A0A3Q0KDB9_SCHMA Loading...

RAB3GAP2_C domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KDB9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 398 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M43.6Very low53.5Low242 Ų242147.4 Ų147.4100%1.19282%0.824SS**  0120.30-79.7176.6151.400106.4
2S52.9Low54.3Low117 Ų117143.7 Ų143.782%0.81880%0.802SS**  trans-55.7132.4-163.9-720000114.5C4S2-C4 VanDerWaalsContact C-N 3.3Å; S2-C4 PolarHBondContact O-N 3.36Å
3D48.5Very low54.7Low157 Ų157147.5 Ų147.584%0.8481%0.81SS**  trans-61.780.9166.6-72.8-54.3000111.6K5D3-K5 VanDerWaalsContact C-N 3.29Å; D3-K5 PolarHBondContact O-N 2.85Å
4C48.4Very low54.9Low119 Ų119146.9 Ų146.980%0.80481%0.805SS**  trans-82.181.2159.7-79.50000108.3S2 P6S2-C4 VanDerWaalsContact C-N 3.3Å; S2-C4 PolarHBondContact O-N 3.36Å; C4-P6 WeakPolarHBondContact O-CD 3.47Å
5K51.9Low54.9Low181 Ų181141 Ų14179%0.78778%0.783SS**  trans-65.5119.2165.7-85.5-176.5177.81760108.1D3 V7D3-K5 VanDerWaalsContact C-N 3.29Å; D3-K5 PolarHBondContact O-N 2.85Å; K5-V7 PolarHBondContact O-N 2.96Å
6P54.4Low55.2Low121 Ų121144.6 Ų144.679%0.78679%0.789SS**  trans-62.5124.2175.924.2-30.6000108.6C4 S8C4-P6 WeakPolarHBondContact O-CD 3.47Å; P6-S8 VanDerWaalsContact C-N 3.32Å; P6-S8 PolarHBondContact O-N 3.03Å
7V56.7Low55.6Low143 Ų143146.5 Ų146.587%0.86779%0.791SS**  trans-66.996171.7179.20000106.6K5 S9K5-V7 PolarHBondContact O-N 2.96Å; V7-S9 PolarHBondContact O-N 3.15Å; V7-S9 VanDerWaalsContact O-N 3.12Å
8S57.3Low55.9Low104 Ų104147.8 Ų147.873%0.72779%0.788SS**  trans-59.8113.8171.9-179.30000108.1P6 K10P6-S8 VanDerWaalsContact C-N 3.32Å; P6-S8 PolarHBondContact O-N 3.03Å; S8-K10 PolarHBondContact O-N 3.18Å; S8-K10 VanDerWaalsContact O-N 3.16Å
9S58.4Low56.2Low85 Ų85143.5 Ų143.559%0.59477%0.768SS**  trans-58119.4176.958.20000109.5V7 L11V7-S9 PolarHBondContact O-N 3.15Å; V7-S9 VanDerWaalsContact O-N 3.12Å; S9-L11 PolarHBondContact O-N 3.03Å
10K58.8Low56.8Low214 Ų214139.4 Ų139.493%0.9375%0.749SS**  trans-77.239.5170.4-69.3-176.1175.7-179.50111.7S8 D12S8-K10 PolarHBondContact O-N 3.18Å; S8-K10 VanDerWaalsContact O-N 3.16Å; K10-D12 PolarHBondContact O-N 3.33Å
11L57.3Low57.3Low138 Ų138139.5 Ų139.572%0.72375%0.749SS**  trans-76.7115.4170.7-82.9157.6000106.7S9 Q13S9-L11 PolarHBondContact O-N 3.03Å; L11-Q13 PolarHBondContact O-N 3.01Å
12D62.9Low58.5Low103 Ų103131.4 Ų131.455%0.55172%0.72SS**  trans-55.7122175.9-177.40.5000109K10 N14 A15K10-D12 PolarHBondContact O-N 3.33Å; D12-N14 PolarHBondContact O-N 3.5Å; D12-N14 WeakPolarHBondContact OD1-CB 3.47Å; D12-N14 PolarHBondContact OD1-N 3.39Å; D12-A15 HydrophobicContact CB-CB 4.21Å; D12-A15 WeakPolarHBondContact O-CB 3.46Å; D12-A15 PolarHBondContact O-N 3.43Å
13Q59.8Low59.4Low194 Ų194129 Ų12991%0.90770%0.701SS**THydrogen-bonded Turntrans-66.3-15.7178.4-69.6-177.3-7.600112.2L11L11-Q13 PolarHBondContact O-N 3.01Å
14N58.2Low60.3Low138 Ų138125.6 Ų125.674%0.73868%0.681SS**THydrogen-bonded Turntrans-94.61.8172.8-62.1-35.3000113D12 K16D12-N14 PolarHBondContact O-N 3.5Å; D12-N14 WeakPolarHBondContact OD1-CB 3.47Å; D12-N14 PolarHBondContact OD1-N 3.39Å; N14-K16 VanDerWaalsContact C-N 3.35Å; N14-K16 PolarHBondContact O-N 2.9Å
15A54.5Low61.4Low59 Ų59126.4 Ų126.449%0.48867%0.671SS.*SBendtrans-61.9102.7170.300000107.2D12 E17D12-A15 HydrophobicContact CB-CB 4.21Å; D12-A15 WeakPolarHBondContact O-CB 3.46Å; D12-A15 PolarHBondContact O-N 3.43Å; A15-E17 PolarHBondContact O-N 3.24Å; A15-E17 VanDerWaalsContact O-N 3.1Å
16K59Low62.5Low199 Ų199124 Ų12487%0.86566%0.663SS**  trans-46.9124172.3-70.7-177.6177.5-1790106.9N14 F18N14-K16 VanDerWaalsContact C-N 3.35Å; N14-K16 PolarHBondContact O-N 2.9Å; K16-F18 PolarHBondContact O-N 3Å; K16-F18 VanDerWaalsContact O-N 3.14Å
17E63.4Low63.6Low177 Ų177126.1 Ų126.183%0.82766%0.655SS**  trans-45.9124.4178.6-170171.8-171.400108.4A15 V19A15-E17 PolarHBondContact O-N 3.24Å; A15-E17 VanDerWaalsContact O-N 3.1Å; E17-V19 PolarHBondContact O-N 3.45Å
18F60.2Low64.4Low170 Ų170122 Ų12275%0.74663%0.63SS**  trans-62.5105.6178.9172-95.6000107.4K16 P20K16-F18 PolarHBondContact O-N 3Å; K16-F18 VanDerWaalsContact O-N 3.14Å; F18-P20 HydrophobicContact CD1-CG 4.36Å; F18-P20 HydrophobicContact CE1-CB 4.18Å; F18-P20 HydrophobicContact CE1-CG 4.09Å; F18-P20 WeakPolarHBondContact O-CD 3.22Å
19V62.3Low65.5Low66 Ų66119.7 Ų119.740%0.461%0.61SS.*  trans-85.4117170.6-174.40000106.4E17 L21 V23 I24E17-V19 PolarHBondContact O-N 3.45Å; V19-L21 PolarHBondContact O-N 2.95Å; V19-V23 HydrophobicContact CG1-CB 3.87Å; V19-V23 HydrophobicContact CG1-CG1 3.82Å; V19-I24 HydrophobicContact CB-CD1 4.28Å; V19-I24 HydrophobicContact CB-CG1 4.11Å; V19-I24 HydrophobicContact CG1-CD1 4.38Å; V19-I24 HydrophobicContact CG1-CG1 3.68Å
20P66.9Low66.8Low61 Ų61118.6 Ų118.640%0.39660%0.602SS.*  trans-54.7138.8178-23.733.1000110.5F18 A22 V23 I24F18-P20 HydrophobicContact CD1-CG 4.36Å; F18-P20 HydrophobicContact CE1-CB 4.18Å; F18-P20 HydrophobicContact CE1-CG 4.09Å; F18-P20 WeakPolarHBondContact O-CD 3.22Å; P20-A22 PolarHBondContact O-N 2.94Å; P20-V23 HydrophobicContact CB-CG2 4.18Å; P20-V23 HydrophobicContact CG-CG2 4.23Å; P20-V23 WeakPolarHBondContact O-CB 3.45Å; P20-V23 PolarHBondContact O-N 3.28Å; P20-I24 PolarHBondContact O-N 3.21Å
21L68.1Low68Low142 Ų142113.6 Ų113.674%0.74358%0.582SS**Hα-helixtrans-52.6-35.3-178.9-165.196.2000112.4V19 V23 I24 K25V19-L21 PolarHBondContact O-N 2.95Å; L21-V23 VanDerWaalsContact C-N 3.35Å; L21-V23 PolarHBondContact O-N 2.94Å; L21-I24 PolarHBondContact O-N 3.44Å; L21-K25 WeakPolarHBondContact O-CB 3.46Å; L21-K25 PolarHBondContact O-N 3.47Å
22A69.7Low69.3Low71 Ų71108.1 Ų108.159%0.58755%0.553SS**Hα-helixtrans-58.9-43.3175.600000112.5P20 K25 E26P20-A22 PolarHBondContact O-N 2.94Å; A22-K25 PolarHBondContact O-N 3.28Å; A22-E26 WeakPolarHBondContact O-CB 3.48Å; A22-E26 PolarHBondContact O-N 2.89Å
23V70.5Confident70.6Confident68 Ų68108 Ų10841%0.41255%0.545SS..Hα-helixtrans-67.6-38.3178.5178.30000110.9V19 P20 L21 R27V19-V23 HydrophobicContact CG1-CB 3.87Å; V19-V23 HydrophobicContact CG1-CG1 3.82Å; P20-V23 HydrophobicContact CB-CG2 4.18Å; P20-V23 HydrophobicContact CG-CG2 4.23Å; P20-V23 WeakPolarHBondContact O-CB 3.45Å; P20-V23 PolarHBondContact O-N 3.28Å; L21-V23 VanDerWaalsContact C-N 3.35Å; L21-V23 PolarHBondContact O-N 2.94Å; V23-R27 WeakPolarHBondContact O-CB 3.25Å; V23-R27 PolarHBondContact O-N 3.41Å
24I67Low72Confident84 Ų84102.4 Ų102.443%0.43152%0.524SS..Hα-helixtrans-63.3-46.9174.4-58.5176.6000109.7V19 P20 L21 E26 R27 T28V19-I24 HydrophobicContact CB-CD1 4.28Å; V19-I24 HydrophobicContact CB-CG1 4.11Å; V19-I24 HydrophobicContact CG1-CD1 4.38Å; V19-I24 HydrophobicContact CG1-CG1 3.68Å; P20-I24 PolarHBondContact O-N 3.21Å; L21-I24 PolarHBondContact O-N 3.44Å; I24-E26 PolarHBondContact O-N 3.05Å; I24-R27 PolarHBondContact O-N 3.45Å; I24-T28 WeakPolarHBondContact O-CB 3.44Å; I24-T28 PolarHBondContact O-N 3.16Å; I24-T28 PolarHBondContact O-OG1 3.34Å
25K71.2Confident73.4Confident136 Ų13697.9 Ų97.959%0.59150%0.499SS*.Hα-helixtrans-60.9-46.4179.2-171.9179.5178.6-176.20111.7L21 A22 T28 L29L21-K25 WeakPolarHBondContact O-CB 3.46Å; L21-K25 PolarHBondContact O-N 3.47Å; A22-K25 PolarHBondContact O-N 3.28Å; K25-T28 PolarHBondContact O-N 2.9Å; K25-L29 HydrophobicContact CG-CD1 4.17Å; K25-L29 WeakPolarHBondContact O-CB 3.35Å; K25-L29 VanDerWaalsContact O-CG 3.31Å; K25-L29 WeakPolarHBondContact O-CG 3.48Å; K25-L29 PolarHBondContact O-N 3.14Å
26E76.9Confident75Confident131 Ų13195.1 Ų95.161%0.61248%0.477SS*.Hα-helixtrans-63.1-42.9178.2-173.6178.7-173.200112A22 I24 L29 S30A22-E26 WeakPolarHBondContact O-CB 3.48Å; A22-E26 PolarHBondContact O-N 2.89Å; I24-E26 PolarHBondContact O-N 3.05Å; E26-L29 PolarHBondContact O-N 3.27Å; E26-S30 WeakPolarHBondContact O-CB 3.38Å; E26-S30 PolarHBondContact O-N 3.27Å; E26-S30 PolarHBondContact O-OG 2.88Å
27R75.6Confident76.5Confident165 Ų16588.8 Ų88.862%0.62345%0.45SS*.Hα-helixtrans-61.1-48.2174177.5-179.8-86.5172.8-6.8111.2V23 I24 L29 S30 E31V23-R27 WeakPolarHBondContact O-CB 3.25Å; V23-R27 PolarHBondContact O-N 3.41Å; I24-R27 PolarHBondContact O-N 3.45Å; R27-L29 VanDerWaalsContact C-N 3.33Å; R27-L29 PolarHBondContact O-N 3.19Å; R27-S30 WeakPolarHBondContact O-CB 3.36Å; R27-S30 PolarHBondContact O-N 2.95Å; R27-S30 VanDerWaalsContact O-N 3.16Å; R27-E31 HydrophobicContact CG-CG 4.42Å; R27-E31 WeakPolarHBondContact CG-OE1 3.34Å; R27-E31 WeakPolarHBondContact O-CG 3.43Å; R27-E31 PolarHBondContact O-N 3.48Å
28T75.3Confident77.8Confident56 Ų5682.9 Ų82.934%0.34442%0.424SS..Hα-helixtrans-60-43.9178.8-59.10000111.5I24 K25 S30 E31 M32I24-T28 WeakPolarHBondContact O-CB 3.44Å; I24-T28 PolarHBondContact O-N 3.16Å; I24-T28 PolarHBondContact O-OG1 3.34Å; K25-T28 PolarHBondContact O-N 2.9Å; T28-S30 VanDerWaalsContact C-N 3.33Å; T28-S30 PolarHBondContact O-N 2.85Å; T28-E31 PolarHBondContact O-N 3.29Å; T28-M32 HydrophobicContact CG2-CE 3.56Å; T28-M32 HydrophobicContact CG2-SD 4.16Å; T28-M32 WeakPolarHBondContact O-CB 3.07Å; T28-M32 VanDerWaalsContact O-CG 3.27Å; T28-M32 WeakPolarHBondContact O-CG 2.97Å; T28-M32 PolarHBondContact O-N 3.15Å
29L80.2Confident79.2Confident57 Ų5774.8 Ų74.830%0.29839%0.389SS..Hα-helixtrans-62.8-40.6175.7-74.1171.6000111.9K25 E26 R27 M32 R33 L68K25-L29 HydrophobicContact CG-CD1 4.17Å; K25-L29 WeakPolarHBondContact O-CB 3.35Å; K25-L29 VanDerWaalsContact O-CG 3.31Å; K25-L29 WeakPolarHBondContact O-CG 3.48Å; K25-L29 PolarHBondContact O-N 3.14Å; E26-L29 PolarHBondContact O-N 3.27Å; R27-L29 VanDerWaalsContact C-N 3.33Å; R27-L29 PolarHBondContact O-N 3.19Å; L29-M32 PolarHBondContact O-N 3.26Å; L29-R33 VanDerWaalsContact O-CB 3.31Å; L29-R33 WeakPolarHBondContact O-CB 3.46Å; L29-R33 PolarHBondContact O-N 2.94Å; L29-L68 HydrophobicContact CD2-CD1 4.17Å; L29-L68 HydrophobicContact CD2-CD2 4.11Å
30S84.4Confident80.4Confident62 Ų6273.1 Ų73.143%0.43438%0.376SS..Hα-helixtrans-65.1-41.2177.1-58.40000112E26 R27 T28 R33 T34E26-S30 WeakPolarHBondContact O-CB 3.38Å; E26-S30 PolarHBondContact O-N 3.27Å; E26-S30 PolarHBondContact O-OG 2.88Å; R27-S30 WeakPolarHBondContact O-CB 3.36Å; R27-S30 PolarHBondContact O-N 2.95Å; R27-S30 VanDerWaalsContact O-N 3.16Å; T28-S30 VanDerWaalsContact C-N 3.33Å; T28-S30 PolarHBondContact O-N 2.85Å; S30-R33 PolarHBondContact O-N 3.44Å; S30-T34 PolarHBondContact O-N 3.01Å; S30-T34 PolarHBondContact O-OG1 3.4Å
31E84.4Confident81.4Confident108 Ų10875.2 Ų75.251%0.50538%0.384SS..Hα-helixtrans-64.8-45.4175.4-73.3173.8-169.200111.3R27 T28 R33 T34 I35R27-E31 HydrophobicContact CG-CG 4.42Å; R27-E31 WeakPolarHBondContact CG-OE1 3.34Å; R27-E31 WeakPolarHBondContact O-CG 3.43Å; R27-E31 PolarHBondContact O-N 3.48Å; T28-E31 PolarHBondContact O-N 3.29Å; E31-R33 PolarHBondContact O-N 3.07Å; E31-T34 PolarHBondContact O-N 3.23Å; E31-I35 WeakPolarHBondContact O-CG1 3.18Å; E31-I35 PolarHBondContact O-N 3.33Å
32M84.5Confident82.2Confident23 Ų2370.9 Ų70.911%0.11336%0.361CS..Hα-helixtrans-59.2-46.3174.3-72.1173.9177.900111.4T28 L29 T34 I35 V36 I57 I72T28-M32 HydrophobicContact CG2-CE 3.56Å; T28-M32 HydrophobicContact CG2-SD 4.16Å; T28-M32 WeakPolarHBondContact O-CB 3.07Å; T28-M32 VanDerWaalsContact O-CG 3.27Å; T28-M32 WeakPolarHBondContact O-CG 2.97Å; T28-M32 PolarHBondContact O-N 3.15Å; L29-M32 PolarHBondContact O-N 3.26Å; M32-T34 VanDerWaalsContact C-N 3.32Å; M32-T34 PolarHBondContact O-N 3.09Å; M32-I35 PolarHBondContact O-N 2.95Å; M32-V36 WeakPolarHBondContact O-CG2 3.4Å; M32-V36 PolarHBondContact O-N 3.31Å; M32-I57 HydrophobicContact CE-CG2 3.97Å; M32-I57 HydrophobicContact CG-CG2 4.12Å; M32-I57 HydrophobicContact SD-CG2 4.32Å; M32-I72 HydrophobicContact CB-CD1 4Å
33R89.7Confident82.7Confident100 Ų10071.1 Ų71.138%0.37736%0.357SS..Hα-helixtrans-58.4-44.2177.1-171.1176.8-169.8110.21.6111.7L29 S30 E31 I35 V36 E37 I72 L76L29-R33 VanDerWaalsContact O-CB 3.31Å; L29-R33 WeakPolarHBondContact O-CB 3.46Å; L29-R33 PolarHBondContact O-N 2.94Å; S30-R33 PolarHBondContact O-N 3.44Å; E31-R33 PolarHBondContact O-N 3.07Å; R33-I35 VanDerWaalsContact C-N 3.34Å; R33-I35 PolarHBondContact O-N 3.44Å; R33-V36 PolarHBondContact O-N 3.06Å; R33-E37 VanDerWaalsContact O-CB 3.24Å; R33-E37 WeakPolarHBondContact O-CB 3.35Å; R33-E37 PolarHBondContact O-N 3.2Å; R33-I72 HydrophobicContact CB-CG2 4.3Å; R33-I72 HydrophobicContact CG-CG2 4.24Å; R33-L76 HydrophobicContact CG-CD1 4.31Å
34T89.2Confident83Confident77 Ų7774.3 Ų74.347%0.47237%0.371SS..Hα-helixtrans-60.3-44.1177.6-53.40000111.3S30 E31 M32 V36 E37 D38S30-T34 PolarHBondContact O-N 3.01Å; S30-T34 PolarHBondContact O-OG1 3.4Å; E31-T34 PolarHBondContact O-N 3.23Å; M32-T34 VanDerWaalsContact C-N 3.32Å; M32-T34 PolarHBondContact O-N 3.09Å; T34-V36 VanDerWaalsContact C-N 3.35Å; T34-V36 PolarHBondContact O-N 3.44Å; T34-E37 PolarHBondContact O-N 3.3Å; T34-D38 VanDerWaalsContact O-CG 3.3Å; T34-D38 PolarHBondContact O-N 3.27Å
35I87.8Confident83.5Confident43 Ų4373.8 Ų73.822%0.22139%0.386CS..Hα-helixtrans-64.6-39.5-179.8-67.5167.5000111.7E31 M32 R33 K53 I54 I57E31-I35 WeakPolarHBondContact O-CG1 3.18Å; E31-I35 PolarHBondContact O-N 3.33Å; M32-I35 PolarHBondContact O-N 2.95Å; R33-I35 VanDerWaalsContact C-N 3.34Å; R33-I35 PolarHBondContact O-N 3.44Å; I35-K53 HydrophobicContact CG2-CB 3.89Å; I35-I54 HydrophobicContact CG2-CG1 3.9Å; I35-I57 HydrophobicContact CB-CD1 4.19Å; I35-I57 HydrophobicContact CD1-CD1 3.62Å; I35-I57 HydrophobicContact CG2-CD1 3.84Å
36V88.3Confident83.9Confident2 Ų272.6 Ų72.61%0.01238%0.383CS..Hα-helixtrans-70.6-40.9175.6-178.40000110.8M32 R33 T34 D38 I39 I54 I72 L73 L76M32-V36 WeakPolarHBondContact O-CG2 3.4Å; M32-V36 PolarHBondContact O-N 3.31Å; R33-V36 PolarHBondContact O-N 3.06Å; T34-V36 VanDerWaalsContact C-N 3.35Å; T34-V36 PolarHBondContact O-N 3.44Å; V36-D38 VanDerWaalsContact C-N 3.31Å; V36-D38 PolarHBondContact O-N 2.86Å; V36-I39 PolarHBondContact O-N 3.23Å; V36-I54 HydrophobicContact CB-CD1 4.34Å; V36-I54 HydrophobicContact CG1-CD1 4.46Å; V36-I54 HydrophobicContact CG2-CD1 4.06Å; V36-I54 HydrophobicContact CG2-CG1 4.12Å; V36-I72 HydrophobicContact CB-CG2 3.77Å; V36-I72 HydrophobicContact CG1-CG2 4.05Å; V36-I72 HydrophobicContact CG2-CG2 3.83Å; V36-L73 HydrophobicContact CG1-CB 4.22Å; V36-L73 HydrophobicContact CG1-CD1 3.64Å; V36-L76 HydrophobicContact CB-CD1 3.83Å; V36-L76 HydrophobicContact CG1-CD1 3.65Å
37E91.4Very high84.3Confident66 Ų6666.7 Ų66.731%0.30836%0.356SS..Hα-helixtrans-63.7-35.8-179.8-177.1158.2-15400112.8R33 T34 I39 F40 N41 L76 R83R33-E37 VanDerWaalsContact O-CB 3.24Å; R33-E37 WeakPolarHBondContact O-CB 3.35Å; R33-E37 PolarHBondContact O-N 3.2Å; T34-E37 PolarHBondContact O-N 3.3Å; E37-I39 PolarHBondContact O-N 3.3Å; E37-I39 VanDerWaalsContact O-N 3.09Å; E37-F40 PolarHBondContact O-N 3.1Å; E37-N41 PolarHBondContact O-ND2 2.9Å; E37-L76 HydrophobicContact CB-CD1 3.9Å; E37-L76 HydrophobicContact CB-CD2 4.3Å; E37-L76 HydrophobicContact CG-CD2 4.39Å; E37-R83 IonicContact OE1-NH2 3.85Å
38D90.9Very high84.9Confident53 Ų5363.4 Ų63.428%0.28335%0.347SS..Hα-helixtrans-54-31.1177.7-79.8-13.4000113T34 V36 F40 N41 L42 Q50T34-D38 VanDerWaalsContact O-CG 3.3Å; T34-D38 PolarHBondContact O-N 3.27Å; V36-D38 VanDerWaalsContact C-N 3.31Å; V36-D38 PolarHBondContact O-N 2.86Å; D38-F40 PolarHBondContact O-N 3.35Å; D38-N41 PolarHBondContact O-N 3Å; D38-N41 VanDerWaalsContact O-N 3.15Å; D38-L42 HydrophobicContact CB-CD1 4.48Å; D38-L42 VanDerWaalsContact O-CG 3.22Å; D38-L42 WeakPolarHBondContact O-CG 3.3Å; D38-L42 PolarHBondContact O-N 3.3Å; D38-Q50 HydrophobicContact CB-CG 4.09Å; D38-Q50 VanDerWaalsContact CB-NE2 3.32Å; D38-Q50 PolarHBondContact OD2-NE2 3.2Å
39I88.9Confident85.4Confident0 Ų062.9 Ų62.90%035%0.349CS..Hα-helixtrans-57-40.7177.9-64169.8000111.2V36 E37 N41 V47 Q50 I51 I54 L86 C90V36-I39 PolarHBondContact O-N 3.23Å; E37-I39 PolarHBondContact O-N 3.3Å; E37-I39 VanDerWaalsContact O-N 3.09Å; I39-N41 PolarHBondContact O-N 2.9Å; I39-V47 HydrophobicContact CG2-CG1 3.65Å; I39-V47 HydrophobicContact CG2-CG2 4.44Å; I39-Q50 HydrophobicContact CG1-CB 3.82Å; I39-I51 HydrophobicContact CD1-CG1 4.39Å; I39-I54 HydrophobicContact CD1-CD1 3.02Å; I39-I54 HydrophobicContact CD1-CG1 4.49Å; I39-I54 HydrophobicContact CG1-CD1 3.81Å; I39-L86 HydrophobicContact CG2-CD1 4.2Å; I39-L86 HydrophobicContact CG2-CD2 3.77Å; I39-L86 HydrophobicContact CG2-CG 3.81Å; I39-L86 WeakPolarHBondContact O-CD2 3.33Å; I39-C90 HydrophobicContact CD1-CB 4.11Å; I39-C90 WeakPolarHBondContact CD1-SG 3.33Å
40F88Confident85.8Confident30 Ų3060.8 Ų60.813%0.13234%0.337CS..Hα-helixtrans-76.1-13.2-174.9-57.1-76.6000113.2E37 D38 L73 L76 R83 L86E37-F40 PolarHBondContact O-N 3.1Å; D38-F40 PolarHBondContact O-N 3.35Å; F40-L73 HydrophobicContact CZ-CD1 4.39Å; F40-L76 HydrophobicContact CD2-CB 4.34Å; F40-L76 HydrophobicContact CE2-CB 3.64Å; F40-L76 HydrophobicContact CE2-CD1 4.47Å; F40-L76 HydrophobicContact CZ-CB 4.27Å; F40-R83 HydrophobicContact CB-CG 4.21Å; F40-R83 HydrophobicContact CD1-CB 3.64Å; F40-R83 HydrophobicContact CD1-CG 3.6Å; F40-R83 HydrophobicContact CE1-CB 3.76Å; F40-R83 HydrophobicContact CE1-CG 4.21Å; F40-R83 WeakPolarHBondContact CE1-O 3.46Å; F40-R83 HydrophobicContact CG-CB 4.48Å; F40-R83 HydrophobicContact CG-CG 4.03Å; F40-L86 HydrophobicContact CD1-CD2 4.25Å
41N87.1Confident86Confident105 Ų10558 Ų5856%0.56132%0.318SS*.Hα-helixtrans-106.2-9.7-176.6-61.3-40.8000113.1E37 D38 I39E37-N41 PolarHBondContact O-ND2 2.9Å; D38-N41 PolarHBondContact O-N 3Å; D38-N41 VanDerWaalsContact O-N 3.15Å; I39-N41 PolarHBondContact O-N 2.9Å
42L84.1Confident86.3Confident52 Ų5260.7 Ų60.727%0.27232%0.323SS..SBendtrans-93.7151.5-175.6-73.2173.3000113.3D38 E46 V47 Q50D38-L42 HydrophobicContact CB-CD1 4.48Å; D38-L42 VanDerWaalsContact O-CG 3.22Å; D38-L42 WeakPolarHBondContact O-CG 3.3Å; D38-L42 PolarHBondContact O-N 3.3Å; L42-E46 HydrophobicContact CB-CB 4.33Å; L42-E46 HydrophobicContact CD1-CB 4.38Å; L42-E46 HydrophobicContact CD2-CB 4.47Å; L42-V47 HydrophobicContact CB-CG2 4.33Å; L42-Q50 HydrophobicContact CD1-CB 4.43Å; L42-Q50 HydrophobicContact CD1-CG 3.25Å
43P81.4Confident86.6Confident76 Ų7664.4 Ų64.449%0.49434%0.339SS..  trans-58.5143.6165.6-18.330.3000110.9G45 E46 V47P43-G45 PolarHBondContact O-N 3.2Å; P43-E46 PolarHBondContact O-N 3.35Å; P43-V47 PolarHBondContact O-N 3.37Å
44L75.9Confident86.7Confident135 Ų13559.7 Ų59.771%0.70732%0.321SS*.Hα-helixtrans-48.2-35-177.8-93.9118.8000114.5E46 V47L44-E46 VanDerWaalsContact C-N 3.26Å; L44-E46 PolarHBondContact O-N 2.93Å; L44-V47 PolarHBondContact O-N 2.86Å
45G77.3Confident86.9Confident73 Ų7357.7 Ų57.775%0.75331%0.306SS*.Hα-helixtrans-66.5-23.6178.600000114.6P43P43-G45 PolarHBondContact O-N 3.2Å
46E81Confident87Confident111 Ų11158 Ų5852%0.51932%0.315SS..Hα-helixtrans-98.5-17.8-177.7-64.6-178.9-151.100112.8L42 P43 L44 Q48 A49L42-E46 HydrophobicContact CB-CB 4.33Å; L42-E46 HydrophobicContact CD1-CB 4.38Å; L42-E46 HydrophobicContact CD2-CB 4.47Å; P43-E46 PolarHBondContact O-N 3.35Å; L44-E46 VanDerWaalsContact C-N 3.26Å; L44-E46 PolarHBondContact O-N 2.93Å; E46-Q48 PolarHBondContact O-N 3.37Å; E46-Q48 VanDerWaalsContact O-N 3.15Å; E46-A49 WeakPolarHBondContact O-CB 3.29Å; E46-A49 PolarHBondContact O-N 2.69Å
47V85.1Confident87.1Confident7 Ų758.9 Ų58.94%0.04232%0.319CS..Hα-helixtrans-54.3-37.3180172.70000112.1I39 L42 P43 L44 A49 Q50 I51 L86I39-V47 HydrophobicContact CG2-CG1 3.65Å; I39-V47 HydrophobicContact CG2-CG2 4.44Å; L42-V47 HydrophobicContact CB-CG2 4.33Å; P43-V47 PolarHBondContact O-N 3.37Å; L44-V47 PolarHBondContact O-N 2.86Å; V47-A49 PolarHBondContact O-N 3.42Å; V47-Q50 PolarHBondContact O-N 2.69Å; V47-I51 HydrophobicContact CG1-CD1 3.69Å; V47-I51 HydrophobicContact CG1-CG1 3.94Å; V47-I51 PolarHBondContact O-N 2.89Å; V47-L86 HydrophobicContact CG1-CD1 4.26Å
48Q87.1Confident87Confident95 Ų9555.8 Ų55.844%0.44431%0.305SS..Hα-helixtrans-61.1-27.3-179.7-72.2-62.8-25.600113.9E46 R52E46-Q48 PolarHBondContact O-N 3.37Å; E46-Q48 VanDerWaalsContact O-N 3.15Å; Q48-R52 WeakPolarHBondContact O-CG 3.41Å; Q48-R52 PolarHBondContact O-N 3.29Å; Q48-R52 PolarHBondContact O-NE 3.38Å
49A86.5Confident87Confident45 Ų4556.8 Ų56.837%0.37231%0.308SS..Hα-helixtrans-72.9-37.9174.300000111.3E46 V47 R52 K53E46-A49 WeakPolarHBondContact O-CB 3.29Å; E46-A49 PolarHBondContact O-N 2.69Å; V47-A49 PolarHBondContact O-N 3.42Å; A49-R52 WeakPolarHBondContact O-CB 3.47Å; A49-R52 PolarHBondContact O-N 3.38Å; A49-K53 PolarHBondContact O-N 3.32Å
50Q87.9Confident86.9Confident14 Ų1460.3 Ų60.37%0.06533%0.326CS..Hα-helixtrans-73.8-39.6177-64.3-62.925.700112.7D38 I39 L42 V47 R52 K53 I54D38-Q50 HydrophobicContact CB-CG 4.09Å; D38-Q50 VanDerWaalsContact CB-NE2 3.32Å; D38-Q50 PolarHBondContact OD2-NE2 3.2Å; I39-Q50 HydrophobicContact CG1-CB 3.82Å; L42-Q50 HydrophobicContact CD1-CB 4.43Å; L42-Q50 HydrophobicContact CD1-CG 3.25Å; V47-Q50 PolarHBondContact O-N 2.69Å; Q50-R52 PolarHBondContact O-N 2.96Å; Q50-K53 WeakPolarHBondContact O-CA 3.29Å; Q50-K53 WeakPolarHBondContact O-CB 3.26Å; Q50-K53 PolarHBondContact O-N 3.38Å; Q50-K53 VanDerWaalsContact OE1-CE 3.23Å; Q50-I54 WeakPolarHBondContact O-CG1 3.46Å; Q50-I54 PolarHBondContact O-N 2.9Å
51I89.6Confident86.5Confident4 Ų466.7 Ų66.72%0.02136%0.362CS..Hα-helixtrans-55.3-40.9172.4-67.9175.6000110.1I39 V47 K53 I54 K55 D93 V94I39-I51 HydrophobicContact CD1-CG1 4.39Å; V47-I51 HydrophobicContact CG1-CD1 3.69Å; V47-I51 HydrophobicContact CG1-CG1 3.94Å; V47-I51 PolarHBondContact O-N 2.89Å; I51-K53 PolarHBondContact O-N 3.39Å; I51-I54 PolarHBondContact O-N 2.9Å; I51-K55 HydrophobicContact CG2-CD 3.98Å; I51-K55 HydrophobicContact CG2-CG 4.37Å; I51-K55 WeakPolarHBondContact O-CB 3.17Å; I51-K55 VanDerWaalsContact O-CG 3.25Å; I51-K55 WeakPolarHBondContact O-CG 3.43Å; I51-K55 PolarHBondContact O-N 3.45Å; I51-D93 HydrophobicContact CG2-CB 4.41Å; I51-V94 HydrophobicContact CG2-CG2 4.29Å
52R90.5Very high86.2Confident164 Ų16467.2 Ų67.262%0.61936%0.364SS*.Hα-helixtrans-61.4-38.2174.1-81.6179.2-88158.6-12.4113.5Q48 A49 Q50 A56Q48-R52 WeakPolarHBondContact O-CG 3.41Å; Q48-R52 PolarHBondContact O-N 3.29Å; Q48-R52 PolarHBondContact O-NE 3.38Å; A49-R52 WeakPolarHBondContact O-CB 3.47Å; A49-R52 PolarHBondContact O-N 3.38Å; Q50-R52 PolarHBondContact O-N 2.96Å; R52-A56 PolarHBondContact O-N 2.86Å
53K90.1Very high85.8Confident100 Ų10068.9 Ų68.944%0.43539%0.385SS..Hα-helixtrans-67.1-41.4175.2-64.2-169.7-158.8151.90111.6I35 A49 Q50 I51 A56 I57I35-K53 HydrophobicContact CG2-CB 3.89Å; A49-K53 PolarHBondContact O-N 3.32Å; Q50-K53 WeakPolarHBondContact O-CA 3.29Å; Q50-K53 WeakPolarHBondContact O-CB 3.26Å; Q50-K53 PolarHBondContact O-N 3.38Å; Q50-K53 VanDerWaalsContact OE1-CE 3.23Å; I51-K53 PolarHBondContact O-N 3.39Å; K53-A56 WeakPolarHBondContact O-CB 3.31Å; K53-A56 PolarHBondContact O-N 3.19Å; K53-I57 WeakPolarHBondContact O-CG1 3.47Å; K53-I57 PolarHBondContact O-N 2.84Å
54I92.1Very high85.9Confident1 Ų171.4 Ų71.41%0.00539%0.39CS..Hα-helixtrans-65.6-42178.7-65.9168.2000110.8I35 V36 I39 Q50 I51 A56 I57 A58 V69 V94I35-I54 HydrophobicContact CG2-CG1 3.9Å; V36-I54 HydrophobicContact CB-CD1 4.34Å; V36-I54 HydrophobicContact CG1-CD1 4.46Å; V36-I54 HydrophobicContact CG2-CD1 4.06Å; V36-I54 HydrophobicContact CG2-CG1 4.12Å; I39-I54 HydrophobicContact CD1-CD1 3.02Å; I39-I54 HydrophobicContact CD1-CG1 4.49Å; I39-I54 HydrophobicContact CG1-CD1 3.81Å; Q50-I54 WeakPolarHBondContact O-CG1 3.46Å; Q50-I54 PolarHBondContact O-N 2.9Å; I51-I54 PolarHBondContact O-N 2.9Å; I54-A56 VanDerWaalsContact C-N 3.33Å; I54-A56 PolarHBondContact O-N 3.32Å; I54-I57 PolarHBondContact O-N 3.03Å; I54-A58 WeakPolarHBondContact O-CB 3.36Å; I54-A58 PolarHBondContact O-N 2.81Å; I54-V69 HydrophobicContact CG2-CG1 3.52Å; I54-V94 HydrophobicContact CB-CG2 4.49Å; I54-V94 HydrophobicContact CG2-CG1 4.38Å; I54-V94 HydrophobicContact CG2-CG2 3.9Å
55K93.2Very high86.5Confident35 Ų3565.2 Ų65.215%0.15236%0.359CS..Hα-helixtrans-53.2-51.1170.2-75.5173.1175.2-171.50111I51 I57 A58 E59 D93 V94 Y97I51-K55 HydrophobicContact CG2-CD 3.98Å; I51-K55 HydrophobicContact CG2-CG 4.37Å; I51-K55 WeakPolarHBondContact O-CB 3.17Å; I51-K55 VanDerWaalsContact O-CG 3.25Å; I51-K55 WeakPolarHBondContact O-CG 3.43Å; I51-K55 PolarHBondContact O-N 3.45Å; K55-I57 VanDerWaalsContact C-N 3.32Å; K55-I57 PolarHBondContact O-N 3.01Å; K55-A58 PolarHBondContact O-N 3.14Å; K55-E59 WeakPolarHBondContact O-CB 3.31Å; K55-E59 WeakPolarHBondContact O-CG 3.27Å; K55-E59 PolarHBondContact O-N 2.87Å; K55-D93 WeakPolarHBondContact CE-O 3.42Å; K55-D93 PolarHBondContact NZ-O 3.47Å; K55-D93 VanDerWaalsContact NZ-O 3.16Å; K55-V94 HydrophobicContact CG-CB 4.48Å; K55-V94 HydrophobicContact CG-CG1 4.33Å; K55-V94 HydrophobicContact CG-CG2 4.07Å; K55-Y97 HydrophobicContact CB-CD1 3.67Å; K55-Y97 HydrophobicContact CB-CE1 3.65Å; K55-Y97 HydrophobicContact CD-CD1 3.56Å; K55-Y97 HydrophobicContact CD-CD2 4.08Å; K55-Y97 HydrophobicContact CD-CE1 4.06Å; K55-Y97 HydrophobicContact CD-CG 3.57Å; K55-Y97 HydrophobicContact CG-CD1 3.51Å; K55-Y97 HydrophobicContact CG-CE1 4.01Å; K55-Y97 HydrophobicContact CG-CG 4.01Å
56A91.3Very high87.2Confident51 Ų5162 Ų6242%0.42133%0.325SS..Hα-helixtrans-61.3-37.4178.700000113.2R52 K53 I54 E59 L60R52-A56 PolarHBondContact O-N 2.86Å; K53-A56 WeakPolarHBondContact O-CB 3.31Å; K53-A56 PolarHBondContact O-N 3.19Å; I54-A56 VanDerWaalsContact C-N 3.33Å; I54-A56 PolarHBondContact O-N 3.32Å; A56-E59 PolarHBondContact O-N 3.39Å; A56-L60 PolarHBondContact O-N 3.16Å
57I89.2Confident87.8Confident20 Ų2058.1 Ų58.110%0.10331%0.306CS..Hα-helixtrans-66.6-47.4175.3-66.5165.1000110.6M32 I35 K53 I54 K55 E59 L60 V69M32-I57 HydrophobicContact CE-CG2 3.97Å; M32-I57 HydrophobicContact CG-CG2 4.12Å; M32-I57 HydrophobicContact SD-CG2 4.32Å; I35-I57 HydrophobicContact CB-CD1 4.19Å; I35-I57 HydrophobicContact CD1-CD1 3.62Å; I35-I57 HydrophobicContact CG2-CD1 3.84Å; K53-I57 WeakPolarHBondContact O-CG1 3.47Å; K53-I57 PolarHBondContact O-N 2.84Å; I54-I57 PolarHBondContact O-N 3.03Å; K55-I57 VanDerWaalsContact C-N 3.32Å; K55-I57 PolarHBondContact O-N 3.01Å; I57-E59 PolarHBondContact O-N 3.34Å; I57-L60 HydrophobicContact CG2-CD1 4.43Å; I57-L60 VanDerWaalsContact O-CB 3.29Å; I57-L60 WeakPolarHBondContact O-CB 3.35Å; I57-L60 VanDerWaalsContact O-CG 3.29Å; I57-L60 WeakPolarHBondContact O-CG 3.38Å; I57-L60 PolarHBondContact O-N 3.1Å; I57-L60 VanDerWaalsContact O-N 3.1Å; I57-V69 HydrophobicContact CB-CG2 4.39Å; I57-V69 HydrophobicContact CG2-CG2 3.69Å
58A89.6Confident88.1Confident0 Ų059.8 Ų59.80%032%0.315CS..Hα-helixtrans-65.7-25.4179.600000112.1I54 K55 S66 V69 V94 L98I54-A58 WeakPolarHBondContact O-CB 3.36Å; I54-A58 PolarHBondContact O-N 2.81Å; K55-A58 PolarHBondContact O-N 3.14Å; A58-S66 PolarHBondContact O-OG 2.89Å; A58-V69 HydrophobicContact CB-CB 4.45Å; A58-V69 HydrophobicContact CB-CG1 4.46Å; A58-V69 HydrophobicContact CB-CG2 4.27Å; A58-V94 HydrophobicContact CB-CG1 4.28Å; A58-L98 HydrophobicContact CB-CD1 3.8Å; A58-L98 HydrophobicContact CB-CD2 4.04Å; A58-L98 HydrophobicContact CB-CG 4.49Å
