A0A5K4FCV4_SCHMA Loading...

ATG16 domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FCV4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 201 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
1M71.3Confident90.4Very high172 Ų172109.3 Ų109.385%0.84760%0.598SS**  0-60.80-85.9-73.2-150.300113.1K3 L4 R5M1-K3 PolarHBondContact O-N 3.15Å; M1-L4 PolarHBondContact O-N 2.98Å; M1-R5 PolarHBondContact O-N 3.06Å
2A85.7Confident91Very high83 Ų83110.8 Ų110.869%0.68660%0.598SS**Hα-helixtrans-58.2-43.9-174.400000114.7L4 R5 G6A2-L4 PolarHBondContact O-N 2.99Å; A2-R5 PolarHBondContact O-N 2.99Å; A2-G6 PolarHBondContact O-N 3.01Å
3K87.4Confident91.4Very high185 Ų185110.7 Ų110.780%0.80459%0.592SS**Hα-helixtrans-60.4-45.1179.2-70-173.8176.9-178.10113.3M1 G6 Q7M1-K3 PolarHBondContact O-N 3.15Å; K3-G6 PolarHBondContact O-N 2.93Å; K3-Q7 WeakPolarHBondContact O-CG 3.43Å; K3-Q7 PolarHBondContact O-N 2.96Å
4L89.5Confident91.8Very high115 Ų115112.9 Ų112.960%0.60259%0.587SS**Hα-helixtrans-64.3-42.3178.3-70.7173000111.5M1 A2 G6 Q7 V8M1-L4 PolarHBondContact O-N 2.98Å; A2-L4 PolarHBondContact O-N 2.99Å; L4-G6 VanDerWaalsContact C-N 3.34Å; L4-G6 PolarHBondContact O-N 3.27Å; L4-Q7 PolarHBondContact O-N 3.37Å; L4-V8 WeakPolarHBondContact O-CG2 3.4Å; L4-V8 PolarHBondContact O-N 2.96Å
5R91.9Very high92.2Very high175 Ų175111.2 Ų111.266%0.6658%0.579SS**Hα-helixtrans-61.2-42.1176.3-71.3-176.7177.7178.6-2.4112M1 A2 V8 A9M1-R5 PolarHBondContact O-N 3.06Å; A2-R5 PolarHBondContact O-N 2.99Å; R5-V8 PolarHBondContact O-N 3.34Å; R5-A9 WeakPolarHBondContact O-CB 3.36Å; R5-A9 PolarHBondContact O-N 3Å
6G93.6Very high92.6Very high44 Ų44110.4 Ų110.445%0.45458%0.575SS.*Hα-helixtrans-63.3-41175.800000113.2A2 K3 L4 A9 A10A2-G6 PolarHBondContact O-N 3.01Å; K3-G6 PolarHBondContact O-N 2.93Å; L4-G6 VanDerWaalsContact C-N 3.34Å; L4-G6 PolarHBondContact O-N 3.27Å; G6-A9 PolarHBondContact O-N 3.14Å; G6-A10 WeakPolarHBondContact O-CB 3.36Å; G6-A10 PolarHBondContact O-N 3.25Å
7Q94.2Very high92.9Very high134 Ų134108.8 Ų108.863%0.62657%0.571SS**Hα-helixtrans-64.8-44.7175.4-74.7178-19.700112.4K3 L4 A9 A10 E11K3-Q7 WeakPolarHBondContact O-CG 3.43Å; K3-Q7 PolarHBondContact O-N 2.96Å; L4-Q7 PolarHBondContact O-N 3.37Å; Q7-A9 VanDerWaalsContact C-N 3.35Å; Q7-A9 PolarHBondContact O-N 3.43Å; Q7-A10 PolarHBondContact O-N 2.92Å; Q7-E11 WeakPolarHBondContact O-CB 3.46Å; Q7-E11 PolarHBondContact O-N 3.48Å
8V95.1Very high93.1Very high81 Ų81105.8 Ų105.849%0.49156%0.56SS.*Hα-helixtrans-61.9-43.7176.9172.40000110.9L4 R5 E11 Q12L4-V8 WeakPolarHBondContact O-CG2 3.4Å; L4-V8 PolarHBondContact O-N 2.96Å; R5-V8 PolarHBondContact O-N 3.34Å; V8-E11 PolarHBondContact O-N 3.4Å; V8-Q12 HydrophobicContact CG1-CG 4.32Å; V8-Q12 WeakPolarHBondContact O-CB 3.15Å; V8-Q12 VanDerWaalsContact O-CG 3.26Å; V8-Q12 WeakPolarHBondContact O-CG 3.32Å; V8-Q12 PolarHBondContact O-N 3.37Å
9A95Very high93.4Very high53 Ų53106.7 Ų106.744%0.43856%0.559SS.*Hα-helixtrans-62.9-4217700000112.2R5 G6 Q7 E11 Q12 E13R5-A9 WeakPolarHBondContact O-CB 3.36Å; R5-A9 PolarHBondContact O-N 3Å; G6-A9 PolarHBondContact O-N 3.14Å; Q7-A9 VanDerWaalsContact C-N 3.35Å; Q7-A9 PolarHBondContact O-N 3.43Å; A9-E11 VanDerWaalsContact C-N 3.34Å; A9-E11 PolarHBondContact O-N 2.98Å; A9-Q12 PolarHBondContact O-N 2.98Å; A9-E13 WeakPolarHBondContact O-CB 3.35Å; A9-E13 PolarHBondContact O-N 2.99Å
10A94.8Very high93.6Very high63 Ų63104.8 Ų104.852%0.52155%0.551SS.*Hα-helixtrans-63.4-39.817600000112.2G6 Q7 E13 R14G6-A10 WeakPolarHBondContact O-CB 3.36Å; G6-A10 PolarHBondContact O-N 3.25Å; Q7-A10 PolarHBondContact O-N 2.92Å; A10-E13 PolarHBondContact O-N 3Å; A10-R14 WeakPolarHBondContact O-CB 3.47Å; A10-R14 PolarHBondContact O-N 3.11Å
11E96.2Very high93.8Very high97 Ų97102.7 Ų102.745%0.45355%0.546SS..Hα-helixtrans-70.2-38.2177.1-175.358.1-162.300112.1Q7 V8 A9 R14 L15Q7-E11 WeakPolarHBondContact O-CB 3.46Å; Q7-E11 PolarHBondContact O-N 3.48Å; V8-E11 PolarHBondContact O-N 3.4Å; A9-E11 VanDerWaalsContact C-N 3.34Å; A9-E11 PolarHBondContact O-N 2.98Å; E11-R14 PolarHBondContact O-N 2.89Å; E11-R14 IonicContact OE1-CZ 2.77Å; E11-R14 IonicContact OE1-NE 2.7Å; E11-R14 PolarHBondContact OE1-NE 2.86Å; E11-R14 IonicContact OE1-NH2 3.52Å; E11-R14 PolarHBondContact OE1-NH2 3.16Å; E11-R14 IonicContact OE2-CZ 3.83Å; E11-R14 IonicContact OE2-NE 3.58Å; E11-R14 PolarHBondContact OE2-NE 3.34Å; E11-R14 IonicContact OE2-NH2 3.65Å; E11-L15 WeakPolarHBondContact O-CB 3.32Å; E11-L15 PolarHBondContact O-N 2.93Å
12Q97.5Very high95.1Very high127 Ų12798 Ų9859%0.59352%0.522SS*.Hα-helixtrans-62-43.7172.8-76174.6-2100111.6V8 A9 L15 L16V8-Q12 HydrophobicContact CG1-CG 4.32Å; V8-Q12 WeakPolarHBondContact O-CB 3.15Å; V8-Q12 VanDerWaalsContact O-CG 3.26Å; V8-Q12 WeakPolarHBondContact O-CG 3.32Å; V8-Q12 PolarHBondContact O-N 3.37Å; A9-Q12 PolarHBondContact O-N 2.98Å; Q12-L15 PolarHBondContact O-N 3.47Å; Q12-L16 WeakPolarHBondContact O-CB 3.42Å; Q12-L16 PolarHBondContact O-N 2.95Å
13E96.5Very high95.7Very high110 Ų11098.4 Ų98.451%0.51451%0.511SS..Hα-helixtrans-64.2-45176.6-173.457.9-150.200111.3A9 A10 L15 L16 V17A9-E13 WeakPolarHBondContact O-CB 3.35Å; A9-E13 PolarHBondContact O-N 2.99Å; A10-E13 PolarHBondContact O-N 3Å; E13-L15 VanDerWaalsContact C-N 3.3Å; E13-L15 PolarHBondContact O-N 3.38Å; E13-L16 PolarHBondContact O-N 3.01Å; E13-L16 VanDerWaalsContact O-N 3.15Å; E13-V17 WeakPolarHBondContact O-CG2 3.48Å; E13-V17 PolarHBondContact O-N 3.42Å
14R97Very high96.2Very high141 Ų14195.5 Ų95.553%0.53250%0.501SS..Hα-helixtrans-57.2-44.3175.3-169.8-16873.175.5-0.1111.7A10 E11 S18A10-R14 WeakPolarHBondContact O-CB 3.47Å; A10-R14 PolarHBondContact O-N 3.11Å; E11-R14 PolarHBondContact O-N 2.89Å; E11-R14 IonicContact OE1-CZ 2.77Å; E11-R14 IonicContact OE1-NE 2.7Å; E11-R14 PolarHBondContact OE1-NE 2.86Å; E11-R14 IonicContact OE1-NH2 3.52Å; E11-R14 PolarHBondContact OE1-NH2 3.16Å; E11-R14 IonicContact OE2-CZ 3.83Å; E11-R14 IonicContact OE2-NE 3.58Å; E11-R14 PolarHBondContact OE2-NE 3.34Å; E11-R14 IonicContact OE2-NH2 3.65Å; R14-S18 WeakPolarHBondContact O-CB 3.32Å; R14-S18 PolarHBondContact O-N 2.96Å
15L97.8Very high96.6Very high88 Ų8895.4 Ų95.446%0.46149%0.492SS..Hα-helixtrans-66.5-41.9176.9-177.262.7000111.4E11 Q12 E13 S18 K19E11-L15 WeakPolarHBondContact O-CB 3.32Å; E11-L15 PolarHBondContact O-N 2.93Å; Q12-L15 PolarHBondContact O-N 3.47Å; E13-L15 VanDerWaalsContact C-N 3.3Å; E13-L15 PolarHBondContact O-N 3.38Å; L15-S18 PolarHBondContact O-N 2.87Å; L15-K19 HydrophobicContact CD1-CG 4.36Å; L15-K19 HydrophobicContact CG-CG 4.46Å; L15-K19 WeakPolarHBondContact O-CG 3.39Å; L15-K19 PolarHBondContact O-N 3.2Å
16L97.9Very high96.9Very high98 Ų9890.6 Ų90.651%0.51348%0.479SS..Hα-helixtrans-61.1-48.9178.1-175.664000110.9Q12 E13 S18 K19 V20Q12-L16 WeakPolarHBondContact O-CB 3.42Å; Q12-L16 PolarHBondContact O-N 2.95Å; E13-L16 PolarHBondContact O-N 3.01Å; E13-L16 VanDerWaalsContact O-N 3.15Å; L16-S18 VanDerWaalsContact C-N 3.32Å; L16-S18 PolarHBondContact O-N 3.29Å; L16-K19 PolarHBondContact O-N 3.42Å; L16-K19 VanDerWaalsContact O-N 3.16Å; L16-V20 WeakPolarHBondContact O-CG2 3.36Å; L16-V20 PolarHBondContact O-N 2.93Å
17V97.6Very high97.1Very high84 Ų8493.6 Ų93.651%0.50948%0.481SS..Hα-helixtrans-57-45.9175.3171.70000110.9E13 K19 V20 S21E13-V17 WeakPolarHBondContact O-CG2 3.48Å; E13-V17 PolarHBondContact O-N 3.42Å; V17-K19 PolarHBondContact O-N 3.4Å; V17-V20 PolarHBondContact O-N 3.18Å; V17-S21 PolarHBondContact O-N 3.35Å; V17-S21 PolarHBondContact O-OG 3.44Å
