A0A077ZJF7_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZJF7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 377 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M40.1Very low33.9Very low200 Ų20098.3 Ų98.399%0.98555%0.554SS**  0-29.80-88-172141.100113.2
2S38.9Very low33.4Very low87 Ų8796.3 Ų96.361%0.60854%0.539SS*.Hα-helixtrans-71.3-36.9171.952.60000113.2L5 S6S2-L5 PolarHBondContact O-N 3.1Å; S2-S6 PolarHBondContact O-N 3.43Å
3D35.4Very low32.9Very low121 Ų12195.2 Ų95.265%0.64754%0.542SS*.Hα-helixtrans-76.9-35.5-168.7-57.6-7.1000111.8L5 S6 E7D3-L5 VanDerWaalsContact C-N 3.28Å; D3-L5 PolarHBondContact O-N 2.93Å; D3-S6 WeakPolarHBondContact O-CB 3.5Å; D3-S6 PolarHBondContact O-N 2.99Å; D3-E7 PolarHBondContact O-N 3.16Å
4D41.5Very low33Very low110 Ų11095 Ų9559%0.58853%0.532SS*.Hα-helixtrans-67.5-28.3174.2-57.4-47000112.7V8D4-V8 VanDerWaalsContact O-CG2 3.25Å; D4-V8 WeakPolarHBondContact O-CG2 3.32Å; D4-V8 PolarHBondContact O-N 2.81Å
5L30Very low32.9Very low116 Ų11694.6 Ų94.661%0.60753%0.527SS*.Hα-helixtrans-75.9-32.9175.2-80.4168.7000111.6S2 D3 V8 V9S2-L5 PolarHBondContact O-N 3.1Å; D3-L5 VanDerWaalsContact C-N 3.28Å; D3-L5 PolarHBondContact O-N 2.93Å; L5-V8 PolarHBondContact O-N 2.95Å; L5-V9 WeakPolarHBondContact O-CB 3.39Å; L5-V9 WeakPolarHBondContact O-CG2 3.37Å; L5-V9 PolarHBondContact O-N 3.14Å
6S27.2Very low32.5Very low65 Ų6590.8 Ų90.846%0.45552%0.515SS..Hα-helixtrans-60.7-48.8174.5-172.20000111.1S2 D3 V8 V9 D10S2-S6 PolarHBondContact O-N 3.43Å; D3-S6 WeakPolarHBondContact O-CB 3.5Å; D3-S6 PolarHBondContact O-N 2.99Å; S6-V8 PolarHBondContact O-N 3.23Å; S6-V9 PolarHBondContact O-N 3.23Å; S6-D10 WeakPolarHBondContact O-CB 3.3Å; S6-D10 VanDerWaalsContact O-CG 3.29Å; S6-D10 PolarHBondContact O-N 2.91Å
7E33.1Very low32.4Very low145 Ų14589.1 Ų89.168%0.67851%0.511SS*.Hα-helixtrans-67.3-35-179.1-76-172.5162.300112.9D3 G11D3-E7 PolarHBondContact O-N 3.16Å; E7-G11 PolarHBondContact O-N 3.37Å
8V33.5Very low32.4Very low26 Ų2689.5 Ų89.516%0.15852%0.52CS..Hα-helixtrans-70.8-39.3176.2172.70000111.2D4 L5 S6 G11 I12 N256D4-V8 VanDerWaalsContact O-CG2 3.25Å; D4-V8 WeakPolarHBondContact O-CG2 3.32Å; D4-V8 PolarHBondContact O-N 2.81Å; L5-V8 PolarHBondContact O-N 2.95Å; S6-V8 PolarHBondContact O-N 3.23Å; V8-G11 PolarHBondContact O-N 3.42Å; V8-I12 HydrophobicContact CG1-CD1 3.74Å; V8-I12 HydrophobicContact CG1-CG1 4.47Å; V8-I12 WeakPolarHBondContact O-CB 3.47Å; V8-I12 WeakPolarHBondContact O-CG1 3.48Å; V8-I12 PolarHBondContact O-N 3.41Å; V8-N256 HydrophobicContact CG1-CB 4.24Å; V8-N256 VanDerWaalsContact CG2-ND2 3.29Å; V8-N256 WeakPolarHBondContact CG2-ND2 3.22Å
9V30.5Very low32.2Very low81 Ų8188.3 Ų88.349%0.49151%0.511SS..Hα-helixtrans-67.5-41.1175.3171.10000110.9L5 S6 G11 I12 S13L5-V9 WeakPolarHBondContact O-CB 3.39Å; L5-V9 WeakPolarHBondContact O-CG2 3.37Å; L5-V9 PolarHBondContact O-N 3.14Å; S6-V9 PolarHBondContact O-N 3.23Å; V9-G11 VanDerWaalsContact C-N 3.32Å; V9-G11 PolarHBondContact O-N 3.22Å; V9-I12 PolarHBondContact O-N 2.71Å; V9-S13 WeakPolarHBondContact O-CB 3.45Å; V9-S13 PolarHBondContact O-N 3.41Å
10D31.2Very low32.2Very low94 Ų9489.9 Ų89.950%0.50351%0.513SS..Hα-helixtrans-66.1-33.9175.6-72.9-26.4000112.2S6 K14S6-D10 WeakPolarHBondContact O-CB 3.3Å; S6-D10 VanDerWaalsContact O-CG 3.29Å; S6-D10 PolarHBondContact O-N 2.91Å; D10-K14 PolarHBondContact O-N 2.86Å
11G31.5Very low32.4Very low36 Ų3689.3 Ų89.337%0.37153%0.528SS..Hα-helixtrans-68-42171.900000113.2E7 V8 V9 K14 I15E7-G11 PolarHBondContact O-N 3.37Å; V8-G11 PolarHBondContact O-N 3.42Å; V9-G11 VanDerWaalsContact C-N 3.32Å; V9-G11 PolarHBondContact O-N 3.22Å; G11-K14 PolarHBondContact O-N 3.3Å; G11-I15 PolarHBondContact O-N 3.17Å
12I28.4Very low32Very low74 Ų7483 Ų8338%0.37950%0.497SS..Hα-helixtrans-71.5-36.5178.7-68.5167.7000111.4V8 V9 K14 I15 G16V8-I12 HydrophobicContact CG1-CD1 3.74Å; V8-I12 HydrophobicContact CG1-CG1 4.47Å; V8-I12 WeakPolarHBondContact O-CB 3.47Å; V8-I12 WeakPolarHBondContact O-CG1 3.48Å; V8-I12 PolarHBondContact O-N 3.41Å; V9-I12 PolarHBondContact O-N 2.71Å; I12-K14 PolarHBondContact O-N 2.95Å; I12-I15 PolarHBondContact O-N 3.4Å; I12-I15 VanDerWaalsContact O-N 3.14Å; I12-G16 PolarHBondContact O-N 3.39Å
13S26.1Very low31.8Very low83 Ų8382.8 Ų82.858%0.5849%0.489SS*.Hα-helixtrans-61.4-30.4174.1-85.70000112.9V9 G16V9-S13 WeakPolarHBondContact O-CB 3.45Å; V9-S13 PolarHBondContact O-N 3.41Å; S13-G16 PolarHBondContact O-N 2.98Å
14K34.5Very low32Very low92 Ų9283.1 Ų83.140%0.449%0.489SS..Hα-helixtrans-79.2-26.7174.4-70.6-178.1-174.8-1740113.9D10 G11 I12 G16 S17D10-K14 PolarHBondContact O-N 2.86Å; G11-K14 PolarHBondContact O-N 3.3Å; I12-K14 PolarHBondContact O-N 2.95Å; K14-G16 VanDerWaalsContact C-N 3.28Å; K14-S17 PolarHBondContact O-OG 3.23Å
15I31.4Very low31.8Very low89 Ų8982 Ų8246%0.45649%0.487SS..Hα-helixtrans-70.6-31.4168.2-62.6169.8000109.6G11 I12 S17 S18 L19G11-I15 PolarHBondContact O-N 3.17Å; I12-I15 PolarHBondContact O-N 3.4Å; I12-I15 VanDerWaalsContact O-N 3.14Å; I15-S17 PolarHBondContact O-N 3.43Å; I15-S18 PolarHBondContact O-N 2.79Å; I15-S18 PolarHBondContact O-OG 2.95Å; I15-L19 HydrophobicContact CG2-CD1 3.76Å; I15-L19 HydrophobicContact CG2-CG 4.37Å; I15-L19 WeakPolarHBondContact O-CD1 3.47Å; I15-L19 VanDerWaalsContact O-CG 3.3Å; I15-L19 WeakPolarHBondContact O-CG 3.35Å; I15-L19 PolarHBondContact O-N 3.45Å
16G26.1Very low32.5Very low33 Ų3382.9 Ų82.934%0.3448%0.482SS..Hα-helixtrans-58.8-37.1178.400000115.4I12 S13 K14 S18 L19I12-G16 PolarHBondContact O-N 3.39Å; S13-G16 PolarHBondContact O-N 2.98Å; K14-G16 VanDerWaalsContact C-N 3.28Å; G16-S18 PolarHBondContact O-N 2.9Å; G16-L19 PolarHBondContact O-N 3.41Å
17S30.8Very low33.4Very low63 Ų6381.6 Ų81.644%0.44147%0.472SS..THydrogen-bonded Turntrans-76.5-20.4-178.758.20000114K14 I15 L19K14-S17 PolarHBondContact O-OG 3.23Å; I15-S17 PolarHBondContact O-N 3.43Å; S17-L19 VanDerWaalsContact C-N 3.3Å
18S33.5Very low34.2Very low96 Ų9675 Ų7567%0.67144%0.441SS*.THydrogen-bonded Turntrans-86.5-4.5170.819.40000112.8I15 G16I15-S18 PolarHBondContact O-N 2.79Å; I15-S18 PolarHBondContact O-OG 2.95Å; G16-S18 PolarHBondContact O-N 2.9Å
19L28.9Very low34.7Very low67 Ų6778.5 Ų78.535%0.35147%0.467SS..  trans-103.5-0.5178.4-67.9169.3000113.3I15 G16 S17 G21 I22I15-L19 HydrophobicContact CG2-CD1 3.76Å; I15-L19 HydrophobicContact CG2-CG 4.37Å; I15-L19 WeakPolarHBondContact O-CD1 3.47Å; I15-L19 VanDerWaalsContact O-CG 3.3Å; I15-L19 WeakPolarHBondContact O-CG 3.35Å; I15-L19 PolarHBondContact O-N 3.45Å; G16-L19 PolarHBondContact O-N 3.41Å; S17-L19 VanDerWaalsContact C-N 3.3Å; L19-G21 PolarHBondContact O-N 2.97Å; L19-I22 HydrophobicContact CD2-CB 4.43Å; L19-I22 HydrophobicContact CD2-CD1 3.52Å; L19-I22 HydrophobicContact CD2-CG1 4.11Å; L19-I22 PolarHBondContact O-N 3.08Å
20E31.7Very low35.5Very low119 Ų11975.6 Ų75.656%0.55645%0.449SS*.THydrogen-bonded Turntrans-61.3-4.6-178.3-98.7-179.7168.800115.1
21G35.5Very low36.3Very low79 Ų7971.7 Ų71.781%0.81443%0.429SS*.THydrogen-bonded Turntrans-109.1-2.3169.700000115.4L19L19-G21 PolarHBondContact O-N 2.97Å
22I31.7Very low36.7Very low68 Ų6879.4 Ų79.435%0.34945%0.452SS..  trans-95.5111177.6-54.1-163.9000107.5L19 I24L19-I22 HydrophobicContact CD2-CB 4.43Å; L19-I22 HydrophobicContact CD2-CD1 3.52Å; L19-I22 HydrophobicContact CD2-CG1 4.11Å; L19-I22 PolarHBondContact O-N 3.08Å; I22-I24 VanDerWaalsContact C-N 3.29Å; I22-I24 PolarHBondContact O-N 3.44Å
23D35.6Very low37.5Very low81 Ų8176.6 Ų76.643%0.43344%0.442SS..  trans-6298.5161.2-175.1-7.9000107.4T25 R26D23-T25 VanDerWaalsContact CG-OG1 3.27Å; D23-T25 PolarHBondContact O-N 3.37Å; D23-T25 VanDerWaalsContact O-N 3.09Å; D23-T25 WeakPolarHBondContact OD1-CB 3.47Å; D23-T25 PolarHBondContact OD1-N 2.92Å; D23-T25 PolarHBondContact OD1-OG1 2.84Å; D23-T25 PolarHBondContact OD2-OG1 3.31Å; D23-R26 HydrophobicContact CB-CB 4.32Å; D23-R26 CarbonylContact O-C 3.34Å; D23-R26 WeakPolarHBondContact O-CA 3.35Å; D23-R26 PolarHBondContact O-N 3.48Å; D23-R26 VanDerWaalsContact O-O 3.11Å
24I39.3Very low38.2Very low128 Ų12878.4 Ų78.466%0.65645%0.449SS*.THydrogen-bonded Turntrans-61.7-17.5179.759169.5000112.1I22 R26 F87I22-I24 VanDerWaalsContact C-N 3.29Å; I22-I24 PolarHBondContact O-N 3.44Å; I24-R26 VanDerWaalsContact C-N 3.32Å; I24-F87 VanDerWaalsContact O-CE1 3.31Å; I24-F87 WeakPolarHBondContact O-CE1 3.22Å
25T37.4Very low38.7Very low88 Ų8875.6 Ų75.654%0.5444%0.439SS..THydrogen-bonded Turntrans-80.8-16.7174.475.80000112.4D23 F87D23-T25 VanDerWaalsContact CG-OG1 3.27Å; D23-T25 PolarHBondContact O-N 3.37Å; D23-T25 VanDerWaalsContact O-N 3.09Å; D23-T25 WeakPolarHBondContact OD1-CB 3.47Å; D23-T25 PolarHBondContact OD1-N 2.92Å; D23-T25 PolarHBondContact OD1-OG1 2.84Å; D23-T25 PolarHBondContact OD2-OG1 3.31Å; T25-F87 WeakPolarHBondContact O-CZ 3.07Å
26R44.7Very low39.1Very low134 Ų13473.4 Ų73.451%0.50644%0.437SS..  trans-141.270.4179.4-69.9-179.6154.1172.4-6.2109.9D23 I24 F28D23-R26 HydrophobicContact CB-CB 4.32Å; D23-R26 CarbonylContact O-C 3.34Å; D23-R26 WeakPolarHBondContact O-CA 3.35Å; D23-R26 PolarHBondContact O-N 3.48Å; D23-R26 VanDerWaalsContact O-O 3.11Å; I24-R26 VanDerWaalsContact C-N 3.32Å; R26-F28 PolarHBondContact O-N 2.93Å
27P45Very low39.7Very low38 Ų3878 Ų7825%0.24746%0.459CS..SBendtrans-62.8-15.8-173.526.4-35000113.2F87P27-F87 HydrophobicContact CG-CD1 3.9Å; P27-F87 HydrophobicContact CG-CE1 4.29Å
28F51.7Low40.3Very low5 Ų577.8 Ų77.82%0.02245%0.452CS..SBendtrans-115.8111.3177.4-57.1-52.1000110R26 A86 I89 L92 Q152R26-F28 PolarHBondContact O-N 2.93Å; F28-A86 HydrophobicContact CD2-CB 4.47Å; F28-A86 WeakPolarHBondContact CD2-O 3.27Å; F28-A86 WeakPolarHBondContact CE2-O 3.48Å; F28-I89 HydrophobicContact CE1-CG1 4.2Å; F28-I89 HydrophobicContact CZ-CG1 3.72Å; F28-L92 HydrophobicContact CB-CD1 4.08Å; F28-L92 HydrophobicContact CD1-CD1 4.42Å; F28-L92 HydrophobicContact CD1-CD2 3.83Å; F28-L92 HydrophobicContact CD2-CB 4.45Å; F28-L92 HydrophobicContact CD2-CD1 3.92Å; F28-L92 HydrophobicContact CD2-CD2 4.35Å; F28-L92 HydrophobicContact CD2-CG 4.46Å; F28-L92 HydrophobicContact CE1-CD2 3.81Å; F28-L92 HydrophobicContact CE2-CB 4.29Å; F28-L92 HydrophobicContact CE2-CD2 4.35Å; F28-L92 HydrophobicContact CG-CD1 3.88Å; F28-L92 HydrophobicContact CG-CD2 4.12Å; F28-L92 HydrophobicContact CZ-CD2 4.1Å; F28-Q152 HydrophobicContact CD1-CB 4.09Å; F28-Q152 HydrophobicContact CD1-CG 4.07Å; F28-Q152 HydrophobicContact CE1-CB 4.44Å
29S43Very low40.4Very low101 Ų10176.9 Ų76.971%0.70646%0.458SS*.  trans-80118.8169.471.40000109.7Q152S29-Q152 PolarHBondContact O-NE2 3.03Å
30V47.4Very low40.7Very low19 Ų1975.6 Ų75.612%0.11546%0.461CS..  trans-84145.8-176.9177.70000112.9K32 K80 M83 D84V30-K32 PolarHBondContact O-N 2.78Å; V30-K80 HydrophobicContact CG1-CG 3.93Å; V30-M83 HydrophobicContact CB-CE 4.26Å; V30-M83 HydrophobicContact CG1-CE 3.43Å; V30-M83 VanDerWaalsContact CG1-CE 3.43Å; V30-M83 HydrophobicContact CG2-CB 4.23Å; V30-M83 HydrophobicContact CG2-CE 3.87Å; V30-M83 HydrophobicContact CG2-CG 4.17Å; V30-D84 WeakPolarHBondContact CB-OD1 3.26Å; V30-D84 HydrophobicContact CG2-CB 4.14Å; V30-D84 VanDerWaalsContact CG2-CG 3.43Å; V30-D84 WeakPolarHBondContact CG2-OD1 3.36Å
31V47.2Very low41.1Very low13 Ų1371.2 Ų71.28%0.07944%0.441CS..  trans-31.1116.7167.51750000113.2G33 K80 E144V31-G33 PolarHBondContact O-N 2.91Å; V31-K80 WeakPolarHBondContact O-CE 3.36Å; V31-K80 PolarHBondContact O-NZ 3.43Å; V31-E144 HydrophobicContact CG1-CB 3.64Å; V31-E144 WeakPolarHBondContact CG1-OE2 3.26Å; V31-E144 HydrophobicContact CG2-CB 4.3Å; V31-E144 VanDerWaalsContact CG2-O 3.29Å; V31-E144 WeakPolarHBondContact CG2-O 3.48Å
32K41.5Very low41.1Very low197 Ų19770.1 Ų70.186%0.85743%0.43SS*.  trans-67.6-8.5176.6-72.5-176.5-179.8176.40114V30 T34V30-K32 PolarHBondContact O-N 2.78Å; K32-T34 PolarHBondContact O-N 3.27Å
33G44.5Very low41.4Very low15 Ų1576.5 Ų76.516%0.15546%0.455CS..  trans-54.895.3175.200000110.9V31 I35V31-G33 PolarHBondContact O-N 2.91Å; G33-I35 PolarHBondContact O-N 3.48Å
34T39.8Very low41.5Very low121 Ų12178.3 Ų78.374%0.74247%0.469SS*.  trans-70118.5161.4350000106.2K32 G36K32-T34 PolarHBondContact O-N 3.27Å; T34-G36 VanDerWaalsContact C-N 3.25Å; T34-G36 PolarHBondContact O-N 3.33Å
35I46.1Very low41.4Very low34 Ų3480 Ų8017%0.17448%0.479CS..  trans-65.2101.3159.8-58.4178.6000104.4G33 V37 Y76 L103G33-I35 PolarHBondContact O-N 3.48Å; I35-V37 PolarHBondContact O-N 3.09Å; I35-V37 VanDerWaalsContact O-N 3.16Å; I35-Y76 HydrophobicContact CD1-CD1 3.28Å; I35-Y76 HydrophobicContact CD1-CD2 3.97Å; I35-Y76 HydrophobicContact CD1-CE1 3.27Å; I35-Y76 HydrophobicContact CD1-CE2 3.95Å; I35-Y76 HydrophobicContact CD1-CG 3.64Å; I35-Y76 HydrophobicContact CG1-CD1 4.12Å; I35-Y76 HydrophobicContact CG1-CE1 3.71Å; I35-L103 HydrophobicContact CD1-CD2 3.45Å; I35-L103 VanDerWaalsContact CD1-CD2 3.45Å; I35-L103 HydrophobicContact CG1-CD2 4.38Å
36G39.6Very low41.4Very low42 Ų4278.2 Ų78.243%0.43348%0.477SS..  trans-50.4126.317800000109.4T34 I38T34-G36 VanDerWaalsContact C-N 3.25Å; T34-G36 PolarHBondContact O-N 3.33Å; G36-I38 PolarHBondContact O-N 2.98Å
37V39.9Very low40.9Very low129 Ų12975.3 Ų75.378%0.78249%0.489SS*.  trans-6491.8163-179.50000105.6I35 G39I35-V37 PolarHBondContact O-N 3.09Å; I35-V37 VanDerWaalsContact O-N 3.16Å; V37-G39 VanDerWaalsContact C-N 3.34Å; V37-G39 PolarHBondContact O-N 2.95Å
38I42.6Very low40.7Very low59 Ų5976.4 Ų76.430%0.30349%0.492SS..  trans-68.8103.2167.5-56.5179.5000105.6G36 G40 E130 Q134G36-I38 PolarHBondContact O-N 2.98Å; I38-G40 PolarHBondContact O-N 3.26Å; I38-E130 HydrophobicContact CG2-CG 4.28Å; I38-E130 WeakPolarHBondContact CG2-OE1 3.33Å; I38-Q134 HydrophobicContact CD1-CB 4.25Å
39G34.6Very low40.2Very low77 Ų7786.3 Ų86.379%0.79454%0.536SS*.THydrogen-bonded Turntrans-67.829.8-179.900000114.9V37V37-G39 VanDerWaalsContact C-N 3.34Å; V37-G39 PolarHBondContact O-N 2.95Å
40G37Very low40.6Very low40 Ų4085.1 Ų85.141%0.41254%0.54SS..THydrogen-bonded Turntrans-118.4-17.4-173.400000115.3I38 G42I38-G40 PolarHBondContact O-N 3.26Å; G40-G42 PolarHBondContact O-N 2.74Å
41I39.6Very low40.9Very low27 Ų2788.6 Ų88.614%0.13855%0.551CS.*SBendtrans-69.9-19.1179.9-47.9-170.3000111.2Q66I41-Q66 HydrophobicContact CG2-CB 3.59Å; I41-Q66 HydrophobicContact CG2-CG 3.27Å
42G35.3Very low42Very low57 Ų5789.3 Ų89.359%0.58856%0.561SS**SBendtrans-88.1112.417700000113.9G40G40-G42 PolarHBondContact O-N 2.74Å
43K36.7Very low44Very low202 Ų20284.9 Ų84.988%0.87855%0.551SS**  trans7079.3150.7-51.3-176.8-172.5-179.10117.5
44T39Very low46Very low118 Ų11889.9 Ų89.972%0.72457%0.568SS**  trans-120.792.1142.139.70000110.5G46T44-G46 PolarHBondContact O-N 3.03Å
45L36.7Very low48.3Very low165 Ų16584.5 Ų84.586%0.86454%0.535SS*.  trans-75.575.9158.3-72.7168.8000107.9G47L45-G47 PolarHBondContact O-N 3.23Å
46G36.7Very low50.3Low49 Ų4988.3 Ų88.351%0.50555%0.55SS.*  trans-69.6119.8164.400000108.8T44 I48T44-G46 PolarHBondContact O-N 3.03Å; G46-I48 WeakPolarHBondContact O-CG1 3.42Å; G46-I48 PolarHBondContact O-N 3.06Å; G46-I48 VanDerWaalsContact O-N 3.13Å
47G34.8Very low52.8Low73 Ų7392.9 Ų92.975%0.75356%0.558SS**  trans-47.2115.6-176.300000113.3L45 F49L45-G47 PolarHBondContact O-N 3.23Å; G47-F49 VanDerWaalsContact C-N 3.34Å; G47-F49 PolarHBondContact O-N 3.34Å; G47-F49 VanDerWaalsContact O-N 3.13Å
48I40.6Very low55.3Low62 Ų6287.4 Ų87.432%0.31852%0.524SS..  trans-89.269-177.6-45.1172.7000110.1G46 W51G46-I48 WeakPolarHBondContact O-CG1 3.42Å; G46-I48 PolarHBondContact O-N 3.06Å; G46-I48 VanDerWaalsContact O-N 3.13Å; I48-W51 HydrophobicContact CB-CD2 4.2Å; I48-W51 HydrophobicContact CB-CE3 3.96Å; I48-W51 HydrophobicContact CB-CZ3 4.16Å; I48-W51 HydrophobicContact CD1-CE3 3.5Å; I48-W51 HydrophobicContact CD1-CH2 4.13Å; I48-W51 HydrophobicContact CD1-CZ3 3.24Å; I48-W51 HydrophobicContact CG1-CD2 4.24Å; I48-W51 HydrophobicContact CG1-CE3 3.6Å; I48-W51 HydrophobicContact CG1-CH2 3.73Å; I48-W51 HydrophobicContact CG1-CZ2 4.39Å; I48-W51 HydrophobicContact CG1-CZ3 3.31Å; I48-W51 HydrophobicContact CG2-CB 3.39Å; I48-W51 HydrophobicContact CG2-CD2 3.12Å; I48-W51 HydrophobicContact CG2-CE3 3.14Å; I48-W51 HydrophobicContact CG2-CG 3.27Å; I48-W51 HydrophobicContact CG2-CH2 4.42Å; I48-W51 HydrophobicContact CG2-CZ2 4.44Å; I48-W51 HydrophobicContact CG2-CZ3 3.84Å
49F42.4Very low57.6Low212 Ų21286 Ų8693%0.9352%0.516SS*.SBendtrans-86.3105.4161.8-78.2-78.8000108G47G47-F49 VanDerWaalsContact C-N 3.34Å; G47-F49 PolarHBondContact O-N 3.34Å; G47-F49 VanDerWaalsContact O-N 3.13Å
50G51Low60.3Low77 Ų7788.6 Ų88.679%0.79451%0.506SS*.SBendtrans116.71.4168.800000118.3
51W53.4Low62.9Low91 Ų9191.4 Ų91.435%0.34551%0.508SS..  trans-79.5137.4173.7-63.4-12.9000112.5I48 D55I48-W51 HydrophobicContact CB-CD2 4.2Å; I48-W51 HydrophobicContact CB-CE3 3.96Å; I48-W51 HydrophobicContact CB-CZ3 4.16Å; I48-W51 HydrophobicContact CD1-CE3 3.5Å; I48-W51 HydrophobicContact CD1-CH2 4.13Å; I48-W51 HydrophobicContact CD1-CZ3 3.24Å; I48-W51 HydrophobicContact CG1-CD2 4.24Å; I48-W51 HydrophobicContact CG1-CE3 3.6Å; I48-W51 HydrophobicContact CG1-CH2 3.73Å; I48-W51 HydrophobicContact CG1-CZ2 4.39Å; I48-W51 HydrophobicContact CG1-CZ3 3.31Å; I48-W51 HydrophobicContact CG2-CB 3.39Å; I48-W51 HydrophobicContact CG2-CD2 3.12Å; I48-W51 HydrophobicContact CG2-CE3 3.14Å; I48-W51 HydrophobicContact CG2-CG 3.27Å; I48-W51 HydrophobicContact CG2-CH2 4.42Å; I48-W51 HydrophobicContact CG2-CZ2 4.44Å; I48-W51 HydrophobicContact CG2-CZ3 3.84Å; W51-D55 HydrophobicContact CB-CB 3.99Å; W51-D55 HydrophobicContact CD2-CB 4.46Å; W51-D55 HydrophobicContact CG-CB 4.24Å
52G70.9Confident65.4Low29 Ų2990.1 Ų90.130%0.29950%0.502SS..  trans-69.1165.8172.800000112.3K54 D55 K56G52-K54 PolarHBondContact O-N 3.28Å; G52-K54 VanDerWaalsContact O-N 3.07Å; G52-D55 PolarHBondContact O-N 3.1Å; G52-K56 PolarHBondContact O-N 3.03Å
53T83.1Confident68.1Low104 Ų10490.8 Ų90.864%0.63849%0.489SS*.Hα-helixtrans-55.1-28.2-179-48.60000113.8K57T53-K57 WeakPolarHBondContact O-CG 3.19Å; T53-K57 PolarHBondContact O-N 2.88Å
54K85.8Confident70.8Confident120 Ų12085.3 Ų85.352%0.52247%0.47SS..Hα-helixtrans-64.4-54.5177-169.3-166.9-177.9-154.20111.9G52 K56 K57 L58 D119G52-K54 PolarHBondContact O-N 3.28Å; G52-K54 VanDerWaalsContact O-N 3.07Å; K54-K56 VanDerWaalsContact C-N 3.29Å; K54-K56 PolarHBondContact O-N 2.98Å; K54-K57 WeakPolarHBondContact O-CB 3.47Å; K54-K57 PolarHBondContact O-N 2.97Å; K54-L58 HydrophobicContact CD-CD1 4.48Å; K54-L58 HydrophobicContact CG-CD1 4.19Å; K54-L58 WeakPolarHBondContact O-CG 3.41Å; K54-L58 PolarHBondContact O-N 3.14Å; K54-D119 PolarHBondContact NZ-O 3.46Å
55D87.7Confident73.3Confident7 Ų781.9 Ų81.94%0.03745%0.446CS..Hα-helixtrans-63.4-36.4-176.8-64.9-15.9000111.4W51 G52 K57 L58 Q59 K121W51-D55 HydrophobicContact CB-CB 3.99Å; W51-D55 HydrophobicContact CD2-CB 4.46Å; W51-D55 HydrophobicContact CG-CB 4.24Å; G52-D55 PolarHBondContact O-N 3.1Å; D55-K57 VanDerWaalsContact C-N 3.33Å; D55-K57 PolarHBondContact O-N 3.04Å; D55-L58 PolarHBondContact O-N 2.95Å; D55-Q59 WeakPolarHBondContact O-CB 3.31Å; D55-Q59 PolarHBondContact O-N 2.96Å; D55-K121 PolarHBondContact OD1-N 3.09Å; D55-K121 VanDerWaalsContact OD1-N 3.09Å
56K88.8Confident75.9Confident115 Ų11575.9 Ų75.950%0.541%0.413SS..Hα-helixtrans-62.2-38.1173.2-69.9-174.3179-177.60112.7G52 K54 K60G52-K56 PolarHBondContact O-N 3.03Å; K54-K56 VanDerWaalsContact C-N 3.29Å; K54-K56 PolarHBondContact O-N 2.98Å; K56-K60 PolarHBondContact O-N 2.75Å; K56-K60 VanDerWaalsContact O-N 3.14Å
57K92.2Very high78.4Confident138 Ų13879.6 Ų79.660%0.642%0.415SS*.Hα-helixtrans-68.8-42.4176.1-74.7179.3178.5-175.30111.6T53 K54 D55 K60 Q61T53-K57 WeakPolarHBondContact O-CG 3.19Å; T53-K57 PolarHBondContact O-N 2.88Å; K54-K57 WeakPolarHBondContact O-CB 3.47Å; K54-K57 PolarHBondContact O-N 2.97Å; D55-K57 VanDerWaalsContact C-N 3.33Å; D55-K57 PolarHBondContact O-N 3.04Å; K57-K60 PolarHBondContact O-N 2.52Å; K57-Q61 WeakPolarHBondContact O-CG 3.41Å; K57-Q61 PolarHBondContact O-N 2.71Å
58L92.4Very high81.2Confident14 Ų1477.7 Ų77.77%0.07339%0.393CS..Hα-helixtrans-63.1-44.6176.4-66.3170.7000111.3K54 D55 K60 Q61 I62 A116 D119 K120K54-L58 HydrophobicContact CD-CD1 4.48Å; K54-L58 HydrophobicContact CG-CD1 4.19Å; K54-L58 WeakPolarHBondContact O-CG 3.41Å; K54-L58 PolarHBondContact O-N 3.14Å; D55-L58 PolarHBondContact O-N 2.95Å; L58-K60 VanDerWaalsContact C-N 3.31Å; L58-K60 PolarHBondContact O-N 3.13Å; L58-Q61 WeakPolarHBondContact O-CB 3.47Å; L58-Q61 PolarHBondContact O-N 3.46Å; L58-I62 WeakPolarHBondContact O-CG1 3.49Å; L58-I62 PolarHBondContact O-N 3.09Å; L58-A116 HydrophobicContact CD2-CB 4.25Å; L58-D119 VanDerWaalsContact CD1-C 3.5Å; L58-D119 HydrophobicContact CD1-CB 3.77Å; L58-D119 WeakPolarHBondContact CD1-O 3.49Å; L58-D119 HydrophobicContact CD2-CB 4.08Å; L58-K120 HydrophobicContact CB-CG 4.06Å; L58-K120 HydrophobicContact CD1-CB 4.47Å; L58-K120 HydrophobicContact CD1-CG 3.81Å
59Q90.9Very high83.5Confident28 Ų2874.8 Ų74.813%0.13138%0.378CS..Hα-helixtrans-59-42.3175.8-173.659.642.400111.9D55 Q61 I62 E63D55-Q59 WeakPolarHBondContact O-CB 3.31Å; D55-Q59 PolarHBondContact O-N 2.96Å; Q59-Q61 VanDerWaalsContact C-N 3.33Å; Q59-Q61 PolarHBondContact O-N 3.08Å; Q59-I62 PolarHBondContact O-N 3.38Å; Q59-E63 WeakPolarHBondContact O-CG 3.38Å; Q59-E63 PolarHBondContact O-N 2.9Å
60K91.3Very high85.8Confident133 Ų13371 Ų7158%0.57836%0.363SS*.Hα-helixtrans-64.2-35.3174.9-172.7175.8-178178.20112.8K56 K57 L58 N64K56-K60 PolarHBondContact O-N 2.75Å; K56-K60 VanDerWaalsContact O-N 3.14Å; K57-K60 PolarHBondContact O-N 2.52Å; L58-K60 VanDerWaalsContact C-N 3.31Å; L58-K60 PolarHBondContact O-N 3.13Å; K60-N64 PolarHBondContact O-N 3.41Å; K60-N64 VanDerWaalsContact O-N 3.07Å; K60-N64 PolarHBondContact O-ND2 3.47Å
61Q92.1Very high87.7Confident98 Ų9874.6 Ų74.646%0.45836%0.357SS..Hα-helixtrans-65.1-45.5173.9-73.1175.8-7.400111K57 L58 Q59 E63 N64 H65K57-Q61 WeakPolarHBondContact O-CG 3.41Å; K57-Q61 PolarHBondContact O-N 2.71Å; L58-Q61 WeakPolarHBondContact O-CB 3.47Å; L58-Q61 PolarHBondContact O-N 3.46Å; Q59-Q61 VanDerWaalsContact C-N 3.33Å; Q59-Q61 PolarHBondContact O-N 3.08Å; Q61-E63 PolarHBondContact O-N 3.46Å; Q61-N64 PolarHBondContact O-N 2.55Å; Q61-H65 PolarHBondContact O-CD2 3.16Å; Q61-H65 PolarHBondContact O-N 2.74Å
62I92Very high89.5Confident1 Ų171.6 Ų71.61%0.00535%0.347CS..Hα-helixtrans-56.4-50.2175-66.5168.8000110L58 Q59 N64 H65 Q66 M113 A116 E117 K120L58-I62 WeakPolarHBondContact O-CG1 3.49Å; L58-I62 PolarHBondContact O-N 3.09Å; Q59-I62 PolarHBondContact O-N 3.38Å; I62-N64 VanDerWaalsContact C-N 3.3Å; I62-N64 PolarHBondContact O-N 2.8Å; I62-H65 PolarHBondContact O-N 2.73Å; I62-H65 VanDerWaalsContact O-N 3.14Å; I62-Q66 HydrophobicContact CG2-CG 4.3Å; I62-Q66 VanDerWaalsContact O-CG 3.27Å; I62-Q66 WeakPolarHBondContact O-CG 3.32Å; I62-Q66 PolarHBondContact O-N 3.46Å; I62-M113 HydrophobicContact CG2-CE 4.14Å; I62-M113 HydrophobicContact CG2-CG 4.32Å; I62-A116 HydrophobicContact CD1-CB 4.12Å; I62-A116 HydrophobicContact CG1-CB 3.73Å; I62-E117 HydrophobicContact CD1-CB 4.21Å; I62-E117 WeakPolarHBondContact CD1-OE2 3.29Å; I62-K120 HydrophobicContact CD1-CD 4.41Å
63E90.9Very high90.3Very high70 Ų7072.6 Ų72.633%0.32734%0.342SS..Hα-helixtrans-58.6-37.3178.1-73.2170-16400113.5Q59 Q61 Q66 K67Q59-E63 WeakPolarHBondContact O-CG 3.38Å; Q59-E63 PolarHBondContact O-N 2.9Å; Q61-E63 PolarHBondContact O-N 3.46Å; E63-Q66 PolarHBondContact O-N 2.69Å; E63-K67 WeakPolarHBondContact O-CG 3.36Å; E63-K67 PolarHBondContact O-N 2.98Å; E63-K67 VanDerWaalsContact O-N 3.09Å
64N93.1Very high90.6Very high87 Ų8773.6 Ų73.647%0.46534%0.34SS..Hα-helixtrans-67.5-42.1176.6-72.1-21.2000111.7K60 Q61 I62 Q66 K67 A68K60-N64 PolarHBondContact O-N 3.41Å; K60-N64 VanDerWaalsContact O-N 3.07Å; K60-N64 PolarHBondContact O-ND2 3.47Å; Q61-N64 PolarHBondContact O-N 2.55Å; I62-N64 VanDerWaalsContact C-N 3.3Å; I62-N64 PolarHBondContact O-N 2.8Å; N64-Q66 VanDerWaalsContact C-N 3.35Å; N64-K67 PolarHBondContact O-N 2.98Å; N64-A68 PolarHBondContact O-N 3.22Å
65H92.6Very high90.7Very high47 Ų4773.8 Ų73.822%0.21834%0.337CS..Hα-helixtrans-65-38.6175-72.6-58.9000111.8Q61 I62 K67 A68 I69 N109 S112 M113Q61-H65 PolarHBondContact O-CD2 3.16Å; Q61-H65 PolarHBondContact O-N 2.74Å; I62-H65 PolarHBondContact O-N 2.73Å; I62-H65 VanDerWaalsContact O-N 3.14Å; H65-K67 PolarHBondContact O-N 2.87Å; H65-A68 WeakPolarHBondContact O-CB 3.48Å; H65-A68 PolarHBondContact O-N 2.84Å; H65-I69 WeakPolarHBondContact O-CG1 3.42Å; H65-I69 PolarHBondContact O-N 2.75Å; H65-N109 HydrophobicContact CB-CB 4.23Å; H65-N109 PolarHBondContact ND1-OD1 2.89Å; H65-S112 WeakPolarHBondContact NE2-CB 3.18Å; H65-M113 HydrophobicContact CB-CG 3.41Å; H65-M113 VanDerWaalsContact CB-CG 3.41Å; H65-M113 HydrophobicContact CB-SD 3.55Å; H65-M113 VanDerWaalsContact CB-SD 3.55Å