59E90.7Very high88.5Confident75 Ų7555.3 Ų55.335%0.3529%0.294SS..THydrogen-bonded Turntrans-79-11.7174.2-77.8-176.8147.900114.5K55 A56 I57 Y97 L98 K102K55-E59 WeakPolarHBondContact O-CB 3.31Å; K55-E59 WeakPolarHBondContact O-CG 3.27Å; K55-E59 PolarHBondContact O-N 2.87Å; A56-E59 PolarHBondContact O-N 3.39Å; I57-E59 PolarHBondContact O-N 3.34Å; E59-Y97 HydrophobicContact CG-CE1 4.14Å; E59-Y97 WeakPolarHBondContact OE1-CE1 3.5Å; E59-Y97 VanDerWaalsContact OE1-CZ 3.29Å; E59-Y97 PolarHBondContact OE1-OH 3.24Å; E59-Y97 PolarHBondContact OE2-OH 3.46Å; E59-L98 HydrophobicContact CB-CD2 4.46Å; E59-L98 HydrophobicContact CG-CD2 3.47Å; E59-L98 VanDerWaalsContact CG-CD2 3.47Å; E59-K102 VanDerWaalsContact C-NZ 3.31Å; E59-K102 PolarHBondContact O-NZ 2.91Å
60L87.3Confident88.9Confident74 Ų7453.2 Ų53.239%0.38728%0.276SS..SBendtrans-56.3144.7-178.3-69.4174.3000111.7A56 I57 L62 A65 K102A56-L60 PolarHBondContact O-N 3.16Å; I57-L60 HydrophobicContact CG2-CD1 4.43Å; I57-L60 VanDerWaalsContact O-CB 3.29Å; I57-L60 WeakPolarHBondContact O-CB 3.35Å; I57-L60 VanDerWaalsContact O-CG 3.29Å; I57-L60 WeakPolarHBondContact O-CG 3.38Å; I57-L60 PolarHBondContact O-N 3.1Å; I57-L60 VanDerWaalsContact O-N 3.1Å; L60-L62 HydrophobicContact CB-CB 4.43Å; L60-L62 HydrophobicContact CB-CD1 3.99Å; L60-L62 HydrophobicContact CD1-CD1 3.94Å; L60-L62 HydrophobicContact CG-CD1 4.47Å; L60-L62 PolarHBondContact O-N 3.41Å; L60-A65 HydrophobicContact CB-CB 4.29Å; L60-K102 PolarHBondContact O-NZ 2.76Å
61D80.4Confident89.3Confident164 Ų16455.1 Ų55.188%0.87729%0.285SS*.SBendtrans-83.948.1176-158.725000111.2
62L80.4Confident89.5Confident116 Ų11655.4 Ų55.461%0.60729%0.287SS*.SBendtrans-112.6133.8176.6-86.8137.3000107.7L60 H64 A65L60-L62 HydrophobicContact CB-CB 4.43Å; L60-L62 HydrophobicContact CB-CD1 3.99Å; L60-L62 HydrophobicContact CD1-CD1 3.94Å; L60-L62 HydrophobicContact CG-CD1 4.47Å; L60-L62 PolarHBondContact O-N 3.41Å; L62-H64 PolarHBondContact O-N 2.95Å; L62-A65 HydrophobicContact CB-CB 4.11Å; L62-A65 WeakPolarHBondContact O-CB 3.24Å; L62-A65 PolarHBondContact O-N 2.88Å; L62-A65 VanDerWaalsContact O-N 3.13Å
63A76Confident89.8Confident87 Ų8747.6 Ų47.672%0.71926%0.258SS*.THydrogen-bonded Turntrans-54.4127.4178.100000110A65A63-A65 VanDerWaalsContact C-N 3.27Å; A63-A65 PolarHBondContact O-N 3.43Å
64H83.5Confident90.1Very high129 Ų12942.9 Ų42.960%0.59724%0.237SC*.THydrogen-bonded Turntrans66.114.1178.2-45.7-74.5000116.2L62 S66 H67 L68L62-H64 PolarHBondContact O-N 2.95Å; H64-S66 PolarHBondContact O-N 3.43Å; H64-H67 HydrophobicContact CB-CB 4.25Å; H64-H67 PolarHBondContact O-N 2.92Å; H64-L68 WeakPolarHBondContact O-CB 3.48Å; H64-L68 WeakPolarHBondContact O-CG 3.47Å; H64-L68 PolarHBondContact O-N 3.35Å
65A87.7Confident90.2Very high5 Ų546 Ų464%0.04125%0.251CS..Hα-helixtrans-57.2-48.3178.300000112.3L60 L62 A63 L68 V69L60-A65 HydrophobicContact CB-CB 4.29Å; L62-A65 HydrophobicContact CB-CB 4.11Å; L62-A65 WeakPolarHBondContact O-CB 3.24Å; L62-A65 PolarHBondContact O-N 2.88Å; L62-A65 VanDerWaalsContact O-N 3.13Å; A63-A65 VanDerWaalsContact C-N 3.27Å; A63-A65 PolarHBondContact O-N 3.43Å; A65-L68 PolarHBondContact O-N 2.89Å; A65-V69 WeakPolarHBondContact O-CG2 3.42Å; A65-V69 PolarHBondContact O-N 3.16Å; A65-V69 VanDerWaalsContact O-N 3.11Å
66S92.4Very high90.2Very high6 Ų644.4 Ų44.44%0.04225%0.245CC..Hα-helixtrans-62.9-43.1177.6-37.40000111.5A58 H64 V69 G70 K102 L106A58-S66 PolarHBondContact O-OG 2.89Å; H64-S66 PolarHBondContact O-N 3.43Å; S66-V69 PolarHBondContact O-N 2.85Å; S66-G70 PolarHBondContact O-N 2.91Å; S66-K102 WeakPolarHBondContact CB-O 3.44Å; S66-L106 WeakPolarHBondContact O-CA 3.15Å; S66-L106 VanDerWaalsContact O-CD1 3.25Å; S66-L106 WeakPolarHBondContact O-CD1 3.47Å
67H93.9Very high90.4Very high28 Ų2842 Ų4213%0.1323%0.225CC..Hα-helixtrans-60.7-47.6178.2-170.899.1000112.4H64 V69 G70 E71 D105 G109 E112H64-H67 HydrophobicContact CB-CB 4.25Å; H64-H67 PolarHBondContact O-N 2.92Å; H67-V69 VanDerWaalsContact C-N 3.32Å; H67-V69 PolarHBondContact O-N 3.43Å; H67-G70 WeakPolarHBondContact O-CA 3.28Å; H67-G70 PolarHBondContact O-N 3.35Å; H67-E71 IonicContact CD2-OE1 3.35Å; H67-E71 PolarHBondContact CD2-OE1 3.5Å; H67-E71 IonicContact NE2-OE1 3.36Å; H67-E71 PolarHBondContact NE2-OE1 2.83Å; H67-E71 PolarHBondContact O-N 2.9Å; H67-D105 WeakPolarHBondContact CA-O 3.47Å; H67-D105 PolarHBondContact ND1-O 3.46Å; H67-G109 VanDerWaalsContact CE1-CA 3.41Å; H67-G109 WeakPolarHBondContact CE1-CA 3.37Å; H67-G109 PolarHBondContact CE1-N 3.44Å; H67-G109 PolarHBondContact ND1-N 2.99Å; H67-E112 IonicContact CE1-OE2 3.19Å; H67-E112 PolarHBondContact CE1-OE2 3.45Å; H67-E112 IonicContact NE2-OE2 3.3Å; H67-E112 PolarHBondContact NE2-OE2 3.16Å
68L91.5Very high90.6Very high42 Ų4241 Ų4122%0.2222%0.22CC..Hα-helixtrans-61.8-38.1177-72.5170000112.6L29 H64 A65 G70 E71 I72L29-L68 HydrophobicContact CD2-CD1 4.17Å; L29-L68 HydrophobicContact CD2-CD2 4.11Å; H64-L68 WeakPolarHBondContact O-CB 3.48Å; H64-L68 WeakPolarHBondContact O-CG 3.47Å; H64-L68 PolarHBondContact O-N 3.35Å; A65-L68 PolarHBondContact O-N 2.89Å; L68-G70 PolarHBondContact O-N 3.48Å; L68-E71 PolarHBondContact O-N 2.96Å; L68-I72 WeakPolarHBondContact O-CB 3.44Å; L68-I72 VanDerWaalsContact O-CG1 3.27Å; L68-I72 WeakPolarHBondContact O-CG1 3.16Å; L68-I72 PolarHBondContact O-N 3.11Å
69V94.2Very high90.6Very high2 Ų243.6 Ų43.61%0.01224%0.236CC..Hα-helixtrans-60.9-39.7172.8170.30000110.3I54 I57 A58 A65 S66 H67 L73 L106I54-V69 HydrophobicContact CG2-CG1 3.52Å; I57-V69 HydrophobicContact CB-CG2 4.39Å; I57-V69 HydrophobicContact CG2-CG2 3.69Å; A58-V69 HydrophobicContact CB-CB 4.45Å; A58-V69 HydrophobicContact CB-CG1 4.46Å; A58-V69 HydrophobicContact CB-CG2 4.27Å; A65-V69 WeakPolarHBondContact O-CG2 3.42Å; A65-V69 PolarHBondContact O-N 3.16Å; A65-V69 VanDerWaalsContact O-N 3.11Å; S66-V69 PolarHBondContact O-N 2.85Å; H67-V69 VanDerWaalsContact C-N 3.32Å; H67-V69 PolarHBondContact O-N 3.43Å; V69-L73 WeakPolarHBondContact O-CB 3.35Å; V69-L73 PolarHBondContact O-N 3.42Å; V69-L106 HydrophobicContact CB-CD1 3.97Å; V69-L106 HydrophobicContact CG1-CD1 3.72Å
70G96.4Very high90.4Very high0 Ų041.8 Ų41.80%023%0.228CC..Hα-helixtrans-61.9-50.117700000112.3S66 H67 L68 I72 L73 A74 V110S66-G70 PolarHBondContact O-N 2.91Å; H67-G70 WeakPolarHBondContact O-CA 3.28Å; H67-G70 PolarHBondContact O-N 3.35Å; L68-G70 PolarHBondContact O-N 3.48Å; G70-I72 PolarHBondContact O-N 3.16Å; G70-L73 PolarHBondContact O-N 3.21Å; G70-A74 WeakPolarHBondContact O-CB 3.47Å; G70-A74 PolarHBondContact O-N 3.29Å; G70-V110 WeakPolarHBondContact O-CG2 3.38Å
71E95.4Very high90.4Very high54 Ų5439.8 Ų39.825%0.25222%0.219SC..Hα-helixtrans-57-51.2176.5-67.9176.1-17100111.9H67 L68 L73 A74 Q75H67-E71 IonicContact CD2-OE1 3.35Å; H67-E71 PolarHBondContact CD2-OE1 3.5Å; H67-E71 IonicContact NE2-OE1 3.36Å; H67-E71 PolarHBondContact NE2-OE1 2.83Å; H67-E71 PolarHBondContact O-N 2.9Å; L68-E71 PolarHBondContact O-N 2.96Å; E71-L73 VanDerWaalsContact C-N 3.32Å; E71-L73 PolarHBondContact O-N 2.91Å; E71-A74 PolarHBondContact O-N 3.11Å; E71-Q75 WeakPolarHBondContact O-CG 3.43Å; E71-Q75 PolarHBondContact O-N 3.26Å
72I94.5Very high90.7Very high10 Ų1042.3 Ų42.35%0.05122%0.216CC..Hα-helixtrans-61.3-43.6-179.1-70.9170.6000110.5M32 R33 V36 L68 G70 Q75 L76M32-I72 HydrophobicContact CB-CD1 4Å; R33-I72 HydrophobicContact CB-CG2 4.3Å; R33-I72 HydrophobicContact CG-CG2 4.24Å; V36-I72 HydrophobicContact CB-CG2 3.77Å; V36-I72 HydrophobicContact CG1-CG2 4.05Å; V36-I72 HydrophobicContact CG2-CG2 3.83Å; L68-I72 WeakPolarHBondContact O-CB 3.44Å; L68-I72 VanDerWaalsContact O-CG1 3.27Å; L68-I72 WeakPolarHBondContact O-CG1 3.16Å; L68-I72 PolarHBondContact O-N 3.11Å; G70-I72 PolarHBondContact O-N 3.16Å; I72-Q75 PolarHBondContact O-N 3.41Å; I72-L76 HydrophobicContact CG2-CD1 3.75Å; I72-L76 HydrophobicContact CG2-CG 4.47Å; I72-L76 WeakPolarHBondContact O-CB 3.44Å; I72-L76 WeakPolarHBondContact O-CG 3.25Å; I72-L76 PolarHBondContact O-N 3.13Å
73L95.7Very high91.2Very high1 Ų138.7 Ų38.71%0.00520%0.195CC..Hα-helixtrans-63.7-43.5179.6-174.564000110.9V36 F40 V69 G70 E71 L76 T77 C90 F91V36-L73 HydrophobicContact CG1-CB 4.22Å; V36-L73 HydrophobicContact CG1-CD1 3.64Å; F40-L73 HydrophobicContact CZ-CD1 4.39Å; V69-L73 WeakPolarHBondContact O-CB 3.35Å; V69-L73 PolarHBondContact O-N 3.42Å; G70-L73 PolarHBondContact O-N 3.21Å; E71-L73 VanDerWaalsContact C-N 3.32Å; E71-L73 PolarHBondContact O-N 2.91Å; L73-L76 PolarHBondContact O-N 3.22Å; L73-T77 WeakPolarHBondContact O-CB 3.34Å; L73-T77 PolarHBondContact O-N 3.38Å; L73-T77 PolarHBondContact O-OG1 3.38Å; L73-C90 HydrophobicContact CD1-CB 4.3Å; L73-F91 HydrophobicContact CD2-CB 3.58Å; L73-F91 HydrophobicContact CD2-CD2 4.46Å; L73-F91 HydrophobicContact CD2-CG 4.41Å
74A96.4Very high92Very high0 Ų034.6 Ų34.60%016%0.161CC..Hα-helixtrans-59.8-51.9175.900000111.6G70 E71 L76 T77 T78 V110 V114 M117 F172G70-A74 WeakPolarHBondContact O-CB 3.47Å; G70-A74 PolarHBondContact O-N 3.29Å; E71-A74 PolarHBondContact O-N 3.11Å; A74-L76 VanDerWaalsContact C-N 3.33Å; A74-L76 PolarHBondContact O-N 3.48Å; A74-T77 PolarHBondContact O-N 3.3Å; A74-T78 WeakPolarHBondContact O-CG2 3.44Å; A74-T78 PolarHBondContact O-N 3.05Å; A74-T78 PolarHBondContact O-OG1 2.9Å; A74-V110 HydrophobicContact CB-CG1 4.23Å; A74-V114 HydrophobicContact CB-CG2 4.32Å; A74-M117 HydrophobicContact CB-CE 4.26Å; A74-F172 HydrophobicContact CB-CE1 4.18Å
75Q94.5Very high92.4Very high66 Ų6630.9 Ų30.931%0.30815%0.149SC..Hα-helixtrans-56.8-43.8179.5-70174.89.400113E71 I72 T78 T79 S113E71-Q75 WeakPolarHBondContact O-CG 3.43Å; E71-Q75 PolarHBondContact O-N 3.26Å; I72-Q75 PolarHBondContact O-N 3.41Å; Q75-T78 PolarHBondContact O-OG1 3.3Å; Q75-T79 PolarHBondContact O-N 3.35Å; Q75-T79 PolarHBondContact O-OG1 2.98Å; Q75-S113 WeakPolarHBondContact CG-OG 3.32Å
76L94Very high92.5Very high3 Ų332.4 Ų32.42%0.01616%0.156CC..Hα-helixtrans-73.6-35.4-179.7-69.9171.7000112.1R33 V36 E37 F40 I72 L73 A74 T79 R83R33-L76 HydrophobicContact CG-CD1 4.31Å; V36-L76 HydrophobicContact CB-CD1 3.83Å; V36-L76 HydrophobicContact CG1-CD1 3.65Å; E37-L76 HydrophobicContact CB-CD1 3.9Å; E37-L76 HydrophobicContact CB-CD2 4.3Å; E37-L76 HydrophobicContact CG-CD2 4.39Å; F40-L76 HydrophobicContact CD2-CB 4.34Å; F40-L76 HydrophobicContact CE2-CB 3.64Å; F40-L76 HydrophobicContact CE2-CD1 4.47Å; F40-L76 HydrophobicContact CZ-CB 4.27Å; I72-L76 HydrophobicContact CG2-CD1 3.75Å; I72-L76 HydrophobicContact CG2-CG 4.47Å; I72-L76 WeakPolarHBondContact O-CB 3.44Å; I72-L76 WeakPolarHBondContact O-CG 3.25Å; I72-L76 PolarHBondContact O-N 3.13Å; L73-L76 PolarHBondContact O-N 3.22Å; A74-L76 VanDerWaalsContact C-N 3.33Å; A74-L76 PolarHBondContact O-N 3.48Å; L76-T79 WeakPolarHBondContact O-CB 3.25Å; L76-T79 PolarHBondContact O-N 3.11Å; L76-T79 PolarHBondContact O-OG1 3.06Å; L76-R83 VanDerWaalsContact O-CD 3.28Å; L76-R83 WeakPolarHBondContact O-CD 3.45Å
77T94.5Very high92.6Very high0 Ų032.1 Ų32.10%015%0.154CC..Hα-helixtrans-65-41.5178.1-620000111.3L73 A74 T79 V84 G87 F172L73-T77 WeakPolarHBondContact O-CB 3.34Å; L73-T77 PolarHBondContact O-N 3.38Å; L73-T77 PolarHBondContact O-OG1 3.38Å; A74-T77 PolarHBondContact O-N 3.3Å; T77-T79 VanDerWaalsContact C-N 3.3Å; T77-T79 PolarHBondContact O-N 2.91Å; T77-V84 HydrophobicContact CG2-CB 4.49Å; T77-V84 HydrophobicContact CG2-CG1 4.46Å; T77-G87 WeakPolarHBondContact OG1-CA 3.32Å; T77-F172 HydrophobicContact CG2-CD2 3.65Å; T77-F172 HydrophobicContact CG2-CE2 3.76Å; T77-F172 HydrophobicContact CG2-CG 4.09Å; T77-F172 HydrophobicContact CG2-CZ 4.27Å
78T93Very high92.6Very high0 Ų031.3 Ų31.30%015%0.15CC..THydrogen-bonded Turntrans-83.6-1.1-17956.70000113.3A74 Q75 N80 M117 H165 L169 F172A74-T78 WeakPolarHBondContact O-CG2 3.44Å; A74-T78 PolarHBondContact O-N 3.05Å; A74-T78 PolarHBondContact O-OG1 2.9Å; Q75-T78 PolarHBondContact O-OG1 3.3Å; T78-N80 PolarHBondContact O-N 3.34Å; T78-M117 HydrophobicContact CG2-CE 3.72Å; T78-M117 HydrophobicContact CG2-SD 4.32Å; T78-M117 WeakPolarHBondContact OG1-CE 3.33Å; T78-M117 PolarHBondContact OG1-SD 2.85Å; T78-H165 VanDerWaalsContact O-CA 3.29Å; T78-H165 WeakPolarHBondContact O-CA 3.37Å; T78-H165 PolarHBondContact O-ND1 3.38Å; T78-H165 PolarHBondContact OG1-CE1 3.36Å; T78-L169 HydrophobicContact CG2-CB 4.4Å; T78-L169 HydrophobicContact CG2-CD1 4.14Å; T78-F172 HydrophobicContact CG2-CB 3.89Å; T78-F172 HydrophobicContact CG2-CD1 3.55Å; T78-F172 HydrophobicContact CG2-CE1 4.42Å; T78-F172 HydrophobicContact CG2-CG 4.04Å
79T89.4Confident92.6Very high54 Ų5435.3 Ų35.333%0.33116%0.163SC..THydrogen-bonded Turntrans-58.5-35.3179.9-58.40000112.4Q75 L76 T77Q75-T79 PolarHBondContact O-N 3.35Å; Q75-T79 PolarHBondContact O-OG1 2.98Å; L76-T79 WeakPolarHBondContact O-CB 3.25Å; L76-T79 PolarHBondContact O-N 3.11Å; L76-T79 PolarHBondContact O-OG1 3.06Å; T77-T79 VanDerWaalsContact C-N 3.3Å; T77-T79 PolarHBondContact O-N 2.91Å
80N86.4Confident92.5Very high36 Ų3635.3 Ų35.319%0.19316%0.162CC..SBendtrans-158.6162.817063.759.1000111T78 R82 R83 D164T78-N80 PolarHBondContact O-N 3.34Å; N80-R82 VanDerWaalsContact C-N 3.28Å; N80-R82 PolarHBondContact O-N 2.96Å; N80-R82 WeakPolarHBondContact OD1-CB 3.37Å; N80-R82 PolarHBondContact OD1-N 3.4Å; N80-R82 VanDerWaalsContact OD1-N 3.12Å; N80-R83 PolarHBondContact O-N 2.92Å; N80-R83 VanDerWaalsContact O-N 3.16Å; N80-R83 WeakPolarHBondContact OD1-CG 3.41Å; N80-R83 PolarHBondContact OD1-N 3.45Å; N80-R83 VanDerWaalsContact OD1-N 3.11Å; N80-D164 WeakPolarHBondContact CA-O 3.46Å; N80-D164 HydrophobicContact CB-CB 3.86Å
81V87.4Confident92.5Very high32 Ų3235.3 Ų35.319%0.19416%0.163CC..Hα-helixtrans-57.7-37.4-177.3178.90000113.2R83 V84 F167 V171V81-R83 PolarHBondContact O-N 3Å; V81-V84 WeakPolarHBondContact O-CB 3.36Å; V81-V84 WeakPolarHBondContact O-CG2 3.48Å; V81-V84 PolarHBondContact O-N 3.4Å; V81-V84 VanDerWaalsContact O-N 3.11Å; V81-F167 HydrophobicContact CG2-CB 3.35Å; V81-V171 HydrophobicContact CG1-CG2 4.21Å; V81-V171 HydrophobicContact CG2-CG2 4.49Å
82R88.3Confident92.3Very high217 Ų21734 Ų3482%0.81916%0.156SC*.Hα-helixtrans-64.5-26.6-177.1-59.2-177.7-178179.13.2112.7N80N80-R82 VanDerWaalsContact C-N 3.28Å; N80-R82 PolarHBondContact O-N 2.96Å; N80-R82 WeakPolarHBondContact OD1-CB 3.37Å; N80-R82 PolarHBondContact OD1-N 3.4Å; N80-R82 VanDerWaalsContact OD1-N 3.12Å
83R90.4Very high92.2Very high41 Ų4135.7 Ų35.716%0.15517%0.165CC..Hα-helixtrans-79.4-22.9178.6-71.4-179.1173.9-164-4.2112.7E37 F40 L76 N80 V81 S85 L86 G87E37-R83 IonicContact OE1-NH2 3.85Å; F40-R83 HydrophobicContact CB-CG 4.21Å; F40-R83 HydrophobicContact CD1-CB 3.64Å; F40-R83 HydrophobicContact CD1-CG 3.6Å; F40-R83 HydrophobicContact CE1-CB 3.76Å; F40-R83 HydrophobicContact CE1-CG 4.21Å; F40-R83 WeakPolarHBondContact CE1-O 3.46Å; F40-R83 HydrophobicContact CG-CB 4.48Å; F40-R83 HydrophobicContact CG-CG 4.03Å; L76-R83 VanDerWaalsContact O-CD 3.28Å; L76-R83 WeakPolarHBondContact O-CD 3.45Å; N80-R83 PolarHBondContact O-N 2.92Å; N80-R83 VanDerWaalsContact O-N 3.16Å; N80-R83 WeakPolarHBondContact OD1-CG 3.41Å; N80-R83 PolarHBondContact OD1-N 3.45Å; N80-R83 VanDerWaalsContact OD1-N 3.11Å; V81-R83 PolarHBondContact O-N 3Å; R83-S85 PolarHBondContact O-N 3.03Å; R83-L86 PolarHBondContact O-N 3.43Å; R83-G87 PolarHBondContact O-N 2.84Å
84V92.5Very high92.1Very high1 Ų135.7 Ų35.71%0.00617%0.165CC..Hα-helixtrans-58.8-51.3-166.3179.40000113T77 V81 L86 G87 F88 G168 V171 F172 Y175T77-V84 HydrophobicContact CG2-CB 4.49Å; T77-V84 HydrophobicContact CG2-CG1 4.46Å; V81-V84 WeakPolarHBondContact O-CB 3.36Å; V81-V84 WeakPolarHBondContact O-CG2 3.48Å; V81-V84 PolarHBondContact O-N 3.4Å; V81-V84 VanDerWaalsContact O-N 3.11Å; V84-L86 PolarHBondContact O-N 2.8Å; V84-G87 PolarHBondContact O-N 3.49Å; V84-F88 VanDerWaalsContact O-CB 3.25Å; V84-F88 WeakPolarHBondContact O-CB 3.46Å; V84-F88 PolarHBondContact O-N 3.29Å; V84-G168 WeakPolarHBondContact CG2-O 3.43Å; V84-V171 HydrophobicContact CB-CG1 4.15Å; V84-V171 HydrophobicContact CG1-CB 4.28Å; V84-V171 HydrophobicContact CG1-CG1 3.8Å; V84-V171 HydrophobicContact CG2-CB 4.31Å; V84-V171 HydrophobicContact CG2-CG1 4.41Å; V84-F172 HydrophobicContact CG1-CB 3.86Å; V84-F172 HydrophobicContact CG1-CD2 4.07Å; V84-F172 HydrophobicContact CG1-CG 4.44Å; V84-F172 HydrophobicContact CG2-CB 4.48Å; V84-Y175 HydrophobicContact CG1-CD2 3.7Å; V84-Y175 HydrophobicContact CG1-CE2 4.1Å
85S91.7Very high92Very high50 Ų5038 Ų3835%0.3517%0.174SC..Hα-helixtrans-61-43.1-177-1760000112.5R83 R89R83-S85 PolarHBondContact O-N 3.03Å; S85-R89 WeakPolarHBondContact O-CB 3.26Å; S85-R89 PolarHBondContact O-N 3.42Å
86L90.9Very high91.8Very high38 Ų3839.1 Ų39.120%0.19919%0.194CC..Hα-helixtrans-70.4-43.1179.7-178.160.2000111.6I39 F40 V47 R83 V84 R89 C90I39-L86 HydrophobicContact CG2-CD1 4.2Å; I39-L86 HydrophobicContact CG2-CD2 3.77Å; I39-L86 HydrophobicContact CG2-CG 3.81Å; I39-L86 WeakPolarHBondContact O-CD2 3.33Å; F40-L86 HydrophobicContact CD1-CD2 4.25Å; V47-L86 HydrophobicContact CG1-CD1 4.26Å; R83-L86 PolarHBondContact O-N 3.43Å; V84-L86 PolarHBondContact O-N 2.8Å; L86-R89 PolarHBondContact O-N 2.72Å; L86-C90 WeakPolarHBondContact O-CB 3.28Å; L86-C90 PolarHBondContact O-N 3.17Å
87G93.6Very high91.8Very high0 Ų044.5 Ų44.50%022%0.215CC..Hα-helixtrans-64.6-43178.300000112.2T77 R83 V84 C90 F91T77-G87 WeakPolarHBondContact OG1-CA 3.32Å; R83-G87 PolarHBondContact O-N 2.84Å; V84-G87 PolarHBondContact O-N 3.49Å; G87-C90 WeakPolarHBondContact O-CB 3.4Å; G87-C90 PolarHBondContact O-N 3.23Å; G87-F91 PolarHBondContact O-N 2.92Å
88F94.5Very high91.7Very high11 Ų1145 Ų455%0.04822%0.217CC..Hα-helixtrans-62.2-43.3173.8178.7-101.7000112.5V84 F91 K92 F172 Y175 L176 N179 L180V84-F88 VanDerWaalsContact O-CB 3.25Å; V84-F88 WeakPolarHBondContact O-CB 3.46Å; V84-F88 PolarHBondContact O-N 3.29Å; F88-F91 HydrophobicContact CD2-CD1 4.47Å; F88-F91 WeakPolarHBondContact O-CB 3.4Å; F88-F91 PolarHBondContact O-N 3.21Å; F88-K92 HydrophobicContact CD1-CD 4.44Å; F88-K92 HydrophobicContact CE1-CD 3.56Å; F88-K92 HydrophobicContact CE1-CG 4.03Å; F88-K92 HydrophobicContact CE2-CG 4.4Å; F88-K92 HydrophobicContact CZ-CD 3.66Å; F88-K92 HydrophobicContact CZ-CG 3.91Å; F88-K92 PolarHBondContact O-N 3.23Å; F88-F172 HydrophobicContact CB-CD2 4.35Å; F88-F172 HydrophobicContact CB-CE2 4.1Å; F88-F172 HydrophobicContact CD2-CD2 4.45Å; F88-F172 AromaticContact CD2-CE2 3.97Å; F88-F172 HydrophobicContact CD2-CE2 3.97Å; F88-Y175 AromaticContact CD1-CD1 3.6Å; F88-Y175 HydrophobicContact CD1-CD1 3.6Å; F88-Y175 HydrophobicContact CD1-CE1 4.3Å; F88-Y175 HydrophobicContact CD1-CG 4.17Å; F88-Y175 HydrophobicContact CD2-CG 4.47Å; F88-Y175 AromaticContact CE1-CD1 3.83Å; F88-Y175 HydrophobicContact CE1-CD1 3.83Å; F88-Y175 HydrophobicContact CG-CD1 4.02Å; F88-Y175 HydrophobicContact CG-CG 4.12Å; F88-Y175 HydrophobicContact CZ-CD1 4.43Å; F88-L176 HydrophobicContact CD2-CD2 4.47Å; F88-L176 HydrophobicContact CE2-CD2 4.28Å; F88-N179 HydrophobicContact CE1-CB 3.69Å; F88-N179 HydrophobicContact CZ-CB 3.6Å; F88-L180 HydrophobicContact CE2-CB 4.45Å; F88-L180 HydrophobicContact CE2-CD1 4.33Å
89R91Very high91.6Very high126 Ų12648.4 Ų48.448%0.47524%0.24SC..Hα-helixtrans-61.7-46174.6-173.7-178.9-61.7152.93.4111.4S85 L86 F91 K92 D93S85-R89 WeakPolarHBondContact O-CB 3.26Å; S85-R89 PolarHBondContact O-N 3.42Å; L86-R89 PolarHBondContact O-N 2.72Å; R89-F91 VanDerWaalsContact C-N 3.25Å; R89-F91 PolarHBondContact O-N 2.95Å; R89-K92 PolarHBondContact O-N 3.48Å; R89-D93 WeakPolarHBondContact O-CB 3.48Å; R89-D93 VanDerWaalsContact O-CG 3.23Å; R89-D93 PolarHBondContact O-N 3.22Å
90C92.5Very high91.7Very high1 Ų152.3 Ų52.31%0.00726%0.259CS..Hα-helixtrans-57.3-42.6174.8-179.60000111.2I39 L73 L86 G87 D93 V94I39-C90 HydrophobicContact CD1-CB 4.11Å; I39-C90 WeakPolarHBondContact CD1-SG 3.33Å; L73-C90 HydrophobicContact CD1-CB 4.3Å; L86-C90 WeakPolarHBondContact O-CB 3.28Å; L86-C90 PolarHBondContact O-N 3.17Å; G87-C90 WeakPolarHBondContact O-CB 3.4Å; G87-C90 PolarHBondContact O-N 3.23Å; C90-D93 PolarHBondContact O-N 3.08Å; C90-V94 WeakPolarHBondContact O-CB 3.42Å; C90-V94 WeakPolarHBondContact O-CG2 3.27Å; C90-V94 PolarHBondContact O-N 3.12Å
91F94.9Very high91.9Very high1 Ų155.5 Ų55.50%0.00428%0.279CS..Hα-helixtrans-59.5-53177.2170.2-137.6000111.4L73 G87 F88 R89 D93 V94 R95 L106 E107 V110 L176 L180L73-F91 HydrophobicContact CD2-CB 3.58Å; L73-F91 HydrophobicContact CD2-CD2 4.46Å; L73-F91 HydrophobicContact CD2-CG 4.41Å; G87-F91 PolarHBondContact O-N 2.92Å; F88-F91 HydrophobicContact CD2-CD1 4.47Å; F88-F91 WeakPolarHBondContact O-CB 3.4Å; F88-F91 PolarHBondContact O-N 3.21Å; R89-F91 VanDerWaalsContact C-N 3.25Å; R89-F91 PolarHBondContact O-N 2.95Å; F91-D93 VanDerWaalsContact C-N 3.32Å; F91-D93 PolarHBondContact O-N 2.89Å; F91-V94 PolarHBondContact O-N 3.07Å; F91-R95 HydrophobicContact CD2-CB 4.43Å; F91-R95 HydrophobicContact CE2-CB 4.16Å; F91-R95 HydrophobicContact CE2-CG 4.47Å; F91-R95 VanDerWaalsContact O-CB 3.31Å; F91-R95 WeakPolarHBondContact O-CB 3.45Å; F91-R95 PolarHBondContact O-N 3.36Å; F91-L106 HydrophobicContact CD2-CD2 3.96Å; F91-L106 HydrophobicContact CD2-CG 4.3Å; F91-L106 HydrophobicContact CE2-CD2 3.99Å; F91-L106 HydrophobicContact CE2-CG 4.13Å; F91-E107 HydrophobicContact CE2-CB 4.38Å; F91-E107 HydrophobicContact CZ-CB 4.09Å; F91-E107 HydrophobicContact CZ-CG 4.14Å; F91-V110 HydrophobicContact CD1-CG1 4.48Å; F91-V110 HydrophobicContact CD2-CG2 3.83Å; F91-V110 HydrophobicContact CE1-CG1 4.14Å; F91-V110 HydrophobicContact CE1-CG2 4.42Å; F91-V110 HydrophobicContact CE2-CB 4.38Å; F91-V110 HydrophobicContact CE2-CG2 3.73Å; F91-V110 HydrophobicContact CG-CG2 4.27Å; F91-V110 HydrophobicContact CZ-CB 4.22Å; F91-V110 HydrophobicContact CZ-CG1 4.34Å; F91-V110 HydrophobicContact CZ-CG2 4.05Å; F91-L176 HydrophobicContact CD1-CD2 4.24Å; F91-L176 HydrophobicContact CE1-CD2 3.82Å; F91-L180 HydrophobicContact CD1-CD1 4.02Å; F91-L180 HydrophobicContact CE1-CD1 3.28Å; F91-L180 HydrophobicContact CE1-CD2 4.45Å; F91-L180 HydrophobicContact CE1-CG 4.49Å; F91-L180 HydrophobicContact CZ-CD1 3.9Å
92K92.8Very high92.2Very high27 Ų2756.1 Ų56.112%0.11728%0.279CS..Hα-helixtrans-56.6-46.2176.4-76.7-167.475-179.80111.7F88 R89 V94 R95 A96 N179 S182 D184F88-K92 HydrophobicContact CD1-CD 4.44Å; F88-K92 HydrophobicContact CE1-CD 3.56Å; F88-K92 HydrophobicContact CE1-CG 4.03Å; F88-K92 HydrophobicContact CE2-CG 4.4Å; F88-K92 HydrophobicContact CZ-CD 3.66Å; F88-K92 HydrophobicContact CZ-CG 3.91Å; F88-K92 PolarHBondContact O-N 3.23Å; R89-K92 PolarHBondContact O-N 3.48Å; K92-V94 VanDerWaalsContact C-N 3.35Å; K92-V94 PolarHBondContact O-N 3.41Å; K92-R95 PolarHBondContact O-N 3.28Å; K92-A96 VanDerWaalsContact O-CB 3.26Å; K92-A96 WeakPolarHBondContact O-CB 3.31Å; K92-A96 PolarHBondContact O-N 2.89Å; K92-N179 PolarHBondContact NZ-O 3.47Å; K92-S182 PolarHBondContact NZ-O 3.29Å; K92-D184 IonicContact NZ-OD1 2.72Å; K92-D184 PolarHBondContact NZ-OD1 2.86Å
93D91.6Very high92.5Very high44 Ų4445.9 Ų45.924%0.23524%0.242CC..Hα-helixtrans-64.6-36.6-177.2-75.1-3000113.1I51 K55 R89 C90 F91 Y97I51-D93 HydrophobicContact CG2-CB 4.41Å; K55-D93 WeakPolarHBondContact CE-O 3.42Å; K55-D93 PolarHBondContact NZ-O 3.47Å; K55-D93 VanDerWaalsContact NZ-O 3.16Å; R89-D93 WeakPolarHBondContact O-CB 3.48Å; R89-D93 VanDerWaalsContact O-CG 3.23Å; R89-D93 PolarHBondContact O-N 3.22Å; C90-D93 PolarHBondContact O-N 3.08Å; F91-D93 VanDerWaalsContact C-N 3.32Å; F91-D93 PolarHBondContact O-N 2.89Å; D93-Y97 WeakPolarHBondContact O-CB 3.43Å
94V93.8Very high92.6Very high1 Ų148.8 Ų48.81%0.00626%0.26CS..Hα-helixtrans-76.3-46.9176.8178.50000109.6I51 I54 K55 A58 C90 F91 K92 A96 Y97 L98 L106I51-V94 HydrophobicContact CG2-CG2 4.29Å; I54-V94 HydrophobicContact CB-CG2 4.49Å; I54-V94 HydrophobicContact CG2-CG1 4.38Å; I54-V94 HydrophobicContact CG2-CG2 3.9Å; K55-V94 HydrophobicContact CG-CB 4.48Å; K55-V94 HydrophobicContact CG-CG1 4.33Å; K55-V94 HydrophobicContact CG-CG2 4.07Å; A58-V94 HydrophobicContact CB-CG1 4.28Å; C90-V94 WeakPolarHBondContact O-CB 3.42Å; C90-V94 WeakPolarHBondContact O-CG2 3.27Å; C90-V94 PolarHBondContact O-N 3.12Å; F91-V94 PolarHBondContact O-N 3.07Å; K92-V94 VanDerWaalsContact C-N 3.35Å; K92-V94 PolarHBondContact O-N 3.41Å; V94-A96 VanDerWaalsContact C-N 3.34Å; V94-A96 PolarHBondContact O-N 2.97Å; V94-Y97 PolarHBondContact O-N 3.12Å; V94-Y97 VanDerWaalsContact O-N 3.14Å; V94-L98 HydrophobicContact CG1-CD1 3.97Å; V94-L98 HydrophobicContact CG1-CG 4.4Å; V94-L98 WeakPolarHBondContact O-CG 3.35Å; V94-L98 PolarHBondContact O-N 2.78Å; V94-L106 HydrophobicContact CB-CD2 4.13Å; V94-L106 HydrophobicContact CG1-CD1 4.49Å; V94-L106 HydrophobicContact CG1-CD2 3.78Å
95R94Very high92.7Very high50 Ų5052.6 Ų52.619%0.18928%0.281CS..Hα-helixtrans-55.8-47.9178.2-169.7-173.771.4172.8-3.3111.6F91 K92 Y97 L98 L106 E107 L180 N181F91-R95 HydrophobicContact CD2-CB 4.43Å; F91-R95 HydrophobicContact CE2-CB 4.16Å; F91-R95 HydrophobicContact CE2-CG 4.47Å; F91-R95 VanDerWaalsContact O-CB 3.31Å; F91-R95 WeakPolarHBondContact O-CB 3.45Å; F91-R95 PolarHBondContact O-N 3.36Å; K92-R95 PolarHBondContact O-N 3.28Å; R95-Y97 VanDerWaalsContact C-N 3.25Å; R95-Y97 PolarHBondContact O-N 3.24Å; R95-L98 PolarHBondContact O-N 2.9Å; R95-L106 HydrophobicContact CB-CD2 3.91Å; R95-E107 VanDerWaalsContact CD-OE2 3.26Å; R95-E107 WeakPolarHBondContact CD-OE2 3.33Å; R95-E107 IonicContact CZ-OE2 2.81Å; R95-E107 IonicContact NE-OE2 3.16Å; R95-E107 IonicContact NH1-OE2 3.21Å; R95-E107 PolarHBondContact NH1-OE2 3.48Å; R95-L180 VanDerWaalsContact NH1-CG 3.3Å; R95-L180 PolarHBondContact NH2-O 2.94Å; R95-N181 PolarHBondContact NH1-OD1 3.15Å
96A90.9Very high92.9Very high88 Ų8850.2 Ų50.273%0.72726%0.264SS*.THydrogen-bonded Turntrans-69.7-20.3-178.200000114K92 V94K92-A96 VanDerWaalsContact O-CB 3.26Å; K92-A96 WeakPolarHBondContact O-CB 3.31Å; K92-A96 PolarHBondContact O-N 2.89Å; V94-A96 VanDerWaalsContact C-N 3.34Å; V94-A96 PolarHBondContact O-N 2.97Å
97Y92.7Very high93.2Very high116 Ų11650 Ų5046%0.45526%0.262SS..THydrogen-bonded Turntrans-85.4-30.1178.1170.8-95.3000112.6K55 E59 D93 V94 R95K55-Y97 HydrophobicContact CB-CD1 3.67Å; K55-Y97 HydrophobicContact CB-CE1 3.65Å; K55-Y97 HydrophobicContact CD-CD1 3.56Å; K55-Y97 HydrophobicContact CD-CD2 4.08Å; K55-Y97 HydrophobicContact CD-CE1 4.06Å; K55-Y97 HydrophobicContact CD-CG 3.57Å; K55-Y97 HydrophobicContact CG-CD1 3.51Å; K55-Y97 HydrophobicContact CG-CE1 4.01Å; K55-Y97 HydrophobicContact CG-CG 4.01Å; E59-Y97 HydrophobicContact CG-CE1 4.14Å; E59-Y97 WeakPolarHBondContact OE1-CE1 3.5Å; E59-Y97 VanDerWaalsContact OE1-CZ 3.29Å; E59-Y97 PolarHBondContact OE1-OH 3.24Å; E59-Y97 PolarHBondContact OE2-OH 3.46Å; D93-Y97 WeakPolarHBondContact O-CB 3.43Å; V94-Y97 PolarHBondContact O-N 3.12Å; V94-Y97 VanDerWaalsContact O-N 3.14Å; R95-Y97 VanDerWaalsContact C-N 3.25Å; R95-Y97 PolarHBondContact O-N 3.24Å