18S97.6Very high97.3Very high54 Ų5492 Ų9238%0.37848%0.481SS..Hα-helixtrans-60.7-42.3176.8175.20000112.5R14 L15 L16 S21 E22R14-S18 WeakPolarHBondContact O-CB 3.32Å; R14-S18 PolarHBondContact O-N 2.96Å; L15-S18 PolarHBondContact O-N 2.87Å; L16-S18 VanDerWaalsContact C-N 3.32Å; L16-S18 PolarHBondContact O-N 3.29Å; S18-S21 WeakPolarHBondContact CA-OG 3.4Å; S18-S21 PolarHBondContact O-N 2.88Å; S18-S21 PolarHBondContact O-OG 3.31Å; S18-E22 WeakPolarHBondContact O-CB 3.27Å; S18-E22 PolarHBondContact O-N 2.84Å
19K97.9Very high97.5Very high123 Ų12392.3 Ų92.354%0.53548%0.477SS..Hα-helixtrans-68.6-39.5177.2-69.2-61.5-177.9-174.50112.1L15 L16 V17 E22 I23L15-K19 HydrophobicContact CD1-CG 4.36Å; L15-K19 HydrophobicContact CG-CG 4.46Å; L15-K19 WeakPolarHBondContact O-CG 3.39Å; L15-K19 PolarHBondContact O-N 3.2Å; L16-K19 PolarHBondContact O-N 3.42Å; L16-K19 VanDerWaalsContact O-N 3.16Å; V17-K19 PolarHBondContact O-N 3.4Å; K19-E22 PolarHBondContact O-N 3.44Å; K19-I23 WeakPolarHBondContact O-CB 3.32Å; K19-I23 VanDerWaalsContact O-CG1 3.22Å; K19-I23 WeakPolarHBondContact O-CG1 3.42Å; K19-I23 PolarHBondContact O-N 2.96Å
20V97.8Very high97.6Very high68 Ų6893.9 Ų93.941%0.41248%0.477SS..Hα-helixtrans-62.3-44.7174.7171.10000110.8L16 V17 E22 I23 Q24L16-V20 WeakPolarHBondContact O-CG2 3.36Å; L16-V20 PolarHBondContact O-N 2.93Å; V17-V20 PolarHBondContact O-N 3.18Å; V20-E22 VanDerWaalsContact C-N 3.33Å; V20-E22 PolarHBondContact O-N 2.8Å; V20-I23 PolarHBondContact O-N 3.41Å; V20-Q24 WeakPolarHBondContact O-CG 3.5Å; V20-Q24 PolarHBondContact O-N 2.98Å
21S97.5Very high97.8Very high61 Ų6195 Ų9543%0.42748%0.475SS..Hα-helixtrans-63.1-38.9176.8610000112.6V17 S18 Q24 R25V17-S21 PolarHBondContact O-N 3.35Å; V17-S21 PolarHBondContact O-OG 3.44Å; S18-S21 WeakPolarHBondContact CA-OG 3.4Å; S18-S21 PolarHBondContact O-N 2.88Å; S18-S21 PolarHBondContact O-OG 3.31Å; S21-Q24 PolarHBondContact O-N 3.39Å; S21-R25 WeakPolarHBondContact O-CB 3.24Å; S21-R25 PolarHBondContact O-N 3.44Å
22E98Very high97.9Very high75 Ų7596.6 Ų96.635%0.3548%0.48SS..Hα-helixtrans-68.8-40.8178.1-179.961.1-17500111.6S18 K19 V20 Q24 R25 L26S18-E22 WeakPolarHBondContact O-CB 3.27Å; S18-E22 PolarHBondContact O-N 2.84Å; K19-E22 PolarHBondContact O-N 3.44Å; V20-E22 VanDerWaalsContact C-N 3.33Å; V20-E22 PolarHBondContact O-N 2.8Å; E22-Q24 VanDerWaalsContact C-N 3.34Å; E22-Q24 PolarHBondContact O-N 3.24Å; E22-R25 WeakPolarHBondContact O-CB 3.45Å; E22-R25 PolarHBondContact O-N 2.98Å; E22-R25 IonicContact OE1-CZ 2.85Å; E22-R25 IonicContact OE1-NE 3.35Å; E22-R25 IonicContact OE1-NH2 3.53Å; E22-R25 PolarHBondContact OE1-NH2 2.91Å; E22-R25 IonicContact OE2-CZ 3.23Å; E22-R25 IonicContact OE2-NE 2.8Å; E22-R25 PolarHBondContact OE2-NE 3.37Å; E22-R25 IonicContact OE2-NH2 3.25Å; E22-L26 HydrophobicContact CG-CD1 4.19Å; E22-L26 WeakPolarHBondContact O-CB 3.4Å; E22-L26 WeakPolarHBondContact O-CG 3.34Å; E22-L26 PolarHBondContact O-N 3.07Å
23I98.3Very high97.9Very high91 Ų9194.3 Ų94.347%0.46747%0.471SS..Hα-helixtrans-60.2-45.2173.7-72.6168.2000110.3K19 V20 R25 L26 H27K19-I23 WeakPolarHBondContact O-CB 3.32Å; K19-I23 VanDerWaalsContact O-CG1 3.22Å; K19-I23 WeakPolarHBondContact O-CG1 3.42Å; K19-I23 PolarHBondContact O-N 2.96Å; V20-I23 PolarHBondContact O-N 3.41Å; I23-R25 PolarHBondContact O-N 3.46Å; I23-L26 PolarHBondContact O-N 2.91Å; I23-H27 WeakPolarHBondContact CG2-CE1 3.44Å; I23-H27 VanDerWaalsContact CG2-ND1 3.33Å; I23-H27 WeakPolarHBondContact CG2-ND1 3.31Å; I23-H27 PolarHBondContact O-N 3.07Å; I23-H27 PolarHBondContact O-ND1 3.21Å
24Q98.2Very high98Very high123 Ų12396.3 Ų96.358%0.57547%0.474SS*.Hα-helixtrans-62.2-41.6177.2-73.9173.6-15.300112.3V20 S21 E22 H27 T28V20-Q24 WeakPolarHBondContact O-CG 3.5Å; V20-Q24 PolarHBondContact O-N 2.98Å; S21-Q24 PolarHBondContact O-N 3.39Å; E22-Q24 VanDerWaalsContact C-N 3.34Å; E22-Q24 PolarHBondContact O-N 3.24Å; Q24-H27 PolarHBondContact O-N 3.24Å; Q24-T28 PolarHBondContact O-N 3.3Å; Q24-T28 PolarHBondContact O-OG1 3.41Å
25R98.3Very high98.1Very high113 Ų11393.4 Ų93.443%0.42648%0.476SS..Hα-helixtrans-60.4-48.9175.2-169.9-166.56869.2-0.4111.2S21 E22 I23 H27 T28 E29S21-R25 WeakPolarHBondContact O-CB 3.24Å; S21-R25 PolarHBondContact O-N 3.44Å; E22-R25 WeakPolarHBondContact O-CB 3.45Å; E22-R25 PolarHBondContact O-N 2.98Å; E22-R25 IonicContact OE1-CZ 2.85Å; E22-R25 IonicContact OE1-NE 3.35Å; E22-R25 IonicContact OE1-NH2 3.53Å; E22-R25 PolarHBondContact OE1-NH2 2.91Å; E22-R25 IonicContact OE2-CZ 3.23Å; E22-R25 IonicContact OE2-NE 2.8Å; E22-R25 PolarHBondContact OE2-NE 3.37Å; E22-R25 IonicContact OE2-NH2 3.25Å; I23-R25 PolarHBondContact O-N 3.46Å; R25-H27 PolarHBondContact O-N 2.93Å; R25-T28 WeakPolarHBondContact O-CB 3.49Å; R25-T28 PolarHBondContact O-N 2.85Å; R25-E29 IonicContact CZ-OE2 2.67Å; R25-E29 IonicContact NH1-OE2 2.94Å; R25-E29 PolarHBondContact NH1-OE2 3.08Å; R25-E29 PolarHBondContact O-N 2.9Å
26L98.2Very high98.1Very high74 Ų7493.4 Ų93.439%0.38747%0.473SS..Hα-helixtrans-63.9-37.9178.6-72.1171.6000112.5E22 I23 E29 L30E22-L26 HydrophobicContact CG-CD1 4.19Å; E22-L26 WeakPolarHBondContact O-CB 3.4Å; E22-L26 WeakPolarHBondContact O-CG 3.34Å; E22-L26 PolarHBondContact O-N 3.07Å; I23-L26 PolarHBondContact O-N 2.91Å; L26-E29 PolarHBondContact O-N 3.22Å; L26-L30 WeakPolarHBondContact O-CB 3.34Å; L26-L30 WeakPolarHBondContact O-CG 3.46Å; L26-L30 PolarHBondContact O-N 2.99Å
27H98.1Very high98.2Very high107 Ų10794.3 Ų94.350%0.49548%0.478SS..Hα-helixtrans-62.6-44.6173.4-80.290.4000111.6I23 Q24 R25 E29 L30 D31I23-H27 WeakPolarHBondContact CG2-CE1 3.44Å; I23-H27 VanDerWaalsContact CG2-ND1 3.33Å; I23-H27 WeakPolarHBondContact CG2-ND1 3.31Å; I23-H27 PolarHBondContact O-N 3.07Å; I23-H27 PolarHBondContact O-ND1 3.21Å; Q24-H27 PolarHBondContact O-N 3.24Å; R25-H27 PolarHBondContact O-N 2.93Å; H27-E29 VanDerWaalsContact C-N 3.32Å; H27-E29 PolarHBondContact O-N 3.48Å; H27-L30 PolarHBondContact O-N 3.02Å; H27-D31 PolarHBondContact O-N 3.42Å
28T98.1Very high98.2Very high100 Ų10094.1 Ų94.161%0.61348%0.476SS*.Hα-helixtrans-61.2-42176.9-54.20000111.5Q24 R25 D31 K32Q24-T28 PolarHBondContact O-N 3.3Å; Q24-T28 PolarHBondContact O-OG1 3.41Å; R25-T28 WeakPolarHBondContact O-CB 3.49Å; R25-T28 PolarHBondContact O-N 2.85Å; T28-D31 PolarHBondContact O-N 3.02Å; T28-K32 WeakPolarHBondContact O-CB 3.34Å; T28-K32 PolarHBondContact O-N 3.46Å
29E98.3Very high98.2Very high89 Ų8996.4 Ų96.442%0.41649%0.485SS..Hα-helixtrans-66.2-42.1176.9-171.3174.5179.200112R25 L26 H27 K32 L33R25-E29 IonicContact CZ-OE2 2.67Å; R25-E29 IonicContact NH1-OE2 2.94Å; R25-E29 PolarHBondContact NH1-OE2 3.08Å; R25-E29 PolarHBondContact O-N 2.9Å; L26-E29 PolarHBondContact O-N 3.22Å; H27-E29 VanDerWaalsContact C-N 3.32Å; H27-E29 PolarHBondContact O-N 3.48Å; E29-K32 WeakPolarHBondContact O-CB 3.33Å; E29-K32 PolarHBondContact O-N 3.47Å; E29-L33 HydrophobicContact CG-CD1 4.33Å; E29-L33 WeakPolarHBondContact O-CB 3.4Å; E29-L33 WeakPolarHBondContact O-CG 3.41Å; E29-L33 PolarHBondContact O-N 2.9Å