66Q90.8Very high90.7Very high38 Ų3874 Ų7418%0.17834%0.337CS..Hα-helixtrans-59.5-46.7174.4-70179.3-26.300112.1I41 I62 E63 N64 A68 I69 E70 M113I41-Q66 HydrophobicContact CG2-CB 3.59Å; I41-Q66 HydrophobicContact CG2-CG 3.27Å; I62-Q66 HydrophobicContact CG2-CG 4.3Å; I62-Q66 VanDerWaalsContact O-CG 3.27Å; I62-Q66 WeakPolarHBondContact O-CG 3.32Å; I62-Q66 PolarHBondContact O-N 3.46Å; E63-Q66 PolarHBondContact O-N 2.69Å; N64-Q66 VanDerWaalsContact C-N 3.35Å; Q66-A68 VanDerWaalsContact C-N 3.31Å; Q66-A68 PolarHBondContact O-N 3.33Å; Q66-I69 PolarHBondContact O-N 2.83Å; Q66-E70 PolarHBondContact O-N 3.33Å; Q66-M113 HydrophobicContact CG-CE 3.52Å; Q66-M113 HydrophobicContact CG-SD 4.02Å
67K90.6Very high90.6Very high127 Ų12771.4 Ų71.455%0.55233%0.334SS*.Hα-helixtrans-64-35.2175.4-71.2175.6-176.9176.60112.9E63 N64 H65 K71E63-K67 WeakPolarHBondContact O-CG 3.36Å; E63-K67 PolarHBondContact O-N 2.98Å; E63-K67 VanDerWaalsContact O-N 3.09Å; N64-K67 PolarHBondContact O-N 2.98Å; H65-K67 PolarHBondContact O-N 2.87Å; K67-K71 PolarHBondContact O-N 3.47Å
68A91.7Very high90.3Very high34 Ų3470.5 Ų70.528%0.28133%0.332SS..Hα-helixtrans-66.3-43.2175.200000111.2N64 H65 Q66 E70 K71 L72N64-A68 PolarHBondContact O-N 3.22Å; H65-A68 WeakPolarHBondContact O-CB 3.48Å; H65-A68 PolarHBondContact O-N 2.84Å; Q66-A68 VanDerWaalsContact C-N 3.31Å; Q66-A68 PolarHBondContact O-N 3.33Å; A68-E70 VanDerWaalsContact C-N 3.35Å; A68-E70 PolarHBondContact O-N 3.32Å; A68-K71 PolarHBondContact O-N 3.49Å; A68-L72 VanDerWaalsContact O-CG 3.28Å; A68-L72 WeakPolarHBondContact O-CG 3.17Å; A68-L72 PolarHBondContact O-N 2.89Å
69I90.7Very high90.1Very high1 Ų170.4 Ų70.41%0.00533%0.331CS..Hα-helixtrans-62.3-40.9175.7-69.2164.6000111.3H65 Q66 K71 L72 R73 Q106 N109 L110 M113H65-I69 WeakPolarHBondContact O-CG1 3.42Å; H65-I69 PolarHBondContact O-N 2.75Å; Q66-I69 PolarHBondContact O-N 2.83Å; I69-K71 PolarHBondContact O-N 2.76Å; I69-L72 WeakPolarHBondContact O-CB 3.14Å; I69-L72 PolarHBondContact O-N 3.45Å; I69-L72 VanDerWaalsContact O-N 3.16Å; I69-R73 HydrophobicContact CG2-CG 4.36Å; I69-R73 WeakPolarHBondContact O-CG 3.02Å; I69-R73 PolarHBondContact O-N 3.36Å; I69-Q106 HydrophobicContact CG2-CG 4.47Å; I69-N109 HydrophobicContact CD1-CB 3.75Å; I69-N109 HydrophobicContact CG1-CB 3.66Å; I69-L110 HydrophobicContact CD1-CD2 3.82Å; I69-L110 HydrophobicContact CD1-CG 3.8Å; I69-M113 HydrophobicContact CD1-SD 3.66Å
70E89Confident89.6Confident133 Ų13370.9 Ų70.962%0.62133%0.333SS*.Hα-helixtrans-57.7-47.7177.9-172.3172.5-162.600112Q66 A68 L72 R73 E74Q66-E70 PolarHBondContact O-N 3.33Å; A68-E70 VanDerWaalsContact C-N 3.35Å; A68-E70 PolarHBondContact O-N 3.32Å; E70-L72 VanDerWaalsContact C-N 3.34Å; E70-L72 PolarHBondContact O-N 3.24Å; E70-R73 PolarHBondContact O-N 2.86Å; E70-E74 PolarHBondContact O-N 3.21Å; E70-E74 VanDerWaalsContact O-N 3.12Å
71K90.8Very high89.1Confident152 Ų15268.7 Ų68.766%0.66133%0.327SS*.Hα-helixtrans-64.2-37.2174.7-66.4-177.7178.8-170.90113K67 A68 I69 R73 E74 R75K67-K71 PolarHBondContact O-N 3.47Å; A68-K71 PolarHBondContact O-N 3.49Å; I69-K71 PolarHBondContact O-N 2.76Å; K71-R73 VanDerWaalsContact C-N 3.32Å; K71-E74 PolarHBondContact O-N 3.49Å; K71-R75 PolarHBondContact O-N 3.36Å; K71-R75 VanDerWaalsContact O-N 3.08Å
72L92.4Very high88.5Confident27 Ų2765.4 Ų65.414%0.14132%0.317CS..Hα-helixtrans-65-38176.2-73.4166.3000111A68 I69 E70 R75 Y76 N102 T105 Q106A68-L72 VanDerWaalsContact O-CG 3.28Å; A68-L72 WeakPolarHBondContact O-CG 3.17Å; A68-L72 PolarHBondContact O-N 2.89Å; I69-L72 WeakPolarHBondContact O-CB 3.14Å; I69-L72 PolarHBondContact O-N 3.45Å; I69-L72 VanDerWaalsContact O-N 3.16Å; E70-L72 VanDerWaalsContact C-N 3.34Å; E70-L72 PolarHBondContact O-N 3.24Å; L72-R75 PolarHBondContact O-N 2.94Å; L72-Y76 WeakPolarHBondContact O-CB 3.41Å; L72-Y76 PolarHBondContact O-N 3.18Å; L72-N102 PolarHBondContact O-ND2 2.9Å; L72-N102 PolarHBondContact O-OD1 2.9Å; L72-N102 VanDerWaalsContact O-OD1 3.13Å; L72-T105 HydrophobicContact CD1-CG2 3.74Å; L72-T105 HydrophobicContact CD2-CG2 4.21Å; L72-Q106 HydrophobicContact CB-CG 3.63Å; L72-Q106 HydrophobicContact CD1-CG 3.83Å; L72-Q106 HydrophobicContact CG-CG 4.34Å
73R87Confident87.8Confident51 Ų5165.5 Ų65.519%0.19232%0.318CS..Hα-helixtrans-66.5-42175.9-72.5178.4-177165.74.5112.9I69 E70 K71 Y76 S77I69-R73 HydrophobicContact CG2-CG 4.36Å; I69-R73 WeakPolarHBondContact O-CG 3.02Å; I69-R73 PolarHBondContact O-N 3.36Å; E70-R73 PolarHBondContact O-N 2.86Å; K71-R73 VanDerWaalsContact C-N 3.32Å; R73-Y76 WeakPolarHBondContact O-CB 3.34Å; R73-Y76 PolarHBondContact O-N 3.49Å; R73-S77 PolarHBondContact O-N 3.26Å
74E89.1Confident86.8Confident125 Ų12563.8 Ų63.858%0.58431%0.311SS*.Hα-helixtrans-57.2-51.7173.9-175.1174.9-159.400110.2E70 K71 Y76 S77 E78E70-E74 PolarHBondContact O-N 3.21Å; E70-E74 VanDerWaalsContact O-N 3.12Å; K71-E74 PolarHBondContact O-N 3.49Å; E74-Y76 VanDerWaalsContact C-N 3.29Å; E74-Y76 PolarHBondContact O-N 2.96Å; E74-S77 WeakPolarHBondContact O-CB 3.34Å; E74-S77 PolarHBondContact O-N 3.42Å; E74-E78 PolarHBondContact O-N 2.88Å
75R89.2Confident85.7Confident124 Ų12464.5 Ų64.547%0.46832%0.315SS..Hα-helixtrans-59.4-37.5174.8-175.6-179.8178.3179.42.2113K71 L72 S77 E78 L79 E98K71-R75 PolarHBondContact O-N 3.36Å; K71-R75 VanDerWaalsContact O-N 3.08Å; L72-R75 PolarHBondContact O-N 2.94Å; R75-S77 VanDerWaalsContact C-N 3.32Å; R75-E78 PolarHBondContact O-N 2.77Å; R75-L79 HydrophobicContact CG-CD1 4.09Å; R75-L79 HydrophobicContact CG-CG 4.38Å; R75-L79 WeakPolarHBondContact O-CB 3.24Å; R75-L79 WeakPolarHBondContact O-CG 3.31Å; R75-L79 PolarHBondContact O-N 3.03Å; R75-E98 IonicContact CZ-OE2 2.76Å; R75-E98 IonicContact NE-OE2 3.72Å; R75-E98 IonicContact NH2-OE2 3.69Å; R75-E98 PolarHBondContact NH2-OE2 3.36Å
76Y87.6Confident84.7Confident10 Ų1062.6 Ų62.64%0.03931%0.307CS..Hα-helixtrans-64.2-38.8176.5-179.2-86.1000111.5I35 L72 R73 E74 L79 K80 M99 N102 L103I35-Y76 HydrophobicContact CD1-CD1 3.28Å; I35-Y76 HydrophobicContact CD1-CD2 3.97Å; I35-Y76 HydrophobicContact CD1-CE1 3.27Å; I35-Y76 HydrophobicContact CD1-CE2 3.95Å; I35-Y76 HydrophobicContact CD1-CG 3.64Å; I35-Y76 HydrophobicContact CG1-CD1 4.12Å; I35-Y76 HydrophobicContact CG1-CE1 3.71Å; L72-Y76 WeakPolarHBondContact O-CB 3.41Å; L72-Y76 PolarHBondContact O-N 3.18Å; R73-Y76 WeakPolarHBondContact O-CB 3.34Å; R73-Y76 PolarHBondContact O-N 3.49Å; E74-Y76 VanDerWaalsContact C-N 3.29Å; E74-Y76 PolarHBondContact O-N 2.96Å; Y76-L79 PolarHBondContact O-N 3.21Å; Y76-K80 WeakPolarHBondContact O-CB 3.41Å; Y76-K80 PolarHBondContact O-N 2.76Å; Y76-M99 HydrophobicContact CD2-CB 4.16Å; Y76-M99 HydrophobicContact CD2-CE 4.34Å; Y76-M99 HydrophobicContact CD2-CG 4.22Å; Y76-M99 HydrophobicContact CE1-CE 3.97Å; Y76-M99 HydrophobicContact CE2-CB 3.84Å; Y76-M99 HydrophobicContact CE2-CE 3.51Å; Y76-M99 HydrophobicContact CE2-CG 4.07Å; Y76-M99 VanDerWaalsContact OH-CE 3.25Å; Y76-M99 WeakPolarHBondContact OH-CE 3.35Å; Y76-N102 PolarHBondContact N-ND2 3.08Å; Y76-L103 HydrophobicContact CD2-CD1 4.35Å; Y76-L103 HydrophobicContact CD2-CD2 4.19Å; Y76-L103 HydrophobicContact CD2-CG 3.91Å; Y76-L103 HydrophobicContact CE2-CD1 3.54Å; Y76-L103 HydrophobicContact CE2-CD2 4.03Å; Y76-L103 HydrophobicContact CE2-CG 3.61Å
77S85.9Confident83.5Confident62 Ų6264 Ų6443%0.43431%0.312SS..Hα-helixtrans-63.2-46.5174.8-162.80000111.3R73 E74 R75 L79 K80 D81R73-S77 PolarHBondContact O-N 3.26Å; E74-S77 WeakPolarHBondContact O-CB 3.34Å; E74-S77 PolarHBondContact O-N 3.42Å; R75-S77 VanDerWaalsContact C-N 3.32Å; S77-L79 VanDerWaalsContact C-N 3.32Å; S77-L79 PolarHBondContact O-N 3.26Å; S77-K80 WeakPolarHBondContact O-CB 3.38Å; S77-K80 PolarHBondContact O-N 2.9Å; S77-D81 PolarHBondContact O-N 3.49Å
78E87.1Confident82.7Confident118 Ų11859.9 Ų59.955%0.55130%0.297SS*.Hα-helixtrans-60-41.8176.3-66.4173.717100112.1E74 R75 K80 D81 A82E74-E78 PolarHBondContact O-N 2.88Å; R75-E78 PolarHBondContact O-N 2.77Å; E78-K80 VanDerWaalsContact C-N 3.35Å; E78-D81 PolarHBondContact O-N 2.85Å; E78-A82 WeakPolarHBondContact O-CB 3.37Å; E78-A82 PolarHBondContact O-N 3.33Å
79L86.9Confident81.8Confident12 Ų1258.5 Ų58.56%0.06329%0.285CS..Hα-helixtrans-64.9-39.6176.5-73.1167.5000112R75 Y76 S77 A82 M83 Y95 E98 M99R75-L79 HydrophobicContact CG-CD1 4.09Å; R75-L79 HydrophobicContact CG-CG 4.38Å; R75-L79 WeakPolarHBondContact O-CB 3.24Å; R75-L79 WeakPolarHBondContact O-CG 3.31Å; R75-L79 PolarHBondContact O-N 3.03Å; Y76-L79 PolarHBondContact O-N 3.21Å; S77-L79 VanDerWaalsContact C-N 3.32Å; S77-L79 PolarHBondContact O-N 3.26Å; L79-A82 PolarHBondContact O-N 3.45Å; L79-M83 WeakPolarHBondContact O-CB 3.28Å; L79-M83 PolarHBondContact O-N 3.2Å; L79-Y95 HydrophobicContact CD2-CD1 4.06Å; L79-E98 HydrophobicContact CD1-CB 3.77Å; L79-E98 HydrophobicContact CD2-CB 3.73Å; L79-E98 HydrophobicContact CD2-CG 4.46Å; L79-E98 WeakPolarHBondContact CD2-OE2 3.5Å; L79-E98 HydrophobicContact CG-CB 4.41Å; L79-M99 HydrophobicContact CB-CG 3.61Å; L79-M99 HydrophobicContact CB-SD 4.43Å; L79-M99 HydrophobicContact CD1-CG 4.2Å
80K80.4Confident81.1Confident39 Ų3965 Ų6517%0.1732%0.315CS..Hα-helixtrans-61.7-48.2175.4-172.3-180-179.7168.40110.7V30 V31 Y76 S77 E78 A82 M83 D84 M99V30-K80 HydrophobicContact CG1-CG 3.93Å; V31-K80 WeakPolarHBondContact O-CE 3.36Å; V31-K80 PolarHBondContact O-NZ 3.43Å; Y76-K80 WeakPolarHBondContact O-CB 3.41Å; Y76-K80 PolarHBondContact O-N 2.76Å; S77-K80 WeakPolarHBondContact O-CB 3.38Å; S77-K80 PolarHBondContact O-N 2.9Å; E78-K80 VanDerWaalsContact C-N 3.35Å; K80-A82 VanDerWaalsContact C-N 3.34Å; K80-A82 PolarHBondContact O-N 3.35Å; K80-M83 WeakPolarHBondContact O-CB 3.16Å; K80-M83 PolarHBondContact O-N 3.05Å; K80-M83 VanDerWaalsContact O-N 3.16Å; K80-D84 PolarHBondContact O-N 2.88Å; K80-M99 HydrophobicContact CB-CE 4.22Å; K80-M99 HydrophobicContact CG-CE 4.45Å
81D80.6Confident80.7Confident86 Ų8664.6 Ų64.646%0.4631%0.308SS..Hα-helixtrans-63.4-40.8177.9-66.7-22.9000111.3S77 E78 M83 D84 N85S77-D81 PolarHBondContact O-N 3.49Å; E78-D81 PolarHBondContact O-N 2.85Å; D81-M83 VanDerWaalsContact C-N 3.28Å; D81-M83 PolarHBondContact O-N 2.9Å; D81-D84 PolarHBondContact O-N 2.81Å; D81-N85 PolarHBondContact O-N 3.13Å; D81-N85 PolarHBondContact O-ND2 3.23Å
82A80.5Confident80.2Confident30 Ų3057.4 Ų57.425%0.24828%0.276CS..Hα-helixtrans-63.1-36.2175.400000112.2E78 L79 K80 N85 A86 Y95E78-A82 WeakPolarHBondContact O-CB 3.37Å; E78-A82 PolarHBondContact O-N 3.33Å; L79-A82 PolarHBondContact O-N 3.45Å; K80-A82 VanDerWaalsContact C-N 3.34Å; K80-A82 PolarHBondContact O-N 3.35Å; A82-N85 PolarHBondContact O-N 2.84Å; A82-A86 PolarHBondContact O-N 3.45Å; A82-A86 VanDerWaalsContact O-N 3.14Å; A82-Y95 HydrophobicContact CB-CD1 4.3Å; A82-Y95 HydrophobicContact CB-CD2 4.3Å; A82-Y95 HydrophobicContact CB-CE1 3.98Å; A82-Y95 HydrophobicContact CB-CE2 3.97Å; A82-Y95 HydrophobicContact CB-CG 4.47Å
83M76.4Confident79.8Confident3 Ų357.8 Ų57.82%0.01528%0.283CS..Hα-helixtrans-70.6-40.7177-160.1166.669.400112.3V30 L79 K80 D81 N85 A86 L92 Y95 N96 M99V30-M83 HydrophobicContact CB-CE 4.26Å; V30-M83 HydrophobicContact CG1-CE 3.43Å; V30-M83 VanDerWaalsContact CG1-CE 3.43Å; V30-M83 HydrophobicContact CG2-CB 4.23Å; V30-M83 HydrophobicContact CG2-CE 3.87Å; V30-M83 HydrophobicContact CG2-CG 4.17Å; L79-M83 WeakPolarHBondContact O-CB 3.28Å; L79-M83 PolarHBondContact O-N 3.2Å; K80-M83 WeakPolarHBondContact O-CB 3.16Å; K80-M83 PolarHBondContact O-N 3.05Å; K80-M83 VanDerWaalsContact O-N 3.16Å; D81-M83 VanDerWaalsContact C-N 3.28Å; D81-M83 PolarHBondContact O-N 2.9Å; M83-N85 PolarHBondContact O-N 3.36Å; M83-A86 WeakPolarHBondContact O-CB 3.2Å; M83-A86 PolarHBondContact O-N 2.74Å; M83-L92 HydrophobicContact CG-CD1 3.49Å; M83-L92 VanDerWaalsContact CG-CD1 3.49Å; M83-L92 HydrophobicContact SD-CD1 4.01Å; M83-Y95 HydrophobicContact CB-CD2 4.36Å; M83-N96 HydrophobicContact SD-CB 4.22Å; M83-M99 HydrophobicContact CE-CE 4.12Å; M83-M99 HydrophobicContact CE-SD 3.55Å; M83-M99 VanDerWaalsContact CE-SD 3.55Å; M83-M99 HydrophobicContact SD-SD 3.86Å
84D69.5Low79.9Confident33 Ų3360.9 Ų60.918%0.17630%0.3CS..Hα-helixtrans-62.2-26.9175.1-88.6-47.6000112.9V30 K80 D81V30-D84 WeakPolarHBondContact CB-OD1 3.26Å; V30-D84 HydrophobicContact CG2-CB 4.14Å; V30-D84 VanDerWaalsContact CG2-CG 3.43Å; V30-D84 WeakPolarHBondContact CG2-OD1 3.36Å; K80-D84 PolarHBondContact O-N 2.88Å; D81-D84 PolarHBondContact O-N 2.81Å
85N70.8Confident79.8Confident103 Ų10357.9 Ų57.955%0.55128%0.284SS*.THydrogen-bonded Turntrans-100.40.4179-64.4-61.4000113.4D81 A82 M83D81-N85 PolarHBondContact O-N 3.13Å; D81-N85 PolarHBondContact O-ND2 3.23Å; A82-N85 PolarHBondContact O-N 2.84Å; M83-N85 PolarHBondContact O-N 3.36Å
86A71.2Confident79.7Confident7 Ų752.3 Ų52.36%0.05826%0.264CS..  trans-73.6133.2-179.100000110.5F28 A82 M83 Y95F28-A86 HydrophobicContact CD2-CB 4.47Å; F28-A86 WeakPolarHBondContact CD2-O 3.27Å; F28-A86 WeakPolarHBondContact CE2-O 3.48Å; A82-A86 PolarHBondContact O-N 3.45Å; A82-A86 VanDerWaalsContact O-N 3.14Å; M83-A86 WeakPolarHBondContact O-CB 3.2Å; M83-A86 PolarHBondContact O-N 2.74Å; A86-Y95 HydrophobicContact CB-CD2 4.27Å; A86-Y95 HydrophobicContact CB-CE2 4.14Å
87F66.6Low79.8Confident66 Ų6656.8 Ų56.829%0.28929%0.288SS..  trans-99.6-14.9169-79-90.4000112.9I24 T25 P27 S209I24-F87 VanDerWaalsContact O-CE1 3.31Å; I24-F87 WeakPolarHBondContact O-CE1 3.22Å; T25-F87 WeakPolarHBondContact O-CZ 3.07Å; P27-F87 HydrophobicContact CG-CD1 3.9Å; P27-F87 HydrophobicContact CG-CE1 4.29Å; F87-S209 PolarHBondContact O-OG 3.18Å
88D72.2Confident80.1Confident42 Ų4257.3 Ų57.323%0.22528%0.284CS..  trans-103.5128.8-173.9-178.43.4000111E90 R91 L92D88-E90 VanDerWaalsContact C-N 3.26Å; D88-E90 PolarHBondContact O-N 3.44Å; D88-E90 PolarHBondContact OD1-N 2.84Å; D88-R91 HydrophobicContact CB-CB 4.21Å; D88-R91 HydrophobicContact CB-CG 4.17Å; D88-R91 PolarHBondContact O-N 2.94Å; D88-L92 WeakPolarHBondContact O-CB 3.37Å; D88-L92 PolarHBondContact O-N 3.35Å
89I73.3Confident80.2Confident5 Ų551.7 Ų51.73%0.02626%0.257CS..Hα-helixtrans-59.8-35.4175.1-65.6-176.2000111.8F28 L92 A93 L153 N205 R206F28-I89 HydrophobicContact CE1-CG1 4.2Å; F28-I89 HydrophobicContact CZ-CG1 3.72Å; I89-L92 WeakPolarHBondContact O-CB 3.29Å; I89-L92 PolarHBondContact O-N 3.31Å; I89-A93 PolarHBondContact O-N 3.33Å; I89-L153 HydrophobicContact CG2-CD2 3.21Å; I89-N205 HydrophobicContact CD1-CB 3.89Å; I89-R206 HydrophobicContact CD1-CG 3.75Å
90E76.1Confident80.5Confident136 Ų13651.4 Ų51.464%0.63626%0.256SS*.Hα-helixtrans-67.1-44.5178.8-66.3-174.2-178.800111.1D88 L92 A93 Q94D88-E90 VanDerWaalsContact C-N 3.26Å; D88-E90 PolarHBondContact O-N 3.44Å; D88-E90 PolarHBondContact OD1-N 2.84Å; E90-L92 VanDerWaalsContact C-N 3.35Å; E90-A93 PolarHBondContact O-N 2.88Å; E90-Q94 WeakPolarHBondContact O-CG 3.25Å; E90-Q94 PolarHBondContact O-N 3.23Å
91R81.2Confident81.2Confident125 Ų12556.1 Ų56.147%0.47228%0.277SS..Hα-helixtrans-64.7-39.8174.8-70.1-174.3178.6170.81.5111.9D88 A93 Q94 Y95D88-R91 HydrophobicContact CB-CB 4.21Å; D88-R91 HydrophobicContact CB-CG 4.17Å; D88-R91 PolarHBondContact O-N 2.94Å; R91-A93 VanDerWaalsContact C-N 3.34Å; R91-A93 PolarHBondContact O-N 3.02Å; R91-Q94 PolarHBondContact O-N 3.49Å; R91-Y95 HydrophobicContact CB-CD2 4.34Å; R91-Y95 HydrophobicContact CB-CE2 3.93Å; R91-Y95 WeakPolarHBondContact O-CD2 3.44Å; R91-Y95 PolarHBondContact O-N 3.38Å
92L80.8Confident81.8Confident1 Ų152.4 Ų52.41%0.00526%0.257CS..Hα-helixtrans-55.5-49174.8177.479.1000111.3F28 M83 D88 I89 E90 Q94 Y95 N96 L149 Q152F28-L92 HydrophobicContact CB-CD1 4.08Å; F28-L92 HydrophobicContact CD1-CD1 4.42Å; F28-L92 HydrophobicContact CD1-CD2 3.83Å; F28-L92 HydrophobicContact CD2-CB 4.45Å; F28-L92 HydrophobicContact CD2-CD1 3.92Å; F28-L92 HydrophobicContact CD2-CD2 4.35Å; F28-L92 HydrophobicContact CD2-CG 4.46Å; F28-L92 HydrophobicContact CE1-CD2 3.81Å; F28-L92 HydrophobicContact CE2-CB 4.29Å; F28-L92 HydrophobicContact CE2-CD2 4.35Å; F28-L92 HydrophobicContact CG-CD1 3.88Å; F28-L92 HydrophobicContact CG-CD2 4.12Å; F28-L92 HydrophobicContact CZ-CD2 4.1Å; M83-L92 HydrophobicContact CG-CD1 3.49Å; M83-L92 VanDerWaalsContact CG-CD1 3.49Å; M83-L92 HydrophobicContact SD-CD1 4.01Å; D88-L92 WeakPolarHBondContact O-CB 3.37Å; D88-L92 PolarHBondContact O-N 3.35Å; I89-L92 WeakPolarHBondContact O-CB 3.29Å; I89-L92 PolarHBondContact O-N 3.31Å; E90-L92 VanDerWaalsContact C-N 3.35Å; L92-Q94 VanDerWaalsContact C-N 3.34Å; L92-Q94 PolarHBondContact O-N 2.87Å; L92-Y95 PolarHBondContact O-N 3.39Å; L92-N96 WeakPolarHBondContact O-CB 3.47Å; L92-N96 PolarHBondContact O-N 3.49Å; L92-L149 HydrophobicContact CD2-CD1 3.84Å; L92-L149 HydrophobicContact CG-CD1 3.92Å; L92-Q152 HydrophobicContact CD2-CB 3.76Å; L92-Q152 HydrophobicContact CD2-CG 4.49Å
93A84.1Confident82.5Confident35 Ų3551 Ų5129%0.28925%0.245SC..Hα-helixtrans-63.4-39.6177.600000112.3I89 E90 R91 N96 D97 L149I89-A93 PolarHBondContact O-N 3.33Å; E90-A93 PolarHBondContact O-N 2.88Å; R91-A93 VanDerWaalsContact C-N 3.34Å; R91-A93 PolarHBondContact O-N 3.02Å; A93-N96 PolarHBondContact O-N 3.39Å; A93-D97 PolarHBondContact O-N 3.49Å; A93-L149 HydrophobicContact CB-CD1 4.16Å; A93-L149 HydrophobicContact CB-CD2 4.46Å
94Q88.1Confident83.4Confident117 Ų11756.2 Ų56.255%0.54727%0.268SS..Hα-helixtrans-63.7-48.3175.8-72.2174.1-11.200112.3E90 R91 L92 N96 D97 E98E90-Q94 WeakPolarHBondContact O-CG 3.25Å; E90-Q94 PolarHBondContact O-N 3.23Å; R91-Q94 PolarHBondContact O-N 3.49Å; L92-Q94 VanDerWaalsContact C-N 3.34Å; L92-Q94 PolarHBondContact O-N 2.87Å; Q94-N96 VanDerWaalsContact C-N 3.3Å; Q94-N96 PolarHBondContact O-N 2.92Å; Q94-D97 PolarHBondContact O-N 2.82Å; Q94-E98 PolarHBondContact O-N 3.28Å
95Y87.1Confident84.7Confident61 Ų6157.4 Ų57.424%0.23928%0.276CS..Hα-helixtrans-62.8-38.6178.1-65.8-41.3000111.9L79 A82 M83 A86 R91 L92 E98 M99L79-Y95 HydrophobicContact CD2-CD1 4.06Å; A82-Y95 HydrophobicContact CB-CD1 4.3Å; A82-Y95 HydrophobicContact CB-CD2 4.3Å; A82-Y95 HydrophobicContact CB-CE1 3.98Å; A82-Y95 HydrophobicContact CB-CE2 3.97Å; A82-Y95 HydrophobicContact CB-CG 4.47Å; M83-Y95 HydrophobicContact CB-CD2 4.36Å; A86-Y95 HydrophobicContact CB-CD2 4.27Å; A86-Y95 HydrophobicContact CB-CE2 4.14Å; R91-Y95 HydrophobicContact CB-CD2 4.34Å; R91-Y95 HydrophobicContact CB-CE2 3.93Å; R91-Y95 WeakPolarHBondContact O-CD2 3.44Å; R91-Y95 PolarHBondContact O-N 3.38Å; L92-Y95 PolarHBondContact O-N 3.39Å; Y95-E98 PolarHBondContact O-N 3.01Å; Y95-M99 WeakPolarHBondContact O-CB 3.42Å; Y95-M99 VanDerWaalsContact O-CG 3.28Å; Y95-M99 WeakPolarHBondContact O-CG 3.5Å; Y95-M99 PolarHBondContact O-N 3.43Å
96N86.6Confident85.7Confident8 Ų852.5 Ų52.54%0.04325%0.25CS..Hα-helixtrans-61.6-46.9174.7-165-88.1000112.2M83 L92 A93 Q94 E98 M99 V100 A145 L149M83-N96 HydrophobicContact SD-CB 4.22Å; L92-N96 WeakPolarHBondContact O-CB 3.47Å; L92-N96 PolarHBondContact O-N 3.49Å; A93-N96 PolarHBondContact O-N 3.39Å; Q94-N96 VanDerWaalsContact C-N 3.3Å; Q94-N96 PolarHBondContact O-N 2.92Å; N96-E98 VanDerWaalsContact C-N 3.31Å; N96-E98 PolarHBondContact O-N 3.43Å; N96-M99 WeakPolarHBondContact O-CB 3.46Å; N96-M99 PolarHBondContact O-N 3.43Å; N96-V100 WeakPolarHBondContact O-CG2 3.39Å; N96-V100 PolarHBondContact O-N 3.18Å; N96-A145 PolarHBondContact ND2-O 3Å; N96-L149 HydrophobicContact CB-CB 4.36Å; N96-L149 HydrophobicContact CB-CD1 4.35Å; N96-L149 HydrophobicContact CB-CD2 3.88Å; N96-L149 HydrophobicContact CB-CG 4.42Å
97D91.2Very high86.9Confident104 Ų10453 Ų5356%0.55625%0.251SS*.Hα-helixtrans-59.7-42.5175.4-178.269.2000111.5A93 Q94 M99 V100 K101A93-D97 PolarHBondContact O-N 3.49Å; Q94-D97 PolarHBondContact O-N 2.82Å; D97-M99 PolarHBondContact O-N 2.89Å; D97-V100 PolarHBondContact O-N 2.95Å; D97-K101 VanDerWaalsContact O-CB 3.22Å; D97-K101 WeakPolarHBondContact O-CB 3.26Å; D97-K101 PolarHBondContact O-N 2.82Å
98E92.1Very high88.3Confident72 Ų7252.4 Ų52.434%0.33626%0.259SS..Hα-helixtrans-63.5-41175.9-73-159.4-154.800112.7R75 L79 Q94 Y95 N96 K101 N102R75-E98 IonicContact CZ-OE2 2.76Å; R75-E98 IonicContact NE-OE2 3.72Å; R75-E98 IonicContact NH2-OE2 3.69Å; R75-E98 PolarHBondContact NH2-OE2 3.36Å; L79-E98 HydrophobicContact CD1-CB 3.77Å; L79-E98 HydrophobicContact CD2-CB 3.73Å; L79-E98 HydrophobicContact CD2-CG 4.46Å; L79-E98 WeakPolarHBondContact CD2-OE2 3.5Å; L79-E98 HydrophobicContact CG-CB 4.41Å; Q94-E98 PolarHBondContact O-N 3.28Å; Y95-E98 PolarHBondContact O-N 3.01Å; N96-E98 VanDerWaalsContact C-N 3.31Å; N96-E98 PolarHBondContact O-N 3.43Å; E98-K101 PolarHBondContact O-N 3.37Å; E98-N102 WeakPolarHBondContact O-CB 3.4Å; E98-N102 PolarHBondContact O-N 2.88Å
99M89.4Confident89.5Confident0 Ų051.5 Ų51.50%025%0.254CS..Hα-helixtrans-62.8-46.8175-75.2176.170.600111.3Y76 L79 K80 M83 Y95 N96 D97 N102 L103Y76-M99 HydrophobicContact CD2-CB 4.16Å; Y76-M99 HydrophobicContact CD2-CE 4.34Å; Y76-M99 HydrophobicContact CD2-CG 4.22Å; Y76-M99 HydrophobicContact CE1-CE 3.97Å; Y76-M99 HydrophobicContact CE2-CB 3.84Å; Y76-M99 HydrophobicContact CE2-CE 3.51Å; Y76-M99 HydrophobicContact CE2-CG 4.07Å; Y76-M99 VanDerWaalsContact OH-CE 3.25Å; Y76-M99 WeakPolarHBondContact OH-CE 3.35Å; L79-M99 HydrophobicContact CB-CG 3.61Å; L79-M99 HydrophobicContact CB-SD 4.43Å; L79-M99 HydrophobicContact CD1-CG 4.2Å; K80-M99 HydrophobicContact CB-CE 4.22Å; K80-M99 HydrophobicContact CG-CE 4.45Å; M83-M99 HydrophobicContact CE-CE 4.12Å; M83-M99 HydrophobicContact CE-SD 3.55Å; M83-M99 VanDerWaalsContact CE-SD 3.55Å; M83-M99 HydrophobicContact SD-SD 3.86Å; Y95-M99 WeakPolarHBondContact O-CB 3.42Å; Y95-M99 VanDerWaalsContact O-CG 3.28Å; Y95-M99 WeakPolarHBondContact O-CG 3.5Å; Y95-M99 PolarHBondContact O-N 3.43Å; N96-M99 WeakPolarHBondContact O-CB 3.46Å; N96-M99 PolarHBondContact O-N 3.43Å; D97-M99 PolarHBondContact O-N 2.89Å; M99-N102 WeakPolarHBondContact O-CB 3.29Å; M99-N102 PolarHBondContact O-N 3.39Å; M99-L103 WeakPolarHBondContact O-CG 3.3Å; M99-L103 PolarHBondContact O-N 3.34Å
100V91.8Very high90.5Very high6 Ų651.3 Ų51.34%0.03625%0.253CS..Hα-helixtrans-63-44.8178169.20000110.7N96 D97 N102 L103 K104 I142 A145 E146N96-V100 WeakPolarHBondContact O-CG2 3.39Å; N96-V100 PolarHBondContact O-N 3.18Å; D97-V100 PolarHBondContact O-N 2.95Å; V100-N102 VanDerWaalsContact C-N 3.33Å; V100-N102 PolarHBondContact O-N 3.46Å; V100-L103 PolarHBondContact O-N 2.89Å; V100-K104 HydrophobicContact CG1-CD 3.92Å; V100-K104 VanDerWaalsContact CG1-CE 3.48Å; V100-K104 HydrophobicContact CG1-CG 4.49Å; V100-K104 VanDerWaalsContact CG1-NZ 3.32Å; V100-K104 WeakPolarHBondContact O-CB 3.21Å; V100-K104 VanDerWaalsContact O-CG 3.32Å; V100-K104 WeakPolarHBondContact O-CG 3.45Å; V100-K104 PolarHBondContact O-N 3.04Å; V100-I142 HydrophobicContact CG1-CG2 4Å; V100-I142 HydrophobicContact CG2-CG2 4.25Å; V100-A145 HydrophobicContact CG2-CB 4.34Å; V100-E146 HydrophobicContact CG2-CG 4.09Å
101K95.5Very high91.6Very high139 Ų13949.9 Ų49.960%0.60425%0.246SC*.Hα-helixtrans-63-39.7176.1-176.2177.6-178.9176.40112D97 E98 T105D97-K101 VanDerWaalsContact O-CB 3.22Å; D97-K101 WeakPolarHBondContact O-CB 3.26Å; D97-K101 PolarHBondContact O-N 2.82Å; E98-K101 PolarHBondContact O-N 3.37Å; K101-T105 WeakPolarHBondContact O-CB 3.44Å; K101-T105 PolarHBondContact O-N 2.85Å; K101-T105 PolarHBondContact O-OG1 3.36Å
102N93.9Very high92.3Very high7 Ų746.4 Ų46.44%0.03724%0.242CC..Hα-helixtrans-59.9-52.3175-177.2-49.2000110.8L72 Y76 E98 M99 V100 K104 T105 Q106L72-N102 PolarHBondContact O-ND2 2.9Å; L72-N102 PolarHBondContact O-OD1 2.9Å; L72-N102 VanDerWaalsContact O-OD1 3.13Å; Y76-N102 PolarHBondContact N-ND2 3.08Å; E98-N102 WeakPolarHBondContact O-CB 3.4Å; E98-N102 PolarHBondContact O-N 2.88Å; M99-N102 WeakPolarHBondContact O-CB 3.29Å; M99-N102 PolarHBondContact O-N 3.39Å; V100-N102 VanDerWaalsContact C-N 3.33Å; V100-N102 PolarHBondContact O-N 3.46Å; N102-K104 PolarHBondContact O-N 3.39Å; N102-T105 CarbonylContact O-C 3.58Å; N102-T105 WeakPolarHBondContact O-CA 3.31Å; N102-T105 WeakPolarHBondContact O-CB 3.47Å; N102-T105 PolarHBondContact O-N 3.3Å; N102-Q106 PolarHBondContact O-N 3.48Å; N102-Q106 PolarHBondContact OD1-NE2 3.05Å