98L92.6Very high93.3Very high10 Ų1052 Ų525%0.05228%0.279CS..SBendtrans-75.8153.8-177.5-68.5171.4000111.8A58 E59 V94 R95 K102 L106A58-L98 HydrophobicContact CB-CD1 3.8Å; A58-L98 HydrophobicContact CB-CD2 4.04Å; A58-L98 HydrophobicContact CB-CG 4.49Å; E59-L98 HydrophobicContact CB-CD2 4.46Å; E59-L98 HydrophobicContact CG-CD2 3.47Å; E59-L98 VanDerWaalsContact CG-CD2 3.47Å; V94-L98 HydrophobicContact CG1-CD1 3.97Å; V94-L98 HydrophobicContact CG1-CG 4.4Å; V94-L98 WeakPolarHBondContact O-CG 3.35Å; V94-L98 PolarHBondContact O-N 2.78Å; R95-L98 PolarHBondContact O-N 2.9Å; L98-K102 HydrophobicContact CB-CB 4.15Å; L98-K102 HydrophobicContact CD1-CB 4.33Å; L98-K102 HydrophobicContact CD2-CB 4.43Å; L98-L106 HydrophobicContact CD1-CB 4.29Å; L98-L106 HydrophobicContact CD1-CD2 4.07Å
99P92Very high93.4Very high72 Ų7251.5 Ų51.547%0.46828%0.277SS..  trans-57.5147.4165-19.931.3000111.1T101 K102 G103P99-T101 PolarHBondContact O-N 3.39Å; P99-K102 PolarHBondContact O-N 3.4Å; P99-G103 PolarHBondContact O-N 3Å
100D91.1Very high93.7Very high137 Ų13745.5 Ų45.573%0.73325%0.254SS*.Hα-helixtrans-46.2-43.4-174.4-62-15.4000114K102 G103 N104D100-K102 PolarHBondContact O-N 3.2Å; D100-G103 PolarHBondContact O-N 3.28Å; D100-N104 VanDerWaalsContact O-CB 3.28Å; D100-N104 WeakPolarHBondContact O-CB 3.45Å; D100-N104 PolarHBondContact O-N 3.02Å; D100-N104 PolarHBondContact O-ND2 3.34Å
101T91.9Very high93.9Very high102 Ų10246.7 Ų46.763%0.62626%0.26SS*.Hα-helixtrans-60.3-48178.550.90000112.3P99 D105P99-T101 PolarHBondContact O-N 3.39Å; T101-D105 VanDerWaalsContact O-CG 3.32Å; T101-D105 PolarHBondContact O-N 3.49Å
102K93Very high94Very high45 Ų4551.3 Ų51.320%0.19628%0.282CS..Hα-helixtrans-74.4-33178.9-66.4-163.3-179.5-160.90112.4E59 L60 S66 L98 P99 D100 D105 L106E59-K102 VanDerWaalsContact C-NZ 3.31Å; E59-K102 PolarHBondContact O-NZ 2.91Å; L60-K102 PolarHBondContact O-NZ 2.76Å; S66-K102 WeakPolarHBondContact CB-O 3.44Å; L98-K102 HydrophobicContact CB-CB 4.15Å; L98-K102 HydrophobicContact CD1-CB 4.33Å; L98-K102 HydrophobicContact CD2-CB 4.43Å; P99-K102 PolarHBondContact O-N 3.4Å; D100-K102 PolarHBondContact O-N 3.2Å; K102-D105 PolarHBondContact O-N 3.04Å; K102-L106 WeakPolarHBondContact O-CB 3.35Å; K102-L106 PolarHBondContact O-N 3.28Å
103G93.5Very high94.2Very high3 Ų350.3 Ų50.33%0.03128%0.278CS..Hα-helixtrans-62.6-44.3172.500000111.7P99 D100 L106 E107P99-G103 PolarHBondContact O-N 3Å; D100-G103 PolarHBondContact O-N 3.28Å; G103-L106 WeakPolarHBondContact O-CB 3.43Å; G103-L106 PolarHBondContact O-N 2.93Å; G103-E107 PolarHBondContact O-N 3.41Å
104N93.7Very high94.5Very high102 Ų10248.2 Ų48.255%0.54527%0.267SS..Hα-helixtrans-66.9-39.7175.1-68.1-18.1000111.8D100 E107 A108D100-N104 VanDerWaalsContact O-CB 3.28Å; D100-N104 WeakPolarHBondContact O-CB 3.45Å; D100-N104 PolarHBondContact O-N 3.02Å; D100-N104 PolarHBondContact O-ND2 3.34Å; N104-E107 PolarHBondContact O-N 3.32Å; N104-A108 WeakPolarHBondContact O-CB 3.24Å; N104-A108 PolarHBondContact O-N 3.44Å
105D94.6Very high94.5Very high81 Ų8152.9 Ų52.943%0.43329%0.287SS..Hα-helixtrans-64.1-40175.3-76-13.8000112.1H67 T101 K102 A108 G109H67-D105 WeakPolarHBondContact CA-O 3.47Å; H67-D105 PolarHBondContact ND1-O 3.46Å; T101-D105 VanDerWaalsContact O-CG 3.32Å; T101-D105 PolarHBondContact O-N 3.49Å; K102-D105 PolarHBondContact O-N 3.04Å; D105-A108 PolarHBondContact O-N 3.01Å; D105-G109 PolarHBondContact O-N 3.08Å; D105-G109 VanDerWaalsContact O-N 3.11Å
106L95.6Very high94.5Very high0 Ų054.7 Ų54.70%030%0.3CS..Hα-helixtrans-61.1-48.917317681.7000111.1S66 V69 F91 V94 R95 L98 K102 G103 A108 G109 V110S66-L106 WeakPolarHBondContact O-CA 3.15Å; S66-L106 VanDerWaalsContact O-CD1 3.25Å; S66-L106 WeakPolarHBondContact O-CD1 3.47Å; V69-L106 HydrophobicContact CB-CD1 3.97Å; V69-L106 HydrophobicContact CG1-CD1 3.72Å; F91-L106 HydrophobicContact CD2-CD2 3.96Å; F91-L106 HydrophobicContact CD2-CG 4.3Å; F91-L106 HydrophobicContact CE2-CD2 3.99Å; F91-L106 HydrophobicContact CE2-CG 4.13Å; V94-L106 HydrophobicContact CB-CD2 4.13Å; V94-L106 HydrophobicContact CG1-CD1 4.49Å; V94-L106 HydrophobicContact CG1-CD2 3.78Å; R95-L106 HydrophobicContact CB-CD2 3.91Å; L98-L106 HydrophobicContact CD1-CB 4.29Å; L98-L106 HydrophobicContact CD1-CD2 4.07Å; K102-L106 WeakPolarHBondContact O-CB 3.35Å; K102-L106 PolarHBondContact O-N 3.28Å; G103-L106 WeakPolarHBondContact O-CB 3.43Å; G103-L106 PolarHBondContact O-N 2.93Å; L106-A108 VanDerWaalsContact C-N 3.34Å; L106-A108 PolarHBondContact O-N 2.59Å; L106-G109 PolarHBondContact O-N 3.5Å; L106-V110 PolarHBondContact O-N 3.24Å; L106-V110 VanDerWaalsContact O-N 3.08Å
107E96.4Very high94.6Very high33 Ų3351 Ų5115%0.15427%0.267CS..Hα-helixtrans-59.7-44.7177178.4168.4153.900111.4F91 R95 G103 N104 G109 V110 L111F91-E107 HydrophobicContact CE2-CB 4.38Å; F91-E107 HydrophobicContact CZ-CB 4.09Å; F91-E107 HydrophobicContact CZ-CG 4.14Å; R95-E107 VanDerWaalsContact CD-OE2 3.26Å; R95-E107 WeakPolarHBondContact CD-OE2 3.33Å; R95-E107 IonicContact CZ-OE2 2.81Å; R95-E107 IonicContact NE-OE2 3.16Å; R95-E107 IonicContact NH1-OE2 3.21Å; R95-E107 PolarHBondContact NH1-OE2 3.48Å; G103-E107 PolarHBondContact O-N 3.41Å; N104-E107 PolarHBondContact O-N 3.32Å; E107-G109 VanDerWaalsContact C-N 3.29Å; E107-G109 PolarHBondContact O-N 3.09Å; E107-V110 WeakPolarHBondContact O-CB 3.48Å; E107-V110 PolarHBondContact O-N 3.33Å; E107-V110 VanDerWaalsContact O-N 3.09Å; E107-L111 HydrophobicContact CG-CD1 4.04Å; E107-L111 HydrophobicContact CG-CG 4.21Å; E107-L111 WeakPolarHBondContact O-CG 3.44Å; E107-L111 PolarHBondContact O-N 3.02Å
108A95.8Very high94.7Very high43 Ų4345.4 Ų45.436%0.35525%0.246SC..Hα-helixtrans-56.8-42.617600000112.1N104 D105 L106 V110 L111 E112N104-A108 WeakPolarHBondContact O-CB 3.24Å; N104-A108 PolarHBondContact O-N 3.44Å; D105-A108 PolarHBondContact O-N 3.01Å; L106-A108 VanDerWaalsContact C-N 3.34Å; L106-A108 PolarHBondContact O-N 2.59Å; A108-V110 PolarHBondContact O-N 3.43Å; A108-L111 PolarHBondContact O-N 3.49Å; A108-E112 VanDerWaalsContact O-CB 3.3Å; A108-E112 WeakPolarHBondContact O-CB 3.37Å; A108-E112 PolarHBondContact O-N 3.32Å
109G96.2Very high94.6Very high0 Ų049.6 Ų49.60%027%0.265CS..Hα-helixtrans-65.4-36.4176.300000113.5H67 D105 L106 E107 S113H67-G109 VanDerWaalsContact CE1-CA 3.41Å; H67-G109 WeakPolarHBondContact CE1-CA 3.37Å; H67-G109 PolarHBondContact CE1-N 3.44Å; H67-G109 PolarHBondContact ND1-N 2.99Å; D105-G109 PolarHBondContact O-N 3.08Å; D105-G109 VanDerWaalsContact O-N 3.11Å; L106-G109 PolarHBondContact O-N 3.5Å; E107-G109 VanDerWaalsContact C-N 3.29Å; E107-G109 PolarHBondContact O-N 3.09Å; G109-S113 WeakPolarHBondContact O-CB 3.45Å; G109-S113 PolarHBondContact O-N 3.1Å; G109-S113 VanDerWaalsContact O-N 3.1Å
110V98Very high94.4Very high0 Ų051.9 Ų51.90%027%0.27CS..Hα-helixtrans-63.3-51.3172.5170.70000110.6G70 A74 F91 L106 E107 A108 E112 S113 V114 F172 L176G70-V110 WeakPolarHBondContact O-CG2 3.38Å; A74-V110 HydrophobicContact CB-CG1 4.23Å; F91-V110 HydrophobicContact CD1-CG1 4.48Å; F91-V110 HydrophobicContact CD2-CG2 3.83Å; F91-V110 HydrophobicContact CE1-CG1 4.14Å; F91-V110 HydrophobicContact CE1-CG2 4.42Å; F91-V110 HydrophobicContact CE2-CB 4.38Å; F91-V110 HydrophobicContact CE2-CG2 3.73Å; F91-V110 HydrophobicContact CG-CG2 4.27Å; F91-V110 HydrophobicContact CZ-CB 4.22Å; F91-V110 HydrophobicContact CZ-CG1 4.34Å; F91-V110 HydrophobicContact CZ-CG2 4.05Å; L106-V110 PolarHBondContact O-N 3.24Å; L106-V110 VanDerWaalsContact O-N 3.08Å; E107-V110 WeakPolarHBondContact O-CB 3.48Å; E107-V110 PolarHBondContact O-N 3.33Å; E107-V110 VanDerWaalsContact O-N 3.09Å; A108-V110 PolarHBondContact O-N 3.43Å; V110-E112 PolarHBondContact O-N 3.11Å; V110-S113 PolarHBondContact O-N 3.33Å; V110-V114 HydrophobicContact CG1-CG2 4.42Å; V110-V114 WeakPolarHBondContact O-CB 3.42Å; V110-V114 VanDerWaalsContact O-CG2 3.28Å; V110-V114 WeakPolarHBondContact O-CG2 3.38Å; V110-V114 PolarHBondContact O-N 3.42Å; V110-F172 HydrophobicContact CG1-CE1 3.95Å; V110-F172 HydrophobicContact CG1-CZ 3.86Å; V110-L176 HydrophobicContact CG1-CD2 4.33Å
111L97.5Very high94.1Very high25 Ų2545.5 Ų45.513%0.13124%0.236CC..Hα-helixtrans-65.2-40.5-176.3-63.7-175.6000112E107 A108 V114 K115 L176 P194 P197E107-L111 HydrophobicContact CG-CD1 4.04Å; E107-L111 HydrophobicContact CG-CG 4.21Å; E107-L111 WeakPolarHBondContact O-CG 3.44Å; E107-L111 PolarHBondContact O-N 3.02Å; A108-L111 PolarHBondContact O-N 3.49Å; L111-V114 PolarHBondContact O-N 2.85Å; L111-K115 WeakPolarHBondContact O-CB 3.41Å; L111-K115 PolarHBondContact O-N 2.89Å; L111-L176 HydrophobicContact CD2-CD1 4.45Å; L111-P194 HydrophobicContact CD1-CB 4.34Å; L111-P197 HydrophobicContact CD2-CG 3.42Å; L111-P197 VanDerWaalsContact CD2-CG 3.42Å
112E96.5Very high93.8Very high99 Ų9943.2 Ų43.246%0.46322%0.219SC..Hα-helixtrans-63.6-44.9175.9-177.1164.1-170.100111.5H67 A108 V110 V114 K115 L116H67-E112 IonicContact CE1-OE2 3.19Å; H67-E112 PolarHBondContact CE1-OE2 3.45Å; H67-E112 IonicContact NE2-OE2 3.3Å; H67-E112 PolarHBondContact NE2-OE2 3.16Å; A108-E112 VanDerWaalsContact O-CB 3.3Å; A108-E112 WeakPolarHBondContact O-CB 3.37Å; A108-E112 PolarHBondContact O-N 3.32Å; V110-E112 PolarHBondContact O-N 3.11Å; E112-V114 VanDerWaalsContact C-N 3.35Å; E112-V114 PolarHBondContact O-N 2.91Å; E112-K115 PolarHBondContact O-N 3.47Å; E112-L116 HydrophobicContact CG-CD1 4.46Å; E112-L116 WeakPolarHBondContact O-CG 3.34Å; E112-L116 PolarHBondContact O-N 3.05Å
113S96.4Very high93.1Very high5 Ų544.7 Ų44.74%0.03524%0.235CC..Hα-helixtrans-64.5-38.7176.5-175.60000112.4Q75 G109 V110 L116 M117Q75-S113 WeakPolarHBondContact CG-OG 3.32Å; G109-S113 WeakPolarHBondContact O-CB 3.45Å; G109-S113 PolarHBondContact O-N 3.1Å; G109-S113 VanDerWaalsContact O-N 3.1Å; V110-S113 PolarHBondContact O-N 3.33Å; S113-L116 PolarHBondContact O-N 3.26Å; S113-M117 WeakPolarHBondContact O-CE 3.1Å; S113-M117 WeakPolarHBondContact O-CG 3.38Å; S113-M117 PolarHBondContact O-N 2.91Å
114V97.4Very high91.6Very high0 Ų044.8 Ų44.80%024%0.236CC..Hα-helixtrans-64.6-42.7177166.90000111.4A74 V110 L111 E112 L116 M117 T118 L169 F172 L173 L176A74-V114 HydrophobicContact CB-CG2 4.32Å; V110-V114 HydrophobicContact CG1-CG2 4.42Å; V110-V114 WeakPolarHBondContact O-CB 3.42Å; V110-V114 VanDerWaalsContact O-CG2 3.28Å; V110-V114 WeakPolarHBondContact O-CG2 3.38Å; V110-V114 PolarHBondContact O-N 3.42Å; L111-V114 PolarHBondContact O-N 2.85Å; E112-V114 VanDerWaalsContact C-N 3.35Å; E112-V114 PolarHBondContact O-N 2.91Å; V114-L116 PolarHBondContact O-N 3.14Å; V114-M117 HydrophobicContact CB-CE 4.47Å; V114-M117 HydrophobicContact CG2-CE 3.99Å; V114-M117 PolarHBondContact O-N 2.92Å; V114-T118 WeakPolarHBondContact O-CB 3.3Å; V114-T118 PolarHBondContact O-N 2.94Å; V114-T118 PolarHBondContact O-OG1 3.37Å; V114-L169 HydrophobicContact CG1-CD1 4.11Å; V114-F172 HydrophobicContact CG2-CD1 3.77Å; V114-F172 HydrophobicContact CG2-CE1 3.59Å; V114-L173 HydrophobicContact CG1-CD2 3.41Å; V114-L173 VanDerWaalsContact CG1-CD2 3.41Å; V114-L173 HydrophobicContact CG1-CG 4.04Å; V114-L176 HydrophobicContact CG1-CD1 4.42Å; V114-L176 HydrophobicContact CG2-CD1 4.02Å
115K95.4Very high90.2Very high99 Ų9943.5 Ų43.543%0.4324%0.235SC..Hα-helixtrans-60.1-45.2174.4-179.8179.8179179.30111.8L111 E112 T118 Q119L111-K115 WeakPolarHBondContact O-CB 3.41Å; L111-K115 PolarHBondContact O-N 2.89Å; E112-K115 PolarHBondContact O-N 3.47Å; K115-T118 WeakPolarHBondContact O-CB 3.4Å; K115-T118 PolarHBondContact O-N 3.19Å; K115-Q119 VanDerWaalsContact O-CG 3.31Å; K115-Q119 WeakPolarHBondContact O-CG 3.49Å; K115-Q119 PolarHBondContact O-N 2.84Å
116L94Very high88.9Confident88 Ų8841.4 Ų41.446%0.46123%0.225SC..Hα-helixtrans-61.4-47.1177.2-71.6173.1000111.8E112 S113 V114 T118 Q119 E120E112-L116 HydrophobicContact CG-CD1 4.46Å; E112-L116 WeakPolarHBondContact O-CG 3.34Å; E112-L116 PolarHBondContact O-N 3.05Å; S113-L116 PolarHBondContact O-N 3.26Å; V114-L116 PolarHBondContact O-N 3.14Å; L116-T118 VanDerWaalsContact C-N 3.29Å; L116-T118 PolarHBondContact O-N 2.81Å; L116-Q119 WeakPolarHBondContact O-CB 3.35Å; L116-Q119 PolarHBondContact O-N 3.36Å; L116-Q119 VanDerWaalsContact O-N 3.16Å; L116-E120 WeakPolarHBondContact O-CG 3.24Å; L116-E120 PolarHBondContact O-N 3.37Å
117M93.3Very high87.5Confident10 Ų1041.6 Ų41.65%0.04923%0.226CC..Hα-helixtrans-61.2-39.5176.4-69.1-179.1-64.400111.8A74 T78 S113 V114 E120 V121 H165 L169A74-M117 HydrophobicContact CB-CE 4.26Å; T78-M117 HydrophobicContact CG2-CE 3.72Å; T78-M117 HydrophobicContact CG2-SD 4.32Å; T78-M117 WeakPolarHBondContact OG1-CE 3.33Å; T78-M117 PolarHBondContact OG1-SD 2.85Å; S113-M117 WeakPolarHBondContact O-CE 3.1Å; S113-M117 WeakPolarHBondContact O-CG 3.38Å; S113-M117 PolarHBondContact O-N 2.91Å; V114-M117 HydrophobicContact CB-CE 4.47Å; V114-M117 HydrophobicContact CG2-CE 3.99Å; V114-M117 PolarHBondContact O-N 2.92Å; M117-E120 PolarHBondContact O-N 3.35Å; M117-V121 WeakPolarHBondContact O-CG2 3.47Å; M117-V121 PolarHBondContact O-N 2.91Å; M117-H165 PolarHBondContact SD-CE1 3.35Å; M117-L169 HydrophobicContact CB-CD1 4.26Å; M117-L169 HydrophobicContact CB-CD2 4.19Å; M117-L169 HydrophobicContact CE-CD1 4.27Å
118T93.6Very high86Confident0 Ų042.4 Ų42.40%023%0.229CC..Hα-helixtrans-61.8-46.1174.7-58.40000110.9V114 K115 L116 E120 V121 L122 D200 L204V114-T118 WeakPolarHBondContact O-CB 3.3Å; V114-T118 PolarHBondContact O-N 2.94Å; V114-T118 PolarHBondContact O-OG1 3.37Å; K115-T118 WeakPolarHBondContact O-CB 3.4Å; K115-T118 PolarHBondContact O-N 3.19Å; L116-T118 VanDerWaalsContact C-N 3.29Å; L116-T118 PolarHBondContact O-N 2.81Å; T118-E120 VanDerWaalsContact C-N 3.35Å; T118-E120 PolarHBondContact O-N 3.37Å; T118-V121 PolarHBondContact O-N 3.18Å; T118-L122 HydrophobicContact CG2-CD1 3.85Å; T118-L122 HydrophobicContact CG2-CG 4.36Å; T118-L122 WeakPolarHBondContact O-CB 3.41Å; T118-L122 WeakPolarHBondContact O-CG 3.29Å; T118-L122 PolarHBondContact O-N 2.84Å; T118-D200 HydrophobicContact CG2-CB 3.9Å; T118-L204 HydrophobicContact CG2-CD2 4.06Å; T118-L204 HydrophobicContact CG2-CG 4.03Å
119Q90.6Very high84.4Confident98 Ų9841.2 Ų41.246%0.45822%0.219SC..Hα-helixtrans-62.8-38.9176.2-71.9177.1-13.700112.7K115 L116 L122 S123K115-Q119 VanDerWaalsContact O-CG 3.31Å; K115-Q119 WeakPolarHBondContact O-CG 3.49Å; K115-Q119 PolarHBondContact O-N 2.84Å; L116-Q119 WeakPolarHBondContact O-CB 3.35Å; L116-Q119 PolarHBondContact O-N 3.36Å; L116-Q119 VanDerWaalsContact O-N 3.16Å; Q119-L122 PolarHBondContact O-N 3.09Å; Q119-S123 WeakPolarHBondContact O-CB 3.48Å; Q119-S123 PolarHBondContact O-N 3.16Å
120E87.1Confident82.8Confident120 Ų12041.3 Ų41.356%0.56122%0.219SC*.Hα-helixtrans-61.1-46.2174.4-74.1175.817900111.2L116 M117 T118 L122 S123L116-E120 WeakPolarHBondContact O-CG 3.24Å; L116-E120 PolarHBondContact O-N 3.37Å; M117-E120 PolarHBondContact O-N 3.35Å; T118-E120 VanDerWaalsContact C-N 3.35Å; T118-E120 PolarHBondContact O-N 3.37Å; E120-L122 VanDerWaalsContact C-N 3.35Å; E120-L122 PolarHBondContact O-N 3.29Å; E120-S123 PolarHBondContact O-N 3.23Å; E120-S123 PolarHBondContact O-OG 2.86Å
121V85.8Confident80.9Confident3 Ų342 Ų422%0.01822%0.223CC..Hα-helixtrans-59.6-44.9174.91690000111.4M117 T118 G124 L127 L166 L169 L204M117-V121 WeakPolarHBondContact O-CG2 3.47Å; M117-V121 PolarHBondContact O-N 2.91Å; T118-V121 PolarHBondContact O-N 3.18Å; V121-G124 PolarHBondContact O-N 2.95Å; V121-L127 HydrophobicContact CG1-CD1 3.87Å; V121-L127 HydrophobicContact CG1-CD2 3.87Å; V121-L127 HydrophobicContact CG1-CG 3.58Å; V121-L166 HydrophobicContact CB-CD1 4.44Å; V121-L166 HydrophobicContact CG1-CD1 3.57Å; V121-L166 HydrophobicContact CG2-CD1 3.99Å; V121-L169 HydrophobicContact CG2-CD2 4.07Å; V121-L204 HydrophobicContact CB-CD2 4.23Å; V121-L204 HydrophobicContact CG1-CD2 3.59Å
122L85.3Confident78.9Confident53 Ų5345.7 Ų45.728%0.27724%0.242SC..Hα-helixtrans-71-27.1-179.3-67.5171.1000113.8T118 Q119 E120 G124 L127 L203 L204 A207T118-L122 HydrophobicContact CG2-CD1 3.85Å; T118-L122 HydrophobicContact CG2-CG 4.36Å; T118-L122 WeakPolarHBondContact O-CB 3.41Å; T118-L122 WeakPolarHBondContact O-CG 3.29Å; T118-L122 PolarHBondContact O-N 2.84Å; Q119-L122 PolarHBondContact O-N 3.09Å; E120-L122 VanDerWaalsContact C-N 3.35Å; E120-L122 PolarHBondContact O-N 3.29Å; L122-G124 PolarHBondContact O-N 2.84Å; L122-L127 HydrophobicContact CD2-CD1 4.27Å; L122-L203 HydrophobicContact CD1-CB 3.71Å; L122-L203 HydrophobicContact CD1-CD1 4.12Å; L122-L203 HydrophobicContact CD1-CG 4.42Å; L122-L204 HydrophobicContact CD2-CD2 4.19Å; L122-L204 HydrophobicContact CG-CD2 4.35Å; L122-A207 HydrophobicContact CD2-CB 3.39Å
123S77.7Confident76.4Confident77 Ų7742.5 Ų42.554%0.53823%0.231SC..THydrogen-bonded Turntrans-61.1-917676.30000113.2Q119 E120Q119-S123 WeakPolarHBondContact O-CB 3.48Å; Q119-S123 PolarHBondContact O-N 3.16Å; E120-S123 PolarHBondContact O-N 3.23Å; E120-S123 PolarHBondContact O-OG 2.86Å
124G62.6Low73.7Confident5 Ų546.6 Ų46.65%0.05226%0.259CS..SBendtrans104-16.3151.800000114.4V121 L122 K128V121-G124 PolarHBondContact O-N 2.95Å; L122-G124 PolarHBondContact O-N 2.84Å; G124-K128 WeakPolarHBondContact O-CB 3.48Å; G124-K128 VanDerWaalsContact O-CD 3.25Å; G124-K128 WeakPolarHBondContact O-CD 3.32Å; G124-K128 WeakPolarHBondContact O-CG 3.31Å; G124-K128 PolarHBondContact O-N 2.83Å
125S65.3Low70.9Confident75 Ų7554.9 Ų54.952%0.52430%0.298SS..Hα-helixtrans-62.3-44.7175.654.70000111.5S129S125-S129 VanDerWaalsContact O-CB 3.27Å; S125-S129 WeakPolarHBondContact O-CB 3.47Å; S125-S129 PolarHBondContact O-N 3.34Å; S125-S129 PolarHBondContact O-OG 3.46Å
126T65.5Low68.1Low37 Ų3757.2 Ų57.223%0.22732%0.315CS..Hα-helixtrans-72.1-53.2-178.1-49.20000112.2K128 S129 L130T126-K128 PolarHBondContact O-N 3.15Å; T126-S129 PolarHBondContact O-N 2.83Å; T126-S129 PolarHBondContact O-OG 3.09Å; T126-L130 PolarHBondContact O-N 3.21Å
127L66.9Low65.1Low4 Ų456.6 Ų56.62%0.02133%0.33CS..Hα-helixtrans-66.3-39.2-178.2-72.5174.3000113.2V121 L122 S129 L130 L166 A207 V208 L211 L246V121-L127 HydrophobicContact CG1-CD1 3.87Å; V121-L127 HydrophobicContact CG1-CD2 3.87Å; V121-L127 HydrophobicContact CG1-CG 3.58Å; L122-L127 HydrophobicContact CD2-CD1 4.27Å; L127-S129 VanDerWaalsContact C-N 3.31Å; L127-S129 PolarHBondContact O-N 3.21Å; L127-L130 WeakPolarHBondContact O-CB 3.46Å; L127-L130 PolarHBondContact O-N 3.16Å; L127-L166 HydrophobicContact CD2-CD2 3.83Å; L127-A207 HydrophobicContact CD1-CB 3.86Å; L127-V208 HydrophobicContact CD2-CG1 4.18Å; L127-L211 HydrophobicContact CB-CD1 3.63Å; L127-L211 HydrophobicContact CD1-CD1 4.12Å; L127-L211 HydrophobicContact CG-CD1 4.4Å; L127-L246 HydrophobicContact CD2-CD2 4.17Å
128K64Low62.2Low49 Ų4963.6 Ų63.621%0.21337%0.367CS..Hα-helixtrans-66.3-36.1176.4-66.2171.9-165.6163.70111.8G124 T126 L130 M131 L211 L230G124-K128 WeakPolarHBondContact O-CB 3.48Å; G124-K128 VanDerWaalsContact O-CD 3.25Å; G124-K128 WeakPolarHBondContact O-CD 3.32Å; G124-K128 WeakPolarHBondContact O-CG 3.31Å; G124-K128 PolarHBondContact O-N 2.83Å; T126-K128 PolarHBondContact O-N 3.15Å; K128-L130 PolarHBondContact O-N 3.14Å; K128-M131 PolarHBondContact O-N 2.95Å; K128-L211 HydrophobicContact CG-CD2 4.5Å; K128-L230 PolarHBondContact NZ-O 3.15Å
129S62.6Low59.4Low19 Ų1968.1 Ų68.113%0.13340%0.399CS..Hα-helixtrans-60.9-29.8176.274.90000113.1S125 T126 L127S125-S129 VanDerWaalsContact O-CB 3.27Å; S125-S129 WeakPolarHBondContact O-CB 3.47Å; S125-S129 PolarHBondContact O-N 3.34Å; S125-S129 PolarHBondContact O-OG 3.46Å; T126-S129 PolarHBondContact O-N 2.83Å; T126-S129 PolarHBondContact O-OG 3.09Å; L127-S129 VanDerWaalsContact C-N 3.31Å; L127-S129 PolarHBondContact O-N 3.21Å
130L62.9Low56.6Low1 Ų170.3 Ų70.31%0.00541%0.413CS..Hα-helixtrans-74.2-27.7178.4-86.3153.8000114.6T126 L127 K128 T163 L166 L238 W243 L246T126-L130 PolarHBondContact O-N 3.21Å; L127-L130 WeakPolarHBondContact O-CB 3.46Å; L127-L130 PolarHBondContact O-N 3.16Å; K128-L130 PolarHBondContact O-N 3.14Å; L130-T163 HydrophobicContact CD2-CG2 3.55Å; L130-T163 HydrophobicContact CG-CG2 4.22Å; L130-L166 HydrophobicContact CD1-CD2 3.22Å; L130-L238 HydrophobicContact CD2-CB 4.46Å; L130-L238 HydrophobicContact CD2-CD1 3.8Å; L130-L238 HydrophobicContact CG-CD1 3.91Å; L130-W243 HydrophobicContact CB-CE3 4.19Å; L130-L246 HydrophobicContact CD1-CD2 4.13Å
131M58.8Low54.1Low16 Ų1670.1 Ų70.18%0.07943%0.425CS..Hα-helixtrans-88.4-27.5-174.7-70.2-175.886.600114.6K128 S133 L211 F215 W243K128-M131 PolarHBondContact O-N 2.95Å; M131-S133 PolarHBondContact O-N 2.85Å; M131-S133 VanDerWaalsContact O-N 3.11Å; M131-L211 HydrophobicContact CE-CB 3.89Å; M131-L211 WeakPolarHBondContact CE-O 3.43Å; M131-L211 HydrophobicContact SD-CB 3.4Å; M131-L211 WeakPolarHBondContact SD-CB 3.31Å; M131-L211 HydrophobicContact SD-CD1 4.03Å; M131-L211 HydrophobicContact SD-CD2 3.49Å; M131-L211 WeakPolarHBondContact SD-CD2 3.46Å; M131-L211 HydrophobicContact SD-CG 3.79Å; M131-F215 HydrophobicContact CE-CB 3.24Å; M131-F215 HydrophobicContact CE-CD2 4.35Å; M131-F215 HydrophobicContact CE-CG 3.87Å; M131-W243 HydrophobicContact CE-CH2 4.2Å; M131-W243 HydrophobicContact CE-CZ2 3.69Å; M131-W243 HydrophobicContact CG-CD2 3.85Å; M131-W243 HydrophobicContact CG-CE3 3.68Å; M131-W243 HydrophobicContact CG-CH2 3.61Å; M131-W243 HydrophobicContact CG-CZ2 3.78Å; M131-W243 HydrophobicContact CG-CZ3 3.56Å; M131-W243 HydrophobicContact SD-CH2 3.93Å; M131-W243 HydrophobicContact SD-CZ2 4.04Å; M131-W243 HydrophobicContact SD-CZ3 4.41Å
132L54.3Low51.7Low101 Ų10175.9 Ų75.953%0.52946%0.461SS..  trans-87.887.5-170.6-67.9172000110.7C235L132-C235 HydrophobicContact CD1-CB 4.31Å
133S44.2Very low49.1Very low33 Ų3379.2 Ų79.223%0.23148%0.484CS..  trans-144.9115.8155.8570000112.1M131 L238 E240M131-S133 PolarHBondContact O-N 2.85Å; M131-S133 VanDerWaalsContact O-N 3.11Å; S133-L238 WeakPolarHBondContact CB-O 3.31Å; S133-L238 PolarHBondContact OG-O 3.36Å; S133-E240 PolarHBondContact OG-N 3.14Å
134S41Very low46.8Very low91 Ų9181.3 Ų81.364%0.63650%0.498SS*.  trans-179.691.4133.567.10000108.5
135E38.5Very low45.1Very low173 Ų17385.8 Ų85.881%0.80853%0.528SS*.SBendtrans-158.6-23.4155.3-117.1170.5-158.500115.1
136N35.5Very low43.4Very low148 Ų14893.5 Ų93.579%0.79155%0.545SS*.THydrogen-bonded Turntrans-99.715.2-177.2-72.2-13.4000116
137G32Very low41.7Very low76 Ų76100.2 Ų100.278%0.78458%0.576SS**THydrogen-bonded Turntrans-90.5-4.1174.500000115.4S139G137-S139 PolarHBondContact O-N 3.29Å
138L32.9Very low39.8Very low157 Ų157106.8 Ų106.882%0.82261%0.611SS**  trans-86.1-0.4-172.2-82.1164.9000115.3D140L138-D140 PolarHBondContact O-N 2.92Å
139S34Very low38.4Very low95 Ų95111 Ų11166%0.66464%0.641SS**SBendtrans-96.472.2169.160.70000110.6G137G137-S139 PolarHBondContact O-N 3.29Å
140D30.8Very low37Very low143 Ų143119.1 Ų119.177%0.76568%0.677SS**  trans176.273.7139.4-85.3-16.3000109.4L138 T142L138-D140 PolarHBondContact O-N 2.92Å; D140-T142 PolarHBondContact O-N 3.41Å
141S35.5Very low35.7Very low116 Ų116123.4 Ų123.481%0.81171%0.707SS**  trans-71.359.1173.553.50000112.2
142T34.7Very low34.7Very low125 Ų125126.8 Ų126.877%0.76773%0.732SS**SBendtrans-143.534.2167.3500000114.6D140D140-T142 PolarHBondContact O-N 3.41Å
143T31.2Very low34.4Very low123 Ų123129 Ų12976%0.75574%0.744SS**  trans-152.967.3157.190000109.8C145T143-C145 PolarHBondContact O-N 3.19Å
144S30.1Very low34.3Very low120 Ų120132.1 Ų132.184%0.83976%0.762SS**  trans-69.476.5160.1-178.70000107.6R146S144-R146 VanDerWaalsContact C-N 3.32Å; S144-R146 PolarHBondContact O-N 3.43Å
145C27.5Very low34.5Very low100 Ų100132.5 Ų132.568%0.67675%0.754SS**  trans-60.1106.5156.2-830000105.3T143 M147T143-C145 PolarHBondContact O-N 3.19Å; C145-M147 PolarHBondContact O-N 2.92Å
146R28.4Very low34.5Very low236 Ų236129.5 Ų129.589%0.89175%0.749SS**  trans-44.293.9159-80.9174.3160.1175.5-6.8107.6S144 N148S144-R146 VanDerWaalsContact C-N 3.32Å; S144-R146 PolarHBondContact O-N 3.43Å; R146-N148 VanDerWaalsContact C-N 3.28Å; R146-N148 PolarHBondContact O-N 2.96Å
147M30.5Very low35Very low179 Ų179126.5 Ų126.588%0.88273%0.73SS**  trans-68.898.2166.2-80.9-173.8170.500105.3C145 V149C145-M147 PolarHBondContact O-N 2.92Å; M147-V149 PolarHBondContact O-N 3.45Å
148N25.7Very low35.7Very low142 Ų142124.1 Ų124.176%0.75970%0.701SS**  trans-54.9120.2166.2-113.43.6000107.5R146 E150R146-N148 VanDerWaalsContact C-N 3.28Å; R146-N148 PolarHBondContact O-N 2.96Å; N148-E150 PolarHBondContact O-N 2.87Å
149V35.8Very low35.9Very low137 Ų137124 Ų12483%0.8370%0.698SS**THydrogen-bonded Turntrans-55.1103.8161.6177.80000106.4M147M147-V149 PolarHBondContact O-N 3.45Å
150E32.9Very low36.4Very low189 Ų189123.5 Ų123.588%0.88369%0.688SS**THydrogen-bonded Turntrans161.46.1161.3-93170.3-166.200113.6N148 S152N148-E150 PolarHBondContact O-N 2.87Å; E150-S152 PolarHBondContact O-N 3.23Å; E150-S152 VanDerWaalsContact O-N 3.14Å
151S35.7Very low37.4Very low92 Ų92125.5 Ų125.564%0.64369%0.69SS**SBendtrans-82.393.1171.464.30000111.1
152S38.2Very low38.5Very low87 Ų87124 Ų12461%0.60868%0.678SS**  trans44.599.6159.1-173.90000115.5E150 V154E150-S152 PolarHBondContact O-N 3.23Å; E150-S152 VanDerWaalsContact O-N 3.14Å; S152-V154 PolarHBondContact O-N 2.95Å
153D46.8Very low40.1Very low146 Ų146118.1 Ų118.178%0.78164%0.642SS**SBendtrans-65-1.2-177.2-70.5-39.6000115.5
154V42.2Very low42.4Very low100 Ų100113.8 Ų113.861%0.60661%0.614SS**SBendtrans-103.994.5167.5-174.70000107.3S152S152-V154 PolarHBondContact O-N 2.95Å
155Q45.7Very low44.9Very low99 Ų99110.4 Ų110.446%0.46359%0.585SS.*PPolyproline II helixtrans-60.3136.2178.1-69.7-89.5-40.600109.7
156P37.6Very low47.8Very low110 Ų110105.7 Ų105.771%0.71455%0.553SS**PPolyproline II helixtrans-65141.2-179.824.3-31.1000111.3
157E46.7Very low50.7Low84 Ų8494.6 Ų94.639%0.39351%0.511SS..PPolyproline II helixtrans-56.2135.6177-72.3-178.3153.900111.2Q249E157-Q249 PolarHBondContact OE1-NE2 2.97Å
158P45.9Very low53.7Low26 Ų2686 Ų8617%0.16947%0.469CS..PPolyproline II helixtrans-63.9158.3177.328.3-35.6000111.7F167 S242P158-F167 HydrophobicContact CG-CE2 3.92Å; P158-S242 WeakPolarHBondContact CG-OG 3.38Å
159M39.1Very low57Low156 Ų15679.3 Ų79.377%0.76843%0.433SS*.  trans-102.218.7178.2-76-153-75.600113.3
