A0A060XKG5_ONCMY Loading...

Calcium homeostasis modulator 1

AlphaFold DB , UniProt , Accession A0A060XKG5, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110485747, Length 359 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M47.7Very low49.6Very low173 Ų173137.5 Ų137.585%0.85263%0.634SS**  0-20.90-75-150.5-78.800113K3 F4 R5M1-K3 PolarHBondContact O-N 3.17Å; M1-F4 PolarHBondContact O-N 3.09Å; M1-R5 PolarHBondContact O-N 3.4Å
2D45.1Very low49Very low114 Ų114135.2 Ų135.261%0.6162%0.624SS**Hα-helixtrans-72.2-27.9-171.2-48.2-63.3000114.8F4 R5 M6D2-F4 PolarHBondContact O-N 3.21Å; D2-R5 PolarHBondContact O-N 3.47Å; D2-M6 PolarHBondContact O-N 3.09Å
3K51.1Low48.5Very low174 Ų174131.2 Ų131.276%0.75762%0.621SS**Hα-helixtrans-65.2-37.5176.1-63.8-175.2179.4179.20112.7M1 M7M1-K3 PolarHBondContact O-N 3.17Å; K3-M7 PolarHBondContact O-N 3.33Å
4F50.7Low47.8Very low151 Ų151128.4 Ų128.466%0.66261%0.612SS**Hα-helixtrans-71.8-35.1175.4-76.7-79.8000112.1M1 D2 F8M1-F4 PolarHBondContact O-N 3.09Å; D2-F4 PolarHBondContact O-N 3.21Å; F4-F8 VanDerWaalsContact O-CB 3.28Å; F4-F8 WeakPolarHBondContact O-CB 3.27Å; F4-F8 PolarHBondContact O-N 3.09Å
5R48.7Very low47.2Very low188 Ų188129 Ų12971%0.70961%0.614SS**Hα-helixtrans-64.4-38.5174.2-115.4-177.1-177.6-148.71112.6M1 D2 F8 Q9M1-R5 PolarHBondContact O-N 3.4Å; D2-R5 PolarHBondContact O-N 3.47Å; R5-F8 WeakPolarHBondContact O-CB 3.46Å; R5-F8 PolarHBondContact O-N 2.98Å; R5-Q9 PolarHBondContact O-N 3.25Å
6M50.6Low46.6Very low123 Ų123133.9 Ų133.961%0.60664%0.636SS**Hα-helixtrans-69.1-44.6175.5-90.8-171.6-85.300112.9D2 F8 Q9 F10D2-M6 PolarHBondContact O-N 3.09Å; M6-F8 PolarHBondContact O-N 3.04Å; M6-Q9 PolarHBondContact O-N 3.42Å; M6-F10 PolarHBondContact O-N 3.49Å
7M53.9Low46.3Very low131 Ų131131.7 Ų131.765%0.64564%0.639SS**Hα-helixtrans-60.4-34.5173-70.2-177.79400111.3K3 L11K3-M7 PolarHBondContact O-N 3.33Å; M7-L11 WeakPolarHBondContact O-CD1 3.47Å; M7-L11 WeakPolarHBondContact O-CG 3.39Å; M7-L11 PolarHBondContact O-N 2.81Å; M7-L11 VanDerWaalsContact O-N 3.14Å
8F52.7Low45.9Very low71 Ų71129.1 Ų129.131%0.31162%0.624SS.*Hα-helixtrans-66.9-46.8176.2170.1-107.8000113.8F4 R5 M6 F10 L11 Q12 L28F4-F8 VanDerWaalsContact O-CB 3.28Å; F4-F8 WeakPolarHBondContact O-CB 3.27Å; F4-F8 PolarHBondContact O-N 3.09Å; R5-F8 WeakPolarHBondContact O-CB 3.46Å; R5-F8 PolarHBondContact O-N 2.98Å; M6-F8 PolarHBondContact O-N 3.04Å; F8-F10 PolarHBondContact O-N 3.1Å; F8-L11 PolarHBondContact O-N 3.11Å; F8-L11 VanDerWaalsContact O-N 3.08Å; F8-Q12 WeakPolarHBondContact O-CB 3.44Å; F8-Q12 PolarHBondContact O-N 2.95Å; F8-L28 HydrophobicContact CD2-CD1 3.3Å; F8-L28 HydrophobicContact CD2-CD2 4.13Å; F8-L28 HydrophobicContact CD2-CG 4.31Å; F8-L28 HydrophobicContact CE2-CD1 3.23Å; F8-L28 HydrophobicContact CG-CD1 4.35Å; F8-L28 HydrophobicContact CZ-CD1 4.27Å
9Q53.3Low46Very low134 Ų134125.7 Ų125.763%0.62661%0.608SS**Hα-helixtrans-60.8-35.8176.8-82179.5-27.900112.1R5 M6 L11 S13R5-Q9 PolarHBondContact O-N 3.25Å; M6-Q9 PolarHBondContact O-N 3.42Å; Q9-L11 VanDerWaalsContact C-N 3.35Å; Q9-S13 PolarHBondContact O-N 3.19Å; Q9-S13 PolarHBondContact O-OG 2.97Å
10F47.4Very low46.6Very low149 Ų149123.8 Ų123.865%0.65460%0.6SS**Hα-helixtrans-68.4-32.5175.2-171.3-96.9000113.1M6 F8 S13M6-F10 PolarHBondContact O-N 3.49Å; F8-F10 PolarHBondContact O-N 3.1Å; F10-S13 PolarHBondContact O-OG 3.21Å
11L44.3Very low47.3Very low104 Ų104119.5 Ų119.555%0.54559%0.589SS.*Hα-helixtrans-80.2-29.4177.4-70.1167.4000112.7M7 F8 Q9M7-L11 WeakPolarHBondContact O-CD1 3.47Å; M7-L11 WeakPolarHBondContact O-CG 3.39Å; M7-L11 PolarHBondContact O-N 2.81Å; M7-L11 VanDerWaalsContact O-N 3.14Å; F8-L11 PolarHBondContact O-N 3.11Å; F8-L11 VanDerWaalsContact O-N 3.08Å; Q9-L11 VanDerWaalsContact C-N 3.35Å
12Q42Very low48.4Very low110 Ų110115.4 Ų115.451%0.51457%0.569SS.*Hα-helixtrans-76.4-27.5-179.4-167.2173.64.800113.1F8F8-Q12 WeakPolarHBondContact O-CB 3.44Å; F8-Q12 PolarHBondContact O-N 2.95Å
13S43.2Very low49.7Very low84 Ų84110.3 Ų110.359%0.58754%0.542SS*.SBendtrans-77.4-15-178.760.60000114.7Q9 F10Q9-S13 PolarHBondContact O-N 3.19Å; Q9-S13 PolarHBondContact O-OG 2.97Å; F10-S13 PolarHBondContact O-OG 3.21Å