103L94.2Very high92.9Very high0 Ų046.4 Ų46.40%024%0.241CC..Hα-helixtrans-60.2-43.3177.8-74.2176.3000112.6I35 Y76 M99 V100 T105 Q106 N107 N138 A141 I142I35-L103 HydrophobicContact CD1-CD2 3.45Å; I35-L103 VanDerWaalsContact CD1-CD2 3.45Å; I35-L103 HydrophobicContact CG1-CD2 4.38Å; Y76-L103 HydrophobicContact CD2-CD1 4.35Å; Y76-L103 HydrophobicContact CD2-CD2 4.19Å; Y76-L103 HydrophobicContact CD2-CG 3.91Å; Y76-L103 HydrophobicContact CE2-CD1 3.54Å; Y76-L103 HydrophobicContact CE2-CD2 4.03Å; Y76-L103 HydrophobicContact CE2-CG 3.61Å; M99-L103 WeakPolarHBondContact O-CG 3.3Å; M99-L103 PolarHBondContact O-N 3.34Å; V100-L103 PolarHBondContact O-N 2.89Å; L103-T105 VanDerWaalsContact C-N 3.26Å; L103-T105 PolarHBondContact O-N 2.97Å; L103-Q106 WeakPolarHBondContact O-CB 3.46Å; L103-Q106 PolarHBondContact O-N 3.5Å; L103-Q106 VanDerWaalsContact O-N 3.14Å; L103-N107 PolarHBondContact O-N 2.91Å; L103-N138 HydrophobicContact CD2-CB 4.04Å; L103-A141 HydrophobicContact CD1-CB 3.81Å; L103-I142 HydrophobicContact CB-CD1 3.74Å; L103-I142 HydrophobicContact CB-CG1 3.61Å; L103-I142 HydrophobicContact CD1-CG1 3.61Å; L103-I142 HydrophobicContact CG-CG1 4.25Å
104K95.8Very high93.5Very high114 Ų11445 Ų4550%0.49623%0.229SC..Hα-helixtrans-59.6-37.3173.5-74.1173.3-179.7164.60111.8V100 N102 N107 A108 I142V100-K104 HydrophobicContact CG1-CD 3.92Å; V100-K104 VanDerWaalsContact CG1-CE 3.48Å; V100-K104 HydrophobicContact CG1-CG 4.49Å; V100-K104 VanDerWaalsContact CG1-NZ 3.32Å; V100-K104 WeakPolarHBondContact O-CB 3.21Å; V100-K104 VanDerWaalsContact O-CG 3.32Å; V100-K104 WeakPolarHBondContact O-CG 3.45Å; V100-K104 PolarHBondContact O-N 3.04Å; N102-K104 PolarHBondContact O-N 3.39Å; K104-N107 PolarHBondContact O-N 3.46Å; K104-A108 PolarHBondContact O-N 2.9Å; K104-I142 HydrophobicContact CG-CD1 3.89Å
105T96.2Very high93.9Very high58 Ų5845.9 Ų45.936%0.35623%0.231SC..Hα-helixtrans-70.2-38.1175.7-52.40000111.7L72 K101 N102 L103 N107 A108 N109L72-T105 HydrophobicContact CD1-CG2 3.74Å; L72-T105 HydrophobicContact CD2-CG2 4.21Å; K101-T105 WeakPolarHBondContact O-CB 3.44Å; K101-T105 PolarHBondContact O-N 2.85Å; K101-T105 PolarHBondContact O-OG1 3.36Å; N102-T105 CarbonylContact O-C 3.58Å; N102-T105 WeakPolarHBondContact O-CA 3.31Å; N102-T105 WeakPolarHBondContact O-CB 3.47Å; N102-T105 PolarHBondContact O-N 3.3Å; L103-T105 VanDerWaalsContact C-N 3.26Å; L103-T105 PolarHBondContact O-N 2.97Å; T105-N107 VanDerWaalsContact C-N 3.35Å; T105-A108 PolarHBondContact O-N 3.18Å; T105-N109 PolarHBondContact O-N 3.46Å; T105-N109 VanDerWaalsContact O-N 3.17Å; T105-N109 PolarHBondContact O-ND2 3.31Å
106Q93.1Very high94.3Very high0 Ų043.1 Ų43.10%022%0.221CC..Hα-helixtrans-60.6-45.2171.8-67.1-176.952.600110.9I69 L72 N102 L103 A108 N109 L110I69-Q106 HydrophobicContact CG2-CG 4.47Å; L72-Q106 HydrophobicContact CB-CG 3.63Å; L72-Q106 HydrophobicContact CD1-CG 3.83Å; L72-Q106 HydrophobicContact CG-CG 4.34Å; N102-Q106 PolarHBondContact O-N 3.48Å; N102-Q106 PolarHBondContact OD1-NE2 3.05Å; L103-Q106 WeakPolarHBondContact O-CB 3.46Å; L103-Q106 PolarHBondContact O-N 3.5Å; L103-Q106 VanDerWaalsContact O-N 3.14Å; Q106-A108 PolarHBondContact O-N 3.45Å; Q106-N109 WeakPolarHBondContact O-CB 3.4Å; Q106-N109 PolarHBondContact O-N 3.44Å; Q106-N109 VanDerWaalsContact O-N 3.14Å; Q106-L110 WeakPolarHBondContact O-CG 3.33Å; Q106-L110 PolarHBondContact O-N 3.25Å
107N95.3Very high94.7Very high16 Ų1642.8 Ų42.89%0.08622%0.219CC..Hα-helixtrans-59.3-43.1176.5-71.7-3.8000112.4L103 K104 T105 N109 L110 E111 N138 N139L103-N107 PolarHBondContact O-N 2.91Å; K104-N107 PolarHBondContact O-N 3.46Å; T105-N107 VanDerWaalsContact C-N 3.35Å; N107-N109 VanDerWaalsContact C-N 3.3Å; N107-N109 PolarHBondContact O-N 3.48Å; N107-L110 PolarHBondContact O-N 3.4Å; N107-L110 VanDerWaalsContact O-N 3.16Å; N107-E111 WeakPolarHBondContact O-CG 3.4Å; N107-E111 PolarHBondContact O-N 2.92Å; N107-N138 WeakPolarHBondContact OD1-CB 3.11Å; N107-N138 PolarHBondContact OD1-ND2 2.95Å; N107-N139 PolarHBondContact ND2-OD1 3.4Å
108A97.3Very high94.9Very high55 Ų5542.3 Ų42.346%0.45521%0.214SC..Hα-helixtrans-61.8-35.617600000113.2K104 T105 Q106 S112K104-A108 PolarHBondContact O-N 2.9Å; T105-A108 PolarHBondContact O-N 3.18Å; Q106-A108 PolarHBondContact O-N 3.45Å; A108-S112 PolarHBondContact O-N 2.94Å; A108-S112 VanDerWaalsContact O-N 3.16Å; A108-S112 PolarHBondContact O-OG 3.23Å
109N95.6Very high95Very high23 Ų2342.4 Ų42.412%0.12322%0.217CC..Hα-helixtrans-69.2-41.9173.4-78-85.8000111.4H65 I69 T105 Q106 N107 S112 M113H65-N109 HydrophobicContact CB-CB 4.23Å; H65-N109 PolarHBondContact ND1-OD1 2.89Å; I69-N109 HydrophobicContact CD1-CB 3.75Å; I69-N109 HydrophobicContact CG1-CB 3.66Å; T105-N109 PolarHBondContact O-N 3.46Å; T105-N109 VanDerWaalsContact O-N 3.17Å; T105-N109 PolarHBondContact O-ND2 3.31Å; Q106-N109 WeakPolarHBondContact O-CB 3.4Å; Q106-N109 PolarHBondContact O-N 3.44Å; Q106-N109 VanDerWaalsContact O-N 3.14Å; N107-N109 VanDerWaalsContact C-N 3.3Å; N107-N109 PolarHBondContact O-N 3.48Å; N109-S112 WeakPolarHBondContact O-CB 3.25Å; N109-S112 PolarHBondContact O-N 3Å; N109-M113 VanDerWaalsContact O-CG 3.3Å; N109-M113 WeakPolarHBondContact O-CG 3.35Å; N109-M113 PolarHBondContact O-N 3.47Å
110L96Very high95.1Very high0 Ų043.3 Ų43.30%022%0.221CC..Hα-helixtrans-63.4-43177.1-69.8160.2000111.9I69 Q106 N107 S112 M113 I114 Y131 Q134 I135I69-L110 HydrophobicContact CD1-CD2 3.82Å; I69-L110 HydrophobicContact CD1-CG 3.8Å; Q106-L110 WeakPolarHBondContact O-CG 3.33Å; Q106-L110 PolarHBondContact O-N 3.25Å; N107-L110 PolarHBondContact O-N 3.4Å; N107-L110 VanDerWaalsContact O-N 3.16Å; L110-S112 VanDerWaalsContact C-N 3.3Å; L110-S112 PolarHBondContact O-N 3.21Å; L110-M113 HydrophobicContact CD2-SD 4.48Å; L110-M113 WeakPolarHBondContact O-CB 3.38Å; L110-M113 PolarHBondContact O-N 3.29Å; L110-M113 VanDerWaalsContact O-N 3.13Å; L110-I114 WeakPolarHBondContact O-CG1 3.48Å; L110-I114 PolarHBondContact O-N 3.36Å; L110-Y131 HydrophobicContact CD2-CD1 4.09Å; L110-Y131 HydrophobicContact CD2-CG 4.25Å; L110-Q134 HydrophobicContact CD1-CB 4.01Å; L110-Q134 HydrophobicContact CD1-CG 3.69Å; L110-Q134 HydrophobicContact CD2-CB 4.43Å; L110-I135 HydrophobicContact CB-CD1 3.81Å; L110-I135 HydrophobicContact CB-CG1 3.7Å; L110-I135 HydrophobicContact CD1-CG1 3.8Å; L110-I135 HydrophobicContact CG-CG1 4.37Å
111E97.3Very high95Very high106 Ų10651 Ų5150%0.49525%0.254SS..Hα-helixtrans-60.2-40.3173.6-74-68.3176.800111.9N107 M113 I114 K115 I135N107-E111 WeakPolarHBondContact O-CG 3.4Å; N107-E111 PolarHBondContact O-N 2.92Å; E111-M113 VanDerWaalsContact C-N 3.34Å; E111-M113 PolarHBondContact O-N 3.34Å; E111-I114 PolarHBondContact O-N 2.87Å; E111-K115 PolarHBondContact O-N 2.86Å; E111-I135 HydrophobicContact CG-CD1 3.99Å
112S97.2Very high94.7Very high53 Ų5352.5 Ų52.537%0.37126%0.26SS..Hα-helixtrans-65.5-38174.9-58.30000111.9H65 A108 N109 L110 K115 A116H65-S112 WeakPolarHBondContact NE2-CB 3.18Å; A108-S112 PolarHBondContact O-N 2.94Å; A108-S112 VanDerWaalsContact O-N 3.16Å; A108-S112 PolarHBondContact O-OG 3.23Å; N109-S112 WeakPolarHBondContact O-CB 3.25Å; N109-S112 PolarHBondContact O-N 3Å; L110-S112 VanDerWaalsContact C-N 3.3Å; L110-S112 PolarHBondContact O-N 3.21Å; S112-K115 PolarHBondContact O-N 3.1Å; S112-A116 WeakPolarHBondContact O-CB 3.27Å; S112-A116 PolarHBondContact O-N 3.07Å
113M94.2Very high94.6Very high0 Ų055 Ų550%028%0.276CS..Hα-helixtrans-66.3-41.2174.1-70.6166.853.700112.1I62 H65 Q66 I69 N109 L110 E111 A116 E117 Y131I62-M113 HydrophobicContact CG2-CE 4.14Å; I62-M113 HydrophobicContact CG2-CG 4.32Å; H65-M113 HydrophobicContact CB-CG 3.41Å; H65-M113 VanDerWaalsContact CB-CG 3.41Å; H65-M113 HydrophobicContact CB-SD 3.55Å; H65-M113 VanDerWaalsContact CB-SD 3.55Å; Q66-M113 HydrophobicContact CG-CE 3.52Å; Q66-M113 HydrophobicContact CG-SD 4.02Å; I69-M113 HydrophobicContact CD1-SD 3.66Å; N109-M113 VanDerWaalsContact O-CG 3.3Å; N109-M113 WeakPolarHBondContact O-CG 3.35Å; N109-M113 PolarHBondContact O-N 3.47Å; L110-M113 HydrophobicContact CD2-SD 4.48Å; L110-M113 WeakPolarHBondContact O-CB 3.38Å; L110-M113 PolarHBondContact O-N 3.29Å; L110-M113 VanDerWaalsContact O-N 3.13Å; E111-M113 VanDerWaalsContact C-N 3.34Å; E111-M113 PolarHBondContact O-N 3.34Å; M113-A116 PolarHBondContact O-N 2.71Å; M113-E117 WeakPolarHBondContact O-CB 3.32Å; M113-E117 PolarHBondContact O-N 3.15Å; M113-Y131 HydrophobicContact CB-CD2 3.89Å; M113-Y131 HydrophobicContact CB-CE2 3.76Å; M113-Y131 HydrophobicContact CE-CD1 3.85Å; M113-Y131 HydrophobicContact CE-CD2 4.28Å; M113-Y131 HydrophobicContact CE-CE1 3.32Å; M113-Y131 HydrophobicContact CE-CE2 3.78Å; M113-Y131 HydrophobicContact CE-CG 4.33Å
114I96.2Very high94.5Very high7 Ų757.5 Ų57.54%0.03629%0.289CS..Hα-helixtrans-58.6-49.6174.7-70.5167000110L110 E111 A116 E117 Q118 I128 Y131 R132 I135L110-I114 WeakPolarHBondContact O-CG1 3.48Å; L110-I114 PolarHBondContact O-N 3.36Å; E111-I114 PolarHBondContact O-N 2.87Å; I114-A116 PolarHBondContact O-N 3.09Å; I114-E117 PolarHBondContact O-N 3.28Å; I114-Q118 HydrophobicContact CG2-CG 4.47Å; I114-Q118 VanDerWaalsContact O-CG 3.29Å; I114-Q118 WeakPolarHBondContact O-CG 3.33Å; I114-Q118 PolarHBondContact O-N 2.87Å; I114-I128 HydrophobicContact CG1-CG2 4.43Å; I114-I128 HydrophobicContact CG2-CG2 4.07Å; I114-Y131 HydrophobicContact CG1-CD2 3.92Å; I114-Y131 HydrophobicContact CG1-CG 4.33Å; I114-R132 HydrophobicContact CD1-CG 3.9Å; I114-I135 HydrophobicContact CD1-CD1 3.81Å
115K96.9Very high94.3Very high134 Ų13457.5 Ų57.558%0.58329%0.294SS*.Hα-helixtrans-60.8-45.3178.1-175.2177.7179.8178.10112.2E111 S112 E117 Q118 D119E111-K115 PolarHBondContact O-N 2.86Å; S112-K115 PolarHBondContact O-N 3.1Å; K115-E117 VanDerWaalsContact C-N 3.3Å; K115-E117 PolarHBondContact O-N 3.05Å; K115-Q118 PolarHBondContact O-N 3.07Å; K115-D119 WeakPolarHBondContact O-CB 3.42Å; K115-D119 PolarHBondContact O-N 3.2Å
116A94.8Very high94.2Very high4 Ų461.1 Ų61.13%0.03331%0.311CS..Hα-helixtrans-63.6-35.9178.400000112.4L58 I62 S112 M113 I114 D119L58-A116 HydrophobicContact CD2-CB 4.25Å; I62-A116 HydrophobicContact CD1-CB 4.12Å; I62-A116 HydrophobicContact CG1-CB 3.73Å; S112-A116 WeakPolarHBondContact O-CB 3.27Å; S112-A116 PolarHBondContact O-N 3.07Å; M113-A116 PolarHBondContact O-N 2.71Å; I114-A116 PolarHBondContact O-N 3.09Å; A116-D119 PolarHBondContact O-N 3.2Å
117E93.8Very high94Very high1 Ų163.4 Ų63.41%0.00532%0.322CS..Hα-helixtrans-71.2-39.1176.7-169.956.2-127.700111.7I62 M113 I114 K115 D119 K120 D124 I128I62-E117 HydrophobicContact CD1-CB 4.21Å; I62-E117 WeakPolarHBondContact CD1-OE2 3.29Å; M113-E117 WeakPolarHBondContact O-CB 3.32Å; M113-E117 PolarHBondContact O-N 3.15Å; I114-E117 PolarHBondContact O-N 3.28Å; K115-E117 VanDerWaalsContact C-N 3.3Å; K115-E117 PolarHBondContact O-N 3.05Å; E117-D119 VanDerWaalsContact C-N 3.32Å; E117-D119 PolarHBondContact O-N 2.98Å; E117-K120 WeakPolarHBondContact O-CB 3.44Å; E117-K120 PolarHBondContact O-N 3.05Å; E117-K120 WeakPolarHBondContact OE1-CD 3.36Å; E117-K120 WeakPolarHBondContact OE1-CE 3.48Å; E117-K120 IonicContact OE1-NZ 2.73Å; E117-K120 PolarHBondContact OE1-NZ 3.45Å; E117-K120 WeakPolarHBondContact OE2-CD 3.37Å; E117-K120 IonicContact OE2-NZ 2.83Å; E117-K120 PolarHBondContact OE2-NZ 3.36Å; E117-D124 HydrophobicContact CG-CB 4.17Å; E117-D124 WeakPolarHBondContact OE1-CB 3.48Å; E117-D124 PolarHBondContact OE1-N 2.87Å; E117-I128 HydrophobicContact CB-CD1 4.33Å; E117-I128 HydrophobicContact CB-CG1 4.03Å; E117-I128 HydrophobicContact CG-CD1 4.13Å; E117-I128 HydrophobicContact CG-CG1 3.84Å
118Q95.6Very high93.9Very high94 Ų9463 Ų6344%0.43932%0.319SS..Hα-helixtrans-63.6-34172.9-72.1174-19.200113I114 K115 K120 T123 I128I114-Q118 HydrophobicContact CG2-CG 4.47Å; I114-Q118 VanDerWaalsContact O-CG 3.29Å; I114-Q118 WeakPolarHBondContact O-CG 3.33Å; I114-Q118 PolarHBondContact O-N 2.87Å; K115-Q118 PolarHBondContact O-N 3.07Å; Q118-K120 VanDerWaalsContact C-N 3.29Å; Q118-K120 PolarHBondContact O-N 3.24Å; Q118-T123 PolarHBondContact O-OG1 3.1Å; Q118-I128 HydrophobicContact CG-CD1 3.58Å
119D95.2Very high93.7Very high74 Ų7464.3 Ų64.340%0.39632%0.316SS..THydrogen-bonded Turntrans-77.4-9.1-178.4-81-25.2000114.5K54 L58 K115 A116 E117K54-D119 PolarHBondContact NZ-O 3.46Å; L58-D119 VanDerWaalsContact CD1-C 3.5Å; L58-D119 HydrophobicContact CD1-CB 3.77Å; L58-D119 WeakPolarHBondContact CD1-O 3.49Å; L58-D119 HydrophobicContact CD2-CB 4.08Å; K115-D119 WeakPolarHBondContact O-CB 3.42Å; K115-D119 PolarHBondContact O-N 3.2Å; A116-D119 PolarHBondContact O-N 3.2Å; E117-D119 VanDerWaalsContact C-N 3.32Å; E117-D119 PolarHBondContact O-N 2.98Å
120K91.7Very high93.4Very high19 Ų1965.6 Ų65.68%0.08332%0.321CS..SBendtrans-71.3151176.5-73.816566.8-168.20110.9L58 I62 E117 Q118 K122L58-K120 HydrophobicContact CB-CG 4.06Å; L58-K120 HydrophobicContact CD1-CB 4.47Å; L58-K120 HydrophobicContact CD1-CG 3.81Å; I62-K120 HydrophobicContact CD1-CD 4.41Å; E117-K120 WeakPolarHBondContact O-CB 3.44Å; E117-K120 PolarHBondContact O-N 3.05Å; E117-K120 WeakPolarHBondContact OE1-CD 3.36Å; E117-K120 WeakPolarHBondContact OE1-CE 3.48Å; E117-K120 IonicContact OE1-NZ 2.73Å; E117-K120 PolarHBondContact OE1-NZ 3.45Å; E117-K120 WeakPolarHBondContact OE2-CD 3.37Å; E117-K120 IonicContact OE2-NZ 2.83Å; E117-K120 PolarHBondContact OE2-NZ 3.36Å; Q118-K120 VanDerWaalsContact C-N 3.29Å; Q118-K120 PolarHBondContact O-N 3.24Å; K120-K122 PolarHBondContact O-N 3.43Å
121K89Confident93.3Very high168 Ų16865.9 Ų65.973%0.7332%0.322SS*.SBendtrans-58.2-34.1174.6-71.4-174.4175.5-171.80113.7D55D55-K121 PolarHBondContact OD1-N 3.09Å; D55-K121 VanDerWaalsContact OD1-N 3.09Å
122K89.7Confident93.1Very high170 Ų17067 Ų6774%0.73932%0.322SS*.SBendtrans-121.698.5172.7-67.4-172.8178.9-173.20107.7K120K120-K122 PolarHBondContact O-N 3.43Å
123T91.4Very high92.8Very high59 Ų5970 Ų7036%0.36233%0.329SS..  trans-69.5130.5175-540000110.3Q118 I128Q118-T123 PolarHBondContact O-OG1 3.1Å; T123-I128 HydrophobicContact CG2-CD1 3.4Å
124D91.4Very high92.5Very high52 Ų5270.2 Ų70.228%0.27833%0.329SS..  trans-93.694.4173.1-167.8-23.1000109.7E117 D126 K127 I128E117-D124 HydrophobicContact CG-CB 4.17Å; E117-D124 WeakPolarHBondContact OE1-CB 3.48Å; E117-D124 PolarHBondContact OE1-N 2.87Å; D124-D126 VanDerWaalsContact C-N 3.26Å; D124-D126 PolarHBondContact O-N 2.98Å; D124-D126 PolarHBondContact OD1-N 3.26Å; D124-K127 HydrophobicContact CB-CB 4.23Å; D124-K127 HydrophobicContact CB-CD 4.07Å; D124-K127 HydrophobicContact CB-CG 4.27Å; D124-K127 PolarHBondContact O-N 2.99Å; D124-K127 PolarHBondContact OD1-N 2.91Å; D124-K127 VanDerWaalsContact OD2-CD 3.23Å; D124-K127 WeakPolarHBondContact OD2-CD 3.37Å; D124-K127 WeakPolarHBondContact OD2-CE 3.36Å; D124-K127 WeakPolarHBondContact OD2-CG 3.43Å; D124-K127 IonicContact OD2-NZ 4Å; D124-K127 PolarHBondContact OD2-NZ 3Å; D124-I128 PolarHBondContact O-N 2.91Å
125N93.1Very high92.3Very high115 Ų11570.8 Ų70.862%0.61533%0.332SS*.Hα-helixtrans-66.2-28.6-177-72.6-36.8000112.7K127 I128 E129N125-K127 VanDerWaalsContact C-N 3.34Å; N125-I128 PolarHBondContact O-N 3.11Å; N125-E129 WeakPolarHBondContact O-CB 3.49Å; N125-E129 PolarHBondContact O-N 3.23Å
126D92.4Very high92.1Very high133 Ų13371.2 Ų71.271%0.71134%0.336SS*.Hα-helixtrans-67.6-39179.4-65.4-21.6000110.4D124 E129 E130D124-D126 VanDerWaalsContact C-N 3.26Å; D124-D126 PolarHBondContact O-N 2.98Å; D124-D126 PolarHBondContact OD1-N 3.26Å; D126-E129 PolarHBondContact O-N 2.66Å; D126-E130 PolarHBondContact O-N 3.47Å
127K90.2Very high91.8Very high49 Ų4973.5 Ų73.521%0.21336%0.355CS..Hα-helixtrans-66-41.3172.2-74.2-178.3-176.7165.80112.9D124 N125 E129 E130 Y131D124-K127 HydrophobicContact CB-CB 4.23Å; D124-K127 HydrophobicContact CB-CD 4.07Å; D124-K127 HydrophobicContact CB-CG 4.27Å; D124-K127 PolarHBondContact O-N 2.99Å; D124-K127 PolarHBondContact OD1-N 2.91Å; D124-K127 VanDerWaalsContact OD2-CD 3.23Å; D124-K127 WeakPolarHBondContact OD2-CD 3.37Å; D124-K127 WeakPolarHBondContact OD2-CE 3.36Å; D124-K127 WeakPolarHBondContact OD2-CG 3.43Å; D124-K127 IonicContact OD2-NZ 4Å; D124-K127 PolarHBondContact OD2-NZ 3Å; N125-K127 VanDerWaalsContact C-N 3.34Å; K127-E129 VanDerWaalsContact C-N 3.26Å; K127-E129 PolarHBondContact O-N 3.04Å; K127-E130 WeakPolarHBondContact O-CB 3.31Å; K127-E130 PolarHBondContact O-N 3.26Å; K127-Y131 HydrophobicContact CB-CE2 4.24Å; K127-Y131 WeakPolarHBondContact O-CD1 3.39Å; K127-Y131 WeakPolarHBondContact O-CD2 3.4Å; K127-Y131 PolarHBondContact O-N 3.3Å
128I93.6Very high91.6Very high6 Ų673.5 Ų73.53%0.03136%0.356CS..Hα-helixtrans-60-42.3176.1-70169.9000110.1I114 E117 Q118 T123 D124 N125 Y131 R132I114-I128 HydrophobicContact CG1-CG2 4.43Å; I114-I128 HydrophobicContact CG2-CG2 4.07Å; E117-I128 HydrophobicContact CB-CD1 4.33Å; E117-I128 HydrophobicContact CB-CG1 4.03Å; E117-I128 HydrophobicContact CG-CD1 4.13Å; E117-I128 HydrophobicContact CG-CG1 3.84Å; Q118-I128 HydrophobicContact CG-CD1 3.58Å; T123-I128 HydrophobicContact CG2-CD1 3.4Å; D124-I128 PolarHBondContact O-N 2.91Å; N125-I128 PolarHBondContact O-N 3.11Å; I128-Y131 PolarHBondContact O-N 2.98Å; I128-R132 WeakPolarHBondContact O-CG 3.29Å; I128-R132 PolarHBondContact O-N 3.05Å
129E92.7Very high91.5Very high83 Ų8372.9 Ų72.939%0.38836%0.355SS..Hα-helixtrans-64.9-40.6176.6-175.958.1-159.700112.1N125 D126 K127 Y131 R132 K133N125-E129 WeakPolarHBondContact O-CB 3.49Å; N125-E129 PolarHBondContact O-N 3.23Å; D126-E129 PolarHBondContact O-N 2.66Å; K127-E129 VanDerWaalsContact C-N 3.26Å; K127-E129 PolarHBondContact O-N 3.04Å; E129-Y131 PolarHBondContact O-N 3.43Å; E129-R132 PolarHBondContact O-N 2.63Å; E129-K133 WeakPolarHBondContact O-CG 3.47Å; E129-K133 PolarHBondContact O-N 3.28Å; E129-K133 VanDerWaalsContact OE1-CE 3.27Å; E129-K133 WeakPolarHBondContact OE1-CE 3.27Å
130E89.8Confident91.2Very high51 Ų5175.5 Ų75.524%0.23836%0.363CS..Hα-helixtrans-59.7-44.7173-171.3-176.4172.300111.8I38 D126 K127 R132 K133 Q134I38-E130 HydrophobicContact CG2-CG 4.28Å; I38-E130 WeakPolarHBondContact CG2-OE1 3.33Å; D126-E130 PolarHBondContact O-N 3.47Å; K127-E130 WeakPolarHBondContact O-CB 3.31Å; K127-E130 PolarHBondContact O-N 3.26Å; E130-R132 VanDerWaalsContact C-N 3.35Å; E130-R132 PolarHBondContact O-N 3.36Å; E130-K133 PolarHBondContact O-N 2.84Å; E130-Q134 PolarHBondContact O-N 3.29Å; E130-Q134 VanDerWaalsContact O-N 3.09Å
131Y92.5Very high90.9Very high5 Ų574.9 Ų74.92%0.0236%0.361CS..Hα-helixtrans-64.2-39.6177.6-58.1-20.7000111.9L110 M113 I114 K127 I128 E129 Q134 I135L110-Y131 HydrophobicContact CD2-CD1 4.09Å; L110-Y131 HydrophobicContact CD2-CG 4.25Å; M113-Y131 HydrophobicContact CB-CD2 3.89Å; M113-Y131 HydrophobicContact CB-CE2 3.76Å; M113-Y131 HydrophobicContact CE-CD1 3.85Å; M113-Y131 HydrophobicContact CE-CD2 4.28Å; M113-Y131 HydrophobicContact CE-CE1 3.32Å; M113-Y131 HydrophobicContact CE-CE2 3.78Å; M113-Y131 HydrophobicContact CE-CG 4.33Å; I114-Y131 HydrophobicContact CG1-CD2 3.92Å; I114-Y131 HydrophobicContact CG1-CG 4.33Å; K127-Y131 HydrophobicContact CB-CE2 4.24Å; K127-Y131 WeakPolarHBondContact O-CD1 3.39Å; K127-Y131 WeakPolarHBondContact O-CD2 3.4Å; K127-Y131 PolarHBondContact O-N 3.3Å; I128-Y131 PolarHBondContact O-N 2.98Å; E129-Y131 PolarHBondContact O-N 3.43Å; Y131-Q134 PolarHBondContact O-N 2.91Å; Y131-I135 WeakPolarHBondContact O-CG1 3.46Å; Y131-I135 PolarHBondContact O-N 3.01Å
132R93.9Very high90.9Very high129 Ų12967.5 Ų67.549%0.48733%0.33SS..Hα-helixtrans-64.8-45.2176.3-75.8175.2174.5175.5-1.8112.6I114 I128 E129 E130 Q134 I135 E136I114-R132 HydrophobicContact CD1-CG 3.9Å; I128-R132 WeakPolarHBondContact O-CG 3.29Å; I128-R132 PolarHBondContact O-N 3.05Å; E129-R132 PolarHBondContact O-N 2.63Å; E130-R132 VanDerWaalsContact C-N 3.35Å; E130-R132 PolarHBondContact O-N 3.36Å; R132-Q134 PolarHBondContact O-N 3.27Å; R132-I135 WeakPolarHBondContact O-CB 3.21Å; R132-I135 PolarHBondContact O-N 2.82Å; R132-I135 VanDerWaalsContact O-N 3.11Å; R132-E136 PolarHBondContact O-N 3.37Å
133K91Very high90.8Very high118 Ų11863.9 Ų63.951%0.51332%0.316SS..Hα-helixtrans-58.4-35.3174.3-75.2177.6-179.8173.80111.9E129 E130 E136 A137E129-K133 WeakPolarHBondContact O-CG 3.47Å; E129-K133 PolarHBondContact O-N 3.28Å; E129-K133 VanDerWaalsContact OE1-CE 3.27Å; E129-K133 WeakPolarHBondContact OE1-CE 3.27Å; E130-K133 PolarHBondContact O-N 2.84Å; K133-E136 PolarHBondContact O-N 3.35Å; K133-A137 WeakPolarHBondContact O-CB 3.22Å; K133-A137 PolarHBondContact O-N 2.88Å
134Q87.4Confident90.5Very high4 Ų463.8 Ų63.82%0.01931%0.311CS..Hα-helixtrans-71.2-39.1175.7-172.9140.157.700113.3I38 L110 E130 Y131 R132 E136 A137 N138I38-Q134 HydrophobicContact CD1-CB 4.25Å; L110-Q134 HydrophobicContact CD1-CB 4.01Å; L110-Q134 HydrophobicContact CD1-CG 3.69Å; L110-Q134 HydrophobicContact CD2-CB 4.43Å; E130-Q134 PolarHBondContact O-N 3.29Å; E130-Q134 VanDerWaalsContact O-N 3.09Å; Y131-Q134 PolarHBondContact O-N 2.91Å; R132-Q134 PolarHBondContact O-N 3.27Å; Q134-E136 VanDerWaalsContact C-N 3.29Å; Q134-E136 PolarHBondContact O-N 3.11Å; Q134-A137 PolarHBondContact O-N 2.97Å; Q134-N138 WeakPolarHBondContact O-CB 3.29Å; Q134-N138 VanDerWaalsContact O-CG 3.27Å; Q134-N138 PolarHBondContact O-N 2.8Å
135I92.8Very high90.2Very high19 Ų1961.3 Ų61.310%0.09730%0.298CS..Hα-helixtrans-59.6-43.1172.2-68.5167.7000110.2L110 E111 I114 Y131 R132 N138 N139L110-I135 HydrophobicContact CB-CD1 3.81Å; L110-I135 HydrophobicContact CB-CG1 3.7Å; L110-I135 HydrophobicContact CD1-CG1 3.8Å; L110-I135 HydrophobicContact CG-CG1 4.37Å; E111-I135 HydrophobicContact CG-CD1 3.99Å; I114-I135 HydrophobicContact CD1-CD1 3.81Å; Y131-I135 WeakPolarHBondContact O-CG1 3.46Å; Y131-I135 PolarHBondContact O-N 3.01Å; R132-I135 WeakPolarHBondContact O-CB 3.21Å; R132-I135 PolarHBondContact O-N 2.82Å; R132-I135 VanDerWaalsContact O-N 3.11Å; I135-N138 PolarHBondContact O-N 3.49Å; I135-N139 WeakPolarHBondContact O-CB 3.3Å; I135-N139 PolarHBondContact O-N 2.96Å; I135-N139 PolarHBondContact O-ND2 3.38Å
136E91.5Very high89.8Confident142 Ų14259.9 Ų59.966%0.66429%0.287SS*.Hα-helixtrans-61.6-46.6176.1-172.9-179.1-179.100112R132 K133 Q134 N138 N139 K140R132-E136 PolarHBondContact O-N 3.37Å; K133-E136 PolarHBondContact O-N 3.35Å; Q134-E136 VanDerWaalsContact C-N 3.29Å; Q134-E136 PolarHBondContact O-N 3.11Å; E136-N138 PolarHBondContact O-N 2.83Å; E136-N139 PolarHBondContact O-N 3.3Å; E136-K140 PolarHBondContact O-N 3.2Å
137A89.3Confident89.4Confident53 Ų5355.5 Ų55.544%0.43826%0.263SS..Hα-helixtrans-61.3-42.7176.300000112.3K133 Q134 K140 A141K133-A137 WeakPolarHBondContact O-CB 3.22Å; K133-A137 PolarHBondContact O-N 2.88Å; Q134-A137 PolarHBondContact O-N 2.97Å; A137-K140 PolarHBondContact O-N 3.3Å; A137-A141 WeakPolarHBondContact O-CB 3.46Å; A137-A141 PolarHBondContact O-N 3.21Å
138N90Very high88.8Confident1 Ų153.9 Ų53.91%0.00526%0.258CS..Hα-helixtrans-64.1-41.1175.3-74.4-6.4000111.6L103 N107 Q134 I135 E136 A141 I142L103-N138 HydrophobicContact CD2-CB 4.04Å; N107-N138 WeakPolarHBondContact OD1-CB 3.11Å; N107-N138 PolarHBondContact OD1-ND2 2.95Å; Q134-N138 WeakPolarHBondContact O-CB 3.29Å; Q134-N138 VanDerWaalsContact O-CG 3.27Å; Q134-N138 PolarHBondContact O-N 2.8Å; I135-N138 PolarHBondContact O-N 3.49Å; E136-N138 PolarHBondContact O-N 2.83Å; N138-A141 PolarHBondContact O-N 3.1Å; N138-I142 VanDerWaalsContact O-CG1 3.3Å; N138-I142 WeakPolarHBondContact O-CG1 3.3Å; N138-I142 PolarHBondContact O-N 3.08Å
139N93.1Very high88.2Confident81 Ų8154.9 Ų54.943%0.43326%0.263SS..Hα-helixtrans-63.8-41176.9-72.4-20.5000111.7N107 I135 E136 I142 E143N107-N139 PolarHBondContact ND2-OD1 3.4Å; I135-N139 WeakPolarHBondContact O-CB 3.3Å; I135-N139 PolarHBondContact O-N 2.96Å; I135-N139 PolarHBondContact O-ND2 3.38Å; E136-N139 PolarHBondContact O-N 3.3Å; N139-I142 PolarHBondContact O-N 3.2Å; N139-E143 PolarHBondContact O-N 3.17Å
140K89.1Confident87.6Confident128 Ų12853.6 Ų53.656%0.55726%0.261SS*.Hα-helixtrans-63.3-42.3173.3-176.3176.9173.8-177.90111.8E136 A137 I142 E143 E144E136-K140 PolarHBondContact O-N 3.2Å; A137-K140 PolarHBondContact O-N 3.3Å; K140-I142 VanDerWaalsContact C-N 3.35Å; K140-I142 PolarHBondContact O-N 2.94Å; K140-E143 PolarHBondContact O-N 2.91Å; K140-E144 WeakPolarHBondContact CE-OE1 3.47Å; K140-E144 IonicContact NZ-OE1 3.43Å; K140-E144 WeakPolarHBondContact O-CG 3.37Å; K140-E144 PolarHBondContact O-N 2.93Å
141A85.9Confident86.9Confident6 Ų654.4 Ų54.45%0.0527%0.265CS..Hα-helixtrans-65.3-36.1176.100000112.7L103 A137 N138 A145L103-A141 HydrophobicContact CD1-CB 3.81Å; A137-A141 WeakPolarHBondContact O-CB 3.46Å; A137-A141 PolarHBondContact O-N 3.21Å; N138-A141 PolarHBondContact O-N 3.1Å; A141-A145 VanDerWaalsContact O-CB 3.24Å; A141-A145 WeakPolarHBondContact O-CB 3.34Å; A141-A145 PolarHBondContact O-N 3.44Å