160D43.8Very low59.8Low83 Ų8372.8 Ų72.844%0.44439%0.393SS..  trans-86.3119.4-177-73.4-41.5000111P162 T163 D164 L238D160-P162 VanDerWaalsContact C-N 3.33Å; D160-P162 WeakPolarHBondContact O-CD 3.28Å; D160-P162 VanDerWaalsContact O-N 3.07Å; D160-T163 PolarHBondContact O-N 3.37Å; D160-T163 PolarHBondContact O-OG1 3.45Å; D160-D164 PolarHBondContact O-N 3.01Å; D160-D164 VanDerWaalsContact O-N 3.09Å; D160-L238 HydrophobicContact CB-CD2 3.81Å; D160-L238 VanDerWaalsContact OD2-CD2 3.22Å; D160-L238 WeakPolarHBondContact OD2-CD2 3.35Å
161F50.6Low62.8Low185 Ų18565 Ų6581%0.81136%0.359SS*.Hα-helixtrans-47.7-38.5-173.9-69-84.4000116.2
162P59.9Low65.7Low86 Ų8660.6 Ų60.656%0.55833%0.328SS*.Hα-helixtrans-73.2-33.3178.1-14.129.3000113.2D160D160-P162 VanDerWaalsContact C-N 3.33Å; D160-P162 WeakPolarHBondContact O-CD 3.28Å; D160-P162 VanDerWaalsContact O-N 3.07Å
163T68.8Low68.5Low1 Ų156.5 Ų56.51%0.00630%0.299CS..Hα-helixtrans-77.4-35.5-178.853.90000112.2L130 D160 H165 L166 F167 L238L130-T163 HydrophobicContact CD2-CG2 3.55Å; L130-T163 HydrophobicContact CG-CG2 4.22Å; D160-T163 PolarHBondContact O-N 3.37Å; D160-T163 PolarHBondContact O-OG1 3.45Å; T163-H165 PolarHBondContact O-N 2.98Å; T163-H165 VanDerWaalsContact O-N 3.15Å; T163-L166 WeakPolarHBondContact O-CB 3.49Å; T163-L166 PolarHBondContact O-N 3.4Å; T163-F167 VanDerWaalsContact O-CD2 3.23Å; T163-F167 WeakPolarHBondContact O-CD2 3.39Å; T163-F167 PolarHBondContact O-N 3.35Å; T163-F167 VanDerWaalsContact O-N 3.09Å; T163-L238 HydrophobicContact CG2-CD1 3.07Å; T163-L238 HydrophobicContact CG2-CD2 3.62Å; T163-L238 HydrophobicContact CG2-CG 3.89Å
164D77.6Confident70.8Confident32 Ų3252.4 Ų52.417%0.17127%0.273CS..Hα-helixtrans-55.7-35.1179.5-72.58.9000111.3N80 D160 G168N80-D164 WeakPolarHBondContact CA-O 3.46Å; N80-D164 HydrophobicContact CB-CB 3.86Å; D160-D164 PolarHBondContact O-N 3.01Å; D160-D164 VanDerWaalsContact O-N 3.09Å; D164-G168 PolarHBondContact O-N 3.5Å
165H84Confident73.3Confident48 Ų4851.1 Ų51.122%0.22226%0.258CS..Hα-helixtrans-64.6-43.6176.7-175.358.5000112.6T78 M117 T163 G168 L169T78-H165 VanDerWaalsContact O-CA 3.29Å; T78-H165 WeakPolarHBondContact O-CA 3.37Å; T78-H165 PolarHBondContact O-ND1 3.38Å; T78-H165 PolarHBondContact OG1-CE1 3.36Å; M117-H165 PolarHBondContact SD-CE1 3.35Å; T163-H165 PolarHBondContact O-N 2.98Å; T163-H165 VanDerWaalsContact O-N 3.15Å; H165-G168 PolarHBondContact O-N 3.35Å; H165-L169 WeakPolarHBondContact O-CB 3.3Å; H165-L169 PolarHBondContact O-N 2.87Å
166L88.4Confident75.7Confident2 Ų246.4 Ų46.41%0.0124%0.235CC..Hα-helixtrans-63.9-48.5177.9177.659.9000111.1V121 L127 L130 T163 G168 L169 V170 L246V121-L166 HydrophobicContact CB-CD1 4.44Å; V121-L166 HydrophobicContact CG1-CD1 3.57Å; V121-L166 HydrophobicContact CG2-CD1 3.99Å; L127-L166 HydrophobicContact CD2-CD2 3.83Å; L130-L166 HydrophobicContact CD1-CD2 3.22Å; T163-L166 WeakPolarHBondContact O-CB 3.49Å; T163-L166 PolarHBondContact O-N 3.4Å; L166-G168 VanDerWaalsContact C-N 3.29Å; L166-G168 PolarHBondContact O-N 3.47Å; L166-L169 WeakPolarHBondContact O-CB 3.14Å; L166-L169 PolarHBondContact O-N 3.3Å; L166-V170 HydrophobicContact CD1-CG2 4.35Å; L166-V170 WeakPolarHBondContact O-CG2 3.41Å; L166-V170 PolarHBondContact O-N 3.47Å; L166-L246 HydrophobicContact CD2-CD1 3.68Å; L166-L246 HydrophobicContact CD2-CD2 3.47Å; L166-L246 VanDerWaalsContact CD2-CD2 3.47Å; L166-L246 HydrophobicContact CD2-CG 4.21Å; L166-L246 HydrophobicContact CG-CD1 3.87Å
167F89.9Confident78.4Confident2 Ų241.5 Ų41.51%0.00920%0.203CC..Hα-helixtrans-61.3-41.6176.2-71.8-76.3000111.2V81 P158 T163 L169 V170 V171 L246V81-F167 HydrophobicContact CG2-CB 3.35Å; P158-F167 HydrophobicContact CG-CE2 3.92Å; T163-F167 VanDerWaalsContact O-CD2 3.23Å; T163-F167 WeakPolarHBondContact O-CD2 3.39Å; T163-F167 PolarHBondContact O-N 3.35Å; T163-F167 VanDerWaalsContact O-N 3.09Å; F167-L169 VanDerWaalsContact C-N 3.33Å; F167-L169 PolarHBondContact O-N 3.19Å; F167-V170 PolarHBondContact O-N 3.48Å; F167-V171 VanDerWaalsContact O-CG2 3.31Å; F167-V171 WeakPolarHBondContact O-CG2 3.43Å; F167-V171 PolarHBondContact O-N 3.08Å; F167-L246 HydrophobicContact CE1-CB 4.03Å; F167-L246 HydrophobicContact CE1-CD1 4.34Å; F167-L246 HydrophobicContact CZ-CB 3.98Å
168G91.9Very high80.5Confident0 Ų038.9 Ų38.90%019%0.193CC..Hα-helixtrans-57.2-43.7173.600000112.7V84 D164 H165 L166 F172V84-G168 WeakPolarHBondContact CG2-O 3.43Å; D164-G168 PolarHBondContact O-N 3.5Å; H165-G168 PolarHBondContact O-N 3.35Å; L166-G168 VanDerWaalsContact C-N 3.29Å; L166-G168 PolarHBondContact O-N 3.47Å; G168-F172 VanDerWaalsContact O-CB 3.24Å; G168-F172 WeakPolarHBondContact O-CB 3.49Å; G168-F172 PolarHBondContact O-N 3.35Å
169L94.9Very high82.6Confident0 Ų040.4 Ų40.40%020%0.2CC..Hα-helixtrans-63.8-47.7175.4178.163.7000112.2T78 V114 M117 V121 H165 L166 F167 V171 F172 L173 L204T78-L169 HydrophobicContact CG2-CB 4.4Å; T78-L169 HydrophobicContact CG2-CD1 4.14Å; V114-L169 HydrophobicContact CG1-CD1 4.11Å; M117-L169 HydrophobicContact CB-CD1 4.26Å; M117-L169 HydrophobicContact CB-CD2 4.19Å; M117-L169 HydrophobicContact CE-CD1 4.27Å; V121-L169 HydrophobicContact CG2-CD2 4.07Å; H165-L169 WeakPolarHBondContact O-CB 3.3Å; H165-L169 PolarHBondContact O-N 2.87Å; L166-L169 WeakPolarHBondContact O-CB 3.14Å; L166-L169 PolarHBondContact O-N 3.3Å; F167-L169 VanDerWaalsContact C-N 3.33Å; F167-L169 PolarHBondContact O-N 3.19Å; L169-V171 PolarHBondContact O-N 3.01Å; L169-F172 PolarHBondContact O-N 3.25Å; L169-L173 HydrophobicContact CD1-CD1 4.22Å; L169-L173 HydrophobicContact CD1-CG 4.28Å; L169-L173 HydrophobicContact CG-CD1 4.11Å; L169-L173 WeakPolarHBondContact O-CB 3.42Å; L169-L173 WeakPolarHBondContact O-CG 3.42Å; L169-L173 PolarHBondContact O-N 3.13Å; L169-L204 HydrophobicContact CD2-CD1 4.35Å
170V95Very high85Confident0 Ų033 Ų330%016%0.164CC..Hα-helixtrans-58.1-48.2178.4172.90000110.7L166 F167 L173 R174 F201 L204 L246 Q249 L250L166-V170 HydrophobicContact CD1-CG2 4.35Å; L166-V170 WeakPolarHBondContact O-CG2 3.41Å; L166-V170 PolarHBondContact O-N 3.47Å; F167-V170 PolarHBondContact O-N 3.48Å; V170-L173 PolarHBondContact O-N 3.48Å; V170-R174 WeakPolarHBondContact O-CG 3.27Å; V170-R174 PolarHBondContact O-N 3.23Å; V170-R174 VanDerWaalsContact O-N 3.08Å; V170-F201 HydrophobicContact CG1-CE2 3.92Å; V170-L204 HydrophobicContact CG2-CD1 4.25Å; V170-L246 HydrophobicContact CG2-CD1 4.15Å; V170-Q249 HydrophobicContact CG1-CB 4.37Å; V170-L250 HydrophobicContact CB-CD2 4.49Å; V170-L250 HydrophobicContact CG1-CD2 3.89Å; V170-L250 HydrophobicContact CG1-CG 4.31Å; V170-L250 HydrophobicContact CG2-CD2 3.72Å; V170-L250 HydrophobicContact CG2-CG 4.2Å
171V95.2Very high87.1Confident25 Ų2532.3 Ų32.315%0.15216%0.16CC..Hα-helixtrans-66.3-39.7179.3179.80000110.6V81 V84 F167 L169 R174 Y175V81-V171 HydrophobicContact CG1-CG2 4.21Å; V81-V171 HydrophobicContact CG2-CG2 4.49Å; V84-V171 HydrophobicContact CB-CG1 4.15Å; V84-V171 HydrophobicContact CG1-CB 4.28Å; V84-V171 HydrophobicContact CG1-CG1 3.8Å; V84-V171 HydrophobicContact CG2-CB 4.31Å; V84-V171 HydrophobicContact CG2-CG1 4.41Å; F167-V171 VanDerWaalsContact O-CG2 3.31Å; F167-V171 WeakPolarHBondContact O-CG2 3.43Å; F167-V171 PolarHBondContact O-N 3.08Å; L169-V171 PolarHBondContact O-N 3.01Å; V171-R174 WeakPolarHBondContact O-CB 3.42Å; V171-R174 PolarHBondContact O-N 3.31Å; V171-Y175 HydrophobicContact CG1-CD2 3.94Å; V171-Y175 HydrophobicContact CG1-CE2 3.82Å; V171-Y175 VanDerWaalsContact O-CD2 3.32Å; V171-Y175 WeakPolarHBondContact O-CD2 3.46Å; V171-Y175 PolarHBondContact O-N 3.24Å
172F96.7Very high88.7Confident1 Ų124.5 Ų24.50%0.00413%0.128CC..Hα-helixtrans-66.5-41.9178.8-172.5-131.3000112.4A74 T77 T78 V84 F88 V110 V114 G168 L169 R174 Y175 L176A74-F172 HydrophobicContact CB-CE1 4.18Å; T77-F172 HydrophobicContact CG2-CD2 3.65Å; T77-F172 HydrophobicContact CG2-CE2 3.76Å; T77-F172 HydrophobicContact CG2-CG 4.09Å; T77-F172 HydrophobicContact CG2-CZ 4.27Å; T78-F172 HydrophobicContact CG2-CB 3.89Å; T78-F172 HydrophobicContact CG2-CD1 3.55Å; T78-F172 HydrophobicContact CG2-CE1 4.42Å; T78-F172 HydrophobicContact CG2-CG 4.04Å; V84-F172 HydrophobicContact CG1-CB 3.86Å; V84-F172 HydrophobicContact CG1-CD2 4.07Å; V84-F172 HydrophobicContact CG1-CG 4.44Å; V84-F172 HydrophobicContact CG2-CB 4.48Å; F88-F172 HydrophobicContact CB-CD2 4.35Å; F88-F172 HydrophobicContact CB-CE2 4.1Å; F88-F172 HydrophobicContact CD2-CD2 4.45Å; F88-F172 AromaticContact CD2-CE2 3.97Å; F88-F172 HydrophobicContact CD2-CE2 3.97Å; V110-F172 HydrophobicContact CG1-CE1 3.95Å; V110-F172 HydrophobicContact CG1-CZ 3.86Å; V114-F172 HydrophobicContact CG2-CD1 3.77Å; V114-F172 HydrophobicContact CG2-CE1 3.59Å; G168-F172 VanDerWaalsContact O-CB 3.24Å; G168-F172 WeakPolarHBondContact O-CB 3.49Å; G168-F172 PolarHBondContact O-N 3.35Å; L169-F172 PolarHBondContact O-N 3.25Å; F172-R174 VanDerWaalsContact C-N 3.31Å; F172-R174 PolarHBondContact O-N 2.95Å; F172-Y175 WeakPolarHBondContact O-CB 3.22Å; F172-Y175 PolarHBondContact O-N 3.48Å; F172-Y175 VanDerWaalsContact O-N 3.16Å; F172-L176 HydrophobicContact CD1-CD1 4.05Å; F172-L176 HydrophobicContact CE1-CD1 3.88Å; F172-L176 HydrophobicContact CE1-CG 4.41Å; F172-L176 HydrophobicContact CE2-CD2 4.3Å; F172-L176 HydrophobicContact CE2-CG 4.34Å; F172-L176 HydrophobicContact CZ-CD1 4.21Å; F172-L176 HydrophobicContact CZ-CD2 4.12Å; F172-L176 HydrophobicContact CZ-CG 4.28Å; F172-L176 WeakPolarHBondContact O-CG 3.32Å; F172-L176 PolarHBondContact O-N 3.07Å
173L97.6Very high89.2Confident0 Ų023.4 Ų23.40%012%0.123CC..Hα-helixtrans-57.2-43.8172-80.1167.3000111.5V114 L169 V170 Y175 L176 I177 P197 D200 F201 L204V114-L173 HydrophobicContact CG1-CD2 3.41Å; V114-L173 VanDerWaalsContact CG1-CD2 3.41Å; V114-L173 HydrophobicContact CG1-CG 4.04Å; L169-L173 HydrophobicContact CD1-CD1 4.22Å; L169-L173 HydrophobicContact CD1-CG 4.28Å; L169-L173 HydrophobicContact CG-CD1 4.11Å; L169-L173 WeakPolarHBondContact O-CB 3.42Å; L169-L173 WeakPolarHBondContact O-CG 3.42Å; L169-L173 PolarHBondContact O-N 3.13Å; V170-L173 PolarHBondContact O-N 3.48Å; L173-Y175 PolarHBondContact O-N 3.36Å; L173-L176 PolarHBondContact O-N 3.39Å; L173-I177 WeakPolarHBondContact O-CD1 2.85Å; L173-I177 VanDerWaalsContact O-CG1 3.27Å; L173-I177 WeakPolarHBondContact O-CG1 3.33Å; L173-I177 PolarHBondContact O-N 2.96Å; L173-P197 HydrophobicContact CD2-CB 3.93Å; L173-D200 HydrophobicContact CD1-CB 4.33Å; L173-D200 HydrophobicContact CD2-CB 3.81Å; L173-F201 HydrophobicContact CB-CD2 3.8Å; L173-F201 HydrophobicContact CD1-CB 4.43Å; L173-F201 HydrophobicContact CD1-CD2 4.29Å; L173-L204 HydrophobicContact CD1-CD1 3.63Å
174R95.5Very high89.1Confident61 Ų6129.6 Ų29.623%0.2316%0.156CC..Hα-helixtrans-56-50.6173.9-71.1173.967.3164.37.9111V170 V171 F172 L176 I177 T178 F201 D252 H256V170-R174 WeakPolarHBondContact O-CG 3.27Å; V170-R174 PolarHBondContact O-N 3.23Å; V170-R174 VanDerWaalsContact O-N 3.08Å; V171-R174 WeakPolarHBondContact O-CB 3.42Å; V171-R174 PolarHBondContact O-N 3.31Å; F172-R174 VanDerWaalsContact C-N 3.31Å; F172-R174 PolarHBondContact O-N 2.95Å; R174-L176 VanDerWaalsContact C-N 3.31Å; R174-L176 PolarHBondContact O-N 2.87Å; R174-I177 PolarHBondContact O-N 3.49Å; R174-I177 VanDerWaalsContact O-N 3.14Å; R174-T178 PolarHBondContact O-N 3.23Å; R174-T178 PolarHBondContact O-OG1 2.87Å; R174-F201 HydrophobicContact CG-CD2 4.49Å; R174-F201 HydrophobicContact CG-CE2 3.72Å; R174-F201 HydrophobicContact CG-CZ 4.22Å; R174-D252 IonicContact CZ-OD2 3.25Å; R174-D252 IonicContact NH1-OD2 3.58Å; R174-D252 PolarHBondContact NH1-OD2 3.49Å; R174-D252 IonicContact NH2-OD2 3.13Å; R174-D252 PolarHBondContact NH2-OD2 3.48Å; R174-H256 PolarHBondContact NH2-ND1 3.1Å
175Y94Very high88.2Confident72 Ų7235.6 Ų35.628%0.28219%0.188SC..Hα-helixtrans-59-39.9177.2-87.9-78.8000113.2V84 F88 V171 F172 L173 I177 N179 L180V84-Y175 HydrophobicContact CG1-CD2 3.7Å; V84-Y175 HydrophobicContact CG1-CE2 4.1Å; F88-Y175 AromaticContact CD1-CD1 3.6Å; F88-Y175 HydrophobicContact CD1-CD1 3.6Å; F88-Y175 HydrophobicContact CD1-CE1 4.3Å; F88-Y175 HydrophobicContact CD1-CG 4.17Å; F88-Y175 HydrophobicContact CD2-CG 4.47Å; F88-Y175 AromaticContact CE1-CD1 3.83Å; F88-Y175 HydrophobicContact CE1-CD1 3.83Å; F88-Y175 HydrophobicContact CG-CD1 4.02Å; F88-Y175 HydrophobicContact CG-CG 4.12Å; F88-Y175 HydrophobicContact CZ-CD1 4.43Å; V171-Y175 HydrophobicContact CG1-CD2 3.94Å; V171-Y175 HydrophobicContact CG1-CE2 3.82Å; V171-Y175 VanDerWaalsContact O-CD2 3.32Å; V171-Y175 WeakPolarHBondContact O-CD2 3.46Å; V171-Y175 PolarHBondContact O-N 3.24Å; F172-Y175 WeakPolarHBondContact O-CB 3.22Å; F172-Y175 PolarHBondContact O-N 3.48Å; F172-Y175 VanDerWaalsContact O-N 3.16Å; L173-Y175 PolarHBondContact O-N 3.36Å; Y175-I177 VanDerWaalsContact C-N 3.33Å; Y175-N179 HydrophobicContact CD1-CB 4.31Å; Y175-N179 WeakPolarHBondContact O-CA 3.49Å; Y175-N179 WeakPolarHBondContact O-CB 3.34Å; Y175-N179 PolarHBondContact O-N 2.91Å; Y175-L180 PolarHBondContact O-N 3.23Å
176L95.7Very high86.6Confident0 Ų035.6 Ų35.60%019%0.192CC..Hα-helixtrans-64.2-38.7176.6-68.7172.6000111.9F88 F91 V110 L111 V114 F172 L173 R174 L180 P197F88-L176 HydrophobicContact CD2-CD2 4.47Å; F88-L176 HydrophobicContact CE2-CD2 4.28Å; F91-L176 HydrophobicContact CD1-CD2 4.24Å; F91-L176 HydrophobicContact CE1-CD2 3.82Å; V110-L176 HydrophobicContact CG1-CD2 4.33Å; L111-L176 HydrophobicContact CD2-CD1 4.45Å; V114-L176 HydrophobicContact CG1-CD1 4.42Å; V114-L176 HydrophobicContact CG2-CD1 4.02Å; F172-L176 HydrophobicContact CD1-CD1 4.05Å; F172-L176 HydrophobicContact CE1-CD1 3.88Å; F172-L176 HydrophobicContact CE1-CG 4.41Å; F172-L176 HydrophobicContact CE2-CD2 4.3Å; F172-L176 HydrophobicContact CE2-CG 4.34Å; F172-L176 HydrophobicContact CZ-CD1 4.21Å; F172-L176 HydrophobicContact CZ-CD2 4.12Å; F172-L176 HydrophobicContact CZ-CG 4.28Å; F172-L176 WeakPolarHBondContact O-CG 3.32Å; F172-L176 PolarHBondContact O-N 3.07Å; L173-L176 PolarHBondContact O-N 3.39Å; R174-L176 VanDerWaalsContact C-N 3.31Å; R174-L176 PolarHBondContact O-N 2.87Å; L176-L180 HydrophobicContact CD2-CD1 4.4Å; L176-L180 HydrophobicContact CD2-CD2 4.21Å; L176-L180 WeakPolarHBondContact O-CB 3.44Å; L176-P197 HydrophobicContact CB-CB 4.03Å; L176-P197 HydrophobicContact CB-CG 4.08Å; L176-P197 HydrophobicContact CD1-CG 4.23Å
177I94.6Very high85Confident7 Ų745.2 Ų45.24%0.03624%0.237CC..Hα-helixtrans-71.5-48.3177.4-65.9159.7000110.6L173 R174 Y175 P193 P197 F201 Y260 F261L173-I177 WeakPolarHBondContact O-CD1 2.85Å; L173-I177 VanDerWaalsContact O-CG1 3.27Å; L173-I177 WeakPolarHBondContact O-CG1 3.33Å; L173-I177 PolarHBondContact O-N 2.96Å; R174-I177 PolarHBondContact O-N 3.49Å; R174-I177 VanDerWaalsContact O-N 3.14Å; Y175-I177 VanDerWaalsContact C-N 3.33Å; I177-P193 HydrophobicContact CG2-CB 4.26Å; I177-P193 WeakPolarHBondContact O-CB 3.28Å; I177-P197 HydrophobicContact CG1-CB 4.03Å; I177-F201 HydrophobicContact CD1-CB 3.74Å; I177-F201 HydrophobicContact CD1-CD2 4.31Å; I177-F201 HydrophobicContact CD1-CG 3.99Å; I177-Y260 HydrophobicContact CG2-CG 3.99Å; I177-Y260 VanDerWaalsContact O-CD1 3.3Å; I177-Y260 WeakPolarHBondContact O-CD1 3.29Å; I177-F261 HydrophobicContact CD1-CE1 3.96Å; I177-F261 HydrophobicContact CD1-CZ 4.42Å; I177-F261 HydrophobicContact CG2-CE1 4.17Å
178T90.6Very high83.3Confident29 Ų2949.7 Ų49.718%0.17827%0.269CS..Hα-helixtrans-90.1-29.7-166.458.30000114R174 Y260R174-T178 PolarHBondContact O-N 3.23Å; R174-T178 PolarHBondContact O-OG1 2.87Å; T178-Y260 HydrophobicContact CG2-CD2 3.89Å; T178-Y260 HydrophobicContact CG2-CE2 3.6Å; T178-Y260 HydrophobicContact CG2-CG 4.49Å; T178-Y260 WeakPolarHBondContact O-CE1 3.4Å; T178-Y260 PolarHBondContact O-OH 3.19Å
179N90.6Very high82Confident59 Ų5957.4 Ų57.432%0.31630%0.299SS..Hα-helixtrans-126.8-9.4-165.3-67.561.3000114.6F88 K92 Y175 N181 S182F88-N179 HydrophobicContact CE1-CB 3.69Å; F88-N179 HydrophobicContact CZ-CB 3.6Å; K92-N179 PolarHBondContact NZ-O 3.47Å; Y175-N179 HydrophobicContact CD1-CB 4.31Å; Y175-N179 WeakPolarHBondContact O-CA 3.49Å; Y175-N179 WeakPolarHBondContact O-CB 3.34Å; Y175-N179 PolarHBondContact O-N 2.91Å; N179-N181 VanDerWaalsContact C-N 3.34Å; N179-N181 PolarHBondContact O-N 3.1Å; N179-S182 WeakPolarHBondContact CA-OG 3.43Å; N179-S182 PolarHBondContact O-N 2.99Å; N179-S182 PolarHBondContact O-OG 3.49Å
180L90.7Very high80.6Confident1 Ų159.9 Ų59.91%0.00531%0.314CS..SBendtrans-62.3-45.4-174.3-17958.7000111.8F88 F91 R95 Y175 L176 P194F88-L180 HydrophobicContact CE2-CB 4.45Å; F88-L180 HydrophobicContact CE2-CD1 4.33Å; F91-L180 HydrophobicContact CD1-CD1 4.02Å; F91-L180 HydrophobicContact CE1-CD1 3.28Å; F91-L180 HydrophobicContact CE1-CD2 4.45Å; F91-L180 HydrophobicContact CE1-CG 4.49Å; F91-L180 HydrophobicContact CZ-CD1 3.9Å; R95-L180 VanDerWaalsContact NH1-CG 3.3Å; R95-L180 PolarHBondContact NH2-O 2.94Å; Y175-L180 PolarHBondContact O-N 3.23Å; L176-L180 HydrophobicContact CD2-CD1 4.4Å; L176-L180 HydrophobicContact CD2-CD2 4.21Å; L176-L180 WeakPolarHBondContact O-CB 3.44Å; L180-P194 HydrophobicContact CD2-CG 3.81Å
181N87.9Confident79.8Confident67 Ų6761.5 Ų61.536%0.35833%0.325SS..SBendtrans-99.81.9-177.8-66-21.4000112.7R95 N179 C191 I192R95-N181 PolarHBondContact NH1-OD1 3.15Å; N179-N181 VanDerWaalsContact C-N 3.34Å; N179-N181 PolarHBondContact O-N 3.1Å; N181-C191 HydrophobicContact CB-CB 3.9Å; N181-C191 PolarHBondContact O-SG 3.42Å; N181-I192 PolarHBondContact ND2-O 3.06Å
182S83.1Confident79.5Confident22 Ų2264.7 Ų64.715%0.15434%0.34CS..  trans-70.3131.6172.276.40000109.8K92 N179K92-S182 PolarHBondContact NZ-O 3.29Å; N179-S182 WeakPolarHBondContact CA-OG 3.43Å; N179-S182 PolarHBondContact O-N 2.99Å; N179-S182 PolarHBondContact O-OG 3.49Å
183S70.2Confident79.2Confident63 Ų6365 Ų6544%0.44134%0.342SS..  trans-69.4149.2167.2640000109.1D185 C186S183-D185 PolarHBondContact O-N 3.37Å; S183-C186 PolarHBondContact O-N 3.36Å; S183-C186 WeakPolarHBondContact OG-CB 3.19Å; S183-C186 PolarHBondContact OG-N 2.65Å
184D67.9Low78.9Confident131 Ų13165.8 Ų65.870%0.70135%0.347SS*.THydrogen-bonded Turntrans-69.3-17.9179.2-60.5-29.4000111.8K92K92-D184 IonicContact NZ-OD1 2.72Å; K92-D184 PolarHBondContact NZ-OD1 2.86Å
185D57.2Low78.7Confident158 Ų15864.5 Ų64.585%0.84535%0.345SS*.THydrogen-bonded Turntrans-94.6-5.4-178-66.6-32.9000114.5S183S183-D185 PolarHBondContact O-N 3.37Å
186C52Low78.7Confident47 Ų4764.8 Ų64.832%0.31835%0.348SS..  trans-134.894-179.8-84.90000111.9S183 S188 Y189S183-C186 PolarHBondContact O-N 3.36Å; S183-C186 WeakPolarHBondContact OG-CB 3.19Å; S183-C186 PolarHBondContact OG-N 2.65Å; C186-S188 PolarHBondContact O-N 3.4Å; C186-Y189 HydrophobicContact CB-CD2 4.01Å
187E53.8Low78.7Confident205 Ų20564.8 Ų64.896%0.95835%0.348SS*.THydrogen-bonded Turntrans-68.8-14.7168.7-63.6-167.2161.300112.8
188S53.7Low78.8Confident95 Ų9564.4 Ų64.466%0.66435%0.347SS*.THydrogen-bonded Turntrans-93.3-4.6-166.562.80000116.4C186C186-S188 PolarHBondContact O-N 3.4Å
189Y64.7Low79Confident162 Ų16263.9 Ų63.964%0.63534%0.343SS*.  trans-113.3124.5-177.6-67.3-73.6000111.8C186 C191C186-Y189 HydrophobicContact CB-CD2 4.01Å; Y189-C191 PolarHBondContact O-N 3.43Å; Y189-C191 VanDerWaalsContact O-N 3.08Å
190V65Low79.3Confident53 Ų5361.4 Ų61.432%0.32133%0.329SS..  trans-68.3104.7168.5-1790000108.1M259 Y260 S263V190-M259 HydrophobicContact CG1-CB 4.47Å; V190-M259 HydrophobicContact CG2-CB 4.46Å; V190-M259 HydrophobicContact CG2-CE 3.91Å; V190-Y260 HydrophobicContact CG1-CD1 3.68Å; V190-Y260 HydrophobicContact CG1-CD2 4.43Å; V190-Y260 HydrophobicContact CG1-CE1 3.84Å; V190-Y260 HydrophobicContact CG1-CG 4.02Å; V190-S263 VanDerWaalsContact CG1-OG 3.24Å; V190-S263 WeakPolarHBondContact CG1-OG 3.1Å
191C80.1Confident79.6Confident33 Ų3361.4 Ų61.422%0.22333%0.329CS..PPolyproline II helixtrans-76.8154.9174.7-62.50000111N181 Y189 P193N181-C191 HydrophobicContact CB-CB 3.9Å; N181-C191 PolarHBondContact O-SG 3.42Å; Y189-C191 PolarHBondContact O-N 3.43Å; Y189-C191 VanDerWaalsContact O-N 3.08Å; C191-P193 VanDerWaalsContact O-CD 3.28Å; C191-P193 WeakPolarHBondContact O-CD 3.48Å
192I87.2Confident80Confident93 Ų9358.2 Ų58.248%0.47731%0.312SS..PPolyproline II helixtrans-69.2116.1174.7-63.1165.9000107.6N181N181-I192 PolarHBondContact ND2-O 3.06Å
193P91.2Very high80.6Confident6 Ų658.8 Ų58.84%0.03931%0.313CS..PPolyproline II helixtrans-75.2158.4176.934.9-38.6000110.9I177 C191 C198 Y260 A264I177-P193 HydrophobicContact CG2-CB 4.26Å; I177-P193 WeakPolarHBondContact O-CB 3.28Å; C191-P193 VanDerWaalsContact O-CD 3.28Å; C191-P193 WeakPolarHBondContact O-CD 3.48Å; P193-C198 VanDerWaalsContact CG-SG 3.57Å; P193-Y260 WeakPolarHBondContact CD-O 3.38Å; P193-Y260 WeakPolarHBondContact CG-O 3.45Å; P193-A264 HydrophobicContact CG-CB 3.67Å
194P91Very high81.8Confident17 Ų1755.9 Ų55.911%0.1129%0.293CS..PPolyproline II helixtrans-59.7140.6162.529.7-37.4000110.4L111 L180 P197 C198L111-P194 HydrophobicContact CD1-CB 4.34Å; L180-P194 HydrophobicContact CD2-CG 3.81Å; P194-P197 HydrophobicContact CB-CG 4.27Å; P194-P197 HydrophobicContact CG-CB 4.45Å; P194-P197 HydrophobicContact CG-CG 3.68Å; P194-C198 PolarHBondContact O-SG 2.82Å
195I91.1Very high83.1Confident34 Ų3449.7 Ų49.717%0.17426%0.26CS..Hα-helixtrans-70.6-38-174.4-67.4177.6000111C198 I199 A300 L303I195-C198 VanDerWaalsContact O-CB 3.3Å; I195-C198 WeakPolarHBondContact O-CB 3.44Å; I195-C198 PolarHBondContact O-N 3.43Å; I195-C198 VanDerWaalsContact O-N 3.1Å; I195-I199 HydrophobicContact CG2-CD1 3.69Å; I195-I199 HydrophobicContact CG2-CG1 4.16Å; I195-I199 PolarHBondContact O-N 3.23Å; I195-A300 HydrophobicContact CD1-CB 4.32Å; I195-L303 HydrophobicContact CG2-CD2 4.28Å
196E93.9Very high84.8Confident78 Ų7842.8 Ų42.836%0.36422%0.223SC..Hα-helixtrans-58.9-51-175.6-75.768.1-156.200113C198 I199 D200E196-C198 PolarHBondContact O-N 3.11Å; E196-I199 WeakPolarHBondContact O-CB 3.3Å; E196-I199 PolarHBondContact O-N 2.84Å; E196-D200 PolarHBondContact O-N 3.38Å
197P96.3Very high86.7Confident0 Ų041.4 Ų41.40%022%0.215CC..Hα-helixtrans-58.4-32.8173.4-31.340.4000114.3L111 L173 L176 I177 P194 F201L111-P197 HydrophobicContact CD2-CG 3.42Å; L111-P197 VanDerWaalsContact CD2-CG 3.42Å; L173-P197 HydrophobicContact CD2-CB 3.93Å; L176-P197 HydrophobicContact CB-CB 4.03Å; L176-P197 HydrophobicContact CB-CG 4.08Å; L176-P197 HydrophobicContact CD1-CG 4.23Å; I177-P197 HydrophobicContact CG1-CB 4.03Å; P194-P197 HydrophobicContact CB-CG 4.27Å; P194-P197 HydrophobicContact CG-CB 4.45Å; P194-P197 HydrophobicContact CG-CG 3.68Å; P197-F201 VanDerWaalsContact O-CB 3.31Å; P197-F201 WeakPolarHBondContact O-CB 3.5Å; P197-F201 PolarHBondContact O-N 3.31Å
198C95.7Very high88.4Confident0 Ų031.7 Ų31.70%017%0.17CC..Hα-helixtrans-66-41.9175.7-57.50000110.9P193 P194 I195 E196 C202 F261 L303P193-C198 VanDerWaalsContact CG-SG 3.57Å; P194-C198 PolarHBondContact O-SG 2.82Å; I195-C198 VanDerWaalsContact O-CB 3.3Å; I195-C198 WeakPolarHBondContact O-CB 3.44Å; I195-C198 PolarHBondContact O-N 3.43Å; I195-C198 VanDerWaalsContact O-N 3.1Å; E196-C198 PolarHBondContact O-N 3.11Å; C198-C202 WeakPolarHBondContact O-CB 3.27Å; C198-C202 PolarHBondContact O-N 2.92Å; C198-C202 PolarHBondContact O-SG 3.14Å; C198-F261 HydrophobicContact CB-CD1 3.7Å; C198-F261 HydrophobicContact CB-CE1 3.75Å; C198-L303 HydrophobicContact CB-CD1 3.76Å; C198-L303 HydrophobicContact CB-CD2 3.69Å; C198-L303 HydrophobicContact CB-CG 4.4Å
199I95.4Very high90.2Very high18 Ų1827.2 Ų27.29%0.09214%0.138CC..Hα-helixtrans-62.4-51.8175-70.5167.3000110I195 E196 F201 C202 L203 Y302 L303 L306I195-I199 HydrophobicContact CG2-CD1 3.69Å; I195-I199 HydrophobicContact CG2-CG1 4.16Å; I195-I199 PolarHBondContact O-N 3.23Å; E196-I199 WeakPolarHBondContact O-CB 3.3Å; E196-I199 PolarHBondContact O-N 2.84Å; I199-F201 VanDerWaalsContact C-N 3.3Å; I199-F201 PolarHBondContact O-N 2.75Å; I199-C202 PolarHBondContact O-N 3.5Å; I199-C202 VanDerWaalsContact O-N 3.15Å; I199-L203 HydrophobicContact CG2-CD1 3.92Å; I199-L203 HydrophobicContact CG2-CG 4.31Å; I199-L203 WeakPolarHBondContact O-CG 3.23Å; I199-L203 PolarHBondContact O-N 3.48Å; I199-Y302 HydrophobicContact CD1-CD1 4.05Å; I199-Y302 HydrophobicContact CG1-CD1 4.24Å; I199-Y302 HydrophobicContact CG2-CD1 3.93Å; I199-Y302 HydrophobicContact CG2-CE1 3.63Å; I199-L303 HydrophobicContact CG1-CB 3.93Å; I199-L303 HydrophobicContact CG1-CD1 4.22Å; I199-L306 HydrophobicContact CB-CD1 4.47Å; I199-L306 HydrophobicContact CG2-CD1 3.87Å
200D96.5Very high91.2Very high7 Ų723.8 Ų23.84%0.03713%0.128CC..Hα-helixtrans-58.1-43.6-178.3-72.4-30000111.4T118 L173 E196 L203 L204T118-D200 HydrophobicContact CG2-CB 3.9Å; L173-D200 HydrophobicContact CD1-CB 4.33Å; L173-D200 HydrophobicContact CD2-CB 3.81Å; E196-D200 PolarHBondContact O-N 3.38Å; D200-L203 PolarHBondContact O-N 3.19Å; D200-L204 WeakPolarHBondContact O-CG 3.46Å; D200-L204 PolarHBondContact O-N 3.16Å; D200-L204 VanDerWaalsContact O-N 3.14Å
201F97.8Very high92.1Very high1 Ų123 Ų230%0.00412%0.122CC..Hα-helixtrans-63.8-44.7176-165.6-88.5000112.3V170 L173 R174 I177 P197 I199 L203 L204 V205 L250 F254 F261V170-F201 HydrophobicContact CG1-CE2 3.92Å; L173-F201 HydrophobicContact CB-CD2 3.8Å; L173-F201 HydrophobicContact CD1-CB 4.43Å; L173-F201 HydrophobicContact CD1-CD2 4.29Å; R174-F201 HydrophobicContact CG-CD2 4.49Å; R174-F201 HydrophobicContact CG-CE2 3.72Å; R174-F201 HydrophobicContact CG-CZ 4.22Å; I177-F201 HydrophobicContact CD1-CB 3.74Å; I177-F201 HydrophobicContact CD1-CD2 4.31Å; I177-F201 HydrophobicContact CD1-CG 3.99Å; P197-F201 VanDerWaalsContact O-CB 3.31Å; P197-F201 WeakPolarHBondContact O-CB 3.5Å; P197-F201 PolarHBondContact O-N 3.31Å; I199-F201 VanDerWaalsContact C-N 3.3Å; I199-F201 PolarHBondContact O-N 2.75Å; F201-L203 VanDerWaalsContact C-N 3.3Å; F201-L203 PolarHBondContact O-N 3.19Å; F201-L204 PolarHBondContact O-N 2.96Å; F201-V205 HydrophobicContact CD1-CG2 3.93Å; F201-V205 HydrophobicContact CE1-CG2 3.68Å; F201-V205 HydrophobicContact CZ-CG2 4.46Å; F201-V205 WeakPolarHBondContact O-CG2 3.46Å; F201-V205 PolarHBondContact O-N 3.13Å; F201-L250 HydrophobicContact CE2-CD2 4.18Å; F201-L250 HydrophobicContact CZ-CD2 4.09Å; F201-F254 HydrophobicContact CE1-CB 3.96Å; F201-F254 HydrophobicContact CE1-CD2 4.49Å; F201-F261 HydrophobicContact CD1-CZ 4.12Å
202C96Very high92.4Very high0 Ų021.8 Ų21.80%011%0.113CC..Hα-helixtrans-63.8-35.2176.8-67.10000112.2C198 I199 V205 D206 L306 C310C198-C202 WeakPolarHBondContact O-CB 3.27Å; C198-C202 PolarHBondContact O-N 2.92Å; C198-C202 PolarHBondContact O-SG 3.14Å; I199-C202 PolarHBondContact O-N 3.5Å; I199-C202 VanDerWaalsContact O-N 3.15Å; C202-V205 PolarHBondContact O-N 2.97Å; C202-D206 WeakPolarHBondContact O-CB 3.22Å; C202-D206 PolarHBondContact O-N 3.1Å; C202-L306 HydrophobicContact CB-CB 3.83Å; C202-L306 HydrophobicContact CB-CD1 4.24Å; C202-C310 PolarHBondContact O-SG 2.79Å