14N38.8Very low50.8Low91 Ų91103.1 Ų103.149%0.48752%0.518SS..  trans-112.661.9-178.8-83.2-57.8000112.3E16 S17N14-E16 PolarHBondContact O-N 3.37Å; N14-E16 VanDerWaalsContact O-N 3.12Å; N14-S17 PolarHBondContact O-N 3.27Å
15Q37.9Very low52.3Low138 Ų138101.4 Ų101.465%0.64551%0.514SS*.THydrogen-bonded Turntrans-58.7-19.9-177.8-79.8-79.2-45.200115
16E39Very low54Low207 Ų20793.1 Ų93.197%0.96748%0.484SS*.THydrogen-bonded Turntrans-75.4-21.3174.3-84.4-149.8136.600114.1N14N14-E16 PolarHBondContact O-N 3.37Å; N14-E16 VanDerWaalsContact O-N 3.12Å
17S41.1Very low55.8Low97 Ų9788 Ų8868%0.67846%0.461SS*.THydrogen-bonded Turntrans-96.8-28.4-167.4-177.90000114.1N14N14-S17 PolarHBondContact O-N 3.27Å
18F38.3Very low57.3Low85 Ų8584.8 Ų84.837%0.37345%0.446SS..SBendtrans-113.385.4-177.8-149.6-91.5000112N20 C23 I108F18-N20 PolarHBondContact O-N 3.23Å; F18-C23 HydrophobicContact CE1-CB 4.22Å; F18-I108 HydrophobicContact CE1-CD1 4.1Å; F18-I108 HydrophobicContact CZ-CD1 4.03Å
19M49.1Very low59Low65 Ų6583.7 Ų83.732%0.3245%0.45SS..SBendtrans8.788146.1-165.9169.263.200114.8R105 I108M19-R105 HydrophobicContact CE-CB 4.46Å; M19-R105 HydrophobicContact CE-CG 3.46Å; M19-R105 VanDerWaalsContact CE-CG 3.46Å; M19-R105 HydrophobicContact CG-CG 3.61Å; M19-R105 HydrophobicContact SD-CG 3.49Å; M19-R105 WeakPolarHBondContact SD-CG 3.39Å; M19-I108 HydrophobicContact CE-CD1 3.91Å
20N56.3Low60.8Low86 Ų8677.3 Ų77.346%0.4642%0.421SS..  trans48.8114176.3-64.47.4000115.9F18 I22 C23 R105F18-N20 PolarHBondContact O-N 3.23Å; N20-I22 PolarHBondContact O-N 3.39Å; N20-C23 PolarHBondContact O-N 3.48Å; N20-R105 PolarHBondContact ND2-NH1 3.32Å
21G63.3Low62.8Low34 Ų3471.5 Ų71.535%0.35140%0.4SS..Hα-helixtrans-47.4-25.3179.300000116.5C23 G24 I25G21-C23 VanDerWaalsContact C-N 3.31Å; G21-C23 PolarHBondContact O-N 3.4Å; G21-G24 PolarHBondContact O-N 3.01Å; G21-I25 WeakPolarHBondContact O-CG1 3.18Å; G21-I25 PolarHBondContact O-N 2.69Å
22I70.4Confident64.9Low88 Ų8871.9 Ų71.945%0.45140%0.399SS..Hα-helixtrans-56.8-39.7172.9-60.8172.6000112.3N20 I25 M26N20-I22 PolarHBondContact O-N 3.39Å; I22-I25 PolarHBondContact O-N 3.14Å; I22-M26 HydrophobicContact CG2-CE 4.41Å; I22-M26 HydrophobicContact CG2-CG 4.5Å; I22-M26 WeakPolarHBondContact O-CG 3.39Å; I22-M26 PolarHBondContact O-N 2.94Å
23C71.4Confident67.3Low6 Ų670.5 Ų70.54%0.04140%0.395CS..Hα-helixtrans-66.9-40.2-179.6-64.20000111.8F18 N20 G21 M26 A27 R105 I108F18-C23 HydrophobicContact CE1-CB 4.22Å; N20-C23 PolarHBondContact O-N 3.48Å; G21-C23 VanDerWaalsContact C-N 3.31Å; G21-C23 PolarHBondContact O-N 3.4Å; C23-M26 PolarHBondContact O-N 3.46Å; C23-A27 WeakPolarHBondContact O-CB 3.33Å; C23-A27 PolarHBondContact O-N 3.29Å; C23-R105 VanDerWaalsContact SG-CB 3.56Å; C23-I108 HydrophobicContact CB-CD1 3.89Å
24G74.4Confident69.6Low24 Ų2467.8 Ų67.825%0.24737%0.372CS..Hα-helixtrans-64.4-43174.300000111.8G21 A27 L28G21-G24 PolarHBondContact O-N 3.01Å; G24-A27 PolarHBondContact O-N 2.97Å; G24-L28 WeakPolarHBondContact O-CD1 3.5Å; G24-L28 VanDerWaalsContact O-CG 3.25Å; G24-L28 WeakPolarHBondContact O-CG 3.44Å; G24-L28 PolarHBondContact O-N 3.44Å
25I82.6Confident71.9Confident114 Ų11467.6 Ų67.659%0.58538%0.378SS*.Hα-helixtrans-61.5-45.4176.1-65.8165.3000111.1G21 I22 A27 L28 A29G21-I25 WeakPolarHBondContact O-CG1 3.18Å; G21-I25 PolarHBondContact O-N 2.69Å; I22-I25 PolarHBondContact O-N 3.14Å; I25-A27 PolarHBondContact O-N 2.77Å; I25-L28 PolarHBondContact O-N 3.02Å; I25-A29 WeakPolarHBondContact O-CB 3.44Å; I25-A29 PolarHBondContact O-N 3.26Å
26M84.6Confident74.3Confident14 Ų1465.2 Ų65.27%0.06938%0.382CS..Hα-helixtrans-64-40.4177.8-73.6-162.8-63.400112.6I22 C23 L28 A29 S30 L70 A109I22-M26 HydrophobicContact CG2-CE 4.41Å; I22-M26 HydrophobicContact CG2-CG 4.5Å; I22-M26 WeakPolarHBondContact O-CG 3.39Å; I22-M26 PolarHBondContact O-N 2.94Å; C23-M26 PolarHBondContact O-N 3.46Å; M26-L28 VanDerWaalsContact C-N 3.31Å; M26-L28 PolarHBondContact O-N 3.42Å; M26-A29 PolarHBondContact O-N 3.21Å; M26-S30 WeakPolarHBondContact O-CB 3.3Å; M26-S30 PolarHBondContact O-N 3.48Å; M26-L70 HydrophobicContact CG-CD1 4.22Å; M26-L70 HydrophobicContact SD-CD1 3.76Å; M26-A109 HydrophobicContact CB-CB 3.94Å