142I88.5Confident85.9Confident14 Ų1455.4 Ų55.47%0.07227%0.269CS..Hα-helixtrans-61.2-50.5171-70.9164.7000110V100 L103 K104 N138 N139 K140 E144 A145 E146V100-I142 HydrophobicContact CG1-CG2 4Å; V100-I142 HydrophobicContact CG2-CG2 4.25Å; L103-I142 HydrophobicContact CB-CD1 3.74Å; L103-I142 HydrophobicContact CB-CG1 3.61Å; L103-I142 HydrophobicContact CD1-CG1 3.61Å; L103-I142 HydrophobicContact CG-CG1 4.25Å; K104-I142 HydrophobicContact CG-CD1 3.89Å; N138-I142 VanDerWaalsContact O-CG1 3.3Å; N138-I142 WeakPolarHBondContact O-CG1 3.3Å; N138-I142 PolarHBondContact O-N 3.08Å; N139-I142 PolarHBondContact O-N 3.2Å; K140-I142 VanDerWaalsContact C-N 3.35Å; K140-I142 PolarHBondContact O-N 2.94Å; I142-E144 PolarHBondContact O-N 2.89Å; I142-A145 PolarHBondContact O-N 3.11Å; I142-E146 HydrophobicContact CG2-CG 4.39Å; I142-E146 WeakPolarHBondContact O-CG 3.43Å; I142-E146 PolarHBondContact O-N 3.35Å
143E87.4Confident84.9Confident94 Ų9452.1 Ų52.144%0.43926%0.261SS..Hα-helixtrans-58.2-49179.1-178-179.5179.500110.8N139 K140 A145 E146 Q147N139-E143 PolarHBondContact O-N 3.17Å; K140-E143 PolarHBondContact O-N 2.91Å; E143-A145 VanDerWaalsContact C-N 3.32Å; E143-A145 PolarHBondContact O-N 2.92Å; E143-E146 PolarHBondContact O-N 3.26Å; E143-Q147 HydrophobicContact CG-CG 4.25Å; E143-Q147 VanDerWaalsContact CG-NE2 3.35Å; E143-Q147 WeakPolarHBondContact O-CB 3.43Å; E143-Q147 WeakPolarHBondContact O-CG 3.41Å; E143-Q147 PolarHBondContact O-N 3Å; E143-Q147 PolarHBondContact OE1-NE2 3.48Å
144E85.3Confident83.9Confident56 Ų5647.4 Ų47.426%0.26225%0.246SC..Hα-helixtrans-61.5-38.5177.7-71176.2179.300112.3V31 K140 I142 S148V31-E144 HydrophobicContact CG1-CB 3.64Å; V31-E144 WeakPolarHBondContact CG1-OE2 3.26Å; V31-E144 HydrophobicContact CG2-CB 4.3Å; V31-E144 VanDerWaalsContact CG2-O 3.29Å; V31-E144 WeakPolarHBondContact CG2-O 3.48Å; K140-E144 WeakPolarHBondContact CE-OE1 3.47Å; K140-E144 IonicContact NZ-OE1 3.43Å; K140-E144 WeakPolarHBondContact O-CG 3.37Å; K140-E144 PolarHBondContact O-N 2.93Å; I142-E144 PolarHBondContact O-N 2.89Å; E144-S148 WeakPolarHBondContact O-CB 3.44Å; E144-S148 PolarHBondContact O-N 3.43Å
145A83.8Confident83.1Confident0 Ų048.3 Ų48.30%026%0.256CS..Hα-helixtrans-63.3-47.6175.100000112N96 V100 A141 I142 E143 S148 L149N96-A145 PolarHBondContact ND2-O 3Å; V100-A145 HydrophobicContact CG2-CB 4.34Å; A141-A145 VanDerWaalsContact O-CB 3.24Å; A141-A145 WeakPolarHBondContact O-CB 3.34Å; A141-A145 PolarHBondContact O-N 3.44Å; I142-A145 PolarHBondContact O-N 3.11Å; E143-A145 VanDerWaalsContact C-N 3.32Å; E143-A145 PolarHBondContact O-N 2.92Å; A145-S148 PolarHBondContact O-N 2.81Å; A145-L149 WeakPolarHBondContact O-CB 3.41Å; A145-L149 PolarHBondContact O-N 2.91Å
146E85.8Confident82.3Confident85 Ų8549.7 Ų49.740%0.39726%0.262SS..Hα-helixtrans-66.4-39.7178.7-69.6175.4173.200111.4V100 I142 E143 T150V100-E146 HydrophobicContact CG2-CG 4.09Å; I142-E146 HydrophobicContact CG2-CG 4.39Å; I142-E146 WeakPolarHBondContact O-CG 3.43Å; I142-E146 PolarHBondContact O-N 3.35Å; E143-E146 PolarHBondContact O-N 3.26Å; E146-T150 WeakPolarHBondContact O-CB 3.19Å; E146-T150 PolarHBondContact O-N 3.33Å; E146-T150 PolarHBondContact O-OG1 3.47Å
147Q83.9Confident81.4Confident42 Ų4243.6 Ų43.620%0.19624%0.237CC..Hα-helixtrans-65.2-46175.9-70.3179.2-9.200111.7E143 T150 E151 G157 T158E143-Q147 HydrophobicContact CG-CG 4.25Å; E143-Q147 VanDerWaalsContact CG-NE2 3.35Å; E143-Q147 WeakPolarHBondContact O-CB 3.43Å; E143-Q147 WeakPolarHBondContact O-CG 3.41Å; E143-Q147 PolarHBondContact O-N 3Å; E143-Q147 PolarHBondContact OE1-NE2 3.48Å; Q147-T150 WeakPolarHBondContact O-CB 3.36Å; Q147-T150 PolarHBondContact O-N 3.42Å; Q147-E151 PolarHBondContact O-N 3.4Å; Q147-G157 VanDerWaalsContact CG-O 3.26Å; Q147-G157 WeakPolarHBondContact CG-O 3.31Å; Q147-T158 HydrophobicContact CB-CG2 4.19Å
148S78.7Confident80.9Confident15 Ų1542.6 Ų42.611%0.10523%0.225CC..Hα-helixtrans-64.8-42.4178.3-173.40000111.8E144 A145 T150 E151 Q152E144-S148 WeakPolarHBondContact O-CB 3.44Å; E144-S148 PolarHBondContact O-N 3.43Å; A145-S148 PolarHBondContact O-N 2.81Å; S148-T150 VanDerWaalsContact C-N 3.31Å; S148-T150 PolarHBondContact O-N 3.31Å; S148-E151 PolarHBondContact O-N 3.28Å; S148-Q152 WeakPolarHBondContact O-CB 3.39Å; S148-Q152 VanDerWaalsContact O-CG 3.24Å; S148-Q152 WeakPolarHBondContact O-CG 3.35Å; S148-Q152 PolarHBondContact O-N 3.13Å; S148-Q152 PolarHBondContact OG-NE2 3.1Å; S148-Q152 VanDerWaalsContact OG-NE2 3.13Å
149L80.2Confident80.5Confident26 Ų2650.7 Ų50.714%0.13626%0.26CS..Hα-helixtrans-59.7-45.1172.4177.766.3000110.7L92 A93 N96 A145 E151 Q152 L153L92-L149 HydrophobicContact CD2-CD1 3.84Å; L92-L149 HydrophobicContact CG-CD1 3.92Å; A93-L149 HydrophobicContact CB-CD1 4.16Å; A93-L149 HydrophobicContact CB-CD2 4.46Å; N96-L149 HydrophobicContact CB-CB 4.36Å; N96-L149 HydrophobicContact CB-CD1 4.35Å; N96-L149 HydrophobicContact CB-CD2 3.88Å; N96-L149 HydrophobicContact CB-CG 4.42Å; A145-L149 WeakPolarHBondContact O-CB 3.41Å; A145-L149 PolarHBondContact O-N 2.91Å; L149-E151 VanDerWaalsContact C-N 3.33Å; L149-E151 PolarHBondContact O-N 2.67Å; L149-Q152 PolarHBondContact O-N 2.85Å; L149-L153 HydrophobicContact CD1-CD1 3.95Å; L149-L153 HydrophobicContact CD1-CG 3.96Å; L149-L153 HydrophobicContact CD2-CD1 4.29Å; L149-L153 HydrophobicContact CG-CD1 3.8Å; L149-L153 HydrophobicContact CG-CG 4.17Å; L149-L153 VanDerWaalsContact O-CB 3.31Å; L149-L153 WeakPolarHBondContact O-CB 3.34Å; L149-L153 VanDerWaalsContact O-CG 3.23Å; L149-L153 WeakPolarHBondContact O-CG 3.03Å; L149-L153 PolarHBondContact O-N 3.07Å
150T79.1Confident79.8Confident57 Ų5749.7 Ų49.735%0.3526%0.263SS..Hα-helixtrans-58.7-45.5178.2-59.60000111.1E146 Q147 S148 L153 G154 G155E146-T150 WeakPolarHBondContact O-CB 3.19Å; E146-T150 PolarHBondContact O-N 3.33Å; E146-T150 PolarHBondContact O-OG1 3.47Å; Q147-T150 WeakPolarHBondContact O-CB 3.36Å; Q147-T150 PolarHBondContact O-N 3.42Å; S148-T150 VanDerWaalsContact C-N 3.31Å; S148-T150 PolarHBondContact O-N 3.31Å; T150-L153 CarbonylContact O-C 3.59Å; T150-L153 PolarHBondContact O-N 2.85Å; T150-G154 PolarHBondContact O-N 3.33Å; T150-G154 VanDerWaalsContact O-N 3.12Å; T150-G155 WeakPolarHBondContact O-CA 3.5Å; T150-G155 PolarHBondContact O-N 3.03Å
151E75.5Confident79.3Confident68 Ų6846.3 Ų46.332%0.31825%0.252SS..Hα-helixtrans-61.1-42.4175.8-76.3173-171.600113Q147 S148 L149 G154 G155 F156 T158 N161Q147-E151 PolarHBondContact O-N 3.4Å; S148-E151 PolarHBondContact O-N 3.28Å; L149-E151 VanDerWaalsContact C-N 3.33Å; L149-E151 PolarHBondContact O-N 2.67Å; E151-G154 WeakPolarHBondContact O-CA 3.41Å; E151-G154 PolarHBondContact O-N 3.12Å; E151-G155 WeakPolarHBondContact CA-O 3.29Å; E151-F156 VanDerWaalsContact CG-O 3.27Å; E151-F156 WeakPolarHBondContact CG-O 3.35Å; E151-T158 WeakPolarHBondContact OE1-CB 2.81Å; E151-T158 WeakPolarHBondContact OE1-CG2 3.1Å; E151-T158 PolarHBondContact OE1-N 3.32Å; E151-T158 PolarHBondContact OE1-OG1 2.91Å; E151-N161 VanDerWaalsContact CD-ND2 3.25Å; E151-N161 PolarHBondContact OE1-ND2 3.44Å
152Q71.8Confident79Confident26 Ų2652.2 Ų52.212%0.12127%0.273CS..Hα-helixtrans-72.9-31.5179.3-67.9177.833.300112.5F28 S29 L92 S148 L149 G154F28-Q152 HydrophobicContact CD1-CB 4.09Å; F28-Q152 HydrophobicContact CD1-CG 4.07Å; F28-Q152 HydrophobicContact CE1-CB 4.44Å; S29-Q152 PolarHBondContact O-NE2 3.03Å; L92-Q152 HydrophobicContact CD2-CB 3.76Å; L92-Q152 HydrophobicContact CD2-CG 4.49Å; S148-Q152 WeakPolarHBondContact O-CB 3.39Å; S148-Q152 VanDerWaalsContact O-CG 3.24Å; S148-Q152 WeakPolarHBondContact O-CG 3.35Å; S148-Q152 PolarHBondContact O-N 3.13Å; S148-Q152 PolarHBondContact OG-NE2 3.1Å; S148-Q152 VanDerWaalsContact OG-NE2 3.13Å; L149-Q152 PolarHBondContact O-N 2.85Å; Q152-G154 PolarHBondContact O-N 3.45Å
153L72Confident78.7Confident59 Ų5957.8 Ų57.831%0.30930%0.297SS..THydrogen-bonded Turntrans-75.79.3164.4-63.9-179.4000112.2I89 L149 T150 G155 Q202I89-L153 HydrophobicContact CG2-CD2 3.21Å; L149-L153 HydrophobicContact CD1-CD1 3.95Å; L149-L153 HydrophobicContact CD1-CG 3.96Å; L149-L153 HydrophobicContact CD2-CD1 4.29Å; L149-L153 HydrophobicContact CG-CD1 3.8Å; L149-L153 HydrophobicContact CG-CG 4.17Å; L149-L153 VanDerWaalsContact O-CB 3.31Å; L149-L153 WeakPolarHBondContact O-CB 3.34Å; L149-L153 VanDerWaalsContact O-CG 3.23Å; L149-L153 WeakPolarHBondContact O-CG 3.03Å; L149-L153 PolarHBondContact O-N 3.07Å; T150-L153 CarbonylContact O-C 3.59Å; T150-L153 PolarHBondContact O-N 2.85Å; L153-G155 VanDerWaalsContact C-N 3.32Å; L153-G155 PolarHBondContact O-N 2.94Å; L153-Q202 PolarHBondContact O-NE2 2.84Å; L153-Q202 PolarHBondContact O-OE1 3.2Å
154G69.9Low78.5Confident19 Ų1956 Ų5620%0.19630%0.295CS..THydrogen-bonded Turntrans77.5-3.317400000116.1T150 E151 Q152 M198 Q202T150-G154 PolarHBondContact O-N 3.33Å; T150-G154 VanDerWaalsContact O-N 3.12Å; E151-G154 WeakPolarHBondContact O-CA 3.41Å; E151-G154 PolarHBondContact O-N 3.12Å; Q152-G154 PolarHBondContact O-N 3.45Å; G154-M198 VanDerWaalsContact C-CE 3.44Å; G154-M198 WeakPolarHBondContact O-CE 3.46Å; G154-M198 WeakPolarHBondContact O-CG 3.5Å; G154-Q202 VanDerWaalsContact CA-NE2 3.34Å
155G71.7Confident78.3Confident23 Ų2353.6 Ų53.624%0.23729%0.285CS..SBendtrans-64.1173.2169.800000112.4T150 E151 L153 G157T150-G155 WeakPolarHBondContact O-CA 3.5Å; T150-G155 PolarHBondContact O-N 3.03Å; E151-G155 WeakPolarHBondContact CA-O 3.29Å; L153-G155 VanDerWaalsContact C-N 3.32Å; L153-G155 PolarHBondContact O-N 2.94Å; G155-G157 PolarHBondContact O-N 3.3Å
156F76.4Confident78.3Confident49 Ų4956.4 Ų56.422%0.21531%0.308CS..  trans-69.2-35.1179.6-63.6-82.3000112.6E151 T158 N161 Y162 A165 Y194E151-F156 VanDerWaalsContact CG-O 3.27Å; E151-F156 WeakPolarHBondContact CG-O 3.35Å; F156-T158 PolarHBondContact O-N 3.01Å; F156-N161 HydrophobicContact CB-CB 4.2Å; F156-N161 HydrophobicContact CD1-CB 4.46Å; F156-N161 WeakPolarHBondContact O-CB 3.37Å; F156-N161 PolarHBondContact O-ND2 3.14Å; F156-Y162 HydrophobicContact CB-CD1 3.9Å; F156-Y162 HydrophobicContact CB-CD2 3.81Å; F156-Y162 HydrophobicContact CB-CE1 3.7Å; F156-Y162 HydrophobicContact CB-CE2 3.58Å; F156-Y162 HydrophobicContact CB-CG 3.95Å; F156-Y162 HydrophobicContact CD1-CD1 4.41Å; F156-Y162 AromaticContact CD2-CD1 3.84Å; F156-Y162 HydrophobicContact CD2-CD1 3.84Å; F156-Y162 AromaticContact CD2-CE1 3.38Å; F156-Y162 HydrophobicContact CD2-CE1 3.38Å; F156-Y162 AromaticContact CD2-CZ 3.9Å; F156-Y162 HydrophobicContact CE2-CE1 4.19Å; F156-Y162 AromaticContact CG-CD1 3.79Å; F156-Y162 HydrophobicContact CG-CD1 3.79Å; F156-Y162 AromaticContact CG-CE1 3.68Å; F156-Y162 HydrophobicContact CG-CE1 3.68Å; F156-Y162 HydrophobicContact CG-CE2 4.46Å; F156-Y162 HydrophobicContact CG-CG 4.24Å; F156-A165 HydrophobicContact CD1-CB 4.13Å; F156-A165 HydrophobicContact CE1-CB 3.46Å; F156-A165 VanDerWaalsContact CE1-CB 3.46Å; F156-A165 HydrophobicContact CZ-CB 4.3Å; F156-Y194 HydrophobicContact CD1-CE1 4.39Å; F156-Y194 WeakPolarHBondContact CD1-OH 3.47Å; F156-Y194 HydrophobicContact CE1-CD1 4.49Å; F156-Y194 AromaticContact CE1-CE1 3.41Å; F156-Y194 HydrophobicContact CE1-CE1 3.41Å; F156-Y194 VanDerWaalsContact CE1-CE1 3.41Å; F156-Y194 AromaticContact CE1-CZ 3.5Å; F156-Y194 VanDerWaalsContact CE1-CZ 3.5Å; F156-Y194 WeakPolarHBondContact CE1-OH 3.48Å; F156-Y194 HydrophobicContact CZ-CD1 4.37Å; F156-Y194 AromaticContact CZ-CE1 3.58Å; F156-Y194 HydrophobicContact CZ-CE1 3.58Å
157G72.6Confident78.4Confident13 Ų1357.5 Ų57.513%0.13431%0.313CS..  trans62.2-59.4179.500000115.5Q147 G155Q147-G157 VanDerWaalsContact CG-O 3.26Å; Q147-G157 WeakPolarHBondContact CG-O 3.31Å; G155-G157 PolarHBondContact O-N 3.3Å
158T78.3Confident78.6Confident32 Ų3259.4 Ų59.420%0.19632%0.322CS..SBendtrans-99.4149.8-178.9550000113.5Q147 E151 F156 A160 N161 Y162Q147-T158 HydrophobicContact CB-CG2 4.19Å; E151-T158 WeakPolarHBondContact OE1-CB 2.81Å; E151-T158 WeakPolarHBondContact OE1-CG2 3.1Å; E151-T158 PolarHBondContact OE1-N 3.32Å; E151-T158 PolarHBondContact OE1-OG1 2.91Å; F156-T158 PolarHBondContact O-N 3.01Å; T158-A160 PolarHBondContact O-N 3.44Å; T158-N161 PolarHBondContact O-N 2.91Å; T158-N161 VanDerWaalsContact O-N 3.1Å; T158-N161 PolarHBondContact OG1-N 3.05Å; T158-N161 PolarHBondContact OG1-ND2 3.14Å; T158-Y162 WeakPolarHBondContact O-CD2 3.34Å; T158-Y162 PolarHBondContact O-N 2.94Å; T158-Y162 VanDerWaalsContact O-N 3.15Å
159K80.7Confident79.1Confident171 Ų17161.1 Ų61.174%0.74333%0.328SS*.Hα-helixtrans-56.1-30.6170.5-68.3179.1-1771690112.8K163K159-K163 WeakPolarHBondContact O-CB 3.36Å; K159-K163 PolarHBondContact O-N 3.32Å
160A79.8Confident79.6Confident60 Ų6062.5 Ų62.550%0.49634%0.342SS..Hα-helixtrans-63.1-48.2175.700000111T158 Y162 K163 S164T158-A160 PolarHBondContact O-N 3.44Å; A160-Y162 PolarHBondContact O-N 3.27Å; A160-K163 WeakPolarHBondContact O-CB 3.43Å; A160-K163 PolarHBondContact O-N 3.26Å; A160-K163 VanDerWaalsContact O-N 3.11Å; A160-S164 PolarHBondContact O-N 3Å; A160-S164 PolarHBondContact O-OG 2.95Å
161N77.4Confident80.1Confident58 Ų5866.1 Ų66.131%0.3135%0.353SS..Hα-helixtrans-64.1-39.9177.7-69.6-11.4000112.4E151 F156 T158 K163 S164 A165E151-N161 VanDerWaalsContact CD-ND2 3.25Å; E151-N161 PolarHBondContact OE1-ND2 3.44Å; F156-N161 HydrophobicContact CB-CB 4.2Å; F156-N161 HydrophobicContact CD1-CB 4.46Å; F156-N161 WeakPolarHBondContact O-CB 3.37Å; F156-N161 PolarHBondContact O-ND2 3.14Å; T158-N161 PolarHBondContact O-N 2.91Å; T158-N161 VanDerWaalsContact O-N 3.1Å; T158-N161 PolarHBondContact OG1-N 3.05Å; T158-N161 PolarHBondContact OG1-ND2 3.14Å; N161-K163 VanDerWaalsContact C-N 3.32Å; N161-K163 PolarHBondContact O-N 3.37Å; N161-S164 PolarHBondContact O-N 3.17Å; N161-A165 WeakPolarHBondContact O-CB 3.38Å; N161-A165 PolarHBondContact O-N 2.95Å
162Y80.1Confident80.8Confident129 Ų12964.3 Ų64.351%0.50635%0.347SS..Hα-helixtrans-58.8-43.7171.4-76-75.5000112F156 T158 A160 A166F156-Y162 HydrophobicContact CB-CD1 3.9Å; F156-Y162 HydrophobicContact CB-CD2 3.81Å; F156-Y162 HydrophobicContact CB-CE1 3.7Å; F156-Y162 HydrophobicContact CB-CE2 3.58Å; F156-Y162 HydrophobicContact CB-CG 3.95Å; F156-Y162 HydrophobicContact CD1-CD1 4.41Å; F156-Y162 AromaticContact CD2-CD1 3.84Å; F156-Y162 HydrophobicContact CD2-CD1 3.84Å; F156-Y162 AromaticContact CD2-CE1 3.38Å; F156-Y162 HydrophobicContact CD2-CE1 3.38Å; F156-Y162 AromaticContact CD2-CZ 3.9Å; F156-Y162 HydrophobicContact CE2-CE1 4.19Å; F156-Y162 AromaticContact CG-CD1 3.79Å; F156-Y162 HydrophobicContact CG-CD1 3.79Å; F156-Y162 AromaticContact CG-CE1 3.68Å; F156-Y162 HydrophobicContact CG-CE1 3.68Å; F156-Y162 HydrophobicContact CG-CE2 4.46Å; F156-Y162 HydrophobicContact CG-CG 4.24Å; T158-Y162 WeakPolarHBondContact O-CD2 3.34Å; T158-Y162 PolarHBondContact O-N 2.94Å; T158-Y162 VanDerWaalsContact O-N 3.15Å; A160-Y162 PolarHBondContact O-N 3.27Å; Y162-A166 WeakPolarHBondContact O-CB 3.1Å; Y162-A166 PolarHBondContact O-N 3.26Å
163K83.5Confident81.8Confident132 Ų13268.7 Ų68.757%0.57436%0.362SS*.Hα-helixtrans-64.5-47178.6-176.1-176.5172.9-163.90111.2K159 A160 N161 A165 A166 E167K159-K163 WeakPolarHBondContact O-CB 3.36Å; K159-K163 PolarHBondContact O-N 3.32Å; A160-K163 WeakPolarHBondContact O-CB 3.43Å; A160-K163 PolarHBondContact O-N 3.26Å; A160-K163 VanDerWaalsContact O-N 3.11Å; N161-K163 VanDerWaalsContact C-N 3.32Å; N161-K163 PolarHBondContact O-N 3.37Å; K163-A165 VanDerWaalsContact C-N 3.35Å; K163-A165 PolarHBondContact O-N 3.47Å; K163-A166 PolarHBondContact O-N 2.96Å; K163-E167 WeakPolarHBondContact CE-OE1 3.43Å; K163-E167 IonicContact NZ-OE1 3.95Å; K163-E167 WeakPolarHBondContact O-CG 3.27Å; K163-E167 PolarHBondContact O-N 3.15Å
164S82.3Confident82.7Confident56 Ų5668.9 Ų68.939%0.39237%0.366SS..Hα-helixtrans-60.9-43.4177.9-65.40000111.9A160 N161 A166 E167 E168A160-S164 PolarHBondContact O-N 3Å; A160-S164 PolarHBondContact O-OG 2.95Å; N161-S164 PolarHBondContact O-N 3.17Å; S164-A166 PolarHBondContact O-N 2.77Å; S164-E167 PolarHBondContact O-N 3.46Å; S164-E168 PolarHBondContact O-N 3.29Å
165A81.1Confident83.8Confident6 Ų671.1 Ų71.15%0.0537%0.373CS..Hα-helixtrans-61.3-45.6174.500000111.6F156 N161 K163 E167 E168 F169F156-A165 HydrophobicContact CD1-CB 4.13Å; F156-A165 HydrophobicContact CE1-CB 3.46Å; F156-A165 VanDerWaalsContact CE1-CB 3.46Å; F156-A165 HydrophobicContact CZ-CB 4.3Å; N161-A165 WeakPolarHBondContact O-CB 3.38Å; N161-A165 PolarHBondContact O-N 2.95Å; K163-A165 VanDerWaalsContact C-N 3.35Å; K163-A165 PolarHBondContact O-N 3.47Å; A165-E167 VanDerWaalsContact C-N 3.32Å; A165-E167 PolarHBondContact O-N 2.89Å; A165-E168 PolarHBondContact O-N 3.31Å; A165-F169 WeakPolarHBondContact O-CD2 3.46Å; A165-F169 PolarHBondContact O-N 3.37Å
166A83.5Confident84.6Confident59 Ų5970.2 Ų70.249%0.48836%0.364SS..Hα-helixtrans-60.6-40176.500000112.7Y162 K163 S164 A170Y162-A166 WeakPolarHBondContact O-CB 3.1Å; Y162-A166 PolarHBondContact O-N 3.26Å; K163-A166 PolarHBondContact O-N 2.96Å; S164-A166 PolarHBondContact O-N 2.77Å; A166-A170 VanDerWaalsContact O-CB 3.28Å; A166-A170 WeakPolarHBondContact O-CB 3.3Å; A166-A170 PolarHBondContact O-N 2.78Å
167E88.4Confident85.1Confident107 Ų10774.1 Ų74.150%0.538%0.381SS..Hα-helixtrans-63.7-39.6174.6-73.8174166.700111.8K163 S164 A165 K171K163-E167 WeakPolarHBondContact CE-OE1 3.43Å; K163-E167 IonicContact NZ-OE1 3.95Å; K163-E167 WeakPolarHBondContact O-CG 3.27Å; K163-E167 PolarHBondContact O-N 3.15Å; S164-E167 PolarHBondContact O-N 3.46Å; A165-E167 VanDerWaalsContact C-N 3.32Å; A165-E167 PolarHBondContact O-N 2.89Å; E167-K171 VanDerWaalsContact O-CB 3.29Å; E167-K171 WeakPolarHBondContact O-CB 3.38Å; E167-K171 PolarHBondContact O-N 3.43Å
168E87.5Confident86Confident82 Ų8279.1 Ų79.138%0.38340%0.404SS..Hα-helixtrans-65.2-47.7175-75.8-172.4-160.600112.6S164 A165 A170 K171 T172 K190S164-E168 PolarHBondContact O-N 3.29Å; A165-E168 PolarHBondContact O-N 3.31Å; E168-A170 VanDerWaalsContact C-N 3.34Å; E168-A170 PolarHBondContact O-N 3.36Å; E168-K171 PolarHBondContact O-N 3.36Å; E168-T172 PolarHBondContact O-N 2.86Å; E168-T172 PolarHBondContact O-OG1 2.82Å; E168-T172 VanDerWaalsContact O-OG1 3.11Å; E168-K190 WeakPolarHBondContact OE2-CE 3.33Å; E168-K190 IonicContact OE2-NZ 3.94Å; E168-K190 PolarHBondContact OE2-NZ 3.35Å
169F89.8Confident86.6Confident52 Ų5285 Ų8523%0.22843%0.43CS..Hα-helixtrans-62.7-41.6176.8-80.5-75.2000111.8A165 K171 T172 W173 L187 K190 F191A165-F169 WeakPolarHBondContact O-CD2 3.46Å; A165-F169 PolarHBondContact O-N 3.37Å; F169-K171 VanDerWaalsContact C-N 3.34Å; F169-K171 PolarHBondContact O-N 3.49Å; F169-T172 PolarHBondContact O-N 3.2Å; F169-W173 PolarHBondContact O-N 3.25Å; F169-L187 HydrophobicContact CB-CD2 4.18Å; F169-L187 HydrophobicContact CD1-CD2 3.78Å; F169-L187 HydrophobicContact CG-CD2 4.49Å; F169-L187 WeakPolarHBondContact O-CD2 3.14Å; F169-K190 HydrophobicContact CD1-CB 4.4Å; F169-K190 HydrophobicContact CD1-CG 4.08Å; F169-K190 HydrophobicContact CE1-CB 4.15Å; F169-K190 HydrophobicContact CE1-CG 3.95Å; F169-K190 HydrophobicContact CZ-CG 4.45Å; F169-F191 HydrophobicContact CE1-CB 4.05Å; F169-F191 HydrophobicContact CZ-CB 4.26Å; F169-F191 HydrophobicContact CZ-CD2 4.35Å
170A89.6Confident87Confident54 Ų5480.2 Ų80.245%0.44643%0.429SS..Hα-helixtrans-61.6-43.4175.400000111.4A166 E168 W173 V174A166-A170 VanDerWaalsContact O-CB 3.28Å; A166-A170 WeakPolarHBondContact O-CB 3.3Å; A166-A170 PolarHBondContact O-N 2.78Å; E168-A170 VanDerWaalsContact C-N 3.34Å; E168-A170 PolarHBondContact O-N 3.36Å; A170-W173 PolarHBondContact O-N 3.21Å; A170-V174 WeakPolarHBondContact O-CG2 3.49Å; A170-V174 PolarHBondContact O-N 3.17Å
171K91.1Very high87.2Confident133 Ų13380.1 Ų80.158%0.57842%0.424SS*.Hα-helixtrans-62.6-47.9175.8-178.7-179.7174.9-1710111.7E167 E168 F169 W173 V174 D175E167-K171 VanDerWaalsContact O-CB 3.29Å; E167-K171 WeakPolarHBondContact O-CB 3.38Å; E167-K171 PolarHBondContact O-N 3.43Å; E168-K171 PolarHBondContact O-N 3.36Å; F169-K171 VanDerWaalsContact C-N 3.34Å; F169-K171 PolarHBondContact O-N 3.49Å; K171-W173 VanDerWaalsContact C-N 3.26Å; K171-W173 PolarHBondContact O-N 3Å; K171-V174 PolarHBondContact O-N 3.34Å; K171-V174 VanDerWaalsContact O-N 3.1Å; K171-D175 WeakPolarHBondContact CE-OD2 3.37Å; K171-D175 WeakPolarHBondContact CG-OD2 3.4Å; K171-D175 WeakPolarHBondContact O-CB 3.47Å; K171-D175 VanDerWaalsContact O-CG 3.29Å; K171-D175 PolarHBondContact O-N 3.42Å
172T88.7Confident87.8Confident30 Ų3081.8 Ų81.818%0.18443%0.434CS..Hα-helixtrans-55.6-42.4177-64.50000111.8E168 F169 A176 A186 K190E168-T172 PolarHBondContact O-N 2.86Å; E168-T172 PolarHBondContact O-OG1 2.82Å; E168-T172 VanDerWaalsContact O-OG1 3.11Å; F169-T172 PolarHBondContact O-N 3.2Å; T172-A176 WeakPolarHBondContact O-CB 3.33Å; T172-A176 PolarHBondContact O-N 2.81Å; T172-A186 HydrophobicContact CG2-CB 3.84Å; T172-A186 WeakPolarHBondContact CG2-O 3.39Å; T172-K190 HydrophobicContact CG2-CB 3.96Å; T172-K190 HydrophobicContact CG2-CG 4.42Å
173W92.6Very high88.2Confident118 Ų11876.3 Ų76.345%0.44742%0.415SS..Hα-helixtrans-64.1-45.6176.1-173.691.5000112.3F169 A170 K171 A176 F177 A183 L187F169-W173 PolarHBondContact O-N 3.25Å; A170-W173 PolarHBondContact O-N 3.21Å; K171-W173 VanDerWaalsContact C-N 3.26Å; K171-W173 PolarHBondContact O-N 3Å; W173-A176 PolarHBondContact O-N 2.93Å; W173-F177 HydrophobicContact CE3-CB 4.42Å; W173-F177 HydrophobicContact CH2-CB 4.29Å; W173-F177 HydrophobicContact CH2-CD2 4.08Å; W173-F177 HydrophobicContact CH2-CG 4.16Å; W173-F177 HydrophobicContact CZ2-CD2 4.48Å; W173-F177 HydrophobicContact CZ3-CB 4.13Å; W173-F177 HydrophobicContact CZ3-CG 4.28Å; W173-F177 WeakPolarHBondContact O-CB 3.35Å; W173-F177 PolarHBondContact O-N 3.07Å; W173-A183 VanDerWaalsContact CD1-CB 3.5Å; W173-A183 HydrophobicContact CG-CB 4.15Å; W173-L187 HydrophobicContact CB-CD1 4.49Å; W173-L187 HydrophobicContact CB-CD2 4.22Å; W173-L187 HydrophobicContact CB-CG 4.4Å; W173-L187 HydrophobicContact CG-CD1 4.48Å
174V92.4Very high88.5Confident64 Ų6475.3 Ų75.339%0.38842%0.415SS..Hα-helixtrans-64.3-42.7179.7169.70000111.3A170 K171 F177 N178A170-V174 WeakPolarHBondContact O-CG2 3.49Å; A170-V174 PolarHBondContact O-N 3.17Å; K171-V174 PolarHBondContact O-N 3.34Å; K171-V174 VanDerWaalsContact O-N 3.1Å; V174-F177 PolarHBondContact O-N 2.97Å; V174-N178 WeakPolarHBondContact CG1-ND2 3.5Å; V174-N178 WeakPolarHBondContact O-CB 3.32Å; V174-N178 VanDerWaalsContact O-CG 3.22Å; V174-N178 PolarHBondContact O-N 3.39Å; V174-N178 PolarHBondContact O-ND2 3.03Å; V174-N178 VanDerWaalsContact O-ND2 3.14Å
175D91.5Very high88.9Confident65 Ų6578.3 Ų78.335%0.34842%0.423SS..Hα-helixtrans-62-47.7178.1-69.9-15.5000110K171 F177 N178 E179K171-D175 WeakPolarHBondContact CE-OD2 3.37Å; K171-D175 WeakPolarHBondContact CG-OD2 3.4Å; K171-D175 WeakPolarHBondContact O-CB 3.47Å; K171-D175 VanDerWaalsContact O-CG 3.29Å; K171-D175 PolarHBondContact O-N 3.42Å; D175-F177 PolarHBondContact O-N 2.88Å; D175-N178 PolarHBondContact O-N 2.98Å; D175-E179 WeakPolarHBondContact O-CB 3.26Å; D175-E179 WeakPolarHBondContact O-CG 3.46Å; D175-E179 PolarHBondContact O-N 3.41Å
176A88.7Confident89.1Confident4 Ų479 Ų793%0.03343%0.429CS..Hα-helixtrans-61.2-43.7177.300000112.8T172 W173 N178 E179 G180 S181 A183 A186T172-A176 WeakPolarHBondContact O-CB 3.33Å; T172-A176 PolarHBondContact O-N 2.81Å; W173-A176 PolarHBondContact O-N 2.93Å; A176-N178 VanDerWaalsContact C-N 3.35Å; A176-N178 PolarHBondContact O-N 3.37Å; A176-E179 PolarHBondContact O-N 3.44Å; A176-G180 PolarHBondContact O-N 3.49Å; A176-S181 WeakPolarHBondContact CA-OG 3.25Å; A176-S181 WeakPolarHBondContact CB-OG 3.48Å; A176-S181 PolarHBondContact O-N 2.81Å; A176-S181 PolarHBondContact O-OG 3.09Å; A176-S181 VanDerWaalsContact O-OG 3.12Å; A176-A183 HydrophobicContact CB-CB 4.06Å; A176-A186 HydrophobicContact CB-CB 3.57Å
177F88.6Confident89.4Confident132 Ų13278.3 Ų78.358%0.57942%0.417SS*.Hα-helixtrans-60.1-43.9175.5179.8-95.3000112.2W173 V174 D175 G180W173-F177 HydrophobicContact CE3-CB 4.42Å; W173-F177 HydrophobicContact CH2-CB 4.29Å; W173-F177 HydrophobicContact CH2-CD2 4.08Å; W173-F177 HydrophobicContact CH2-CG 4.16Å; W173-F177 HydrophobicContact CZ2-CD2 4.48Å; W173-F177 HydrophobicContact CZ3-CB 4.13Å; W173-F177 HydrophobicContact CZ3-CG 4.28Å; W173-F177 WeakPolarHBondContact O-CB 3.35Å; W173-F177 PolarHBondContact O-N 3.07Å; V174-F177 PolarHBondContact O-N 2.97Å; D175-F177 PolarHBondContact O-N 2.88Å; F177-G180 PolarHBondContact O-N 2.63Å
178N91.3Very high89.3Confident117 Ų11777.3 Ų77.363%0.62642%0.415SS*.Hα-helixtrans-70-32.6179.7-72.2-30.7000112.9V174 D175 A176V174-N178 WeakPolarHBondContact CG1-ND2 3.5Å; V174-N178 WeakPolarHBondContact O-CB 3.32Å; V174-N178 VanDerWaalsContact O-CG 3.22Å; V174-N178 PolarHBondContact O-N 3.39Å; V174-N178 PolarHBondContact O-ND2 3.03Å; V174-N178 VanDerWaalsContact O-ND2 3.14Å; D175-N178 PolarHBondContact O-N 2.98Å; A176-N178 VanDerWaalsContact C-N 3.35Å; A176-N178 PolarHBondContact O-N 3.37Å