203L95.5Very high92.1Very high34 Ų3418 Ų1818%0.1789%0.093CC..Hα-helixtrans-64.2-40.6175.6-72.5170.7000112.2L122 I199 D200 F201 A207 L306L122-L203 HydrophobicContact CD1-CB 3.71Å; L122-L203 HydrophobicContact CD1-CD1 4.12Å; L122-L203 HydrophobicContact CD1-CG 4.42Å; I199-L203 HydrophobicContact CG2-CD1 3.92Å; I199-L203 HydrophobicContact CG2-CG 4.31Å; I199-L203 WeakPolarHBondContact O-CG 3.23Å; I199-L203 PolarHBondContact O-N 3.48Å; D200-L203 PolarHBondContact O-N 3.19Å; F201-L203 VanDerWaalsContact C-N 3.3Å; F201-L203 PolarHBondContact O-N 3.19Å; L203-A207 VanDerWaalsContact O-CB 3.28Å; L203-A207 WeakPolarHBondContact O-CB 3.42Å; L203-A207 PolarHBondContact O-N 2.95Å; L203-L306 HydrophobicContact CD2-CD1 4.04Å; L203-L306 HydrophobicContact CD2-CD2 3.82Å; L203-L306 HydrophobicContact CG-CD1 4.02Å
204L95.1Very high91.5Very high2 Ų222.5 Ų22.51%0.0111%0.114CC..Hα-helixtrans-63.5-44174.6-67177000111.4T118 V121 L122 L169 V170 L173 D200 F201 A207 V208 L250T118-L204 HydrophobicContact CG2-CD2 4.06Å; T118-L204 HydrophobicContact CG2-CG 4.03Å; V121-L204 HydrophobicContact CB-CD2 4.23Å; V121-L204 HydrophobicContact CG1-CD2 3.59Å; L122-L204 HydrophobicContact CD2-CD2 4.19Å; L122-L204 HydrophobicContact CG-CD2 4.35Å; L169-L204 HydrophobicContact CD2-CD1 4.35Å; V170-L204 HydrophobicContact CG2-CD1 4.25Å; L173-L204 HydrophobicContact CD1-CD1 3.63Å; D200-L204 WeakPolarHBondContact O-CG 3.46Å; D200-L204 PolarHBondContact O-N 3.16Å; D200-L204 VanDerWaalsContact O-N 3.14Å; F201-L204 PolarHBondContact O-N 2.96Å; L204-A207 PolarHBondContact O-N 2.87Å; L204-V208 PolarHBondContact O-N 3.11Å; L204-L250 HydrophobicContact CB-CD2 3.93Å
205V96.2Very high90.7Very high0 Ų024.3 Ų24.30%012%0.12CC..Hα-helixtrans-61.7-47.5177.4173.20000111.4F201 C202 A207 V208 C209 L250 F254 C310 M314F201-V205 HydrophobicContact CD1-CG2 3.93Å; F201-V205 HydrophobicContact CE1-CG2 3.68Å; F201-V205 HydrophobicContact CZ-CG2 4.46Å; F201-V205 WeakPolarHBondContact O-CG2 3.46Å; F201-V205 PolarHBondContact O-N 3.13Å; C202-V205 PolarHBondContact O-N 2.97Å; V205-A207 PolarHBondContact O-N 2.97Å; V205-V208 WeakPolarHBondContact O-CG2 3.48Å; V205-V208 PolarHBondContact O-N 2.92Å; V205-C209 PolarHBondContact O-N 2.97Å; V205-C209 PolarHBondContact O-SG 3.32Å; V205-L250 HydrophobicContact CG2-CB 4.13Å; V205-L250 HydrophobicContact CG2-CD2 4.04Å; V205-F254 HydrophobicContact CB-CD2 4.32Å; V205-F254 HydrophobicContact CG1-CD2 4.07Å; V205-F254 HydrophobicContact CG2-CB 4.28Å; V205-F254 HydrophobicContact CG2-CD2 4Å; V205-C310 HydrophobicContact CG1-CB 3.88Å; V205-M314 HydrophobicContact CG1-CE 3.23Å
206D93.1Very high89.5Confident13 Ų1323.8 Ų23.87%0.0712%0.118CC..Hα-helixtrans-58.4-48176.3-172.152.6000111C202 V208 C209 E210 R309C202-D206 WeakPolarHBondContact O-CB 3.22Å; C202-D206 PolarHBondContact O-N 3.1Å; D206-V208 PolarHBondContact O-N 3.09Å; D206-C209 WeakPolarHBondContact O-CB 3.32Å; D206-C209 PolarHBondContact O-N 3.24Å; D206-C209 VanDerWaalsContact O-N 3.14Å; D206-E210 WeakPolarHBondContact O-CG 3.44Å; D206-E210 PolarHBondContact O-N 3.03Å; D206-R309 WeakPolarHBondContact OD1-CD 3.38Å; D206-R309 VanDerWaalsContact OD1-CG 3.26Å; D206-R309 WeakPolarHBondContact OD1-CG 3.47Å; D206-R309 IonicContact OD1-CZ 3.79Å; D206-R309 IonicContact OD1-NE 3Å; D206-R309 PolarHBondContact OD1-NE 3.16Å; D206-R309 WeakPolarHBondContact OD2-CD 3.33Å; D206-R309 IonicContact OD2-CZ 3.17Å; D206-R309 IonicContact OD2-NE 3.12Å; D206-R309 PolarHBondContact OD2-NE 3.03Å; D206-R309 VanDerWaalsContact OD2-NE 3.12Å; D206-R309 IonicContact OD2-NH1 3.41Å; D206-R309 PolarHBondContact OD2-NH1 3.02Å; D206-R309 IonicContact OD2-NH2 3.73Å
207A90.5Very high88.2Confident19 Ų1927 Ų2716%0.15713%0.127CC..Hα-helixtrans-60.5-43.7179.700000112.7L122 L127 L203 L204 V205 C209 L211L122-A207 HydrophobicContact CD2-CB 3.39Å; L127-A207 HydrophobicContact CD1-CB 3.86Å; L203-A207 VanDerWaalsContact O-CB 3.28Å; L203-A207 WeakPolarHBondContact O-CB 3.42Å; L203-A207 PolarHBondContact O-N 2.95Å; L204-A207 PolarHBondContact O-N 2.87Å; V205-A207 PolarHBondContact O-N 2.97Å; A207-C209 VanDerWaalsContact C-N 3.32Å; A207-C209 PolarHBondContact O-N 3.03Å; A207-L211 WeakPolarHBondContact O-CB 3.35Å; A207-L211 WeakPolarHBondContact O-CD1 3.47Å; A207-L211 VanDerWaalsContact O-CG 3.23Å; A207-L211 WeakPolarHBondContact O-CG 3.43Å; A207-L211 PolarHBondContact O-N 2.74Å
208V90.4Very high86.6Confident1 Ų130.3 Ų30.31%0.00615%0.147CC..Hα-helixtrans-70.4-29.1177.3-60.80000112.7L127 L204 V205 D206 Q212 W243 L246 L247 L250 F251L127-V208 HydrophobicContact CD2-CG1 4.18Å; L204-V208 PolarHBondContact O-N 3.11Å; V205-V208 WeakPolarHBondContact O-CG2 3.48Å; V205-V208 PolarHBondContact O-N 2.92Å; D206-V208 PolarHBondContact O-N 3.09Å; V208-Q212 VanDerWaalsContact O-CB 3.3Å; V208-Q212 WeakPolarHBondContact O-CB 3.41Å; V208-Q212 PolarHBondContact O-N 3.36Å; V208-W243 HydrophobicContact CB-CH2 3.83Å; V208-W243 HydrophobicContact CB-CZ2 4.46Å; V208-W243 HydrophobicContact CB-CZ3 4.49Å; V208-W243 HydrophobicContact CG1-CH2 3.88Å; V208-W243 HydrophobicContact CG1-CZ3 4.08Å; V208-L246 HydrophobicContact CG1-CD2 4.14Å; V208-L247 HydrophobicContact CB-CD2 3.88Å; V208-L247 HydrophobicContact CG2-CD2 3.9Å; V208-L250 HydrophobicContact CB-CD1 4.15Å; V208-L250 HydrophobicContact CG1-CD1 3.5Å; V208-L250 HydrophobicContact CG2-CD1 3.58Å; V208-F251 HydrophobicContact CG2-CE1 4.21Å
209C90.8Very high85Confident1 Ų137 Ų371%0.00718%0.177CC..Hα-helixtrans-66.1-52.2173.7-68.80000111.3V205 D206 A207 L211 Q212 L213 L317V205-C209 PolarHBondContact O-N 2.97Å; V205-C209 PolarHBondContact O-SG 3.32Å; D206-C209 WeakPolarHBondContact O-CB 3.32Å; D206-C209 PolarHBondContact O-N 3.24Å; D206-C209 VanDerWaalsContact O-N 3.14Å; A207-C209 VanDerWaalsContact C-N 3.32Å; A207-C209 PolarHBondContact O-N 3.03Å; C209-L211 VanDerWaalsContact C-N 3.29Å; C209-L211 PolarHBondContact O-N 3.49Å; C209-Q212 PolarHBondContact O-N 2.83Å; C209-L213 WeakPolarHBondContact O-CB 3.41Å; C209-L213 WeakPolarHBondContact O-CG 3.49Å; C209-L213 PolarHBondContact O-N 2.78Å; C209-L317 HydrophobicContact CB-CD1 4.07Å
210E86.6Confident83.1Confident89 Ų8942 Ų4242%0.41620%0.204SC..Hα-helixtrans-57.9-44.1177.7-69.7-72.8178.500111.5D206 L213 H214 R309D206-E210 WeakPolarHBondContact O-CG 3.44Å; D206-E210 PolarHBondContact O-N 3.03Å; E210-L213 PolarHBondContact O-N 3.3Å; E210-H214 WeakPolarHBondContact O-CB 3.12Å; E210-H214 PolarHBondContact O-N 3.38Å; E210-R309 IonicContact OE1-CZ 3.71Å; E210-R309 IonicContact OE1-NE 3.69Å; E210-R309 IonicContact OE1-NH2 2.85Å; E210-R309 PolarHBondContact OE1-NH2 2.93Å
211L83.9Confident81Confident37 Ų3743.9 Ų43.919%0.19422%0.217CC..Hα-helixtrans-60.8-51.9176.3-86.1173.2000111.5L127 K128 M131 A207 C209 L213 H214 F215 W243L127-L211 HydrophobicContact CB-CD1 3.63Å; L127-L211 HydrophobicContact CD1-CD1 4.12Å; L127-L211 HydrophobicContact CG-CD1 4.4Å; K128-L211 HydrophobicContact CG-CD2 4.5Å; M131-L211 HydrophobicContact CE-CB 3.89Å; M131-L211 WeakPolarHBondContact CE-O 3.43Å; M131-L211 HydrophobicContact SD-CB 3.4Å; M131-L211 WeakPolarHBondContact SD-CB 3.31Å; M131-L211 HydrophobicContact SD-CD1 4.03Å; M131-L211 HydrophobicContact SD-CD2 3.49Å; M131-L211 WeakPolarHBondContact SD-CD2 3.46Å; M131-L211 HydrophobicContact SD-CG 3.79Å; A207-L211 WeakPolarHBondContact O-CB 3.35Å; A207-L211 WeakPolarHBondContact O-CD1 3.47Å; A207-L211 VanDerWaalsContact O-CG 3.23Å; A207-L211 WeakPolarHBondContact O-CG 3.43Å; A207-L211 PolarHBondContact O-N 2.74Å; C209-L211 VanDerWaalsContact C-N 3.29Å; C209-L211 PolarHBondContact O-N 3.49Å; L211-L213 VanDerWaalsContact C-N 3.31Å; L211-L213 PolarHBondContact O-N 3.23Å; L211-H214 PolarHBondContact O-N 3.37Å; L211-H214 VanDerWaalsContact O-N 3.13Å; L211-F215 PolarHBondContact O-N 3.5Å; L211-W243 HydrophobicContact CB-CH2 4.01Å; L211-W243 HydrophobicContact CB-CZ2 4.39Å; L211-W243 HydrophobicContact CD1-CH2 4.34Å
212Q85.9Confident78.5Confident7 Ų753.5 Ų53.53%0.03326%0.262CS..Hα-helixtrans-59.1-42.5178.6-178.761.615.600111.9V208 C209 H214 F215 V216 W243 L317 Q322V208-Q212 VanDerWaalsContact O-CB 3.3Å; V208-Q212 WeakPolarHBondContact O-CB 3.41Å; V208-Q212 PolarHBondContact O-N 3.36Å; C209-Q212 PolarHBondContact O-N 2.83Å; Q212-H214 VanDerWaalsContact C-N 3.34Å; Q212-H214 PolarHBondContact O-N 3.38Å; Q212-F215 PolarHBondContact O-N 2.9Å; Q212-V216 WeakPolarHBondContact O-CG2 3.34Å; Q212-V216 PolarHBondContact O-N 3.29Å; Q212-W243 HydrophobicContact CB-CZ2 4.16Å; Q212-L317 HydrophobicContact CB-CD1 4.37Å; Q212-L317 HydrophobicContact CB-CD2 3.78Å; Q212-L317 HydrophobicContact CG-CD1 4.42Å; Q212-L317 HydrophobicContact CG-CD2 3.41Å; Q212-L317 VanDerWaalsContact CG-CD2 3.41Å; Q212-Q322 PolarHBondContact NE2-O 3.27Å
213L82.1Confident75.8Confident13 Ų1357.7 Ų57.77%0.06829%0.287CS..Hα-helixtrans-59.7-45.2175.5-72.5167.7000111.5C209 E210 L211 R217 T316 L317 Q322C209-L213 WeakPolarHBondContact O-CB 3.41Å; C209-L213 WeakPolarHBondContact O-CG 3.49Å; C209-L213 PolarHBondContact O-N 2.78Å; E210-L213 PolarHBondContact O-N 3.3Å; L211-L213 VanDerWaalsContact C-N 3.31Å; L211-L213 PolarHBondContact O-N 3.23Å; L213-R217 VanDerWaalsContact O-CG 3.29Å; L213-R217 WeakPolarHBondContact O-CG 3.43Å; L213-R217 PolarHBondContact O-N 2.9Å; L213-T316 HydrophobicContact CD1-CG2 4.38Å; L213-T316 HydrophobicContact CD2-CG2 3.67Å; L213-L317 HydrophobicContact CD2-CD2 3.6Å; L213-L317 HydrophobicContact CD2-CG 3.94Å; L213-L317 HydrophobicContact CG-CD2 3.65Å; L213-L317 HydrophobicContact CG-CG 3.97Å; L213-Q322 VanDerWaalsContact CA-OE1 3.32Å; L213-Q322 PolarHBondContact O-OE1 2.94Å
214H77.5Confident73.2Confident101 Ų10163.5 Ų63.547%0.46832%0.319SS..Hα-helixtrans-65.5-45.1179.2-177.7-83.8000112.4E210 L211 Q212 V216 R217 V218E210-H214 WeakPolarHBondContact O-CB 3.12Å; E210-H214 PolarHBondContact O-N 3.38Å; L211-H214 PolarHBondContact O-N 3.37Å; L211-H214 VanDerWaalsContact O-N 3.13Å; Q212-H214 VanDerWaalsContact C-N 3.34Å; Q212-H214 PolarHBondContact O-N 3.38Å; H214-V216 PolarHBondContact O-N 3.34Å; H214-R217 PolarHBondContact O-N 3.16Å; H214-V218 VanDerWaalsContact CE1-CG2 3.43Å; H214-V218 WeakPolarHBondContact CE1-CG2 3.33Å; H214-V218 WeakPolarHBondContact O-CG2 3.39Å; H214-V218 PolarHBondContact O-N 3.42Å
215F73.5Confident70.4Confident56 Ų5670.2 Ų70.225%0.24635%0.35CS..Hα-helixtrans-63.4-40.4-177.9172.3-96.5000112.8M131 L211 Q212 V218 K219M131-F215 HydrophobicContact CE-CB 3.24Å; M131-F215 HydrophobicContact CE-CD2 4.35Å; M131-F215 HydrophobicContact CE-CG 3.87Å; L211-F215 PolarHBondContact O-N 3.5Å; Q212-F215 PolarHBondContact O-N 2.9Å; F215-V218 PolarHBondContact O-N 2.96Å; F215-K219 HydrophobicContact CE1-CD 4.38Å; F215-K219 WeakPolarHBondContact O-CB 3.37Å; F215-K219 PolarHBondContact O-N 2.92Å
216V66.6Low67.6Low22 Ų2277.1 Ų77.113%0.13339%0.392CS..Hα-helixtrans-70-37178177.90000111.4Q212 H214 K219 N220 Q322Q212-V216 WeakPolarHBondContact O-CG2 3.34Å; Q212-V216 PolarHBondContact O-N 3.29Å; H214-V216 PolarHBondContact O-N 3.34Å; V216-K219 PolarHBondContact O-N 2.92Å; V216-N220 WeakPolarHBondContact O-CB 3.34Å; V216-N220 VanDerWaalsContact O-CG 3.24Å; V216-N220 PolarHBondContact O-N 3.14Å; V216-N220 PolarHBondContact O-ND2 2.88Å; V216-Q322 HydrophobicContact CB-CB 4.24Å; V216-Q322 HydrophobicContact CB-CG 4.06Å; V216-Q322 HydrophobicContact CG1-CB 4.23Å; V216-Q322 HydrophobicContact CG1-CG 3.7Å; V216-Q322 HydrophobicContact CG2-CB 4.03Å; V216-Q322 HydrophobicContact CG2-CG 4.39Å
217R67.2Low64.7Low145 Ų14579.4 Ų79.455%0.54742%0.419SS..Hα-helixtrans-60-47.8172.5-72.9174.1-175-175.30.5112.1L213 H214 K219 N220 S221L213-R217 VanDerWaalsContact O-CG 3.29Å; L213-R217 WeakPolarHBondContact O-CG 3.43Å; L213-R217 PolarHBondContact O-N 2.9Å; H214-R217 PolarHBondContact O-N 3.16Å; R217-K219 PolarHBondContact O-N 2.9Å; R217-N220 PolarHBondContact O-N 3.32Å; R217-S221 PolarHBondContact O-N 3Å; R217-S221 PolarHBondContact O-OG 3.35Å
218V62.5Low62.2Low71 Ų7183.6 Ų83.643%0.4344%0.438SS..Hα-helixtrans-63.5-41.3178173.40000111.7H214 F215 N220 S221H214-V218 VanDerWaalsContact CE1-CG2 3.43Å; H214-V218 WeakPolarHBondContact CE1-CG2 3.33Å; H214-V218 WeakPolarHBondContact O-CG2 3.39Å; H214-V218 PolarHBondContact O-N 3.42Å; F215-V218 PolarHBondContact O-N 2.96Å; V218-N220 VanDerWaalsContact C-N 3.28Å; V218-N220 PolarHBondContact O-N 3.35Å; V218-S221 WeakPolarHBondContact CA-OG 3.49Å; V218-S221 PolarHBondContact O-N 2.95Å; V218-S221 PolarHBondContact O-OG 3.35Å
219K61.4Low59.3Low141 Ų14188.4 Ų88.461%0.61347%0.472SS*.Hα-helixtrans-64.6-32.9178.3-172.6176180176.30112.7F215 V216 R217F215-K219 HydrophobicContact CE1-CD 4.38Å; F215-K219 WeakPolarHBondContact O-CB 3.37Å; F215-K219 PolarHBondContact O-N 2.92Å; V216-K219 PolarHBondContact O-N 2.92Å; R217-K219 PolarHBondContact O-N 2.9Å
220N56.9Low56.9Low123 Ų12394.1 Ų94.166%0.65850%0.502SS*.Hα-helixtrans-85.3-23179.9-69.5-18.2000113.1V216 R217 V218 E222V216-N220 WeakPolarHBondContact O-CB 3.34Å; V216-N220 VanDerWaalsContact O-CG 3.24Å; V216-N220 PolarHBondContact O-N 3.14Å; V216-N220 PolarHBondContact O-ND2 2.88Å; R217-N220 PolarHBondContact O-N 3.32Å; V218-N220 VanDerWaalsContact C-N 3.28Å; V218-N220 PolarHBondContact O-N 3.35Å; N220-E222 PolarHBondContact O-N 2.7Å
221S50.8Low54.5Low46 Ų4695.7 Ų95.732%0.32251%0.512SS..  trans-77.3114.9171.456.50000109.9R217 V218 V223R217-S221 PolarHBondContact O-N 3Å; R217-S221 PolarHBondContact O-OG 3.35Å; V218-S221 WeakPolarHBondContact CA-OG 3.49Å; V218-S221 PolarHBondContact O-N 2.95Å; V218-S221 PolarHBondContact O-OG 3.35Å; S221-V223 PolarHBondContact O-N 2.82Å
222E46.5Very low52Low203 Ų203100.7 Ų100.795%0.94954%0.539SS*.  trans-61.43.5165.9-68.7-173.3158.600113.1N220N220-E222 PolarHBondContact O-N 2.7Å
223V40Very low49.3Very low87 Ų87104.2 Ų104.253%0.52757%0.569SS.*  trans-91115.1-174-167.90000108.6S221 E225S221-V223 PolarHBondContact O-N 2.82Å; V223-E225 HydrophobicContact CB-CG 3.95Å; V223-E225 HydrophobicContact CG1-CG 3.39Å; V223-E225 PolarHBondContact O-N 3.34Å
224N39Very low46.7Very low157 Ų157109.4 Ų109.484%0.8461%0.607SS**  trans-61.370.8161.8-79-31.4000109.6T226N224-T226 VanDerWaalsContact C-N 3.33Å; N224-T226 PolarHBondContact O-N 2.82Å
225E38Very low44.4Very low143 Ų143106.9 Ų106.967%0.66860%0.6SS**  trans-78.989.3172.3-67.9-158163.100108.9V223 G227V223-E225 HydrophobicContact CB-CG 3.95Å; V223-E225 HydrophobicContact CG1-CG 3.39Å; V223-E225 PolarHBondContact O-N 3.34Å; E225-G227 PolarHBondContact O-N 3.26Å
226T36.7Very low42.5Very low145 Ų145107.8 Ų107.889%0.8962%0.618SS**  trans-6633159.147.50000112.2N224N224-T226 VanDerWaalsContact C-N 3.33Å; N224-T226 PolarHBondContact O-N 2.82Å
227G32.8Very low41Very low61 Ų61113.3 Ų113.363%0.62965%0.646SS**  trans-104.720.4179.300000113.5E225 S229E225-G227 PolarHBondContact O-N 3.26Å; G227-S229 PolarHBondContact O-N 3.03Å
228L36.5Very low40.1Very low107 Ų107107.2 Ų107.256%0.5662%0.624SS**  trans-64.588.7-177.9-68.4169.1000111.7L230 L231L228-L230 PolarHBondContact O-N 2.91Å; L228-L231 PolarHBondContact O-N 3.41Å
229S30.5Very low39.8Very low102 Ų102106.4 Ų106.471%0.71362%0.622SS**  trans-88.584.3154.71710000108G227G227-S229 PolarHBondContact O-N 3.03Å
230L40.7Very low40.1Very low121 Ų121105.3 Ų105.363%0.63462%0.619SS**SBend-127.154.5102.6-140.9152.5000109.7K128 L228K128-L230 PolarHBondContact NZ-O 3.15Å; L228-L230 PolarHBondContact O-N 2.91Å
231L35.1Very low40.7Very low122 Ų122102.3 Ų102.364%0.63961%0.605SS**  trans22.399.8165.4-77.395.9000117.8L228L228-L231 PolarHBondContact O-N 3.41Å
232D31.3Very low42Very low141 Ų141100.2 Ų100.275%0.75459%0.59SS**  trans59.189.8130.1-60.2-22.3000118.5
233A29.3Very low43.7Very low81 Ų8191 Ų9167%0.66955%0.547SS*.  172.4130127.700000112.4C235A233-C235 PolarHBondContact O-N 2.96Å
234S28.6Very low45.8Very low123 Ų12388.5 Ų88.586%0.8653%0.529SS*.  trans33.776.7146.263.50000117.6
235C28.4Very low48.1Very low47 Ų4781.9 Ų81.932%0.31850%0.495SS..PPolyproline II helixtrans-91.5123.8170.6-78.40000110.5L132 A233L132-C235 HydrophobicContact CD1-CB 4.31Å; A233-C235 PolarHBondContact O-N 2.96Å
236A33.2Very low50.5Low76 Ų7675 Ų7563%0.62846%0.463SS*.PPolyproline II helixtrans-81141.8175.900000110.8
237L35.1Very low53.1Low137 Ų13768.1 Ų68.172%0.71742%0.421SS*.PPolyproline II helixtrans-66.9135.1-164.8-6886.3000114.3
238L48.5Very low55.9Low18 Ų1868.4 Ų68.49%0.09440%0.403CS..  trans-136.2150.5161.5-70.7153.1000110.3L130 S133 D160 T163L130-L238 HydrophobicContact CD2-CB 4.46Å; L130-L238 HydrophobicContact CD2-CD1 3.8Å; L130-L238 HydrophobicContact CG-CD1 3.91Å; S133-L238 WeakPolarHBondContact CB-O 3.31Å; S133-L238 PolarHBondContact OG-O 3.36Å; D160-L238 HydrophobicContact CB-CD2 3.81Å; D160-L238 VanDerWaalsContact OD2-CD2 3.22Å; D160-L238 WeakPolarHBondContact OD2-CD2 3.35Å; T163-L238 HydrophobicContact CG2-CD1 3.07Å; T163-L238 HydrophobicContact CG2-CD2 3.62Å; T163-L238 HydrophobicContact CG2-CG 3.89Å
239S57.1Low58.5Low54 Ų5464.5 Ų64.538%0.37838%0.382SS..  trans-74.9149.7-169.955.10000114.2T241 S242S239-T241 PolarHBondContact O-N 3.01Å; S239-T241 PolarHBondContact OG-OG1 2.86Å; S239-S242 PolarHBondContact O-N 2.98Å
240E66.1Low61.7Low117 Ų11759.8 Ų59.855%0.54735%0.349SS..Hα-helixtrans-42.7-34170.9-177176.6-17700113.6S133 W243 H244S133-E240 PolarHBondContact OG-N 3.14Å; E240-W243 PolarHBondContact O-N 2.91Å; E240-H244 WeakPolarHBondContact CG-CE1 3.49Å; E240-H244 PolarHBondContact O-CD2 2.88Å; E240-H244 VanDerWaalsContact O-CG 3.25Å; E240-H244 PolarHBondContact O-N 3.05Å; E240-H244 VanDerWaalsContact O-N 3.08Å; E240-H244 IonicContact OE1-CE1 3.65Å; E240-H244 PolarHBondContact OE1-CE1 3.39Å; E240-H244 IonicContact OE1-NE2 3.73Å
241T70.9Confident64.3Low60 Ų6054 Ų5437%0.36832%0.319SS..Hα-helixtrans-62-41.8176.856.50000113.8S239 H244 S245S239-T241 PolarHBondContact O-N 3.01Å; S239-T241 PolarHBondContact OG-OG1 2.86Å; T241-H244 PolarHBondContact O-N 3.48Å; T241-S245 WeakPolarHBondContact O-CB 3.31Å; T241-S245 PolarHBondContact O-N 3.13Å; T241-S245 PolarHBondContact O-OG 3.34Å
242S76.4Confident67.1Low2 Ų249.7 Ų49.71%0.01430%0.297CS..Hα-helixtrans-70.8-38-178-57.30000110.5P158 S239 S245 L246P158-S242 WeakPolarHBondContact CG-OG 3.38Å; S239-S242 PolarHBondContact O-N 2.98Å; S242-S245 PolarHBondContact O-N 3.41Å; S242-L246 WeakPolarHBondContact O-CB 3.48Å; S242-L246 PolarHBondContact O-N 2.84Å
243W83Confident70.1Confident11 Ų1143.2 Ų43.24%0.04226%0.263CS..Hα-helixtrans-63.4-47.1174.3180-116.3000112.3L130 M131 V208 L211 Q212 E240 S245 L246 L247L130-W243 HydrophobicContact CB-CE3 4.19Å; M131-W243 HydrophobicContact CE-CH2 4.2Å; M131-W243 HydrophobicContact CE-CZ2 3.69Å; M131-W243 HydrophobicContact CG-CD2 3.85Å; M131-W243 HydrophobicContact CG-CE3 3.68Å; M131-W243 HydrophobicContact CG-CH2 3.61Å; M131-W243 HydrophobicContact CG-CZ2 3.78Å; M131-W243 HydrophobicContact CG-CZ3 3.56Å; M131-W243 HydrophobicContact SD-CH2 3.93Å; M131-W243 HydrophobicContact SD-CZ2 4.04Å; M131-W243 HydrophobicContact SD-CZ3 4.41Å; V208-W243 HydrophobicContact CB-CH2 3.83Å; V208-W243 HydrophobicContact CB-CZ2 4.46Å; V208-W243 HydrophobicContact CB-CZ3 4.49Å; V208-W243 HydrophobicContact CG1-CH2 3.88Å; V208-W243 HydrophobicContact CG1-CZ3 4.08Å; L211-W243 HydrophobicContact CB-CH2 4.01Å; L211-W243 HydrophobicContact CB-CZ2 4.39Å; L211-W243 HydrophobicContact CD1-CH2 4.34Å; Q212-W243 HydrophobicContact CB-CZ2 4.16Å; E240-W243 PolarHBondContact O-N 2.91Å; W243-S245 VanDerWaalsContact C-N 3.28Å; W243-S245 PolarHBondContact O-N 3.4Å; W243-L246 HydrophobicContact CE3-CD2 4.01Å; W243-L246 HydrophobicContact CZ3-CD2 3.87Å; W243-L246 PolarHBondContact O-N 3.45Å; W243-L247 HydrophobicContact CD2-CG 4.44Å; W243-L247 HydrophobicContact CH2-CD2 4.49Å; W243-L247 HydrophobicContact CZ2-CD1 4.38Å; W243-L247 HydrophobicContact CZ2-CD2 3.97Å; W243-L247 HydrophobicContact CZ2-CG 4.23Å; W243-L247 WeakPolarHBondContact O-CG 3.3Å; W243-L247 PolarHBondContact O-N 3.13Å
244H85.3Confident73.3Confident34 Ų3439.3 Ų39.316%0.15723%0.231CC..Hα-helixtrans-61.1-38.5176.2-64.6169.9000112.3E240 T241 Y248 P324 T325E240-H244 WeakPolarHBondContact CG-CE1 3.49Å; E240-H244 PolarHBondContact O-CD2 2.88Å; E240-H244 VanDerWaalsContact O-CG 3.25Å; E240-H244 PolarHBondContact O-N 3.05Å; E240-H244 VanDerWaalsContact O-N 3.08Å; E240-H244 IonicContact OE1-CE1 3.65Å; E240-H244 PolarHBondContact OE1-CE1 3.39Å; E240-H244 IonicContact OE1-NE2 3.73Å; T241-H244 PolarHBondContact O-N 3.48Å; H244-Y248 WeakPolarHBondContact O-CB 3.29Å; H244-Y248 PolarHBondContact O-N 3.31Å; H244-P324 WeakPolarHBondContact CD2-CG 3.49Å; H244-P324 WeakPolarHBondContact NE2-CB 3.2Å; H244-P324 WeakPolarHBondContact NE2-CG 3.49Å; H244-T325 HydrophobicContact CB-CG2 4.43Å
245S86.3Confident76.3Confident17 Ų1734.8 Ų34.812%0.11920%0.199CC..Hα-helixtrans-66.1-41.7177.3-57.30000111.6T241 S242 W243 Y248 Q249T241-S245 WeakPolarHBondContact O-CB 3.31Å; T241-S245 PolarHBondContact O-N 3.13Å; T241-S245 PolarHBondContact O-OG 3.34Å; S242-S245 PolarHBondContact O-N 3.41Å; W243-S245 VanDerWaalsContact C-N 3.28Å; W243-S245 PolarHBondContact O-N 3.4Å; S245-Y248 PolarHBondContact O-N 2.99Å; S245-Q249 WeakPolarHBondContact O-CG 3.32Å; S245-Q249 PolarHBondContact O-N 3.34Å
246L88.7Confident79.1Confident0 Ų037.1 Ų37.10%021%0.205CC..Hα-helixtrans-63-48.7176177.466.2000111.8L127 L130 L166 F167 V170 V208 S242 W243 Y248 Q249 L250L127-L246 HydrophobicContact CD2-CD2 4.17Å; L130-L246 HydrophobicContact CD1-CD2 4.13Å; L166-L246 HydrophobicContact CD2-CD1 3.68Å; L166-L246 HydrophobicContact CD2-CD2 3.47Å; L166-L246 VanDerWaalsContact CD2-CD2 3.47Å; L166-L246 HydrophobicContact CD2-CG 4.21Å; L166-L246 HydrophobicContact CG-CD1 3.87Å; F167-L246 HydrophobicContact CE1-CB 4.03Å; F167-L246 HydrophobicContact CE1-CD1 4.34Å; F167-L246 HydrophobicContact CZ-CB 3.98Å; V170-L246 HydrophobicContact CG2-CD1 4.15Å; V208-L246 HydrophobicContact CG1-CD2 4.14Å; S242-L246 WeakPolarHBondContact O-CB 3.48Å; S242-L246 PolarHBondContact O-N 2.84Å; W243-L246 HydrophobicContact CE3-CD2 4.01Å; W243-L246 HydrophobicContact CZ3-CD2 3.87Å; W243-L246 PolarHBondContact O-N 3.45Å; L246-Y248 PolarHBondContact O-N 3Å; L246-Q249 PolarHBondContact O-N 3.27Å; L246-L250 HydrophobicContact CD1-CD1 3.8Å; L246-L250 HydrophobicContact CD1-CG 4.19Å; L246-L250 HydrophobicContact CG-CD1 3.85Å; L246-L250 WeakPolarHBondContact O-CB 3.49Å; L246-L250 WeakPolarHBondContact O-CG 3.47Å; L246-L250 PolarHBondContact O-N 3.39Å
247L91.1Very high81.9Confident0 Ų033.6 Ų33.60%018%0.176CC..Hα-helixtrans-54.7-45.7175.3-73.4174.4000110.7V208 W243 L250 F251 L328V208-L247 HydrophobicContact CB-CD2 3.88Å; V208-L247 HydrophobicContact CG2-CD2 3.9Å; W243-L247 HydrophobicContact CD2-CG 4.44Å; W243-L247 HydrophobicContact CH2-CD2 4.49Å; W243-L247 HydrophobicContact CZ2-CD1 4.38Å; W243-L247 HydrophobicContact CZ2-CD2 3.97Å; W243-L247 HydrophobicContact CZ2-CG 4.23Å; W243-L247 WeakPolarHBondContact O-CG 3.3Å; W243-L247 PolarHBondContact O-N 3.13Å; L247-L250 PolarHBondContact O-N 2.68Å; L247-F251 HydrophobicContact CB-CD2 4.47Å; L247-F251 HydrophobicContact CB-CE2 4.1Å; L247-F251 HydrophobicContact CB-CZ 4.49Å; L247-F251 HydrophobicContact CD2-CE1 4.38Å; L247-F251 HydrophobicContact CD2-CE2 4.08Å; L247-F251 HydrophobicContact CD2-CZ 3.71Å; L247-F251 WeakPolarHBondContact O-CB 3.49Å; L247-F251 WeakPolarHBondContact O-CD2 3.33Å; L247-F251 WeakPolarHBondContact O-CG 3.4Å; L247-F251 PolarHBondContact O-N 3Å; L247-L328 HydrophobicContact CB-CD1 4.12Å; L247-L328 HydrophobicContact CB-CD2 3.68Å; L247-L328 HydrophobicContact CD1-CD1 4.03Å
248Y92.1Very high84.5Confident66 Ų6627.1 Ų27.126%0.25914%0.142SC..Hα-helixtrans-63.7-49-179.7179.6-101.6000111.4H244 S245 L246 L250 F251 D252 I327 L328 T331H244-Y248 WeakPolarHBondContact O-CB 3.29Å; H244-Y248 PolarHBondContact O-N 3.31Å; S245-Y248 PolarHBondContact O-N 2.99Å; L246-Y248 PolarHBondContact O-N 3Å; Y248-L250 VanDerWaalsContact C-N 3.29Å; Y248-L250 PolarHBondContact O-N 2.91Å; Y248-F251 PolarHBondContact O-N 3.04Å; Y248-D252 HydrophobicContact CE1-CB 4.47Å; Y248-D252 WeakPolarHBondContact O-CB 3.22Å; Y248-D252 PolarHBondContact O-N 3.5Å; Y248-I327 HydrophobicContact CD2-CD1 4.41Å; Y248-I327 HydrophobicContact CD2-CG1 4.14Å; Y248-I327 HydrophobicContact CE2-CD1 3.84Å; Y248-I327 HydrophobicContact CE2-CG1 3.73Å; Y248-L328 HydrophobicContact CD2-CD2 4.47Å; Y248-T331 HydrophobicContact CE2-CG2 4.44Å; Y248-T331 WeakPolarHBondContact CE2-OG1 3.49Å
249Q91.7Very high86.4Confident26 Ų2630.5 Ų30.512%0.12116%0.158CC..Hα-helixtrans-62.2-36.1179.6-72.6-164.419.800113.1E157 V170 S245 L246 G253E157-Q249 PolarHBondContact OE1-NE2 2.97Å; V170-Q249 HydrophobicContact CG1-CB 4.37Å; S245-Q249 WeakPolarHBondContact O-CG 3.32Å; S245-Q249 PolarHBondContact O-N 3.34Å; L246-Q249 PolarHBondContact O-N 3.27Å; Q249-G253 WeakPolarHBondContact O-CA 3.32Å; Q249-G253 PolarHBondContact O-N 3.26Å
250L95.9Very high88Confident2 Ų230 Ų301%0.0115%0.149CC..Hα-helixtrans-72-44.7177.1-78170000111.9V170 F201 L204 V205 V208 L246 L247 Y248 G253 F254V170-L250 HydrophobicContact CB-CD2 4.49Å; V170-L250 HydrophobicContact CG1-CD2 3.89Å; V170-L250 HydrophobicContact CG1-CG 4.31Å; V170-L250 HydrophobicContact CG2-CD2 3.72Å; V170-L250 HydrophobicContact CG2-CG 4.2Å; F201-L250 HydrophobicContact CE2-CD2 4.18Å; F201-L250 HydrophobicContact CZ-CD2 4.09Å; L204-L250 HydrophobicContact CB-CD2 3.93Å; V205-L250 HydrophobicContact CG2-CB 4.13Å; V205-L250 HydrophobicContact CG2-CD2 4.04Å; V208-L250 HydrophobicContact CB-CD1 4.15Å; V208-L250 HydrophobicContact CG1-CD1 3.5Å; V208-L250 HydrophobicContact CG2-CD1 3.58Å; L246-L250 HydrophobicContact CD1-CD1 3.8Å; L246-L250 HydrophobicContact CD1-CG 4.19Å; L246-L250 HydrophobicContact CG-CD1 3.85Å; L246-L250 WeakPolarHBondContact O-CB 3.49Å; L246-L250 WeakPolarHBondContact O-CG 3.47Å; L246-L250 PolarHBondContact O-N 3.39Å; L247-L250 PolarHBondContact O-N 2.68Å; Y248-L250 VanDerWaalsContact C-N 3.29Å; Y248-L250 PolarHBondContact O-N 2.91Å; L250-G253 PolarHBondContact O-N 3.01Å; L250-F254 VanDerWaalsContact O-CB 3.31Å; L250-F254 WeakPolarHBondContact O-CB 3.08Å; L250-F254 PolarHBondContact O-N 3.38Å