27A87.2Confident76.7Confident16 Ų1659.2 Ų59.213%0.13235%0.353CS..Hα-helixtrans-58.6-45.1174.800000111.3C23 G24 I25 S30 A31 I108 V112C23-A27 WeakPolarHBondContact O-CB 3.33Å; C23-A27 PolarHBondContact O-N 3.29Å; G24-A27 PolarHBondContact O-N 2.97Å; I25-A27 PolarHBondContact O-N 2.77Å; A27-S30 PolarHBondContact O-N 2.89Å; A27-S30 PolarHBondContact O-OG 2.78Å; A27-A31 PolarHBondContact O-N 3.01Å; A27-I108 HydrophobicContact CB-CG2 4.03Å; A27-V112 HydrophobicContact CB-CG2 4.12Å
28L85.2Confident79.1Confident63 Ų6362.2 Ų62.233%0.3336%0.356SS..Hα-helixtrans-65.6-46.8177-66.6162.3000111.8F8 G24 I25 M26 S30 A31 Q32F8-L28 HydrophobicContact CD2-CD1 3.3Å; F8-L28 HydrophobicContact CD2-CD2 4.13Å; F8-L28 HydrophobicContact CD2-CG 4.31Å; F8-L28 HydrophobicContact CE2-CD1 3.23Å; F8-L28 HydrophobicContact CG-CD1 4.35Å; F8-L28 HydrophobicContact CZ-CD1 4.27Å; G24-L28 WeakPolarHBondContact O-CD1 3.5Å; G24-L28 VanDerWaalsContact O-CG 3.25Å; G24-L28 WeakPolarHBondContact O-CG 3.44Å; G24-L28 PolarHBondContact O-N 3.44Å; I25-L28 PolarHBondContact O-N 3.02Å; M26-L28 VanDerWaalsContact C-N 3.31Å; M26-L28 PolarHBondContact O-N 3.42Å; L28-S30 PolarHBondContact O-N 2.73Å; L28-A31 PolarHBondContact O-N 3.3Å; L28-A31 VanDerWaalsContact O-N 3.16Å; L28-Q32 WeakPolarHBondContact O-CB 3.3Å; L28-Q32 VanDerWaalsContact O-CG 3.29Å; L28-Q32 WeakPolarHBondContact O-CG 3.4Å; L28-Q32 PolarHBondContact O-N 3.39Å
29A88.8Confident81.6Confident48 Ų4860.4 Ų60.440%0.39735%0.348SS..Hα-helixtrans-56.2-40.3176.500000111I25 M26 Q32 L33I25-A29 WeakPolarHBondContact O-CB 3.44Å; I25-A29 PolarHBondContact O-N 3.26Å; M26-A29 PolarHBondContact O-N 3.21Å; A29-Q32 PolarHBondContact O-N 3.28Å; A29-L33 WeakPolarHBondContact O-CB 3.11Å; A29-L33 PolarHBondContact O-N 3.37Å
30S91.6Very high83.7Confident0 Ų060.5 Ų60.50%036%0.355CS..Hα-helixtrans-62.4-44.9176.9780000112.8M26 A27 L28 Y34 V112 W113M26-S30 WeakPolarHBondContact O-CB 3.3Å; M26-S30 PolarHBondContact O-N 3.48Å; A27-S30 PolarHBondContact O-N 2.89Å; A27-S30 PolarHBondContact O-OG 2.78Å; L28-S30 PolarHBondContact O-N 2.73Å; S30-Y34 PolarHBondContact O-N 3.41Å; S30-V112 WeakPolarHBondContact OG-CG1 3.33Å; S30-W113 WeakPolarHBondContact O-CZ3 3.41Å
31A89.5Confident85.4Confident28 Ų2857.2 Ų57.223%0.23134%0.339CS..Hα-helixtrans-69.4-39178.500000112.2A27 L28 Y34 S35 V112A27-A31 PolarHBondContact O-N 3.01Å; L28-A31 PolarHBondContact O-N 3.3Å; L28-A31 VanDerWaalsContact O-N 3.16Å; A31-Y34 PolarHBondContact O-N 2.78Å; A31-S35 PolarHBondContact O-N 2.72Å; A31-V112 HydrophobicContact CB-CG1 4.22Å
32Q89.1Confident86.8Confident111 Ų11158 Ų5852%0.51934%0.338SS..Hα-helixtrans-67.8-42.1177.3-67.8-66.14.800111.7L28 A29 Y34 S35 A36L28-Q32 WeakPolarHBondContact O-CB 3.3Å; L28-Q32 VanDerWaalsContact O-CG 3.29Å; L28-Q32 WeakPolarHBondContact O-CG 3.4Å; L28-Q32 PolarHBondContact O-N 3.39Å; A29-Q32 PolarHBondContact O-N 3.28Å; Q32-Y34 VanDerWaalsContact C-N 3.31Å; Q32-Y34 PolarHBondContact O-N 3.31Å; Q32-S35 PolarHBondContact O-N 3.33Å; Q32-S35 VanDerWaalsContact O-N 3.13Å; Q32-A36 WeakPolarHBondContact O-CB 3.23Å; Q32-A36 PolarHBondContact O-N 2.74Å
33L92.1Very high87.9Confident82 Ų8254.4 Ų54.443%0.42932%0.32SS..Hα-helixtrans-63.6-38.8176.5-166.1147.7000110.9A29 S35 A36 F37 F63 W113A29-L33 WeakPolarHBondContact O-CB 3.11Å; A29-L33 PolarHBondContact O-N 3.37Å; L33-S35 VanDerWaalsContact C-N 3.35Å; L33-S35 PolarHBondContact O-N 2.87Å; L33-A36 PolarHBondContact O-N 3.08Å; L33-F37 VanDerWaalsContact O-CB 3.28Å; L33-F37 WeakPolarHBondContact O-CB 3.19Å; L33-F37 PolarHBondContact O-N 2.59Å; L33-F63 HydrophobicContact CD1-CZ 4.37Å; L33-W113 HydrophobicContact CB-CZ3 4.28Å; L33-W113 HydrophobicContact CD2-CH2 3.64Å; L33-W113 HydrophobicContact CD2-CZ3 3.51Å