179E90.9Very high89.2Confident157 Ų15777.6 Ų77.673%0.73442%0.419SS*.Hα-helixtrans-78.6-8.7175.1-70.1176.7-179.100112.9D175 A176 S181D175-E179 WeakPolarHBondContact O-CB 3.26Å; D175-E179 WeakPolarHBondContact O-CG 3.46Å; D175-E179 PolarHBondContact O-N 3.41Å; A176-E179 PolarHBondContact O-N 3.44Å; E179-S181 VanDerWaalsContact C-N 3.25Å; E179-S181 PolarHBondContact O-N 3.48Å
180G88.6Confident89Confident70 Ų7076.8 Ų76.872%0.72242%0.415SS*.THydrogen-bonded Turntrans70.320.6-17500000113.5A176 F177A176-G180 PolarHBondContact O-N 3.49Å; F177-G180 PolarHBondContact O-N 2.63Å
181S84.6Confident88.7Confident57 Ų5779.3 Ų79.340%0.39942%0.417SS..SBendtrans-89.7167.3175.960.80000111.6A176 E179 A183A176-S181 WeakPolarHBondContact CA-OG 3.25Å; A176-S181 WeakPolarHBondContact CB-OG 3.48Å; A176-S181 PolarHBondContact O-N 2.81Å; A176-S181 PolarHBondContact O-OG 3.09Å; A176-S181 VanDerWaalsContact O-OG 3.12Å; E179-S181 VanDerWaalsContact C-N 3.25Å; E179-S181 PolarHBondContact O-N 3.48Å; S181-A183 PolarHBondContact O-N 2.78Å; S181-A183 VanDerWaalsContact O-N 3.13Å
182D89.7Confident88.2Confident94 Ų9476.9 Ų76.950%0.50341%0.41SS..  trans-70.9108.1177.9-171.6-32.7000110L184 E185 A186D182-L184 VanDerWaalsContact C-N 3.26Å; D182-L184 PolarHBondContact O-N 3.46Å; D182-L184 WeakPolarHBondContact OD1-CA 3.45Å; D182-L184 WeakPolarHBondContact OD1-CB 3.32Å; D182-L184 PolarHBondContact OD1-N 2.87Å; D182-E185 HydrophobicContact CB-CB 3.86Å; D182-E185 PolarHBondContact O-N 3.34Å; D182-E185 PolarHBondContact OD1-N 3.07Å; D182-A186 PolarHBondContact O-N 3.36Å
183A88.3Confident87.8Confident14 Ų1480.8 Ų80.812%0.11643%0.426CS..Hα-helixtrans-65.2-27.7-178.500000113.3W173 A176 S181 L187W173-A183 VanDerWaalsContact CD1-CB 3.5Å; W173-A183 HydrophobicContact CG-CB 4.15Å; A176-A183 HydrophobicContact CB-CB 4.06Å; S181-A183 PolarHBondContact O-N 2.78Å; S181-A183 VanDerWaalsContact O-N 3.13Å; A183-L187 WeakPolarHBondContact O-CB 3.45Å; A183-L187 WeakPolarHBondContact O-CG 3.11Å; A183-L187 PolarHBondContact O-N 3.48Å
184L90.3Very high86.9Confident110 Ų11078.5 Ų78.558%0.57642%0.418SS*.Hα-helixtrans-72.2-41.1174.717962.4000110.7D182 L187 N188D182-L184 VanDerWaalsContact C-N 3.26Å; D182-L184 PolarHBondContact O-N 3.46Å; D182-L184 WeakPolarHBondContact OD1-CA 3.45Å; D182-L184 WeakPolarHBondContact OD1-CB 3.32Å; D182-L184 PolarHBondContact OD1-N 2.87Å; L184-L187 PolarHBondContact O-N 3.47Å; L184-N188 PolarHBondContact O-N 2.66Å; L184-N188 PolarHBondContact O-ND2 2.9Å
185E89.6Confident86.1Confident120 Ų12079.8 Ų79.856%0.56142%0.418SS*.Hα-helixtrans-61.5-45.1173.9-171179.9173.500111.2D182 L187 N188 N189D182-E185 HydrophobicContact CB-CB 3.86Å; D182-E185 PolarHBondContact O-N 3.34Å; D182-E185 PolarHBondContact OD1-N 3.07Å; E185-L187 PolarHBondContact O-N 3.34Å; E185-N188 PolarHBondContact O-N 2.98Å; E185-N189 WeakPolarHBondContact O-CB 2.98Å; E185-N189 VanDerWaalsContact O-CG 3.3Å; E185-N189 PolarHBondContact O-N 2.89Å; E185-N189 PolarHBondContact O-ND2 3.09Å
186A85Confident85.4Confident21 Ų2177.9 Ų77.917%0.17441%0.408CS..Hα-helixtrans-60.6-42.5176.400000112.4T172 A176 D182 N189 K190T172-A186 HydrophobicContact CG2-CB 3.84Å; T172-A186 WeakPolarHBondContact CG2-O 3.39Å; A176-A186 HydrophobicContact CB-CB 3.57Å; D182-A186 PolarHBondContact O-N 3.36Å; A186-N189 PolarHBondContact O-N 2.97Å; A186-K190 WeakPolarHBondContact O-CB 3.2Å; A186-K190 PolarHBondContact O-N 3.34Å
187L89.4Confident84.5Confident44 Ų4480.9 Ų80.923%0.2343%0.426CS..Hα-helixtrans-64-42174.8-75.9174.9000112.5F169 W173 A183 L184 E185 K190 F191F169-L187 HydrophobicContact CB-CD2 4.18Å; F169-L187 HydrophobicContact CD1-CD2 3.78Å; F169-L187 HydrophobicContact CG-CD2 4.49Å; F169-L187 WeakPolarHBondContact O-CD2 3.14Å; W173-L187 HydrophobicContact CB-CD1 4.49Å; W173-L187 HydrophobicContact CB-CD2 4.22Å; W173-L187 HydrophobicContact CB-CG 4.4Å; W173-L187 HydrophobicContact CG-CD1 4.48Å; A183-L187 WeakPolarHBondContact O-CB 3.45Å; A183-L187 WeakPolarHBondContact O-CG 3.11Å; A183-L187 PolarHBondContact O-N 3.48Å; L184-L187 PolarHBondContact O-N 3.47Å; E185-L187 PolarHBondContact O-N 3.34Å; L187-K190 PolarHBondContact O-N 2.95Å; L187-F191 WeakPolarHBondContact O-CB 3.45Å; L187-F191 PolarHBondContact O-N 2.86Å
188N87.5Confident83.5Confident85 Ų8576.9 Ų76.946%0.45541%0.41SS..Hα-helixtrans-62.7-46175.9-75.2-28.8000111.1L184 E185 K190 F191 D192L184-N188 PolarHBondContact O-N 2.66Å; L184-N188 PolarHBondContact O-ND2 2.9Å; E185-N188 PolarHBondContact O-N 2.98Å; N188-K190 VanDerWaalsContact C-N 3.29Å; N188-K190 PolarHBondContact O-N 3.19Å; N188-F191 WeakPolarHBondContact O-CB 3.27Å; N188-F191 PolarHBondContact O-N 2.88Å; N188-F191 VanDerWaalsContact O-N 3.17Å; N188-D192 PolarHBondContact O-N 2.83Å
189N85.3Confident82.6Confident89 Ų8973.1 Ų73.148%0.47639%0.389SS..Hα-helixtrans-59.5-41.1175.8-71.4-26.5000111.6E185 A186 D192 E193E185-N189 WeakPolarHBondContact O-CB 2.98Å; E185-N189 VanDerWaalsContact O-CG 3.3Å; E185-N189 PolarHBondContact O-N 2.89Å; E185-N189 PolarHBondContact O-ND2 3.09Å; A186-N189 PolarHBondContact O-N 2.97Å; N189-D192 PolarHBondContact O-N 3.17Å; N189-E193 WeakPolarHBondContact O-CB 3.44Å; N189-E193 PolarHBondContact O-N 2.85Å
190K84.4Confident81.7Confident34 Ų3467 Ų6715%0.14836%0.363CS..Hα-helixtrans-68.5-37.2176.7-174.561.9176173.10112.5E168 F169 T172 A186 L187 N188 E193 Y194E168-K190 WeakPolarHBondContact OE2-CE 3.33Å; E168-K190 IonicContact OE2-NZ 3.94Å; E168-K190 PolarHBondContact OE2-NZ 3.35Å; F169-K190 HydrophobicContact CD1-CB 4.4Å; F169-K190 HydrophobicContact CD1-CG 4.08Å; F169-K190 HydrophobicContact CE1-CB 4.15Å; F169-K190 HydrophobicContact CE1-CG 3.95Å; F169-K190 HydrophobicContact CZ-CG 4.45Å; T172-K190 HydrophobicContact CG2-CB 3.96Å; T172-K190 HydrophobicContact CG2-CG 4.42Å; A186-K190 WeakPolarHBondContact O-CB 3.2Å; A186-K190 PolarHBondContact O-N 3.34Å; L187-K190 PolarHBondContact O-N 2.95Å; N188-K190 VanDerWaalsContact C-N 3.29Å; N188-K190 PolarHBondContact O-N 3.19Å; K190-E193 IonicContact NZ-OE2 3.91Å; K190-Y194 VanDerWaalsContact O-CB 3.28Å; K190-Y194 WeakPolarHBondContact O-CB 3.19Å; K190-Y194 PolarHBondContact O-N 2.57Å
191F84.4Confident80.8Confident108 Ų10869.7 Ų69.747%0.47435%0.354SS..Hα-helixtrans-62.8-48.7172.9179.5-89.5000110.9F169 L187 N188 E193 Y194 F195F169-F191 HydrophobicContact CE1-CB 4.05Å; F169-F191 HydrophobicContact CZ-CB 4.26Å; F169-F191 HydrophobicContact CZ-CD2 4.35Å; L187-F191 WeakPolarHBondContact O-CB 3.45Å; L187-F191 PolarHBondContact O-N 2.86Å; N188-F191 WeakPolarHBondContact O-CB 3.27Å; N188-F191 PolarHBondContact O-N 2.88Å; N188-F191 VanDerWaalsContact O-N 3.17Å; F191-E193 PolarHBondContact O-N 3.33Å; F191-Y194 PolarHBondContact O-N 3.45Å; F191-F195 HydrophobicContact CD1-CB 4.43Å; F191-F195 HydrophobicContact CE1-CB 4.11Å; F191-F195 HydrophobicContact CE1-CG 4.3Å; F191-F195 HydrophobicContact CZ-CB 4.36Å; F191-F195 HydrophobicContact CZ-CD2 4.25Å; F191-F195 HydrophobicContact CZ-CG 4.42Å; F191-F195 WeakPolarHBondContact O-CB 3.3Å; F191-F195 PolarHBondContact O-N 2.89Å
192D81.5Confident79.9Confident81 Ų8168.6 Ų68.643%0.43334%0.343SS..Hα-helixtrans-60.1-46.4177.9-73-14.5000110.7N188 N189 Y194 N196N188-D192 PolarHBondContact O-N 2.83Å; N189-D192 PolarHBondContact O-N 3.17Å; D192-Y194 PolarHBondContact O-N 3.36Å; D192-N196 WeakPolarHBondContact O-CA 3.44Å; D192-N196 WeakPolarHBondContact O-CB 3.41Å; D192-N196 PolarHBondContact O-N 2.83Å; D192-N196 PolarHBondContact O-ND2 2.88Å
193E78.4Confident79.3Confident112 Ų11265.5 Ų65.552%0.52333%0.326SS..Hα-helixtrans-56.7-49.7175-174.6-167.2162.300111.7N189 K190 F191 T197N189-E193 WeakPolarHBondContact O-CB 3.44Å; N189-E193 PolarHBondContact O-N 2.85Å; K190-E193 IonicContact NZ-OE2 3.91Å; F191-E193 PolarHBondContact O-N 3.33Å; E193-T197 WeakPolarHBondContact O-CB 3.35Å; E193-T197 PolarHBondContact O-N 3.45Å; E193-T197 PolarHBondContact O-OG1 2.85Å
194Y73.9Confident78.8Confident71 Ų7166 Ų6628%0.27833%0.327SS..Hα-helixtrans-65.9-50.4-177.1-165-88.5000111.6F156 K190 F191 D192 T197 M198F156-Y194 HydrophobicContact CD1-CE1 4.39Å; F156-Y194 WeakPolarHBondContact CD1-OH 3.47Å; F156-Y194 HydrophobicContact CE1-CD1 4.49Å; F156-Y194 AromaticContact CE1-CE1 3.41Å; F156-Y194 HydrophobicContact CE1-CE1 3.41Å; F156-Y194 VanDerWaalsContact CE1-CE1 3.41Å; F156-Y194 AromaticContact CE1-CZ 3.5Å; F156-Y194 VanDerWaalsContact CE1-CZ 3.5Å; F156-Y194 WeakPolarHBondContact CE1-OH 3.48Å; F156-Y194 HydrophobicContact CZ-CD1 4.37Å; F156-Y194 AromaticContact CZ-CE1 3.58Å; F156-Y194 HydrophobicContact CZ-CE1 3.58Å; K190-Y194 VanDerWaalsContact O-CB 3.28Å; K190-Y194 WeakPolarHBondContact O-CB 3.19Å; K190-Y194 PolarHBondContact O-N 2.57Å; F191-Y194 PolarHBondContact O-N 3.45Å; D192-Y194 PolarHBondContact O-N 3.36Å; Y194-T197 PolarHBondContact O-N 3.44Å; Y194-M198 VanDerWaalsContact O-CB 3.3Å; Y194-M198 WeakPolarHBondContact O-CB 3.31Å; Y194-M198 PolarHBondContact O-N 3.37Å
195F76.4Confident77.9Confident91 Ų9163 Ų6340%0.39931%0.311SS..Hα-helixtrans-64.7-44.6-179-174.5-96.2000111.3F191 M198 L199F191-F195 HydrophobicContact CD1-CB 4.43Å; F191-F195 HydrophobicContact CE1-CB 4.11Å; F191-F195 HydrophobicContact CE1-CG 4.3Å; F191-F195 HydrophobicContact CZ-CB 4.36Å; F191-F195 HydrophobicContact CZ-CD2 4.25Å; F191-F195 HydrophobicContact CZ-CG 4.42Å; F191-F195 WeakPolarHBondContact O-CB 3.3Å; F191-F195 PolarHBondContact O-N 2.89Å; F195-M198 PolarHBondContact O-N 2.97Å; F195-L199 HydrophobicContact CD1-CD2 4.38Å; F195-L199 HydrophobicContact CE1-CD2 3.54Å; F195-L199 HydrophobicContact CZ-CD2 3.9Å; F195-L199 VanDerWaalsContact O-CB 3.25Å; F195-L199 WeakPolarHBondContact O-CB 3.48Å; F195-L199 PolarHBondContact O-N 2.71Å
196N76.6Confident77.2Confident25 Ų2563.1 Ų63.113%0.13431%0.306CS..Hα-helixtrans-65.5-42.4178-72.5-24.5000111.6D192 M198 T200 L266 V268D192-N196 WeakPolarHBondContact O-CA 3.44Å; D192-N196 WeakPolarHBondContact O-CB 3.41Å; D192-N196 PolarHBondContact O-N 2.83Å; D192-N196 PolarHBondContact O-ND2 2.88Å; N196-M198 VanDerWaalsContact C-N 3.35Å; N196-M198 PolarHBondContact O-N 3.48Å; N196-T200 WeakPolarHBondContact O-CA 3.44Å; N196-T200 WeakPolarHBondContact O-CB 3.5Å; N196-T200 PolarHBondContact O-N 3.37Å; N196-T200 PolarHBondContact O-OG1 2.78Å; N196-L266 PolarHBondContact ND2-O 2.86Å; N196-L266 PolarHBondContact OD1-O 2.81Å; N196-V268 HydrophobicContact CB-CG2 3.43Å; N196-V268 VanDerWaalsContact CB-CG2 3.43Å; N196-V268 WeakPolarHBondContact ND2-CG2 3.39Å
197T70.4Confident76.9Confident66 Ų6662.2 Ų62.241%0.40530%0.299SS..Hα-helixtrans-61.2-46176.3-61.60000111E193 Y194 K201E193-T197 WeakPolarHBondContact O-CB 3.35Å; E193-T197 PolarHBondContact O-N 3.45Å; E193-T197 PolarHBondContact O-OG1 2.85Å; Y194-T197 PolarHBondContact O-N 3.44Å; T197-K201 HydrophobicContact CG2-CD 4.31Å; T197-K201 WeakPolarHBondContact O-CB 3.38Å; T197-K201 VanDerWaalsContact O-CG 3.3Å; T197-K201 WeakPolarHBondContact O-CG 3Å; T197-K201 PolarHBondContact O-N 3.35Å
198M67.1Low76.3Confident49 Ų4962.7 Ų62.724%0.24130%0.304CS..Hα-helixtrans-61.7-51.7178.5173.6-178155.300111.9G154 Y194 F195 N196 K201 Q202G154-M198 VanDerWaalsContact C-CE 3.44Å; G154-M198 WeakPolarHBondContact O-CE 3.46Å; G154-M198 WeakPolarHBondContact O-CG 3.5Å; Y194-M198 VanDerWaalsContact O-CB 3.3Å; Y194-M198 WeakPolarHBondContact O-CB 3.31Å; Y194-M198 PolarHBondContact O-N 3.37Å; F195-M198 PolarHBondContact O-N 2.97Å; N196-M198 VanDerWaalsContact C-N 3.35Å; N196-M198 PolarHBondContact O-N 3.48Å; M198-K201 PolarHBondContact O-N 3.06Å; M198-Q202 WeakPolarHBondContact O-CG 3.38Å; M198-Q202 PolarHBondContact O-N 3.45Å; M198-Q202 VanDerWaalsContact O-N 3.07Å
199L72.9Confident75.6Confident38 Ų3859.5 Ų59.520%0.19929%0.288CS..Hα-helixtrans-68.3-38.2-177.9-173.152000111.8F195 Q202 L203 L266F195-L199 HydrophobicContact CD1-CD2 4.38Å; F195-L199 HydrophobicContact CE1-CD2 3.54Å; F195-L199 HydrophobicContact CZ-CD2 3.9Å; F195-L199 VanDerWaalsContact O-CB 3.25Å; F195-L199 WeakPolarHBondContact O-CB 3.48Å; F195-L199 PolarHBondContact O-N 2.71Å; L199-Q202 PolarHBondContact O-N 3.42Å; L199-L203 HydrophobicContact CD1-CD1 3.52Å; L199-L203 HydrophobicContact CD1-CG 3.95Å; L199-L203 HydrophobicContact CG-CD1 3.74Å; L199-L203 WeakPolarHBondContact O-CB 3.4Å; L199-L203 WeakPolarHBondContact O-CG 3.05Å; L199-L203 PolarHBondContact O-N 2.94Å; L199-L266 HydrophobicContact CB-CD1 4.21Å; L199-L266 HydrophobicContact CD2-CD1 4.28Å; L199-L266 HydrophobicContact CD2-CD2 3.34Å; L199-L266 HydrophobicContact CD2-CG 4.45Å; L199-L266 HydrophobicContact CG-CD1 4.08Å; L199-L266 HydrophobicContact CG-CD2 4.02Å
200T72.5Confident75.4Confident28 Ų2861.7 Ų61.717%0.17229%0.293CS..Hα-helixtrans-59.3-51.2172.3-60.60000110.1N196 Q202 L203 M204 M263N196-T200 WeakPolarHBondContact O-CA 3.44Å; N196-T200 WeakPolarHBondContact O-CB 3.5Å; N196-T200 PolarHBondContact O-N 3.37Å; N196-T200 PolarHBondContact O-OG1 2.78Å; T200-Q202 VanDerWaalsContact C-N 3.34Å; T200-Q202 PolarHBondContact O-N 2.92Å; T200-L203 PolarHBondContact O-N 3.31Å; T200-M204 HydrophobicContact CG2-CG 3.76Å; T200-M204 WeakPolarHBondContact O-CB 3.48Å; T200-M204 WeakPolarHBondContact O-CG 3.34Å; T200-M204 PolarHBondContact O-N 3.19Å; T200-M263 HydrophobicContact CG2-SD 3.92Å
201K69.4Low75.4Confident126 Ų12661.2 Ų61.255%0.54829%0.29SS..Hα-helixtrans-55.6-46.9177.5-77.7177.6178.9-176.90112.2T197 M198 N205T197-K201 HydrophobicContact CG2-CD 4.31Å; T197-K201 WeakPolarHBondContact O-CB 3.38Å; T197-K201 VanDerWaalsContact O-CG 3.3Å; T197-K201 WeakPolarHBondContact O-CG 3Å; T197-K201 PolarHBondContact O-N 3.35Å; M198-K201 PolarHBondContact O-N 3.06Å; K201-N205 WeakPolarHBondContact O-CB 3.46Å; K201-N205 PolarHBondContact O-N 3.14Å; K201-N205 PolarHBondContact O-ND2 3.38Å; K201-N205 PolarHBondContact O-OD1 3.06Å
202Q64.4Low75.2Confident34 Ų3457.9 Ų57.916%0.15928%0.277CS..Hα-helixtrans-62.5-49.2-180-70.1175.130.500112.7L153 G154 M198 L199 T200 N205 R206L153-Q202 PolarHBondContact O-NE2 2.84Å; L153-Q202 PolarHBondContact O-OE1 3.2Å; G154-Q202 VanDerWaalsContact CA-NE2 3.34Å; M198-Q202 WeakPolarHBondContact O-CG 3.38Å; M198-Q202 PolarHBondContact O-N 3.45Å; M198-Q202 VanDerWaalsContact O-N 3.07Å; L199-Q202 PolarHBondContact O-N 3.42Å; T200-Q202 VanDerWaalsContact C-N 3.34Å; T200-Q202 PolarHBondContact O-N 2.92Å; Q202-N205 PolarHBondContact O-N 3.3Å; Q202-R206 PolarHBondContact O-N 3.47Å; Q202-R206 VanDerWaalsContact O-N 3.09Å
203L77Confident75Confident29 Ų2955.9 Ų55.915%0.15227%0.266CS..Hα-helixtrans-74.6-31.2-175.7-67.6171.3000111.4L199 T200 R206 A207 Y258 L262L199-L203 HydrophobicContact CD1-CD1 3.52Å; L199-L203 HydrophobicContact CD1-CG 3.95Å; L199-L203 HydrophobicContact CG-CD1 3.74Å; L199-L203 WeakPolarHBondContact O-CB 3.4Å; L199-L203 WeakPolarHBondContact O-CG 3.05Å; L199-L203 PolarHBondContact O-N 2.94Å; T200-L203 PolarHBondContact O-N 3.31Å; L203-R206 PolarHBondContact O-N 2.98Å; L203-A207 WeakPolarHBondContact O-CB 3.3Å; L203-A207 PolarHBondContact O-N 2.94Å; L203-Y258 HydrophobicContact CB-CE1 4.44Å; L203-Y258 WeakPolarHBondContact O-CE1 3.38Å; L203-L262 HydrophobicContact CB-CD1 4.28Å; L203-L262 HydrophobicContact CB-CD2 3.43Å; L203-L262 VanDerWaalsContact CB-CD2 3.43Å; L203-L262 HydrophobicContact CB-CG 4.48Å; L203-L262 HydrophobicContact CD1-CD1 3.26Å; L203-L262 HydrophobicContact CD1-CD2 4.01Å; L203-L262 HydrophobicContact CD1-CG 4.26Å; L203-L262 HydrophobicContact CG-CD1 4.39Å; L203-L262 HydrophobicContact CG-CD2 4.36Å
204M78Confident75.1Confident25 Ų2552.7 Ų52.712%0.12325%0.254CS..Hα-helixtrans-68.2-38.9170.2-67.6-60.578.400111.8T200 R206 A207 T208 F255 Y258 A259 L262T200-M204 HydrophobicContact CG2-CG 3.76Å; T200-M204 WeakPolarHBondContact O-CB 3.48Å; T200-M204 WeakPolarHBondContact O-CG 3.34Å; T200-M204 PolarHBondContact O-N 3.19Å; M204-R206 PolarHBondContact O-N 3.21Å; M204-A207 HydrophobicContact CE-CB 3.92Å; M204-A207 CarbonylContact O-C 2.98Å; M204-A207 WeakPolarHBondContact O-CB 3.43Å; M204-A207 PolarHBondContact O-N 3.38Å; M204-A207 VanDerWaalsContact O-N 3.17Å; M204-T208 WeakPolarHBondContact O-CB 3.37Å; M204-T208 PolarHBondContact O-N 3.41Å; M204-T208 PolarHBondContact O-OG1 3.47Å; M204-F255 HydrophobicContact SD-CZ 4.13Å; M204-Y258 HydrophobicContact CE-CD1 3.46Å; M204-Y258 VanDerWaalsContact CE-CD1 3.46Å; M204-Y258 HydrophobicContact CE-CE1 3.43Å; M204-Y258 VanDerWaalsContact CE-CE1 3.43Å; M204-A259 HydrophobicContact CE-CB 4.01Å; M204-A259 HydrophobicContact SD-CB 3.59Å; M204-A259 VanDerWaalsContact SD-CB 3.59Å; M204-L262 HydrophobicContact CE-CD2 3.52Å
205N72.4Confident75.2Confident46 Ų4650 Ų5025%0.24624%0.244CC..Hα-helixtrans-59.5-46.4172-75.8-10.3000111.3I89 K201 Q202 A207 T208 S209I89-N205 HydrophobicContact CD1-CB 3.89Å; K201-N205 WeakPolarHBondContact O-CB 3.46Å; K201-N205 PolarHBondContact O-N 3.14Å; K201-N205 PolarHBondContact O-ND2 3.38Å; K201-N205 PolarHBondContact O-OD1 3.06Å; Q202-N205 PolarHBondContact O-N 3.3Å; N205-A207 VanDerWaalsContact C-N 3.31Å; N205-A207 PolarHBondContact O-N 3.16Å; N205-T208 WeakPolarHBondContact O-CB 3.06Å; N205-T208 PolarHBondContact O-N 2.93Å; N205-T208 VanDerWaalsContact O-N 3.15Å; N205-S209 PolarHBondContact O-N 2.74Å; N205-S209 PolarHBondContact O-OG 3.21Å
206R73.4Confident75.4Confident124 Ų12449.2 Ų49.247%0.46824%0.244SC..Hα-helixtrans-59.6-40.4174.1-67.2-175.7177.2166.8-1112.7I89 Q202 L203 M204 K210I89-R206 HydrophobicContact CD1-CG 3.75Å; Q202-R206 PolarHBondContact O-N 3.47Å; Q202-R206 VanDerWaalsContact O-N 3.09Å; L203-R206 PolarHBondContact O-N 2.98Å; M204-R206 PolarHBondContact O-N 3.21Å; R206-K210 VanDerWaalsContact O-CB 3.27Å; R206-K210 WeakPolarHBondContact O-CB 3.49Å; R206-K210 PolarHBondContact O-N 3.13Å
207A79Confident75.7Confident1 Ų152.9 Ų52.91%0.00826%0.261CS..Hα-helixtrans-64.8-41.6175.900000111.4L203 M204 N205 K210 Y211 F255 Y258L203-A207 WeakPolarHBondContact O-CB 3.3Å; L203-A207 PolarHBondContact O-N 2.94Å; M204-A207 HydrophobicContact CE-CB 3.92Å; M204-A207 CarbonylContact O-C 2.98Å; M204-A207 WeakPolarHBondContact O-CB 3.43Å; M204-A207 PolarHBondContact O-N 3.38Å; M204-A207 VanDerWaalsContact O-N 3.17Å; N205-A207 VanDerWaalsContact C-N 3.31Å; N205-A207 PolarHBondContact O-N 3.16Å; A207-K210 PolarHBondContact O-N 2.83Å; A207-Y211 HydrophobicContact CB-CD2 3.99Å; A207-Y211 HydrophobicContact CB-CE2 4.14Å; A207-Y211 WeakPolarHBondContact O-CB 3.48Å; A207-Y211 WeakPolarHBondContact O-CD2 3.2Å; A207-Y211 PolarHBondContact O-N 2.97Å; A207-F255 HydrophobicContact CB-CD2 3.76Å; A207-F255 HydrophobicContact CB-CE2 3.65Å; A207-Y258 HydrophobicContact CB-CD1 3.47Å; A207-Y258 VanDerWaalsContact CB-CD1 3.47Å; A207-Y258 HydrophobicContact CB-CE1 3.59Å; A207-Y258 HydrophobicContact CB-CG 4.35Å
208T76.6Confident76.1Confident55 Ų5550.7 Ų50.734%0.33725%0.249SC..Iπ-helixtrans-60.9-50.8176.1-61.70000110.1M204 N205 K210 Y211 I212 Q213M204-T208 WeakPolarHBondContact O-CB 3.37Å; M204-T208 PolarHBondContact O-N 3.41Å; M204-T208 PolarHBondContact O-OG1 3.47Å; N205-T208 WeakPolarHBondContact O-CB 3.06Å; N205-T208 PolarHBondContact O-N 2.93Å; N205-T208 VanDerWaalsContact O-N 3.15Å; T208-K210 VanDerWaalsContact C-N 3.28Å; T208-K210 PolarHBondContact O-N 3.33Å; T208-Y211 PolarHBondContact O-N 2.92Å; T208-I212 HydrophobicContact CG2-CB 3.96Å; T208-I212 HydrophobicContact CG2-CG1 4Å; T208-I212 HydrophobicContact CG2-CG2 4.5Å; T208-I212 WeakPolarHBondContact O-CA 3.45Å; T208-I212 WeakPolarHBondContact O-CB 3.33Å; T208-I212 PolarHBondContact O-N 3.48Å; T208-Q213 PolarHBondContact O-N 2.87Å
209S73.5Confident76.4Confident17 Ų1753 Ų5312%0.11926%0.258CS..Iπ-helixtrans-57.8-42.4175.6-43.10000111.3F87 N205 Q213F87-S209 PolarHBondContact O-OG 3.18Å; N205-S209 PolarHBondContact O-N 2.74Å; N205-S209 PolarHBondContact O-OG 3.21Å; S209-Q213 WeakPolarHBondContact O-CB 3.33Å; S209-Q213 PolarHBondContact O-OE1 3.32Å
210K82.3Confident76.5Confident136 Ų13656.5 Ų56.559%0.59128%0.277SS*.Iπ-helixtrans-72.7-40.9-176.6-174176.8177.5-168.10114.3R206 A207 T208R206-K210 VanDerWaalsContact O-CB 3.27Å; R206-K210 WeakPolarHBondContact O-CB 3.49Å; R206-K210 PolarHBondContact O-N 3.13Å; A207-K210 PolarHBondContact O-N 2.83Å; T208-K210 VanDerWaalsContact C-N 3.28Å; T208-K210 PolarHBondContact O-N 3.33Å
211Y83.2Confident76.9Confident23 Ų2362.5 Ų62.59%0.0930%0.301CS..Iπ-helixtrans-107-33.5-169.3-57-60000112.6A207 T208 N251 L254 F255 Y258A207-Y211 HydrophobicContact CB-CD2 3.99Å; A207-Y211 HydrophobicContact CB-CE2 4.14Å; A207-Y211 WeakPolarHBondContact O-CB 3.48Å; A207-Y211 WeakPolarHBondContact O-CD2 3.2Å; A207-Y211 PolarHBondContact O-N 2.97Å; T208-Y211 PolarHBondContact O-N 2.92Å; Y211-N251 WeakPolarHBondContact O-CB 3.37Å; Y211-N251 VanDerWaalsContact O-CG 3.29Å; Y211-L254 HydrophobicContact CD1-CB 3.81Å; Y211-L254 HydrophobicContact CD1-CD1 4.38Å; Y211-L254 HydrophobicContact CE1-CB 3.73Å; Y211-L254 HydrophobicContact CE1-CD1 4.25Å; Y211-L254 HydrophobicContact CG-CB 4.47Å; Y211-F255 HydrophobicContact CD2-CB 3.97Å; Y211-F255 HydrophobicContact CD2-CD2 4.07Å; Y211-F255 HydrophobicContact CD2-CG 4.48Å; Y211-F255 HydrophobicContact CG-CB 4.2Å; Y211-Y258 HydrophobicContact CE2-CD2 4.45Å; Y211-Y258 HydrophobicContact CE2-CG 4.08Å
212I79.4Confident77.1Confident39 Ų3956.7 Ų56.720%0.228%0.276CS..Iπ-helixtrans-88.5-37.5-177.7-52.8-58.9000111.6T208 P214 I215 L216 L252 F255T208-I212 HydrophobicContact CG2-CB 3.96Å; T208-I212 HydrophobicContact CG2-CG1 4Å; T208-I212 HydrophobicContact CG2-CG2 4.5Å; T208-I212 WeakPolarHBondContact O-CA 3.45Å; T208-I212 WeakPolarHBondContact O-CB 3.33Å; T208-I212 PolarHBondContact O-N 3.48Å; I212-P214 VanDerWaalsContact C-CD 3.49Å; I212-I215 HydrophobicContact CD1-CD1 4.16Å; I212-I215 WeakPolarHBondContact O-CA 3.25Å; I212-I215 VanDerWaalsContact O-CB 3.3Å; I212-I215 WeakPolarHBondContact O-CB 3.13Å; I212-I215 PolarHBondContact O-N 3.37Å; I212-L216 HydrophobicContact CG2-CD1 4.31Å; I212-L216 HydrophobicContact CG2-CG 4.26Å; I212-L216 PolarHBondContact O-N 3.24Å; I212-L216 VanDerWaalsContact O-N 3.17Å; I212-L252 HydrophobicContact CD1-CD2 3.5Å; I212-F255 HydrophobicContact CD1-CD2 4.47Å; I212-F255 HydrophobicContact CG1-CD2 4.33Å
213Q78.4Confident77.5Confident39 Ų3958 Ų5818%0.18229%0.286CS..Hα-helixtrans-53.6-43.6179.7-169.4-175.8-36.400113.6T208 S209 I215 L216 E217T208-Q213 PolarHBondContact O-N 2.87Å; S209-Q213 WeakPolarHBondContact O-CB 3.33Å; S209-Q213 PolarHBondContact O-OE1 3.32Å; Q213-I215 PolarHBondContact O-N 3.03Å; Q213-L216 PolarHBondContact O-N 2.92Å; Q213-L216 VanDerWaalsContact O-N 3.11Å; Q213-E217 HydrophobicContact CG-CG 4.29Å; Q213-E217 PolarHBondContact NE2-OE1 3.32Å; Q213-E217 WeakPolarHBondContact O-CG 3.49Å; Q213-E217 PolarHBondContact O-N 2.85Å
214P80.6Confident77.3Confident44 Ų4458.9 Ų58.929%0.28630%0.295SS..Hα-helixtrans-61.8-27176.8-23.635.1000114I212 A218I212-P214 VanDerWaalsContact C-CD 3.49Å; P214-A218 WeakPolarHBondContact O-CB 3.35Å; P214-A218 PolarHBondContact O-N 3.44Å
215I76.2Confident77Confident14 Ų1463.3 Ų63.37%0.07232%0.319CS..Hα-helixtrans-72.2-46.5175.5-53.2169.2000109.2I212 Q213 A218 F219 K248 N251 L252I212-I215 HydrophobicContact CD1-CD1 4.16Å; I212-I215 WeakPolarHBondContact O-CA 3.25Å; I212-I215 VanDerWaalsContact O-CB 3.3Å; I212-I215 WeakPolarHBondContact O-CB 3.13Å; I212-I215 PolarHBondContact O-N 3.37Å; Q213-I215 PolarHBondContact O-N 3.03Å; I215-A218 WeakPolarHBondContact O-CB 3.45Å; I215-A218 PolarHBondContact O-N 3.45Å; I215-F219 HydrophobicContact CG2-CD2 4.15Å; I215-F219 HydrophobicContact CG2-CE2 3.98Å; I215-F219 WeakPolarHBondContact O-CD2 3.3Å; I215-F219 PolarHBondContact O-N 3.34Å; I215-F219 VanDerWaalsContact O-N 3.1Å; I215-K248 HydrophobicContact CD1-CB 4.33Å; I215-K248 HydrophobicContact CD1-CG 4.49Å; I215-K248 HydrophobicContact CG2-CB 4.29Å; I215-N251 HydrophobicContact CD1-CB 3.99Å; I215-N251 HydrophobicContact CG1-CB 4.19Å; I215-L252 HydrophobicContact CD1-CG 4.46Å
216L79.3Confident77Confident76 Ų7665 Ų6540%0.39835%0.348SS..Hα-helixtrans-63.2-45178.9-60.1178.5000111.4I212 Q213 A218 F219 D220I212-L216 HydrophobicContact CG2-CD1 4.31Å; I212-L216 HydrophobicContact CG2-CG 4.26Å; I212-L216 PolarHBondContact O-N 3.24Å; I212-L216 VanDerWaalsContact O-N 3.17Å; Q213-L216 PolarHBondContact O-N 2.92Å; Q213-L216 VanDerWaalsContact O-N 3.11Å; L216-A218 PolarHBondContact O-N 3.07Å; L216-F219 WeakPolarHBondContact O-CA 3.21Å; L216-F219 WeakPolarHBondContact O-CB 3.42Å; L216-F219 PolarHBondContact O-N 3.43Å; L216-D220 PolarHBondContact O-N 2.95Å