30L98.4Very high98.2Very high85 Ų8595.2 Ų95.245%0.44549%0.487SS..Hα-helixtrans-61.4-43.6174.7-80.9175.3000112.2L26 H27 K32 L33 R34L26-L30 WeakPolarHBondContact O-CB 3.34Å; L26-L30 WeakPolarHBondContact O-CG 3.46Å; L26-L30 PolarHBondContact O-N 2.99Å; H27-L30 PolarHBondContact O-N 3.02Å; L30-K32 VanDerWaalsContact C-N 3.34Å; L30-L33 PolarHBondContact O-N 3.4Å; L30-R34 WeakPolarHBondContact O-CB 3.37Å; L30-R34 VanDerWaalsContact O-CG 3.23Å; L30-R34 WeakPolarHBondContact O-CG 3.42Å; L30-R34 PolarHBondContact O-N 3.42Å
31D98.5Very high98.3Very high87 Ų8798.8 Ų98.847%0.46550%0.497SS..Hα-helixtrans-67.4-37.8178.9-71-22.1000111.4H27 T28 R34 S35H27-D31 PolarHBondContact O-N 3.42Å; T28-D31 PolarHBondContact O-N 3.02Å; D31-R34 PolarHBondContact O-N 2.88Å; D31-R34 IonicContact OD1-NH1 3.63Å; D31-R34 PolarHBondContact OD1-NH1 3Å; D31-S35 PolarHBondContact O-N 3.38Å
32K98.5Very high98.3Very high131 Ų131100.6 Ų100.657%0.5750%0.502SS*.Hα-helixtrans-59.6-51.1171.3-171-168.6-179.7-146.80111.5T28 E29 L30 R34 S35 E36T28-K32 WeakPolarHBondContact O-CB 3.34Å; T28-K32 PolarHBondContact O-N 3.46Å; E29-K32 WeakPolarHBondContact O-CB 3.33Å; E29-K32 PolarHBondContact O-N 3.47Å; L30-K32 VanDerWaalsContact C-N 3.34Å; K32-R34 VanDerWaalsContact C-N 3.33Å; K32-R34 PolarHBondContact O-N 3.32Å; K32-S35 WeakPolarHBondContact O-CB 3.47Å; K32-S35 PolarHBondContact O-N 3.2Å; K32-S35 VanDerWaalsContact O-N 3.15Å; K32-E36 WeakPolarHBondContact CE-OE1 3.49Å; K32-E36 IonicContact NZ-OE1 3.55Å; K32-E36 PolarHBondContact NZ-OE1 2.98Å; K32-E36 WeakPolarHBondContact O-CG 3.42Å; K32-E36 PolarHBondContact O-N 2.95Å
33L98.4Very high98.3Very high78 Ų78103.8 Ų103.841%0.40851%0.511SS..Hα-helixtrans-62.4-38.9179.5-72.7171.8000112.1E29 L30 S35 E36 I37E29-L33 HydrophobicContact CG-CD1 4.33Å; E29-L33 WeakPolarHBondContact O-CB 3.4Å; E29-L33 WeakPolarHBondContact O-CG 3.41Å; E29-L33 PolarHBondContact O-N 2.9Å; L30-L33 PolarHBondContact O-N 3.4Å; L33-S35 VanDerWaalsContact C-N 3.34Å; L33-S35 PolarHBondContact O-N 2.98Å; L33-E36 PolarHBondContact O-N 3.42Å; L33-I37 WeakPolarHBondContact O-CB 3.4Å; L33-I37 VanDerWaalsContact O-CG1 3.24Å; L33-I37 WeakPolarHBondContact O-CG1 3.48Å; L33-I37 PolarHBondContact O-N 3.18Å
34R98.5Very high98.3Very high152 Ų152104 Ų10457%0.57451%0.513SS*.Hα-helixtrans-61.8-41.3173.9-76.5168.7173.6168.9-3.9112.1L30 D31 K32 T38L30-R34 WeakPolarHBondContact O-CB 3.37Å; L30-R34 VanDerWaalsContact O-CG 3.23Å; L30-R34 WeakPolarHBondContact O-CG 3.42Å; L30-R34 PolarHBondContact O-N 3.42Å; D31-R34 PolarHBondContact O-N 2.88Å; D31-R34 IonicContact OD1-NH1 3.63Å; D31-R34 PolarHBondContact OD1-NH1 3Å; K32-R34 VanDerWaalsContact C-N 3.33Å; K32-R34 PolarHBondContact O-N 3.32Å; R34-T38 WeakPolarHBondContact O-CB 3.45Å; R34-T38 PolarHBondContact O-N 3.47Å; R34-T38 PolarHBondContact O-OG1 3.48Å
35S98.3Very high98.3Very high81 Ų81101.3 Ų101.357%0.56651%0.505SS*.Hα-helixtrans-64.1-44.7174.9-173.90000111.4D31 K32 L33 T38 N39D31-S35 PolarHBondContact O-N 3.38Å; K32-S35 WeakPolarHBondContact O-CB 3.47Å; K32-S35 PolarHBondContact O-N 3.2Å; K32-S35 VanDerWaalsContact O-N 3.15Å; L33-S35 VanDerWaalsContact C-N 3.34Å; L33-S35 PolarHBondContact O-N 2.98Å; S35-T38 PolarHBondContact O-N 2.82Å; S35-N39 WeakPolarHBondContact O-CB 3.47Å; S35-N39 PolarHBondContact O-N 3.35Å
36E98.5Very high98.3Very high88 Ų8899.8 Ų99.841%0.41150%0.503SS..Hα-helixtrans-62.4-45177-72.3176.9-16700111.8K32 L33 T38 N39 V40K32-E36 WeakPolarHBondContact CE-OE1 3.49Å; K32-E36 IonicContact NZ-OE1 3.55Å; K32-E36 PolarHBondContact NZ-OE1 2.98Å; K32-E36 WeakPolarHBondContact O-CG 3.42Å; K32-E36 PolarHBondContact O-N 2.95Å; L33-E36 PolarHBondContact O-N 3.42Å; E36-T38 VanDerWaalsContact C-N 3.32Å; E36-T38 PolarHBondContact O-N 2.97Å; E36-N39 PolarHBondContact O-N 3.34Å; E36-V40 WeakPolarHBondContact O-CG2 3.49Å; E36-V40 PolarHBondContact O-N 3.44Å
37I98.3Very high98.3Very high117 Ų117100.3 Ų100.360%0.651%0.505SS*.Hα-helixtrans-58.8-44.4175.1-72.2166.1000110.9L33 V40 K41L33-I37 WeakPolarHBondContact O-CB 3.4Å; L33-I37 VanDerWaalsContact O-CG1 3.24Å; L33-I37 WeakPolarHBondContact O-CG1 3.48Å; L33-I37 PolarHBondContact O-N 3.18Å; I37-V40 PolarHBondContact O-N 3.28Å; I37-K41 WeakPolarHBondContact O-CB 3.41Å; I37-K41 PolarHBondContact O-N 3.39Å
38T98.4Very high98.3Very high79 Ų7998.5 Ų98.549%0.48550%0.501SS..Hα-helixtrans-62.2-44.7177.7-590000111.1R34 S35 E36 K41 N42R34-T38 WeakPolarHBondContact O-CB 3.45Å; R34-T38 PolarHBondContact O-N 3.47Å; R34-T38 PolarHBondContact O-OG1 3.48Å; S35-T38 PolarHBondContact O-N 2.82Å; E36-T38 VanDerWaalsContact C-N 3.32Å; E36-T38 PolarHBondContact O-N 2.97Å; T38-K41 PolarHBondContact O-N 3.48Å; T38-N42 VanDerWaalsContact O-CG 3.23Å; T38-N42 PolarHBondContact O-N 3.15Å; T38-N42 PolarHBondContact O-ND2 3.43Å; T38-N42 PolarHBondContact O-OD1 2.88Å
39N98.4Very high98.4Very high103 Ų10399.5 Ų99.555%0.55150%0.499SS*.Hα-helixtrans-63.1-46.3178.1-175.952.3000112.3S35 E36 K41 N42 R43S35-N39 WeakPolarHBondContact O-CB 3.47Å; S35-N39 PolarHBondContact O-N 3.35Å; E36-N39 PolarHBondContact O-N 3.34Å; N39-K41 VanDerWaalsContact C-N 3.34Å; N39-K41 PolarHBondContact O-N 3.38Å; N39-N42 PolarHBondContact O-N 3.41Å; N39-R43 WeakPolarHBondContact O-CB 3.49Å; N39-R43 PolarHBondContact O-N 2.98Å
40V98.3Very high98.4Very high97 Ų97100.2 Ų100.259%0.58850%0.502SS*.Hα-helixtrans-62.6-41.7177.2170.70000110.9E36 I37 R43 N44E36-V40 WeakPolarHBondContact O-CG2 3.49Å; E36-V40 PolarHBondContact O-N 3.44Å; I37-V40 PolarHBondContact O-N 3.28Å; V40-R43 PolarHBondContact O-N 3.41Å; V40-N44 WeakPolarHBondContact O-CB 3.38Å; V40-N44 PolarHBondContact O-N 2.89Å
41K98.4Very high98.4Very high144 Ų144101 Ų10163%0.62650%0.504SS*.Hα-helixtrans-60.7-46.7176-175.5179.3177.2-178.70111.5I37 T38 N39 R43 N44 T45I37-K41 WeakPolarHBondContact O-CB 3.41Å; I37-K41 PolarHBondContact O-N 3.39Å; T38-K41 PolarHBondContact O-N 3.48Å; N39-K41 VanDerWaalsContact C-N 3.34Å; N39-K41 PolarHBondContact O-N 3.38Å; K41-R43 PolarHBondContact O-N 2.93Å; K41-N44 PolarHBondContact O-N 3.39Å; K41-T45 PolarHBondContact O-N 2.83Å; K41-T45 PolarHBondContact O-OG1 2.99Å
42N98.3Very high98.4Very high99 Ų99101.2 Ų101.253%0.52951%0.505SS..Hα-helixtrans-62.1-43.3177.9-68.8-12.3000111.7T38 N39 T45 Q46T38-N42 VanDerWaalsContact O-CG 3.23Å; T38-N42 PolarHBondContact O-N 3.15Å; T38-N42 PolarHBondContact O-ND2 3.43Å; T38-N42 PolarHBondContact O-OD1 2.88Å; N39-N42 PolarHBondContact O-N 3.41Å; N42-T45 PolarHBondContact O-N 3.44Å; N42-Q46 PolarHBondContact O-N 3.38Å
43R98.1Very high98.4Very high141 Ų141100.8 Ų100.853%0.53251%0.505SS..Hα-helixtrans-66.7-37177.8-167137.7-179.478.5-1.3112.4N39 V40 K41 Q46 I47N39-R43 WeakPolarHBondContact O-CB 3.49Å; N39-R43 PolarHBondContact O-N 2.98Å; V40-R43 PolarHBondContact O-N 3.41Å; K41-R43 PolarHBondContact O-N 2.93Å; R43-Q46 VanDerWaalsContact NH1-OE1 3.07Å; R43-Q46 PolarHBondContact O-N 2.99Å; R43-I47 HydrophobicContact CG-CD1 4.11Å; R43-I47 VanDerWaalsContact O-CG1 3.27Å; R43-I47 WeakPolarHBondContact O-CG1 3.24Å; R43-I47 PolarHBondContact O-N 3.02Å
44N98.2Very high98.3Very high97 Ų97101.6 Ų101.652%0.51951%0.513SS..Hα-helixtrans-63.7-43.8173.5-172.649.7000111.5V40 K41 Q46 I47 V48V40-N44 WeakPolarHBondContact O-CB 3.38Å; V40-N44 PolarHBondContact O-N 2.89Å; K41-N44 PolarHBondContact O-N 3.39Å; N44-Q46 VanDerWaalsContact C-N 3.35Å; N44-Q46 PolarHBondContact O-N 3.47Å; N44-I47 PolarHBondContact O-N 3.43Å; N44-V48 VanDerWaalsContact O-CG2 3.31Å; N44-V48 WeakPolarHBondContact O-CG2 3.48Å; N44-V48 PolarHBondContact O-N 2.94Å
