hα-helixtrans-62.4-37.7175.1-170-101.5000112.5W25 R27 R33W25-W29 WeakPolarHBondContact O-CB 3.32Å; W25-W29 PolarHBondContact O-N 3.36Å; R27-W29 VanDerWaalsContact C-N 3.34Å; R27-W29 PolarHBondContact O-N 3.45Å; W29-R33 VanDerWaalsContact O-CB 3.27Å; W29-R33 WeakPolarHBondContact O-CB 3.38Å; W29-R33 PolarHBondContact O-N 3.2Å
30R60.4Low48.3Very low161 Ų161115.7 Ų115.761%0.60856%0.564SS**Hα-helixtrans-66.9-43.3172.8-88.7-175.6-80.4176.5-7.8111.8R26 R27 A28 R33 F34R26-R30 WeakPolarHBondContact O-CG 3.49Å; R26-R30 PolarHBondContact O-N 3.48Å; R26-R30 PolarHBondContact O-NE 3.32Å; R27-R30 WeakPolarHBondContact O-CB 3.41Å; R27-R30 PolarHBondContact O-N 2.98Å; R27-R30 VanDerWaalsContact O-N 3.14Å; A28-R30 VanDerWaalsContact C-N 3.34Å; A28-R30 PolarHBondContact O-N 3.46Å; R30-R33 PolarHBondContact O-N 2.9Å; R30-F34 WeakPolarHBondContact O-CB 3.13Å; R30-F34 PolarHBondContact O-N 3.37Å
31H53.1Low47.8Very low131 Ų131118.5 Ų118.561%0.60658%0.584SS**Hα-helixtrans-65.8-39.2175.5-77.1-69.4000112.4R27 A28 F34 L35R27-H31 PolarHBondContact O-CD2 3.46Å; R27-H31 PolarHBondContact O-N 2.66Å; A28-H31 CarbonylContact O-C 3.6Å; A28-H31 PolarHBondContact O-N 2.93Å; H31-F34 PolarHBondContact O-N 3.28Å; H31-L35 PolarHBondContact O-N 2.82Å; H31-L35 VanDerWaalsContact O-N 3.12Å
32L47.4Very low47.2Very low81 Ų81115.1 Ų115.142%0.42458%0.58SS.*Hα-helixtrans-64.6-39.4174.3-89.1152.7000112.1A28 F34 F37A28-L32 VanDerWaalsContact O-CB 3.3Å; A28-L32 WeakPolarHBondContact O-CB 3.24Å; A28-L32 WeakPolarHBondContact O-CD1 3.29Å; A28-L32 PolarHBondContact O-N 2.94Å; L32-F34 VanDerWaalsContact C-N 3.33Å; L32-F37 HydrophobicContact CD2-CD1 4.07Å; L32-F37 HydrophobicContact CD2-CE1 4.39Å; L32-F37 HydrophobicContact CD2-CG 4.42Å
33R45.7Very low46.8Very low204 Ų204118.6 Ų118.677%0.7759%0.591SS**Hα-helixtrans-70.6-28.7176-153.9178.2-164.1173.14.3112.6W29 R30W29-R33 VanDerWaalsContact O-CB 3.27Å; W29-R33 WeakPolarHBondContact O-CB 3.38Å; W29-R33 PolarHBondContact O-N 3.2Å; R30-R33 PolarHBondContact O-N 2.9Å
34F47.4Very low46.6Very low191 Ų191119.4 Ų119.484%0.83859%0.585SS**Hα-helixtrans-82-22.7179.6-147-91.5000113.3R30 H31 L32 G36R30-F34 WeakPolarHBondContact O-CB 3.13Å; R30-F34 PolarHBondContact O-N 3.37Å; H31-F34 PolarHBondContact O-N 3.28Å; L32-F34 VanDerWaalsContact C-N 3.33Å; F34-G36 PolarHBondContact O-N 3.16Å
35L42.4Very low46.5Very low126 Ų126117.6 Ų117.666%0.6658%0.579SS**THydrogen-bonded Turntrans-81.210.9179.5-91.8158000114.5H31 F37H31-L35 PolarHBondContact O-N 2.82Å; H31-L35 VanDerWaalsContact O-N 3.12Å; L35-F37 HydrophobicContact CB-CD2 3.64Å; L35-F37 HydrophobicContact CB-CE2 3.71Å; L35-F37 WeakPolarHBondContact O-CD2 3.36Å; L35-F37 PolarHBondContact O-N 3.19Å
36G34.3Very low46.5Very low61 Ų61115.4 Ų115.463%0.62958%0.579SS**THydrogen-bonded Turntrans74.422.8175.500000114.9F34 G38F34-G36 PolarHBondContact O-N 3.16Å; G36-G38 PolarHBondContact O-N 3.05Å
37F40.6Very low46.4Very low79 Ų79112.8 Ų112.835%0.34658%0.576SS.*  trans-76.336-178.8-78.8-125.2000113.4L32 L35 Q39 F40L32-F37 HydrophobicContact CD2-CD1 4.07Å; L32-F37 HydrophobicContact CD2-CE1 4.39Å; L32-F37 HydrophobicContact CD2-CG 4.42Å; L35-F37 HydrophobicContact CB-CD2 3.64Å; L35-F37 HydrophobicContact CB-CE2 3.71Å; L35-F37 WeakPolarHBondContact O-CD2 3.36Å; L35-F37 PolarHBondContact O-N 3.19Å; F37-Q39 PolarHBondContact O-N 3.23Å; F37-Q39 VanDerWaalsContact O-N 3.11Å; F37-F40 HydrophobicContact CB-CB 4.36Å; F37-F40 HydrophobicContact CB-CD2 3.94Å; F37-F40 HydrophobicContact CB-CG 4.41Å; F37-F40 HydrophobicContact CD1-CB 3.69Å; F37-F40 AromaticContact CD1-CD1 3.62Å; F37-F40 HydrophobicContact CD1-CD1 3.62Å; F37-F40 AromaticContact CD1-CD2 2.88Å; F37-F40 HydrophobicContact CD1-CD2 2.88Å; F37-F40 AromaticContact CD1-CE1 3.93Å; F37-F40 HydrophobicContact CD1-CE1 3.93Å; F37-F40 AromaticContact CD1-CE2 3.24Å; F37-F40 HydrophobicContact CD1-CE2 3.24Å; F37-F40 AromaticContact CD1-CG 3.08Å; F37-F40 HydrophobicContact CD1-CG 3.08Å; F37-F40 AromaticContact CD1-CZ 3.75Å; F37-F40 HydrophobicContact CD1-CZ 3.75Å; F37-F40 HydrophobicContact CD2-CD2 4.15Å; F37-F40 HydrophobicContact CD2-CE2 4.07Å; F37-F40 HydrophobicContact CE1-CB 4.44Å; F37-F40 AromaticContact CE1-CD1 3.49Å; F37-F40 HydrophobicContact CE1-CD1 3.49Å; F37-F40 VanDerWaalsContact CE1-CD1 3.49Å; F37-F40 AromaticContact CE1-CD2 3.21Å; F37-F40 HydrophobicContact CE1-CD2 3.21Å; F37-F40 AromaticContact CE1-CE1 3.31Å; F37-F40 HydrophobicContact CE1-CE1 3.31Å; F37-F40 AromaticContact CE1-CE2 2.98Å; F37-F40 HydrophobicContact CE1-CE2 2.98Å; F37-F40 AromaticContact CE1-CG 3.43Å; F37-F40 HydrophobicContact CE1-CG 3.43Å; F37-F40 VanDerWaalsContact CE1-CG 3.43Å; F37-F40 AromaticContact CE1-CZ 3.04Å; F37-F40 HydrophobicContact CE1-CZ 3.04Å; F37-F40 HydrophobicContact CE2-CD2 4.37Å; F37-F40 AromaticContact CE2-CE2 3.86Å; F37-F40 HydrophobicContact CE2-CE2 3.86Å; F37-F40 HydrophobicContact CE2-CZ 4.34Å; F37-F40 HydrophobicContact CG-CB 4.41Å; F37-F40 AromaticContact CG-CD2 3.4Å; F37-F40 HydrophobicContact CG-CD2 3.4Å; F37-F40 AromaticContact CG-CE2 3.76Å; F37-F40 HydrophobicContact CG-CE2 3.76Å; F37-F40 AromaticContact CG-CG 3.97Å; F37-F40 HydrophobicContact CG-CG 3.97Å; F37-F40 AromaticContact CZ-CD2 3.94Å; F37-F40 HydrophobicContact CZ-CD2 3.94Å; F37-F40 HydrophobicContact CZ-CE1 4.07Å; F37-F40 AromaticContact CZ-CE2 3.31Å; F37-F40 HydrophobicContact CZ-CE2 3.31Å; F37-F40 AromaticContact CZ-CZ 3.38Å; F37-F40 HydrophobicContact CZ-CZ 3.38Å
38G37.9Very low46.3Very low81 Ų81107.3 Ų107.384%0.83556%0.558SS**THydrogen-bonded Turntrans-67.74.6165.900000113.8G36G36-G38 PolarHBondContact O-N 3.05Å
39Q34.9Very low46.6Very low167 Ų167110 Ų11078%0.7857%0.566SS**THydrogen-bonded Turntrans-133.28.6-175-72.4-178-21.400114.3F37 S41F37-Q39 PolarHBondContact O-N 3.23Å; F37-Q39 VanDerWaalsContact O-N 3.11Å; Q39-S41 PolarHBondContact O-N 2.88Å
40F42.4Very low47Very low108 Ų108107.9 Ų107.947%0.47456%0.564SS.*  trans-81.947.4-179.9-94.7-103.2000113.5F37 G42F37-F40 HydrophobicContact CB-CB 4.36Å; F37-F40 HydrophobicContact CB-CD2 3.94Å; F37-F40 HydrophobicContact CB-CG 4.41Å; F37-F40 HydrophobicContact CD1-CB 3.69Å; F37-F40 AromaticContact CD1-CD1 3.62Å; F37-F40 HydrophobicContact CD1-CD1 3.62Å; F37-F40 AromaticContact CD1-CD2 2.88Å; F37-F40 HydrophobicContact CD1-CD2 2.88Å; F37-F40 AromaticContact CD1-CE1 3.93Å; F37-F40 HydrophobicContact CD1-CE1 3.93Å; F37-F40 AromaticContact CD1-CE2 3.24Å; F37-F40 HydrophobicContact CD1-CE2 3.24Å; F37-F40 AromaticContact CD1-CG 3.08Å; F37-F40 HydrophobicContact CD1-CG 3.08Å; F37-F40 AromaticContact CD1-CZ 3.75Å; F37-F40 HydrophobicContact CD1-CZ 3.75Å; F37-F40 HydrophobicContact CD2-CD2 4.15Å; F37-F40 HydrophobicContact CD2-CE2 4.07Å; F37-F40 HydrophobicContact CE1-CB 4.44Å; F37-F40 AromaticContact CE1-CD1 3.49Å; F37-F40 HydrophobicContact CE1-CD1 3.49Å; F37-F40 VanDerWaalsContact CE1-CD1 3.49Å; F37-F40 AromaticContact CE1-CD2 3.21Å; F37-F40 HydrophobicContact CE1-CD2 3.21Å; F37-F40 AromaticContact CE1-CE1 3.31Å; F37-F40 HydrophobicContact CE1-CE1 3.31Å; F37-F40 AromaticContact CE1-CE2 2.98Å; F37-F40 HydrophobicContact CE1-CE2 2.98Å; F37-F40 AromaticContact CE1-CG 3.43Å; F37-F40 HydrophobicContact CE1-CG 3.43Å; F37-F40 VanDerWaalsContact CE1-CG 3.43Å; F37-F40 AromaticContact CE1-CZ 3.04Å; F37-F40 HydrophobicContact CE1-CZ 3.04Å; F37-F40 HydrophobicContact CE2-CD2 4.37Å; F37-F40 AromaticContact CE2-CE2 3.86Å; F37-F40 HydrophobicContact CE2-CE2 3.86Å; F37-F40 HydrophobicContact CE2-CZ 4.34Å; F37-F40 HydrophobicContact CG-CB 4.41Å; F37-F40 AromaticContact CG-CD2 3.4Å; F37-F40 HydrophobicContact CG-CD2 3.4Å; F37-F40 AromaticContact CG-CE2 3.76Å; F37-F40 HydrophobicContact CG-CE2 3.76Å; F37-F40 AromaticContact CG-CG 3.97Å; F37-F40 HydrophobicContact CG-CG 3.97Å; F37-F40 AromaticContact CZ-CD2 3.94Å; F37-F40 HydrophobicContact CZ-CD2 3.94Å; F37-F40 HydrophobicContact CZ-CE1 4.07Å; F37-F40 AromaticContact CZ-CE2 3.31Å; F37-F40 HydrophobicContact CZ-CE2 3.31Å; F37-F40 AromaticContact CZ-CZ 3.38Å; F37-F40 HydrophobicContact CZ-CZ 3.38Å; F40-G42 PolarHBondContact O-N 3.48Å