217E82.9Confident77Confident102 Ų10259.9 Ų59.948%0.47733%0.331SS..Hα-helixtrans-61.3-33.2175.5-71.4176.3-179.500112.4Q213 K221Q213-E217 HydrophobicContact CG-CG 4.29Å; Q213-E217 PolarHBondContact NE2-OE1 3.32Å; Q213-E217 WeakPolarHBondContact O-CG 3.49Å; Q213-E217 PolarHBondContact O-N 2.85Å; E217-K221 VanDerWaalsContact O-CB 3.3Å; E217-K221 WeakPolarHBondContact O-CB 3.36Å; E217-K221 PolarHBondContact O-N 3.12Å
218A79.3Confident76.6Confident20 Ų2065.9 Ų65.917%0.16536%0.358CS..Hα-helixtrans-69.7-36.1175.100000112.1P214 I215 L216 A222 I244 L247P214-A218 WeakPolarHBondContact O-CB 3.35Å; P214-A218 PolarHBondContact O-N 3.44Å; I215-A218 WeakPolarHBondContact O-CB 3.45Å; I215-A218 PolarHBondContact O-N 3.45Å; L216-A218 PolarHBondContact O-N 3.07Å; A218-A222 WeakPolarHBondContact O-CB 3.34Å; A218-A222 PolarHBondContact O-N 2.95Å; A218-A222 VanDerWaalsContact O-N 3.07Å; A218-I244 HydrophobicContact CB-CG1 3.88Å; A218-L247 HydrophobicContact CB-CD1 3.7Å
219F74.5Confident75.9Confident97 Ų9764.1 Ų64.143%0.42535%0.351SS..Hα-helixtrans-63.4-51.8169.9-85.4-74.6000111.2I215 L216 K221 A222 V223 I244I215-F219 HydrophobicContact CG2-CD2 4.15Å; I215-F219 HydrophobicContact CG2-CE2 3.98Å; I215-F219 WeakPolarHBondContact O-CD2 3.3Å; I215-F219 PolarHBondContact O-N 3.34Å; I215-F219 VanDerWaalsContact O-N 3.1Å; L216-F219 WeakPolarHBondContact O-CA 3.21Å; L216-F219 WeakPolarHBondContact O-CB 3.42Å; L216-F219 PolarHBondContact O-N 3.43Å; F219-K221 VanDerWaalsContact C-N 3.26Å; F219-K221 PolarHBondContact O-N 2.9Å; F219-A222 PolarHBondContact O-N 3.11Å; F219-V223 WeakPolarHBondContact O-CG2 3.18Å; F219-V223 PolarHBondContact O-N 3.04Å; F219-V223 VanDerWaalsContact O-N 3.09Å; F219-I244 HydrophobicContact CD1-CD1 3.96Å; F219-I244 HydrophobicContact CD2-CG2 3.96Å; F219-I244 HydrophobicContact CE1-CD1 4.21Å; F219-I244 HydrophobicContact CE1-CG2 4.08Å; F219-I244 HydrophobicContact CE2-CG2 3.46Å; F219-I244 VanDerWaalsContact CE2-CG2 3.46Å; F219-I244 HydrophobicContact CG-CD1 4.24Å; F219-I244 HydrophobicContact CG-CG2 4.47Å; F219-I244 HydrophobicContact CZ-CG2 3.53Å
220D75Confident74.9Confident111 Ų11166.1 Ų66.159%0.59438%0.375SS*.Hα-helixtrans-55-43.2178.6-76.5-16.3000111.5L216 V223 S224L216-D220 PolarHBondContact O-N 2.95Å; D220-V223 CarbonylContact O-C 3.59Å; D220-V223 WeakPolarHBondContact O-CG2 3.43Å; D220-V223 PolarHBondContact O-N 3.42Å; D220-S224 WeakPolarHBondContact O-CB 3.46Å; D220-S224 PolarHBondContact O-N 3.21Å
221K80.9Confident73.5Confident155 Ų15563.6 Ų63.667%0.67437%0.368SS*.Hα-helixtrans-64.3-42.5177-175.2178178.2-1780112.3E217 F219 V223 S224E217-K221 VanDerWaalsContact O-CB 3.3Å; E217-K221 WeakPolarHBondContact O-CB 3.36Å; E217-K221 PolarHBondContact O-N 3.12Å; F219-K221 VanDerWaalsContact C-N 3.26Å; F219-K221 PolarHBondContact O-N 2.9Å; K221-V223 PolarHBondContact O-N 3.25Å; K221-S224 PolarHBondContact O-N 2.8Å; K221-S224 VanDerWaalsContact O-N 3.15Å; K221-S224 PolarHBondContact O-OG 3.26Å
222A73.8Confident72.2Confident3 Ų368.7 Ų68.73%0.02540%0.396CS..Hα-helixtrans-64.1-31.7179.800000112.1A218 F219 S227 V236 E240 I244A218-A222 WeakPolarHBondContact O-CB 3.34Å; A218-A222 PolarHBondContact O-N 2.95Å; A218-A222 VanDerWaalsContact O-N 3.07Å; F219-A222 PolarHBondContact O-N 3.11Å; A222-S227 WeakPolarHBondContact O-CB 3.33Å; A222-S227 PolarHBondContact O-OG 3.12Å; A222-V236 HydrophobicContact CB-CG1 4.01Å; A222-V236 HydrophobicContact CB-CG2 4Å; A222-E240 HydrophobicContact CB-CB 4.19Å; A222-I244 HydrophobicContact CB-CD1 3.89Å
223V71.2Confident71Confident63 Ų6367.6 Ų67.638%0.38240%0.395SS..THydrogen-bonded Turntrans-98.616.5175.4-54.40000113.3F219 D220 K221 G233 V236F219-V223 WeakPolarHBondContact O-CG2 3.18Å; F219-V223 PolarHBondContact O-N 3.04Å; F219-V223 VanDerWaalsContact O-N 3.09Å; D220-V223 CarbonylContact O-C 3.59Å; D220-V223 WeakPolarHBondContact O-CG2 3.43Å; D220-V223 PolarHBondContact O-N 3.42Å; K221-V223 PolarHBondContact O-N 3.25Å; V223-G233 WeakPolarHBondContact CB-O 3.35Å; V223-G233 WeakPolarHBondContact O-CA 3.45Å; V223-V236 HydrophobicContact CG1-CG2 3.9Å
224S73.6Confident70.1Confident47 Ų4772.7 Ų72.733%0.32942%0.423SS..SBendtrans-88.5152.8177.166.80000112.1D220 K221 G226 S227D220-S224 WeakPolarHBondContact O-CB 3.46Å; D220-S224 PolarHBondContact O-N 3.21Å; K221-S224 PolarHBondContact O-N 2.8Å; K221-S224 VanDerWaalsContact O-N 3.15Å; K221-S224 PolarHBondContact O-OG 3.26Å; S224-G226 PolarHBondContact O-N 2.79Å; S224-S227 WeakPolarHBondContact O-CB 3.46Å; S224-S227 PolarHBondContact O-N 3.36Å; S224-S227 VanDerWaalsContact O-N 3.1Å; S224-S227 PolarHBondContact O-OG 3.25Å
225D70.4Confident69.3Low118 Ų11874.6 Ų74.663%0.63143%0.43SS*.THydrogen-bonded Turntrans-54.7121.5169.3-83.812.9000110.1N232D225-N232 VanDerWaalsContact OD1-C 3.3Å; D225-N232 WeakPolarHBondContact OD1-CA 3.42Å; D225-N232 WeakPolarHBondContact OD1-CB 3.42Å
226G73.4Confident68.8Low82 Ų8276.7 Ų76.785%0.84544%0.444SS*.THydrogen-bonded Turntrans94.57.5-177.800000115.7S224S224-G226 PolarHBondContact O-N 2.79Å
227S73.8Confident68.8Low16 Ų1674.9 Ų74.911%0.11244%0.436CS..  trans-62.3161.9169.675.90000112.6A222 S224 G229 G230 E240A222-S227 WeakPolarHBondContact O-CB 3.33Å; A222-S227 PolarHBondContact O-OG 3.12Å; S224-S227 WeakPolarHBondContact O-CB 3.46Å; S224-S227 PolarHBondContact O-N 3.36Å; S224-S227 VanDerWaalsContact O-N 3.1Å; S224-S227 PolarHBondContact O-OG 3.25Å; S227-G229 PolarHBondContact O-N 3.36Å; S227-G230 PolarHBondContact O-N 2.73Å; S227-E240 WeakPolarHBondContact CB-OE1 3.28Å
228E70.6Confident68.7Low126 Ų12677.6 Ų77.659%0.58945%0.446SS*.THydrogen-bonded Turntrans-63-24178.6-72.3-175.7-175.900111G230 T237 K239 E240E228-G230 PolarHBondContact O-N 2.88Å; E228-T237 VanDerWaalsContact C-CG2 3.49Å; E228-T237 HydrophobicContact CB-CG2 4.05Å; E228-K239 IonicContact OE1-NZ 2.77Å; E228-K239 PolarHBondContact OE1-NZ 3.29Å; E228-K239 WeakPolarHBondContact OE2-CD 3.42Å; E228-K239 IonicContact OE2-NZ 2.85Å; E228-K239 PolarHBondContact OE2-NZ 2.9Å; E228-E240 PolarHBondContact N-OE1 2.99Å
229G62.3Low69Low18 Ų1882.7 Ų82.719%0.18646%0.464CS..THydrogen-bonded Turntrans-68.1-14.117500000114.6S227 N231 T237 E240S227-G229 PolarHBondContact O-N 3.36Å; G229-N231 PolarHBondContact O-N 3.49Å; G229-T237 VanDerWaalsContact CA-CG2 3.42Å; G229-T237 VanDerWaalsContact N-CG2 3.34Å; G229-E240 PolarHBondContact N-OE2 2.86Å
230G51.3Low69.2Low60 Ų6079.7 Ų79.762%0.61945%0.452SS*.  trans66.929158.700000116.9S227 E228S227-G230 PolarHBondContact O-N 2.73Å; E228-G230 PolarHBondContact O-N 2.88Å
231N53.7Low69.4Low83 Ų8379.1 Ų79.144%0.44445%0.448SS..SBendtrans-146.854.2-174.4-1355.6000116.3G229 G233 L234 D235G229-N231 PolarHBondContact O-N 3.49Å; N231-G233 PolarHBondContact O-N 3.05Å; N231-L234 PolarHBondContact O-N 3.49Å; N231-D235 HydrophobicContact CB-CB 4.3Å; N231-D235 PolarHBondContact ND2-OD2 3.44Å
232N55.3Low69.5Low129 Ų12976.3 Ų76.369%0.6944%0.437SS*.THydrogen-bonded Turntrans41.738.4179.8-692.5000114.3D225D225-N232 VanDerWaalsContact OD1-C 3.3Å; D225-N232 WeakPolarHBondContact OD1-CA 3.42Å; D225-N232 WeakPolarHBondContact OD1-CB 3.42Å
233G55Low70Confident16 Ų1677.6 Ų77.617%0.16545%0.451CS..THydrogen-bonded Turntrans86.49.8178.500000119.7V223 N231V223-G233 WeakPolarHBondContact CB-O 3.35Å; V223-G233 WeakPolarHBondContact O-CA 3.45Å; N231-G233 PolarHBondContact O-N 3.05Å
234L59.8Low70.4Confident147 Ų14775 Ų7577%0.7744%0.435SS*.SBendtrans-94.5-18.6-178.4-63.7176.1000114.9N231N231-L234 PolarHBondContact O-N 3.49Å
235D62.3Low70.6Confident83 Ų8378.9 Ų78.944%0.44445%0.445SS..  trans-126.2143-175.6-71.8-50000111.7N231N231-D235 HydrophobicContact CB-CB 4.3Å; N231-D235 PolarHBondContact ND2-OD2 3.44Å
236V67Low71.5Confident59 Ų5980.1 Ų80.136%0.35845%0.448SS..  trans-117126.8174.7177.30000108.5A222 V223 E240 L241A222-V236 HydrophobicContact CB-CG1 4.01Å; A222-V236 HydrophobicContact CB-CG2 4Å; V223-V236 HydrophobicContact CG1-CG2 3.9Å; V236-E240 HydrophobicContact CG1-CB 3.79Å; V236-L241 HydrophobicContact CG1-CB 4.15Å
237T79.3Confident72.1Confident37 Ų3779.4 Ų79.423%0.22742%0.424CS..  trans-69.1157.8176.7630000111.8E228 G229 K239 E240 L241E228-T237 VanDerWaalsContact C-CG2 3.49Å; E228-T237 HydrophobicContact CB-CG2 4.05Å; G229-T237 VanDerWaalsContact CA-CG2 3.42Å; G229-T237 VanDerWaalsContact N-CG2 3.34Å; T237-K239 PolarHBondContact O-N 3.42Å; T237-E240 WeakPolarHBondContact CB-OE2 3.44Å; T237-E240 WeakPolarHBondContact CG2-OE2 3Å; T237-E240 PolarHBondContact N-OE2 3.32Å; T237-E240 PolarHBondContact O-N 3.45Å; T237-E240 WeakPolarHBondContact OG1-CB 3.37Å; T237-E240 VanDerWaalsContact OG1-CD 3.27Å; T237-E240 WeakPolarHBondContact OG1-CG 3.32Å; T237-E240 PolarHBondContact OG1-N 3.42Å; T237-E240 PolarHBondContact OG1-OE2 3.24Å; T237-L241 WeakPolarHBondContact O-CB 3.15Å; T237-L241 PolarHBondContact O-N 2.81Å
238K80.6Confident72.4Confident160 Ų16083 Ų8370%0.69644%0.438SS*.Hα-helixtrans-55.4-38.8172.1-174.4176175.3-176.10112.4L241 E242K238-L241 PolarHBondContact O-N 2.93Å; K238-E242 WeakPolarHBondContact CE-OE1 3.23Å; K238-E242 WeakPolarHBondContact O-CB 3.12Å; K238-E242 VanDerWaalsContact O-CG 3.26Å; K238-E242 WeakPolarHBondContact O-CG 3.41Å; K238-E242 PolarHBondContact O-N 3.43Å
239K84.5Confident73.1Confident127 Ų12781 Ų8155%0.55243%0.431SS*.Hα-helixtrans-67.9-43.2178.5178.4-178.8158.5-146.20112E228 T237 E242 G243E228-K239 IonicContact OE1-NZ 2.77Å; E228-K239 PolarHBondContact OE1-NZ 3.29Å; E228-K239 WeakPolarHBondContact OE2-CD 3.42Å; E228-K239 IonicContact OE2-NZ 2.85Å; E228-K239 PolarHBondContact OE2-NZ 2.9Å; T237-K239 PolarHBondContact O-N 3.42Å; K239-E242 PolarHBondContact O-N 3.27Å; K239-G243 PolarHBondContact O-N 2.76Å
240E79.2Confident74.4Confident33 Ų3386.8 Ų86.815%0.15445%0.451CS..Hα-helixtrans-62.8-43.3173.9-74.4161148.600111.1A222 S227 E228 G229 V236 T237 E242 G243 I244A222-E240 HydrophobicContact CB-CB 4.19Å; S227-E240 WeakPolarHBondContact CB-OE1 3.28Å; E228-E240 PolarHBondContact N-OE1 2.99Å; G229-E240 PolarHBondContact N-OE2 2.86Å; V236-E240 HydrophobicContact CG1-CB 3.79Å; T237-E240 WeakPolarHBondContact CB-OE2 3.44Å; T237-E240 WeakPolarHBondContact CG2-OE2 3Å; T237-E240 PolarHBondContact N-OE2 3.32Å; T237-E240 PolarHBondContact O-N 3.45Å; T237-E240 WeakPolarHBondContact OG1-CB 3.37Å; T237-E240 VanDerWaalsContact OG1-CD 3.27Å; T237-E240 WeakPolarHBondContact OG1-CG 3.32Å; T237-E240 PolarHBondContact OG1-N 3.42Å; T237-E240 PolarHBondContact OG1-OE2 3.24Å; E240-E242 PolarHBondContact O-N 2.99Å; E240-G243 PolarHBondContact O-N 3.41Å; E240-I244 WeakPolarHBondContact O-CG1 3.32Å; E240-I244 PolarHBondContact O-N 3.26Å
241L80.1Confident76Confident99 Ų9984.7 Ų84.752%0.51843%0.426SS..Hα-helixtrans-63.2-41.2176.6-175.762.9000112.5V236 T237 K238 I244 K245V236-L241 HydrophobicContact CG1-CB 4.15Å; T237-L241 WeakPolarHBondContact O-CB 3.15Å; T237-L241 PolarHBondContact O-N 2.81Å; K238-L241 PolarHBondContact O-N 2.93Å; L241-I244 PolarHBondContact O-N 3.18Å; L241-K245 WeakPolarHBondContact O-CB 3.49Å; L241-K245 PolarHBondContact O-N 2.94Å
242E83.3Confident77.4Confident97 Ų9783.4 Ų83.445%0.45342%0.418SS..Hα-helixtrans-62-44.7173.9-77.8170179.600111.1K238 K239 E240 I244 K245 E246K238-E242 WeakPolarHBondContact CE-OE1 3.23Å; K238-E242 WeakPolarHBondContact O-CB 3.12Å; K238-E242 VanDerWaalsContact O-CG 3.26Å; K238-E242 WeakPolarHBondContact O-CG 3.41Å; K238-E242 PolarHBondContact O-N 3.43Å; K239-E242 PolarHBondContact O-N 3.27Å; E240-E242 PolarHBondContact O-N 2.99Å; E242-I244 PolarHBondContact O-N 3.47Å; E242-K245 WeakPolarHBondContact O-CB 3.33Å; E242-K245 PolarHBondContact O-N 3.13Å; E242-E246 WeakPolarHBondContact O-CG 3.46Å; E242-E246 PolarHBondContact O-N 3.25Å
243G84.2Confident78.7Confident29 Ų2980 Ų8030%0.29941%0.408SS..Hα-helixtrans-61.7-42.4175.300000113.4K239 E240 K245 E246 L247K239-G243 PolarHBondContact O-N 2.76Å; E240-G243 PolarHBondContact O-N 3.41Å; G243-K245 VanDerWaalsContact C-N 3.32Å; G243-K245 PolarHBondContact O-N 3.41Å; G243-E246 PolarHBondContact O-N 3.42Å; G243-L247 WeakPolarHBondContact O-CB 3.37Å; G243-L247 WeakPolarHBondContact O-CG 3.15Å; G243-L247 PolarHBondContact O-N 3.4Å
244I78.6Confident80.2Confident9 Ų982.2 Ų82.25%0.04642%0.416CS..Hα-helixtrans-62.1-41.9173.8-70.5165.4000110.5A218 F219 A222 E240 L241 E242 L247 K248A218-I244 HydrophobicContact CB-CG1 3.88Å; F219-I244 HydrophobicContact CD1-CD1 3.96Å; F219-I244 HydrophobicContact CD2-CG2 3.96Å; F219-I244 HydrophobicContact CE1-CD1 4.21Å; F219-I244 HydrophobicContact CE1-CG2 4.08Å; F219-I244 HydrophobicContact CE2-CG2 3.46Å; F219-I244 VanDerWaalsContact CE2-CG2 3.46Å; F219-I244 HydrophobicContact CG-CD1 4.24Å; F219-I244 HydrophobicContact CG-CG2 4.47Å; F219-I244 HydrophobicContact CZ-CG2 3.53Å; A222-I244 HydrophobicContact CB-CD1 3.89Å; E240-I244 WeakPolarHBondContact O-CG1 3.32Å; E240-I244 PolarHBondContact O-N 3.26Å; L241-I244 PolarHBondContact O-N 3.18Å; E242-I244 PolarHBondContact O-N 3.47Å; I244-L247 PolarHBondContact O-N 3.41Å; I244-K248 VanDerWaalsContact O-CB 3.27Å; I244-K248 WeakPolarHBondContact O-CB 3.31Å; I244-K248 PolarHBondContact O-N 3.05Å
245K78.5Confident81.3Confident128 Ų12876.6 Ų76.656%0.55739%0.385SS*.Hα-helixtrans-63.8-44.6178.8-173.9-177.8175.8-171.60111.9L241 E242 G243 K248 D249L241-K245 WeakPolarHBondContact O-CB 3.49Å; L241-K245 PolarHBondContact O-N 2.94Å; E242-K245 WeakPolarHBondContact O-CB 3.33Å; E242-K245 PolarHBondContact O-N 3.13Å; G243-K245 VanDerWaalsContact C-N 3.32Å; G243-K245 PolarHBondContact O-N 3.41Å; K245-K248 WeakPolarHBondContact O-CB 3.24Å; K245-K248 PolarHBondContact O-N 2.95Å; K245-D249 WeakPolarHBondContact O-CB 3.28Å; K245-D249 VanDerWaalsContact O-CG 3.31Å; K245-D249 PolarHBondContact O-N 2.95Å
246E89Confident82.2Confident145 Ų14574.3 Ų74.368%0.67837%0.373SS*.Hα-helixtrans-62.4-43.5175.9-72.3-178.9-18000111.9E242 G243 D249 K250E242-E246 WeakPolarHBondContact O-CG 3.46Å; E242-E246 PolarHBondContact O-N 3.25Å; G243-E246 PolarHBondContact O-N 3.42Å; E246-D249 PolarHBondContact O-N 2.95Å; E246-K250 WeakPolarHBondContact O-CB 3.47Å; E246-K250 PolarHBondContact O-N 3.4Å
247L86.1Confident83.1Confident67 Ų6776.9 Ų76.935%0.35138%0.381SS..Hα-helixtrans-60.3-45.3173.9-79.7171.5000111.5A218 G243 I244 N251A218-L247 HydrophobicContact CB-CD1 3.7Å; G243-L247 WeakPolarHBondContact O-CB 3.37Å; G243-L247 WeakPolarHBondContact O-CG 3.15Å; G243-L247 PolarHBondContact O-N 3.4Å; I244-L247 PolarHBondContact O-N 3.41Å; L247-N251 WeakPolarHBondContact O-CB 3.45Å; L247-N251 PolarHBondContact O-N 3.29Å; L247-N251 PolarHBondContact O-ND2 2.85Å
248K80.8Confident83.2Confident92 Ų9278.6 Ų78.640%0.438%0.384SS..Hα-helixtrans-59.4-54.4177.2176-142.1163.5-159.20110.8I215 I244 K245 K250 N251 L252I215-K248 HydrophobicContact CD1-CB 4.33Å; I215-K248 HydrophobicContact CD1-CG 4.49Å; I215-K248 HydrophobicContact CG2-CB 4.29Å; I244-K248 VanDerWaalsContact O-CB 3.27Å; I244-K248 WeakPolarHBondContact O-CB 3.31Å; I244-K248 PolarHBondContact O-N 3.05Å; K245-K248 WeakPolarHBondContact O-CB 3.24Å; K245-K248 PolarHBondContact O-N 2.95Å; K248-K250 VanDerWaalsContact C-N 3.33Å; K248-K250 PolarHBondContact O-N 2.94Å; K248-N251 PolarHBondContact O-N 3.39Å; K248-L252 HydrophobicContact CD-CD1 4.25Å; K248-L252 HydrophobicContact CG-CD1 3.66Å; K248-L252 HydrophobicContact CG-CG 4.18Å; K248-L252 VanDerWaalsContact O-CB 3.3Å; K248-L252 WeakPolarHBondContact O-CB 3.21Å; K248-L252 VanDerWaalsContact O-CG 3.29Å; K248-L252 WeakPolarHBondContact O-CG 3.44Å; K248-L252 PolarHBondContact O-N 3.04Å
249D84.9Confident83.3Confident82 Ų8271.6 Ų71.644%0.43936%0.356SS..Hα-helixtrans-62.6-41.9-175-68.5-15.7000110.9K245 E246 A253K245-D249 WeakPolarHBondContact O-CB 3.28Å; K245-D249 VanDerWaalsContact O-CG 3.31Å; K245-D249 PolarHBondContact O-N 2.95Å; E246-D249 PolarHBondContact O-N 2.95Å; D249-A253 WeakPolarHBondContact O-CB 3.45Å; D249-A253 PolarHBondContact O-N 3.49Å
250K90.1Very high83.1Confident141 Ų14170.8 Ų70.861%0.61335%0.353SS*.Hα-helixtrans-63.7-50.7175.2-179.4-177177.1-176.20112.5E246 K248 A253 L254E246-K250 WeakPolarHBondContact O-CB 3.47Å; E246-K250 PolarHBondContact O-N 3.4Å; K248-K250 VanDerWaalsContact C-N 3.33Å; K248-K250 PolarHBondContact O-N 2.94Å; K250-A253 PolarHBondContact O-N 3.39Å; K250-L254 HydrophobicContact CG-CD1 4.38Å; K250-L254 WeakPolarHBondContact O-CG 2.95Å; K250-L254 PolarHBondContact O-N 3.04Å
251N83.1Confident83.1Confident16 Ų1673.3 Ų73.39%0.08637%0.367CS..Hα-helixtrans-73.7-35.9-173.2-78.3-54.3000112.5Y211 I215 L247 K248 A253 L254 F255Y211-N251 WeakPolarHBondContact O-CB 3.37Å; Y211-N251 VanDerWaalsContact O-CG 3.29Å; I215-N251 HydrophobicContact CD1-CB 3.99Å; I215-N251 HydrophobicContact CG1-CB 4.19Å; L247-N251 WeakPolarHBondContact O-CB 3.45Å; L247-N251 PolarHBondContact O-N 3.29Å; L247-N251 PolarHBondContact O-ND2 2.85Å; K248-N251 PolarHBondContact O-N 3.39Å; N251-A253 VanDerWaalsContact C-N 3.32Å; N251-A253 PolarHBondContact O-N 2.83Å; N251-L254 PolarHBondContact O-N 3.1Å; N251-F255 WeakPolarHBondContact O-CB 3.07Å; N251-F255 PolarHBondContact O-N 2.96Å
252L82.9Confident83.1Confident55 Ų5569.3 Ų69.329%0.28835%0.346SS..Hα-helixtrans-66-35.7174.5-70.3-177.3000111.9I212 I215 K248 F255 N256I212-L252 HydrophobicContact CD1-CD2 3.5Å; I215-L252 HydrophobicContact CD1-CG 4.46Å; K248-L252 HydrophobicContact CD-CD1 4.25Å; K248-L252 HydrophobicContact CG-CD1 3.66Å; K248-L252 HydrophobicContact CG-CG 4.18Å; K248-L252 VanDerWaalsContact O-CB 3.3Å; K248-L252 WeakPolarHBondContact O-CB 3.21Å; K248-L252 VanDerWaalsContact O-CG 3.29Å; K248-L252 WeakPolarHBondContact O-CG 3.44Å; K248-L252 PolarHBondContact O-N 3.04Å; L252-F255 PolarHBondContact O-N 3.47Å; L252-N256 VanDerWaalsContact O-CB 3.27Å; L252-N256 WeakPolarHBondContact O-CB 3.35Å; L252-N256 PolarHBondContact O-N 2.95Å
253A83.9Confident82.8Confident58 Ų5867.4 Ų67.448%0.47934%0.338SS..Hα-helixtrans-61.5-47.5172.500000111.6D249 K250 N251 N256 E257D249-A253 WeakPolarHBondContact O-CB 3.45Å; D249-A253 PolarHBondContact O-N 3.49Å; K250-A253 PolarHBondContact O-N 3.39Å; N251-A253 VanDerWaalsContact C-N 3.32Å; N251-A253 PolarHBondContact O-N 2.83Å; A253-N256 PolarHBondContact O-N 3.14Å; A253-E257 PolarHBondContact O-N 2.95Å
254L86.3Confident82.5Confident63 Ų6371.8 Ų71.833%0.3335%0.354SS..Hα-helixtrans-64.7-39.2176.9-69.7172.3000112.7Y211 K250 N251 Y258Y211-L254 HydrophobicContact CD1-CB 3.81Å; Y211-L254 HydrophobicContact CD1-CD1 4.38Å; Y211-L254 HydrophobicContact CE1-CB 3.73Å; Y211-L254 HydrophobicContact CE1-CD1 4.25Å; Y211-L254 HydrophobicContact CG-CB 4.47Å; K250-L254 HydrophobicContact CG-CD1 4.38Å; K250-L254 WeakPolarHBondContact O-CG 2.95Å; K250-L254 PolarHBondContact O-N 3.04Å; N251-L254 PolarHBondContact O-N 3.1Å; L254-Y258 WeakPolarHBondContact O-CB 3.42Å; L254-Y258 PolarHBondContact O-N 3.49Å
255F83.3Confident82.4Confident28 Ų2877.2 Ų77.212%0.12339%0.388CS..Hα-helixtrans-60.9-48.6174.7179.1-84.8000110.9M204 A207 Y211 I212 N251 L252 Y258 A259M204-F255 HydrophobicContact SD-CZ 4.13Å; A207-F255 HydrophobicContact CB-CD2 3.76Å; A207-F255 HydrophobicContact CB-CE2 3.65Å; Y211-F255 HydrophobicContact CD2-CB 3.97Å; Y211-F255 HydrophobicContact CD2-CD2 4.07Å; Y211-F255 HydrophobicContact CD2-CG 4.48Å; Y211-F255 HydrophobicContact CG-CB 4.2Å; I212-F255 HydrophobicContact CD1-CD2 4.47Å; I212-F255 HydrophobicContact CG1-CD2 4.33Å; N251-F255 WeakPolarHBondContact O-CB 3.07Å; N251-F255 PolarHBondContact O-N 2.96Å; L252-F255 PolarHBondContact O-N 3.47Å; F255-Y258 PolarHBondContact O-N 2.97Å; F255-A259 HydrophobicContact CE1-CB 4.44Å; F255-A259 WeakPolarHBondContact O-CB 3.19Å; F255-A259 PolarHBondContact O-N 3.41Å
256N81.6Confident82.3Confident36 Ų3672.2 Ų72.219%0.19337%0.367CS..Hα-helixtrans-62.9-42.6179.6-179.855.7000112V8 L252 A253 A259 K260V8-N256 HydrophobicContact CG1-CB 4.24Å; V8-N256 VanDerWaalsContact CG2-ND2 3.29Å; V8-N256 WeakPolarHBondContact CG2-ND2 3.22Å; L252-N256 VanDerWaalsContact O-CB 3.27Å; L252-N256 WeakPolarHBondContact O-CB 3.35Å; L252-N256 PolarHBondContact O-N 2.95Å; A253-N256 PolarHBondContact O-N 3.14Å; N256-A259 PolarHBondContact O-N 3.25Å; N256-K260 WeakPolarHBondContact O-CB 3.42Å; N256-K260 WeakPolarHBondContact O-CG 3.43Å; N256-K260 PolarHBondContact O-N 3.17Å
257E84.2Confident81.5Confident113 Ų11370.9 Ų70.953%0.52837%0.365SS..Hα-helixtrans-61.1-46.5174.8-173.9-174.4161.700111.5A253 A259 K260 N261A253-E257 PolarHBondContact O-N 2.95Å; E257-A259 PolarHBondContact O-N 2.91Å; E257-K260 PolarHBondContact O-N 3.22Å; E257-N261 WeakPolarHBondContact O-CB 3.34Å; E257-N261 VanDerWaalsContact O-CG 3.28Å; E257-N261 PolarHBondContact O-N 3.45Å; E257-N261 PolarHBondContact O-ND2 2.94Å
258Y81.6Confident80.7Confident73 Ų7369.3 Ų69.329%0.28636%0.358SS..Hα-helixtrans-60.8-44176.3179.2-86.7000111.9L203 M204 A207 Y211 L254 F255 L262L203-Y258 HydrophobicContact CB-CE1 4.44Å; L203-Y258 WeakPolarHBondContact O-CE1 3.38Å; M204-Y258 HydrophobicContact CE-CD1 3.46Å; M204-Y258 VanDerWaalsContact CE-CD1 3.46Å; M204-Y258 HydrophobicContact CE-CE1 3.43Å; M204-Y258 VanDerWaalsContact CE-CE1 3.43Å; A207-Y258 HydrophobicContact CB-CD1 3.47Å; A207-Y258 VanDerWaalsContact CB-CD1 3.47Å; A207-Y258 HydrophobicContact CB-CE1 3.59Å; A207-Y258 HydrophobicContact CB-CG 4.35Å; Y211-Y258 HydrophobicContact CE2-CD2 4.45Å; Y211-Y258 HydrophobicContact CE2-CG 4.08Å; L254-Y258 WeakPolarHBondContact O-CB 3.42Å; L254-Y258 PolarHBondContact O-N 3.49Å; F255-Y258 PolarHBondContact O-N 2.97Å; Y258-L262 VanDerWaalsContact O-CB 3.29Å; Y258-L262 WeakPolarHBondContact O-CB 3.41Å; Y258-L262 PolarHBondContact O-N 3.47Å
259A82.5Confident79.8Confident13 Ų1372.5 Ų72.511%0.10737%0.371CS..Hα-helixtrans-63.5-45.5178.100000112.3M204 F255 N256 E257 L262 M263M204-A259 HydrophobicContact CE-CB 4.01Å; M204-A259 HydrophobicContact SD-CB 3.59Å; M204-A259 VanDerWaalsContact SD-CB 3.59Å; F255-A259 HydrophobicContact CE1-CB 4.44Å; F255-A259 WeakPolarHBondContact O-CB 3.19Å; F255-A259 PolarHBondContact O-N 3.41Å; N256-A259 PolarHBondContact O-N 3.25Å; E257-A259 PolarHBondContact O-N 2.91Å; A259-L262 WeakPolarHBondContact O-CB 3.41Å; A259-L262 PolarHBondContact O-N 3.26Å; A259-M263 WeakPolarHBondContact O-CG 3.38Å; A259-M263 PolarHBondContact O-N 2.94Å
260K81.1Confident78.5Confident110 Ų11074 Ų7448%0.47839%0.386SS..Hα-helixtrans-60.8-51.7176.3-74.4-177.9178-170.60111.7N256 E257 L262 M263 D264N256-K260 WeakPolarHBondContact O-CB 3.42Å; N256-K260 WeakPolarHBondContact O-CG 3.43Å; N256-K260 PolarHBondContact O-N 3.17Å; E257-K260 PolarHBondContact O-N 3.22Å; K260-L262 PolarHBondContact O-N 2.77Å; K260-M263 PolarHBondContact O-N 2.83Å; K260-M263 VanDerWaalsContact O-N 3.11Å; K260-D264 WeakPolarHBondContact O-CB 3.13Å; K260-D264 VanDerWaalsContact O-CG 3.27Å; K260-D264 PolarHBondContact O-N 2.73Å
261N80.1Confident76.7Confident86 Ų8674 Ų7446%0.4640%0.398SS..Hα-helixtrans-57.6-38.1177.9-72.9-25000111.8E257 V265E257-N261 WeakPolarHBondContact O-CB 3.34Å; E257-N261 VanDerWaalsContact O-CG 3.28Å; E257-N261 PolarHBondContact O-N 3.45Å; E257-N261 PolarHBondContact O-ND2 2.94Å; N261-V265 WeakPolarHBondContact O-CB 3.29Å; N261-V265 VanDerWaalsContact O-CG2 3.25Å; N261-V265 WeakPolarHBondContact O-CG2 3.42Å; N261-V265 PolarHBondContact O-N 3.41Å
262L80.1Confident74.9Confident15 Ų1576 Ų768%0.07942%0.423CS..Hα-helixtrans-63.6-52.5175.4175.261.3000111.8L203 M204 Y258 A259 K260 D264 V265 L266L203-L262 HydrophobicContact CB-CD1 4.28Å; L203-L262 HydrophobicContact CB-CD2 3.43Å; L203-L262 VanDerWaalsContact CB-CD2 3.43Å; L203-L262 HydrophobicContact CB-CG 4.48Å; L203-L262 HydrophobicContact CD1-CD1 3.26Å; L203-L262 HydrophobicContact CD1-CD2 4.01Å; L203-L262 HydrophobicContact CD1-CG 4.26Å; L203-L262 HydrophobicContact CG-CD1 4.39Å; L203-L262 HydrophobicContact CG-CD2 4.36Å; M204-L262 HydrophobicContact CE-CD2 3.52Å; Y258-L262 VanDerWaalsContact O-CB 3.29Å; Y258-L262 WeakPolarHBondContact O-CB 3.41Å; Y258-L262 PolarHBondContact O-N 3.47Å; A259-L262 WeakPolarHBondContact O-CB 3.41Å; A259-L262 PolarHBondContact O-N 3.26Å; K260-L262 PolarHBondContact O-N 2.77Å; L262-D264 PolarHBondContact O-N 3.47Å; L262-V265 PolarHBondContact O-N 3.23Å; L262-V265 VanDerWaalsContact O-N 3.14Å; L262-L266 HydrophobicContact CD1-CD1 3.8Å; L262-L266 HydrophobicContact CD1-CD2 4.4Å; L262-L266 HydrophobicContact CD1-CG 3.83Å; L262-L266 HydrophobicContact CG-CD1 3.99Å; L262-L266 HydrophobicContact CG-CG 4.31Å; L262-L266 WeakPolarHBondContact O-CG 3.41Å; L262-L266 PolarHBondContact O-N 3.2Å