45T98.2Very high98.3Very high66 Ų6698.4 Ų98.441%0.40551%0.507SS..Hα-helixtrans-58.2-46.7173.9-62.90000111.5K41 N42 I47 V48 E49K41-T45 PolarHBondContact O-N 2.83Å; K41-T45 PolarHBondContact O-OG1 2.99Å; N42-T45 PolarHBondContact O-N 3.44Å; T45-I47 PolarHBondContact O-N 2.95Å; T45-V48 PolarHBondContact O-N 2.97Å; T45-E49 WeakPolarHBondContact CG2-OE1 3.27Å; T45-E49 WeakPolarHBondContact O-CG 3.4Å; T45-E49 PolarHBondContact O-N 3.31Å
46Q98.3Very high98.3Very high81 Ų81100.7 Ų100.738%0.37951%0.507SS..Hα-helixtrans-59-45.6177-168.5-163.4-1.100112.3N42 R43 N44 V48 E49 E50N42-Q46 PolarHBondContact O-N 3.38Å; R43-Q46 VanDerWaalsContact NH1-OE1 3.07Å; R43-Q46 PolarHBondContact O-N 2.99Å; N44-Q46 VanDerWaalsContact C-N 3.35Å; N44-Q46 PolarHBondContact O-N 3.47Å; Q46-V48 VanDerWaalsContact C-N 3.34Å; Q46-V48 PolarHBondContact O-N 3.28Å; Q46-E49 PolarHBondContact O-N 3.47Å; Q46-E50 WeakPolarHBondContact CG-OE1 3.37Å; Q46-E50 PolarHBondContact NE2-OE1 3Å; Q46-E50 WeakPolarHBondContact O-CG 3.31Å; Q46-E50 PolarHBondContact O-N 3.49Å
47I98.4Very high98.3Very high85 Ų85100 Ų10044%0.43651%0.511SS..Hα-helixtrans-64.1-40.1179.6-71.2165.9000111.2R43 N44 T45 E50 H51R43-I47 HydrophobicContact CG-CD1 4.11Å; R43-I47 VanDerWaalsContact O-CG1 3.27Å; R43-I47 WeakPolarHBondContact O-CG1 3.24Å; R43-I47 PolarHBondContact O-N 3.02Å; N44-I47 PolarHBondContact O-N 3.43Å; T45-I47 PolarHBondContact O-N 2.95Å; I47-E50 PolarHBondContact O-N 3.48Å; I47-H51 VanDerWaalsContact O-CB 3.25Å; I47-H51 WeakPolarHBondContact O-CB 3.25Å; I47-H51 PolarHBondContact O-N 3.3Å
48V98.5Very high98.3Very high68 Ų6898.7 Ų98.741%0.41251%0.505SS..Hα-helixtrans-63.3-43.3176.51700000110.8N44 T45 Q46 H51 D52N44-V48 VanDerWaalsContact O-CG2 3.31Å; N44-V48 WeakPolarHBondContact O-CG2 3.48Å; N44-V48 PolarHBondContact O-N 2.94Å; T45-V48 PolarHBondContact O-N 2.97Å; Q46-V48 VanDerWaalsContact C-N 3.34Å; Q46-V48 PolarHBondContact O-N 3.28Å; V48-H51 PolarHBondContact O-N 3.35Å; V48-D52 PolarHBondContact O-N 2.89Å
49E98.4Very high98.3Very high122 Ų12297.3 Ų97.357%0.5750%0.502SS*.Hα-helixtrans-62.7-45176.1-70.7170.2-176.300112.2T45 Q46 H51 D52 Q53T45-E49 WeakPolarHBondContact CG2-OE1 3.27Å; T45-E49 WeakPolarHBondContact O-CG 3.4Å; T45-E49 PolarHBondContact O-N 3.31Å; Q46-E49 PolarHBondContact O-N 3.47Å; E49-H51 VanDerWaalsContact C-N 3.34Å; E49-H51 PolarHBondContact O-N 3.43Å; E49-D52 PolarHBondContact O-N 2.94Å; E49-Q53 WeakPolarHBondContact O-CB 3.48Å; E49-Q53 PolarHBondContact O-N 3.35Å
50E98.4Very high98.3Very high103 Ų10396.6 Ų96.648%0.48150%0.498SS..Hα-helixtrans-62.6-39.8176.1-73.2172.9-167.500112Q46 I47 T54Q46-E50 WeakPolarHBondContact CG-OE1 3.37Å; Q46-E50 PolarHBondContact NE2-OE1 3Å; Q46-E50 WeakPolarHBondContact O-CG 3.31Å; Q46-E50 PolarHBondContact O-N 3.49Å; I47-E50 PolarHBondContact O-N 3.48Å; E50-T54 WeakPolarHBondContact O-CB 3.32Å; E50-T54 PolarHBondContact O-N 3.31Å; E50-T54 PolarHBondContact O-OG1 3.3Å
51H98.3Very high98.3Very high103 Ų10394.1 Ų94.148%0.47749%0.488SS..Hα-helixtrans-63.3-48175.7170.7-91.1000111.7I47 V48 E49 Q53 T54 L55I47-H51 VanDerWaalsContact O-CB 3.25Å; I47-H51 WeakPolarHBondContact O-CB 3.25Å; I47-H51 PolarHBondContact O-N 3.3Å; V48-H51 PolarHBondContact O-N 3.35Å; E49-H51 VanDerWaalsContact C-N 3.34Å; E49-H51 PolarHBondContact O-N 3.43Å; H51-Q53 VanDerWaalsContact C-N 3.31Å; H51-Q53 PolarHBondContact O-N 2.97Å; H51-T54 WeakPolarHBondContact O-CB 3.34Å; H51-T54 PolarHBondContact O-N 2.86Å; H51-T54 VanDerWaalsContact O-N 3.15Å; H51-L55 WeakPolarHBondContact CE1-CD1 3.39Å; H51-L55 PolarHBondContact O-N 2.99Å
52D98.5Very high98.3Very high91 Ų9192.1 Ų92.149%0.48748%0.481SS..Hα-helixtrans-64.7-38179.8-72.1-9.3000111.6V48 E49 T54 L55 K56V48-D52 PolarHBondContact O-N 2.89Å; E49-D52 PolarHBondContact O-N 2.94Å; D52-T54 VanDerWaalsContact C-N 3.34Å; D52-L55 PolarHBondContact O-N 3.47Å; D52-K56 WeakPolarHBondContact O-CB 3.44Å; D52-K56 PolarHBondContact O-N 3.31Å
53Q98.4Very high98.3Very high122 Ų12294.8 Ų94.857%0.5749%0.487SS*.Hα-helixtrans-63.8-40.1173.5-175.656.142.900111.9E49 H51 K56 S57E49-Q53 WeakPolarHBondContact O-CB 3.48Å; E49-Q53 PolarHBondContact O-N 3.35Å; H51-Q53 VanDerWaalsContact C-N 3.31Å; H51-Q53 PolarHBondContact O-N 2.97Å; Q53-K56 PolarHBondContact O-N 3.31Å; Q53-S57 PolarHBondContact O-N 2.92Å
54T98.1Very high98.3Very high94 Ų9491.8 Ų91.858%0.57749%0.485SS*.Hα-helixtrans-66.3-43.4176.6-58.60000111.4E50 H51 D52 K56 S57 L58E50-T54 WeakPolarHBondContact O-CB 3.32Å; E50-T54 PolarHBondContact O-N 3.31Å; E50-T54 PolarHBondContact O-OG1 3.3Å; H51-T54 WeakPolarHBondContact O-CB 3.34Å; H51-T54 PolarHBondContact O-N 2.86Å; H51-T54 VanDerWaalsContact O-N 3.15Å; D52-T54 VanDerWaalsContact C-N 3.34Å; T54-K56 VanDerWaalsContact C-N 3.32Å; T54-K56 PolarHBondContact O-N 3.21Å; T54-S57 PolarHBondContact O-N 2.97Å; T54-L58 WeakPolarHBondContact O-CB 3.44Å; T54-L58 PolarHBondContact O-N 3.22Å
55L98.5Very high98.4Very high86 Ų8691.7 Ų91.745%0.4548%0.483SS..Hα-helixtrans-61.3-40.3175.1-76.9-176.3000112.2H51 D52 L58 A59H51-L55 WeakPolarHBondContact CE1-CD1 3.39Å; H51-L55 PolarHBondContact O-N 2.99Å; D52-L55 PolarHBondContact O-N 3.47Å; L55-L58 PolarHBondContact O-N 3.49Å; L55-A59 WeakPolarHBondContact O-CB 3.08Å; L55-A59 PolarHBondContact O-N 3.41Å
56K98.3Very high98.4Very high129 Ų12995 Ų9556%0.56149%0.492SS*.Hα-helixtrans-62.7-47.2175.2-173.1175.1-179.1177.20111.5D52 Q53 T54 L58 A59 D60D52-K56 WeakPolarHBondContact O-CB 3.44Å; D52-K56 PolarHBondContact O-N 3.31Å; Q53-K56 PolarHBondContact O-N 3.31Å; T54-K56 VanDerWaalsContact C-N 3.32Å; T54-K56 PolarHBondContact O-N 3.21Å; K56-L58 VanDerWaalsContact C-N 3.28Å; K56-L58 PolarHBondContact O-N 3.35Å; K56-A59 PolarHBondContact O-N 2.92Å; K56-D60 PolarHBondContact O-N 3.38Å
57S98.4Very high98.4Very high72 Ų7294.1 Ų94.150%0.50350%0.495SS..Hα-helixtrans-60.9-37.7176-170.40000112.3Q53 T54 D60 A61Q53-S57 PolarHBondContact O-N 2.92Å; T54-S57 PolarHBondContact O-N 2.97Å; S57-D60 PolarHBondContact O-N 3.46Å; S57-A61 WeakPolarHBondContact O-CB 3.49Å; S57-A61 PolarHBondContact O-N 2.87Å
58L98.4Very high98.4Very high91 Ų9194 Ų9448%0.47650%0.495SS..Hα-helixtrans-64.5-44.6175.4179.165.2000111.3T54 L55 K56 D60 A61 Q62T54-L58 WeakPolarHBondContact O-CB 3.44Å; T54-L58 PolarHBondContact O-N 3.22Å; L55-L58 PolarHBondContact O-N 3.49Å; K56-L58 VanDerWaalsContact C-N 3.28Å; K56-L58 PolarHBondContact O-N 3.35Å; L58-D60 VanDerWaalsContact C-N 3.34Å; L58-D60 PolarHBondContact O-N 3.34Å; L58-A61 PolarHBondContact O-N 3.43Å; L58-Q62 WeakPolarHBondContact O-CB 3.48Å; L58-Q62 WeakPolarHBondContact O-CG 3.45Å; L58-Q62 PolarHBondContact O-N 3.48Å
59A98.3Very high98.4Very high50 Ų5096.4 Ų96.441%0.41350%0.502SS..Hα-helixtrans-62.2-40.7177.100000112L55 K56 Q62 K63L55-A59 WeakPolarHBondContact O-CB 3.08Å; L55-A59 PolarHBondContact O-N 3.41Å; K56-A59 PolarHBondContact O-N 2.92Å; A59-Q62 PolarHBondContact O-N 3.15Å; A59-K63 WeakPolarHBondContact O-CB 3.47Å; A59-K63 PolarHBondContact O-N 3Å
60D98.2Very high98.4Very high88 Ų8895.2 Ų95.247%0.47150%0.503SS..Hα-helixtrans-66-41176.3-72.5-24000111.9K56 S57 L58 K63 T64K56-D60 PolarHBondContact O-N 3.38Å; S57-D60 PolarHBondContact O-N 3.46Å; L58-D60 VanDerWaalsContact C-N 3.34Å; L58-D60 PolarHBondContact O-N 3.34Å; D60-K63 PolarHBondContact O-N 3Å; D60-T64 PolarHBondContact O-N 2.84Å; D60-T64 PolarHBondContact O-OG1 2.89Å