251F96.5Very high89.1Confident0 Ų024.4 Ų24.40%012%0.123CC..Hα-helixtrans-70.2-45.7179.2-61.4-17.6000111.9V208 L247 Y248 G253 F254 S255 M314 L317 L323 L328 T331 V332 L335V208-F251 HydrophobicContact CG2-CE1 4.21Å; L247-F251 HydrophobicContact CB-CD2 4.47Å; L247-F251 HydrophobicContact CB-CE2 4.1Å; L247-F251 HydrophobicContact CB-CZ 4.49Å; L247-F251 HydrophobicContact CD2-CE1 4.38Å; L247-F251 HydrophobicContact CD2-CE2 4.08Å; L247-F251 HydrophobicContact CD2-CZ 3.71Å; L247-F251 WeakPolarHBondContact O-CB 3.49Å; L247-F251 WeakPolarHBondContact O-CD2 3.33Å; L247-F251 WeakPolarHBondContact O-CG 3.4Å; L247-F251 PolarHBondContact O-N 3Å; Y248-F251 PolarHBondContact O-N 3.04Å; F251-G253 VanDerWaalsContact C-N 3.33Å; F251-G253 PolarHBondContact O-N 3.45Å; F251-F254 PolarHBondContact O-N 3.01Å; F251-S255 PolarHBondContact O-N 3.22Å; F251-M314 HydrophobicContact CD1-CE 3.6Å; F251-M314 HydrophobicContact CD1-CG 4.38Å; F251-M314 HydrophobicContact CD1-SD 4.23Å; F251-M314 HydrophobicContact CE1-CE 4.06Å; F251-M314 HydrophobicContact CE1-CG 4.18Å; F251-M314 HydrophobicContact CG-CE 4.42Å; F251-L317 HydrophobicContact CZ-CD1 4.05Å; F251-L323 HydrophobicContact CE2-CD2 3.8Å; F251-L328 HydrophobicContact CD2-CD2 3.89Å; F251-L328 HydrophobicContact CE2-CD2 4.25Å; F251-T331 HydrophobicContact CB-CG2 4.08Å; F251-V332 HydrophobicContact CB-CG2 4.49Å; F251-V332 HydrophobicContact CD2-CG2 3.49Å; F251-V332 VanDerWaalsContact CD2-CG2 3.49Å; F251-V332 HydrophobicContact CE2-CG2 3.83Å; F251-V332 HydrophobicContact CG-CG2 4.07Å; F251-L335 WeakPolarHBondContact O-CD1 3.23Å
252D94Very high89.8Confident32 Ų3223.5 Ų23.517%0.17112%0.115CC..Hα-helixtrans-59.5-44.2172.2177.474.3000111.4R174 Y248 F254 S255 H256 T331R174-D252 IonicContact CZ-OD2 3.25Å; R174-D252 IonicContact NH1-OD2 3.58Å; R174-D252 PolarHBondContact NH1-OD2 3.49Å; R174-D252 IonicContact NH2-OD2 3.13Å; R174-D252 PolarHBondContact NH2-OD2 3.48Å; Y248-D252 HydrophobicContact CE1-CB 4.47Å; Y248-D252 WeakPolarHBondContact O-CB 3.22Å; Y248-D252 PolarHBondContact O-N 3.5Å; D252-F254 PolarHBondContact O-N 3.3Å; D252-S255 WeakPolarHBondContact O-CB 3.43Å; D252-S255 PolarHBondContact O-N 3.21Å; D252-H256 PolarHBondContact O-N 3.02Å; D252-H256 PolarHBondContact O-ND1 3.06Å; D252-H256 IonicContact OD1-CE1 3.03Å; D252-H256 PolarHBondContact OD1-CE1 3.37Å; D252-H256 IonicContact OD1-ND1 3.89Å; D252-H256 IonicContact OD2-CE1 3.54Å; D252-H256 PolarHBondContact OD2-CE1 2.7Å; D252-H256 VanDerWaalsContact OD2-CE1 3.3Å; D252-H256 IonicContact OD2-ND1 3.01Å; D252-H256 PolarHBondContact OD2-ND1 2.97Å; D252-T331 HydrophobicContact CB-CG2 4.43Å
253G93.9Very high90.2Very high4 Ų424.9 Ų24.94%0.04113%0.125CC..Hα-helixtrans-63.7-38.9176.500000112.8Q249 L250 F251 H256 G257Q249-G253 WeakPolarHBondContact O-CA 3.32Å; Q249-G253 PolarHBondContact O-N 3.26Å; L250-G253 PolarHBondContact O-N 3.01Å; F251-G253 VanDerWaalsContact C-N 3.33Å; F251-G253 PolarHBondContact O-N 3.45Å; G253-H256 PolarHBondContact O-N 3.16Å; G253-G257 PolarHBondContact O-N 2.96Å
254F96.1Very high90.4Very high0 Ų024.4 Ų24.40%012%0.123CC..Hα-helixtrans-66.1-41.7175.4-169.8-85.1000111.2F201 V205 L250 F251 D252 H256 G257 L258 F261 I307 C310 L311 M314 L335F201-F254 HydrophobicContact CE1-CB 3.96Å; F201-F254 HydrophobicContact CE1-CD2 4.49Å; V205-F254 HydrophobicContact CB-CD2 4.32Å; V205-F254 HydrophobicContact CG1-CD2 4.07Å; V205-F254 HydrophobicContact CG2-CB 4.28Å; V205-F254 HydrophobicContact CG2-CD2 4Å; L250-F254 VanDerWaalsContact O-CB 3.31Å; L250-F254 WeakPolarHBondContact O-CB 3.08Å; L250-F254 PolarHBondContact O-N 3.38Å; F251-F254 PolarHBondContact O-N 3.01Å; D252-F254 PolarHBondContact O-N 3.3Å; F254-H256 PolarHBondContact O-N 2.93Å; F254-G257 CarbonylContact O-C 3.57Å; F254-G257 PolarHBondContact O-N 3.46Å; F254-G257 VanDerWaalsContact O-N 3.1Å; F254-L258 HydrophobicContact CD1-CD1 4.25Å; F254-L258 HydrophobicContact CD1-CD2 4.42Å; F254-L258 HydrophobicContact CD1-CG 4.03Å; F254-L258 HydrophobicContact CE1-CD1 4.27Å; F254-L258 HydrophobicContact CE1-CD2 3.8Å; F254-L258 HydrophobicContact CE1-CG 3.92Å; F254-L258 HydrophobicContact CZ-CD2 4.47Å; F254-L258 WeakPolarHBondContact O-CG 3.45Å; F254-L258 PolarHBondContact O-N 2.87Å; F254-F261 AromaticContact CD2-CE2 3.78Å; F254-F261 HydrophobicContact CD2-CE2 3.78Å; F254-F261 HydrophobicContact CD2-CZ 4.46Å; F254-F261 HydrophobicContact CE2-CD2 4.46Å; F254-F261 AromaticContact CE2-CE2 3.84Å; F254-F261 HydrophobicContact CE2-CE2 3.84Å; F254-F261 HydrophobicContact CG-CE2 4.23Å; F254-F261 HydrophobicContact CZ-CE2 4.35Å; F254-I307 HydrophobicContact CZ-CB 4.48Å; F254-I307 HydrophobicContact CZ-CG2 4.07Å; F254-C310 HydrophobicContact CD2-CB 4.49Å; F254-C310 HydrophobicContact CE2-CB 3.67Å; F254-C310 HydrophobicContact CZ-CB 3.74Å; F254-L311 HydrophobicContact CE1-CD2 3.95Å; F254-L311 HydrophobicContact CE1-CG 4.2Å; F254-L311 HydrophobicContact CZ-CG 4.41Å; F254-M314 HydrophobicContact CB-CE 4.06Å; F254-M314 HydrophobicContact CD1-CE 3.96Å; F254-M314 HydrophobicContact CD2-CE 4.35Å; F254-M314 HydrophobicContact CE1-CE 4.44Å; F254-M314 HydrophobicContact CG-CE 3.87Å; F254-L335 HydrophobicContact CB-CD1 4.21Å; F254-L335 HydrophobicContact CD1-CD1 3.77Å; F254-L335 HydrophobicContact CD1-CD2 4.1Å; F254-L335 HydrophobicContact CD1-CG 4.2Å; F254-L335 HydrophobicContact CE1-CD2 4.25Å; F254-L335 HydrophobicContact CG-CD1 4.43Å
255S92.7Very high90.4Very high27 Ų2722.8 Ų22.819%0.18912%0.116CC..Hα-helixtrans-55.5-51.7175.4-171.70000111.2F251 D252 G257 L258F251-S255 PolarHBondContact O-N 3.22Å; D252-S255 WeakPolarHBondContact O-CB 3.43Å; D252-S255 PolarHBondContact O-N 3.21Å; S255-G257 VanDerWaalsContact C-N 3.29Å; S255-G257 PolarHBondContact O-N 3.27Å; S255-L258 PolarHBondContact O-N 3.12Å
256H87.4Confident90.2Very high97 Ų9723.3 Ų23.345%0.44912%0.121SC..Hα-helixtrans-65.2-32.3175.7-66.4123.5000113.1R174 D252 G253 F254R174-H256 PolarHBondContact NH2-ND1 3.1Å; D252-H256 PolarHBondContact O-N 3.02Å; D252-H256 PolarHBondContact O-ND1 3.06Å; D252-H256 IonicContact OD1-CE1 3.03Å; D252-H256 PolarHBondContact OD1-CE1 3.37Å; D252-H256 IonicContact OD1-ND1 3.89Å; D252-H256 IonicContact OD2-CE1 3.54Å; D252-H256 PolarHBondContact OD2-CE1 2.7Å; D252-H256 VanDerWaalsContact OD2-CE1 3.3Å; D252-H256 IonicContact OD2-ND1 3.01Å; D252-H256 PolarHBondContact OD2-ND1 2.97Å; G253-H256 PolarHBondContact O-N 3.16Å; F254-H256 PolarHBondContact O-N 2.93Å
257G90.7Very high89.8Confident2 Ų226.1 Ų26.12%0.02114%0.141CC..Hα-helixtrans-72.9-23.1179.200000114.5G253 F254 S255 M259 Y260 F261G253-G257 PolarHBondContact O-N 2.96Å; F254-G257 CarbonylContact O-C 3.57Å; F254-G257 PolarHBondContact O-N 3.46Å; F254-G257 VanDerWaalsContact O-N 3.1Å; S255-G257 VanDerWaalsContact C-N 3.29Å; S255-G257 PolarHBondContact O-N 3.27Å; G257-M259 VanDerWaalsContact C-N 3.29Å; G257-M259 PolarHBondContact O-N 2.84Å; G257-Y260 WeakPolarHBondContact O-CA 3.15Å; G257-Y260 WeakPolarHBondContact O-CB 3.36Å; G257-Y260 PolarHBondContact O-N 3.5Å; G257-F261 WeakPolarHBondContact O-CD1 3.34Å; G257-F261 WeakPolarHBondContact O-CD2 3.3Å; G257-F261 VanDerWaalsContact O-CG 3.22Å; G257-F261 WeakPolarHBondContact O-CG 3.48Å; G257-F261 PolarHBondContact O-N 2.99Å
258L90Very high89.2Confident1 Ų129.4 Ų29.41%0.00516%0.161CC..Hα-helixtrans-53.9-41.3-174.8-87.8163.8000113.4F254 S255 Y260 N262 L335 Y338 A339 M342F254-L258 HydrophobicContact CD1-CD1 4.25Å; F254-L258 HydrophobicContact CD1-CD2 4.42Å; F254-L258 HydrophobicContact CD1-CG 4.03Å; F254-L258 HydrophobicContact CE1-CD1 4.27Å; F254-L258 HydrophobicContact CE1-CD2 3.8Å; F254-L258 HydrophobicContact CE1-CG 3.92Å; F254-L258 HydrophobicContact CZ-CD2 4.47Å; F254-L258 WeakPolarHBondContact O-CG 3.45Å; F254-L258 PolarHBondContact O-N 2.87Å; S255-L258 PolarHBondContact O-N 3.12Å; L258-Y260 PolarHBondContact O-N 3.23Å; L258-N262 WeakPolarHBondContact O-CB 3.39Å; L258-N262 PolarHBondContact O-N 3Å; L258-L335 HydrophobicContact CD1-CD2 4.21Å; L258-L335 HydrophobicContact CD1-CG 4.06Å; L258-Y338 HydrophobicContact CB-CD1 4.26Å; L258-Y338 HydrophobicContact CB-CE1 3.91Å; L258-Y338 HydrophobicContact CD1-CD1 3.81Å; L258-Y338 HydrophobicContact CD1-CE1 4.33Å; L258-A339 HydrophobicContact CD1-CB 4.18Å; L258-M342 HydrophobicContact CB-SD 4.21Å
259M88.2Confident88.3Confident88 Ų8833.3 Ų33.343%0.43319%0.186SC..Hα-helixtrans-62.3-42.3175.3-70.3-173.17900112.3V190 G257 N262 S263 Y338V190-M259 HydrophobicContact CG1-CB 4.47Å; V190-M259 HydrophobicContact CG2-CB 4.46Å; V190-M259 HydrophobicContact CG2-CE 3.91Å; G257-M259 VanDerWaalsContact C-N 3.29Å; G257-M259 PolarHBondContact O-N 2.84Å; M259-N262 WeakPolarHBondContact O-CB 3.1Å; M259-N262 PolarHBondContact O-N 2.82Å; M259-S263 PolarHBondContact O-N 2.65Å; M259-S263 PolarHBondContact O-OG 3.29Å; M259-Y338 HydrophobicContact CG-CE1 4.32Å; M259-Y338 WeakPolarHBondContact CG-OH 3.44Å; M259-Y338 PolarHBondContact SD-OH 3.2Å; M259-Y338 VanDerWaalsContact SD-OH 3.37Å
260Y90.6Very high87.1Confident44 Ų4433.9 Ų33.917%0.17319%0.191CC..Hα-helixtrans-71.6-40.2-178.6-68.6-91.4000111.4I177 T178 V190 P193 G257 L258 N262 S263 A264I177-Y260 HydrophobicContact CG2-CG 3.99Å; I177-Y260 VanDerWaalsContact O-CD1 3.3Å; I177-Y260 WeakPolarHBondContact O-CD1 3.29Å; T178-Y260 HydrophobicContact CG2-CD2 3.89Å; T178-Y260 HydrophobicContact CG2-CE2 3.6Å; T178-Y260 HydrophobicContact CG2-CG 4.49Å; T178-Y260 WeakPolarHBondContact O-CE1 3.4Å; T178-Y260 PolarHBondContact O-OH 3.19Å; V190-Y260 HydrophobicContact CG1-CD1 3.68Å; V190-Y260 HydrophobicContact CG1-CD2 4.43Å; V190-Y260 HydrophobicContact CG1-CE1 3.84Å; V190-Y260 HydrophobicContact CG1-CG 4.02Å; P193-Y260 WeakPolarHBondContact CD-O 3.38Å; P193-Y260 WeakPolarHBondContact CG-O 3.45Å; G257-Y260 WeakPolarHBondContact O-CA 3.15Å; G257-Y260 WeakPolarHBondContact O-CB 3.36Å; G257-Y260 PolarHBondContact O-N 3.5Å; L258-Y260 PolarHBondContact O-N 3.23Å; Y260-N262 VanDerWaalsContact C-N 3.27Å; Y260-N262 PolarHBondContact O-N 2.69Å; Y260-S263 PolarHBondContact O-N 2.97Å; Y260-A264 PolarHBondContact O-N 2.82Å
261F90.6Very high85.6Confident0 Ų041.3 Ų41.30%022%0.219CC..Hα-helixtrans-58.7-43.1172.1-56.9-24.8000111.1I177 C198 F201 F254 G257 A264 L265 I307I177-F261 HydrophobicContact CD1-CE1 3.96Å; I177-F261 HydrophobicContact CD1-CZ 4.42Å; I177-F261 HydrophobicContact CG2-CE1 4.17Å; C198-F261 HydrophobicContact CB-CD1 3.7Å; C198-F261 HydrophobicContact CB-CE1 3.75Å; F201-F261 HydrophobicContact CD1-CZ 4.12Å; F254-F261 AromaticContact CD2-CE2 3.78Å; F254-F261 HydrophobicContact CD2-CE2 3.78Å; F254-F261 HydrophobicContact CD2-CZ 4.46Å; F254-F261 HydrophobicContact CE2-CD2 4.46Å; F254-F261 AromaticContact CE2-CE2 3.84Å; F254-F261 HydrophobicContact CE2-CE2 3.84Å; F254-F261 HydrophobicContact CG-CE2 4.23Å; F254-F261 HydrophobicContact CZ-CE2 4.35Å; G257-F261 WeakPolarHBondContact O-CD1 3.34Å; G257-F261 WeakPolarHBondContact O-CD2 3.3Å; G257-F261 VanDerWaalsContact O-CG 3.22Å; G257-F261 WeakPolarHBondContact O-CG 3.48Å; G257-F261 PolarHBondContact O-N 2.99Å; F261-A264 PolarHBondContact O-N 3.23Å; F261-L265 WeakPolarHBondContact O-CB 3.46Å; F261-L265 VanDerWaalsContact O-CG 3.32Å; F261-L265 WeakPolarHBondContact O-CG 3.42Å; F261-L265 PolarHBondContact O-N 2.75Å; F261-I307 HydrophobicContact CB-CD1 3.68Å; F261-I307 HydrophobicContact CD2-CD1 4.25Å; F261-I307 HydrophobicContact CD2-CG1 4.25Å; F261-I307 HydrophobicContact CG-CD1 4.15Å
262N85.7Confident84Confident41 Ų4141.4 Ų41.422%0.21922%0.22CC..Hα-helixtrans-62.4-47175.2176.739.9000112.2L258 M259 Y260 A264 L265 A266 V272 M342 Q346L258-N262 WeakPolarHBondContact O-CB 3.39Å; L258-N262 PolarHBondContact O-N 3Å; M259-N262 WeakPolarHBondContact O-CB 3.1Å; M259-N262 PolarHBondContact O-N 2.82Å; Y260-N262 VanDerWaalsContact C-N 3.27Å; Y260-N262 PolarHBondContact O-N 2.69Å; N262-A264 VanDerWaalsContact C-N 3.35Å; N262-A264 PolarHBondContact O-N 3.34Å; N262-L265 PolarHBondContact O-N 3.39Å; N262-A266 WeakPolarHBondContact O-CB 3.43Å; N262-A266 PolarHBondContact O-N 3.35Å; N262-V272 HydrophobicContact CB-CG2 3.93Å; N262-V272 WeakPolarHBondContact OD1-CG2 3.47Å; N262-M342 HydrophobicContact CB-CE 3.54Å; N262-M342 VanDerWaalsContact ND2-CE 3.34Å; N262-M342 WeakPolarHBondContact ND2-CE 3.37Å; N262-Q346 VanDerWaalsContact CG-NE2 3.32Å; N262-Q346 PolarHBondContact OD1-NE2 2.84Å
263S84.6Confident82.4Confident31 Ų3140 Ų4022%0.21721%0.212CC..Hα-helixtrans-59.1-43175.9-66.20000112.6V190 M259 Y260 S267V190-S263 VanDerWaalsContact CG1-OG 3.24Å; V190-S263 WeakPolarHBondContact CG1-OG 3.1Å; M259-S263 PolarHBondContact O-N 2.65Å; M259-S263 PolarHBondContact O-OG 3.29Å; Y260-S263 PolarHBondContact O-N 2.97Å; S263-S267 WeakPolarHBondContact O-CB 3.39Å; S263-S267 PolarHBondContact O-N 3.26Å
264A86.5Confident80.9Confident0 Ų043.6 Ų43.60%023%0.231CC..Hα-helixtrans-59.1-51.317500000111.8P193 Y260 F261 N262 S267P193-A264 HydrophobicContact CG-CB 3.67Å; Y260-A264 PolarHBondContact O-N 2.82Å; F261-A264 PolarHBondContact O-N 3.23Å; N262-A264 VanDerWaalsContact C-N 3.35Å; N262-A264 PolarHBondContact O-N 3.34Å; A264-S267 PolarHBondContact O-N 3.49Å; A264-S267 PolarHBondContact O-OG 3.28Å
265L85Confident79.2Confident0 Ų044 Ų440%024%0.235CC..Hα-helixtrans-70.4-37.9-177.4-67.1179.3000113F261 N262 S267 V268 N269 V270 V272 A300 L303 I307F261-L265 WeakPolarHBondContact O-CB 3.46Å; F261-L265 VanDerWaalsContact O-CG 3.32Å; F261-L265 WeakPolarHBondContact O-CG 3.42Å; F261-L265 PolarHBondContact O-N 2.75Å; N262-L265 PolarHBondContact O-N 3.39Å; L265-S267 VanDerWaalsContact C-N 3.3Å; L265-S267 PolarHBondContact O-N 2.68Å; L265-V268 CarbonylContact O-C 3.43Å; L265-V268 VanDerWaalsContact O-CG2 3.23Å; L265-V268 WeakPolarHBondContact O-CG2 3.27Å; L265-V268 PolarHBondContact O-N 2.87Å; L265-N269 PolarHBondContact O-N 3.28Å; L265-V270 CarbonylContact C-O 3.56Å; L265-V270 HydrophobicContact CB-CB 4.42Å; L265-V270 WeakPolarHBondContact CB-O 3.21Å; L265-V270 HydrophobicContact CD2-CB 4.19Å; L265-V270 HydrophobicContact CD2-CG1 4.04Å; L265-V270 PolarHBondContact O-N 2.99Å; L265-V272 HydrophobicContact CB-CG2 3.9Å; L265-V272 HydrophobicContact CD1-CB 4.05Å; L265-V272 HydrophobicContact CD1-CG1 3.99Å; L265-V272 HydrophobicContact CD1-CG2 3.9Å; L265-A300 HydrophobicContact CD2-CB 3.9Å; L265-A300 WeakPolarHBondContact CD2-O 3.3Å; L265-L303 HydrophobicContact CD1-CG 4.48Å; L265-L303 HydrophobicContact CD2-CB 4.2Å; L265-L303 HydrophobicContact CD2-CD2 3.97Å; L265-L303 HydrophobicContact CD2-CG 4.19Å; L265-L303 HydrophobicContact CG-CD2 4.16Å; L265-L303 HydrophobicContact CG-CG 4.49Å; L265-I307 HydrophobicContact CD1-CD1 3.73Å
266A81.8Confident77.8Confident28 Ų2843.2 Ų43.223%0.23123%0.23CC..Hα-helixtrans-62.6-37.4174.800000111.7N262 V268 N269 W353N262-A266 WeakPolarHBondContact O-CB 3.43Å; N262-A266 PolarHBondContact O-N 3.35Å; A266-V268 PolarHBondContact O-N 3.34Å; A266-V268 VanDerWaalsContact O-N 3.14Å; A266-N269 PolarHBondContact O-N 3.46Å; A266-N269 VanDerWaalsContact O-N 3.11Å; A266-W353 HydrophobicContact CB-CH2 4.41Å
267S80Confident76.6Confident60 Ų6039 Ų3942%0.4221%0.21SC..Hα-helixtrans-61.6-22.5178.378.20000114.3S263 A264 L265S263-S267 WeakPolarHBondContact O-CB 3.39Å; S263-S267 PolarHBondContact O-N 3.26Å; A264-S267 PolarHBondContact O-N 3.49Å; A264-S267 PolarHBondContact O-OG 3.28Å; L265-S267 VanDerWaalsContact C-N 3.3Å; L265-S267 PolarHBondContact O-N 2.68Å
268V79Confident75.2Confident69 Ų6942 Ų4242%0.41822%0.223SC..THydrogen-bonded Turntrans-113.514.6179.5-63.80000112.7L265 A266 V270 A300L265-V268 CarbonylContact O-C 3.43Å; L265-V268 VanDerWaalsContact O-CG2 3.23Å; L265-V268 WeakPolarHBondContact O-CG2 3.27Å; L265-V268 PolarHBondContact O-N 2.87Å; A266-V268 PolarHBondContact O-N 3.34Å; A266-V268 VanDerWaalsContact O-N 3.14Å; V268-V270 VanDerWaalsContact C-N 3.27Å; V268-V270 HydrophobicContact CG2-CB 4.24Å; V268-V270 HydrophobicContact CG2-CG2 4Å; V268-V270 PolarHBondContact O-N 3.45Å; V268-A300 HydrophobicContact CG2-CB 3.49Å; V268-A300 VanDerWaalsContact CG2-CB 3.49Å
269N74.1Confident73.7Confident147 Ų14748.5 Ų48.579%0.78625%0.248SC*.THydrogen-bonded Turntrans56.632.4-179.5-63.2-42.6000114.7L265 A266L265-N269 PolarHBondContact O-N 3.28Å; A266-N269 PolarHBondContact O-N 3.46Å; A266-N269 VanDerWaalsContact O-N 3.11Å
270V66.7Low71.9Confident38 Ų3850.6 Ų50.623%0.2327%0.266CS..  trans-100.3134.7173.5175.20000109.5L265 V268 A300L265-V270 CarbonylContact C-O 3.56Å; L265-V270 HydrophobicContact CB-CB 4.42Å; L265-V270 WeakPolarHBondContact CB-O 3.21Å; L265-V270 HydrophobicContact CD2-CB 4.19Å; L265-V270 HydrophobicContact CD2-CG1 4.04Å; L265-V270 PolarHBondContact O-N 2.99Å; V268-V270 VanDerWaalsContact C-N 3.27Å; V268-V270 HydrophobicContact CG2-CB 4.24Å; V268-V270 HydrophobicContact CG2-CG2 4Å; V268-V270 PolarHBondContact O-N 3.45Å; V270-A300 HydrophobicContact CB-CB 4.27Å; V270-A300 HydrophobicContact CG2-CB 3.78Å
271R63.9Low69.8Low158 Ų15851.8 Ų51.860%0.59628%0.28SS*.  trans-71.8137176-71-172.3179.6-177.5-0110.8S304R271-S304 WeakPolarHBondContact O-CB 3.39Å; R271-S304 PolarHBondContact O-OG 3.27Å
272V63.1Low67.6Low2 Ų254.5 Ų54.51%0.01230%0.299CS..SBendtrans-79.7-55.7-179.3-170.30000111.3N262 L265 S304 I307 N308 Q346N262-V272 HydrophobicContact CB-CG2 3.93Å; N262-V272 WeakPolarHBondContact OD1-CG2 3.47Å; L265-V272 HydrophobicContact CB-CG2 3.9Å; L265-V272 HydrophobicContact CD1-CB 4.05Å; L265-V272 HydrophobicContact CD1-CG1 3.99Å; L265-V272 HydrophobicContact CD1-CG2 3.9Å; V272-S304 PolarHBondContact O-OG 3.33Å; V272-I307 HydrophobicContact CG1-CD1 4.16Å; V272-I307 HydrophobicContact CG1-CG2 4.42Å; V272-N308 PolarHBondContact O-ND2 3.4Å; V272-Q346 VanDerWaalsContact CG2-NE2 3.27Å
273L60.2Low65.7Low2 Ų255.6 Ų55.61%0.0130%0.304CS..  trans-124.3106-168.2-57.9175.3000107.6G275 W277 I307 L311 A339 M342 A343L273-G275 PolarHBondContact O-N 3.42Å; L273-W277 HydrophobicContact CD1-CZ2 4.43Å; L273-I307 HydrophobicContact CD2-CG2 3.72Å; L273-L311 HydrophobicContact CD2-CD1 3.35Å; L273-A339 HydrophobicContact CD1-CB 4.34Å; L273-A339 WeakPolarHBondContact CD1-O 3.36Å; L273-M342 HydrophobicContact CD1-CB 4.17Å; L273-A343 HydrophobicContact CB-CB 3.78Å; L273-A343 HydrophobicContact CD1-CB 3.9Å; L273-A343 HydrophobicContact CG-CB 4.49Å
274N62.3Low63.9Low81 Ų8160.6 Ų60.643%0.43333%0.329SS..  trans-792.5174670.5000112.2A276 N308N274-A276 PolarHBondContact O-N 3.08Å; N274-A276 WeakPolarHBondContact OD1-CB 3.19Å; N274-A276 PolarHBondContact OD1-N 3.47Å; N274-N308 PolarHBondContact OD1-OD1 3.02Å; N274-N308 VanDerWaalsContact OD1-OD1 3.1Å
275G60.7Low61.6Low9 Ų965.5 Ų65.59%0.09336%0.355CS..SBendtrans68.85.6-17600000113.9L273 W277 Q278L273-G275 PolarHBondContact O-N 3.42Å; G275-W277 PolarHBondContact O-N 2.97Å; G275-Q278 WeakPolarHBondContact O-CB 3.34Å; G275-Q278 PolarHBondContact O-N 2.86Å
276A63.5Low59.7Low9 Ų967.6 Ų67.67%0.07436%0.363CS..G310 helixtrans-58.7-35.7-178.800000111.4N274 Q278 R279 R286 Y291N274-A276 PolarHBondContact O-N 3.08Å; N274-A276 WeakPolarHBondContact OD1-CB 3.19Å; N274-A276 PolarHBondContact OD1-N 3.47Å; A276-Q278 VanDerWaalsContact C-N 3.34Å; A276-Q278 PolarHBondContact O-N 3.28Å; A276-R279 PolarHBondContact O-N 3.33Å; A276-R286 PolarHBondContact O-NH2 2.95Å; A276-Y291 VanDerWaalsContact CB-OH 3.26Å; A276-Y291 WeakPolarHBondContact CB-OH 3.2Å
277W62.2Low58Low9 Ų974.9 Ų74.93%0.03439%0.392CS..G310 helixtrans-67.7-28.4176.761.1-92.2000113.1L273 G275 R286 N308 L311 T312 R315 L336 A339 A343L273-W277 HydrophobicContact CD1-CZ2 4.43Å; G275-W277 PolarHBondContact O-N 2.97Å; W277-R286 VanDerWaalsContact CA-NH2 3.26Å; W277-R286 PolarHBondContact O-NH2 2.93Å; W277-R286 VanDerWaalsContact O-NH2 3.09Å; W277-N308 VanDerWaalsContact CD1-OD1 3.25Å; W277-L311 HydrophobicContact CB-CB 4.07Å; W277-L311 HydrophobicContact CD2-CB 4.04Å; W277-L311 HydrophobicContact CD2-CD1 4.08Å; W277-L311 HydrophobicContact CE3-CB 4.44Å; W277-L311 HydrophobicContact CG-CB 3.85Å; W277-L311 HydrophobicContact CG-CD1 4.16Å; W277-L311 HydrophobicContact CZ2-CD1 4.22Å; W277-T312 WeakPolarHBondContact CB-OG1 3.34Å; W277-R315 WeakPolarHBondContact O-CD 3.46Å; W277-R315 PolarHBondContact O-NH1 3.32Å; W277-L336 HydrophobicContact CE3-CD2 4.11Å; W277-L336 WeakPolarHBondContact CH2-O 3.49Å; W277-L336 HydrophobicContact CZ3-CD2 3.99Å; W277-A339 HydrophobicContact CH2-CB 3.73Å; W277-A339 HydrophobicContact CZ2-CB 3.72Å; W277-A343 HydrophobicContact CZ2-CB 4.46Å
278Q61.7Low56Low65 Ų6578.7 Ų78.730%0.30441%0.408SS..G310 helixtrans-73.1-23.7177.8-67.7173.7-35.700113.4G275 A276 T280 S340G275-Q278 WeakPolarHBondContact O-CB 3.34Å; G275-Q278 PolarHBondContact O-N 2.86Å; A276-Q278 VanDerWaalsContact C-N 3.34Å; A276-Q278 PolarHBondContact O-N 3.28Å; Q278-T280 PolarHBondContact O-N 3.34Å; Q278-T280 VanDerWaalsContact O-N 3.13Å; Q278-S340 PolarHBondContact NE2-OG 2.78Å
279R58.2Low54.2Low137 Ų13779.1 Ų79.152%0.51741%0.408SS..  trans-53.1121.9-173.5-68.4-176-178.4169.31111.2A276 C281 R315A276-R279 PolarHBondContact O-N 3.33Å; R279-C281 PolarHBondContact O-N 3.06Å; R279-R315 PolarHBondContact O-NH1 3.45Å; R279-R315 PolarHBondContact O-NH2 3.5Å
280T50.2Low52.6Low133 Ų13376.7 Ų76.782%0.81640%0.402SS*.  trans-74.6-0.3-178.145.70000114.1Q278Q278-T280 PolarHBondContact O-N 3.34Å; Q278-T280 VanDerWaalsContact O-N 3.13Å
281C45Very low51.6Low69 Ų6980.7 Ų80.747%0.46641%0.414SS..SBendtrans-55.1152.6176.8-55.60000111.5R279 D285R279-C281 PolarHBondContact O-N 3.06Å; C281-D285 HydrophobicContact CB-CB 4.43Å
282S45.1Very low50.4Low56 Ų5681.3 Ų81.339%0.39242%0.424SS..  trans-55.3145.2178.680.10000109.8D284 D285S282-D284 PolarHBondContact O-N 3.39Å; S282-D284 VanDerWaalsContact O-N 3.17Å; S282-D285 PolarHBondContact N-OD2 3.01Å; S282-D285 PolarHBondContact O-N 3.27Å; S282-D285 VanDerWaalsContact O-N 3.08Å; S282-D285 VanDerWaalsContact OG-CG 3.26Å; S282-D285 PolarHBondContact OG-N 3.39Å; S282-D285 PolarHBondContact OG-OD2 2.94Å
283L46.8Very low49.4Very low65 Ų6585.4 Ų85.434%0.3445%0.45SS..G310 helixtrans-56.4-31.4178.2-74.4165.3000111.1D285 R286 E320L283-D285 VanDerWaalsContact C-N 3.32Å; L283-D285 PolarHBondContact O-N 3.32Å; L283-R286 WeakPolarHBondContact O-CB 3.19Å; L283-R286 PolarHBondContact O-N 3.15Å; L283-E320 HydrophobicContact CD1-CG 4.33Å
284D45.8Very low48.4Very low136 Ų13688.9 Ų88.973%0.72747%0.474SS*.G310 helixtrans-64.4-30.9178.4-64.8-29.4000113.3S282 R286S282-D284 PolarHBondContact O-N 3.39Å; S282-D284 VanDerWaalsContact O-N 3.17Å; D284-R286 PolarHBondContact O-N 3.45Å
285D39.1Very low47.6Very low103 Ų10391.7 Ų91.755%0.55150%0.495SS*.G310 helixtrans-69.8-13.3178.2-65.4-52.3000112.5C281 S282 L283C281-D285 HydrophobicContact CB-CB 4.43Å; S282-D285 PolarHBondContact N-OD2 3.01Å; S282-D285 PolarHBondContact O-N 3.27Å; S282-D285 VanDerWaalsContact O-N 3.08Å; S282-D285 VanDerWaalsContact OG-CG 3.26Å; S282-D285 PolarHBondContact OG-N 3.39Å; S282-D285 PolarHBondContact OG-OD2 2.94Å; L283-D285 VanDerWaalsContact C-N 3.32Å; L283-D285 PolarHBondContact O-N 3.32Å
286R44.7Very low47Very low44 Ų4498.2 Ų98.217%0.16653%0.528CS..G310 helixtrans-91.8-17.1-173.6-66.7178.4133.9170.83.3115.2A276 W277 L283 D284 N288 D289A276-R286 PolarHBondContact O-NH2 2.95Å; W277-R286 VanDerWaalsContact CA-NH2 3.26Å; W277-R286 PolarHBondContact O-NH2 2.93Å; W277-R286 VanDerWaalsContact O-NH2 3.09Å; L283-R286 WeakPolarHBondContact O-CB 3.19Å; L283-R286 PolarHBondContact O-N 3.15Å; D284-R286 PolarHBondContact O-N 3.45Å; R286-N288 PolarHBondContact O-N 2.92Å; R286-D289 PolarHBondContact O-N 3.4Å
287E45.2Very low47Very low181 Ų181100 Ų10085%0.84654%0.539SS*.THydrogen-bonded Turntrans-57.6-21.1174.8-100.5-173.9168.300112.1
288N37.9Very low48Very low140 Ų140103.7 Ų103.775%0.74956%0.563SS**THydrogen-bonded Turntrans-85.7-12.4176.4-68.1-43.4000114.8R286 S290R286-N288 PolarHBondContact O-N 2.92Å; N288-S290 PolarHBondContact O-N 3.35Å
289D42Very low49.1Very low78 Ų78103.2 Ų103.242%0.41757%0.567SS.*  trans-78.966.3171-97.4-4.1000108.3R286 Y291R286-D289 PolarHBondContact O-N 3.4Å; D289-Y291 HydrophobicContact CB-CD2 4.07Å; D289-Y291 HydrophobicContact CB-CE2 3.92Å; D289-Y291 PolarHBondContact O-N 3.49Å
290S40Very low50.4Low96 Ų9697 Ų9767%0.67155%0.545SS*.  trans-62.486.5161.156.10000107.6N288 Q292N288-S290 PolarHBondContact O-N 3.35Å; S290-Q292 PolarHBondContact O-N 3.14Å
291Y47.2Very low52Low122 Ų12292.2 Ų92.248%0.47852%0.517SS..  trans-65.480.7165.4-84.9-89.1000106.8A276 D289 P293A276-Y291 VanDerWaalsContact CB-OH 3.26Å; A276-Y291 WeakPolarHBondContact CB-OH 3.2Å; D289-Y291 HydrophobicContact CB-CD2 4.07Å; D289-Y291 HydrophobicContact CB-CE2 3.92Å; D289-Y291 PolarHBondContact O-N 3.49Å; Y291-P293 VanDerWaalsContact O-CD 3.31Å; Y291-P293 WeakPolarHBondContact O-CD 3.43Å
292Q37.7Very low54Low171 Ų17192.8 Ų92.880%0.79951%0.509SS*.  trans-63.3118.6174.5-137.9170.17.800105.9S290 S294S290-Q292 PolarHBondContact O-N 3.14Å; Q292-S294 PolarHBondContact O-N 2.86Å
293P41.3Very low56.2Low87 Ų8790.1 Ų90.157%0.56549%0.491SS*.  trans-57115.4175.5-18.329.2000107Y291 T295Y291-P293 VanDerWaalsContact O-CD 3.31Å; Y291-P293 WeakPolarHBondContact O-CD 3.43Å; P293-T295 PolarHBondContact O-N 3.23Å
294S40.1Very low58.1Low75 Ų7587.9 Ų87.952%0.52448%0.481SS..  trans-52.8132.3174.958.50000108.3Q292 D296 C297Q292-S294 PolarHBondContact O-N 2.86Å; S294-D296 PolarHBondContact O-N 3.16Å; S294-C297 PolarHBondContact O-N 2.88Å; S294-C297 VanDerWaalsContact O-N 3.14Å
295T45.5Very low60.1Low141 Ų14183.7 Ų83.787%0.86546%0.457SS*.THydrogen-bonded Turntrans-57.4-16.5-172.140.20000115P293P293-T295 PolarHBondContact O-N 3.23Å
296D48.1Very low62.5Low145 Ų14578.9 Ų78.978%0.77543%0.432SS*.THydrogen-bonded Turntrans-118.253.2175.8-62.4-39000111.7S294 T298S294-D296 PolarHBondContact O-N 3.16Å; D296-T298 PolarHBondContact O-N 2.93Å; D296-T298 VanDerWaalsContact O-N 3.11Å
297C63.3Low64.8Low48 Ų4876.8 Ų76.832%0.32442%0.424SS..  trans-72.9107.6-179.8-128.60000110.5S294 S301S294-C297 PolarHBondContact O-N 2.88Å; S294-C297 VanDerWaalsContact O-N 3.14Å; C297-S301 PolarHBondContact SG-OG 2.98Å
298T82.8Confident66.9Low85 Ų8568.9 Ų68.952%0.52139%0.387SS..  trans-57154.2162.464.90000110.4D296 A300 S301 Y302D296-T298 PolarHBondContact O-N 2.93Å; D296-T298 VanDerWaalsContact O-N 3.11Å; T298-A300 PolarHBondContact O-N 3.4Å; T298-A300 VanDerWaalsContact O-N 3.13Å; T298-S301 PolarHBondContact N-OG 3.46Å; T298-S301 PolarHBondContact O-N 2.95Å; T298-S301 VanDerWaalsContact O-N 3.12Å; T298-S301 PolarHBondContact O-OG 3.31Å; T298-S301 PolarHBondContact OG1-N 3.48Å; T298-S301 PolarHBondContact OG1-OG 3.32Å; T298-Y302 PolarHBondContact O-N 3.15Å
299S85.4Confident69.3Low56 Ų5667.8 Ų67.839%0.39237%0.373SS..Hα-helixtrans-54.1-35.2176.2-53.50000112.1Y302 L303S299-Y302 PolarHBondContact O-N 2.93Å; S299-L303 WeakPolarHBondContact O-CB 3.36Å; S299-L303 PolarHBondContact O-N 2.83Å
300A85.7Confident71.8Confident6 Ų664.1 Ų64.15%0.0535%0.353CS..Hα-helixtrans-68.6-45.2177.600000113.3I195 L265 V268 V270 T298 Y302 L303 S304I195-A300 HydrophobicContact CD1-CB 4.32Å; L265-A300 HydrophobicContact CD2-CB 3.9Å; L265-A300 WeakPolarHBondContact CD2-O 3.3Å; V268-A300 HydrophobicContact CG2-CB 3.49Å; V268-A300 VanDerWaalsContact CG2-CB 3.49Å; V270-A300 HydrophobicContact CB-CB 4.27Å; V270-A300 HydrophobicContact CG2-CB 3.78Å; T298-A300 PolarHBondContact O-N 3.4Å; T298-A300 VanDerWaalsContact O-N 3.13Å; A300-Y302 VanDerWaalsContact C-N 3.28Å; A300-Y302 PolarHBondContact O-N 3.48Å; A300-L303 PolarHBondContact O-N 3.15Å; A300-S304 PolarHBondContact O-N 2.92Å