41S49Very low46.9Very low110 Ų110106.5 Ų106.577%0.76956%0.563SS**THydrogen-bonded Turntrans-90.119.1-169.856.90000115.5Q39Q39-S41 PolarHBondContact O-N 2.88Å
42G38.5Very low47.1Very low37 Ų37102.6 Ų102.638%0.38155%0.548SS..THydrogen-bonded Turntrans-137.1-57.4175.600000112.5F40 F44 L45 V46F40-G42 PolarHBondContact O-N 3.48Å; G42-F44 PolarHBondContact O-N 3.48Å; G42-L45 WeakPolarHBondContact O-CB 3.24Å; G42-L45 PolarHBondContact O-N 3.11Å; G42-V46 WeakPolarHBondContact O-CG2 3.13Å; G42-V46 PolarHBondContact O-N 3.31Å
43Q39.9Very low47.3Very low124 Ų124107.4 Ų107.458%0.57956%0.56SS**Hα-helixtrans-63.6-41.8-175.7-155.279.520.500113.1L45 V46 D47Q43-L45 VanDerWaalsContact C-N 3.3Å; Q43-L45 PolarHBondContact O-N 3.17Å; Q43-V46 CarbonylContact O-C 3.59Å; Q43-V46 PolarHBondContact O-N 3.39Å; Q43-V46 VanDerWaalsContact O-N 3.16Å; Q43-D47 PolarHBondContact O-N 3.14Å
44F46.7Very low47.6Very low109 Ų109102.9 Ų102.948%0.47855%0.551SS.*Hα-helixtrans-63.6-37.8176.8179.4-98.8000111.8G42 V46 D47 L48G42-F44 PolarHBondContact O-N 3.48Å; F44-V46 VanDerWaalsContact C-N 3.35Å; F44-D47 PolarHBondContact O-N 2.95Å; F44-L48 WeakPolarHBondContact O-CB 3.5Å; F44-L48 PolarHBondContact O-N 3.33Å
45L48.6Very low48Very low100 Ų10099 Ų9952%0.52454%0.537SS..Hα-helixtrans-65.5-41.2174.8-165.975.6000110.5G42 Q43 L48 L49G42-L45 WeakPolarHBondContact O-CB 3.24Å; G42-L45 PolarHBondContact O-N 3.11Å; Q43-L45 VanDerWaalsContact C-N 3.3Å; Q43-L45 PolarHBondContact O-N 3.17Å; L45-L48 PolarHBondContact O-N 2.95Å; L45-L49 HydrophobicContact CG-CD1 4.19Å; L45-L49 VanDerWaalsContact O-CB 3.24Å; L45-L49 WeakPolarHBondContact O-CB 3.42Å; L45-L49 WeakPolarHBondContact O-CG 3.4Å; L45-L49 PolarHBondContact O-N 2.84Å
46V52.7Low48.6Very low69 Ų69103.1 Ų103.142%0.41854%0.544SS..Hα-helixtrans-65.8-42.7176173.50000111.6G42 Q43 F44 L49 L50G42-V46 WeakPolarHBondContact O-CG2 3.13Å; G42-V46 PolarHBondContact O-N 3.31Å; Q43-V46 CarbonylContact O-C 3.59Å; Q43-V46 PolarHBondContact O-N 3.39Å; Q43-V46 VanDerWaalsContact O-N 3.16Å; F44-V46 VanDerWaalsContact C-N 3.35Å; V46-L49 PolarHBondContact O-N 2.92Å; V46-L50 HydrophobicContact CG1-CD1 3.9Å; V46-L50 VanDerWaalsContact O-CB 3.29Å; V46-L50 WeakPolarHBondContact O-CB 3.3Å; V46-L50 PolarHBondContact O-N 3.03Å
47D52.6Low49.3Very low89 Ų89106.1 Ų106.148%0.47655%0.545SS..Hα-helixtrans-67-38.7177.3-71.7-29.1000111.6Q43 F44 F51Q43-D47 PolarHBondContact O-N 3.14Å; F44-D47 PolarHBondContact O-N 2.95Å; D47-F51 VanDerWaalsContact O-CB 3.28Å; D47-F51 WeakPolarHBondContact O-CB 3.45Å; D47-F51 PolarHBondContact O-N 2.91Å
48L52.9Low49.6Very low46 Ų46107.2 Ų107.224%0.24156%0.558CS.*Hα-helixtrans-65.9-43.9173.3-167.279.2000111L11 F44 L45 F51 V52L11-L48 HydrophobicContact CD2-CD1 3.86Å; L11-L48 HydrophobicContact CD2-CD2 3.43Å; L11-L48 VanDerWaalsContact CD2-CD2 3.43Å; L11-L48 HydrophobicContact CD2-CG 3.55Å; F44-L48 WeakPolarHBondContact O-CB 3.5Å; F44-L48 PolarHBondContact O-N 3.33Å; L45-L48 PolarHBondContact O-N 2.95Å; L48-F51 PolarHBondContact O-N 3.42Å; L48-V52 VanDerWaalsContact O-CG2 3.25Å; L48-V52 WeakPolarHBondContact O-CG2 2.85Å; L48-V52 PolarHBondContact O-N 3.44Å
49L59.5Low50Low101 Ų101108.7 Ų108.753%0.52955%0.553SS.*Hα-helixtrans-65.1-41.7175.8-76.4169.6000111.4L45 V46 V52 R53L45-L49 HydrophobicContact CG-CD1 4.19Å; L45-L49 VanDerWaalsContact O-CB 3.24Å; L45-L49 WeakPolarHBondContact O-CB 3.42Å; L45-L49 WeakPolarHBondContact O-CG 3.4Å; L45-L49 PolarHBondContact O-N 2.84Å; V46-L49 PolarHBondContact O-N 2.92Å; L49-V52 PolarHBondContact O-N 2.99Å; L49-R53 WeakPolarHBondContact O-CB 3.49Å; L49-R53 PolarHBondContact O-N 3.41Å
50L59.6Low50.9Low91 Ų91108.8 Ų108.848%0.47655%0.554SS.*Hα-helixtrans-62.8-41.4174-92159.6000111.4V46 R53 L54V46-L50 HydrophobicContact CG1-CD1 3.9Å; V46-L50 VanDerWaalsContact O-CB 3.29Å; V46-L50 WeakPolarHBondContact O-CB 3.3Å; V46-L50 PolarHBondContact O-N 3.03Å; L50-R53 PolarHBondContact O-N 3.38Å; L50-L54 WeakPolarHBondContact O-CB 3.24Å; L50-L54 PolarHBondContact O-N 3.38Å
51F59.5Low51Low132 Ų132108.4 Ų108.458%0.57956%0.557SS**Hα-helixtrans-65.1-43.4176.4-174.3-103.5000111.9D47 L48 L54 I55D47-F51 VanDerWaalsContact O-CB 3.28Å; D47-F51 WeakPolarHBondContact O-CB 3.45Å; D47-F51 PolarHBondContact O-N 2.91Å; L48-F51 PolarHBondContact O-N 3.42Å; F51-L54 WeakPolarHBondContact O-CB 3.39Å; F51-L54 PolarHBondContact O-N 3.35Å; F51-I55 HydrophobicContact CD1-CD1 3.69Å; F51-I55 HydrophobicContact CE1-CD1 3.31Å; F51-I55 HydrophobicContact CE1-CG1 4.33Å; F51-I55 HydrophobicContact CZ-CD1 3.83Å; F51-I55 WeakPolarHBondContact O-CG1 3.33Å; F51-I55 PolarHBondContact O-N 3.25Å
52V55.7Low51.2Low48 Ų48106.3 Ų106.329%0.29155%0.552SS.*Hα-helixtrans-64.4-40.5173.3173.30000110.9L11 L48 L49 L54 I55 W56L11-V52 HydrophobicContact CD1-CG2 3.84Å; L11-V52 HydrophobicContact CD2-CG2 4Å; L11-V52 HydrophobicContact CG-CG2 4.41Å; L48-V52 VanDerWaalsContact O-CG2 3.25Å; L48-V52 WeakPolarHBondContact O-CG2 2.85Å; L48-V52 PolarHBondContact O-N 3.44Å; L49-V52 PolarHBondContact O-N 2.99Å; V52-L54 VanDerWaalsContact C-N 3.34Å; V52-I55 PolarHBondContact O-N 2.65Å; V52-W56 WeakPolarHBondContact O-CB 3.25Å; V52-W56 PolarHBondContact O-N 2.89Å
53R51.6Low51.8Low183 Ų183114 Ų11469%0.69157%0.57SS**Hα-helixtrans-62.6-41.6174.4-128.9-179.6-178.4161.2-0.2111.1L49 L50 W56 L57L49-R53 WeakPolarHBondContact O-CB 3.49Å; L49-R53 PolarHBondContact O-N 3.41Å; L50-R53 PolarHBondContact O-N 3.38Å; R53-W56 CarbonylContact O-C 3.59Å; R53-W56 PolarHBondContact O-N 3.05Å; R53-L57 HydrophobicContact CG-CD1 4.34Å; R53-L57 VanDerWaalsContact O-CB 3.26Å; R53-L57 WeakPolarHBondContact O-CB 3.17Å; R53-L57 PolarHBondContact O-N 3.3Å
54L52.7Low52.5Low109 Ų109114.2 Ų114.257%0.57157%0.572SS**Hα-helixtrans-64.2-41.9175.8-102.1146.4000112.2L50 F51 V52 W56 L57 V58L50-L54 WeakPolarHBondContact O-CB 3.24Å; L50-L54 PolarHBondContact O-N 3.38Å; F51-L54 WeakPolarHBondContact O-CB 3.39Å; F51-L54 PolarHBondContact O-N 3.35Å; V52-L54 VanDerWaalsContact C-N 3.34Å; L54-W56 VanDerWaalsContact C-N 3.28Å; L54-W56 PolarHBondContact O-N 3.46Å; L54-L57 PolarHBondContact O-N 2.95Å; L54-V58 WeakPolarHBondContact O-CG2 3.3Å; L54-V58 PolarHBondContact O-N 3.45Å
55I56.2Low52.9Low108 Ų108114.2 Ų114.255%0.55458%0.577SS**Hα-helixtrans-64-36.5173.7-69.3169.1000110.9F51 V52F51-I55 HydrophobicContact CD1-CD1 3.69Å; F51-I55 HydrophobicContact CE1-CD1 3.31Å; F51-I55 HydrophobicContact CE1-CG1 4.33Å; F51-I55 HydrophobicContact CZ-CD1 3.83Å; F51-I55 WeakPolarHBondContact O-CG1 3.33Å; F51-I55 PolarHBondContact O-N 3.25Å; V52-I55 PolarHBondContact O-N 2.65Å