61A98.2Very high98.4Very high45 Ų4594.3 Ų94.337%0.37250%0.501SS..Hα-helixtrans-63.1-44.917400000111.6S57 L58 K63 T64 I65S57-A61 WeakPolarHBondContact O-CB 3.49Å; S57-A61 PolarHBondContact O-N 2.87Å; L58-A61 PolarHBondContact O-N 3.43Å; A61-K63 VanDerWaalsContact C-N 3.33Å; A61-K63 PolarHBondContact O-N 3.31Å; A61-T64 WeakPolarHBondContact O-CB 3.23Å; A61-T64 PolarHBondContact O-N 2.92Å; A61-I65 WeakPolarHBondContact O-CG1 3.24Å; A61-I65 PolarHBondContact O-N 2.86Å
62Q98.3Very high98.4Very high102 Ų10293.8 Ų93.848%0.47750%0.501SS..Hα-helixtrans-61-40175.6-75.2178.1-19.300112.4L58 A59 T64 I65 K66L58-Q62 WeakPolarHBondContact O-CB 3.48Å; L58-Q62 WeakPolarHBondContact O-CG 3.45Å; L58-Q62 PolarHBondContact O-N 3.48Å; A59-Q62 PolarHBondContact O-N 3.15Å; Q62-T64 VanDerWaalsContact C-N 3.34Å; Q62-I65 PolarHBondContact O-N 3.37Å; Q62-K66 WeakPolarHBondContact O-CG 3.44Å; Q62-K66 PolarHBondContact O-N 3.28Å
63K98.4Very high98.4Very high154 Ų15492.3 Ų92.367%0.6750%0.501SS*.Hα-helixtrans-62.9-42.6175-176.1-178.2178-175.90111.4A59 D60 A61 K66 S67A59-K63 WeakPolarHBondContact O-CB 3.47Å; A59-K63 PolarHBondContact O-N 3Å; D60-K63 PolarHBondContact O-N 3Å; A61-K63 VanDerWaalsContact C-N 3.33Å; A61-K63 PolarHBondContact O-N 3.31Å; K63-K66 PolarHBondContact O-N 2.89Å; K63-S67 PolarHBondContact O-N 3.24Å
64T98.5Very high98.3Very high79 Ų7993.6 Ų93.649%0.48550%0.501SS..Hα-helixtrans-62.8-44.8176.9-57.70000111.2D60 A61 Q62 K66 S67 N68D60-T64 PolarHBondContact O-N 2.84Å; D60-T64 PolarHBondContact O-OG1 2.89Å; A61-T64 WeakPolarHBondContact O-CB 3.23Å; A61-T64 PolarHBondContact O-N 2.92Å; Q62-T64 VanDerWaalsContact C-N 3.34Å; T64-K66 PolarHBondContact O-N 3.01Å; T64-S67 WeakPolarHBondContact O-CB 3.41Å; T64-S67 PolarHBondContact O-N 3.42Å; T64-N68 PolarHBondContact O-N 3.27Å
65I98.6Very high98.3Very high94 Ų9492.9 Ų92.948%0.48249%0.493SS..Hα-helixtrans-58.3-50.1176.1-70.2166.2000110.7A61 Q62 S67 N68 E69A61-I65 WeakPolarHBondContact O-CG1 3.24Å; A61-I65 PolarHBondContact O-N 2.86Å; Q62-I65 PolarHBondContact O-N 3.37Å; I65-S67 VanDerWaalsContact C-N 3.27Å; I65-S67 PolarHBondContact O-N 2.91Å; I65-N68 WeakPolarHBondContact O-CB 3.49Å; I65-N68 PolarHBondContact O-N 3.42Å; I65-N68 VanDerWaalsContact O-N 3.07Å; I65-E69 HydrophobicContact CG2-CG 4.35Å; I65-E69 WeakPolarHBondContact O-CG 3.35Å; I65-E69 PolarHBondContact O-N 3.23Å
66K98.5Very high98.2Very high136 Ų13693.4 Ų93.459%0.59150%0.496SS*.Hα-helixtrans-58.9-38.4177.7-73177.4179.5179.20113Q62 K63 T64 T70Q62-K66 WeakPolarHBondContact O-CG 3.44Å; Q62-K66 PolarHBondContact O-N 3.28Å; K63-K66 PolarHBondContact O-N 2.89Å; T64-K66 PolarHBondContact O-N 3.01Å; K66-T70 PolarHBondContact O-N 3.47Å; K66-T70 VanDerWaalsContact O-N 3.08Å; K66-T70 PolarHBondContact O-OG1 2.87Å
67S98.4Very high98.1Very high62 Ų6295 Ų9543%0.43450%0.499SS..Hα-helixtrans-63.1-46.5174.8-173.50000111K63 T64 I65 T70 I71K63-S67 PolarHBondContact O-N 3.24Å; T64-S67 WeakPolarHBondContact O-CB 3.41Å; T64-S67 PolarHBondContact O-N 3.42Å; I65-S67 VanDerWaalsContact C-N 3.27Å; I65-S67 PolarHBondContact O-N 2.91Å; S67-T70 WeakPolarHBondContact O-CB 3.5Å; S67-T70 PolarHBondContact O-N 2.93Å; S67-I71 WeakPolarHBondContact O-CG1 3.47Å; S67-I71 PolarHBondContact O-N 3.39Å
68N98.6Very high97.9Very high82 Ų8294.6 Ų94.644%0.43949%0.489SS..Hα-helixtrans-63.8-41.9178.1-69-7.5000111.9T64 I65 T70 I71 I72T64-N68 PolarHBondContact O-N 3.27Å; I65-N68 WeakPolarHBondContact O-CB 3.49Å; I65-N68 PolarHBondContact O-N 3.42Å; I65-N68 VanDerWaalsContact O-N 3.07Å; N68-T70 VanDerWaalsContact C-N 3.28Å; N68-T70 PolarHBondContact O-N 3.4Å; N68-I71 PolarHBondContact O-N 2.95Å; N68-I72 WeakPolarHBondContact O-CB 3.37Å; N68-I72 VanDerWaalsContact O-CG1 3.24Å; N68-I72 WeakPolarHBondContact O-CG1 3.34Å; N68-I72 PolarHBondContact O-N 2.85Å
69E98.7Very high97.7Very high119 Ų11994.7 Ų94.756%0.55649%0.489SS*.Hα-helixtrans-57.3-42.9174.1-73171.9164.500111.5I65 I72 A73I65-E69 HydrophobicContact CG2-CG 4.35Å; I65-E69 WeakPolarHBondContact O-CG 3.35Å; I65-E69 PolarHBondContact O-N 3.23Å; E69-I72 PolarHBondContact O-N 2.77Å; E69-A73 WeakPolarHBondContact O-CB 3.37Å; E69-A73 PolarHBondContact O-N 3.47Å
70T98.1Very high97.4Very high98 Ų9895.2 Ų95.260%0.60149%0.493SS*.Hα-helixtrans-64.7-44177.1-560000111.5K66 S67 N68 A73 W74K66-T70 PolarHBondContact O-N 3.47Å; K66-T70 VanDerWaalsContact O-N 3.08Å; K66-T70 PolarHBondContact O-OG1 2.87Å; S67-T70 WeakPolarHBondContact O-CB 3.5Å; S67-T70 PolarHBondContact O-N 2.93Å; N68-T70 VanDerWaalsContact C-N 3.28Å; N68-T70 PolarHBondContact O-N 3.4Å; T70-A73 PolarHBondContact O-N 2.96Å; T70-W74 PolarHBondContact O-N 3.33Å
71I98.4Very high97.1Very high84 Ų8495.4 Ų95.443%0.43149%0.491SS..Hα-helixtrans-62.5-46.4177-67.8165.1000110.5S67 N68 A73 W74 L75S67-I71 WeakPolarHBondContact O-CG1 3.47Å; S67-I71 PolarHBondContact O-N 3.39Å; N68-I71 PolarHBondContact O-N 2.95Å; I71-A73 VanDerWaalsContact C-N 3.34Å; I71-A73 PolarHBondContact O-N 3.43Å; I71-W74 PolarHBondContact O-N 3.48Å; I71-L75 HydrophobicContact CG2-CD1 3.87Å; I71-L75 HydrophobicContact CG2-CG 4.3Å; I71-L75 VanDerWaalsContact O-CG 3.32Å; I71-L75 WeakPolarHBondContact O-CG 3.33Å; I71-L75 PolarHBondContact O-N 2.9Å
72I98.1Very high96.6Very high92 Ų9298.3 Ų98.347%0.47250%0.501SS..Hα-helixtrans-60.1-44.9177.4-69.2164.6000110.4N68 E69 W74 L75 N76N68-I72 WeakPolarHBondContact O-CB 3.37Å; N68-I72 VanDerWaalsContact O-CG1 3.24Å; N68-I72 WeakPolarHBondContact O-CG1 3.34Å; N68-I72 PolarHBondContact O-N 2.85Å; E69-I72 PolarHBondContact O-N 2.77Å; I72-W74 VanDerWaalsContact C-N 3.34Å; I72-W74 PolarHBondContact O-N 3.38Å; I72-L75 PolarHBondContact O-N 2.95Å; I72-N76 WeakPolarHBondContact O-CB 3.47Å; I72-N76 VanDerWaalsContact O-CG 3.25Å; I72-N76 PolarHBondContact O-N 2.76Å; I72-N76 PolarHBondContact O-ND2 3.31Å
73A98.1Very high95.9Very high60 Ų6098.2 Ų98.250%0.49650%0.504SS..Hα-helixtrans-61-41.9177.100000112.3E69 T70 I71 R77E69-A73 WeakPolarHBondContact O-CB 3.37Å; E69-A73 PolarHBondContact O-N 3.47Å; T70-A73 PolarHBondContact O-N 2.96Å; I71-A73 VanDerWaalsContact C-N 3.34Å; I71-A73 PolarHBondContact O-N 3.43Å; A73-R77 PolarHBondContact O-N 2.7Å; A73-R77 VanDerWaalsContact O-N 3.07Å
74W97.8Very high94.8Very high149 Ų14994 Ų9456%0.56449%0.493SS*.Hα-helixtrans-64.7-46.1175.1178.777.7000112T70 I71 I72 N76 R77 Q78T70-W74 PolarHBondContact O-N 3.33Å; I71-W74 PolarHBondContact O-N 3.48Å; I72-W74 VanDerWaalsContact C-N 3.34Å; I72-W74 PolarHBondContact O-N 3.38Å; W74-N76 PolarHBondContact O-N 2.77Å; W74-R77 WeakPolarHBondContact O-CB 3.41Å; W74-R77 PolarHBondContact O-N 2.91Å; W74-Q78 HydrophobicContact CD2-CG 4.05Å; W74-Q78 HydrophobicContact CE3-CG 4.36Å; W74-Q78 HydrophobicContact CH2-CG 4.07Å; W74-Q78 HydrophobicContact CZ2-CG 3.72Å; W74-Q78 HydrophobicContact CZ3-CG 4.38Å; W74-Q78 WeakPolarHBondContact O-CG 3.38Å; W74-Q78 PolarHBondContact O-N 3.36Å
75L97.9Very high93.3Very high79 Ų7991.6 Ų91.641%0.41448%0.484SS..Hα-helixtrans-60.2-44.4177.1-71.5172.2000111.8I71 I72 R77 Q78 I79I71-L75 HydrophobicContact CG2-CD1 3.87Å; I71-L75 HydrophobicContact CG2-CG 4.3Å; I71-L75 VanDerWaalsContact O-CG 3.32Å; I71-L75 WeakPolarHBondContact O-CG 3.33Å; I71-L75 PolarHBondContact O-N 2.9Å; I72-L75 PolarHBondContact O-N 2.95Å; L75-R77 VanDerWaalsContact C-N 3.3Å; L75-R77 PolarHBondContact O-N 3.49Å; L75-Q78 PolarHBondContact O-N 3.29Å; L75-I79 WeakPolarHBondContact O-CG1 3.43Å; L75-I79 PolarHBondContact O-N 2.92Å