34Y91.3Very high89Confident27 Ų2757.8 Ų57.811%0.10634%0.337CS..Hα-helixtrans-60.9-43.5171.5-175.3-87.8000112S30 A31 Q32 A36 F37 W113 V116 T117 D120S30-Y34 PolarHBondContact O-N 3.41Å; A31-Y34 PolarHBondContact O-N 2.78Å; Q32-Y34 VanDerWaalsContact C-N 3.31Å; Q32-Y34 PolarHBondContact O-N 3.31Å; Y34-A36 VanDerWaalsContact C-N 3.32Å; Y34-A36 PolarHBondContact O-N 2.83Å; Y34-F37 PolarHBondContact O-N 3.46Å; Y34-W113 HydrophobicContact CD2-CD2 4.45Å; Y34-W113 HydrophobicContact CD2-CH2 4.04Å; Y34-W113 AromaticContact CD2-CZ2 3.89Å; Y34-W113 HydrophobicContact CD2-CZ2 3.89Å; Y34-W113 HydrophobicContact CD2-CZ3 4.36Å; Y34-V116 HydrophobicContact CD1-CG1 3.34Å; Y34-V116 HydrophobicContact CD2-CG1 4.47Å; Y34-V116 HydrophobicContact CE1-CG1 3.76Å; Y34-V116 HydrophobicContact CG-CG1 3.76Å; Y34-T117 HydrophobicContact CE2-CG2 4.01Å; Y34-T117 WeakPolarHBondContact CE2-OG1 3.35Å; Y34-D120 HydrophobicContact CE1-CB 3.97Å; Y34-D120 WeakPolarHBondContact CE1-OD2 3.45Å; Y34-D120 VanDerWaalsContact OH-CB 3.28Å; Y34-D120 WeakPolarHBondContact OH-CB 3.16Å; Y34-D120 PolarHBondContact OH-OD2 3.48Å
35S86.5Confident89.8Confident87 Ų8758.7 Ų58.761%0.60834%0.338SS*.Hα-helixtrans-68.3-30.6179.5-172.10000113.3A31 Q32 L33A31-S35 PolarHBondContact O-N 2.72Å; Q32-S35 PolarHBondContact O-N 3.33Å; Q32-S35 VanDerWaalsContact O-N 3.13Å; L33-S35 VanDerWaalsContact C-N 3.35Å; L33-S35 PolarHBondContact O-N 2.87Å
36A88.4Confident90.2Very high87 Ų8760.5 Ų60.572%0.71934%0.344SS*.Hα-helixtrans-83.1-21.2177.200000112.5Q32 L33 Y34 E38Q32-A36 WeakPolarHBondContact O-CB 3.23Å; Q32-A36 PolarHBondContact O-N 2.74Å; L33-A36 PolarHBondContact O-N 3.08Å; Y34-A36 VanDerWaalsContact C-N 3.32Å; Y34-A36 PolarHBondContact O-N 2.83Å; A36-E38 PolarHBondContact O-N 3.14Å
37F90.8Very high90.7Very high82 Ų8266.3 Ų66.336%0.3637%0.367SS..SBendtrans-69.7124179.4179.7-96.9000111L33 Y34 F39 L55L33-F37 VanDerWaalsContact O-CB 3.28Å; L33-F37 WeakPolarHBondContact O-CB 3.19Å; L33-F37 PolarHBondContact O-N 2.59Å; Y34-F37 PolarHBondContact O-N 3.46Å; F37-F39 HydrophobicContact CD1-CB 4.47Å; F37-F39 HydrophobicContact CE1-CB 4.26Å; F37-F39 HydrophobicContact CE1-CD2 4.3Å; F37-F39 PolarHBondContact O-N 3.35Å; F37-L55 HydrophobicContact CE1-CD1 3.54Å; F37-L55 HydrophobicContact CE1-CD2 3.78Å; F37-L55 HydrophobicContact CE1-CG 4.34Å; F37-L55 HydrophobicContact CE2-CD2 4.16Å; F37-L55 HydrophobicContact CZ-CD1 3.81Å; F37-L55 HydrophobicContact CZ-CD2 3.5Å; F37-L55 VanDerWaalsContact CZ-CD2 3.5Å; F37-L55 HydrophobicContact CZ-CG 4.31Å
38E90Very high91.1Very high160 Ų16065.6 Ų65.675%0.74836%0.36SS*.  trans-83.7112173.8-167.9174179.300110.2A36 S40A36-E38 PolarHBondContact O-N 3.14Å; E38-S40 PolarHBondContact O-N 2.86Å
39F90.6Very high91.6Very high46 Ų4668.5 Ų68.520%0.20237%0.368CS..  trans-82.5116.5178.3-175.8-87.9000111F37 C41 Y51 L55 K122 C126F37-F39 HydrophobicContact CD1-CB 4.47Å; F37-F39 HydrophobicContact CE1-CB 4.26Å; F37-F39 HydrophobicContact CE1-CD2 4.3Å; F37-F39 PolarHBondContact O-N 3.35Å; F39-C41 HydrophobicContact CE1-CB 3.88Å; F39-C41 HydrophobicContact CZ-CB 4.43Å; F39-Y51 HydrophobicContact CD2-CE1 4.16Å; F39-Y51 HydrophobicContact CE1-CE1 4.41Å; F39-Y51 HydrophobicContact CE2-CD1 4.34Å; F39-Y51 AromaticContact CE2-CE1 3.72Å; F39-Y51 HydrophobicContact CE2-CE1 3.72Å; F39-Y51 HydrophobicContact CZ-CD1 4.28Å; F39-Y51 AromaticContact CZ-CE1 3.85Å; F39-Y51 HydrophobicContact CZ-CE1 3.85Å; F39-L55 HydrophobicContact CD2-CD1 3.49Å; F39-L55 VanDerWaalsContact CD2-CD1 3.49Å; F39-L55 HydrophobicContact CE2-CD1 3.5Å; F39-L55 VanDerWaalsContact CE2-CD1 3.5Å; F39-K122 HydrophobicContact CB-CD 4.24Å; F39-K122 HydrophobicContact CD1-CB 3.82Å; F39-K122 HydrophobicContact CD1-CD 4.22Å; F39-K122 HydrophobicContact CD2-CB 4.34Å; F39-K122 HydrophobicContact CE1-CB 3.84Å; F39-K122 HydrophobicContact CE2-CB 4.37Å; F39-K122 HydrophobicContact CG-CB 4.08Å; F39-K122 HydrophobicContact CG-CD 4.31Å; F39-K122 HydrophobicContact CZ-CB 4.14Å; F39-K122 VanDerWaalsContact CZ-O 3.26Å; F39-K122 WeakPolarHBondContact CZ-O 2.89Å; F39-C126 HydrophobicContact CE1-CB 4.1Å; F39-C126 HydrophobicContact CZ-CB 3.63Å
40S93Very high91.9Very high68 Ų6869.2 Ų69.248%0.47637%0.374SS..  trans-12889.6-178.1-530000110.3E38 Y51E38-S40 PolarHBondContact O-N 2.86Å; S40-Y51 PolarHBondContact N-OH 3.43Å; S40-Y51 VanDerWaalsContact N-OH 3.11Å; S40-Y51 WeakPolarHBondContact O-CE1 3.47Å; S40-Y51 PolarHBondContact O-OH 2.92Å