263M76.9Confident73Confident56 Ų5677.1 Ų77.128%0.27644%0.435SS..Hα-helixtrans-60-37.5-178.7-65.5-67.4-79.100111.2T200 A259 K260 L266 N267 V268T200-M263 HydrophobicContact CG2-SD 3.92Å; A259-M263 WeakPolarHBondContact O-CG 3.38Å; A259-M263 PolarHBondContact O-N 2.94Å; K260-M263 PolarHBondContact O-N 2.83Å; K260-M263 VanDerWaalsContact O-N 3.11Å; M263-L266 PolarHBondContact O-N 2.94Å; M263-N267 PolarHBondContact O-N 3.4Å; M263-N267 VanDerWaalsContact O-N 3.12Å; M263-V268 HydrophobicContact CE-CB 3.63Å; M263-V268 HydrophobicContact CE-CG1 3.23Å; M263-V268 PolarHBondContact O-N 2.87Å; M263-V268 HydrophobicContact SD-CB 3.99Å; M263-V268 HydrophobicContact SD-CG1 4.14Å; M263-V268 HydrophobicContact SD-CG2 4.41Å
264D77.8Confident71.1Confident121 Ų12177.3 Ų77.365%0.64743%0.433SS*.Hα-helixtrans-63.7-46.5174.2-68.7-23.6000112K260 L262 L266 N267K260-D264 WeakPolarHBondContact O-CB 3.13Å; K260-D264 VanDerWaalsContact O-CG 3.27Å; K260-D264 PolarHBondContact O-N 2.73Å; L262-D264 PolarHBondContact O-N 3.47Å; D264-L266 VanDerWaalsContact C-N 3.32Å; D264-L266 PolarHBondContact O-N 2.87Å; D264-N267 PolarHBondContact O-N 3.28Å
265V76.5Confident69.3Low123 Ų12382.6 Ų82.675%0.74546%0.462SS*.Hα-helixtrans-63.2-38.7177.1167.30000111.8N261 L262 N267N261-V265 WeakPolarHBondContact O-CB 3.29Å; N261-V265 VanDerWaalsContact O-CG2 3.25Å; N261-V265 WeakPolarHBondContact O-CG2 3.42Å; N261-V265 PolarHBondContact O-N 3.41Å; L262-V265 PolarHBondContact O-N 3.23Å; L262-V265 VanDerWaalsContact O-N 3.14Å; V265-N267 PolarHBondContact O-N 3.41Å
266L75.2Confident67.5Low23 Ų2383.8 Ų83.812%0.1247%0.468CS..THydrogen-bonded Turntrans-77.2-1.8177-61.5-173.6000112.9N196 L199 L262 M263 D264 V268N196-L266 PolarHBondContact ND2-O 2.86Å; N196-L266 PolarHBondContact OD1-O 2.81Å; L199-L266 HydrophobicContact CB-CD1 4.21Å; L199-L266 HydrophobicContact CD2-CD1 4.28Å; L199-L266 HydrophobicContact CD2-CD2 3.34Å; L199-L266 HydrophobicContact CD2-CG 4.45Å; L199-L266 HydrophobicContact CG-CD1 4.08Å; L199-L266 HydrophobicContact CG-CD2 4.02Å; L262-L266 HydrophobicContact CD1-CD1 3.8Å; L262-L266 HydrophobicContact CD1-CD2 4.4Å; L262-L266 HydrophobicContact CD1-CG 3.83Å; L262-L266 HydrophobicContact CG-CD1 3.99Å; L262-L266 HydrophobicContact CG-CG 4.31Å; L262-L266 WeakPolarHBondContact O-CG 3.41Å; L262-L266 PolarHBondContact O-N 3.2Å; M263-L266 PolarHBondContact O-N 2.94Å; D264-L266 VanDerWaalsContact C-N 3.32Å; D264-L266 PolarHBondContact O-N 2.87Å; L266-V268 HydrophobicContact CB-CG2 3.63Å; L266-V268 PolarHBondContact O-N 3.49Å
267N73.6Confident66.6Low118 Ų11884.8 Ų84.863%0.63148%0.479SS*.THydrogen-bonded Turntrans5128.9-173-169.442.5000112.1M263 D264 V265 K269M263-N267 PolarHBondContact O-N 3.4Å; M263-N267 VanDerWaalsContact O-N 3.12Å; D264-N267 PolarHBondContact O-N 3.28Å; V265-N267 PolarHBondContact O-N 3.41Å; N267-K269 PolarHBondContact O-N 2.82Å
268V68.1Low65.3Low34 Ų3483.4 Ų83.421%0.20649%0.486CS..  trans-79.195.1173.9-174.50000106.1N196 M263 L266N196-V268 HydrophobicContact CB-CG2 3.43Å; N196-V268 VanDerWaalsContact CB-CG2 3.43Å; N196-V268 WeakPolarHBondContact ND2-CG2 3.39Å; M263-V268 HydrophobicContact CE-CB 3.63Å; M263-V268 HydrophobicContact CE-CG1 3.23Å; M263-V268 PolarHBondContact O-N 2.87Å; M263-V268 HydrophobicContact SD-CB 3.99Å; M263-V268 HydrophobicContact SD-CG1 4.14Å; M263-V268 HydrophobicContact SD-CG2 4.41Å; L266-V268 HydrophobicContact CB-CG2 3.63Å; L266-V268 PolarHBondContact O-N 3.49Å
269K62.2Low64.3Low158 Ų15886.2 Ų86.269%0.68751%0.506SS*.  trans-60.1140.8170.6-63.6-178.7-176.7175.40107.5N267 T271N267-K269 PolarHBondContact O-N 2.82Å; K269-T271 PolarHBondContact O-N 3.37Å
270P56.7Low63.1Low113 Ų11390.4 Ų90.473%0.73452%0.523SS*.  trans-50.3124.5161.222.4-29.9000105.7G272P270-G272 PolarHBondContact O-N 2.89Å
271T53.2Low61.9Low141 Ų14187.6 Ų87.687%0.86551%0.511SS*.  trans-61.984.7162.128.80000104.5K269 S273K269-T271 PolarHBondContact O-N 3.37Å; T271-S273 PolarHBondContact O-N 2.92Å
272G46Very low60.9Low60 Ų6085.3 Ų85.362%0.61951%0.508SS*.  trans-50.1122.6-17500000105.9P270 S274P270-G272 PolarHBondContact O-N 2.89Å; G272-S274 PolarHBondContact O-N 3.2Å
273S41.6Very low60.2Low78 Ų7889.7 Ų89.755%0.54553%0.531SS..  trans6.193174.1-59.90000111.3T271 N275T271-S273 PolarHBondContact O-N 2.92Å; S273-N275 PolarHBondContact O-N 3.29Å
274S44.7Very low59.6Low61 Ų6193.7 Ų93.743%0.42755%0.548SS..  trans-40.4126.5158.552.90000105.2G272 I276G272-S274 PolarHBondContact O-N 3.2Å; S274-I276 CarbonylContact O-C 3.58Å; S274-I276 WeakPolarHBondContact O-CA 3.27Å; S274-I276 PolarHBondContact O-N 2.86Å; S274-I276 VanDerWaalsContact O-O 3.12Å
275N48.1Very low59.1Low175 Ų17590.6 Ų90.694%0.93654%0.536SS*.SBendtrans-56.64.8-173.9-76.9-38.2000114S273 S277S273-N275 PolarHBondContact O-N 3.29Å; N275-S277 PolarHBondContact O-N 2.82Å
276I46.2Very low58.5Low52 Ų5287 Ų8727%0.26752%0.515SS..  trans-56.6110.5163.1-57.1-172.2000108.7S274 Q280 Q281S274-I276 CarbonylContact O-C 3.58Å; S274-I276 WeakPolarHBondContact O-CA 3.27Å; S274-I276 PolarHBondContact O-N 2.86Å; S274-I276 VanDerWaalsContact O-O 3.12Å; I276-Q280 VanDerWaalsContact CA-OE1 3.31Å; I276-Q280 HydrophobicContact CB-CB 4.39Å; I276-Q280 HydrophobicContact CG2-CB 3.1Å; I276-Q280 HydrophobicContact CG2-CG 4.12Å; I276-Q281 HydrophobicContact CG2-CG 4.1Å; I276-Q281 PolarHBondContact O-NE2 2.83Å
277S61.3Low58.2Low58 Ų5888.8 Ų88.841%0.40653%0.527SS..  trans-51.8156176.665.80000111.5N275 L279 Q280 Q281N275-S277 PolarHBondContact O-N 2.82Å; S277-L279 PolarHBondContact O-N 3.19Å; S277-Q280 VanDerWaalsContact N-OE1 3.14Å; S277-Q280 PolarHBondContact O-N 3.05Å; S277-Q280 PolarHBondContact OG-N 3.43Å; S277-Q280 PolarHBondContact OG-OE1 3.45Å; S277-Q281 PolarHBondContact O-N 2.76Å; S277-Q281 VanDerWaalsContact O-N 3.11Å
278A57Low57.9Low83 Ų8390.3 Ų90.369%0.68653%0.53SS*.Hα-helixtrans-48.9-31.6173.800000112.8G282A278-G282 PolarHBondContact O-N 3.08Å
279L61.9Low57.7Low133 Ų13392.9 Ų92.970%0.69655%0.549SS*.Hα-helixtrans-62.9-46175.5-121.7155.1000112.7S277 G282 I283S277-L279 PolarHBondContact O-N 3.19Å; L279-G282 PolarHBondContact O-N 2.78Å; L279-I283 HydrophobicContact CD2-CD1 4.45Å; L279-I283 VanDerWaalsContact O-CG1 3.27Å; L279-I283 WeakPolarHBondContact O-CG1 3.18Å; L279-I283 PolarHBondContact O-N 3.47Å; L279-I283 VanDerWaalsContact O-N 3.1Å
280Q57.5Low57.8Low100 Ų10088.5 Ų88.547%0.46754%0.536SS..Hα-helixtrans-74.6-32179.4-73.1169.7-66.100112.2I276 S277 I283 Q284I276-Q280 VanDerWaalsContact CA-OE1 3.31Å; I276-Q280 HydrophobicContact CB-CB 4.39Å; I276-Q280 HydrophobicContact CG2-CB 3.1Å; I276-Q280 HydrophobicContact CG2-CG 4.12Å; S277-Q280 VanDerWaalsContact N-OE1 3.14Å; S277-Q280 PolarHBondContact O-N 3.05Å; S277-Q280 PolarHBondContact OG-N 3.43Å; S277-Q280 PolarHBondContact OG-OE1 3.45Å; Q280-I283 PolarHBondContact O-N 3.12Å; Q280-Q284 PolarHBondContact O-N 3.05Å; Q280-Q284 VanDerWaalsContact O-N 3.08Å
281Q54.4Low58.4Low51 Ų5185.2 Ų85.224%0.23852%0.518CS..Hα-helixtrans-62-45.1170.6-73.8172.51000110.7I276 S277 I283 Q284 S285I276-Q281 HydrophobicContact CG2-CG 4.1Å; I276-Q281 PolarHBondContact O-NE2 2.83Å; S277-Q281 PolarHBondContact O-N 2.76Å; S277-Q281 VanDerWaalsContact O-N 3.11Å; Q281-I283 PolarHBondContact O-N 2.96Å; Q281-Q284 PolarHBondContact O-N 3.29Å; Q281-S285 PolarHBondContact O-N 3.19Å
282G59.8Low58.7Low38 Ų3883.4 Ų83.439%0.39250%0.5SS..Hα-helixtrans-63-26.3174.100000114A278 L279 S285 V286A278-G282 PolarHBondContact O-N 3.08Å; L279-G282 PolarHBondContact O-N 2.78Å; G282-S285 PolarHBondContact O-OG 3.1Å; G282-V286 WeakPolarHBondContact O-CG2 3Å
283I66.5Low59.3Low108 Ų10883 Ų8355%0.55449%0.491SS*.Hα-helixtrans-75-38.5174.5-70.7164.2000111.4L279 Q280 Q281 S285 V286L279-I283 HydrophobicContact CD2-CD1 4.45Å; L279-I283 VanDerWaalsContact O-CG1 3.27Å; L279-I283 WeakPolarHBondContact O-CG1 3.18Å; L279-I283 PolarHBondContact O-N 3.47Å; L279-I283 VanDerWaalsContact O-N 3.1Å; Q280-I283 PolarHBondContact O-N 3.12Å; Q281-I283 PolarHBondContact O-N 2.96Å; I283-S285 VanDerWaalsContact C-N 3.26Å; I283-S285 PolarHBondContact O-N 2.88Å; I283-V286 WeakPolarHBondContact O-CB 3.44Å; I283-V286 PolarHBondContact O-N 3.19Å; I283-V286 VanDerWaalsContact O-N 3.17Å
284Q64.6Low60.6Low139 Ų13983.1 Ų83.165%0.6549%0.485SS*.Hα-helixtrans-64.3-31178.8-75.7-176.4-20.200112.8Q280 Q281 V286Q280-Q284 PolarHBondContact O-N 3.05Å; Q280-Q284 VanDerWaalsContact O-N 3.08Å; Q281-Q284 PolarHBondContact O-N 3.29Å; Q284-V286 PolarHBondContact O-N 3.15Å
285S66Low61.7Low56 Ų5685.8 Ų85.839%0.39249%0.491SS..THydrogen-bonded Turntrans-78.94.2176.455.20000114.5Q281 G282 I283 T287Q281-S285 PolarHBondContact O-N 3.19Å; G282-S285 PolarHBondContact O-OG 3.1Å; I283-S285 VanDerWaalsContact C-N 3.26Å; I283-S285 PolarHBondContact O-N 2.88Å; S285-T287 PolarHBondContact O-N 3.28Å
286V64.4Low62.4Low48 Ų4881.2 Ų81.229%0.29147%0.472SS..  trans-83.7111.6175.8178.90000108.3G282 I283 Q284 T290 A291 L294G282-V286 WeakPolarHBondContact O-CG2 3Å; I283-V286 WeakPolarHBondContact O-CB 3.44Å; I283-V286 PolarHBondContact O-N 3.19Å; I283-V286 VanDerWaalsContact O-N 3.17Å; Q284-V286 PolarHBondContact O-N 3.15Å; V286-T290 HydrophobicContact CG1-CG2 3.76Å; V286-A291 HydrophobicContact CG1-CB 3.92Å; V286-L294 HydrophobicContact CG1-CD1 4.03Å
287T68.5Low63.3Low61 Ų6183 Ų8337%0.37448%0.482SS..  trans-58.6155.4173.175.10000111.4S285 S289 T290 A291S285-T287 PolarHBondContact O-N 3.28Å; T287-S289 PolarHBondContact O-N 3.11Å; T287-T290 CarbonylContact O-C 3.4Å; T287-T290 WeakPolarHBondContact O-CA 3.33Å; T287-T290 WeakPolarHBondContact O-CB 3.35Å; T287-T290 PolarHBondContact O-N 2.98Å; T287-T290 PolarHBondContact OG1-N 3.46Å; T287-T290 PolarHBondContact OG1-OG1 2.86Å; T287-A291 PolarHBondContact O-N 2.92Å
288E67.5Low63.9Low150 Ų15085.5 Ų85.570%0.70149%0.49SS*.Hα-helixtrans-56.1-38.4178.8-170.6178.1178.100112.5A291 Q292E288-A291 WeakPolarHBondContact O-CB 3.49Å; E288-A291 PolarHBondContact O-N 3.49Å; E288-Q292 WeakPolarHBondContact O-CG 3.22Å; E288-Q292 PolarHBondContact O-N 2.9Å
289S64.8Low64.5Low87 Ų8785 Ų8561%0.60848%0.476SS*.Hα-helixtrans-63.7-43.1175.1-179.50000112T287 A291 Q292 A293T287-S289 PolarHBondContact O-N 3.11Å; S289-A291 VanDerWaalsContact C-N 3.33Å; S289-Q292 PolarHBondContact O-N 3.36Å; S289-A293 PolarHBondContact O-N 2.96Å
290T64Low64.8Low67 Ų6781.1 Ų81.141%0.41146%0.46SS..Hα-helixtrans-64.8-39.5174.5-50.10000111V286 T287 A293 L294V286-T290 HydrophobicContact CG1-CG2 3.76Å; T287-T290 CarbonylContact O-C 3.4Å; T287-T290 WeakPolarHBondContact O-CA 3.33Å; T287-T290 WeakPolarHBondContact O-CB 3.35Å; T287-T290 PolarHBondContact O-N 2.98Å; T287-T290 PolarHBondContact OG1-N 3.46Å; T287-T290 PolarHBondContact OG1-OG1 2.86Å; T290-A293 PolarHBondContact O-N 3.28Å; T290-L294 HydrophobicContact CG2-CD1 4.34Å; T290-L294 WeakPolarHBondContact O-CB 3.29Å; T290-L294 VanDerWaalsContact O-CG 3.32Å; T290-L294 WeakPolarHBondContact O-CG 3.25Å; T290-L294 PolarHBondContact O-N 3.46Å
291A69.3Low64.9Low44 Ų4480.7 Ų80.736%0.36446%0.46SS..Hα-helixtrans-63.8-42.417700000112V286 T287 E288 S289 L294 E295V286-A291 HydrophobicContact CG1-CB 3.92Å; T287-A291 PolarHBondContact O-N 2.92Å; E288-A291 WeakPolarHBondContact O-CB 3.49Å; E288-A291 PolarHBondContact O-N 3.49Å; S289-A291 VanDerWaalsContact C-N 3.33Å; A291-L294 PolarHBondContact O-N 3.34Å; A291-E295 WeakPolarHBondContact O-CB 3.49Å; A291-E295 PolarHBondContact O-N 2.92Å
292Q59.4Low65.7Low103 Ų10387 Ų8748%0.48148%0.482SS..Hα-helixtrans-65.2-38.9175.4-73.3172.9-1.200112.4E288 S289 E295 S296E288-Q292 WeakPolarHBondContact O-CG 3.22Å; E288-Q292 PolarHBondContact O-N 2.9Å; S289-Q292 PolarHBondContact O-N 3.36Å; Q292-E295 PolarHBondContact O-N 3.39Å; Q292-S296 WeakPolarHBondContact O-CB 3.24Å; Q292-S296 PolarHBondContact O-N 2.89Å; Q292-S296 PolarHBondContact O-OG 3.47Å
293A58.7Low66.2Low51 Ų5192.9 Ų92.942%0.42149%0.493SS..Hα-helixtrans-64.1-43.6173.900000111.3S289 T290 S296 I297S289-A293 PolarHBondContact O-N 2.96Å; T290-A293 PolarHBondContact O-N 3.28Å; A293-S296 PolarHBondContact O-N 3.21Å; A293-I297 WeakPolarHBondContact O-CG1 3.18Å; A293-I297 PolarHBondContact O-N 2.74Å
294L69.1Low66.7Low81 Ų8195.1 Ų95.142%0.42450%0.496SS..Hα-helixtrans-63.1-42.9174.3-73.7171.6000111.8V286 T290 A291 S296 I297 L298V286-L294 HydrophobicContact CG1-CD1 4.03Å; T290-L294 HydrophobicContact CG2-CD1 4.34Å; T290-L294 WeakPolarHBondContact O-CB 3.29Å; T290-L294 VanDerWaalsContact O-CG 3.32Å; T290-L294 WeakPolarHBondContact O-CG 3.25Å; T290-L294 PolarHBondContact O-N 3.46Å; A291-L294 PolarHBondContact O-N 3.34Å; L294-S296 VanDerWaalsContact C-N 3.31Å; L294-S296 PolarHBondContact O-N 2.86Å; L294-I297 PolarHBondContact O-N 2.9Å; L294-L298 WeakPolarHBondContact O-CB 3.18Å; L294-L298 VanDerWaalsContact O-CG 3.26Å; L294-L298 WeakPolarHBondContact O-CG 3.4Å; L294-L298 PolarHBondContact O-N 3.5Å
295E67.1Low67.2Low116 Ų11691.9 Ų91.954%0.54249%0.485SS..Hα-helixtrans-57.6-45.5174.9-174.5-173169.500111.1A291 Q292 I297 L298 N299A291-E295 WeakPolarHBondContact O-CB 3.49Å; A291-E295 PolarHBondContact O-N 2.92Å; Q292-E295 PolarHBondContact O-N 3.39Å; E295-I297 PolarHBondContact O-N 3.05Å; E295-L298 PolarHBondContact O-N 2.95Å; E295-N299 WeakPolarHBondContact O-CB 3.35Å; E295-N299 PolarHBondContact O-N 2.82Å; E295-N299 PolarHBondContact O-ND2 3.45Å
296S62.6Low67.9Low79 Ų7991.8 Ų91.855%0.55249%0.488SS*.Hα-helixtrans-61.8-43.8177.7-60.30000111.8Q292 A293 L294 N299 S300Q292-S296 WeakPolarHBondContact O-CB 3.24Å; Q292-S296 PolarHBondContact O-N 2.89Å; Q292-S296 PolarHBondContact O-OG 3.47Å; A293-S296 PolarHBondContact O-N 3.21Å; L294-S296 VanDerWaalsContact C-N 3.31Å; L294-S296 PolarHBondContact O-N 2.86Å; S296-N299 PolarHBondContact O-N 3.23Å; S296-S300 PolarHBondContact O-N 3.16Å
297I64.4Low68.4Low91 Ų9192 Ų9247%0.46749%0.489SS..Hα-helixtrans-63.4-46.4175.2-67.4166.3000110.5A293 L294 E295 N299 S300 L301A293-I297 WeakPolarHBondContact O-CG1 3.18Å; A293-I297 PolarHBondContact O-N 2.74Å; L294-I297 PolarHBondContact O-N 2.9Å; E295-I297 PolarHBondContact O-N 3.05Å; I297-N299 VanDerWaalsContact C-N 3.33Å; I297-N299 PolarHBondContact O-N 2.88Å; I297-S300 WeakPolarHBondContact O-CB 3.45Å; I297-S300 PolarHBondContact O-N 3.44Å; I297-S300 VanDerWaalsContact O-N 3.13Å; I297-S300 PolarHBondContact O-OG 3.28Å; I297-L301 HydrophobicContact CG2-CD1 3.97Å; I297-L301 HydrophobicContact CG2-CG 4.3Å; I297-L301 WeakPolarHBondContact O-CG 3.4Å; I297-L301 PolarHBondContact O-N 2.96Å
298L75.6Confident69Low110 Ų11095.1 Ų95.158%0.57650%0.5SS*.Hα-helixtrans-63.2-38.6179.7-74.5170.6000112.2L294 E295 L301 R302L294-L298 WeakPolarHBondContact O-CB 3.18Å; L294-L298 VanDerWaalsContact O-CG 3.26Å; L294-L298 WeakPolarHBondContact O-CG 3.4Å; L294-L298 PolarHBondContact O-N 3.5Å; E295-L298 PolarHBondContact O-N 2.95Å; L298-L301 PolarHBondContact O-N 3.13Å; L298-R302 WeakPolarHBondContact O-CB 3.48Å; L298-R302 PolarHBondContact O-N 3.43Å
299N68.1Low69.7Low73 Ų7394.4 Ų94.439%0.3950%0.496SS..Hα-helixtrans-64.3-40.9173.4-76.8-27.3000111.5E295 S296 I297 R302 Y303E295-N299 WeakPolarHBondContact O-CB 3.35Å; E295-N299 PolarHBondContact O-N 2.82Å; E295-N299 PolarHBondContact O-ND2 3.45Å; S296-N299 PolarHBondContact O-N 3.23Å; I297-N299 VanDerWaalsContact C-N 3.33Å; I297-N299 PolarHBondContact O-N 2.88Å; N299-R302 PolarHBondContact O-N 3.5Å; N299-Y303 PolarHBondContact O-N 3.16Å; N299-Y303 VanDerWaalsContact O-N 3.1Å
300S68.6Low70.5Confident51 Ų5192.6 Ų92.636%0.35749%0.486SS..Hα-helixtrans-65-42.7174.680.50000112.5S296 I297 Y303 Y304S296-S300 PolarHBondContact O-N 3.16Å; I297-S300 WeakPolarHBondContact O-CB 3.45Å; I297-S300 PolarHBondContact O-N 3.44Å; I297-S300 VanDerWaalsContact O-N 3.13Å; I297-S300 PolarHBondContact O-OG 3.28Å; S300-Y303 WeakPolarHBondContact O-CB 3.28Å; S300-Y303 PolarHBondContact O-N 3.04Å; S300-Y304 WeakPolarHBondContact O-CD2 3.39Å; S300-Y304 PolarHBondContact O-N 3.39Å
301L59.2Low71.4Confident91 Ų9193.3 Ų93.348%0.47649%0.488SS..Hα-helixtrans-64.1-42.3177-72.8173.7000111.2I297 L298 Y303 Y304 V305I297-L301 HydrophobicContact CG2-CD1 3.97Å; I297-L301 HydrophobicContact CG2-CG 4.3Å; I297-L301 WeakPolarHBondContact O-CG 3.4Å; I297-L301 PolarHBondContact O-N 2.96Å; L298-L301 PolarHBondContact O-N 3.13Å; L301-Y303 VanDerWaalsContact C-N 3.26Å; L301-Y303 PolarHBondContact O-N 2.9Å; L301-Y304 PolarHBondContact O-N 3.34Å; L301-V305 WeakPolarHBondContact O-CB 3.39Å; L301-V305 VanDerWaalsContact O-CG2 3.31Å; L301-V305 WeakPolarHBondContact O-CG2 3.05Å; L301-V305 PolarHBondContact O-N 3.45Å
302R72.2Confident72.3Confident183 Ų18394.7 Ų94.769%0.69149%0.491SS*.Hα-helixtrans-56.5-43.3174.2-177.2-175.7-71.8165.4-1.8111L298 N299 A306L298-R302 WeakPolarHBondContact O-CB 3.48Å; L298-R302 PolarHBondContact O-N 3.43Å; N299-R302 PolarHBondContact O-N 3.5Å; R302-A306 WeakPolarHBondContact O-CB 3.15Å; R302-A306 PolarHBondContact O-N 2.98Å
303Y70.2Confident73.6Confident161 Ų16197.4 Ų97.463%0.63150%0.497SS*.Hα-helixtrans-62.4-50.7175.5176.2-96.2000112N299 S300 L301 V305 A306 T307N299-Y303 PolarHBondContact O-N 3.16Å; N299-Y303 VanDerWaalsContact O-N 3.1Å; S300-Y303 WeakPolarHBondContact O-CB 3.28Å; S300-Y303 PolarHBondContact O-N 3.04Å; L301-Y303 VanDerWaalsContact C-N 3.26Å; L301-Y303 PolarHBondContact O-N 2.9Å; Y303-V305 PolarHBondContact O-N 3.38Å; Y303-A306 PolarHBondContact O-N 2.91Å; Y303-T307 PolarHBondContact O-N 3.41Å; Y303-T307 PolarHBondContact O-OG1 2.92Å; Y303-T307 VanDerWaalsContact O-OG1 3.09Å
304Y75.8Confident75.1Confident156 Ų15699.8 Ų99.861%0.61250%0.502SS*.Hα-helixtrans-63.3-40.2-179.6-74.6-64000113.3S300 L301 T307 Q308S300-Y304 WeakPolarHBondContact O-CD2 3.39Å; S300-Y304 PolarHBondContact O-N 3.39Å; L301-Y304 PolarHBondContact O-N 3.34Å; Y304-T307 PolarHBondContact O-N 3.14Å; Y304-Q308 WeakPolarHBondContact O-CB 3.42Å; Y304-Q308 PolarHBondContact O-N 3.17Å
305V75.2Confident75.9Confident71 Ų71100.7 Ų100.743%0.4351%0.506SS..Hα-helixtrans-65.2-41.6176.6171.50000110.8L301 Y303 Q308 Q309L301-V305 WeakPolarHBondContact O-CB 3.39Å; L301-V305 VanDerWaalsContact O-CG2 3.31Å; L301-V305 WeakPolarHBondContact O-CG2 3.05Å; L301-V305 PolarHBondContact O-N 3.45Å; Y303-V305 PolarHBondContact O-N 3.38Å; V305-Q308 PolarHBondContact O-N 2.82Å; V305-Q309 HydrophobicContact CG1-CG 4.45Å; V305-Q309 WeakPolarHBondContact O-CB 3.26Å; V305-Q309 VanDerWaalsContact O-CG 3.31Å; V305-Q309 WeakPolarHBondContact O-CG 3.3Å; V305-Q309 PolarHBondContact O-N 3.34Å
306A81.4Confident76.7Confident53 Ų53102 Ų10244%0.43851%0.506SS..Hα-helixtrans-62.2-43.4175.700000111.8R302 Y303 Q309 A310R302-A306 WeakPolarHBondContact O-CB 3.15Å; R302-A306 PolarHBondContact O-N 2.98Å; Y303-A306 PolarHBondContact O-N 2.91Å; A306-Q309 PolarHBondContact O-N 3.39Å; A306-A310 PolarHBondContact O-N 3.24Å
307T74.5Confident77.8Confident53 Ų53101.6 Ų101.633%0.32550%0.497SS..Hα-helixtrans-62.4-46.3174.9-57.60000111.4Y303 Y304 Q309 A310 D311Y303-T307 PolarHBondContact O-N 3.41Å; Y303-T307 PolarHBondContact O-OG1 2.92Å; Y303-T307 VanDerWaalsContact O-OG1 3.09Å; Y304-T307 PolarHBondContact O-N 3.14Å; T307-Q309 VanDerWaalsContact C-N 3.33Å; T307-Q309 PolarHBondContact O-N 2.94Å; T307-A310 WeakPolarHBondContact O-CA 3.42Å; T307-A310 WeakPolarHBondContact O-CB 3.15Å; T307-A310 PolarHBondContact O-N 3.04Å; T307-A310 VanDerWaalsContact O-N 3.08Å; T307-D311 PolarHBondContact O-N 2.85Å
308Q80.5Confident78.9Confident127 Ų127100.2 Ų100.259%0.59349%0.493SS*.Hα-helixtrans-63.1-38.8178.1-172.117949.700112.1Y304 V305 A310 D311 V312Y304-Q308 WeakPolarHBondContact O-CB 3.42Å; Y304-Q308 PolarHBondContact O-N 3.17Å; V305-Q308 PolarHBondContact O-N 2.82Å; Q308-A310 VanDerWaalsContact C-N 3.3Å; Q308-A310 PolarHBondContact O-N 3.26Å; Q308-D311 PolarHBondContact O-N 2.95Å; Q308-V312 HydrophobicContact CG-CG2 4.47Å; Q308-V312 WeakPolarHBondContact O-CB 3.36Å; Q308-V312 VanDerWaalsContact O-CG2 3.29Å; Q308-V312 WeakPolarHBondContact O-CG2 3.45Å; Q308-V312 PolarHBondContact O-N 2.89Å
309Q82.5Confident79.3Confident135 Ų13599.5 Ų99.563%0.63149%0.49SS*.Hα-helixtrans-62.6-38.4173.8-77.1179.7-9.900111.8V305 A306 T307 R313V305-Q309 HydrophobicContact CG1-CG 4.45Å; V305-Q309 WeakPolarHBondContact O-CB 3.26Å; V305-Q309 VanDerWaalsContact O-CG 3.31Å; V305-Q309 WeakPolarHBondContact O-CG 3.3Å; V305-Q309 PolarHBondContact O-N 3.34Å; A306-Q309 PolarHBondContact O-N 3.39Å; T307-Q309 VanDerWaalsContact C-N 3.33Å; T307-Q309 PolarHBondContact O-N 2.94Å; Q309-R313 WeakPolarHBondContact O-CB 3.35Å; Q309-R313 PolarHBondContact O-N 2.94Å
310A82.3Confident80.1Confident48 Ų48101.3 Ų101.340%0.39750%0.499SS..Hα-helixtrans-64.7-44.8173.600000111.5A306 T307 Q308 R313 I314A306-A310 PolarHBondContact O-N 3.24Å; T307-A310 WeakPolarHBondContact O-CA 3.42Å; T307-A310 WeakPolarHBondContact O-CB 3.15Å; T307-A310 PolarHBondContact O-N 3.04Å; T307-A310 VanDerWaalsContact O-N 3.08Å; Q308-A310 VanDerWaalsContact C-N 3.3Å; Q308-A310 PolarHBondContact O-N 3.26Å; A310-R313 WeakPolarHBondContact O-CB 3.32Å; A310-R313 PolarHBondContact O-N 3.2Å; A310-I314 WeakPolarHBondContact O-CG1 3.44Å; A310-I314 PolarHBondContact O-N 2.87Å
311D83.1Confident80.7Confident83 Ų83104 Ų10444%0.44451%0.506SS..Hα-helixtrans-63.2-45.1177.9-68.6-22.6000112T307 Q308 R313 I314 I315T307-D311 PolarHBondContact O-N 2.85Å; Q308-D311 PolarHBondContact O-N 2.95Å; D311-R313 PolarHBondContact O-N 3.02Å; D311-I314 PolarHBondContact O-N 3.47Å; D311-I314 VanDerWaalsContact O-N 3.13Å; D311-I315 VanDerWaalsContact O-CG1 3.3Å; D311-I315 WeakPolarHBondContact O-CG1 3.36Å; D311-I315 PolarHBondContact O-N 3.38Å
312V87.4Confident81.7Confident72 Ų72105.6 Ų105.644%0.43651%0.509SS..Hα-helixtrans-61.1-37.5176169.40000110.9Q308 R316Q308-V312 HydrophobicContact CG-CG2 4.47Å; Q308-V312 WeakPolarHBondContact O-CB 3.36Å; Q308-V312 VanDerWaalsContact O-CG2 3.29Å; Q308-V312 WeakPolarHBondContact O-CG2 3.45Å; Q308-V312 PolarHBondContact O-N 2.89Å; V312-R316 VanDerWaalsContact O-CB 3.31Å; V312-R316 WeakPolarHBondContact O-CB 3.45Å; V312-R316 PolarHBondContact O-N 2.76Å
313R88Confident81.9Confident161 Ų161101.4 Ų101.461%0.60850%0.5SS*.Hα-helixtrans-64.4-46.3173.8-175.8178.4176.5-125.1-4.2111.1Q309 A310 D311 I315 R316 D317Q309-R313 WeakPolarHBondContact O-CB 3.35Å; Q309-R313 PolarHBondContact O-N 2.94Å; A310-R313 WeakPolarHBondContact O-CB 3.32Å; A310-R313 PolarHBondContact O-N 3.2Å; D311-R313 PolarHBondContact O-N 3.02Å; R313-I315 VanDerWaalsContact C-N 3.35Å; R313-I315 PolarHBondContact O-N 3.44Å; R313-R316 WeakPolarHBondContact O-CB 3.4Å; R313-R316 PolarHBondContact O-N 3.09Å; R313-D317 IonicContact NE-OD2 2.79Å; R313-D317 WeakPolarHBondContact O-CB 3.02Å; R313-D317 PolarHBondContact O-N 2.96Å
314I88.4Confident81.9Confident101 Ų10195.1 Ų95.152%0.51848%0.484SS..Hα-helixtrans-60.5-44.2176.8-68.3164000111.1A310 D311 D317 T318A310-I314 WeakPolarHBondContact O-CG1 3.44Å; A310-I314 PolarHBondContact O-N 2.87Å; D311-I314 PolarHBondContact O-N 3.47Å; D311-I314 VanDerWaalsContact O-N 3.13Å; I314-D317 PolarHBondContact O-N 2.85Å; I314-T318 WeakPolarHBondContact O-CB 3.28Å; I314-T318 PolarHBondContact O-N 3.31Å; I314-T318 PolarHBondContact O-OG1 2.87Å
315I86.1Confident81.5Confident99 Ų9992.3 Ų92.351%0.50848%0.479SS..Hα-helixtrans-61.3-46.5176.4-69.2165.3000110.2D311 R313 T318 L319D311-I315 VanDerWaalsContact O-CG1 3.3Å; D311-I315 WeakPolarHBondContact O-CG1 3.36Å; D311-I315 PolarHBondContact O-N 3.38Å; R313-I315 VanDerWaalsContact C-N 3.35Å; R313-I315 PolarHBondContact O-N 3.44Å; I315-T318 PolarHBondContact O-N 3.49Å; I315-L319 HydrophobicContact CG2-CD1 3.98Å; I315-L319 HydrophobicContact CG2-CG 4.36Å; I315-L319 WeakPolarHBondContact O-CB 3.48Å; I315-L319 VanDerWaalsContact O-CG 3.29Å; I315-L319 WeakPolarHBondContact O-CG 3.4Å; I315-L319 PolarHBondContact O-N 3.41Å
316R84.6Confident80.9Confident143 Ų14392 Ų9254%0.5448%0.481SS..Hα-helixtrans-59.3-48.3177-176.1-165.7-56.5158.93.4111.2V312 R313 T318 L319 L320V312-R316 VanDerWaalsContact O-CB 3.31Å; V312-R316 WeakPolarHBondContact O-CB 3.45Å; V312-R316 PolarHBondContact O-N 2.76Å; R313-R316 WeakPolarHBondContact O-CB 3.4Å; R313-R316 PolarHBondContact O-N 3.09Å; R316-T318 VanDerWaalsContact C-N 3.31Å; R316-T318 PolarHBondContact O-N 2.9Å; R316-L319 PolarHBondContact O-N 3.27Å; R316-L320 HydrophobicContact CG-CD1 4.14Å; R316-L320 HydrophobicContact CG-CG 4.5Å; R316-L320 WeakPolarHBondContact O-CB 3.45Å; R316-L320 WeakPolarHBondContact O-CG 3.48Å; R316-L320 PolarHBondContact O-N 2.83Å
317D85.1Confident79.9Confident71 Ų7193.9 Ų93.938%0.3848%0.482SS..Hα-helixtrans-62.9-41.6-179.8-67.3-12.6000110.3R313 I314 L319 L320 E321R313-D317 IonicContact NE-OD2 2.79Å; R313-D317 WeakPolarHBondContact O-CB 3.02Å; R313-D317 PolarHBondContact O-N 2.96Å; I314-D317 PolarHBondContact O-N 2.85Å; D317-L319 PolarHBondContact O-N 3.16Å; D317-L320 PolarHBondContact O-N 3.42Å; D317-E321 WeakPolarHBondContact O-CB 3.41Å; D317-E321 PolarHBondContact O-N 3.16Å