301S83.9Confident74.4Confident33 Ų3359.5 Ų59.523%0.23132%0.321CS..Hα-helixtrans-64.6-35.8174.646.10000111.9C297 T298 S304 M305C297-S301 PolarHBondContact SG-OG 2.98Å; T298-S301 PolarHBondContact N-OG 3.46Å; T298-S301 PolarHBondContact O-N 2.95Å; T298-S301 VanDerWaalsContact O-N 3.12Å; T298-S301 PolarHBondContact O-OG 3.31Å; T298-S301 PolarHBondContact OG1-N 3.48Å; T298-S301 PolarHBondContact OG1-OG 3.32Å; S301-S304 PolarHBondContact O-N 3.3Å; S301-M305 PolarHBondContact O-N 2.94Å
302Y86.8Confident76.4Confident80 Ų8055.5 Ų55.531%0.31431%0.309SS..Hα-helixtrans-64.7-44.8174-176.8-120.9000111.8I199 T298 S299 A300 M305 L306I199-Y302 HydrophobicContact CD1-CD1 4.05Å; I199-Y302 HydrophobicContact CG1-CD1 4.24Å; I199-Y302 HydrophobicContact CG2-CD1 3.93Å; I199-Y302 HydrophobicContact CG2-CE1 3.63Å; T298-Y302 PolarHBondContact O-N 3.15Å; S299-Y302 PolarHBondContact O-N 2.93Å; A300-Y302 VanDerWaalsContact C-N 3.28Å; A300-Y302 PolarHBondContact O-N 3.48Å; Y302-M305 HydrophobicContact CD2-CE 3.51Å; Y302-M305 HydrophobicContact CE2-CE 3.5Å; Y302-M305 VanDerWaalsContact CE2-CE 3.5Å; Y302-M305 WeakPolarHBondContact O-CB 3.28Å; Y302-M305 PolarHBondContact O-N 3.34Å; Y302-L306 HydrophobicContact CD1-CD1 3.92Å; Y302-L306 HydrophobicContact CE1-CD1 3.53Å; Y302-L306 HydrophobicContact CE1-CG 4.27Å; Y302-L306 HydrophobicContact CE2-CD1 4.37Å; Y302-L306 HydrophobicContact CE2-CD2 4.39Å; Y302-L306 HydrophobicContact CE2-CG 4.24Å; Y302-L306 WeakPolarHBondContact O-CG 3.34Å; Y302-L306 PolarHBondContact O-N 3.21Å
303L90.2Very high79Confident0 Ų047.9 Ų47.90%028%0.277CS..Hα-helixtrans-59.3-47.3174.2175.160.5000111.9I195 C198 I199 L265 S299 A300 M305 L306 I307I195-L303 HydrophobicContact CG2-CD2 4.28Å; C198-L303 HydrophobicContact CB-CD1 3.76Å; C198-L303 HydrophobicContact CB-CD2 3.69Å; C198-L303 HydrophobicContact CB-CG 4.4Å; I199-L303 HydrophobicContact CG1-CB 3.93Å; I199-L303 HydrophobicContact CG1-CD1 4.22Å; L265-L303 HydrophobicContact CD1-CG 4.48Å; L265-L303 HydrophobicContact CD2-CB 4.2Å; L265-L303 HydrophobicContact CD2-CD2 3.97Å; L265-L303 HydrophobicContact CD2-CG 4.19Å; L265-L303 HydrophobicContact CG-CD2 4.16Å; L265-L303 HydrophobicContact CG-CG 4.49Å; S299-L303 WeakPolarHBondContact O-CB 3.36Å; S299-L303 PolarHBondContact O-N 2.83Å; A300-L303 PolarHBondContact O-N 3.15Å; L303-M305 VanDerWaalsContact C-N 3.31Å; L303-M305 PolarHBondContact O-N 3.38Å; L303-L306 PolarHBondContact O-N 3.46Å; L303-L306 VanDerWaalsContact O-N 3.15Å; L303-I307 HydrophobicContact CD1-CD1 4.06Å; L303-I307 HydrophobicContact CD1-CG1 4.17Å; L303-I307 HydrophobicContact CG-CD1 3.95Å; L303-I307 WeakPolarHBondContact O-CG1 3.34Å; L303-I307 PolarHBondContact O-N 2.81Å
304S87.9Confident81.5Confident18 Ų1843.8 Ų43.813%0.12625%0.25CC..Hα-helixtrans-56.3-45.9176.1176.90000111.7R271 V272 A300 S301 L306 I307 N308R271-S304 WeakPolarHBondContact O-CB 3.39Å; R271-S304 PolarHBondContact O-OG 3.27Å; V272-S304 PolarHBondContact O-OG 3.33Å; A300-S304 PolarHBondContact O-N 2.92Å; S301-S304 PolarHBondContact O-N 3.3Å; S304-L306 PolarHBondContact O-N 3.45Å; S304-I307 PolarHBondContact O-N 3.12Å; S304-N308 PolarHBondContact O-N 3Å; S304-N308 VanDerWaalsContact O-N 3.15Å; S304-N308 PolarHBondContact O-ND2 2.9Å
305M86.9Confident83.9Confident49 Ų4942.5 Ų42.524%0.24123%0.233CC..Hα-helixtrans-59.6-45.8175.6-175.8-169.374.200111.9S301 Y302 L303 I307 N308 R309S301-M305 PolarHBondContact O-N 2.94Å; Y302-M305 HydrophobicContact CD2-CE 3.51Å; Y302-M305 HydrophobicContact CE2-CE 3.5Å; Y302-M305 VanDerWaalsContact CE2-CE 3.5Å; Y302-M305 WeakPolarHBondContact O-CB 3.28Å; Y302-M305 PolarHBondContact O-N 3.34Å; L303-M305 VanDerWaalsContact C-N 3.31Å; L303-M305 PolarHBondContact O-N 3.38Å; M305-I307 PolarHBondContact O-N 3.11Å; M305-N308 PolarHBondContact O-N 2.76Å; M305-R309 WeakPolarHBondContact O-CB 3.23Å; M305-R309 PolarHBondContact O-N 2.67Å
306L91.2Very high86Confident2 Ų236.5 Ų36.51%0.0120%0.196CC..Hα-helixtrans-62.2-40.9178.3-73.6175.3000112.6I199 C202 L203 Y302 L303 S304 N308 R309 C310I199-L306 HydrophobicContact CB-CD1 4.47Å; I199-L306 HydrophobicContact CG2-CD1 3.87Å; C202-L306 HydrophobicContact CB-CB 3.83Å; C202-L306 HydrophobicContact CB-CD1 4.24Å; L203-L306 HydrophobicContact CD2-CD1 4.04Å; L203-L306 HydrophobicContact CD2-CD2 3.82Å; L203-L306 HydrophobicContact CG-CD1 4.02Å; Y302-L306 HydrophobicContact CD1-CD1 3.92Å; Y302-L306 HydrophobicContact CE1-CD1 3.53Å; Y302-L306 HydrophobicContact CE1-CG 4.27Å; Y302-L306 HydrophobicContact CE2-CD1 4.37Å; Y302-L306 HydrophobicContact CE2-CD2 4.39Å; Y302-L306 HydrophobicContact CE2-CG 4.24Å; Y302-L306 WeakPolarHBondContact O-CG 3.34Å; Y302-L306 PolarHBondContact O-N 3.21Å; L303-L306 PolarHBondContact O-N 3.46Å; L303-L306 VanDerWaalsContact O-N 3.15Å; S304-L306 PolarHBondContact O-N 3.45Å; L306-N308 PolarHBondContact O-N 2.97Å; L306-R309 WeakPolarHBondContact O-CB 3.48Å; L306-R309 PolarHBondContact O-N 2.96Å; L306-C310 WeakPolarHBondContact O-CB 3.49Å; L306-C310 PolarHBondContact O-N 3.44Å; L306-C310 PolarHBondContact O-SG 3.17Å
307I92Very high88.1Confident0 Ų029.6 Ų29.60%016%0.159CC..Hα-helixtrans-60-47.8176.4-68162.4000110.3F254 F261 L265 V272 L273 L303 S304 M305 R309 C310 L311F254-I307 HydrophobicContact CZ-CB 4.48Å; F254-I307 HydrophobicContact CZ-CG2 4.07Å; F261-I307 HydrophobicContact CB-CD1 3.68Å; F261-I307 HydrophobicContact CD2-CD1 4.25Å; F261-I307 HydrophobicContact CD2-CG1 4.25Å; F261-I307 HydrophobicContact CG-CD1 4.15Å; L265-I307 HydrophobicContact CD1-CD1 3.73Å; V272-I307 HydrophobicContact CG1-CD1 4.16Å; V272-I307 HydrophobicContact CG1-CG2 4.42Å; L273-I307 HydrophobicContact CD2-CG2 3.72Å; L303-I307 HydrophobicContact CD1-CD1 4.06Å; L303-I307 HydrophobicContact CD1-CG1 4.17Å; L303-I307 HydrophobicContact CG-CD1 3.95Å; L303-I307 WeakPolarHBondContact O-CG1 3.34Å; L303-I307 PolarHBondContact O-N 2.81Å; S304-I307 PolarHBondContact O-N 3.12Å; M305-I307 PolarHBondContact O-N 3.11Å; I307-R309 VanDerWaalsContact C-N 3.28Å; I307-R309 PolarHBondContact O-N 2.94Å; I307-C310 PolarHBondContact O-N 2.92Å; I307-L311 HydrophobicContact CG2-CD1 3.95Å; I307-L311 WeakPolarHBondContact O-CG 3.42Å; I307-L311 PolarHBondContact O-N 3.2Å
308N89.1Confident89.4Confident15 Ų1529.3 Ų29.38%0.0816%0.155CC..Hα-helixtrans-64.1-35.5178.5-72.5-78.6000111.7V272 N274 W277 S304 M305 L306 T312V272-N308 PolarHBondContact O-ND2 3.4Å; N274-N308 PolarHBondContact OD1-OD1 3.02Å; N274-N308 VanDerWaalsContact OD1-OD1 3.1Å; W277-N308 VanDerWaalsContact CD1-OD1 3.25Å; S304-N308 PolarHBondContact O-N 3Å; S304-N308 VanDerWaalsContact O-N 3.15Å; S304-N308 PolarHBondContact O-ND2 2.9Å; M305-N308 PolarHBondContact O-N 2.76Å; L306-N308 PolarHBondContact O-N 2.97Å; N308-T312 WeakPolarHBondContact O-CB 3.47Å; N308-T312 PolarHBondContact O-N 2.95Å; N308-T312 PolarHBondContact O-OG1 3.35Å
309R89.1Confident89.6Confident117 Ų11729.6 Ų29.644%0.44216%0.156SC..Hα-helixtrans-65.9-46.9174.5-165.9-177.5172.3169.81.1111.9D206 E210 M305 L306 I307 L311 T312 G313D206-R309 WeakPolarHBondContact OD1-CD 3.38Å; D206-R309 VanDerWaalsContact OD1-CG 3.26Å; D206-R309 WeakPolarHBondContact OD1-CG 3.47Å; D206-R309 IonicContact OD1-CZ 3.79Å; D206-R309 IonicContact OD1-NE 3Å; D206-R309 PolarHBondContact OD1-NE 3.16Å; D206-R309 WeakPolarHBondContact OD2-CD 3.33Å; D206-R309 IonicContact OD2-CZ 3.17Å; D206-R309 IonicContact OD2-NE 3.12Å; D206-R309 PolarHBondContact OD2-NE 3.03Å; D206-R309 VanDerWaalsContact OD2-NE 3.12Å; D206-R309 IonicContact OD2-NH1 3.41Å; D206-R309 PolarHBondContact OD2-NH1 3.02Å; D206-R309 IonicContact OD2-NH2 3.73Å; E210-R309 IonicContact OE1-CZ 3.71Å; E210-R309 IonicContact OE1-NE 3.69Å; E210-R309 IonicContact OE1-NH2 2.85Å; E210-R309 PolarHBondContact OE1-NH2 2.93Å; M305-R309 WeakPolarHBondContact O-CB 3.23Å; M305-R309 PolarHBondContact O-N 2.67Å; L306-R309 WeakPolarHBondContact O-CB 3.48Å; L306-R309 PolarHBondContact O-N 2.96Å; I307-R309 VanDerWaalsContact C-N 3.28Å; I307-R309 PolarHBondContact O-N 2.94Å; R309-L311 PolarHBondContact O-N 2.85Å; R309-T312 WeakPolarHBondContact O-CB 3.43Å; R309-T312 PolarHBondContact O-N 3.32Å; R309-G313 PolarHBondContact O-N 3.38Å
310C94.4Very high89.6Confident0 Ų030 Ų300%015%0.152CC..Hα-helixtrans-57.9-49.7175.8-67.30000111.5C202 V205 F254 L306 I307 T312 G313 M314C202-C310 PolarHBondContact O-SG 2.79Å; V205-C310 HydrophobicContact CG1-CB 3.88Å; F254-C310 HydrophobicContact CD2-CB 4.49Å; F254-C310 HydrophobicContact CE2-CB 3.67Å; F254-C310 HydrophobicContact CZ-CB 3.74Å; L306-C310 WeakPolarHBondContact O-CB 3.49Å; L306-C310 PolarHBondContact O-N 3.44Å; L306-C310 PolarHBondContact O-SG 3.17Å; I307-C310 PolarHBondContact O-N 2.92Å; C310-T312 VanDerWaalsContact C-N 3.27Å; C310-T312 PolarHBondContact O-N 3.22Å; C310-G313 PolarHBondContact O-N 2.98Å; C310-M314 WeakPolarHBondContact O-CB 3.32Å; C310-M314 WeakPolarHBondContact O-CG 3.48Å; C310-M314 PolarHBondContact O-N 3.22Å
311L93.5Very high89.6Confident0 Ų037.8 Ų37.80%019%0.187CC..Hα-helixtrans-61-37.4177.9-70.4170.3000112.1F254 L273 W277 I307 R309 R315 L335 L336 A339F254-L311 HydrophobicContact CE1-CD2 3.95Å; F254-L311 HydrophobicContact CE1-CG 4.2Å; F254-L311 HydrophobicContact CZ-CG 4.41Å; L273-L311 HydrophobicContact CD2-CD1 3.35Å; W277-L311 HydrophobicContact CB-CB 4.07Å; W277-L311 HydrophobicContact CD2-CB 4.04Å; W277-L311 HydrophobicContact CD2-CD1 4.08Å; W277-L311 HydrophobicContact CE3-CB 4.44Å; W277-L311 HydrophobicContact CG-CB 3.85Å; W277-L311 HydrophobicContact CG-CD1 4.16Å; W277-L311 HydrophobicContact CZ2-CD1 4.22Å; I307-L311 HydrophobicContact CG2-CD1 3.95Å; I307-L311 WeakPolarHBondContact O-CG 3.42Å; I307-L311 PolarHBondContact O-N 3.2Å; R309-L311 PolarHBondContact O-N 2.85Å; L311-R315 WeakPolarHBondContact O-CB 3.47Å; L311-R315 PolarHBondContact O-N 3.01Å; L311-L335 HydrophobicContact CD2-CD2 3.37Å; L311-L336 HydrophobicContact CD2-CD2 4.11Å; L311-A339 HydrophobicContact CD1-CB 4.1Å; L311-A339 HydrophobicContact CD2-CB 3.76Å
312T90.2Very high89.6Confident38 Ų3837 Ų3723%0.23318%0.18CC..Hα-helixtrans-65.4-48.4174.7-60.40000111.1W277 N308 R309 C310 M314 R315 T316W277-T312 WeakPolarHBondContact CB-OG1 3.34Å; N308-T312 WeakPolarHBondContact O-CB 3.47Å; N308-T312 PolarHBondContact O-N 2.95Å; N308-T312 PolarHBondContact O-OG1 3.35Å; R309-T312 WeakPolarHBondContact O-CB 3.43Å; R309-T312 PolarHBondContact O-N 3.32Å; C310-T312 VanDerWaalsContact C-N 3.27Å; C310-T312 PolarHBondContact O-N 3.22Å; T312-M314 PolarHBondContact O-N 3.42Å; T312-R315 PolarHBondContact O-N 3.36Å; T312-T316 PolarHBondContact O-N 2.96Å; T312-T316 PolarHBondContact O-OG1 2.97Å; T312-T316 VanDerWaalsContact O-OG1 3.06Å
313G91.3Very high89.6Confident11 Ų1133.4 Ų33.411%0.11317%0.166CC..Hα-helixtrans-58.9-46177.300000112.5R309 C310 R315 T316 L317R309-G313 PolarHBondContact O-N 3.38Å; C310-G313 PolarHBondContact O-N 2.98Å; G313-R315 PolarHBondContact O-N 3.07Å; G313-T316 PolarHBondContact O-N 2.99Å; G313-L317 WeakPolarHBondContact O-CG 3.41Å; G313-L317 PolarHBondContact O-N 2.95Å
314M94.2Very high89.2Confident0 Ų035.7 Ų35.70%018%0.181CC..Hα-helixtrans-61.8-42.8175.8-71.6-174.3-161.800112.7V205 F251 F254 C310 T312 L317 L318 V332 L335V205-M314 HydrophobicContact CG1-CE 3.23Å; F251-M314 HydrophobicContact CD1-CE 3.6Å; F251-M314 HydrophobicContact CD1-CG 4.38Å; F251-M314 HydrophobicContact CD1-SD 4.23Å; F251-M314 HydrophobicContact CE1-CE 4.06Å; F251-M314 HydrophobicContact CE1-CG 4.18Å; F251-M314 HydrophobicContact CG-CE 4.42Å; F254-M314 HydrophobicContact CB-CE 4.06Å; F254-M314 HydrophobicContact CD1-CE 3.96Å; F254-M314 HydrophobicContact CD2-CE 4.35Å; F254-M314 HydrophobicContact CE1-CE 4.44Å; F254-M314 HydrophobicContact CG-CE 3.87Å; C310-M314 WeakPolarHBondContact O-CB 3.32Å; C310-M314 WeakPolarHBondContact O-CG 3.48Å; C310-M314 PolarHBondContact O-N 3.22Å; T312-M314 PolarHBondContact O-N 3.42Å; M314-L317 WeakPolarHBondContact O-CB 3.43Å; M314-L317 PolarHBondContact O-N 3.48Å; M314-L318 PolarHBondContact O-N 3.5Å; M314-V332 HydrophobicContact CB-CG1 3.89Å; M314-V332 WeakPolarHBondContact O-CG1 3.3Å; M314-L335 HydrophobicContact CE-CD1 3.94Å; M314-L335 HydrophobicContact SD-CD1 3.49Å; M314-L335 WeakPolarHBondContact SD-CD1 3.36Å; M314-L335 HydrophobicContact SD-CD2 3.68Å; M314-L335 HydrophobicContact SD-CG 4.24Å
315R91.7Very high89.1Confident49 Ų4936.6 Ų36.619%0.18519%0.186CC..Hα-helixtrans-61.7-45.6175179.1179.5168.2-141.9-8.5111.4W277 R279 L311 T312 G313 L317 L318 V319 L336W277-R315 WeakPolarHBondContact O-CD 3.46Å; W277-R315 PolarHBondContact O-NH1 3.32Å; R279-R315 PolarHBondContact O-NH1 3.45Å; R279-R315 PolarHBondContact O-NH2 3.5Å; L311-R315 WeakPolarHBondContact O-CB 3.47Å; L311-R315 PolarHBondContact O-N 3.01Å; T312-R315 PolarHBondContact O-N 3.36Å; G313-R315 PolarHBondContact O-N 3.07Å; R315-L317 VanDerWaalsContact C-N 3.34Å; R315-L317 PolarHBondContact O-N 2.87Å; R315-L318 PolarHBondContact O-N 3.33Å; R315-V319 HydrophobicContact CG-CG2 4.15Å; R315-V319 WeakPolarHBondContact O-CG2 3.36Å; R315-V319 PolarHBondContact O-N 3.11Å; R315-L336 HydrophobicContact CB-CD1 4.01Å; R315-L336 HydrophobicContact CB-CD2 4.19Å; R315-L336 HydrophobicContact CG-CD1 4.5Å
316T89.4Confident89.1Confident14 Ų1444.1 Ų44.19%0.08621%0.211CC..Hα-helixtrans-60.2-45.5177.6-57.20000110.8L213 T312 G313 L318 V319 E320L213-T316 HydrophobicContact CD1-CG2 4.38Å; L213-T316 HydrophobicContact CD2-CG2 3.67Å; T312-T316 PolarHBondContact O-N 2.96Å; T312-T316 PolarHBondContact O-OG1 2.97Å; T312-T316 VanDerWaalsContact O-OG1 3.06Å; G313-T316 PolarHBondContact O-N 2.99Å; T316-L318 VanDerWaalsContact C-N 3.27Å; T316-L318 PolarHBondContact O-N 3.22Å; T316-V319 PolarHBondContact O-N 3.25Å; T316-E320 VanDerWaalsContact CG2-CD 3.48Å; T316-E320 HydrophobicContact CG2-CG 4.04Å; T316-E320 VanDerWaalsContact CG2-OE1 3.3Å; T316-E320 WeakPolarHBondContact CG2-OE1 3.41Å; T316-E320 VanDerWaalsContact O-CB 3.32Å; T316-E320 WeakPolarHBondContact O-CB 3.43Å; T316-E320 WeakPolarHBondContact O-CG 3.29Å; T316-E320 PolarHBondContact O-N 3.46Å
317L91Very high89Confident0 Ų047.1 Ų47.10%023%0.227CC..Hα-helixtrans-57-38.9175-77.1173.8000113.1C209 Q212 L213 F251 G313 M314 R315 Q322 L323C209-L317 HydrophobicContact CB-CD1 4.07Å; Q212-L317 HydrophobicContact CB-CD1 4.37Å; Q212-L317 HydrophobicContact CB-CD2 3.78Å; Q212-L317 HydrophobicContact CG-CD1 4.42Å; Q212-L317 HydrophobicContact CG-CD2 3.41Å; Q212-L317 VanDerWaalsContact CG-CD2 3.41Å; L213-L317 HydrophobicContact CD2-CD2 3.6Å; L213-L317 HydrophobicContact CD2-CG 3.94Å; L213-L317 HydrophobicContact CG-CD2 3.65Å; L213-L317 HydrophobicContact CG-CG 3.97Å; F251-L317 HydrophobicContact CZ-CD1 4.05Å; G313-L317 WeakPolarHBondContact O-CG 3.41Å; G313-L317 PolarHBondContact O-N 2.95Å; M314-L317 WeakPolarHBondContact O-CB 3.43Å; M314-L317 PolarHBondContact O-N 3.48Å; R315-L317 VanDerWaalsContact C-N 3.34Å; R315-L317 PolarHBondContact O-N 2.87Å; L317-Q322 HydrophobicContact CD2-CB 3.87Å; L317-Q322 PolarHBondContact O-N 3.38Å; L317-L323 HydrophobicContact CB-CD1 4.46Å; L317-L323 HydrophobicContact CB-CD2 3.95Å; L317-L323 HydrophobicContact CB-CG 3.96Å; L317-L323 HydrophobicContact CD1-CD2 4.14Å
318L90.5Very high88.9Confident43 Ų4347.1 Ų47.123%0.22523%0.227CC..Hα-helixtrans-72.2-47.7178.2-175.167.1000112M314 R315 T316 E321 L323 R329 V332 L333 L336M314-L318 PolarHBondContact O-N 3.5Å; R315-L318 PolarHBondContact O-N 3.33Å; T316-L318 VanDerWaalsContact C-N 3.27Å; T316-L318 PolarHBondContact O-N 3.22Å; L318-E321 PolarHBondContact O-N 3.07Å; L318-L323 HydrophobicContact CB-CD1 4.21Å; L318-L323 HydrophobicContact CD1-CD1 4.02Å; L318-R329 HydrophobicContact CD1-CB 4.14Å; L318-R329 HydrophobicContact CD1-CG 4.16Å; L318-V332 HydrophobicContact CB-CG1 4.04Å; L318-V332 HydrophobicContact CD2-CG1 4.33Å; L318-L333 HydrophobicContact CD2-CB 4.24Å; L318-L333 HydrophobicContact CD2-CD1 4.12Å; L318-L336 HydrophobicContact CD2-CD1 3.97Å
319V87.5Confident89.1Confident90 Ų9051.4 Ų51.455%0.54524%0.242SC..Hα-helixtrans-69.1-39.6-176.8171.40000111.9R315 T316 E321R315-V319 HydrophobicContact CG-CG2 4.15Å; R315-V319 WeakPolarHBondContact O-CG2 3.36Å; R315-V319 PolarHBondContact O-N 3.11Å; T316-V319 PolarHBondContact O-N 3.25Å; V319-E321 PolarHBondContact O-N 2.95Å
320E86.3Confident89.2Confident66 Ų6648.5 Ų48.531%0.30824%0.239SC..THydrogen-bonded Turntrans-79.77.1176.5-62.8-176.3-178.300112.5L283 T316 Q322L283-E320 HydrophobicContact CD1-CG 4.33Å; T316-E320 VanDerWaalsContact CG2-CD 3.48Å; T316-E320 HydrophobicContact CG2-CG 4.04Å; T316-E320 VanDerWaalsContact CG2-OE1 3.3Å; T316-E320 WeakPolarHBondContact CG2-OE1 3.41Å; T316-E320 VanDerWaalsContact O-CB 3.32Å; T316-E320 WeakPolarHBondContact O-CB 3.43Å; T316-E320 WeakPolarHBondContact O-CG 3.29Å; T316-E320 PolarHBondContact O-N 3.46Å; E320-Q322 HydrophobicContact CB-CG 3.71Å; E320-Q322 VanDerWaalsContact O-CG 3.27Å; E320-Q322 WeakPolarHBondContact O-CG 3.17Å; E320-Q322 PolarHBondContact O-N 2.78Å; E320-Q322 VanDerWaalsContact O-N 3.15Å; E320-Q322 PolarHBondContact OE2-NE2 2.93Å
321E84.7Confident89.1Confident168 Ų16849.2 Ų49.279%0.78524%0.244SC*.THydrogen-bonded Turntrans5331.1-177.8-60.3-171.2172.200114.1L318 V319 L323L318-E321 PolarHBondContact O-N 3.07Å; V319-E321 PolarHBondContact O-N 2.95Å; E321-L323 VanDerWaalsContact C-N 3.29Å; E321-L323 PolarHBondContact O-N 3.4Å
322Q84.7Confident89.2Confident18 Ų1849.2 Ų49.28%0.08424%0.244CC..  trans-89.26.5-175.3-59.3-167.29.400113.4Q212 L213 V216 L317 E320Q212-Q322 PolarHBondContact NE2-O 3.27Å; L213-Q322 VanDerWaalsContact CA-OE1 3.32Å; L213-Q322 PolarHBondContact O-OE1 2.94Å; V216-Q322 HydrophobicContact CB-CB 4.24Å; V216-Q322 HydrophobicContact CB-CG 4.06Å; V216-Q322 HydrophobicContact CG1-CB 4.23Å; V216-Q322 HydrophobicContact CG1-CG 3.7Å; V216-Q322 HydrophobicContact CG2-CB 4.03Å; V216-Q322 HydrophobicContact CG2-CG 4.39Å; L317-Q322 HydrophobicContact CD2-CB 3.87Å; L317-Q322 PolarHBondContact O-N 3.38Å; E320-Q322 HydrophobicContact CB-CG 3.71Å; E320-Q322 VanDerWaalsContact O-CG 3.27Å; E320-Q322 WeakPolarHBondContact O-CG 3.17Å; E320-Q322 PolarHBondContact O-N 2.78Å; E320-Q322 VanDerWaalsContact O-N 3.15Å; E320-Q322 PolarHBondContact OE2-NE2 2.93Å
323L86.7Confident89.3Confident3 Ų351.4 Ų51.42%0.01625%0.253CS..  trans-88.9116.7174.4-69.3172.8000110.7F251 L317 L318 E321 T325 L328 R329 V332F251-L323 HydrophobicContact CE2-CD2 3.8Å; L317-L323 HydrophobicContact CB-CD1 4.46Å; L317-L323 HydrophobicContact CB-CD2 3.95Å; L317-L323 HydrophobicContact CB-CG 3.96Å; L317-L323 HydrophobicContact CD1-CD2 4.14Å; L318-L323 HydrophobicContact CB-CD1 4.21Å; L318-L323 HydrophobicContact CD1-CD1 4.02Å; E321-L323 VanDerWaalsContact C-N 3.29Å; E321-L323 PolarHBondContact O-N 3.4Å; L323-T325 PolarHBondContact O-N 3.02Å; L323-L328 HydrophobicContact CB-CB 4.41Å; L323-L328 HydrophobicContact CD2-CB 4.42Å; L323-R329 HydrophobicContact CB-CG 3.52Å; L323-R329 HydrophobicContact CD1-CG 4.02Å; L323-R329 HydrophobicContact CG-CG 4.42Å; L323-R329 PolarHBondContact O-NE 3.41Å; L323-R329 VanDerWaalsContact O-NE 3.16Å; L323-V332 HydrophobicContact CD1-CB 3.82Å; L323-V332 HydrophobicContact CD1-CG1 4.11Å; L323-V332 HydrophobicContact CD1-CG2 3.75Å; L323-V332 HydrophobicContact CD2-CG2 4.44Å
324P80.6Confident89.3Confident49 Ų4954.5 Ų54.532%0.31827%0.268SS..  trans-69.8-32.1-164.323.8-31.6000113.3H244 L328H244-P324 WeakPolarHBondContact CD2-CG 3.49Å; H244-P324 WeakPolarHBondContact NE2-CB 3.2Å; H244-P324 WeakPolarHBondContact NE2-CG 3.49Å; P324-L328 HydrophobicContact CG-CD1 3.75Å
325T85.5Confident89.3Confident37 Ų3754.5 Ų54.523%0.22727%0.268CS..SBendtrans-115.4154.7-175.570.30000112.3H244 L323 I327 L328 R329H244-T325 HydrophobicContact CB-CG2 4.43Å; L323-T325 PolarHBondContact O-N 3.02Å; T325-I327 VanDerWaalsContact C-N 3.3Å; T325-I327 PolarHBondContact O-N 3.41Å; T325-I327 WeakPolarHBondContact OG1-CG2 3.27Å; T325-L328 HydrophobicContact CG2-CD1 4.45Å; T325-L328 PolarHBondContact O-N 3.16Å; T325-L328 WeakPolarHBondContact OG1-CB 3.41Å; T325-L328 WeakPolarHBondContact OG1-CD1 3.25Å; T325-L328 WeakPolarHBondContact OG1-CG 3.1Å; T325-L328 PolarHBondContact OG1-N 3.14Å; T325-R329 PolarHBondContact O-N 3.49Å; T325-R329 VanDerWaalsContact O-N 3.15Å; T325-R329 PolarHBondContact O-NE 3.5Å
326R88.6Confident89.3Confident207 Ų20753 Ų5378%0.78126%0.263SS*.Hα-helixtrans-63.2-37.1176.6-174179.5179.7176.10.2111.9R329 S330R326-R329 PolarHBondContact O-N 2.93Å; R326-S330 PolarHBondContact O-N 2.96Å
327I88.7Confident89.3Confident65 Ų6556.7 Ų56.733%0.33328%0.281SS..Hα-helixtrans-66.4-39.6179.3-167.8165.3000111.7Y248 T325 S330 T331Y248-I327 HydrophobicContact CD2-CD1 4.41Å; Y248-I327 HydrophobicContact CD2-CG1 4.14Å; Y248-I327 HydrophobicContact CE2-CD1 3.84Å; Y248-I327 HydrophobicContact CE2-CG1 3.73Å; T325-I327 VanDerWaalsContact C-N 3.3Å; T325-I327 PolarHBondContact O-N 3.41Å; T325-I327 WeakPolarHBondContact OG1-CG2 3.27Å; I327-S330 PolarHBondContact O-N 3.4Å; I327-T331 WeakPolarHBondContact O-CB 3.37Å; I327-T331 PolarHBondContact O-N 2.97Å; I327-T331 PolarHBondContact O-OG1 3.49Å
328L89.6Confident89.1Confident0 Ų060 Ų600%029%0.293CS..Hα-helixtrans-63-44.2173.5-73.9170.4000111.4L247 Y248 F251 L323 P324 T325 S330 T331 V332L247-L328 HydrophobicContact CB-CD1 4.12Å; L247-L328 HydrophobicContact CB-CD2 3.68Å; L247-L328 HydrophobicContact CD1-CD1 4.03Å; Y248-L328 HydrophobicContact CD2-CD2 4.47Å; F251-L328 HydrophobicContact CD2-CD2 3.89Å; F251-L328 HydrophobicContact CE2-CD2 4.25Å; L323-L328 HydrophobicContact CB-CB 4.41Å; L323-L328 HydrophobicContact CD2-CB 4.42Å; P324-L328 HydrophobicContact CG-CD1 3.75Å; T325-L328 HydrophobicContact CG2-CD1 4.45Å; T325-L328 PolarHBondContact O-N 3.16Å; T325-L328 WeakPolarHBondContact OG1-CB 3.41Å; T325-L328 WeakPolarHBondContact OG1-CD1 3.25Å; T325-L328 WeakPolarHBondContact OG1-CG 3.1Å; T325-L328 PolarHBondContact OG1-N 3.14Å; L328-S330 PolarHBondContact O-N 3.42Å; L328-T331 PolarHBondContact O-N 2.87Å; L328-V332 WeakPolarHBondContact O-CB 3.03Å; L328-V332 WeakPolarHBondContact O-CG2 3.5Å; L328-V332 PolarHBondContact O-N 3.29Å
329R92.6Very high89Confident105 Ų10557.9 Ų57.940%0.39628%0.283SS..Hα-helixtrans-58.7-46.1175.2-75.1179.3-103.1130.6-5.6112.3L318 L323 T325 R326 L333L318-R329 HydrophobicContact CD1-CB 4.14Å; L318-R329 HydrophobicContact CD1-CG 4.16Å; L323-R329 HydrophobicContact CB-CG 3.52Å; L323-R329 HydrophobicContact CD1-CG 4.02Å; L323-R329 HydrophobicContact CG-CG 4.42Å; L323-R329 PolarHBondContact O-NE 3.41Å; L323-R329 VanDerWaalsContact O-NE 3.16Å; T325-R329 PolarHBondContact O-N 3.49Å; T325-R329 VanDerWaalsContact O-N 3.15Å; T325-R329 PolarHBondContact O-NE 3.5Å; R326-R329 PolarHBondContact O-N 2.93Å; R329-L333 WeakPolarHBondContact O-CB 3.44Å; R329-L333 PolarHBondContact O-N 3Å
330S92.1Very high88.9Confident56 Ų5655.8 Ų55.839%0.39227%0.272SS..Hα-helixtrans-61.7-49.3176.4-1620000111.3R326 I327 L328 V332 L333 D334R326-S330 PolarHBondContact O-N 2.96Å; I327-S330 PolarHBondContact O-N 3.4Å; L328-S330 PolarHBondContact O-N 3.42Å; S330-V332 VanDerWaalsContact C-N 3.32Å; S330-V332 PolarHBondContact O-N 3.12Å; S330-L333 WeakPolarHBondContact O-CB 3.4Å; S330-L333 PolarHBondContact O-N 3.02Å; S330-L333 VanDerWaalsContact O-N 3.13Å; S330-D334 WeakPolarHBondContact O-CB 3.15Å; S330-D334 PolarHBondContact O-N 3.3Å; S330-D334 PolarHBondContact OG-OD2 2.87Å
331T92.8Very high88.6Confident15 Ų1558.4 Ų58.49%0.09228%0.284CS..Hα-helixtrans-58.6-44.7-178.5-53.30000111.5Y248 F251 D252 I327 L328 L335Y248-T331 HydrophobicContact CE2-CG2 4.44Å; Y248-T331 WeakPolarHBondContact CE2-OG1 3.49Å; F251-T331 HydrophobicContact CB-CG2 4.08Å; D252-T331 HydrophobicContact CB-CG2 4.43Å; I327-T331 WeakPolarHBondContact O-CB 3.37Å; I327-T331 PolarHBondContact O-N 2.97Å; I327-T331 PolarHBondContact O-OG1 3.49Å; L328-T331 PolarHBondContact O-N 2.87Å; T331-L335 WeakPolarHBondContact O-CB 3.13Å; T331-L335 PolarHBondContact O-N 3.19Å
332V93.9Very high88.5Confident0 Ų051.4 Ų51.40%025%0.252CS..Hα-helixtrans-67.9-40.2177.81690000111.5F251 M314 L318 L323 L328 S330 L335 L336F251-V332 HydrophobicContact CB-CG2 4.49Å; F251-V332 HydrophobicContact CD2-CG2 3.49Å; F251-V332 VanDerWaalsContact CD2-CG2 3.49Å; F251-V332 HydrophobicContact CE2-CG2 3.83Å; F251-V332 HydrophobicContact CG-CG2 4.07Å; M314-V332 HydrophobicContact CB-CG1 3.89Å; M314-V332 WeakPolarHBondContact O-CG1 3.3Å; L318-V332 HydrophobicContact CB-CG1 4.04Å; L318-V332 HydrophobicContact CD2-CG1 4.33Å; L323-V332 HydrophobicContact CD1-CB 3.82Å; L323-V332 HydrophobicContact CD1-CG1 4.11Å; L323-V332 HydrophobicContact CD1-CG2 3.75Å; L323-V332 HydrophobicContact CD2-CG2 4.44Å; L328-V332 WeakPolarHBondContact O-CB 3.03Å; L328-V332 WeakPolarHBondContact O-CG2 3.5Å; L328-V332 PolarHBondContact O-N 3.29Å; S330-V332 VanDerWaalsContact C-N 3.32Å; S330-V332 PolarHBondContact O-N 3.12Å; V332-L335 PolarHBondContact O-N 2.98Å; V332-L336 HydrophobicContact CG1-CD1 3.82Å; V332-L336 HydrophobicContact CG1-CG 4.3Å; V332-L336 WeakPolarHBondContact O-CB 3.47Å; V332-L336 VanDerWaalsContact O-CG 3.23Å; V332-L336 WeakPolarHBondContact O-CG 3.23Å; V332-L336 PolarHBondContact O-N 3.26Å
333L92.6Very high88.2Confident83 Ų8350.6 Ų50.644%0.43525%0.248SC..Hα-helixtrans-61.4-49.8175.8179.964.5000111.2L318 R329 S330 L335 L336 M337L318-L333 HydrophobicContact CD2-CB 4.24Å; L318-L333 HydrophobicContact CD2-CD1 4.12Å; R329-L333 WeakPolarHBondContact O-CB 3.44Å; R329-L333 PolarHBondContact O-N 3Å; S330-L333 WeakPolarHBondContact O-CB 3.4Å; S330-L333 PolarHBondContact O-N 3.02Å; S330-L333 VanDerWaalsContact O-N 3.13Å; L333-L335 VanDerWaalsContact C-N 3.31Å; L333-L335 PolarHBondContact O-N 3.2Å; L333-L336 PolarHBondContact O-N 2.86Å; L333-M337 HydrophobicContact CD1-CG 4.49Å; L333-M337 HydrophobicContact CG-CE 4.22Å; L333-M337 HydrophobicContact CG-SD 4.46Å; L333-M337 WeakPolarHBondContact O-CG 3.32Å; L333-M337 PolarHBondContact O-N 3.18Å
334D91.7Very high87.6Confident77 Ų7752.9 Ų52.941%0.41227%0.267SS..Hα-helixtrans-59.4-43.5178.8-64.4-29.3000111.2S330 M337 Y338S330-D334 WeakPolarHBondContact O-CB 3.15Å; S330-D334 PolarHBondContact O-N 3.3Å; S330-D334 PolarHBondContact OG-OD2 2.87Å; D334-M337 PolarHBondContact O-N 3.47Å; D334-M337 WeakPolarHBondContact OD1-CE 3.36Å; D334-Y338 VanDerWaalsContact O-CB 3.29Å; D334-Y338 WeakPolarHBondContact O-CB 3.37Å; D334-Y338 PolarHBondContact O-N 2.76Å