41C93.5Very high92.1Very high17 Ų1772.2 Ų72.212%0.11539%0.386CS..  trans-63.2132.9177.5-173.10000110.5F39 C43 C126 P159F39-C41 HydrophobicContact CE1-CB 3.88Å; F39-C41 HydrophobicContact CZ-CB 4.43Å; C41-C43 PolarHBondContact O-N 3.24Å; C41-C126 HydrophobicContact CB-CB 3.88Å; C41-C126 WeakPolarHBondContact CB-SG 3.43Å; C41-C126 WeakPolarHBondContact SG-CB 3.27Å; C41-C126 CovalentContact SG-SG 2.05Å; C41-C126 PolarHBondContact SG-SG 3.47Å; C41-P159 HydrophobicContact CB-CB 4.03Å
42P92.9Very high92.4Very high51 Ų5170.9 Ų70.933%0.33138%0.375SS..  trans-61.8-28.5179.4-2534.1000114I44 Y51P42-I44 HydrophobicContact CB-CD1 4.49Å; P42-I44 PolarHBondContact O-N 3.43Å; P42-Y51 HydrophobicContact CG-CD2 4.3Å; P42-Y51 HydrophobicContact CG-CG 4.04Å
43C93.6Very high92.7Very high11 Ų1167.4 Ų67.47%0.07436%0.359CS..  trans57.735.6-175.6-67.60000113.7C41 N48 A156 C160C41-C43 PolarHBondContact O-N 3.24Å; C43-N48 WeakPolarHBondContact CA-OD1 3.33Å; C43-N48 PolarHBondContact N-OD1 2.97Å; C43-A156 VanDerWaalsContact CA-O 3.27Å; C43-A156 WeakPolarHBondContact CA-O 3.46Å; C43-A156 WeakPolarHBondContact CB-O 3.31Å; C43-C160 HydrophobicContact CB-CB 3.97Å; C43-C160 WeakPolarHBondContact CB-SG 3.43Å; C43-C160 WeakPolarHBondContact SG-CB 3.39Å; C43-C160 PolarHBondContact SG-N 3.44Å; C43-C160 VanDerWaalsContact SG-N 3.4Å; C43-C160 CovalentContact SG-SG 2.02Å; C43-C160 PolarHBondContact SG-SG 2.85Å
44I93Very high92.9Very high78 Ų7864.7 Ų64.740%0.435%0.35SS..  trans-120.9128.5175-57.7167000106.6P42 E46 Y47 N48P42-I44 HydrophobicContact CB-CD1 4.49Å; P42-I44 PolarHBondContact O-N 3.43Å; I44-E46 HydrophobicContact CG2-CB 4.48Å; I44-E46 PolarHBondContact O-N 2.96Å; I44-E46 VanDerWaalsContact O-N 3.13Å; I44-Y47 HydrophobicContact CB-CD2 4.24Å; I44-Y47 HydrophobicContact CD1-CD2 4.38Å; I44-Y47 HydrophobicContact CG2-CD2 3.97Å; I44-Y47 PolarHBondContact O-N 2.94Å; I44-Y47 VanDerWaalsContact O-N 3.09Å; I44-N48 PolarHBondContact N-OD1 3.48Å; I44-N48 VanDerWaalsContact N-OD1 3.07Å; I44-N48 WeakPolarHBondContact O-CB 3.35Å; I44-N48 PolarHBondContact O-N 3.32Å; I44-N48 PolarHBondContact O-OD1 3.42Å; I44-N48 VanDerWaalsContact O-OD1 3.1Å
45P90.9Very high93.1Very high42 Ų4264.6 Ų64.627%0.27335%0.352SS..Hα-helixtrans-56.6-36.2-171.120.5-32.4000113.3V130 V152 A156P45-V130 HydrophobicContact CB-CG2 4.31Å; P45-V152 HydrophobicContact CB-CG1 3.62Å; P45-V152 HydrophobicContact CG-CG1 4.24Å; P45-A156 HydrophobicContact CB-CB 4.01Å; P45-A156 HydrophobicContact CG-CB 4.42Å
46E92.6Very high93.5Very high153 Ų15361.8 Ų61.872%0.71533%0.33SS*.Hα-helixtrans-68.9-33.1-178.8-65.9158.3-164.800113.5I44I44-E46 HydrophobicContact CG2-CB 4.48Å; I44-E46 PolarHBondContact O-N 2.96Å; I44-E46 VanDerWaalsContact O-N 3.13Å
47Y94.7Very high93.8Very high136 Ų13660.9 Ų60.953%0.53332%0.315SS..Hα-helixtrans-104.7-18.7-172.1-67.2-74.2000114I44 Y49 A50 Y51I44-Y47 HydrophobicContact CB-CD2 4.24Å; I44-Y47 HydrophobicContact CD1-CD2 4.38Å; I44-Y47 HydrophobicContact CG2-CD2 3.97Å; I44-Y47 PolarHBondContact O-N 2.94Å; I44-Y47 VanDerWaalsContact O-N 3.09Å; Y47-Y49 PolarHBondContact O-N 3.35Å; Y47-A50 PolarHBondContact O-N 3.24Å; Y47-Y51 WeakPolarHBondContact O-CB 3.38Å; Y47-Y51 PolarHBondContact O-N 3.26Å
48N95.1Very high94.1Very high0 Ų062.2 Ų62.20%033%0.325CS..Hα-helixtrans-55.5-47-176.8-87.210000113C43 I44 G52 C126 S129 A156C43-N48 WeakPolarHBondContact CA-OD1 3.33Å; C43-N48 PolarHBondContact N-OD1 2.97Å; I44-N48 PolarHBondContact N-OD1 3.48Å; I44-N48 VanDerWaalsContact N-OD1 3.07Å; I44-N48 WeakPolarHBondContact O-CB 3.35Å; I44-N48 PolarHBondContact O-N 3.32Å; I44-N48 PolarHBondContact O-OD1 3.42Å; I44-N48 VanDerWaalsContact O-OD1 3.1Å; N48-G52 PolarHBondContact O-N 3.1Å; N48-C126 WeakPolarHBondContact CB-O 3.49Å; N48-S129 PolarHBondContact ND2-OG 3.43Å; N48-A156 WeakPolarHBondContact ND2-CA 3.35Å; N48-A156 PolarHBondContact ND2-O 3.04Å