56W54.4Low53.1Low213 Ų213118.4 Ų118.481%0.80759%0.585SS**Hα-helixtrans-77-27.8177.8-162.1-86.9000113.3V52 R53 L54 V58V52-W56 WeakPolarHBondContact O-CB 3.25Å; V52-W56 PolarHBondContact O-N 2.89Å; R53-W56 CarbonylContact O-C 3.59Å; R53-W56 PolarHBondContact O-N 3.05Å; L54-W56 VanDerWaalsContact C-N 3.28Å; L54-W56 PolarHBondContact O-N 3.46Å; W56-V58 VanDerWaalsContact C-N 3.3Å; W56-V58 PolarHBondContact O-N 3.48Å
57L48.4Very low53.4Low125 Ų125118.7 Ų118.765%0.65459%0.588SS**THydrogen-bonded Turntrans-85.48.7178.4-110.9126.2000114.2R53 L54 P59R53-L57 HydrophobicContact CG-CD1 4.34Å; R53-L57 VanDerWaalsContact O-CB 3.26Å; R53-L57 WeakPolarHBondContact O-CB 3.17Å; R53-L57 PolarHBondContact O-N 3.3Å; L54-L57 PolarHBondContact O-N 2.95Å; L57-P59 WeakPolarHBondContact O-CD 3.46Å
58V47.9Very low53.4Low101 Ų101119.5 Ų119.561%0.61259%0.591SS**  trans-100.780.2167.3-179.60000109.1L54 W56 E60L54-V58 WeakPolarHBondContact O-CG2 3.3Å; L54-V58 PolarHBondContact O-N 3.45Å; W56-V58 VanDerWaalsContact C-N 3.3Å; W56-V58 PolarHBondContact O-N 3.48Å; V58-E60 PolarHBondContact O-N 3.35Å
59P46.6Very low53.6Low113 Ų113122.3 Ų122.373%0.73461%0.606SS**  trans-91.472.2168.138.8-33000108.7L57L57-P59 WeakPolarHBondContact O-CD 3.46Å
60E53.3Low53.5Low169 Ų169122.3 Ų122.379%0.7961%0.606SS**SBendtrans-120.6-7.2172.6-75.9-161.6156.800114.8V58V58-E60 PolarHBondContact O-N 3.35Å
61D45.7Very low53.4Low100 Ų100122.3 Ų122.354%0.53561%0.606SS.*  trans-156.6102.6167.5-90.8-55.6000112.4R63 M64D61-R63 PolarHBondContact O-N 3.37Å; D61-M64 HydrophobicContact CB-CB 4.3Å; D61-M64 PolarHBondContact O-N 2.85Å
62G51.7Low53.2Low66 Ų66120.9 Ų120.968%0.6860%0.603SS**Hα-helixtrans-56.3-17.6169.400000113.6R66G62-R66 WeakPolarHBondContact O-CB 3.44Å; G62-R66 PolarHBondContact O-N 3.4Å
63R52.4Low53.2Low199 Ų199123.6 Ų123.675%0.75162%0.617SS**Hα-helixtrans-66.7-38.6170.7-82.6-175.2-96.5-157.5-7.6112.9D61 R66 T67D61-R63 PolarHBondContact O-N 3.37Å; R63-R66 PolarHBondContact O-N 2.87Å; R63-T67 WeakPolarHBondContact O-CB 3.3Å; R63-T67 PolarHBondContact O-N 3.29Å; R63-T67 PolarHBondContact O-OG1 2.86Å
64M54.9Low53Low127 Ų127117.9 Ų117.963%0.62660%0.602SS**Hα-helixtrans-72.3-41.6-175.7-131.7180172.600111.1D61 T67 L68D61-M64 HydrophobicContact CB-CB 4.3Å; D61-M64 PolarHBondContact O-N 2.85Å; M64-T67 PolarHBondContact O-N 3.34Å; M64-L68 WeakPolarHBondContact O-CB 3.24Å; M64-L68 PolarHBondContact O-N 3.3Å
65L53.7Low52.9Low110 Ų110115 Ų11558%0.57659%0.593SS**Hα-helixtrans-63.5-43.7173.9-166.180.7000111.6T67 L68 L69L65-T67 VanDerWaalsContact C-N 3.32Å; L65-T67 PolarHBondContact O-N 3Å; L65-L68 PolarHBondContact O-N 3.22Å; L65-L69 HydrophobicContact CD2-CD1 4.45Å; L65-L69 HydrophobicContact CG-CD1 4.19Å; L65-L69 WeakPolarHBondContact O-CB 3.3Å; L65-L69 WeakPolarHBondContact O-CG 3.33Å; L65-L69 PolarHBondContact O-N 3.05Å
66R53.3Low52.8Low187 Ų187115 Ų11571%0.70660%0.598SS**Hα-helixtrans-64.3-36.9177-155.3179.3-157169.95.2111.8G62 R63 L69 L70G62-R66 WeakPolarHBondContact O-CB 3.44Å; G62-R66 PolarHBondContact O-N 3.4Å; R63-R66 PolarHBondContact O-N 2.87Å; R66-L69 PolarHBondContact O-N 3.19Å; R66-L70 HydrophobicContact CG-CD1 4.44Å; R66-L70 VanDerWaalsContact O-CB 3.29Å; R66-L70 WeakPolarHBondContact O-CB 3.5Å; R66-L70 PolarHBondContact O-N 3.41Å
67T59Low52.6Low76 Ų76108.4 Ų108.447%0.46659%0.585SS.*Hα-helixtrans-68.9-43.4176.9-53.50000111.2R63 M64 L65 L70 I71R63-T67 WeakPolarHBondContact O-CB 3.3Å; R63-T67 PolarHBondContact O-N 3.29Å; R63-T67 PolarHBondContact O-OG1 2.86Å; M64-T67 PolarHBondContact O-N 3.34Å; L65-T67 VanDerWaalsContact C-N 3.32Å; L65-T67 PolarHBondContact O-N 3Å; T67-L70 PolarHBondContact O-N 2.95Å; T67-I71 HydrophobicContact CG2-CD1 3.98Å; T67-I71 WeakPolarHBondContact O-CB 3.11Å; T67-I71 VanDerWaalsContact O-CG1 3.24Å; T67-I71 WeakPolarHBondContact O-CG1 3.16Å; T67-I71 PolarHBondContact O-N 2.82Å
68L52.7Low52.4Low105 Ų105106.9 Ų106.955%0.5558%0.578SS.*Hα-helixtrans-60.5-44.8173.7-111.4144000111.6M64 L65 I71 L72M64-L68 WeakPolarHBondContact O-CB 3.24Å; M64-L68 PolarHBondContact O-N 3.3Å; L65-L68 PolarHBondContact O-N 3.22Å; L68-I71 PolarHBondContact O-N 2.88Å; L68-L72 HydrophobicContact CD2-CD1 4.5Å; L68-L72 WeakPolarHBondContact O-CB 3.3Å; L68-L72 WeakPolarHBondContact O-CG 3.42Å; L68-L72 PolarHBondContact O-N 2.76Å
69L56.5Low52.2Low105 Ų105107.9 Ų107.955%0.5558%0.58SS.*Hα-helixtrans-66.7-37.9175.7-74.8168.1000112.7L65 R66 L72 N73L65-L69 HydrophobicContact CD2-CD1 4.45Å; L65-L69 HydrophobicContact CG-CD1 4.19Å; L65-L69 WeakPolarHBondContact O-CB 3.3Å; L65-L69 WeakPolarHBondContact O-CG 3.33Å; L65-L69 PolarHBondContact O-N 3.05Å; R66-L69 PolarHBondContact O-N 3.19Å; L69-L72 PolarHBondContact O-N 3.41Å; L69-N73 WeakPolarHBondContact O-CB 3.4Å; L69-N73 PolarHBondContact O-N 3.16Å
70L57Low52.1Low101 Ų101107.7 Ų107.753%0.52958%0.578SS.*Hα-helixtrans-64.9-44.8174.6-107.7145.4000111.6R66 T67 L72 N73 V74R66-L70 HydrophobicContact CG-CD1 4.44Å; R66-L70 VanDerWaalsContact O-CB 3.29Å; R66-L70 WeakPolarHBondContact O-CB 3.5Å; R66-L70 PolarHBondContact O-N 3.41Å; T67-L70 PolarHBondContact O-N 2.95Å; L70-L72 VanDerWaalsContact C-N 3.32Å; L70-L72 PolarHBondContact O-N 3.48Å; L70-N73 PolarHBondContact O-N 3.41Å; L70-V74 WeakPolarHBondContact O-CB 3.14Å; L70-V74 WeakPolarHBondContact O-CG2 3.24Å; L70-V74 PolarHBondContact O-N 3.24Å
71I59Low51.5Low92 Ų92106.5 Ų106.547%0.47258%0.577SS.*Hα-helixtrans-63.5-41.8177.5-68.3166.4000110.3T67 L68 A75T67-I71 HydrophobicContact CG2-CD1 3.98Å; T67-I71 WeakPolarHBondContact O-CB 3.11Å; T67-I71 VanDerWaalsContact O-CG1 3.24Å; T67-I71 WeakPolarHBondContact O-CG1 3.16Å; T67-I71 PolarHBondContact O-N 2.82Å; L68-I71 PolarHBondContact O-N 2.88Å; I71-A75 VanDerWaalsContact O-CB 3.28Å; I71-A75 WeakPolarHBondContact O-CB 3.34Å; I71-A75 PolarHBondContact O-N 3.31Å
72L54.9Low51.5Low101 Ų101105.1 Ų105.153%0.52958%0.575SS.*Hα-helixtrans-64.9-45.6175.2-80.5163000111.7L68 L69 L70 V74 A75 T76L68-L72 HydrophobicContact CD2-CD1 4.5Å; L68-L72 WeakPolarHBondContact O-CB 3.3Å; L68-L72 WeakPolarHBondContact O-CG 3.42Å; L68-L72 PolarHBondContact O-N 2.76Å; L69-L72 PolarHBondContact O-N 3.41Å; L70-L72 VanDerWaalsContact C-N 3.32Å; L70-L72 PolarHBondContact O-N 3.48Å; L72-V74 PolarHBondContact O-N 2.77Å; L72-A75 CarbonylContact O-C 3.53Å; L72-A75 WeakPolarHBondContact O-CB 3.29Å; L72-A75 PolarHBondContact O-N 2.9Å; L72-A75 VanDerWaalsContact O-N 3.14Å; L72-T76 PolarHBondContact O-N 2.93Å; L72-T76 PolarHBondContact O-OG1 3.35Å
73N54.6Low51.4Low106 Ų106107.1 Ų107.157%0.56758%0.578SS**Hα-helixtrans-64.8-40.8179.8-164.418.8000111.8L69 L70 A75 T76 S77L69-N73 WeakPolarHBondContact O-CB 3.4Å; L69-N73 PolarHBondContact O-N 3.16Å; L70-N73 PolarHBondContact O-N 3.41Å; N73-A75 VanDerWaalsContact C-N 3.3Å; N73-A75 PolarHBondContact O-N 2.8Å; N73-T76 WeakPolarHBondContact CA-OG1 3.26Å; N73-T76 PolarHBondContact O-N 3.33Å; N73-T76 PolarHBondContact O-OG1 2.88Å; N73-T76 VanDerWaalsContact O-OG1 3.12Å; N73-S77 VanDerWaalsContact O-CB 3.28Å; N73-S77 WeakPolarHBondContact O-CB 3.16Å; N73-S77 PolarHBondContact O-N 2.91Å; N73-S77 PolarHBondContact O-OG 3.3Å
74V49Very low51.2Low63 Ų63105.5 Ų105.538%0.38258%0.581SS.*Hα-helixtrans-66.9-32.4174.2171.10000111.5L70 L72 N78L70-V74 WeakPolarHBondContact O-CB 3.14Å; L70-V74 WeakPolarHBondContact O-CG2 3.24Å; L70-V74 PolarHBondContact O-N 3.24Å; L72-V74 PolarHBondContact O-N 2.77Å; V74-N78 PolarHBondContact O-ND2 2.79Å