76N96.7Very high91.6Very high96 Ų9694.6 Ų94.651%0.51349%0.491SS..Hα-helixtrans-61.3-39.5176.9-73.9-18.6000112I72 W74 I79 A80I72-N76 WeakPolarHBondContact O-CB 3.47Å; I72-N76 VanDerWaalsContact O-CG 3.25Å; I72-N76 PolarHBondContact O-N 2.76Å; I72-N76 PolarHBondContact O-ND2 3.31Å; W74-N76 PolarHBondContact O-N 2.77Å; N76-I79 PolarHBondContact O-N 3.31Å; N76-A80 WeakPolarHBondContact O-CB 3.48Å; N76-A80 PolarHBondContact O-N 3.16Å
77R96Very high89.7Confident164 Ų16492 Ų9262%0.61949%0.486SS*.Hα-helixtrans-62.3-46.3173.3179.3178.1176.7163.82111.6A73 W74 L75 I79 A80 E81A73-R77 PolarHBondContact O-N 2.7Å; A73-R77 VanDerWaalsContact O-N 3.07Å; W74-R77 WeakPolarHBondContact O-CB 3.41Å; W74-R77 PolarHBondContact O-N 2.91Å; L75-R77 VanDerWaalsContact C-N 3.3Å; L75-R77 PolarHBondContact O-N 3.49Å; R77-I79 VanDerWaalsContact C-N 3.32Å; R77-I79 PolarHBondContact O-N 3.4Å; R77-A80 PolarHBondContact O-N 2.84Å; R77-E81 HydrophobicContact CG-CG 4.45Å; R77-E81 VanDerWaalsContact CG-OE1 3.31Å; R77-E81 WeakPolarHBondContact CG-OE1 3.22Å; R77-E81 IonicContact CZ-OE1 3.37Å; R77-E81 IonicContact NE-OE1 3.84Å; R77-E81 PolarHBondContact NE-OE1 3.47Å; R77-E81 IonicContact NH2-OE1 3.83Å; R77-E81 WeakPolarHBondContact O-CB 3.37Å; R77-E81 WeakPolarHBondContact O-CG 3.33Å; R77-E81 PolarHBondContact O-N 3.33Å
78Q94.6Very high87.9Confident63 Ų6393.9 Ų93.929%0.29449%0.488SS..Hα-helixtrans-61-40177.3-66.1-60.1115.300112W74 L75 N82W74-Q78 HydrophobicContact CD2-CG 4.05Å; W74-Q78 HydrophobicContact CE3-CG 4.36Å; W74-Q78 HydrophobicContact CH2-CG 4.07Å; W74-Q78 HydrophobicContact CZ2-CG 3.72Å; W74-Q78 HydrophobicContact CZ3-CG 4.38Å; W74-Q78 WeakPolarHBondContact O-CG 3.38Å; W74-Q78 PolarHBondContact O-N 3.36Å; L75-Q78 PolarHBondContact O-N 3.29Å; Q78-N82 WeakPolarHBondContact O-CB 3.46Å; Q78-N82 VanDerWaalsContact O-CG 3.26Å; Q78-N82 PolarHBondContact O-N 3.44Å; Q78-N82 PolarHBondContact O-ND2 2.88Å
79I93.4Very high86Confident92 Ų9294.4 Ų94.447%0.47249%0.491SS..Hα-helixtrans-63.1-49.4176-67.4165.5000110.3L75 N76 R77 E81 N82 D83L75-I79 WeakPolarHBondContact O-CG1 3.43Å; L75-I79 PolarHBondContact O-N 2.92Å; N76-I79 PolarHBondContact O-N 3.31Å; R77-I79 VanDerWaalsContact C-N 3.32Å; R77-I79 PolarHBondContact O-N 3.4Å; I79-E81 VanDerWaalsContact C-N 3.31Å; I79-E81 PolarHBondContact O-N 3.03Å; I79-N82 PolarHBondContact O-N 2.9Å; I79-N82 VanDerWaalsContact O-N 3.16Å; I79-D83 PolarHBondContact O-N 3.15Å
80A92.8Very high84Confident62 Ų6296.4 Ų96.451%0.51249%0.493SS..Hα-helixtrans-60.5-38.4179.200000113N76 R77 S84N76-A80 WeakPolarHBondContact O-CB 3.48Å; N76-A80 PolarHBondContact O-N 3.16Å; R77-A80 PolarHBondContact O-N 2.84Å; A80-S84 VanDerWaalsContact O-CB 3.27Å; A80-S84 WeakPolarHBondContact O-CB 3.44Å; A80-S84 PolarHBondContact O-N 2.85Å; A80-S84 VanDerWaalsContact O-N 3.11Å
81E90.7Very high82.1Confident91 Ų9197.5 Ų97.543%0.42550%0.495SS..Hα-helixtrans-67.5-40.8175.4-71.9174.4-172.300111.9R77 I79 G85R77-E81 HydrophobicContact CG-CG 4.45Å; R77-E81 VanDerWaalsContact CG-OE1 3.31Å; R77-E81 WeakPolarHBondContact CG-OE1 3.22Å; R77-E81 IonicContact CZ-OE1 3.37Å; R77-E81 IonicContact NE-OE1 3.84Å; R77-E81 PolarHBondContact NE-OE1 3.47Å; R77-E81 IonicContact NH2-OE1 3.83Å; R77-E81 WeakPolarHBondContact O-CB 3.37Å; R77-E81 WeakPolarHBondContact O-CG 3.33Å; R77-E81 PolarHBondContact O-N 3.33Å; I79-E81 VanDerWaalsContact C-N 3.31Å; I79-E81 PolarHBondContact O-N 3.03Å; E81-G85 PolarHBondContact O-N 3.35Å
82N87.3Confident80Confident107 Ų107100.6 Ų100.657%0.57251%0.505SS*.Hα-helixtrans-68.6-42.5177.6-76.3-38.9000112.9Q78 I79 G85 Y86Q78-N82 WeakPolarHBondContact O-CB 3.46Å; Q78-N82 VanDerWaalsContact O-CG 3.26Å; Q78-N82 PolarHBondContact O-N 3.44Å; Q78-N82 PolarHBondContact O-ND2 2.88Å; I79-N82 PolarHBondContact O-N 2.9Å; I79-N82 VanDerWaalsContact O-N 3.16Å; N82-G85 PolarHBondContact O-N 3.06Å; N82-Y86 WeakPolarHBondContact O-CB 3.33Å; N82-Y86 PolarHBondContact O-N 3.29Å
83D85.2Confident77.9Confident100 Ų100103.5 Ų103.554%0.53552%0.521SS..Hα-helixtrans-66.7-39.8178-72.9-19.9000111.2I79 Y86 V87I79-D83 PolarHBondContact O-N 3.15Å; D83-Y86 PolarHBondContact O-N 3.35Å; D83-V87 VanDerWaalsContact O-CG2 3.32Å; D83-V87 WeakPolarHBondContact O-CG2 3.36Å; D83-V87 PolarHBondContact O-N 2.88Å
84S74.4Confident75.5Confident64 Ų64103.5 Ų103.545%0.44852%0.517SS..Hα-helixtrans-63.3-44.5173.4-176.30000111.8A80 Y86 V87 Q88A80-S84 VanDerWaalsContact O-CB 3.27Å; A80-S84 WeakPolarHBondContact O-CB 3.44Å; A80-S84 PolarHBondContact O-N 2.85Å; A80-S84 VanDerWaalsContact O-N 3.11Å; S84-Y86 VanDerWaalsContact C-N 3.34Å; S84-Y86 PolarHBondContact O-N 3.42Å; S84-V87 PolarHBondContact O-N 2.67Å; S84-Q88 WeakPolarHBondContact O-CG 3.43Å; S84-Q88 PolarHBondContact O-N 2.94Å
85G67.8Low72.9Confident29 Ų29100.5 Ų100.530%0.29952%0.524SS..Hα-helixtrans-63-38.9175.700000112.8E81 N82 Q88 N89E81-G85 PolarHBondContact O-N 3.35Å; N82-G85 PolarHBondContact O-N 3.06Å; G85-Q88 PolarHBondContact O-N 2.94Å; G85-N89 WeakPolarHBondContact O-CB 3.41Å; G85-N89 PolarHBondContact O-N 3.25Å; G85-N89 PolarHBondContact O-ND2 3.46Å
86Y61.1Low70.4Confident157 Ų157104.9 Ų104.962%0.61654%0.54SS*.Hα-helixtrans-66.4-43.7176.4-170.7-105.6000111.9N82 D83 S84 N89 R90N82-Y86 WeakPolarHBondContact O-CB 3.33Å; N82-Y86 PolarHBondContact O-N 3.29Å; D83-Y86 PolarHBondContact O-N 3.35Å; S84-Y86 VanDerWaalsContact C-N 3.34Å; S84-Y86 PolarHBondContact O-N 3.42Å; Y86-N89 PolarHBondContact O-N 2.96Å; Y86-R90 HydrophobicContact CD1-CG 4.48Å; Y86-R90 VanDerWaalsContact CE1-CD 3.41Å; Y86-R90 HydrophobicContact CE1-CG 4.24Å; Y86-R90 WeakPolarHBondContact O-CB 3.44Å; Y86-R90 WeakPolarHBondContact O-CG 3.43Å; Y86-R90 PolarHBondContact O-N 2.92Å
87V60.2Low68Low81 Ų81105.5 Ų105.549%0.49155%0.55SS..Hα-helixtrans-64.6-42.9175.7174.30000111.3D83 S84 R90 L91D83-V87 VanDerWaalsContact O-CG2 3.32Å; D83-V87 WeakPolarHBondContact O-CG2 3.36Å; D83-V87 PolarHBondContact O-N 2.88Å; S84-V87 PolarHBondContact O-N 2.67Å; V87-R90 PolarHBondContact O-N 2.96Å; V87-L91 HydrophobicContact CG1-CD1 3.92Å; V87-L91 HydrophobicContact CG1-CG 4.5Å; V87-L91 WeakPolarHBondContact O-CG 3.26Å; V87-L91 PolarHBondContact O-N 3.31Å
88Q59.8Low65.6Low102 Ų102104.2 Ų104.248%0.47756%0.56SS.*Hα-helixtrans-65.4-40.3177-73-151.624.400112.9S84 G85 L91 K92S84-Q88 WeakPolarHBondContact O-CG 3.43Å; S84-Q88 PolarHBondContact O-N 2.94Å; G85-Q88 PolarHBondContact O-N 2.94Å; Q88-L91 PolarHBondContact O-N 3.48Å; Q88-K92 WeakPolarHBondContact O-CG 3.41Å; Q88-K92 PolarHBondContact O-N 3.32Å
89N58.5Low63.3Low94 Ų94107.9 Ų107.950%0.50358%0.58SS.*Hα-helixtrans-68.2-36.4177.5-71.7-20.9000111.7G85 Y86 K92 L93G85-N89 WeakPolarHBondContact O-CB 3.41Å; G85-N89 PolarHBondContact O-N 3.25Å; G85-N89 PolarHBondContact O-ND2 3.46Å; Y86-N89 PolarHBondContact O-N 2.96Å; N89-K92 PolarHBondContact O-N 2.99Å; N89-L93 WeakPolarHBondContact O-CB 3.5Å; N89-L93 WeakPolarHBondContact O-CG 3.48Å; N89-L93 PolarHBondContact O-N 2.87Å