318T88.4Confident79.2Confident62 Ų6294 Ų9438%0.3849%0.485SS..Hα-helixtrans-61.2-45173.7-56.60000111.5I314 I315 R316 E321 K322I314-T318 WeakPolarHBondContact O-CB 3.28Å; I314-T318 PolarHBondContact O-N 3.31Å; I314-T318 PolarHBondContact O-OG1 2.87Å; I315-T318 PolarHBondContact O-N 3.49Å; R316-T318 VanDerWaalsContact C-N 3.31Å; R316-T318 PolarHBondContact O-N 2.9Å; T318-E321 PolarHBondContact O-N 3.33Å; T318-K322 HydrophobicContact CG2-CG 4.39Å; T318-K322 WeakPolarHBondContact O-CB 3.14Å; T318-K322 VanDerWaalsContact O-CG 3.25Å; T318-K322 WeakPolarHBondContact O-CG 3.39Å; T318-K322 PolarHBondContact O-N 3.46Å
319L84.5Confident78Confident96 Ų9690.8 Ų90.850%0.50348%0.48SS..Hα-helixtrans-65-43.1177.7-73.7173.7000111.2I315 R316 D317 E321 K322 L323I315-L319 HydrophobicContact CG2-CD1 3.98Å; I315-L319 HydrophobicContact CG2-CG 4.36Å; I315-L319 WeakPolarHBondContact O-CB 3.48Å; I315-L319 VanDerWaalsContact O-CG 3.29Å; I315-L319 WeakPolarHBondContact O-CG 3.4Å; I315-L319 PolarHBondContact O-N 3.41Å; R316-L319 PolarHBondContact O-N 3.27Å; D317-L319 PolarHBondContact O-N 3.16Å; L319-E321 VanDerWaalsContact C-N 3.33Å; L319-E321 PolarHBondContact O-N 2.88Å; L319-K322 PolarHBondContact O-N 3.36Å; L319-L323 HydrophobicContact CB-CD1 4.33Å; L319-L323 WeakPolarHBondContact O-CB 3.44Å; L319-L323 WeakPolarHBondContact O-CD1 3.47Å; L319-L323 WeakPolarHBondContact O-CG 3.48Å; L319-L323 PolarHBondContact O-N 3.14Å
320L83.1Confident76.7Confident110 Ų11089 Ų8958%0.57647%0.474SS*.Hα-helixtrans-62.5-39.5175.7-74.7172.9000111.6R316 D317 G324R316-L320 HydrophobicContact CG-CD1 4.14Å; R316-L320 HydrophobicContact CG-CG 4.5Å; R316-L320 WeakPolarHBondContact O-CB 3.45Å; R316-L320 WeakPolarHBondContact O-CG 3.48Å; R316-L320 PolarHBondContact O-N 2.83Å; D317-L320 PolarHBondContact O-N 3.42Å; L320-G324 VanDerWaalsContact O-CA 3.27Å; L320-G324 WeakPolarHBondContact O-CA 3.39Å; L320-G324 PolarHBondContact O-N 3.11Å
321E82.6Confident75.4Confident109 Ų10991.1 Ų91.151%0.50948%0.482SS..Hα-helixtrans-63.8-49.9173.4-169.6-164.2143.300111D317 T318 L319 N325D317-E321 WeakPolarHBondContact O-CB 3.41Å; D317-E321 PolarHBondContact O-N 3.16Å; T318-E321 PolarHBondContact O-N 3.33Å; L319-E321 VanDerWaalsContact C-N 3.33Å; L319-E321 PolarHBondContact O-N 2.88Å; E321-N325 VanDerWaalsContact O-CB 3.22Å; E321-N325 WeakPolarHBondContact O-CB 3.48Å; E321-N325 PolarHBondContact O-N 3.01Å; E321-N325 PolarHBondContact O-ND2 2.97Å; E321-N325 PolarHBondContact O-OD1 2.96Å
322K79.8Confident74.1Confident123 Ų12395.1 Ų95.154%0.53550%0.498SS..Hα-helixtrans-65.7-44.6-179.5-65.9-61.4-179.9-157.90112.6T318 L319 S326T318-K322 HydrophobicContact CG2-CG 4.39Å; T318-K322 WeakPolarHBondContact O-CB 3.14Å; T318-K322 VanDerWaalsContact O-CG 3.25Å; T318-K322 WeakPolarHBondContact O-CG 3.39Å; T318-K322 PolarHBondContact O-N 3.46Å; L319-K322 PolarHBondContact O-N 3.36Å; K322-S326 WeakPolarHBondContact O-CB 3.42Å; K322-S326 PolarHBondContact O-N 3.46Å; K322-S326 PolarHBondContact O-OG 3.47Å
323L75.6Confident72.4Confident96 Ų9694.6 Ų94.650%0.50349%0.493SS..Hα-helixtrans-69.1-44.1176.5-77.5156.1000111L319 N325 S326 I327L319-L323 HydrophobicContact CB-CD1 4.33Å; L319-L323 WeakPolarHBondContact O-CB 3.44Å; L319-L323 WeakPolarHBondContact O-CD1 3.47Å; L319-L323 WeakPolarHBondContact O-CG 3.48Å; L319-L323 PolarHBondContact O-N 3.14Å; L323-N325 VanDerWaalsContact C-N 3.33Å; L323-N325 PolarHBondContact O-N 3.11Å; L323-S326 CarbonylContact O-C 3.57Å; L323-S326 PolarHBondContact O-N 3.28Å; L323-S326 VanDerWaalsContact O-N 3.16Å; L323-I327 WeakPolarHBondContact O-CB 3.43Å; L323-I327 VanDerWaalsContact O-CG1 3.26Å; L323-I327 WeakPolarHBondContact O-CG1 3.43Å; L323-I327 PolarHBondContact O-N 3.35Å
324G70.4Confident70.9Confident29 Ų2990.9 Ų90.930%0.29949%0.488SS..Hα-helixtrans-60.2-43.2176.700000111.6L320 I327 S328L320-G324 VanDerWaalsContact O-CA 3.27Å; L320-G324 WeakPolarHBondContact O-CA 3.39Å; L320-G324 PolarHBondContact O-N 3.11Å; G324-I327 PolarHBondContact O-N 3.07Å; G324-S328 WeakPolarHBondContact O-CB 3.33Å; G324-S328 PolarHBondContact O-N 3.03Å; G324-S328 PolarHBondContact O-OG 2.9Å
325N67.6Low69.4Low96 Ų9690.2 Ų90.251%0.51349%0.493SS..Hα-helixtrans-64.2-41.4173.6-69.5-13.8000111.7E321 L323 A329E321-N325 VanDerWaalsContact O-CB 3.22Å; E321-N325 WeakPolarHBondContact O-CB 3.48Å; E321-N325 PolarHBondContact O-N 3.01Å; E321-N325 PolarHBondContact O-ND2 2.97Å; E321-N325 PolarHBondContact O-OD1 2.96Å; L323-N325 VanDerWaalsContact C-N 3.33Å; L323-N325 PolarHBondContact O-N 3.11Å; N325-A329 VanDerWaalsContact O-CB 3.28Å; N325-A329 WeakPolarHBondContact O-CB 3.5Å; N325-A329 PolarHBondContact O-N 3.27Å
326S63.3Low68.2Low66 Ų6689.1 Ų89.146%0.46249%0.494SS..Hα-helixtrans-66.1-43.5177.3-56.40000112.1K322 L323 A329 I330K322-S326 WeakPolarHBondContact O-CB 3.42Å; K322-S326 PolarHBondContact O-N 3.46Å; K322-S326 PolarHBondContact O-OG 3.47Å; L323-S326 CarbonylContact O-C 3.57Å; L323-S326 PolarHBondContact O-N 3.28Å; L323-S326 VanDerWaalsContact O-N 3.16Å; S326-A329 PolarHBondContact O-N 3.09Å; S326-I330 WeakPolarHBondContact O-CD1 3.45Å; S326-I330 VanDerWaalsContact O-CG1 3.24Å; S326-I330 WeakPolarHBondContact O-CG1 3.37Å; S326-I330 PolarHBondContact O-N 3.42Å; S326-I330 VanDerWaalsContact O-N 3.09Å
327I61.1Low67.2Low92 Ų9283.7 Ų83.747%0.47248%0.478SS..Hα-helixtrans-71.2-40.6179-68.6169000110.5L323 G324 A329 I330 T331L323-I327 WeakPolarHBondContact O-CB 3.43Å; L323-I327 VanDerWaalsContact O-CG1 3.26Å; L323-I327 WeakPolarHBondContact O-CG1 3.43Å; L323-I327 PolarHBondContact O-N 3.35Å; G324-I327 PolarHBondContact O-N 3.07Å; I327-A329 VanDerWaalsContact C-N 3.3Å; I327-A329 PolarHBondContact O-N 2.89Å; I327-I330 CarbonylContact O-C 3.57Å; I327-I330 PolarHBondContact O-N 3.46Å; I327-I330 VanDerWaalsContact O-N 3.08Å; I327-T331 HydrophobicContact CG2-CG2 3.81Å; I327-T331 WeakPolarHBondContact O-CB 3.3Å; I327-T331 WeakPolarHBondContact O-CG2 3.27Å; I327-T331 PolarHBondContact O-N 3.19Å; I327-T331 PolarHBondContact O-OG1 3.14Å
328S58.8Low66.6Low55 Ų5585.2 Ų85.239%0.38549%0.492SS..Hα-helixtrans-63.6-38.8175.6-58.30000110.8G324 I330 T331 Q332G324-S328 WeakPolarHBondContact O-CB 3.33Å; G324-S328 PolarHBondContact O-N 3.03Å; G324-S328 PolarHBondContact O-OG 2.9Å; S328-I330 VanDerWaalsContact C-N 3.27Å; S328-I330 PolarHBondContact O-N 3.29Å; S328-T331 PolarHBondContact O-N 3.45Å; S328-Q332 PolarHBondContact O-N 2.96Å
329A55.5Low66.1Low59 Ų5987 Ų8749%0.48850%0.502SS..Hα-helixtrans-64.5-28.3172.200000113.4N325 S326 I327N325-A329 VanDerWaalsContact O-CB 3.28Å; N325-A329 WeakPolarHBondContact O-CB 3.5Å; N325-A329 PolarHBondContact O-N 3.27Å; S326-A329 PolarHBondContact O-N 3.09Å; I327-A329 VanDerWaalsContact C-N 3.3Å; I327-A329 PolarHBondContact O-N 2.89Å
330I54.9Low65.6Low97 Ų9785.3 Ų85.350%0.49749%0.493SS..Hα-helixtrans-83.5-38.6175.6-66.9162.4000111.8S326 I327 S328 T334S326-I330 WeakPolarHBondContact O-CD1 3.45Å; S326-I330 VanDerWaalsContact O-CG1 3.24Å; S326-I330 WeakPolarHBondContact O-CG1 3.37Å; S326-I330 PolarHBondContact O-N 3.42Å; S326-I330 VanDerWaalsContact O-N 3.09Å; I327-I330 CarbonylContact O-C 3.57Å; I327-I330 PolarHBondContact O-N 3.46Å; I327-I330 VanDerWaalsContact O-N 3.08Å; S328-I330 VanDerWaalsContact C-N 3.27Å; S328-I330 PolarHBondContact O-N 3.29Å; I330-T334 WeakPolarHBondContact O-CG2 3.1Å
331T55.8Low65.3Low94 Ų9483.4 Ų83.458%0.57748%0.483SS*.Hα-helixtrans-93.4-32.9-167.353.20000114I327 S328I327-T331 HydrophobicContact CG2-CG2 3.81Å; I327-T331 WeakPolarHBondContact O-CB 3.3Å; I327-T331 WeakPolarHBondContact O-CG2 3.27Å; I327-T331 PolarHBondContact O-N 3.19Å; I327-T331 PolarHBondContact O-OG1 3.14Å; S328-T331 PolarHBondContact O-N 3.45Å
332Q54.4Low65.3Low166 Ų16682.9 Ų82.978%0.77648%0.48SS*.THydrogen-bonded Turntrans-96.4-19.3-174.1-73.1-169.8-7.500114.3S328S328-Q332 PolarHBondContact O-N 2.96Å
333D53.4Low65.5Low62 Ų6281.2 Ų81.233%0.33248%0.477SS..  trans-151.176.8174.2-159.24000112.3S335 S336D333-S335 PolarHBondContact O-N 3.41Å; D333-S335 WeakPolarHBondContact OD1-CA 3.4Å; D333-S335 WeakPolarHBondContact OD1-CB 3.35Å; D333-S335 PolarHBondContact OD1-N 3.24Å; D333-S335 VanDerWaalsContact OD1-N 3.14Å; D333-S335 PolarHBondContact OD1-OG 3.03Å; D333-S336 PolarHBondContact O-N 3.21Å; D333-S336 VanDerWaalsContact OD2-CB 3.31Å; D333-S336 WeakPolarHBondContact OD2-CB 3.4Å; D333-S336 PolarHBondContact OD2-OG 3.35Å
334T54.9Low65.8Low82 Ų8285.4 Ų85.450%0.50349%0.486SS..THydrogen-bonded Turntrans-53.9-13.3166.140.80000113.2I330 L340I330-T334 WeakPolarHBondContact O-CG2 3.1Å; T334-L340 HydrophobicContact CG2-CD1 4.15Å
335S57.6Low66.6Low87 Ų8788.4 Ų88.461%0.60850%0.495SS*.THydrogen-bonded Turntrans-83.8-12.4174.7-70000113.9D333 I341D333-S335 PolarHBondContact O-N 3.41Å; D333-S335 WeakPolarHBondContact OD1-CA 3.4Å; D333-S335 WeakPolarHBondContact OD1-CB 3.35Å; D333-S335 PolarHBondContact OD1-N 3.24Å; D333-S335 VanDerWaalsContact OD1-N 3.14Å; D333-S335 PolarHBondContact OD1-OG 3.03Å; S335-I341 WeakPolarHBondContact O-CD1 3.41Å
336S61Low67.6Low76 Ų7688 Ų8853%0.53149%0.49SS..THydrogen-bonded Turntrans-110.1-20.7-176.3-77.50000114.8D333 P338D333-S336 PolarHBondContact O-N 3.21Å; D333-S336 VanDerWaalsContact OD2-CB 3.31Å; D333-S336 WeakPolarHBondContact OD2-CB 3.4Å; D333-S336 PolarHBondContact OD2-OG 3.35Å; S336-P338 WeakPolarHBondContact O-CD 3.34Å
337S64.7Low68.9Low29 Ų2988.8 Ų88.820%0.20349%0.492CS..  trans-69.4111.9177.6173.70000110.3V339 L340 I341S337-V339 PolarHBondContact O-N 3.5Å; S337-V339 VanDerWaalsContact O-N 3.13Å; S337-L340 PolarHBondContact O-N 3.5Å; S337-I341 WeakPolarHBondContact O-CG1 3.34Å; S337-I341 PolarHBondContact O-N 2.85Å
338P71.7Confident70.3Confident104 Ų10488 Ų8868%0.67549%0.492SS*.Hα-helixtrans-57.8-34.4-175.5-24.435.2000112.5S336 E342S336-P338 WeakPolarHBondContact O-CD 3.34Å; P338-E342 WeakPolarHBondContact O-CB 3.42Å; P338-E342 PolarHBondContact O-N 3.35Å; P338-E342 VanDerWaalsContact O-N 3.1Å
339V77.5Confident72Confident99 Ų9990 Ų9060%0.650%0.497SS*.Hα-helixtrans-68.9-42.4178.3179.40000111.5S337 E342 L343S337-V339 PolarHBondContact O-N 3.5Å; S337-V339 VanDerWaalsContact O-N 3.13Å; V339-E342 PolarHBondContact O-N 2.99Å; V339-L343 HydrophobicContact CG1-CD1 4.09Å; V339-L343 WeakPolarHBondContact O-CB 3.27Å; V339-L343 VanDerWaalsContact O-CG 3.29Å; V339-L343 WeakPolarHBondContact O-CG 3.46Å; V339-L343 PolarHBondContact O-N 2.89Å
340L74.1Confident73.8Confident60 Ų6092.6 Ų92.631%0.31450%0.502SS..Hα-helixtrans-70.5-36.2179.4-68.4176.2000112T334 S337 L343 R344T334-L340 HydrophobicContact CG2-CD1 4.15Å; S337-L340 PolarHBondContact O-N 3.5Å; L340-L343 HydrophobicContact CD2-CD1 4.46Å; L340-R344 WeakPolarHBondContact O-CB 3.38Å; L340-R344 PolarHBondContact O-N 3.13Å
341I77.4Confident75.6Confident71 Ų7190.7 Ų90.736%0.36450%0.495SS..Hα-helixtrans-60.3-49.1173.8-63.6166.5000109.9S335 S337 R344 L345S335-I341 WeakPolarHBondContact O-CD1 3.41Å; S337-I341 WeakPolarHBondContact O-CG1 3.34Å; S337-I341 PolarHBondContact O-N 2.85Å; I341-R344 PolarHBondContact O-N 2.98Å; I341-L345 HydrophobicContact CG2-CD1 4.09Å; I341-L345 WeakPolarHBondContact O-CG 3.45Å; I341-L345 PolarHBondContact O-N 3.34Å
342E82.4Confident77.2Confident97 Ų9790.6 Ų90.645%0.45349%0.491SS..Hα-helixtrans-63.1-44.1179.9-173.457.6-148.500112P338 V339 R344 L345 Q346P338-E342 WeakPolarHBondContact O-CB 3.42Å; P338-E342 PolarHBondContact O-N 3.35Å; P338-E342 VanDerWaalsContact O-N 3.1Å; V339-E342 PolarHBondContact O-N 2.99Å; E342-R344 VanDerWaalsContact C-N 3.28Å; E342-R344 PolarHBondContact O-N 3.31Å; E342-L345 PolarHBondContact O-N 2.93Å; E342-Q346 WeakPolarHBondContact O-CB 3.36Å; E342-Q346 WeakPolarHBondContact O-CG 3.41Å; E342-Q346 PolarHBondContact O-N 2.95Å; E342-Q346 PolarHBondContact OE1-NE2 3.06Å
343L82.8Confident78.9Confident89 Ų8986.9 Ų86.947%0.46648%0.476SS..Hα-helixtrans-60.7-37.2175.4-75.6171.3000112.5V339 L340 T347V339-L343 HydrophobicContact CG1-CD1 4.09Å; V339-L343 WeakPolarHBondContact O-CB 3.27Å; V339-L343 VanDerWaalsContact O-CG 3.29Å; V339-L343 WeakPolarHBondContact O-CG 3.46Å; V339-L343 PolarHBondContact O-N 2.89Å; L340-L343 HydrophobicContact CD2-CD1 4.46Å; L343-T347 WeakPolarHBondContact O-CB 3.49Å; L343-T347 PolarHBondContact O-N 3.34Å; L343-T347 PolarHBondContact O-OG1 3.36Å
344R82.2Confident80.5Confident183 Ų18391.5 Ų91.569%0.69149%0.488SS*.Hα-helixtrans-70.7-42.2178.3-162.6170.5-169.7165.82.1111.4L340 I341 E342 T347 T348L340-R344 WeakPolarHBondContact O-CB 3.38Å; L340-R344 PolarHBondContact O-N 3.13Å; I341-R344 PolarHBondContact O-N 2.98Å; E342-R344 VanDerWaalsContact C-N 3.28Å; E342-R344 PolarHBondContact O-N 3.31Å; R344-T347 PolarHBondContact O-N 2.95Å; R344-T348 PolarHBondContact O-N 3.24Å; R344-T348 PolarHBondContact O-OG1 3.14Å; R344-T348 VanDerWaalsContact O-OG1 3.09Å
345L86.7Confident81.9Confident93 Ų9391.1 Ų91.149%0.48748%0.483SS..Hα-helixtrans-59.3-46.7172.7-75.7167000111.3I341 E342 T347 T348 I349I341-L345 HydrophobicContact CG2-CD1 4.09Å; I341-L345 WeakPolarHBondContact O-CG 3.45Å; I341-L345 PolarHBondContact O-N 3.34Å; E342-L345 PolarHBondContact O-N 2.93Å; L345-T347 VanDerWaalsContact C-N 3.33Å; L345-T347 PolarHBondContact O-N 3.28Å; L345-T348 PolarHBondContact O-N 2.97Å; L345-I349 VanDerWaalsContact O-CG1 3.31Å; L345-I349 WeakPolarHBondContact O-CG1 3.38Å; L345-I349 PolarHBondContact O-N 3.49Å
346Q89.4Confident83.1Confident87 Ų8791.1 Ų91.141%0.40748%0.48SS..Hα-helixtrans-61.5-40.5175.8-71.5177.821.300112E342 T348 I349 L350E342-Q346 WeakPolarHBondContact O-CB 3.36Å; E342-Q346 WeakPolarHBondContact O-CG 3.41Å; E342-Q346 PolarHBondContact O-N 2.95Å; E342-Q346 PolarHBondContact OE1-NE2 3.06Å; Q346-T348 PolarHBondContact O-N 3.03Å; Q346-I349 PolarHBondContact O-N 3.44Å; Q346-L350 WeakPolarHBondContact O-CB 3.14Å; Q346-L350 WeakPolarHBondContact O-CG 3.23Å; Q346-L350 PolarHBondContact O-N 3.06Å
347T91.6Very high84Confident83 Ų8392.6 Ų92.651%0.50948%0.481SS..Hα-helixtrans-63.4-41.2176.8-57.40000111.9L343 R344 L345 L350 T351L343-T347 WeakPolarHBondContact O-CB 3.49Å; L343-T347 PolarHBondContact O-N 3.34Å; L343-T347 PolarHBondContact O-OG1 3.36Å; R344-T347 PolarHBondContact O-N 2.95Å; L345-T347 VanDerWaalsContact C-N 3.33Å; L345-T347 PolarHBondContact O-N 3.28Å; T347-L350 PolarHBondContact O-N 3.4Å; T347-T351 WeakPolarHBondContact O-CB 3.49Å; T347-T351 PolarHBondContact O-N 3.48Å; T347-T351 PolarHBondContact O-OG1 3.41Å
348T90.6Very high84.6Confident75 Ų7593.7 Ų93.746%0.4649%0.492SS..Hα-helixtrans-62.5-48.7174.6-570000110.8R344 L345 Q346 L350 T351 D352R344-T348 PolarHBondContact O-N 3.24Å; R344-T348 PolarHBondContact O-OG1 3.14Å; R344-T348 VanDerWaalsContact O-OG1 3.09Å; L345-T348 PolarHBondContact O-N 2.97Å; Q346-T348 PolarHBondContact O-N 3.03Å; T348-L350 VanDerWaalsContact C-N 3.33Å; T348-L350 PolarHBondContact O-N 3Å; T348-T351 WeakPolarHBondContact O-CB 3.49Å; T348-T351 PolarHBondContact O-N 3.45Å; T348-T351 VanDerWaalsContact O-N 3.08Å; T348-D352 PolarHBondContact O-N 3.31Å
349I92.8Very high84.6Confident97 Ų9792.4 Ų92.450%0.49749%0.486SS..Hα-helixtrans-58.7-44.4177.3-68.3165.7000111.1L345 Q346 T351 D352 I353L345-I349 VanDerWaalsContact O-CG1 3.31Å; L345-I349 WeakPolarHBondContact O-CG1 3.38Å; L345-I349 PolarHBondContact O-N 3.49Å; Q346-I349 PolarHBondContact O-N 3.44Å; I349-T351 VanDerWaalsContact C-N 3.29Å; I349-T351 PolarHBondContact O-N 3.47Å; I349-D352 PolarHBondContact O-N 2.88Å; I349-I353 HydrophobicContact CG2-CD1 3.8Å; I349-I353 HydrophobicContact CG2-CG1 4.42Å; I349-I353 VanDerWaalsContact O-CG1 3.26Å; I349-I353 WeakPolarHBondContact O-CG1 3.37Å; I349-I353 PolarHBondContact O-N 3.43Å
350L93.4Very high84.1Confident114 Ų11491.9 Ų91.960%0.59749%0.485SS*.Hα-helixtrans-62.9-36.4177.2-73.6169.4000112Q346 T347 T348 R354Q346-L350 WeakPolarHBondContact O-CB 3.14Å; Q346-L350 WeakPolarHBondContact O-CG 3.23Å; Q346-L350 PolarHBondContact O-N 3.06Å; T347-L350 PolarHBondContact O-N 3.4Å; T348-L350 VanDerWaalsContact C-N 3.33Å; T348-L350 PolarHBondContact O-N 3Å; L350-R354 WeakPolarHBondContact O-CB 3.29Å; L350-R354 PolarHBondContact O-N 3.42Å
351T92.7Very high83.8Confident57 Ų5794.4 Ų94.435%0.3550%0.503SS..Hα-helixtrans-67.6-44.7176.4-55.60000110.8T347 T348 I349 I353 R354 D355T347-T351 WeakPolarHBondContact O-CB 3.49Å; T347-T351 PolarHBondContact O-N 3.48Å; T347-T351 PolarHBondContact O-OG1 3.41Å; T348-T351 WeakPolarHBondContact O-CB 3.49Å; T348-T351 PolarHBondContact O-N 3.45Å; T348-T351 VanDerWaalsContact O-N 3.08Å; I349-T351 VanDerWaalsContact C-N 3.29Å; I349-T351 PolarHBondContact O-N 3.47Å; T351-I353 PolarHBondContact O-N 2.93Å; T351-R354 WeakPolarHBondContact O-CB 3.49Å; T351-R354 PolarHBondContact O-N 3.37Å; T351-D355 WeakPolarHBondContact O-CB 3.39Å; T351-D355 PolarHBondContact O-N 3.34Å
352D90.3Very high82.9Confident92 Ų9299 Ų9949%0.49252%0.52SS..Hα-helixtrans-63.9-40.8177.6-68.4-17.3000112T348 I349 D355 T356T348-D352 PolarHBondContact O-N 3.31Å; I349-D352 PolarHBondContact O-N 2.88Å; D352-D355 PolarHBondContact O-N 3.03Å; D352-T356 WeakPolarHBondContact O-CB 3.44Å; D352-T356 PolarHBondContact O-N 3.33Å; D352-T356 PolarHBondContact O-OG1 2.83Å
353I89.3Confident81.4Confident88 Ų8896.6 Ų96.645%0.45152%0.521SS..Hα-helixtrans-60.6-48.9173.4-70.9167.6000110.1I349 T351 D355 T356 L357I349-I353 HydrophobicContact CG2-CD1 3.8Å; I349-I353 HydrophobicContact CG2-CG1 4.42Å; I349-I353 VanDerWaalsContact O-CG1 3.26Å; I349-I353 WeakPolarHBondContact O-CG1 3.37Å; I349-I353 PolarHBondContact O-N 3.43Å; T351-I353 PolarHBondContact O-N 2.93Å; I353-D355 VanDerWaalsContact C-N 3.33Å; I353-D355 PolarHBondContact O-N 3.26Å; I353-T356 PolarHBondContact O-N 2.95Å; I353-L357 HydrophobicContact CG2-CD1 3.9Å; I353-L357 HydrophobicContact CG2-CG 4.44Å; I353-L357 WeakPolarHBondContact O-CB 3.5Å; I353-L357 VanDerWaalsContact O-CG 3.3Å; I353-L357 WeakPolarHBondContact O-CG 3.44Å; I353-L357 PolarHBondContact O-N 2.9Å
354R86.6Confident80.2Confident158 Ų15896.1 Ų96.160%0.59654%0.537SS*.Hα-helixtrans-59.3-45.2179.7-175.2-159.471.5163.9-2.6111.3L350 T351 L357 A358L350-R354 WeakPolarHBondContact O-CB 3.29Å; L350-R354 PolarHBondContact O-N 3.42Å; T351-R354 WeakPolarHBondContact O-CB 3.49Å; T351-R354 PolarHBondContact O-N 3.37Å; R354-L357 PolarHBondContact O-N 3.01Å; R354-A358 WeakPolarHBondContact O-CB 3.42Å; R354-A358 PolarHBondContact O-N 3.4Å
355D84.4Confident78.8Confident75 Ų7593.1 Ų93.140%0.40153%0.531SS..Hα-helixtrans-70.9-37-176.5-71.8-0.7000111.5T351 D352 I353 A358 S359T351-D355 WeakPolarHBondContact O-CB 3.39Å; T351-D355 PolarHBondContact O-N 3.34Å; D352-D355 PolarHBondContact O-N 3.03Å; I353-D355 VanDerWaalsContact C-N 3.33Å; I353-D355 PolarHBondContact O-N 3.26Å; D355-A358 PolarHBondContact O-N 3.3Å; D355-S359 WeakPolarHBondContact O-CB 3.43Å; D355-S359 PolarHBondContact O-N 3.37Å
356T82.6Confident77.3Confident86 Ų8698.5 Ų98.553%0.52855%0.551SS.*Hα-helixtrans-60.6-50.3171.3-58.20000110.8D352 I353 A358 S359 C360D352-T356 WeakPolarHBondContact O-CB 3.44Å; D352-T356 PolarHBondContact O-N 3.33Å; D352-T356 PolarHBondContact O-OG1 2.83Å; I353-T356 PolarHBondContact O-N 2.95Å; T356-A358 VanDerWaalsContact C-N 3.34Å; T356-A358 PolarHBondContact O-N 3.24Å; T356-S359 WeakPolarHBondContact O-CB 3.43Å; T356-S359 PolarHBondContact O-N 3.38Å; T356-S359 VanDerWaalsContact O-N 3.16Å; T356-S359 PolarHBondContact O-OG 3.25Å; T356-C360 PolarHBondContact O-N 3.44Å; T356-C360 VanDerWaalsContact O-N 3.17Å; T356-C360 PolarHBondContact O-SG 3.43Å
357L81.8Confident75.7Confident108 Ų108102.1 Ų102.157%0.56557%0.568SS**Hα-helixtrans-59.2-43.9176.6-71.7172000111.7I353 R354 S359 C360 V361I353-L357 HydrophobicContact CG2-CD1 3.9Å; I353-L357 HydrophobicContact CG2-CG 4.44Å; I353-L357 WeakPolarHBondContact O-CB 3.5Å; I353-L357 VanDerWaalsContact O-CG 3.3Å; I353-L357 WeakPolarHBondContact O-CG 3.44Å; I353-L357 PolarHBondContact O-N 2.9Å; R354-L357 PolarHBondContact O-N 3.01Å; L357-S359 VanDerWaalsContact C-N 3.31Å; L357-S359 PolarHBondContact O-N 3.41Å; L357-C360 PolarHBondContact O-N 2.73Å; L357-V361 WeakPolarHBondContact O-CG2 3.11Å; L357-V361 PolarHBondContact O-N 3.22Å
358A75.6Confident73.8Confident52 Ų5298.7 Ų98.743%0.4355%0.548SS..Hα-helixtrans-61.8-39.2177.300000111.9R354 D355 T356 C360 V361 K362R354-A358 WeakPolarHBondContact O-CB 3.42Å; R354-A358 PolarHBondContact O-N 3.4Å; D355-A358 PolarHBondContact O-N 3.3Å; T356-A358 VanDerWaalsContact C-N 3.34Å; T356-A358 PolarHBondContact O-N 3.24Å; A358-C360 VanDerWaalsContact C-N 3.29Å; A358-C360 PolarHBondContact O-N 3.36Å; A358-V361 PolarHBondContact O-N 3.13Å; A358-K362 WeakPolarHBondContact O-CB 3.5Å; A358-K362 PolarHBondContact O-N 3.13Å
359S73.1Confident71.8Confident77 Ų77105.1 Ų105.154%0.53856%0.564SS.*Hα-helixtrans-64-33.1177.684.60000112.8D355 T356 L357D355-S359 WeakPolarHBondContact O-CB 3.43Å; D355-S359 PolarHBondContact O-N 3.37Å; T356-S359 WeakPolarHBondContact O-CB 3.43Å; T356-S359 PolarHBondContact O-N 3.38Å; T356-S359 VanDerWaalsContact O-N 3.16Å; T356-S359 PolarHBondContact O-OG 3.25Å; L357-S359 VanDerWaalsContact C-N 3.31Å; L357-S359 PolarHBondContact O-N 3.41Å
360C66.9Low69.8Low87 Ų87106.8 Ų106.859%0.58857%0.574SS**Hα-helixtrans-74.3-28.4176.8-61.80000112.8T356 L357 A358T356-C360 PolarHBondContact O-N 3.44Å; T356-C360 VanDerWaalsContact O-N 3.17Å; T356-C360 PolarHBondContact O-SG 3.43Å; L357-C360 PolarHBondContact O-N 2.73Å; A358-C360 VanDerWaalsContact C-N 3.29Å; A358-C360 PolarHBondContact O-N 3.36Å
361V66.6Low67.7Low114 Ų114104.2 Ų104.269%0.69158%0.575SS**Hα-helixtrans-97.2-24.6-172.9-179.40000113L357 A358 G363L357-V361 WeakPolarHBondContact O-CG2 3.11Å; L357-V361 PolarHBondContact O-N 3.22Å; A358-V361 PolarHBondContact O-N 3.13Å; V361-G363 PolarHBondContact O-N 2.82Å; V361-G363 VanDerWaalsContact O-N 3.14Å
362K58.7Low65.7Low168 Ų168108.9 Ų108.973%0.7360%0.596SS**  trans-68.4112.8-173.7-157.7173.8-174.4178.90111.9A358 G364A358-K362 WeakPolarHBondContact O-CB 3.5Å; A358-K362 PolarHBondContact O-N 3.13Å; K362-G364 PolarHBondContact O-N 3.4Å
363G50.5Low63.7Low46 Ų46110.9 Ų110.947%0.47460%0.601SS.*THydrogen-bonded Turntrans-65.7125.817500000111.6V361V361-G363 PolarHBondContact O-N 2.82Å; V361-G363 VanDerWaalsContact O-N 3.14Å
364G57.8Low61.9Low78 Ų78112.4 Ų112.480%0.80461%0.614SS**THydrogen-bonded Turntrans126.6-3.3172.300000116.5K362K362-G364 PolarHBondContact O-N 3.4Å
365H53.6Low59.8Low121 Ų121113.9 Ų113.956%0.5663%0.625SS**SBendtrans-88.9154.8169.1-171.7-101.8000111Q367 G368H365-Q367 PolarHBondContact O-N 3.33Å; H365-G368 WeakPolarHBondContact O-CA 3.4Å; H365-G368 PolarHBondContact O-N 3.09Å
366K55.6Low57.4Low205 Ų205117 Ų11789%0.89164%0.639SS**THydrogen-bonded Turntrans-56.2-20.4-174.4-30.2-176.1-168.5-178.20114.4
367Q55.8Low55.4Low164 Ų164124.5 Ų124.577%0.76668%0.676SS**THydrogen-bonded Turntrans-119-4.4174.4-65.8179.8-39.600113.1H365 R369H365-Q367 PolarHBondContact O-N 3.33Å; Q367-R369 VanDerWaalsContact C-N 3.32Å; Q367-R369 PolarHBondContact O-N 3.25Å
368G50.6Low54.1Low10 Ų10125.3 Ų125.310%0.10368%0.681CS.*THydrogen-bonded Turntrans-79.275.4-177.900000111.5H365H365-G368 WeakPolarHBondContact O-CA 3.4Å; H365-G368 PolarHBondContact O-N 3.09Å
369R48.4Very low53Low210 Ų210129.2 Ų129.279%0.79269%0.694SS**THydrogen-bonded Turntrans173.2-1.4158.8-99.9169.8-179.4-168.60.9114.2Q367Q367-R369 VanDerWaalsContact C-N 3.32Å; Q367-R369 PolarHBondContact O-N 3.25Å
370N51.1Low51.9Low133 Ų133132.1 Ų132.171%0.71170%0.703SS**SBendtrans-1025.6-177.3-76.7-8.2000115.5
371G50.2Low51Low60 Ų60134.7 Ų134.762%0.61971%0.71SS**THydrogen-bonded Turntrans-83.8-22.4-173.500000117
372I50.9Low50Low154 Ų154136 Ų13679%0.7971%0.711SS**THydrogen-bonded Turntrans-119.653.1177.8-44.1180000109.6
373K46.7Very low49.4Very low135 Ų135133.9 Ų133.959%0.58771%0.71SS**  trans-120.823165.1-85.4-167176-173.80112.3F375K373-F375 PolarHBondContact O-N 3.07Å; K373-F375 VanDerWaalsContact O-N 3.1Å
374V52.3Low49.3Very low120 Ų120140.1 Ų140.173%0.72773%0.726SS**THydrogen-bonded Turntrans-69.50.7172.5-172.30000112.2
375F41.9Very low48.7Very low188 Ų188144.9 Ų144.983%0.82572%0.72SS**THydrogen-bonded Turntrans-12736.4176.5-57.6-69.8000113.9K373K373-F375 PolarHBondContact O-N 3.07Å; K373-F375 VanDerWaalsContact O-N 3.1Å
376M34.2Very low48.3Very low141 Ų141146.9 Ų146.970%0.69573%0.734SS**  trans-127.868.4166-72.5-176.6174.500110
377N41.8Very low47.6Very low243 Ų243141.6 Ų141.6100%1.29972%0.719SS**  trans-161.60135.7-91.4-11.9000108.9

Retrieved 377 of 377 residues in 614.9 ms (Link to these results)