335L93.6Very high87.2Confident0 Ų055.4 Ų55.40%028%0.277CS..Hα-helixtrans-61.4-45.2175.6-177.8165.7000112.1F251 F254 L258 L311 M314 T331 V332 L333 Y338 A339F251-L335 WeakPolarHBondContact O-CD1 3.23Å; F254-L335 HydrophobicContact CB-CD1 4.21Å; F254-L335 HydrophobicContact CD1-CD1 3.77Å; F254-L335 HydrophobicContact CD1-CD2 4.1Å; F254-L335 HydrophobicContact CD1-CG 4.2Å; F254-L335 HydrophobicContact CE1-CD2 4.25Å; F254-L335 HydrophobicContact CG-CD1 4.43Å; L258-L335 HydrophobicContact CD1-CD2 4.21Å; L258-L335 HydrophobicContact CD1-CG 4.06Å; L311-L335 HydrophobicContact CD2-CD2 3.37Å; M314-L335 HydrophobicContact CE-CD1 3.94Å; M314-L335 HydrophobicContact SD-CD1 3.49Å; M314-L335 WeakPolarHBondContact SD-CD1 3.36Å; M314-L335 HydrophobicContact SD-CD2 3.68Å; M314-L335 HydrophobicContact SD-CG 4.24Å; T331-L335 WeakPolarHBondContact O-CB 3.13Å; T331-L335 PolarHBondContact O-N 3.19Å; V332-L335 PolarHBondContact O-N 2.98Å; L333-L335 VanDerWaalsContact C-N 3.31Å; L333-L335 PolarHBondContact O-N 3.2Å; L335-Y338 PolarHBondContact O-N 2.95Å; L335-A339 VanDerWaalsContact O-CB 3.32Å; L335-A339 WeakPolarHBondContact O-CB 3.46Å; L335-A339 PolarHBondContact O-N 3.3Å
336L91.5Very high86.4Confident18 Ų1855 Ų559%0.09427%0.272CS..Hα-helixtrans-67.5-38.3179.2-71.9170.3000111.9W277 L311 R315 L318 V332 L333 S340W277-L336 HydrophobicContact CE3-CD2 4.11Å; W277-L336 WeakPolarHBondContact CH2-O 3.49Å; W277-L336 HydrophobicContact CZ3-CD2 3.99Å; L311-L336 HydrophobicContact CD2-CD2 4.11Å; R315-L336 HydrophobicContact CB-CD1 4.01Å; R315-L336 HydrophobicContact CB-CD2 4.19Å; R315-L336 HydrophobicContact CG-CD1 4.5Å; L318-L336 HydrophobicContact CD2-CD1 3.97Å; V332-L336 HydrophobicContact CG1-CD1 3.82Å; V332-L336 HydrophobicContact CG1-CG 4.3Å; V332-L336 WeakPolarHBondContact O-CB 3.47Å; V332-L336 VanDerWaalsContact O-CG 3.23Å; V332-L336 WeakPolarHBondContact O-CG 3.23Å; V332-L336 PolarHBondContact O-N 3.26Å; L333-L336 PolarHBondContact O-N 2.86Å; L336-S340 VanDerWaalsContact O-CB 3.29Å; L336-S340 WeakPolarHBondContact O-CB 3.26Å; L336-S340 PolarHBondContact O-N 3.35Å
337M89.4Confident85.3Confident91 Ų9148.9 Ų48.945%0.44826%0.255SS..Hα-helixtrans-62.7-48.7172.9-69.5-171.4-5800110.5L333 D334 A339 S340 E341L333-M337 HydrophobicContact CD1-CG 4.49Å; L333-M337 HydrophobicContact CG-CE 4.22Å; L333-M337 HydrophobicContact CG-SD 4.46Å; L333-M337 WeakPolarHBondContact O-CG 3.32Å; L333-M337 PolarHBondContact O-N 3.18Å; D334-M337 PolarHBondContact O-N 3.47Å; D334-M337 WeakPolarHBondContact OD1-CE 3.36Å; M337-A339 PolarHBondContact O-N 3.14Å; M337-S340 WeakPolarHBondContact O-CA 3.15Å; M337-S340 WeakPolarHBondContact O-CB 3.42Å; M337-S340 PolarHBondContact O-N 3.01Å; M337-E341 PolarHBondContact O-N 3.48Å
338Y87.9Confident83.9Confident68 Ų6850.5 Ų50.527%0.26727%0.268SS..Hα-helixtrans-60.8-46.1178.8-178.6-120.9000112.7L258 M259 D334 L335 S340 E341 M342L258-Y338 HydrophobicContact CB-CD1 4.26Å; L258-Y338 HydrophobicContact CB-CE1 3.91Å; L258-Y338 HydrophobicContact CD1-CD1 3.81Å; L258-Y338 HydrophobicContact CD1-CE1 4.33Å; M259-Y338 HydrophobicContact CG-CE1 4.32Å; M259-Y338 WeakPolarHBondContact CG-OH 3.44Å; M259-Y338 PolarHBondContact SD-OH 3.2Å; M259-Y338 VanDerWaalsContact SD-OH 3.37Å; D334-Y338 VanDerWaalsContact O-CB 3.29Å; D334-Y338 WeakPolarHBondContact O-CB 3.37Å; D334-Y338 PolarHBondContact O-N 2.76Å; L335-Y338 PolarHBondContact O-N 2.95Å; Y338-S340 PolarHBondContact O-N 3.46Å; Y338-E341 PolarHBondContact O-N 3.09Å; Y338-M342 HydrophobicContact CD1-SD 4.34Å; Y338-M342 HydrophobicContact CE1-CG 4.35Å; Y338-M342 HydrophobicContact CE1-SD 3.62Å; Y338-M342 HydrophobicContact CE2-CG 4.19Å; Y338-M342 HydrophobicContact CE2-SD 4.4Å; Y338-M342 WeakPolarHBondContact O-CG 3.49Å; Y338-M342 PolarHBondContact O-N 3.48Å
339A87.8Confident82.1Confident0 Ų051.6 Ų51.60%028%0.275CS..Hα-helixtrans-60.3-33173.800000111.7L258 L273 W277 L311 L335 M337 M342 A343L258-A339 HydrophobicContact CD1-CB 4.18Å; L273-A339 HydrophobicContact CD1-CB 4.34Å; L273-A339 WeakPolarHBondContact CD1-O 3.36Å; W277-A339 HydrophobicContact CH2-CB 3.73Å; W277-A339 HydrophobicContact CZ2-CB 3.72Å; L311-A339 HydrophobicContact CD1-CB 4.1Å; L311-A339 HydrophobicContact CD2-CB 3.76Å; L335-A339 VanDerWaalsContact O-CB 3.32Å; L335-A339 WeakPolarHBondContact O-CB 3.46Å; L335-A339 PolarHBondContact O-N 3.3Å; M337-A339 PolarHBondContact O-N 3.14Å; A339-M342 PolarHBondContact O-N 2.97Å; A339-A343 WeakPolarHBondContact O-CB 3.49Å; A339-A343 PolarHBondContact O-N 2.87Å
340S84.7Confident79.8Confident45 Ų4549.1 Ų49.132%0.31527%0.273SS..Hα-helixtrans-69.4-45-179.3-169.80000111.2Q278 L336 M337 Y338 A343 A344Q278-S340 PolarHBondContact NE2-OG 2.78Å; L336-S340 VanDerWaalsContact O-CB 3.29Å; L336-S340 WeakPolarHBondContact O-CB 3.26Å; L336-S340 PolarHBondContact O-N 3.35Å; M337-S340 WeakPolarHBondContact O-CA 3.15Å; M337-S340 WeakPolarHBondContact O-CB 3.42Å; M337-S340 PolarHBondContact O-N 3.01Å; Y338-S340 PolarHBondContact O-N 3.46Å; S340-A343 PolarHBondContact O-N 3.19Å; S340-A344 PolarHBondContact O-N 2.93Å
341E81.8Confident77.3Confident122 Ų12254.6 Ų54.657%0.5729%0.293SS*.Hα-helixtrans-59.8-46.4174.1-68.6174.7-177.700111.2M337 Y338 A343 A344 I345M337-E341 PolarHBondContact O-N 3.48Å; Y338-E341 PolarHBondContact O-N 3.09Å; E341-A343 VanDerWaalsContact C-N 3.33Å; E341-A343 PolarHBondContact O-N 3.44Å; E341-A344 PolarHBondContact O-N 3.19Å; E341-I345 WeakPolarHBondContact O-CG1 3.42Å; E341-I345 PolarHBondContact O-N 3.1Å
342M80.9Confident74.5Confident21 Ų2157.7 Ų57.710%0.10331%0.308CS..Hα-helixtrans-59.4-42.6175.9-71.1-167.178.800112.2L258 N262 L273 Y338 A339 I345 Q346L258-M342 HydrophobicContact CB-SD 4.21Å; N262-M342 HydrophobicContact CB-CE 3.54Å; N262-M342 VanDerWaalsContact ND2-CE 3.34Å; N262-M342 WeakPolarHBondContact ND2-CE 3.37Å; L273-M342 HydrophobicContact CD1-CB 4.17Å; Y338-M342 HydrophobicContact CD1-SD 4.34Å; Y338-M342 HydrophobicContact CE1-CG 4.35Å; Y338-M342 HydrophobicContact CE1-SD 3.62Å; Y338-M342 HydrophobicContact CE2-CG 4.19Å; Y338-M342 HydrophobicContact CE2-SD 4.4Å; Y338-M342 WeakPolarHBondContact O-CG 3.49Å; Y338-M342 PolarHBondContact O-N 3.48Å; A339-M342 PolarHBondContact O-N 2.97Å; M342-I345 PolarHBondContact O-N 3.49Å; M342-Q346 WeakPolarHBondContact O-CG 3.43Å; M342-Q346 PolarHBondContact O-N 2.98Å
343A78.3Confident71.5Confident0 Ų065.1 Ų65.10%034%0.337CS..Hα-helixtrans-64.5-40.5177.100000112L273 W277 A339 S340 E341 Q346 N347L273-A343 HydrophobicContact CB-CB 3.78Å; L273-A343 HydrophobicContact CD1-CB 3.9Å; L273-A343 HydrophobicContact CG-CB 4.49Å; W277-A343 HydrophobicContact CZ2-CB 4.46Å; A339-A343 WeakPolarHBondContact O-CB 3.49Å; A339-A343 PolarHBondContact O-N 2.87Å; S340-A343 PolarHBondContact O-N 3.19Å; E341-A343 VanDerWaalsContact C-N 3.33Å; E341-A343 PolarHBondContact O-N 3.44Å; A343-Q346 PolarHBondContact O-N 3.04Å; A343-N347 WeakPolarHBondContact O-CB 3.35Å; A343-N347 VanDerWaalsContact O-CG 3.28Å; A343-N347 PolarHBondContact O-N 2.68Å; A343-N347 PolarHBondContact O-ND2 3.44Å
344A75.6Confident68.9Low51 Ų5167.7 Ų67.742%0.42136%0.356SS..Hα-helixtrans-63.1-43.1177.300000112.1S340 E341 N347 T348S340-A344 PolarHBondContact O-N 2.93Å; E341-A344 PolarHBondContact O-N 3.19Å; A344-N347 PolarHBondContact O-N 3.21Å; A344-T348 WeakPolarHBondContact O-CG2 3.05Å; A344-T348 PolarHBondContact O-N 2.99Å; A344-T348 PolarHBondContact O-OG1 3.04Å
345I71.8Confident65.9Low103 Ų10371.2 Ų71.253%0.52837%0.37SS..Hα-helixtrans-63.9-42.8176.5-65.2165.9000111E341 M342 N347 T348 T349E341-I345 WeakPolarHBondContact O-CG1 3.42Å; E341-I345 PolarHBondContact O-N 3.1Å; M342-I345 PolarHBondContact O-N 3.49Å; I345-N347 PolarHBondContact O-N 2.98Å; I345-T348 PolarHBondContact O-N 3.32Å; I345-T348 PolarHBondContact O-OG1 3.27Å; I345-T349 WeakPolarHBondContact O-CB 3.17Å; I345-T349 PolarHBondContact O-N 3.22Å; I345-T349 PolarHBondContact O-OG1 3.34Å
346Q69.2Low63.1Low28 Ų2876.3 Ų76.313%0.13141%0.406CS..Hα-helixtrans-64.7-39177.9-74.8178.10.600112.5N262 V272 M342 A343 C350N262-Q346 VanDerWaalsContact CG-NE2 3.32Å; N262-Q346 PolarHBondContact OD1-NE2 2.84Å; V272-Q346 VanDerWaalsContact CG2-NE2 3.27Å; M342-Q346 WeakPolarHBondContact O-CG 3.43Å; M342-Q346 PolarHBondContact O-N 2.98Å; A343-Q346 PolarHBondContact O-N 3.04Å; Q346-C350 VanDerWaalsContact O-CB 3.3Å; Q346-C350 WeakPolarHBondContact O-CB 3.37Å; Q346-C350 PolarHBondContact O-N 3.35Å; Q346-C350 VanDerWaalsContact O-N 3.16Å
347N65.1Low60.3Low78 Ų7883.6 Ų83.642%0.41745%0.445SS..Hα-helixtrans-71.4-34.5-179.8-75.2-29000112.8A343 A344 I345A343-N347 WeakPolarHBondContact O-CB 3.35Å; A343-N347 VanDerWaalsContact O-CG 3.28Å; A343-N347 PolarHBondContact O-N 2.68Å; A343-N347 PolarHBondContact O-ND2 3.44Å; A344-N347 PolarHBondContact O-N 3.21Å; I345-N347 PolarHBondContact O-N 2.98Å
348T58.4Low57.6Low100 Ų10087.1 Ų87.161%0.61346%0.46SS*.Hα-helixtrans-75.9-44.7177.249.40000112.1A344 I345 C350A344-T348 WeakPolarHBondContact O-CG2 3.05Å; A344-T348 PolarHBondContact O-N 2.99Å; A344-T348 PolarHBondContact O-OG1 3.04Å; I345-T348 PolarHBondContact O-N 3.32Å; I345-T348 PolarHBondContact O-OG1 3.27Å; T348-C350 PolarHBondContact O-N 2.89Å
349T51.4Low55.2Low23 Ų2386.4 Ų86.414%0.14146%0.462CS..Hα-helixtrans-70-30.2-178.949.30000112.9I345 Q351 N352 W353 V359I345-T349 WeakPolarHBondContact O-CB 3.17Å; I345-T349 PolarHBondContact O-N 3.22Å; I345-T349 PolarHBondContact O-OG1 3.34Å; T349-Q351 PolarHBondContact O-N 3.13Å; T349-N352 PolarHBondContact O-N 2.95Å; T349-W353 VanDerWaalsContact C-CD1 3.46Å; T349-W353 VanDerWaalsContact CB-NE1 3.35Å; T349-W353 VanDerWaalsContact O-CD1 3.24Å; T349-W353 PolarHBondContact O-N 3.45Å; T349-W353 PolarHBondContact OG1-NE1 3.37Å; T349-W353 VanDerWaalsContact OG1-NE1 3.12Å; T349-V359 HydrophobicContact CG2-CG1 4.01Å
350C44.8Very low52.7Low52 Ų5292.8 Ų92.835%0.35151%0.505SS..THydrogen-bonded Turntrans-57.8-12.1-179-103.30000115.9Q346 T348 N352Q346-C350 VanDerWaalsContact O-CB 3.3Å; Q346-C350 WeakPolarHBondContact O-CB 3.37Å; Q346-C350 PolarHBondContact O-N 3.35Å; Q346-C350 VanDerWaalsContact O-N 3.16Å; T348-C350 PolarHBondContact O-N 2.89Å; C350-N352 PolarHBondContact O-N 3.44Å
351Q40.3Very low50.4Low172 Ų17299.2 Ų99.280%0.80453%0.531SS*.THydrogen-bonded Turntrans-68.3-22.5168.5-72.5-172.4-7.700112.7T349T349-Q351 PolarHBondContact O-N 3.13Å
352N32.9Very low48.4Very low79 Ų7998.4 Ų98.442%0.42253%0.527SS..SBendtrans-126.16.6-171-71-1.8000115.3T349 C350 T354 E355T349-N352 PolarHBondContact O-N 2.95Å; C350-N352 PolarHBondContact O-N 3.44Å; N352-T354 PolarHBondContact O-N 3.44Å; N352-E355 PolarHBondContact O-N 3.48Å
353W31.8Very low46.4Very low157 Ų157102.5 Ų102.560%0.59555%0.548SS*.THydrogen-bonded Turntrans-63.2-10.3-178.1-90.958.6000114.8A266 T349 E355A266-W353 HydrophobicContact CB-CH2 4.41Å; T349-W353 VanDerWaalsContact C-CD1 3.46Å; T349-W353 VanDerWaalsContact CB-NE1 3.35Å; T349-W353 VanDerWaalsContact O-CD1 3.24Å; T349-W353 PolarHBondContact O-N 3.45Å; T349-W353 PolarHBondContact OG1-NE1 3.37Å; T349-W353 VanDerWaalsContact OG1-NE1 3.12Å; W353-E355 VanDerWaalsContact C-N 3.33Å
354T37.5Very low44.5Very low137 Ų137106 Ų10684%0.8458%0.584SS**THydrogen-bonded Turntrans-81.5-4.5170.940.60000114.7N352N352-T354 PolarHBondContact O-N 3.44Å
355E29.7Very low42.9Very low150 Ų150107.9 Ų107.970%0.70159%0.594SS**SBendtrans-122.5104.7177.9-70.6-175.4171.900111.6N352 W353 N357N352-E355 PolarHBondContact O-N 3.48Å; W353-E355 VanDerWaalsContact C-N 3.33Å; E355-N357 PolarHBondContact O-N 2.92Å
356S33.5Very low41.4Very low108 Ų108109.8 Ų109.876%0.75560%0.599SS**THydrogen-bonded Turntrans-13.7111.7169.151.60000117Q358S356-Q358 VanDerWaalsContact C-N 3.32Å; S356-Q358 PolarHBondContact O-N 3.23Å
357N33.4Very low39.9Very low171 Ų171112.5 Ų112.591%0.91461%0.613SS**THydrogen-bonded Turntrans42.429.6143.8-72.3-8.3000120.5E355E355-N357 PolarHBondContact O-N 2.92Å
358Q33.3Very low38.6Very low165 Ų165116.1 Ų116.177%0.77163%0.633SS**  trans-109.714.8167.9-90.6-177.2-14.800114.6S356 C360S356-Q358 VanDerWaalsContact C-N 3.32Å; S356-Q358 PolarHBondContact O-N 3.23Å; Q358-C360 VanDerWaalsContact C-N 3.27Å; Q358-C360 PolarHBondContact O-N 3.43Å
359V37.3Very low37.9Very low52 Ų52114.5 Ų114.532%0.31562%0.62SS.*Hα-helixtrans-71-14.5-174.7178.50000114.1T349 E361 I363T349-V359 HydrophobicContact CG2-CG1 4.01Å; V359-E361 VanDerWaalsContact C-N 3.28Å; V359-E361 PolarHBondContact O-N 3.15Å; V359-I363 HydrophobicContact CG1-CD1 4.03Å; V359-I363 HydrophobicContact CG1-CG1 4.27Å
360C35.3Very low37.5Very low134 Ų134116.9 Ų116.991%0.90564%0.638SS**Hα-helixtrans-70.3-15.5178.3-81.90000114.9Q358Q358-C360 VanDerWaalsContact C-N 3.27Å; Q358-C360 PolarHBondContact O-N 3.43Å
361E36Very low37.6Very low181 Ų181121.2 Ų121.285%0.84666%0.657SS**Hα-helixtrans-99.7-21.1179.4-78.4-173162.700114.9V359V359-E361 VanDerWaalsContact C-N 3.28Å; V359-E361 PolarHBondContact O-N 3.15Å
362E38.9Very low38Very low104 Ų104121.1 Ų121.149%0.48666%0.657SS.*Hα-helixtrans-89-21.1-174.9-87.4-157.6174.700115.6G364 S365 K366E362-G364 PolarHBondContact O-N 3.49Å; E362-G364 VanDerWaalsContact O-N 3.11Å; E362-S365 PolarHBondContact O-N 3.38Å; E362-S365 VanDerWaalsContact O-N 3.16Å; E362-S365 PolarHBondContact O-OG 2.85Å; E362-S365 VanDerWaalsContact O-OG 3.1Å; E362-K366 IonicContact OE2-NZ 3.4Å; E362-K366 PolarHBondContact OE2-NZ 3.28Å
363I39.3Very low38.8Very low107 Ų107120.7 Ų120.755%0.54966%0.66SS.*G310 helixtrans-60.6-29.7-173.1-64.2174.7000111.9V359 S365V359-I363 HydrophobicContact CG1-CD1 4.03Å; V359-I363 HydrophobicContact CG1-CG1 4.27Å; I363-S365 PolarHBondContact O-N 3.24Å; I363-S365 VanDerWaalsContact O-N 3.13Å
364G39Very low39.5Very low73 Ų73115.4 Ų115.475%0.75364%0.643SS**G310 helixtrans-68.6-8.1-179.500000116.2E362E362-G364 PolarHBondContact O-N 3.49Å; E362-G364 VanDerWaalsContact O-N 3.11Å
365S40.9Very low40.2Very low91 Ų91112 Ų11264%0.63664%0.636SS**G310 helixtrans-120.3-4.5-170.360.30000116.2E362 I363E362-S365 PolarHBondContact O-N 3.38Å; E362-S365 VanDerWaalsContact O-N 3.16Å; E362-S365 PolarHBondContact O-OG 2.85Å; E362-S365 VanDerWaalsContact O-OG 3.1Å; I363-S365 PolarHBondContact O-N 3.24Å; I363-S365 VanDerWaalsContact O-N 3.13Å
366K40.5Very low41.4Very low144 Ų144113.8 Ų113.863%0.62664%0.644SS**  trans-117.19-175-81.1177.9-175.6156.30115.8E362 N368E362-K366 IonicContact OE2-NZ 3.4Å; E362-K366 PolarHBondContact OE2-NZ 3.28Å; K366-N368 PolarHBondContact O-N 3.33Å
367L38.6Very low42Very low84 Ų84111.8 Ų111.844%0.4462%0.624SS.*  trans-73.166.1163.2-81163.9000109.9L369 Q394L367-L369 VanDerWaalsContact C-N 3.3Å; L367-L369 PolarHBondContact O-N 2.88Å; L367-Q394 HydrophobicContact CD1-CB 4.31Å; L367-Q394 WeakPolarHBondContact CD1-O 3.3Å
368N37.9Very low43.5Very low154 Ų154107.8 Ų107.882%0.82460%0.603SS**  trans-79.688.3159.7-100.2-18.7000106.5K366 S370K366-N368 PolarHBondContact O-N 3.33Å; N368-S370 VanDerWaalsContact C-N 3.34Å; N368-S370 PolarHBondContact O-N 3.06Å
369L44.5Very low45.1Very low66 Ų66103.2 Ų103.235%0.34660%0.6SS.*  trans-62.799.6165.5-66.4167.5000106.9L367 D371 L389 L395L367-L369 VanDerWaalsContact C-N 3.3Å; L367-L369 PolarHBondContact O-N 2.88Å; L369-D371 PolarHBondContact O-N 2.9Å; L369-L389 HydrophobicContact CD1-CD1 3.44Å; L369-L389 VanDerWaalsContact CD1-CD1 3.44Å; L369-L395 HydrophobicContact CD1-CD1 4.46Å
370S41.6Very low46.6Very low74 Ų74107.9 Ų107.952%0.51762%0.618SS.*  trans-62.2134.1173.2460000109.4N368 E372 S373N368-S370 VanDerWaalsContact C-N 3.34Å; N368-S370 PolarHBondContact O-N 3.06Å; S370-E372 PolarHBondContact O-N 2.94Å; S370-S373 PolarHBondContact O-N 2.95Å; S370-S373 PolarHBondContact O-OG 3.28Å
371D48.1Very low48.1Very low142 Ų142105.9 Ų105.976%0.75960%0.596SS**THydrogen-bonded Turntrans-44.7-22.6-178.7-86.6-29.8000115L369 S373 L374 G375L369-D371 PolarHBondContact O-N 2.9Å; D371-S373 VanDerWaalsContact C-N 3.28Å; D371-S373 PolarHBondContact O-N 3.29Å; D371-L374 PolarHBondContact O-N 2.72Å; D371-G375 PolarHBondContact O-N 3.25Å
372E48.7Very low49.7Very low171 Ų17198.2 Ų98.280%0.79956%0.564SS**THydrogen-bonded Turntrans-61.9-32.7177.5-73.1-178.7160.600113.3S370S370-E372 PolarHBondContact O-N 2.94Å
373S50Low51.4Low69 Ų6995.4 Ų95.448%0.48356%0.558SS.*THydrogen-bonded Turntrans-81.1-19.5-179.151.20000114.1S370 D371S370-S373 PolarHBondContact O-N 2.95Å; S370-S373 PolarHBondContact O-OG 3.28Å; D371-S373 VanDerWaalsContact C-N 3.28Å; D371-S373 PolarHBondContact O-N 3.29Å
374L46.5Very low53.1Low47 Ų4795.4 Ų95.425%0.24656%0.559CS.*THydrogen-bonded Turntrans-93.2-16.8176.6-72.8167.6000112.7D371 E376 L377 A382 F385D371-L374 PolarHBondContact O-N 2.72Å; L374-E376 PolarHBondContact O-N 2.71Å; L374-L377 HydrophobicContact CD2-CD1 4.36Å; L374-L377 PolarHBondContact O-N 3.13Å; L374-A382 HydrophobicContact CD2-CB 4.24Å; L374-F385 HydrophobicContact CD2-CD1 4.38Å
375G51.3Low54.7Low66 Ų6696.3 Ų96.368%0.6854%0.542SS*.THydrogen-bonded Turntrans-69-15.2-178.100000115.6D371D371-G375 PolarHBondContact O-N 3.25Å
376E54.5Low56.4Low187 Ų18796.5 Ų96.587%0.87453%0.533SS*.THydrogen-bonded Turntrans-92.7-12177.8-67.2-170.9168.200113.6L374L374-E376 PolarHBondContact O-N 2.71Å
377L47.4Very low58Low65 Ų6594.1 Ų94.134%0.3453%0.528SS..SBendtrans-91.1137.9177-64.9172.1000109.1L374 Q381 A382L374-L377 HydrophobicContact CD2-CD1 4.36Å; L374-L377 PolarHBondContact O-N 3.13Å; L377-Q381 HydrophobicContact CB-CB 3.9Å; L377-Q381 HydrophobicContact CD2-CB 4.06Å; L377-Q381 HydrophobicContact CG-CB 4.42Å; L377-A382 HydrophobicContact CB-CB 4.23Å
378D64.5Low59.8Low88 Ų8895.8 Ų95.847%0.47153%0.531SS..  trans-63.2158.2168.662.638.2000110.1E380 Q381 A382D378-E380 PolarHBondContact O-N 3.41Å; D378-E380 PolarHBondContact OD1-N 3.42Å; D378-Q381 PolarHBondContact O-N 3.28Å; D378-Q381 WeakPolarHBondContact OD1-CB 3.35Å; D378-Q381 WeakPolarHBondContact OD1-CG 3.48Å; D378-Q381 PolarHBondContact OD1-N 3.49Å; D378-Q381 PolarHBondContact OD2-NE2 3.4Å; D378-A382 PolarHBondContact O-N 2.87Å
379G66.6Low61.2Low68 Ų6889 Ų8970%0.70150%0.495SS*.Hα-helixtrans-60.8-18.5-169.900000114.6A383G379-A383 PolarHBondContact O-N 2.85Å
380E68.9Low62.6Low151 Ų15187.5 Ų87.571%0.70649%0.487SS*.Hα-helixtrans-81.5-45.9175.5-159.6165.5-161.700110.2D378 A382 A383 D384D378-E380 PolarHBondContact O-N 3.41Å; D378-E380 PolarHBondContact OD1-N 3.42Å; E380-A382 PolarHBondContact O-N 3.47Å; E380-A383 PolarHBondContact O-N 3.04Å; E380-D384 PolarHBondContact O-N 3.4Å
381Q66.1Low63.9Low91 Ų9192.3 Ų92.343%0.42550%0.501SS..Hα-helixtrans-62.4-38.7174.6-72.5168.44.900113.4L377 D378 A383 F385L377-Q381 HydrophobicContact CB-CB 3.9Å; L377-Q381 HydrophobicContact CD2-CB 4.06Å; L377-Q381 HydrophobicContact CG-CB 4.42Å; D378-Q381 PolarHBondContact O-N 3.28Å; D378-Q381 WeakPolarHBondContact OD1-CB 3.35Å; D378-Q381 WeakPolarHBondContact OD1-CG 3.48Å; D378-Q381 PolarHBondContact OD1-N 3.49Å; D378-Q381 PolarHBondContact OD2-NE2 3.4Å; Q381-A383 VanDerWaalsContact C-N 3.32Å; Q381-F385 WeakPolarHBondContact O-CB 3.29Å; Q381-F385 PolarHBondContact O-N 3.39Å
382A69.8Low64.8Low21 Ų2188 Ų8817%0.17448%0.483CS..Hα-helixtrans-64.2-39.417700000111.5L374 L377 D378 E380 E386L374-A382 HydrophobicContact CD2-CB 4.24Å; L377-A382 HydrophobicContact CB-CB 4.23Å; D378-A382 PolarHBondContact O-N 2.87Å; E380-A382 PolarHBondContact O-N 3.47Å; A382-E386 WeakPolarHBondContact O-CB 3.27Å; A382-E386 PolarHBondContact O-N 3.26Å
383A74Confident65.5Low45 Ų4583 Ų8337%0.37248%0.477SS..Hα-helixtrans-69.5-44.8177.100000111.9G379 E380 Q381 F385 E386 D387G379-A383 PolarHBondContact O-N 2.85Å; E380-A383 PolarHBondContact O-N 3.04Å; Q381-A383 VanDerWaalsContact C-N 3.32Å; A383-F385 VanDerWaalsContact C-N 3.27Å; A383-F385 PolarHBondContact O-N 2.98Å; A383-E386 PolarHBondContact O-N 2.99Å; A383-D387 WeakPolarHBondContact O-CB 3.32Å; A383-D387 PolarHBondContact O-N 3.3Å
384D75.2Confident66Low107 Ų10784.4 Ų84.457%0.57248%0.476SS*.Hα-helixtrans-60.2-38.8176.7-76.9-10.4000111.7E380 F388E380-D384 PolarHBondContact O-N 3.4Å; D384-F388 WeakPolarHBondContact O-CB 3.45Å; D384-F388 PolarHBondContact O-N 2.72Å
385F74.3Confident66.8Low91 Ų9184.1 Ų84.140%0.39947%0.474SS..Hα-helixtrans-71-41176.8-169.1-110.3000112.3L374 Q381 A383 F388 L389L374-F385 HydrophobicContact CD2-CD1 4.38Å; Q381-F385 WeakPolarHBondContact O-CB 3.29Å; Q381-F385 PolarHBondContact O-N 3.39Å; A383-F385 VanDerWaalsContact C-N 3.27Å; A383-F385 PolarHBondContact O-N 2.98Å; F385-F388 PolarHBondContact O-N 3.4Å; F385-L389 HydrophobicContact CD1-CD1 3.8Å; F385-L389 HydrophobicContact CD1-CG 4.41Å; F385-L389 HydrophobicContact CE1-CD1 3.51Å; F385-L389 HydrophobicContact CE1-CG 4.18Å; F385-L389 HydrophobicContact CZ-CD1 4.08Å; F385-L389 HydrophobicContact CZ-CD2 4.36Å; F385-L389 HydrophobicContact CZ-CG 4.33Å; F385-L389 VanDerWaalsContact O-CG 3.29Å; F385-L389 WeakPolarHBondContact O-CG 3.36Å; F385-L389 PolarHBondContact O-N 3.08Å
386E74.6Confident67.5Low95 Ų9586 Ų8644%0.44448%0.476SS..Hα-helixtrans-63-42.9175.2-165174.7-171.200111.2A382 A383 L389 I390 L395A382-E386 WeakPolarHBondContact O-CB 3.27Å; A382-E386 PolarHBondContact O-N 3.26Å; A383-E386 PolarHBondContact O-N 2.99Å; E386-L389 PolarHBondContact O-N 3.17Å; E386-I390 HydrophobicContact CG-CD1 4.22Å; E386-I390 VanDerWaalsContact O-CG1 3.3Å; E386-I390 WeakPolarHBondContact O-CG1 3.31Å; E386-I390 PolarHBondContact O-N 3.19Å; E386-L395 HydrophobicContact CG-CD2 3.74Å
387D74.9Confident68Low95 Ų9584.8 Ų84.851%0.50847%0.468SS..Hα-helixtrans-63.5-43.4175.4-85.5-15.6000111.7A383 L389 I390 E391A383-D387 WeakPolarHBondContact O-CB 3.32Å; A383-D387 PolarHBondContact O-N 3.3Å; D387-L389 VanDerWaalsContact C-N 3.31Å; D387-L389 PolarHBondContact O-N 3.33Å; D387-I390 PolarHBondContact O-N 2.67Å; D387-E391 WeakPolarHBondContact O-CB 3.26Å; D387-E391 WeakPolarHBondContact O-CG 3.39Å; D387-E391 PolarHBondContact O-N 2.77Å
388F75.7Confident68.3Low118 Ų11894.6 Ų94.652%0.51851%0.508SS..Hα-helixtrans-57.7-42.7173.6170.2-98.5000112.2D384 F385 I390 E391 S392D384-F388 WeakPolarHBondContact O-CB 3.45Å; D384-F388 PolarHBondContact O-N 2.72Å; F385-F388 PolarHBondContact O-N 3.4Å; F388-I390 VanDerWaalsContact C-N 3.35Å; F388-E391 PolarHBondContact O-N 3.17Å; F388-S392 VanDerWaalsContact O-CB 3.27Å; F388-S392 WeakPolarHBondContact O-CB 3.43Å; F388-S392 PolarHBondContact O-N 3.49Å; F388-S392 PolarHBondContact O-OG 3.03Å
389L68.8Low68.5Low12 Ų1295 Ų956%0.06351%0.51CS..Hα-helixtrans-69-34.7178.6-69.3173.8000112.3L369 F385 E386 D387 S392 G393 Q394 L395L369-L389 HydrophobicContact CD1-CD1 3.44Å; L369-L389 VanDerWaalsContact CD1-CD1 3.44Å; F385-L389 HydrophobicContact CD1-CD1 3.8Å; F385-L389 HydrophobicContact CD1-CG 4.41Å; F385-L389 HydrophobicContact CE1-CD1 3.51Å; F385-L389 HydrophobicContact CE1-CG 4.18Å; F385-L389 HydrophobicContact CZ-CD1 4.08Å; F385-L389 HydrophobicContact CZ-CD2 4.36Å; F385-L389 HydrophobicContact CZ-CG 4.33Å; F385-L389 VanDerWaalsContact O-CG 3.29Å; F385-L389 WeakPolarHBondContact O-CG 3.36Å; F385-L389 PolarHBondContact O-N 3.08Å; E386-L389 PolarHBondContact O-N 3.17Å; D387-L389 VanDerWaalsContact C-N 3.31Å; D387-L389 PolarHBondContact O-N 3.33Å; L389-S392 WeakPolarHBondContact CA-OG 3.41Å; L389-S392 PolarHBondContact O-OG 2.87Å; L389-G393 PolarHBondContact O-N 3.42Å; L389-Q394 HydrophobicContact CB-CB 4.46Å; L389-Q394 HydrophobicContact CD2-CB 3.93Å; L389-Q394 PolarHBondContact O-N 3.01Å; L389-L395 HydrophobicContact CB-CB 3.84Å; L389-L395 PolarHBondContact O-N 2.92Å
390I72.8Confident68.6Low34 Ų3496.4 Ų96.417%0.17450%0.5CS..Hα-helixtrans-68.6-46.1174.3-71.1167000111.1E386 D387 F388 S392 G393 L395 K397E386-I390 HydrophobicContact CG-CD1 4.22Å; E386-I390 VanDerWaalsContact O-CG1 3.3Å; E386-I390 WeakPolarHBondContact O-CG1 3.31Å; E386-I390 PolarHBondContact O-N 3.19Å; D387-I390 PolarHBondContact O-N 2.67Å; F388-I390 VanDerWaalsContact C-N 3.35Å; I390-S392 VanDerWaalsContact C-N 3.34Å; I390-S392 PolarHBondContact O-N 2.74Å; I390-G393 PolarHBondContact O-N 3.39Å; I390-G393 VanDerWaalsContact O-N 3.16Å; I390-L395 WeakPolarHBondContact CA-O 3.4Å; I390-L395 HydrophobicContact CG1-CB 4.11Å; I390-L395 HydrophobicContact CG1-CD2 4.11Å; I390-K397 HydrophobicContact CD1-CG 4.26Å; I390-K397 HydrophobicContact CG1-CG 4.46Å; I390-K397 HydrophobicContact CG2-CD 4.07Å; I390-K397 HydrophobicContact CG2-CG 3.53Å
391E69.3Low68.6Low175 Ų17593.3 Ų93.382%0.81849%0.489SS*.Hα-helixtrans-66.7-35.7179.7-74.1-168.4164.300112.5D387 F388 G393D387-E391 WeakPolarHBondContact O-CB 3.26Å; D387-E391 WeakPolarHBondContact O-CG 3.39Å; D387-E391 PolarHBondContact O-N 2.77Å; F388-E391 PolarHBondContact O-N 3.17Å; E391-G393 PolarHBondContact O-N 2.86Å
392S67.9Low68.8Low53 Ų5393.5 Ų93.537%0.37149%0.493SS..THydrogen-bonded Turntrans-76.8-317560.80000113.8F388 L389 I390 Q394F388-S392 VanDerWaalsContact O-CB 3.27Å; F388-S392 WeakPolarHBondContact O-CB 3.43Å; F388-S392 PolarHBondContact O-N 3.49Å; F388-S392 PolarHBondContact O-OG 3.03Å; L389-S392 WeakPolarHBondContact CA-OG 3.41Å; L389-S392 PolarHBondContact O-OG 2.87Å; I390-S392 VanDerWaalsContact C-N 3.34Å; I390-S392 PolarHBondContact O-N 2.74Å; S392-Q394 PolarHBondContact O-N 2.89Å; S392-Q394 WeakPolarHBondContact OG-CG 3.41Å
393G61.8Low68.7Low65 Ų6598 Ų9867%0.6751%0.512SS*.THydrogen-bonded Turntrans7311.8-179.500000114.2L389 I390 E391L389-G393 PolarHBondContact O-N 3.42Å; I390-G393 PolarHBondContact O-N 3.39Å; I390-G393 VanDerWaalsContact O-N 3.16Å; E391-G393 PolarHBondContact O-N 2.86Å
394Q61.6Low68.4Low99 Ų99101.5 Ų101.546%0.46352%0.522SS..SBendtrans-81.5-21.2177.7-62.6-174.834.900112.5L367 L389 S392L367-Q394 HydrophobicContact CD1-CB 4.31Å; L367-Q394 WeakPolarHBondContact CD1-O 3.3Å; L389-Q394 HydrophobicContact CB-CB 4.46Å; L389-Q394 HydrophobicContact CD2-CB 3.93Å; L389-Q394 PolarHBondContact O-N 3.01Å; S392-Q394 PolarHBondContact O-N 2.89Å; S392-Q394 WeakPolarHBondContact OG-CG 3.41Å
395L63.6Low67.9Low41 Ų41101.1 Ų101.122%0.21552%0.518CS..SBendtrans-128.7133.9175.9-158.580.9000110.7L369 E386 L389 I390L369-L395 HydrophobicContact CD1-CD1 4.46Å; E386-L395 HydrophobicContact CG-CD2 3.74Å; L389-L395 HydrophobicContact CB-CB 3.84Å; L389-L395 PolarHBondContact O-N 2.92Å; I390-L395 WeakPolarHBondContact CA-O 3.4Å; I390-L395 HydrophobicContact CG1-CB 4.11Å; I390-L395 HydrophobicContact CG1-CD2 4.11Å
396S65.4Low67.4Low104 Ų104101.9 Ų101.973%0.72753%0.527SS*.  trans-82.2133.5175.9-66.40000110.8K398S396-K398 PolarHBondContact O-N 2.73Å
397K64.7Low66.8Low163 Ų163102.5 Ų102.571%0.70953%0.534SS*.  trans-58127.5170.2-73.7-171.6176.6-176.90109.5I390I390-K397 HydrophobicContact CD1-CG 4.26Å; I390-K397 HydrophobicContact CG1-CG 4.46Å; I390-K397 HydrophobicContact CG2-CD 4.07Å; I390-K397 HydrophobicContact CG2-CG 3.53Å
398K54.9Low66Low271 Ų271103.2 Ų103.2100%1.17854%0.537SS*.  trans-59.40172.5-86.7179.8-179.1160.80112.6S396S396-K398 PolarHBondContact O-N 2.73Å

Retrieved 398 of 398 residues in 139.9 ms (Link to these results)