75A49.8Very low51.2Low47 Ų47103.6 Ų103.639%0.38857%0.573SS.*Hα-helixtrans-73.1-33.1174.200000112.3I71 L72 N73 W93I71-A75 VanDerWaalsContact O-CB 3.28Å; I71-A75 WeakPolarHBondContact O-CB 3.34Å; I71-A75 PolarHBondContact O-N 3.31Å; L72-A75 CarbonylContact O-C 3.53Å; L72-A75 WeakPolarHBondContact O-CB 3.29Å; L72-A75 PolarHBondContact O-N 2.9Å; L72-A75 VanDerWaalsContact O-N 3.14Å; N73-A75 VanDerWaalsContact C-N 3.3Å; N73-A75 PolarHBondContact O-N 2.8Å; A75-W93 HydrophobicContact CB-CH2 4.48Å
76T53.4Low50.9Low108 Ų108104 Ų10466%0.66357%0.57SS**Hα-helixtrans-84.8-25177.643.80000114.3L72 N73L72-T76 PolarHBondContact O-N 2.93Å; L72-T76 PolarHBondContact O-OG1 3.35Å; N73-T76 WeakPolarHBondContact CA-OG1 3.26Å; N73-T76 PolarHBondContact O-N 3.33Å; N73-T76 PolarHBondContact O-OG1 2.88Å; N73-T76 VanDerWaalsContact O-OG1 3.12Å
77S49.9Very low51.1Low75 Ų75104.4 Ų104.452%0.52457%0.572SS.*SBendtrans-86.61.4-177.476.10000114.9N73N73-S77 VanDerWaalsContact O-CB 3.28Å; N73-S77 WeakPolarHBondContact O-CB 3.16Å; N73-S77 PolarHBondContact O-N 2.91Å; N73-S77 PolarHBondContact O-OG 3.3Å
78N44.4Very low51Low94 Ų94108.3 Ų108.350%0.50358%0.582SS.*  trans-112.242.9-174.5-80.5-53.2000113.9V74V74-N78 PolarHBondContact O-ND2 2.79Å
79D45.4Very low51Low122 Ų122109 Ų10965%0.65258%0.578SS**  trans-99.6136.8156.8-112.6-31000107.9K86D79-K86 IonicContact OD1-NZ 3.86Å
80P43.4Very low50.9Low109 Ų109112.3 Ų112.371%0.70858%0.583SS**  cis-141.685.212.137.3-13.8000112.9S82P80-S82 PolarHBondContact O-N 3.44Å
81L41.3Very low51.1Low144 Ų144115.9 Ų115.975%0.75459%0.589SS**SBendtrans-88.591.2174.4-78.2165.6000111.2
82S45.1Very low51Low71 Ų71120.7 Ų120.750%0.49760%0.602SS.*  trans51.5121.4158.8172.20000116.9P80 M84 N85 K86P80-S82 PolarHBondContact O-N 3.44Å; S82-M84 PolarHBondContact O-N 3.33Å; S82-N85 PolarHBondContact O-N 3.45Å; S82-K86 PolarHBondContact O-N 3.14Å
83S50.4Low50.9Low107 Ų107119.4 Ų119.475%0.74859%0.59SS**Hα-helixtrans-49.4-25.1179.358.10000114.5
84M47.1Very low50.9Low165 Ų165120 Ų12081%0.81358%0.584SS**Hα-helixtrans-76.6-28.3178.5-157.7168176.500113.3S82S82-M84 PolarHBondContact O-N 3.33Å
85N56.3Low51.4Low87 Ų87126.9 Ų126.947%0.46560%0.604SS.*Hα-helixtrans-84.7-20.5175.5-91.1-24.7000113.7S82 R87 K88 W89S82-N85 PolarHBondContact O-N 3.45Å; N85-R87 PolarHBondContact O-N 3.43Å; N85-R87 VanDerWaalsContact O-N 3.16Å; N85-K88 PolarHBondContact O-N 3.35Å; N85-K88 VanDerWaalsContact O-N 3.16Å; N85-W89 VanDerWaalsContact O-CB 3.27Å; N85-W89 WeakPolarHBondContact O-CB 3.28Å; N85-W89 PolarHBondContact O-N 3.46Å
86K46.4Very low51.3Low118 Ų118130.3 Ų130.351%0.51362%0.615SS.*Hα-helixtrans-54.4-36.7176.9-73.9-172.3175.3-174.30112.6D79 S82 R90D79-K86 IonicContact OD1-NZ 3.86Å; S82-K86 PolarHBondContact O-N 3.14Å; K86-R90 WeakPolarHBondContact O-CB 3.33Å; K86-R90 PolarHBondContact O-N 2.9Å
87R57.2Low51.2Low197 Ų197127.8 Ų127.874%0.74360%0.601SS**Hα-helixtrans-72.3-42.2-179.9-138.6178.7-160.8-1786.4112.5N85 R91N85-R87 PolarHBondContact O-N 3.43Å; N85-R87 VanDerWaalsContact O-N 3.16Å; R87-R91 PolarHBondContact O-N 2.75Å; R87-R91 VanDerWaalsContact O-N 3.13Å
88K57Low51Low157 Ų157132 Ų13268%0.68361%0.605SS**Hα-helixtrans-67.2-44.6174.8-84-177.7178175.90111.1N85 R91 R92N85-K88 PolarHBondContact O-N 3.35Å; N85-K88 VanDerWaalsContact O-N 3.16Å; K88-R91 PolarHBondContact O-N 3.36Å; K88-R92 PolarHBondContact O-N 3.16Å
89W52.2Low51.2Low120 Ų120130.9 Ų130.946%0.45560%0.603SS.*Hα-helixtrans-61.2-49177-174.694.1000111.1N85 R91 R92 W93N85-W89 VanDerWaalsContact O-CB 3.27Å; N85-W89 WeakPolarHBondContact O-CB 3.28Å; N85-W89 PolarHBondContact O-N 3.46Å; W89-R91 VanDerWaalsContact C-N 3.3Å; W89-R91 PolarHBondContact O-N 2.85Å; W89-R92 PolarHBondContact O-N 3.06Å; W89-W93 AromaticContact CD1-CD1 3.69Å; W89-W93 AromaticContact CD1-NE1 3.7Å; W89-W93 AromaticContact CD2-CD1 3.25Å; W89-W93 HydrophobicContact CD2-CG 4.05Å; W89-W93 AromaticContact CD2-NE1 3.62Å; W89-W93 AromaticContact CE2-CD1 3.09Å; W89-W93 AromaticContact CE2-CE2 3.66Å; W89-W93 AromaticContact CE2-CG 3.97Å; W89-W93 AromaticContact CE2-NE1 2.89Å; W89-W93 AromaticContact CE3-CD1 3.79Å; W89-W93 HydrophobicContact CE3-CG 4.15Å; W89-W93 AromaticContact CG-CD1 3.67Å; W89-W93 AromaticContact CH2-CD1 3.97Å; W89-W93 HydrophobicContact CH2-CD2 4.01Å; W89-W93 AromaticContact CH2-CE2 3.87Å; W89-W93 HydrophobicContact CH2-CG 4.05Å; W89-W93 HydrophobicContact CH2-CZ2 4.39Å; W89-W93 AromaticContact CH2-NE1 3.89Å; W89-W93 AromaticContact CZ2-CD1 3.5Å; W89-W93 VanDerWaalsContact CZ2-CD1 3.5Å; W89-W93 AromaticContact CZ2-CD2 3.89Å; W89-W93 HydrophobicContact CZ2-CD2 3.89Å; W89-W93 AromaticContact CZ2-CE2 3.29Å; W89-W93 AromaticContact CZ2-CG 3.98Å; W89-W93 HydrophobicContact CZ2-CG 3.98Å; W89-W93 AromaticContact CZ2-CZ2 3.75Å; W89-W93 HydrophobicContact CZ2-CZ2 3.75Å; W89-W93 AromaticContact CZ2-NE1 3.07Å; W89-W93 HydrophobicContact CZ3-CG 4.15Å; W89-W93 AromaticContact NE1-CD1 3.38Å; W89-W93 AromaticContact NE1-NE1 2.97Å; W89-W93 WeakPolarHBondContact O-CB 3.5Å; W89-W93 PolarHBondContact O-N 3.04Å
90R55.1Low51.6Low175 Ų175128.7 Ų128.766%0.6659%0.594SS**Hα-helixtrans-58.4-40.3176.3-169.2-177.1-86.4-167.7-3.4111.5K86 W94K86-R90 WeakPolarHBondContact O-CB 3.33Å; K86-R90 PolarHBondContact O-N 2.9Å; R90-W94 WeakPolarHBondContact O-CB 3.42Å; R90-W94 VanDerWaalsContact O-CD1 3.25Å; R90-W94 PolarHBondContact O-N 2.79Å
91R61.5Low51.9Low175 Ų175128 Ų12866%0.6658%0.584SS**Hα-helixtrans-65.8-42173.6-79.2-175.6-172.2175.12.7112.9R87 K88 W89 W94 R95R87-R91 PolarHBondContact O-N 2.75Å; R87-R91 VanDerWaalsContact O-N 3.13Å; K88-R91 PolarHBondContact O-N 3.36Å; W89-R91 VanDerWaalsContact C-N 3.3Å; W89-R91 PolarHBondContact O-N 2.85Å; R91-W94 PolarHBondContact O-N 3.28Å; R91-R95 PolarHBondContact O-N 3.36Å; R91-R95 VanDerWaalsContact O-N 3.16Å
92R56.7Low52.6Low193 Ų193125 Ų12573%0.72857%0.567SS**Hα-helixtrans-68.5-42.7179.9-146.3175.6-154.8171.34.8111.2K88 W89 R95 L96K88-R92 PolarHBondContact O-N 3.16Å; W89-R92 PolarHBondContact O-N 3.06Å; R92-R95 PolarHBondContact O-N 3.45Å; R92-L96 PolarHBondContact O-N 3.39Å
93W51.8Low53.1Low74 Ų74130.6 Ų130.628%0.2858%0.578SS.*Hα-helixtrans-61.6-42.4172.9-91.480.2000112.6A75 W89 R95 L96 C97A75-W93 HydrophobicContact CB-CH2 4.48Å; W89-W93 AromaticContact CD1-CD1 3.69Å; W89-W93 AromaticContact CD1-NE1 3.7Å; W89-W93 AromaticContact CD2-CD1 3.25Å; W89-W93 HydrophobicContact CD2-CG 4.05Å; W89-W93 AromaticContact CD2-NE1 3.62Å; W89-W93 AromaticContact CE2-CD1 3.09Å; W89-W93 AromaticContact CE2-CE2 3.66Å; W89-W93 AromaticContact CE2-CG 3.97Å; W89-W93 AromaticContact CE2-NE1 2.89Å; W89-W93 AromaticContact CE3-CD1 3.79Å; W89-W93 HydrophobicContact CE3-CG 4.15Å; W89-W93 AromaticContact CG-CD1 3.67Å; W89-W93 AromaticContact CH2-CD1 3.97Å; W89-W93 HydrophobicContact CH2-CD2 4.01Å; W89-W93 AromaticContact CH2-CE2 3.87Å; W89-W93 HydrophobicContact CH2-CG 4.05Å; W89-W93 HydrophobicContact CH2-CZ2 4.39Å; W89-W93 AromaticContact CH2-NE1 3.89Å; W89-W93 AromaticContact CZ2-CD1 3.5Å; W89-W93 VanDerWaalsContact CZ2-CD1 3.5Å; W89-W93 AromaticContact CZ2-CD2 3.89Å; W89-W93 HydrophobicContact CZ2-CD2 3.89Å; W89-W93 AromaticContact CZ2-CE2 3.29Å; W89-W93 AromaticContact CZ2-CG 3.98Å; W89-W93 HydrophobicContact CZ2-CG 3.98Å; W89-W93 AromaticContact CZ2-CZ2 3.75Å; W89-W93 HydrophobicContact CZ2-CZ2 3.75Å; W89-W93 AromaticContact CZ2-NE1 3.07Å; W89-W93 HydrophobicContact CZ3-CG 4.15Å; W89-W93 AromaticContact NE1-CD1 3.38Å; W89-W93 AromaticContact NE1-NE1 2.97Å; W89-W93 WeakPolarHBondContact O-CB 3.5Å; W89-W93 PolarHBondContact O-N 3.04Å; W93-R95 VanDerWaalsContact C-N 3.29Å; W93-R95 PolarHBondContact O-N 3.24Å; W93-L96 PolarHBondContact O-N 3.34Å; W93-C97 WeakPolarHBondContact O-CB 3.38Å; W93-C97 PolarHBondContact O-N 2.81Å