90R56.4Low61Low161 Ų161108.6 Ų108.661%0.60859%0.593SS**Hα-helixtrans-66.3-38.1172.8-74-170.271.6-117.8-0.2112.7Y86 V87 S94Y86-R90 HydrophobicContact CD1-CG 4.48Å; Y86-R90 VanDerWaalsContact CE1-CD 3.41Å; Y86-R90 HydrophobicContact CE1-CG 4.24Å; Y86-R90 WeakPolarHBondContact O-CB 3.44Å; Y86-R90 WeakPolarHBondContact O-CG 3.43Å; Y86-R90 PolarHBondContact O-N 2.92Å; V87-R90 PolarHBondContact O-N 2.96Å; R90-S94 WeakPolarHBondContact O-CB 3.41Å; R90-S94 PolarHBondContact O-N 3.05Å
91L58.4Low59.1Low120 Ų120111.8 Ų111.863%0.62861%0.606SS**Hα-helixtrans-68.3-35.6175.5-72.5167.5000112.3V87 Q88V87-L91 HydrophobicContact CG1-CD1 3.92Å; V87-L91 HydrophobicContact CG1-CG 4.5Å; V87-L91 WeakPolarHBondContact O-CG 3.26Å; V87-L91 PolarHBondContact O-N 3.31Å; Q88-L91 PolarHBondContact O-N 3.48Å
92K55.5Low56.6Low150 Ų150113.1 Ų113.165%0.65263%0.625SS**Hα-helixtrans-74-32.3176.7-71.6176.1-176.4175.70113.7Q88 N89Q88-K92 WeakPolarHBondContact O-CG 3.41Å; Q88-K92 PolarHBondContact O-N 3.32Å; N89-K92 PolarHBondContact O-N 2.99Å
93L54.2Low54.7Low153 Ų153113.6 Ų113.680%0.80164%0.637SS**Hα-helixtrans-82.2-18.3175.2-71.2164.7000112.6N89 A95N89-L93 WeakPolarHBondContact O-CB 3.5Å; N89-L93 WeakPolarHBondContact O-CG 3.48Å; N89-L93 PolarHBondContact O-N 2.87Å; L93-A95 PolarHBondContact O-N 3.37Å
94S47.1Very low52.7Low59 Ų59112 Ų11241%0.41364%0.644SS.*  trans-8155.6168.6170.60000110.9R90 F96R90-S94 WeakPolarHBondContact O-CB 3.41Å; R90-S94 PolarHBondContact O-N 3.05Å; S94-F96 PolarHBondContact O-N 3.29Å; S94-F96 WeakPolarHBondContact OG-CD2 3.35Å
95A43.3Very low51.5Low87 Ų87115 Ų11572%0.71966%0.659SS**  trans-77.164160.600000108.9L93L93-A95 PolarHBondContact O-N 3.37Å
96F45.1Very low50.4Low170 Ų170120.9 Ų120.975%0.74668%0.682SS**  trans-79.6123.4164-71.2-72.9000107.4S94 V98S94-F96 PolarHBondContact O-N 3.29Å; S94-F96 WeakPolarHBondContact OG-CD2 3.35Å; F96-V98 PolarHBondContact O-N 2.95Å; F96-V98 VanDerWaalsContact O-N 3.15Å
97P47Very low49.8Very low110 Ų110118.9 Ų118.971%0.71469%0.69SS**  trans-63.3121.1173.626.7-30.6000107.4I99P97-I99 PolarHBondContact O-N 3.47Å
98V45.7Very low48.7Very low137 Ų137120.8 Ų120.883%0.8370%0.704SS**  trans-58.7106.5163.6170.60000106.1F96 S100F96-V98 PolarHBondContact O-N 2.95Å; F96-V98 VanDerWaalsContact O-N 3.15Å; V98-S100 VanDerWaalsContact C-N 3.33Å; V98-S100 PolarHBondContact O-N 3.49Å
99I45.6Very low47.8Very low139 Ų139123.5 Ų123.571%0.71372%0.721SS**  trans-67.2100.5167.4-62.3175.6000105.4P97 V101P97-I99 PolarHBondContact O-N 3.47Å; I99-V101 HydrophobicContact CG2-CG1 4.15Å; I99-V101 PolarHBondContact O-N 3.44Å
100S45.5Very low47.2Very low107 Ų107124.3 Ų124.375%0.74873%0.729SS**  trans-6895170.1-168.70000107.9V98 S102V98-S100 VanDerWaalsContact C-N 3.33Å; V98-S100 PolarHBondContact O-N 3.49Å; S100-S102 PolarHBondContact O-N 3.45Å
101V52.6Low46.4Very low129 Ų129123 Ų12378%0.78274%0.739SS**  trans-79.499.4164.5-74.80000107.8I99 S103I99-V101 HydrophobicContact CG2-CG1 4.15Å; I99-V101 PolarHBondContact O-N 3.44Å; V101-S103 PolarHBondContact O-N 3.04Å; V101-S103 VanDerWaalsContact O-N 3.14Å
102S38.6Very low45.9Very low120 Ų120122.2 Ų122.284%0.83974%0.742SS**  trans-57.3108.1167.1178.50000109.7S100S100-S102 PolarHBondContact O-N 3.45Å
103S47.5Very low45.2Very low116 Ų116122.7 Ų122.781%0.81175%0.751SS**  trans-165.399.5151.8-174.80000110.4V101V101-S103 PolarHBondContact O-N 3.04Å; V101-S103 VanDerWaalsContact O-N 3.14Å
104G43.5Very low44.5Very low66 Ų66120 Ų12068%0.6875%0.746SS**  trans92.5117.4147.200000118
105V48.1Very low44.3Very low128 Ų128124.3 Ų124.378%0.77676%0.763SS**  trans86.488142.8-1620000118.7
106I45.4Very low44.3Very low153 Ų153125.4 Ų125.479%0.78576%0.761SS**  52.2115.2126.9-45.5164000119
107C47.4Very low44.4Very low115 Ų115124.2 Ų124.278%0.77776%0.762SS**  131.5117.8122.7-134.10000114.7
108P37.2Very low44.1Very low120 Ų120125 Ų12578%0.77977%0.765SS**  trans-108.4156.3158.735.5-24.1000111.4
109L41.4Very low44Very low159 Ų159123.5 Ų123.583%0.83276%0.761SS**  trans125.9139.8144.5-158.663.7000116.9
110T44.9Very low44.1Very low111 Ų111122.7 Ų122.768%0.68177%0.767SS**  trans83.497.2156.946.60000122.5
111T41.1Very low43.8Very low134 Ų134120.5 Ų120.582%0.82276%0.762SS**  32.4157.6119.937.10000123.9
112P47.2Very low43.4Very low104 Ų104120 Ų12068%0.67576%0.764SS**  trans-100169.2-135.341.4-37.3000115.3
113N41.2Very low43.8Very low160 Ų160123 Ų12386%0.85677%0.765SS**  trans-178.8134.2140.7-87.8-27.8000113.7
114S38.5Very low43.7Very low97 Ų97126.7 Ų126.768%0.67877%0.766SS**  trans52.4129.5136.3-173.50000121.9
115L43.1Very low43.6Very low149 Ų149129.4 Ų129.478%0.7877%0.772SS**  161.5102.8126.2-83.3163000109
116T43.9Very low43.3Very low109 Ų109128.6 Ų128.667%0.66977%0.772SS**  71.5113.298.255.40000116.2
117D46.6Very low43Very low146 Ų146125.4 Ų125.478%0.78177%0.769SS**  -179.4112.7128.6-97.5-26.2000109
118T42.1Very low43Very low127 Ų127129.1 Ų129.178%0.77977%0.772SS**  49.7133.689.6730000112.8
119S42.6Very low43Very low105 Ų105131.8 Ų131.873%0.73477%0.774SS**  cis-175.2156.713.81660000108.9
120S47.3Very low43.2Very low121 Ų121130.6 Ų130.685%0.84677%0.773SS**  trans70.4140.7159.678.60000118.6
121G40.7Very low43.4Very low62 Ų62131 Ų13164%0.63978%0.776SS**  cis145.9121.96.800000108.4
122S44.1Very low44.1Very low118 Ų118130.3 Ų130.383%0.82577%0.773SS**  trans61.8140.5168.5670000116
123E45.4Very low44.3Very low182 Ų182130.5 Ų130.585%0.8578%0.777SS**  cis-160155.442.3-70.7175.8141.400110
124K45.3Very low44.9Very low195 Ų195132.7 Ų132.785%0.84878%0.775SS**  trans-74.6145.8172.2-151.4-178.4-176.1179.10108.8
125P41.5Very low46Very low123 Ų123135 Ų13580%0.79978%0.779SS**  -150.3146.1100.335-17.3000113.2
126S43Very low46.1Very low110 Ų110132.2 Ų132.277%0.76977%0.769SS**  trans-150.694.4156.7-170.30000109.3
127A38.7Very low46.5Very low87 Ų87135.6 Ų135.672%0.71978%0.782SS**  trans-114.9115.9153.900000104.5
128F46.9Very low46.5Very low192 Ų192134.4 Ų134.484%0.84278%0.78SS**  trans-142.3123.8159-93.8-75000109.8
129E38.8Very low46.6Very low177 Ų177137 Ų13783%0.82778%0.783SS**  trans-53.4128.5171.6-67.9156.4135.600110.4T131E129-T131 PolarHBondContact O-N 2.98Å
130T44.9Very low46.7Very low134 Ų134141 Ų14182%0.82279%0.791SS**  trans-88.7100.6164.1-59.70000108.2
131T49.7Very low46.7Very low119 Ų119139.6 Ų139.673%0.7378%0.781SS**  trans-74.3127.9159.6-490000107.7E129 S133E129-T131 PolarHBondContact O-N 2.98Å; T131-S133 PolarHBondContact O-N 3.47Å
132P55.4Low47Very low119 Ų119145.6 Ų145.677%0.77379%0.792SS**  trans-84.4108.5172.230.4-27.1000109.6
133S51.7Low47Very low108 Ų108144.5 Ų144.576%0.75579%0.79SS**PPolyproline II helixtrans-84.6120.6166.5-178.50000109.4T131T131-S133 PolarHBondContact O-N 3.47Å
134Y52.2Low46.9Very low207 Ų207141.5 Ų141.581%0.81279%0.789SS**PPolyproline II helixtrans-91118.1175.3-169.7-94.9000108.8P136Y134-P136 HydrophobicContact CE1-CB 4.19Å
135I62.3Low47Very low146 Ų146144 Ų14475%0.74979%0.793SS**PPolyproline II helixtrans-104120.1169.1-52.4174.4000107.5
136P44.5Very low47.1Very low90 Ų90144.5 Ų144.558%0.58479%0.793SS**PPolyproline II helixtrans-85.5131.8173.930.9-27.4000110.8Y134Y134-P136 HydrophobicContact CE1-CB 4.19Å
137L52.3Low47.8Very low179 Ų179146 Ų14694%0.93780%0.798SS**PPolyproline II helixtrans-84.1122.8175.1-140.179.4000110
138T47.3Very low48Very low122 Ų122146.6 Ų146.675%0.74879%0.794SS**PPolyproline II helixtrans-86127-173.4-12.50000112.8
139Q43.2Very low47.6Very low180 Ų180144.2 Ų144.284%0.84179%0.789SS**  trans42114.1143-80.2176.9-16.600121.2
140H44.7Very low48Very low191 Ų191143.8 Ų143.888%0.88479%0.785SS**  trans-139105.4130.9-151.612.9000112.1