49Y95.3Very high94.4Very high124 Ų12455.6 Ų55.649%0.48630%0.296SS..Hα-helixtrans-64.2-50.5178.9-176.7-99000112Y47 Y51 G52 I53 A127 F128Y47-Y49 PolarHBondContact O-N 3.35Å; Y49-Y51 PolarHBondContact O-N 3.3Å; Y49-G52 PolarHBondContact O-N 3.48Å; Y49-I53 HydrophobicContact CD1-CG1 4.44Å; Y49-I53 HydrophobicContact CD2-CG1 4.02Å; Y49-I53 HydrophobicContact CE1-CG1 4.12Å; Y49-I53 HydrophobicContact CE2-CD1 4.29Å; Y49-I53 HydrophobicContact CE2-CG1 3.66Å; Y49-I53 HydrophobicContact CG-CG1 4.4Å; Y49-I53 WeakPolarHBondContact O-CB 3.24Å; Y49-I53 WeakPolarHBondContact O-CG1 3.33Å; Y49-I53 PolarHBondContact O-N 3.23Å; Y49-A127 HydrophobicContact CD2-CB 4.29Å; Y49-F128 HydrophobicContact CE2-CE1 4.17Å; Y49-F128 HydrophobicContact CE2-CZ 4.24Å
50A96.4Very high94.7Very high63 Ų6353.9 Ų53.952%0.52129%0.289SS..Hα-helixtrans-61.9-42.3-178.800000112.1Y47 G54Y47-A50 PolarHBondContact O-N 3.24Å; A50-G54 VanDerWaalsContact O-CA 3.3Å; A50-G54 WeakPolarHBondContact O-CA 3.26Å; A50-G54 PolarHBondContact O-N 2.96Å
51Y95.8Very high94.9Very high64 Ų6454.9 Ų54.925%0.25129%0.289SS..Hα-helixtrans-66.8-49.2177.3-178.5-95000111.9F39 S40 P42 Y47 Y49 G54 L55F39-Y51 HydrophobicContact CD2-CE1 4.16Å; F39-Y51 HydrophobicContact CE1-CE1 4.41Å; F39-Y51 HydrophobicContact CE2-CD1 4.34Å; F39-Y51 AromaticContact CE2-CE1 3.72Å; F39-Y51 HydrophobicContact CE2-CE1 3.72Å; F39-Y51 HydrophobicContact CZ-CD1 4.28Å; F39-Y51 AromaticContact CZ-CE1 3.85Å; F39-Y51 HydrophobicContact CZ-CE1 3.85Å; S40-Y51 PolarHBondContact N-OH 3.43Å; S40-Y51 VanDerWaalsContact N-OH 3.11Å; S40-Y51 WeakPolarHBondContact O-CE1 3.47Å; S40-Y51 PolarHBondContact O-OH 2.92Å; P42-Y51 HydrophobicContact CG-CD2 4.3Å; P42-Y51 HydrophobicContact CG-CG 4.04Å; Y47-Y51 WeakPolarHBondContact O-CB 3.38Å; Y47-Y51 PolarHBondContact O-N 3.26Å; Y49-Y51 PolarHBondContact O-N 3.3Å; Y51-G54 PolarHBondContact O-N 2.88Å; Y51-L55 HydrophobicContact CD1-CD1 4.3Å; Y51-L55 HydrophobicContact CE1-CD1 3.64Å; Y51-L55 HydrophobicContact CE2-CD1 4.32Å; Y51-L55 PolarHBondContact O-N 2.87Å; Y51-L55 VanDerWaalsContact O-N 3.12Å
52G95.2Very high95Very high0 Ų060.6 Ų60.60%031%0.308CS..Hα-helixtrans-62.1-51-178.700000112.4N48 Y49 L56 S123N48-G52 PolarHBondContact O-N 3.1Å; Y49-G52 PolarHBondContact O-N 3.48Å; G52-L56 PolarHBondContact O-N 2.82Å; G52-S123 PolarHBondContact O-OG 2.96Å
53I96.1Very high95.1Very high38 Ų3858.4 Ų58.420%0.19529%0.293CS..Hα-helixtrans-69.5-35.3177.5-63-57.9000111.6Y49 L55 L56 V57 A127 F128Y49-I53 HydrophobicContact CD1-CG1 4.44Å; Y49-I53 HydrophobicContact CD2-CG1 4.02Å; Y49-I53 HydrophobicContact CE1-CG1 4.12Å; Y49-I53 HydrophobicContact CE2-CD1 4.29Å; Y49-I53 HydrophobicContact CE2-CG1 3.66Å; Y49-I53 HydrophobicContact CG-CG1 4.4Å; Y49-I53 WeakPolarHBondContact O-CB 3.24Å; Y49-I53 WeakPolarHBondContact O-CG1 3.33Å; Y49-I53 PolarHBondContact O-N 3.23Å; I53-L55 VanDerWaalsContact C-N 3.32Å; I53-L55 PolarHBondContact O-N 3.48Å; I53-L56 WeakPolarHBondContact O-CA 3.42Å; I53-L56 WeakPolarHBondContact O-CB 3.42Å; I53-L56 PolarHBondContact O-N 3.33Å; I53-V57 HydrophobicContact CG2-CG2 3.96Å; I53-V57 WeakPolarHBondContact O-CG2 3.15Å; I53-V57 PolarHBondContact O-N 2.7Å; I53-A127 HydrophobicContact CD1-CB 4.03Å; I53-A127 HydrophobicContact CG1-CB 4.02Å; I53-F128 HydrophobicContact CD1-CE2 4.14Å; I53-F128 HydrophobicContact CD1-CZ 4.3Å
54G96.1Very high95.1Very high24 Ų2460.6 Ų60.625%0.24730%0.301CS..Hα-helixtrans-55.3-46175.900000112.1A50 Y51 L56 V57 I58A50-G54 VanDerWaalsContact O-CA 3.3Å; A50-G54 WeakPolarHBondContact O-CA 3.26Å; A50-G54 PolarHBondContact O-N 2.96Å; Y51-G54 PolarHBondContact O-N 2.88Å; G54-L56 VanDerWaalsContact C-N 3.28Å; G54-L56 PolarHBondContact O-N 2.99Å; G54-V57 PolarHBondContact O-N 3.45Å; G54-I58 VanDerWaalsContact O-CB 3.29Å; G54-I58 WeakPolarHBondContact O-CB 3.22Å; G54-I58 WeakPolarHBondContact O-CG1 3.25Å; G54-I58 PolarHBondContact O-N 3.35Å
55L94.8Very high95.1Very high26 Ų2661.6 Ų61.614%0.13631%0.307CS..Hα-helixtrans-68.6-24.3175.7-75.8175.1000114.2F37 F39 Y51 I53 P59 W113F37-L55 HydrophobicContact CE1-CD1 3.54Å; F37-L55 HydrophobicContact CE1-CD2 3.78Å; F37-L55 HydrophobicContact CE1-CG 4.34Å; F37-L55 HydrophobicContact CE2-CD2 4.16Å; F37-L55 HydrophobicContact CZ-CD1 3.81Å; F37-L55 HydrophobicContact CZ-CD2 3.5Å; F37-L55 VanDerWaalsContact CZ-CD2 3.5Å; F37-L55 HydrophobicContact CZ-CG 4.31Å; F39-L55 HydrophobicContact CD2-CD1 3.49Å; F39-L55 VanDerWaalsContact CD2-CD1 3.49Å; F39-L55 HydrophobicContact CE2-CD1 3.5Å; F39-L55 VanDerWaalsContact CE2-CD1 3.5Å; Y51-L55 HydrophobicContact CD1-CD1 4.3Å; Y51-L55 HydrophobicContact CE1-CD1 3.64Å; Y51-L55 HydrophobicContact CE2-CD1 4.32Å; Y51-L55 PolarHBondContact O-N 2.87Å; Y51-L55 VanDerWaalsContact O-N 3.12Å; I53-L55 VanDerWaalsContact C-N 3.32Å; I53-L55 PolarHBondContact O-N 3.48Å; L55-P59 VanDerWaalsContact O-CD 3.31Å; L55-P59 WeakPolarHBondContact O-CD 3.19Å; L55-P59 WeakPolarHBondContact O-CG 3.38Å; L55-W113 PolarHBondContact O-NE1 3.44Å