94W55.8Low53.3Low119 Ų119129.3 Ų129.345%0.45156%0.562SS.*Hα-helixtrans-60.5-37.5173.6-98.7103.3000112.9F21 R90 R91 R98F21-W94 AromaticContact CD1-CH2 3.93Å; F21-W94 HydrophobicContact CD1-CH2 3.93Å; F21-W94 AromaticContact CD1-CZ2 3.53Å; F21-W94 HydrophobicContact CD1-CZ2 3.53Å; F21-W94 AromaticContact CE1-CZ2 3.88Å; F21-W94 HydrophobicContact CE1-CZ2 3.88Å; R90-W94 WeakPolarHBondContact O-CB 3.42Å; R90-W94 VanDerWaalsContact O-CD1 3.25Å; R90-W94 PolarHBondContact O-N 2.79Å; R91-W94 PolarHBondContact O-N 3.28Å; W94-R98 WeakPolarHBondContact O-CB 2.9Å; W94-R98 PolarHBondContact O-N 2.9Å
95R59.8Low53.6Low208 Ų208124.6 Ų124.679%0.78554%0.54SS*.Hα-helixtrans-69.1-39.9176.7-72.3-177.1-174.7179.10.4112.4R91 R92 W93 P99R91-R95 PolarHBondContact O-N 3.36Å; R91-R95 VanDerWaalsContact O-N 3.16Å; R92-R95 PolarHBondContact O-N 3.45Å; W93-R95 VanDerWaalsContact C-N 3.29Å; W93-R95 PolarHBondContact O-N 3.24Å; R95-P99 VanDerWaalsContact O-CD 3.24Å; R95-P99 WeakPolarHBondContact O-CD 3.14Å
96L48.3Very low53.4Low119 Ų119125.4 Ų125.462%0.62354%0.543SS*.Hα-helixtrans-77.1-36.3-179-78.6160.9000113.1R92 W93 T100R92-L96 PolarHBondContact O-N 3.39Å; W93-L96 PolarHBondContact O-N 3.34Å; L96-T100 PolarHBondContact O-OG1 2.83Å
97C49.6Very low53.8Low54 Ų54124.6 Ų124.637%0.36555%0.548SS..Hα-helixtrans-85.5-30.3-172.8-151.40000112.7W93 T100 L101W93-C97 WeakPolarHBondContact O-CB 3.38Å; W93-C97 PolarHBondContact O-N 2.81Å; C97-T100 PolarHBondContact O-N 3.43Å; C97-L101 VanDerWaalsContact O-CB 3.24Å; C97-L101 WeakPolarHBondContact O-CB 3.21Å; C97-L101 PolarHBondContact O-N 2.76Å
98R45.7Very low53.4Low164 Ų164120.9 Ų120.962%0.61954%0.543SS*.Hα-helixtrans-57.4-47.5-178.1-165.9174.8-168176.52.8114.6W94 I102W94-R98 WeakPolarHBondContact O-CB 2.9Å; W94-R98 PolarHBondContact O-N 2.9Å; R98-I102 HydrophobicContact CG-CD1 3.78Å; R98-I102 VanDerWaalsContact O-CB 3.3Å; R98-I102 WeakPolarHBondContact O-CB 3.49Å; R98-I102 WeakPolarHBondContact O-CD1 3.04Å; R98-I102 WeakPolarHBondContact O-CG1 3.48Å; R98-I102 PolarHBondContact O-N 2.86Å
99P48.9Very low53.1Low70 Ų70118 Ų11846%0.45553%0.53SS..Hα-helixtrans-69.8-36.2-179.926-32.8000112.6R95 R103R95-P99 VanDerWaalsContact O-CD 3.24Å; R95-P99 WeakPolarHBondContact O-CD 3.14Å; P99-R103 WeakPolarHBondContact O-CB 3.27Å; P99-R103 PolarHBondContact O-N 3.48Å
100T54.8Low52.6Low76 Ų76120.8 Ų120.847%0.46654%0.541SS..Hα-helixtrans-72.6-41.9-178.8-43.50000111.4L96 C97 R103 I104L96-T100 PolarHBondContact O-OG1 2.83Å; C97-T100 PolarHBondContact O-N 3.43Å; T100-R103 PolarHBondContact O-N 3.4Å; T100-I104 HydrophobicContact CG2-CD1 4.1Å; T100-I104 WeakPolarHBondContact O-CB 3.47Å; T100-I104 VanDerWaalsContact O-CG1 3.3Å; T100-I104 WeakPolarHBondContact O-CG1 3.47Å; T100-I104 PolarHBondContact O-N 2.8Å
101L49.8Very low52.2Low96 Ų96117 Ų11750%0.50354%0.538SS..Hα-helixtrans-66.9-40.8176.3-157114.8000111C97 I104 L105C97-L101 VanDerWaalsContact O-CB 3.24Å; C97-L101 WeakPolarHBondContact O-CB 3.21Å; C97-L101 PolarHBondContact O-N 2.76Å; L101-I104 PolarHBondContact O-N 3.47Å; L101-L105 HydrophobicContact CD2-CD1 3.72Å; L101-L105 HydrophobicContact CG-CD1 4.3Å; L101-L105 VanDerWaalsContact O-CB 3.3Å; L101-L105 WeakPolarHBondContact O-CB 3.25Å; L101-L105 WeakPolarHBondContact O-CD1 3.23Å; L101-L105 WeakPolarHBondContact O-CG 3.47Å; L101-L105 PolarHBondContact O-N 3.11Å
102I55.4Low51.7Low79 Ų79111.2 Ų111.241%0.40553%0.525SS..Hα-helixtrans-63.8-41.4173.1-70.2168.4000110.9R98 L106R98-I102 HydrophobicContact CG-CD1 3.78Å; R98-I102 VanDerWaalsContact O-CB 3.3Å; R98-I102 WeakPolarHBondContact O-CB 3.49Å; R98-I102 WeakPolarHBondContact O-CD1 3.04Å; R98-I102 WeakPolarHBondContact O-CG1 3.48Å; R98-I102 PolarHBondContact O-N 2.86Å; I102-L106 HydrophobicContact CG2-CD1 3.59Å; I102-L106 HydrophobicContact CG2-CG 4.14Å; I102-L106 VanDerWaalsContact O-CB 3.22Å; I102-L106 WeakPolarHBondContact O-CB 3.22Å; I102-L106 VanDerWaalsContact O-CG 3.23Å; I102-L106 WeakPolarHBondContact O-CG 3.35Å; I102-L106 PolarHBondContact O-N 3.3Å
103R55.9Low50.9Low189 Ų189106 Ų10671%0.71351%0.511SS*.Hα-helixtrans-62.6-48.3174.8-87.9-175.7-173164.22.6111.6P99 T100 L105 L106 T107P99-R103 WeakPolarHBondContact O-CB 3.27Å; P99-R103 PolarHBondContact O-N 3.48Å; T100-R103 PolarHBondContact O-N 3.4Å; R103-L105 VanDerWaalsContact C-N 3.34Å; R103-L105 PolarHBondContact O-N 3.12Å; R103-L106 PolarHBondContact O-N 3.38Å; R103-T107 VanDerWaalsContact O-CB 3.26Å; R103-T107 WeakPolarHBondContact O-CB 3.34Å; R103-T107 PolarHBondContact O-N 2.76Å; R103-T107 PolarHBondContact O-OG1 3.2Å
104I54.4Low50.2Low81 Ų81107.9 Ų107.942%0.41553%0.526SS..Hα-helixtrans-62.7-43.2179.7-69166.5000110.5T100 L101 T107 L108T100-I104 HydrophobicContact CG2-CD1 4.1Å; T100-I104 WeakPolarHBondContact O-CB 3.47Å; T100-I104 VanDerWaalsContact O-CG1 3.3Å; T100-I104 WeakPolarHBondContact O-CG1 3.47Å; T100-I104 PolarHBondContact O-N 2.8Å; L101-I104 PolarHBondContact O-N 3.47Å; I104-T107 PolarHBondContact O-N 3.3Å; I104-L108 HydrophobicContact CG2-CD1 3.57Å; I104-L108 HydrophobicContact CG2-CG 4.28Å; I104-L108 VanDerWaalsContact O-CB 3.25Å; I104-L108 WeakPolarHBondContact O-CB 3.3Å; I104-L108 WeakPolarHBondContact O-CD1 3.49Å; I104-L108 WeakPolarHBondContact O-CG 3.42Å; I104-L108 PolarHBondContact O-N 2.91Å
105L53.4Low49.6Very low66 Ų66111.7 Ų111.735%0.34654%0.54SS..Hα-helixtrans-61.5-50.3173.9-70.5166.6000111L101 R103 T107 L108 F109L101-L105 HydrophobicContact CD2-CD1 3.72Å; L101-L105 HydrophobicContact CG-CD1 4.3Å; L101-L105 VanDerWaalsContact O-CB 3.3Å; L101-L105 WeakPolarHBondContact O-CB 3.25Å; L101-L105 WeakPolarHBondContact O-CD1 3.23Å; L101-L105 WeakPolarHBondContact O-CG 3.47Å; L101-L105 PolarHBondContact O-N 3.11Å; R103-L105 VanDerWaalsContact C-N 3.34Å; R103-L105 PolarHBondContact O-N 3.12Å; L105-T107 VanDerWaalsContact C-N 3.31Å; L105-T107 PolarHBondContact O-N 3.03Å; L105-L108 PolarHBondContact O-N 3.47Å; L105-F109 HydrophobicContact CB-CD2 4.25Å; L105-F109 HydrophobicContact CB-CE2 4.46Å; L105-F109 HydrophobicContact CD2-CD2 4.34Å; L105-F109 HydrophobicContact CD2-CE2 3.73Å; L105-F109 WeakPolarHBondContact O-CB 3.21Å; L105-F109 WeakPolarHBondContact O-CD2 3.48Å; L105-F109 WeakPolarHBondContact O-CG 3.26Å; L105-F109 PolarHBondContact O-N 2.89Å
106L51.1Low49Very low103 Ų103105.8 Ų105.854%0.53953%0.527SS..Hα-helixtrans-62.4-35.5178.1-76.3171.6000112.8I102 R103 R110I102-L106 HydrophobicContact CG2-CD1 3.59Å; I102-L106 HydrophobicContact CG2-CG 4.14Å; I102-L106 VanDerWaalsContact O-CB 3.22Å; I102-L106 WeakPolarHBondContact O-CB 3.22Å; I102-L106 VanDerWaalsContact O-CG 3.23Å; I102-L106 WeakPolarHBondContact O-CG 3.35Å; I102-L106 PolarHBondContact O-N 3.3Å; R103-L106 PolarHBondContact O-N 3.38Å; L106-R110 WeakPolarHBondContact O-CA 3.35Å; L106-R110 WeakPolarHBondContact O-CB 3.19Å; L106-R110 WeakPolarHBondContact O-CG 3.49Å; L106-R110 PolarHBondContact O-N 3.17Å
107T54.6Low48.5Very low101 Ų101103.2 Ų103.262%0.6252%0.519SS*.Hα-helixtrans-72.4-43.8177.9-59.10000111R103 I104 L105 F109R103-T107 VanDerWaalsContact O-CB 3.26Å; R103-T107 WeakPolarHBondContact O-CB 3.34Å; R103-T107 PolarHBondContact O-N 2.76Å; R103-T107 PolarHBondContact O-OG1 3.2Å; I104-T107 PolarHBondContact O-N 3.3Å; L105-T107 VanDerWaalsContact C-N 3.31Å; L105-T107 PolarHBondContact O-N 3.03Å; T107-F109 VanDerWaalsContact C-N 3.31Å; T107-F109 PolarHBondContact O-N 3.45Å