141S47.6Very low47.7Very low91 Ų91144.6 Ų144.664%0.63679%0.785SS**  trans26108147.1-172.60000120.5
142Q47.8Very low47.7Very low188 Ų188144.4 Ų144.488%0.87978%0.783SS**  -179.8130.3113.5-94.6-179.525.500112.3
143A43.3Very low47.3Very low95 Ų95147.2 Ų147.279%0.78579%0.786SS**  trans51.9103.1152.500000122.1
144S44.3Very low47.7Very low119 Ų119147.8 Ų147.883%0.83279%0.785SS**  67.888.2119.2-141.60000120.7
145R46.6Very low47.8Very low248 Ų248143.3 Ų143.394%0.93678%0.784SS**  -179.5132.6116.6-108.5-178.4171.1-175.7-2.4110.5
146V44.1Very low47.1Very low132 Ų132141.8 Ų141.880%0.878%0.781SS**  trans-87.1127-175.8178.10000110.1
147V56.6Low47.6Very low143 Ų143145.5 Ų145.587%0.86779%0.793SS**  trans-151.9120.7149.9-175.40000107.9
148P43.7Very low47.6Very low98 Ų98142.8 Ų142.864%0.63678%0.783SS**  trans-114.7148.4167.136.1-25000112.8
149L39Very low47.3Very low142 Ų142142.1 Ų142.174%0.74378%0.783SS**  trans64.9138.7148.5-116.853.8000116.4
150F46.8Very low47.2Very low169 Ų169138.3 Ų138.374%0.74178%0.777SS**  cis-156.8141.946.3-62.4-93.4000110.8
151D39.2Very low46.9Very low151 Ų151134.7 Ų134.781%0.80777%0.773SS**  trans-121.4121.2149.3-84.6-36.2000107.2
152T48.2Very low47Very low115 Ų115135.6 Ų135.671%0.70678%0.779SS**  trans-132.298.5169.6-59.10000107.5T154T152-T154 PolarHBondContact O-N 3.35Å
153H48.8Very low46.4Very low178 Ų178133.9 Ų133.982%0.82478%0.776SS**  trans-80.9107.5167.5-69.5-76.2000108.9S155H153-S155 PolarHBondContact O-N 3.34Å
154T59.6Low46.8Very low119 Ų119135 Ų13573%0.7377%0.774SS**  trans-82.5105.6165.3-55.20000108.5T152 V156T152-T154 PolarHBondContact O-N 3.35Å; T154-V156 HydrophobicContact CG2-CG2 4.03Å
155S53.4Low46.6Very low114 Ų114137.2 Ų137.280%0.79778%0.776SS**  trans-91.1115166.6179.70000108.7H153H153-S155 PolarHBondContact O-N 3.34Å
156V48.7Very low46.5Very low113 Ų113131.9 Ų131.969%0.68576%0.764SS**  trans-95.1108.1173.7-169.90000107.9T154 V158T154-V156 HydrophobicContact CG2-CG2 4.03Å; V156-V158 HydrophobicContact CG1-CG2 4.12Å; V156-V158 PolarHBondContact O-N 3.36Å
157M54.3Low46.5Very low168 Ų168133.1 Ų133.183%0.82877%0.766SS**  trans-77.5108.1173.3-159.6-169.9-53.500108.4
158V52.1Low45.7Very low123 Ų123135.3 Ų135.375%0.74577%0.767SS**  trans-103.495.3173.1-1730000108.5V156 S160V156-V158 HydrophobicContact CG1-CG2 4.12Å; V156-V158 PolarHBondContact O-N 3.36Å; V158-S160 PolarHBondContact O-N 3.32Å
159S41.8Very low45.8Very low107 Ų107136.7 Ų136.775%0.74877%0.774SS**  trans-78.8108.3166.5-630000108.8
160S40.9Very low46Very low100 Ų100135.6 Ų135.670%0.69977%0.773SS**  trans-109.295.9171.3155.10000108.9V158V158-S160 PolarHBondContact O-N 3.32Å
161S39Very low45.9Very low115 Ų115134.9 Ų134.980%0.80478%0.776SS**  trans-84.9110.9167.336.70000110
162S48.1Very low46.1Very low110 Ų110137.1 Ų137.177%0.76978%0.779SS**  trans-129.798.9168.3-69.80000110
163N36.4Very low45.9Very low152 Ų152142.6 Ų142.681%0.81379%0.787SS**  trans-65.5128163.7-78-46.4000110
164T51Low45.4Very low120 Ų120141.9 Ų141.974%0.73679%0.788SS**  trans-146.995.3149.854.70000110.6I166T164-I166 PolarHBondContact O-N 3.21Å
165N41.2Very low44.8Very low164 Ų164142.4 Ų142.488%0.87779%0.785SS**  trans-69.897154.9-80-53.2000108.1
166I43.4Very low44Very low136 Ų136145 Ų14570%0.69779%0.785SS**  trans-145.6129.8167.1-48.1-179.9000108.5T164T164-I166 PolarHBondContact O-N 3.21Å
167L43.3Very low43.7Very low159 Ų159148 Ų14883%0.83280%0.796SS**  trans94.757.8173.3-49.9176.3000117.7
168Q41.1Very low42.9Very low189 Ų189144.7 Ų144.788%0.88379%0.787SS**  trans-97150.3136-87.8179.9-42.300108
169T45Very low42.3Very low127 Ų127146.3 Ų146.378%0.77979%0.791SS**  trans78.8119.7-178.7-14.60000111.1
170V43.8Very low42.2Very low119 Ų119146.7 Ų146.772%0.72179%0.794SS**  cis-164.2134.435.6-138.30000103.2
171D44.6Very low42.1Very low154 Ų154146.1 Ų146.182%0.82479%0.79SS**  -172.8118.590.7-107.3-39.7000109.9
172K43.4Very low42.4Very low198 Ų198148.8 Ų148.886%0.86179%0.787SS**  trans-93.5110.6161.4-65.8178.6179-175.60106.1
173R43.2Very low42.3Very low230 Ų230150.7 Ų150.787%0.86879%0.789SS**  trans167.599.1147.7-98.7-167.3-85.7-1570.7112.5
174L39.5Very low42.3Very low163 Ų163151.4 Ų151.485%0.85379%0.793SS**  trans177.489.4137.9-134.566.3000106.6
175I45.9Very low41.8Very low129 Ų129153.4 Ų153.466%0.66280%0.798SS**  61.6100.185.1-59176.6000112.2
176E37.3Very low41.7Very low170 Ų170151.4 Ų151.479%0.79480%0.795SS**  trans60.8109.1139.4-63.1173166.700120
177L42Very low41.6Very low176 Ų176150.5 Ų150.592%0.92180%0.796SS**  -163120.3120.5-124.784000109.4
178P37.8Very low41.7Very low97 Ų97151.8 Ų151.863%0.6380%0.795SS**  trans-104.9155.317037.2-27.9000111.7
179N40.7Very low41.6Very low157 Ų157150.6 Ų150.684%0.8479%0.794SS**  trans93105.3156.4-46.8-34.9000118.3
180S38.4Very low42Very low116 Ų116151 Ų15181%0.81180%0.796SS**  166.796.2121.7-174.50000108.5
181S40.1Very low42.1Very low88 Ų88150.6 Ų150.662%0.61580%0.796SS**  67.9122.992.4-145.80000114.7
182K43.9Very low42.8Very low171 Ų171149.5 Ų149.574%0.74380%0.798SS**  trans78.199.4146-75.9167.9-172.4178.70118
183N45.7Very low43.4Very low150 Ų150144.9 Ų144.980%0.80280%0.796SS**  160.1128.196.1-75.8-29.2000112.4
184N36.6Very low43.6Very low167 Ų167141.6 Ų141.689%0.89379%0.794SS**  trans-65.1132.7173.4-55-48.4000110.7
185L42Very low44.3Very low162 Ų162141 Ų14185%0.84879%0.792SS**  trans-140105.2160.6-164.369.2000110.5V187L185-V187 HydrophobicContact CD1-CG2 4.38Å; L185-V187 HydrophobicContact CG-CG2 4.2Å
186C37.4Very low44.3Very low121 Ų121142 Ų14282%0.81880%0.799SS**  trans-89121.4164.7168.90000107.9
187V42.9Very low45.3Very low118 Ų118140 Ų14072%0.71580%0.798SS**  trans-142.6106.4160.6-176.10000111L185L185-V187 HydrophobicContact CD1-CG2 4.38Å; L185-V187 HydrophobicContact CG-CG2 4.2Å
188K44.9Very low45.7Very low186 Ų186137.7 Ų137.781%0.80979%0.791SS**  trans10.9132.8144.2-74.3169.3172.4174.20120.8
189N38.8Very low46.6Very low163 Ų163144.7 Ų144.787%0.87281%0.805SS**  trans-37.3146165.2-66.7-12.1000117.3
190V52.7Low47.3Very low135 Ų135144.7 Ų144.782%0.81880%0.802SS**  trans-127127158.9179.70000108.1
191P47.5Very low48.4Very low112 Ų112150.3 Ų150.373%0.72782%0.82SS**PPolyproline II helixtrans-93.4149.6167.232.3-25000111.4
192P58.2Low48.8Very low131 Ų131153.4 Ų153.485%0.85183%0.83SS**PPolyproline II helixtrans-87.5132.9-174.533.7-30.5000111.8
193A55.1Low49Very low100 Ų100152.5 Ų152.583%0.82684%0.835SS**PPolyproline II helixtrans-93.6122.2166.400000109.9
194I49Very low49.2Very low162 Ų162152.6 Ų152.683%0.83184%0.837SS**PPolyproline II helixtrans-55.1132.8164.915.5169.9000111.2
195D53.4Low50Low149 Ų149151.8 Ų151.880%0.79783%0.833SS**  trans-132.1101.4162.6-147.2-4.8000109.6
196N46.8Very low50.5Low151 Ų151151.1 Ų151.181%0.80783%0.832SS**  trans-96.3111.9166.2-85.4-24.7000106.5
197T57.6Low51.3Low128 Ų128153.1 Ų153.179%0.78583%0.833SS**  trans-143.3111156.6-69.50000110.4
198V49.9Very low51.9Low127 Ų127155.6 Ų155.677%0.7784%0.842SS**  trans-56.3134.8167.3172.70000110.4
199R57.1Low52.5Low245 Ų245153.3 Ų153.393%0.92584%0.844SS**  trans-131.299.5153.1-170.7177.6-78.9-1301.3109
200M55.2Low53.6Low156 Ų156152.5 Ų152.577%0.76884%0.842SS**  trans-62.2129.5154.2-90.9-160.761.600109.3
201I61Low53.7Low234 Ų234154.1 Ų154.1100%1.284%0.844SS**  -172.10113.8-77.4150.5000105.4

Retrieved 201 of 201 residues in 46.7 ms (Link to these results)