56L94.8Very high95.1Very high28 Ų2862 Ų6215%0.14731%0.306CS..Hα-helixtrans-77.6-30.1174.9-170.466.2000112.2G52 I53 G54 P60 I114 T117 L118G52-L56 PolarHBondContact O-N 2.82Å; I53-L56 WeakPolarHBondContact O-CA 3.42Å; I53-L56 WeakPolarHBondContact O-CB 3.42Å; I53-L56 PolarHBondContact O-N 3.33Å; G54-L56 VanDerWaalsContact C-N 3.28Å; G54-L56 PolarHBondContact O-N 2.99Å; L56-P60 VanDerWaalsContact O-CG 3.28Å; L56-P60 WeakPolarHBondContact O-CG 3.47Å; L56-I114 HydrophobicContact CD1-CG2 4.38Å; L56-T117 HydrophobicContact CD1-CG2 3.71Å; L56-L118 HydrophobicContact CD1-CD2 4.12Å; L56-L118 HydrophobicContact CD1-CG 4.11Å; L56-L118 HydrophobicContact CD2-CD2 4.39Å
57V95.5Very high94.8Very high68 Ų6854.9 Ų54.941%0.41227%0.274SS..Hα-helixtrans-108-43.4-169.9176.90000113.7I53 G54 P60 I61I53-V57 HydrophobicContact CG2-CG2 3.96Å; I53-V57 WeakPolarHBondContact O-CG2 3.15Å; I53-V57 PolarHBondContact O-N 2.7Å; G54-V57 PolarHBondContact O-N 3.45Å; V57-P60 WeakPolarHBondContact O-CD 3.3Å; V57-I61 HydrophobicContact CG1-CD1 3.74Å; V57-I61 WeakPolarHBondContact O-CG1 3.28Å; V57-I61 PolarHBondContact O-N 3.35Å
58I96.7Very high94.4Very high109 Ų10950 Ų5056%0.55926%0.256SS*.Hα-helixtrans-68.3-49.1-171.8-60-62.1000112.5G54 I61 W62G54-I58 VanDerWaalsContact O-CB 3.29Å; G54-I58 WeakPolarHBondContact O-CB 3.22Å; G54-I58 WeakPolarHBondContact O-CG1 3.25Å; G54-I58 PolarHBondContact O-N 3.35Å; I58-I61 PolarHBondContact O-N 3.5Å; I58-I61 VanDerWaalsContact O-N 3.15Å; I58-W62 PolarHBondContact O-N 3.46Å
59P96Very high94Very high22 Ų2255.5 Ų55.514%0.14329%0.289CS..Hα-helixtrans-61.6-40.6179.5-19.631.6000113.4L55 I61 W62 F63 W113L55-P59 VanDerWaalsContact O-CD 3.31Å; L55-P59 WeakPolarHBondContact O-CD 3.19Å; L55-P59 WeakPolarHBondContact O-CG 3.38Å; P59-I61 VanDerWaalsContact C-N 3.34Å; P59-I61 PolarHBondContact O-N 2.84Å; P59-W62 PolarHBondContact O-N 3.24Å; P59-F63 WeakPolarHBondContact O-CD2 3.18Å; P59-F63 PolarHBondContact O-N 3.23Å; P59-W113 HydrophobicContact CB-CD2 3.85Å; P59-W113 HydrophobicContact CB-CE3 4.4Å; P59-W113 HydrophobicContact CB-CG 4.33Å; P59-W113 HydrophobicContact CB-CH2 4.12Å; P59-W113 HydrophobicContact CB-CZ2 3.54Å; P59-W113 HydrophobicContact CG-CH2 4.34Å; P59-W113 HydrophobicContact CG-CZ2 3.5Å; P59-W113 VanDerWaalsContact CG-CZ2 3.5Å
60P96.3Very high93.2Very high10 Ų1053.3 Ų53.37%0.06529%0.286CS..Hα-helixtrans-56.9-41.2171.6-31.639.2000114.2L56 V57 W62 F63 F64 P110 W113 I114L56-P60 VanDerWaalsContact O-CG 3.28Å; L56-P60 WeakPolarHBondContact O-CG 3.47Å; V57-P60 WeakPolarHBondContact O-CD 3.3Å; P60-W62 VanDerWaalsContact C-N 3.34Å; P60-F63 PolarHBondContact O-N 2.9Å; P60-F64 VanDerWaalsContact O-CB 3.32Å; P60-F64 WeakPolarHBondContact O-CB 3.34Å; P60-F64 PolarHBondContact O-N 3.03Å; P60-P110 HydrophobicContact CB-CB 3.95Å; P60-P110 WeakPolarHBondContact O-CG 3.43Å; P60-W113 VanDerWaalsContact CD-CD1 3.47Å; P60-W113 HydrophobicContact CG-CB 4.26Å; P60-W113 VanDerWaalsContact CG-CD1 3.46Å; P60-W113 HydrophobicContact CG-CG 4.04Å; P60-I114 HydrophobicContact CB-CD1 4.16Å; P60-I114 HydrophobicContact CB-CG1 4.21Å; P60-I114 HydrophobicContact CG-CD1 4.07Å; P60-I114 HydrophobicContact CG-CG1 3.6Å
61I96.7Very high92.2Very high89 Ų8951.4 Ų51.446%0.45627%0.267SS..Hα-helixtrans-62.6-45175.8-66.4167.8000110V57 I58 P59 F64 L65V57-I61 HydrophobicContact CG1-CD1 3.74Å; V57-I61 WeakPolarHBondContact O-CG1 3.28Å; V57-I61 PolarHBondContact O-N 3.35Å; I58-I61 PolarHBondContact O-N 3.5Å; I58-I61 VanDerWaalsContact O-N 3.15Å; P59-I61 VanDerWaalsContact C-N 3.34Å; P59-I61 PolarHBondContact O-N 2.84Å; I61-F64 WeakPolarHBondContact O-CB 3.04Å; I61-F64 PolarHBondContact O-N 3.43Å; I61-L65 HydrophobicContact CG2-CD1 4.31Å; I61-L65 WeakPolarHBondContact O-CG 3.4Å; I61-L65 PolarHBondContact O-N 3.1Å