108L50.5Low47.8Very low120 Ų120109.8 Ų109.863%0.62854%0.536SS*.Hα-helixtrans-66.8-32.2176.3-75167.4000112.5I104 L105 S112I104-L108 HydrophobicContact CG2-CD1 3.57Å; I104-L108 HydrophobicContact CG2-CG 4.28Å; I104-L108 VanDerWaalsContact O-CB 3.25Å; I104-L108 WeakPolarHBondContact O-CB 3.3Å; I104-L108 WeakPolarHBondContact O-CD1 3.49Å; I104-L108 WeakPolarHBondContact O-CG 3.42Å; I104-L108 PolarHBondContact O-N 2.91Å; L105-L108 PolarHBondContact O-N 3.47Å; L108-S112 PolarHBondContact O-OG 3.23Å
109F50.3Low48.1Very low95 Ų95107.9 Ų107.942%0.41754%0.537SS..Hα-helixtrans-96.2-12.7-176.9-75.6-57.5000114.7L105 T107 S112 I113L105-F109 HydrophobicContact CB-CD2 4.25Å; L105-F109 HydrophobicContact CB-CE2 4.46Å; L105-F109 HydrophobicContact CD2-CD2 4.34Å; L105-F109 HydrophobicContact CD2-CE2 3.73Å; L105-F109 WeakPolarHBondContact O-CB 3.21Å; L105-F109 WeakPolarHBondContact O-CD2 3.48Å; L105-F109 WeakPolarHBondContact O-CG 3.26Å; L105-F109 PolarHBondContact O-N 2.89Å; T107-F109 VanDerWaalsContact C-N 3.31Å; T107-F109 PolarHBondContact O-N 3.45Å; F109-S112 PolarHBondContact O-N 2.93Å; F109-I113 HydrophobicContact CB-CB 4.24Å; F109-I113 HydrophobicContact CB-CD1 3.41Å; F109-I113 VanDerWaalsContact CB-CD1 3.41Å; F109-I113 HydrophobicContact CB-CG1 3.61Å; F109-I113 HydrophobicContact CD1-CD1 3.4Å; F109-I113 HydrophobicContact CD1-CG1 3.51Å; F109-I113 HydrophobicContact CD2-CD1 4.11Å; F109-I113 HydrophobicContact CE1-CD1 4.14Å; F109-I113 HydrophobicContact CE1-CG1 4.43Å; F109-I113 HydrophobicContact CG-CD1 3.37Å; F109-I113 HydrophobicContact CG-CG1 3.81Å; F109-I113 WeakPolarHBondContact O-CA 3.46Å; F109-I113 VanDerWaalsContact O-CB 3.25Å; F109-I113 WeakPolarHBondContact O-CB 3.25Å; F109-I113 PolarHBondContact O-N 3.46Å
110R40.8Very low48.1Very low180 Ų180108.1 Ų108.168%0.67954%0.538SS*.Hα-helixtrans-57.4-45-175.3-114.1-179.2173.3177.9-2.2114L106 L114L106-R110 WeakPolarHBondContact O-CA 3.35Å; L106-R110 WeakPolarHBondContact O-CB 3.19Å; L106-R110 WeakPolarHBondContact O-CG 3.49Å; L106-R110 PolarHBondContact O-N 3.17Å; R110-L114 VanDerWaalsContact O-CB 3.29Å; R110-L114 WeakPolarHBondContact O-CB 3.28Å; R110-L114 VanDerWaalsContact O-CD1 3.26Å; R110-L114 WeakPolarHBondContact O-CD1 3.36Å; R110-L114 VanDerWaalsContact O-CG 3.28Å; R110-L114 WeakPolarHBondContact O-CG 3.29Å
111P47.4Very low47.7Very low94 Ų94107.8 Ų107.861%0.6154%0.538SS*.Hα-helixtrans-82.3-31.2179.826.2-26.1000113.6
112S50.3Low47.7Very low54 Ų54108 Ų10838%0.37854%0.538SS..Hα-helixtrans-83.2-48.6-177.450.20000112.4L108 F109 L114 R115 T116L108-S112 PolarHBondContact O-OG 3.23Å; F109-S112 PolarHBondContact O-N 2.93Å; S112-L114 PolarHBondContact O-N 2.82Å; S112-R115 PolarHBondContact O-N 2.8Å; S112-T116 PolarHBondContact O-N 2.92Å; S112-T116 PolarHBondContact O-OG1 3.44Å
113I40.6Very low47.4Very low83 Ų83112.6 Ų112.643%0.42655%0.551SS.*Hα-helixtrans-67.6-34.7177.7-64.8-169.6000111.7F109 R115 C117F109-I113 HydrophobicContact CB-CB 4.24Å; F109-I113 HydrophobicContact CB-CD1 3.41Å; F109-I113 VanDerWaalsContact CB-CD1 3.41Å; F109-I113 HydrophobicContact CB-CG1 3.61Å; F109-I113 HydrophobicContact CD1-CD1 3.4Å; F109-I113 HydrophobicContact CD1-CG1 3.51Å; F109-I113 HydrophobicContact CD2-CD1 4.11Å; F109-I113 HydrophobicContact CE1-CD1 4.14Å; F109-I113 HydrophobicContact CE1-CG1 4.43Å; F109-I113 HydrophobicContact CG-CD1 3.37Å; F109-I113 HydrophobicContact CG-CG1 3.81Å; F109-I113 WeakPolarHBondContact O-CA 3.46Å; F109-I113 VanDerWaalsContact O-CB 3.25Å; F109-I113 WeakPolarHBondContact O-CB 3.25Å; F109-I113 PolarHBondContact O-N 3.46Å; I113-R115 VanDerWaalsContact C-N 3.28Å; I113-R115 PolarHBondContact O-N 3.41Å; I113-C117 HydrophobicContact CG2-CB 4.03Å; I113-C117 WeakPolarHBondContact O-CA 2.91Å; I113-C117 WeakPolarHBondContact O-CB 3.45Å; I113-C117 PolarHBondContact O-N 3.37Å
114L37.7Very low47.1Very low115 Ų115112 Ų11260%0.60255%0.548SS*.Hα-helixtrans-65.2-32.2175.9-78.4172.6000112.3R110 S112 R118R110-L114 VanDerWaalsContact O-CB 3.29Å; R110-L114 WeakPolarHBondContact O-CB 3.28Å; R110-L114 VanDerWaalsContact O-CD1 3.26Å; R110-L114 WeakPolarHBondContact O-CD1 3.36Å; R110-L114 VanDerWaalsContact O-CG 3.28Å; R110-L114 WeakPolarHBondContact O-CG 3.29Å; S112-L114 PolarHBondContact O-N 2.82Å; L114-R118 WeakPolarHBondContact O-CB 3.2Å; L114-R118 PolarHBondContact O-N 2.97Å; L114-R118 VanDerWaalsContact O-N 3.16Å
115R41.5Very low46.7Very low198 Ų198117.3 Ų117.375%0.74756%0.563SS**Hα-helixtrans-76.3-49.6173.4-79.9-174.7-176.7172.72.6112.1S112 I113 R118 L119S112-R115 PolarHBondContact O-N 2.8Å; I113-R115 VanDerWaalsContact C-N 3.28Å; I113-R115 PolarHBondContact O-N 3.41Å; R115-R118 PolarHBondContact O-N 2.74Å; R115-L119 WeakPolarHBondContact O-CB 3.26Å; R115-L119 WeakPolarHBondContact O-CG 3.34Å; R115-L119 PolarHBondContact O-N 2.75Å
116T47.8Very low46.8Very low85 Ų85119.2 Ų119.252%0.52157%0.573SS.*Hα-helixtrans-68.8-40.6-178.1-30.20000111.2S112 L119 T120S112-T116 PolarHBondContact O-N 2.92Å; S112-T116 PolarHBondContact O-OG1 3.44Å; T116-L119 PolarHBondContact O-N 2.83Å; T116-T120 WeakPolarHBondContact O-CB 3.44Å; T116-T120 PolarHBondContact O-N 3.4Å; T116-T120 PolarHBondContact O-OG1 2.81Å
117C37.1Very low47.1Very low65 Ų65119.1 Ų119.144%0.43957%0.57SS.*Hα-helixtrans-70.7-36.7176.4-1620000112I113 C121I113-C117 HydrophobicContact CG2-CB 4.03Å; I113-C117 WeakPolarHBondContact O-CA 2.91Å; I113-C117 WeakPolarHBondContact O-CB 3.45Å; I113-C117 PolarHBondContact O-N 3.37Å; C117-C121 WeakPolarHBondContact O-CB 3.12Å; C117-C121 PolarHBondContact O-N 3.16Å
118R36.7Very low47.1Very low191 Ų191119.7 Ų119.772%0.72157%0.569SS**Hα-helixtrans-61.9-46.3170.4-98.3-176.3165173.2-3.7111.4L114 R115 L122L114-R118 WeakPolarHBondContact O-CB 3.2Å; L114-R118 PolarHBondContact O-N 2.97Å; L114-R118 VanDerWaalsContact O-N 3.16Å; R115-R118 PolarHBondContact O-N 2.74Å; R118-L122 VanDerWaalsContact O-CB 3.23Å; R118-L122 WeakPolarHBondContact O-CB 3.23Å; R118-L122 WeakPolarHBondContact O-CD1 3.18Å; R118-L122 PolarHBondContact O-N 2.86Å
119L50.3Low47.4Very low125 Ų125119.3 Ų119.365%0.65457%0.567SS**Hα-helixtrans-66.3-43.7-180-76.3165.6000111.7R115 T116 L122 R123R115-L119 WeakPolarHBondContact O-CB 3.26Å; R115-L119 WeakPolarHBondContact O-CG 3.34Å; R115-L119 PolarHBondContact O-N 2.75Å; T116-L119 PolarHBondContact O-N 2.83Å; L119-L122 PolarHBondContact O-N 2.82Å; L119-R123 WeakPolarHBondContact O-CB 3.5Å; L119-R123 PolarHBondContact O-N 2.8Å
120T50.2Low47.7Very low75 Ų75124 Ų12446%0.4658%0.582SS.*Hα-helixtrans-72.3-34.8179-44.90000112.2T116 R124T116-T120 WeakPolarHBondContact O-CB 3.44Å; T116-T120 PolarHBondContact O-N 3.4Å; T116-T120 PolarHBondContact O-OG1 2.81Å; T120-R124 WeakPolarHBondContact O-CB 3.5Å; T120-R124 PolarHBondContact O-N 2.84Å
121C46.1Very low48.5Very low69 Ų69120.2 Ų120.247%0.46657%0.574SS.*Hα-helixtrans-73.3-36.3172.3-83.20000112.9C117 R125C117-C121 WeakPolarHBondContact O-CB 3.12Å; C117-C121 PolarHBondContact O-N 3.16Å; C121-R125 VanDerWaalsContact O-CB 3.29Å; C121-R125 WeakPolarHBondContact O-CB 3.37Å; C121-R125 PolarHBondContact O-N 2.83Å
122L50.3Low48.8Very low99 Ų99125 Ų12552%0.51858%0.58SS.*Hα-helixtrans-64.3-43.4170.3-105.8126.9000110.4R118 L119 R125 L126R118-L122 VanDerWaalsContact O-CB 3.23Å; R118-L122 WeakPolarHBondContact O-CB 3.23Å; R118-L122 WeakPolarHBondContact O-CD1 3.18Å; R118-L122 PolarHBondContact O-N 2.86Å; L119-L122 PolarHBondContact O-N 2.82Å; L122-R125 PolarHBondContact O-N 3.49Å; L122-L126 HydrophobicContact CD2-CD1 4.35Å; L122-L126 WeakPolarHBondContact O-CB 3.38Å; L122-L126 VanDerWaalsContact O-CG 3.28Å; L122-L126 WeakPolarHBondContact O-CG 3.37Å; L122-L126 PolarHBondContact O-N 3.19Å
123R48.3Very low49.2Very low176 Ų176131.6 Ų131.666%0.66460%0.596SS**Hα-helixtrans-63.9-45.1177.8-157.2174.8-159.6169.45.5111.4L119 L126 E127L119-R123 WeakPolarHBondContact O-CB 3.5Å; L119-R123 PolarHBondContact O-N 2.8Å; R123-L126 PolarHBondContact O-N 3.41Å; R123-E127 WeakPolarHBondContact O-CB 3.41Å; R123-E127 WeakPolarHBondContact O-CG 3.28Å; R123-E127 PolarHBondContact O-N 2.89Å
124R48.8Very low50.2Low176 Ų176132.1 Ų132.166%0.66460%0.599SS**Hα-helixtrans-64.4-39172.6-89.2-174.5172.7178-1.6113.3T120 L128T120-R124 WeakPolarHBondContact O-CB 3.5Å; T120-R124 PolarHBondContact O-N 2.84Å; R124-L128 VanDerWaalsContact O-CB 3.3Å; R124-L128 WeakPolarHBondContact O-CB 3.3Å; R124-L128 WeakPolarHBondContact O-CD1 3.29Å; R124-L128 VanDerWaalsContact O-CG 3.3Å; R124-L128 WeakPolarHBondContact O-CG 3.3Å; R124-L128 PolarHBondContact O-N 2.9Å
125R47.7Very low51Low194 Ų194129.8 Ų129.873%0.73259%0.59SS**Hα-helixtrans-66.5-40.4175-89.9-175.4165.4-171.8-3.8111.7C121 L122 L129C121-R125 VanDerWaalsContact O-CB 3.29Å; C121-R125 WeakPolarHBondContact O-CB 3.37Å; C121-R125 PolarHBondContact O-N 2.83Å; L122-R125 PolarHBondContact O-N 3.49Å; R125-L129 WeakPolarHBondContact O-CB 3.29Å; R125-L129 VanDerWaalsContact O-CG 3.29Å; R125-L129 WeakPolarHBondContact O-CG 3.29Å; R125-L129 PolarHBondContact O-N 2.98Å
126L55.5Low51.7Low105 Ų105129.6 Ų129.655%0.5559%0.589SS.*Hα-helixtrans-69.6-39.2176.8-74.1168.4000111.9L122 R123 L129 R130L122-L126 HydrophobicContact CD2-CD1 4.35Å; L122-L126 WeakPolarHBondContact O-CB 3.38Å; L122-L126 VanDerWaalsContact O-CG 3.28Å; L122-L126 WeakPolarHBondContact O-CG 3.37Å; L122-L126 PolarHBondContact O-N 3.19Å; R123-L126 PolarHBondContact O-N 3.41Å; L126-L129 PolarHBondContact O-N 2.84Å; L126-R130 WeakPolarHBondContact O-CB 3.46Å; L126-R130 PolarHBondContact O-N 3.36Å
127E57.6Low52.4Low102 Ų102131.8 Ų131.848%0.47760%0.595SS.*Hα-helixtrans-64.8-43.6172.7-79.3170.3179.600111.8R123 L129 R130 I131R123-E127 WeakPolarHBondContact O-CB 3.41Å; R123-E127 WeakPolarHBondContact O-CG 3.28Å; R123-E127 PolarHBondContact O-N 2.89Å; E127-L129 VanDerWaalsContact C-N 3.31Å; E127-L129 PolarHBondContact O-N 3.35Å; E127-R130 PolarHBondContact O-N 2.82Å; E127-I131 WeakPolarHBondContact O-CB 3.32Å; E127-I131 VanDerWaalsContact O-CG1 3.29Å; E127-I131 WeakPolarHBondContact O-CG1 3.16Å; E127-I131 PolarHBondContact O-N 3.31Å
128L54Low53.8Low113 Ų113134.1 Ų134.159%0.59260%0.599SS**Hα-helixtrans-63-35.5174.4-79.5165.4000112.5R124 R132R124-L128 VanDerWaalsContact O-CB 3.3Å; R124-L128 WeakPolarHBondContact O-CB 3.3Å; R124-L128 WeakPolarHBondContact O-CD1 3.29Å; R124-L128 VanDerWaalsContact O-CG 3.3Å; R124-L128 WeakPolarHBondContact O-CG 3.3Å; R124-L128 PolarHBondContact O-N 2.9Å; L128-R132 WeakPolarHBondContact O-CB 3.37Å; L128-R132 PolarHBondContact O-N 2.94Å
129L56Low55Low111 Ų111131.8 Ų131.858%0.58159%0.594SS**Hα-helixtrans-69.9-38.5173.3-74.3171.6000112.1R125 L126 E127 R132 R133R125-L129 WeakPolarHBondContact O-CB 3.29Å; R125-L129 VanDerWaalsContact O-CG 3.29Å; R125-L129 WeakPolarHBondContact O-CG 3.29Å; R125-L129 PolarHBondContact O-N 2.98Å; L126-L129 PolarHBondContact O-N 2.84Å; E127-L129 VanDerWaalsContact C-N 3.31Å; E127-L129 PolarHBondContact O-N 3.35Å; L129-R132 PolarHBondContact O-N 3.33Å; L129-R133 WeakPolarHBondContact O-CB 3.48Å; L129-R133 PolarHBondContact O-N 2.96Å
130R57.7Low55.9Low194 Ų194131.3 Ų131.373%0.73259%0.592SS**Hα-helixtrans-67.5-43177-155.1174.8-164.9160.33.3111.2L126 E127 R133 I134L126-R130 WeakPolarHBondContact O-CB 3.46Å; L126-R130 PolarHBondContact O-N 3.36Å; E127-R130 PolarHBondContact O-N 2.82Å; R130-R133 PolarHBondContact O-N 3.46Å; R130-I134 HydrophobicContact CG-CD1 4.36Å; R130-I134 VanDerWaalsContact O-CG1 3.31Å; R130-I134 WeakPolarHBondContact O-CG1 3.4Å; R130-I134 PolarHBondContact O-N 2.83Å
131I56.8Low56.8Low101 Ų101133.5 Ų133.552%0.51860%0.597SS.*Hα-helixtrans-64.7-44.7174.2-66.1166.9000110.4E127 R133 I134 V135E127-I131 WeakPolarHBondContact O-CB 3.32Å; E127-I131 VanDerWaalsContact O-CG1 3.29Å; E127-I131 WeakPolarHBondContact O-CG1 3.16Å; E127-I131 PolarHBondContact O-N 3.31Å; I131-R133 VanDerWaalsContact C-N 3.29Å; I131-R133 PolarHBondContact O-N 3.33Å; I131-I134 PolarHBondContact O-N 3.31Å; I131-V135 HydrophobicContact CG2-CG2 3.99Å; I131-V135 VanDerWaalsContact O-CB 3.3Å; I131-V135 WeakPolarHBondContact O-CB 3.45Å; I131-V135 WeakPolarHBondContact O-CG2 3.31Å; I131-V135 PolarHBondContact O-N 3.4Å
132R53.4Low57.7Low193 Ų193134 Ų13473%0.72859%0.594SS**Hα-helixtrans-60.1-36.3175.6-96.4-175.1176177.4-0.5113.2L128 L129 R136L128-R132 WeakPolarHBondContact O-CB 3.37Å; L128-R132 PolarHBondContact O-N 2.94Å; L129-R132 PolarHBondContact O-N 3.33Å; R132-R136 WeakPolarHBondContact O-CB 3.3Å; R132-R136 PolarHBondContact O-N 3.01Å
133R59.8Low58.1Low193 Ų193131.4 Ų131.473%0.72859%0.587SS**Hα-helixtrans-74.6-40.3179.3-162.6179.3-99.5178-7.6111.7L129 R130 I131 R136 M137L129-R133 WeakPolarHBondContact O-CB 3.48Å; L129-R133 PolarHBondContact O-N 2.96Å; R130-R133 PolarHBondContact O-N 3.46Å; I131-R133 VanDerWaalsContact C-N 3.29Å; I131-R133 PolarHBondContact O-N 3.33Å; R133-R136 PolarHBondContact O-N 2.97Å; R133-M137 PolarHBondContact O-N 3.36Å
134I60.7Low58.7Low94 Ų94125.9 Ų125.948%0.48258%0.579SS.*Hα-helixtrans-63.9-46.5173.2-67.3166.4000110.3R130 I131 R136 M137 H138R130-I134 HydrophobicContact CG-CD1 4.36Å; R130-I134 VanDerWaalsContact O-CG1 3.31Å; R130-I134 WeakPolarHBondContact O-CG1 3.4Å; R130-I134 PolarHBondContact O-N 2.83Å; I131-I134 PolarHBondContact O-N 3.31Å; I134-R136 PolarHBondContact O-N 2.96Å; I134-M137 PolarHBondContact O-N 3.28Å; I134-H138 WeakPolarHBondContact O-CB 3.24Å; I134-H138 PolarHBondContact O-N 3.5Å
135V55.2Low59.3Low67 Ų67121.9 Ų121.941%0.40657%0.57SS.*Hα-helixtrans-63.6-41.5178.6173.90000111.3I131 H138 F139I131-V135 HydrophobicContact CG2-CG2 3.99Å; I131-V135 VanDerWaalsContact O-CB 3.3Å; I131-V135 WeakPolarHBondContact O-CB 3.45Å; I131-V135 WeakPolarHBondContact O-CG2 3.31Å; I131-V135 PolarHBondContact O-N 3.4Å; V135-H138 PolarHBondContact O-N 2.88Å; V135-F139 HydrophobicContact CG1-CD2 3.64Å; V135-F139 HydrophobicContact CG1-CE2 3.86Å; V135-F139 WeakPolarHBondContact O-CB 3.45Å; V135-F139 WeakPolarHBondContact O-CD2 3.44Å; V135-F139 PolarHBondContact O-N 2.92Å
136R56.2Low60Low194 Ų194117.2 Ų117.273%0.73256%0.56SS**Hα-helixtrans-63.8-42.6173.9-90.9-172-177.7178.30.2113R132 R133 I134 H138 N140R132-R136 WeakPolarHBondContact O-CB 3.3Å; R132-R136 PolarHBondContact O-N 3.01Å; R133-R136 PolarHBondContact O-N 2.97Å; I134-R136 PolarHBondContact O-N 2.96Å; R136-H138 VanDerWaalsContact C-N 3.33Å; R136-N140 VanDerWaalsContact O-CB 3.32Å; R136-N140 WeakPolarHBondContact O-CB 3.49Å; R136-N140 VanDerWaalsContact O-CG 3.28Å; R136-N140 PolarHBondContact O-N 2.87Å
137M61.5Low60.2Low130 Ų130119.1 Ų119.164%0.6456%0.564SS**Hα-helixtrans-64.3-40.3175.9-75.9-155.2-76.500111.4R133 I134 N140 H141R133-M137 PolarHBondContact O-N 3.36Å; I134-M137 PolarHBondContact O-N 3.28Å; M137-N140 PolarHBondContact O-N 3Å; M137-H141 WeakPolarHBondContact O-CB 3.35Å; M137-H141 PolarHBondContact O-N 3.47Å
138H67.7Low60.4Low115 Ų115119.4 Ų119.453%0.53257%0.569SS.*Hα-helixtrans-68-42.3178.9-135.6-62.9000112.5I134 V135 R136 H141 I142I134-H138 WeakPolarHBondContact O-CB 3.24Å; I134-H138 PolarHBondContact O-N 3.5Å; V135-H138 PolarHBondContact O-N 2.88Å; R136-H138 VanDerWaalsContact C-N 3.33Å; H138-H141 PolarHBondContact O-N 2.95Å; H138-I142 WeakPolarHBondContact O-CB 3.4Å; H138-I142 VanDerWaalsContact O-CG1 3.24Å; H138-I142 WeakPolarHBondContact O-CG1 3.42Å; H138-I142 PolarHBondContact O-N 3.45Å
139F62.1Low60.6Low142 Ų142118.5 Ų118.562%0.62357%0.568SS**Hα-helixtrans-66.1-40174.8-94.8-84.1000112.1V135 H141 I142 A143V135-F139 HydrophobicContact CG1-CD2 3.64Å; V135-F139 HydrophobicContact CG1-CE2 3.86Å; V135-F139 WeakPolarHBondContact O-CB 3.45Å; V135-F139 WeakPolarHBondContact O-CD2 3.44Å; V135-F139 PolarHBondContact O-N 2.92Å; F139-H141 VanDerWaalsContact C-N 3.35Å; F139-I142 PolarHBondContact O-N 2.9Å; F139-A143 VanDerWaalsContact O-CB 3.29Å; F139-A143 WeakPolarHBondContact O-CB 3.32Å; F139-A143 PolarHBondContact O-N 3Å
140N67.8Low60.8Low114 Ų114118.7 Ų118.761%0.6157%0.569SS**Hα-helixtrans-65.5-38.2175.3-77-1.8000112R136 M137 A143 A144R136-N140 VanDerWaalsContact O-CB 3.32Å; R136-N140 WeakPolarHBondContact O-CB 3.49Å; R136-N140 VanDerWaalsContact O-CG 3.28Å; R136-N140 PolarHBondContact O-N 2.87Å; M137-N140 PolarHBondContact O-N 3Å; N140-A143 PolarHBondContact O-N 2.92Å; N140-A144 WeakPolarHBondContact O-CB 3.33Å; N140-A144 PolarHBondContact O-N 2.99Å
141H70.1Confident60.9Low121 Ų121114.1 Ų114.156%0.5656%0.559SS**Hα-helixtrans-68.8-41.2177.1-165.4-90.4000112.1M137 H138 F139 A144 L145M137-H141 WeakPolarHBondContact O-CB 3.35Å; M137-H141 PolarHBondContact O-N 3.47Å; H138-H141 PolarHBondContact O-N 2.95Å; F139-H141 VanDerWaalsContact C-N 3.35Å; H141-A144 PolarHBondContact O-N 3.48Å; H141-L145 WeakPolarHBondContact ND1-CD1 3.29Å; H141-L145 PolarHBondContact O-N 3.49Å
142I65.3Low61Low80 Ų80113.7 Ų113.741%0.4156%0.56SS.*Hα-helixtrans-67-38.8175.3-67.2166000111.1H138 F139 L145 N146H138-I142 WeakPolarHBondContact O-CB 3.4Å; H138-I142 VanDerWaalsContact O-CG1 3.24Å; H138-I142 WeakPolarHBondContact O-CG1 3.42Å; H138-I142 PolarHBondContact O-N 3.45Å; F139-I142 PolarHBondContact O-N 2.9Å; I142-L145 PolarHBondContact O-N 3.46Å; I142-N146 PolarHBondContact O-N 3.42Å
143A58.7Low61.1Low45 Ų45114.4 Ų114.437%0.37256%0.563SS.*Hα-helixtrans-65.2-43.6174.900000111.6F139 N140 L145 N146 F147F139-A143 VanDerWaalsContact O-CB 3.29Å; F139-A143 WeakPolarHBondContact O-CB 3.32Å; F139-A143 PolarHBondContact O-N 3Å; N140-A143 PolarHBondContact O-N 2.92Å; A143-L145 PolarHBondContact O-N 3.38Å; A143-N146 PolarHBondContact O-N 3.01Å; A143-F147 WeakPolarHBondContact O-CD2 3.28Å; A143-F147 PolarHBondContact O-N 3.38Å
144A60.5Low61.1Low60 Ų60115.3 Ų115.350%0.49657%0.567SS.*Hα-helixtrans-60.1-45.2175.700000111.8N140 H141 F147 D148N140-A144 WeakPolarHBondContact O-CB 3.33Å; N140-A144 PolarHBondContact O-N 2.99Å; H141-A144 PolarHBondContact O-N 3.48Å; A144-F147 PolarHBondContact O-N 3.04Å; A144-D148 PolarHBondContact O-N 3.32Å
145L60.3Low61.2Low91 Ų91117.2 Ų117.248%0.47658%0.578SS.*Hα-helixtrans-61.4-43.3175.5-84.5159.8000112.9H141 I142 A143 D148 V149H141-L145 WeakPolarHBondContact ND1-CD1 3.29Å; H141-L145 PolarHBondContact O-N 3.49Å; I142-L145 PolarHBondContact O-N 3.46Å; A143-L145 PolarHBondContact O-N 3.38Å; L145-D148 PolarHBondContact O-N 3.49Å; L145-V149 VanDerWaalsContact O-CG2 3.28Å; L145-V149 WeakPolarHBondContact O-CG2 3.45Å; L145-V149 PolarHBondContact O-N 2.94Å
146N63.2Low61.4Low97 Ų97119.6 Ų119.652%0.51959%0.593SS.*Hα-helixtrans-68.9-36178.8-84.1-32.5000112.7I142 A143 L150I142-N146 PolarHBondContact O-N 3.42Å; A143-N146 PolarHBondContact O-N 3.01Å; N146-L150 WeakPolarHBondContact O-CB 3.45Å; N146-L150 WeakPolarHBondContact O-CG 3.38Å; N146-L150 PolarHBondContact O-N 3.23Å; N146-L150 VanDerWaalsContact O-N 3.08Å
147F59.4Low61Low145 Ų145116.3 Ų116.364%0.63662%0.619SS**Hα-helixtrans-66.8-38.3174.1-94.3-85.5000111.7A143 A144 L150 L151A143-F147 WeakPolarHBondContact O-CD2 3.28Å; A143-F147 PolarHBondContact O-N 3.38Å; A144-F147 PolarHBondContact O-N 3.04Å; F147-L150 PolarHBondContact O-N 3.42Å; F147-L151 WeakPolarHBondContact O-CB 3.33Å; F147-L151 PolarHBondContact O-N 3.41Å
148D61.5Low61Low107 Ų107115.6 Ų115.657%0.57262%0.618SS**Hα-helixtrans-66.7-42.6177.7-130.33.5000111.7A144 L145 L150 L151 V152A144-D148 PolarHBondContact O-N 3.32Å; L145-D148 PolarHBondContact O-N 3.49Å; D148-L150 VanDerWaalsContact C-N 3.33Å; D148-L150 PolarHBondContact O-N 3.35Å; D148-L151 PolarHBondContact O-N 3.08Å; D148-V152 WeakPolarHBondContact O-CG2 3.44Å; D148-V152 PolarHBondContact O-N 2.96Å
149V58.8Low60.7Low95 Ų95115.6 Ų115.658%0.57662%0.622SS**Hα-helixtrans-64.4-36.5175.5174.60000111.7L145 R153L145-V149 VanDerWaalsContact O-CG2 3.28Å; L145-V149 WeakPolarHBondContact O-CG2 3.45Å; L145-V149 PolarHBondContact O-N 2.94Å; V149-R153 PolarHBondContact O-N 2.66Å
150L59.2Low60.6Low115 Ų115114.2 Ų114.260%0.60262%0.622SS**Hα-helixtrans-71.6-32.1175-81.3163.6000113N146 F147 D148 R154N146-L150 WeakPolarHBondContact O-CB 3.45Å; N146-L150 WeakPolarHBondContact O-CG 3.38Å; N146-L150 PolarHBondContact O-N 3.23Å; N146-L150 VanDerWaalsContact O-N 3.08Å; F147-L150 PolarHBondContact O-N 3.42Å; D148-L150 VanDerWaalsContact C-N 3.33Å; D148-L150 PolarHBondContact O-N 3.35Å; L150-R154 PolarHBondContact O-N 3.24Å
151L60.8Low60.1Low98 Ų98114.2 Ų114.251%0.51362%0.623SS.*Hα-helixtrans-73.1-41.3176.3-109.7140.3000112F147 D148 R153 R154 N155F147-L151 WeakPolarHBondContact O-CB 3.33Å; F147-L151 PolarHBondContact O-N 3.41Å; D148-L151 PolarHBondContact O-N 3.08Å; L151-R153 VanDerWaalsContact C-N 3.29Å; L151-R153 PolarHBondContact O-N 3.45Å; L151-R154 PolarHBondContact O-N 2.94Å; L151-N155 PolarHBondContact O-N 3.47Å
152V58Low59.5Low91 Ų91113.8 Ų113.855%0.55263%0.627SS**Hα-helixtrans-63-37.4175173.60000110.9D148 R154 N155 T156D148-V152 WeakPolarHBondContact O-CG2 3.44Å; D148-V152 PolarHBondContact O-N 2.96Å; V152-R154 VanDerWaalsContact C-N 3.32Å; V152-R154 PolarHBondContact O-N 3.31Å; V152-N155 PolarHBondContact O-N 3.22Å; V152-T156 PolarHBondContact O-N 3.42Å; V152-T156 PolarHBondContact O-OG1 3.19Å
153R56.8Low59.1Low208 Ų208116 Ų11679%0.78564%0.641SS**Hα-helixtrans-70.9-21.1176.8-129-176.7-169.8-166.62.5114.6V149 L151V149-R153 PolarHBondContact O-N 2.66Å; L151-R153 VanDerWaalsContact C-N 3.29Å; L151-R153 PolarHBondContact O-N 3.45Å
154R59.1Low59.2Low213 Ų213121.1 Ų121.180%0.80466%0.66SS**Hα-helixtrans-88.7-21.9177.3-113.2-172.7-177.8178.41113.7L150 L151 V152L150-R154 PolarHBondContact O-N 3.24Å; L151-R154 PolarHBondContact O-N 2.94Å; V152-R154 VanDerWaalsContact C-N 3.32Å; V152-R154 PolarHBondContact O-N 3.31Å
155N63.3Low59.1Low134 Ų134125.8 Ų125.872%0.71767%0.673SS**SBendtrans-95.8-1.1178.1-77.9-10.1000113.5L151 V152L151-N155 PolarHBondContact O-N 3.47Å; V152-N155 PolarHBondContact O-N 3.22Å
156T59.6Low59Low117 Ų117128.7 Ų128.772%0.71869%0.689SS**  trans-116.83.1-178.642.50000114.7V152V152-T156 PolarHBondContact O-N 3.42Å; V152-T156 PolarHBondContact O-OG1 3.19Å
157G48Very low58.6Low124 Ų124131.5 Ų131.5100%1.27871%0.705SS**  trans-125.40170.400000110.3

Retrieved 157 of 157 residues in 160.5 ms (Link to these results)