62W96.3Very high91Very high136 Ų13654.3 Ų54.352%0.51529%0.287SS..Hα-helixtrans-61.8-47177.7-179.482.8000112.3I58 P59 P60 F64 L65 L66I58-W62 PolarHBondContact O-N 3.46Å; P59-W62 PolarHBondContact O-N 3.24Å; P60-W62 VanDerWaalsContact C-N 3.34Å; W62-F64 VanDerWaalsContact C-N 3.29Å; W62-F64 PolarHBondContact O-N 2.74Å; W62-L65 PolarHBondContact O-N 2.85Å; W62-L66 HydrophobicContact CH2-CD2 3.66Å; W62-L66 HydrophobicContact CZ2-CD2 4.15Å; W62-L66 HydrophobicContact CZ3-CD2 3.88Å; W62-L66 WeakPolarHBondContact O-CB 3.46Å; W62-L66 PolarHBondContact O-N 3.4Å
63F95Very high89.8Confident5 Ų556.2 Ų56.22%0.02230%0.297CS..Hα-helixtrans-61.7-36.8175.9-82.7-65.2000112.5L33 P59 P60 L66 G67 A109 P110 W113L33-F63 HydrophobicContact CD1-CZ 4.37Å; P59-F63 WeakPolarHBondContact O-CD2 3.18Å; P59-F63 PolarHBondContact O-N 3.23Å; P60-F63 PolarHBondContact O-N 2.9Å; F63-L66 PolarHBondContact O-N 3.07Å; F63-G67 PolarHBondContact O-N 3.02Å; F63-A109 HydrophobicContact CB-CB 4.21Å; F63-A109 HydrophobicContact CD1-CB 4.2Å; F63-A109 HydrophobicContact CG-CB 4.31Å; F63-P110 HydrophobicContact CB-CG 4.05Å; F63-W113 HydrophobicContact CD2-CE3 4.3Å; F63-W113 HydrophobicContact CE2-CD2 4.21Å; F63-W113 AromaticContact CE2-CE3 3.53Å; F63-W113 HydrophobicContact CE2-CE3 3.53Å; F63-W113 AromaticContact CE2-CZ3 3.91Å; F63-W113 HydrophobicContact CE2-CZ3 3.91Å; F63-W113 HydrophobicContact CZ-CE3 4.36Å
64F93.9Very high88.8Confident57 Ų5756.2 Ų56.225%0.2530%0.299CS..Hα-helixtrans-62.7-48.9176.3178.8-108.3000110.9P60 I61 W62 G67 F68 T103 L107 P110P60-F64 VanDerWaalsContact O-CB 3.32Å; P60-F64 WeakPolarHBondContact O-CB 3.34Å; P60-F64 PolarHBondContact O-N 3.03Å; I61-F64 WeakPolarHBondContact O-CB 3.04Å; I61-F64 PolarHBondContact O-N 3.43Å; W62-F64 VanDerWaalsContact C-N 3.29Å; W62-F64 PolarHBondContact O-N 2.74Å; F64-G67 PolarHBondContact O-N 3.39Å; F64-F68 HydrophobicContact CD1-CD2 4.5Å; F64-F68 HydrophobicContact CD1-CE2 4.34Å; F64-F68 HydrophobicContact CD2-CE2 4.27Å; F64-F68 HydrophobicContact CE1-CD2 4.25Å; F64-F68 AromaticContact CE1-CE2 3.73Å; F64-F68 HydrophobicContact CE1-CE2 3.73Å; F64-F68 HydrophobicContact CE2-CD2 4.48Å; F64-F68 AromaticContact CE2-CE2 3.65Å; F64-F68 HydrophobicContact CE2-CE2 3.65Å; F64-F68 HydrophobicContact CZ-CD2 4.27Å; F64-F68 AromaticContact CZ-CE2 3.38Å; F64-F68 HydrophobicContact CZ-CE2 3.38Å; F64-F68 HydrophobicContact CZ-CZ 4.13Å; F64-F68 WeakPolarHBondContact O-CD2 3.32Å; F64-F68 PolarHBondContact O-N 2.78Å; F64-T103 HydrophobicContact CE2-CG2 4.04Å; F64-T103 HydrophobicContact CZ-CG2 4.19Å; F64-L107 HydrophobicContact CD2-CD2 3.67Å; F64-L107 HydrophobicContact CD2-CG 4.1Å; F64-L107 HydrophobicContact CE2-CD2 3.67Å; F64-L107 HydrophobicContact CE2-CG 3.86Å; F64-P110 HydrophobicContact CB-CG 3.8Å
65L93.6Very high87.7Confident100 Ų10059.1 Ų59.152%0.52432%0.315SS..Hα-helixtrans-62.3-43.2176.3-66.3175.9000111.8I61 W62 G67 F68 V69I61-L65 HydrophobicContact CG2-CD1 4.31Å; I61-L65 WeakPolarHBondContact O-CG 3.4Å; I61-L65 PolarHBondContact O-N 3.1Å; W62-L65 PolarHBondContact O-N 2.85Å; L65-G67 VanDerWaalsContact C-N 3.25Å; L65-G67 PolarHBondContact O-N 2.88Å; L65-F68 WeakPolarHBondContact O-CB 3.4Å; L65-F68 PolarHBondContact O-N 3.3Å; L65-V69 WeakPolarHBondContact O-CG2 3.3Å; L65-V69 PolarHBondContact O-N 3.5Å
66L90.1Very high86.5Confident49 Ų4960.5 Ų60.526%0.25732%0.321SS..Hα-helixtrans-58.7-39.7175.8-175.763.9000111.3W62 F63 F68 V69 L70W62-L66 HydrophobicContact CH2-CD2 3.66Å; W62-L66 HydrophobicContact CZ2-CD2 4.15Å; W62-L66 HydrophobicContact CZ3-CD2 3.88Å; W62-L66 WeakPolarHBondContact O-CB 3.46Å; W62-L66 PolarHBondContact O-N 3.4Å; F63-L66 PolarHBondContact O-N 3.07Å; L66-F68 VanDerWaalsContact C-N 3.26Å; L66-F68 PolarHBondContact O-N 2.81Å; L66-V69 PolarHBondContact O-N 2.83Å; L66-V69 VanDerWaalsContact O-N 3.17Å; L66-L70 HydrophobicContact CD1-CD1 4.16Å; L66-L70 HydrophobicContact CD1-CG 4.11Å; L66-L70 HydrophobicContact CD2-CD1 4.44Å; L66-L70 HydrophobicContact CG-CD1 3.9Å; L66-L70 HydrophobicContact CG-CG 4.25Å; L66-L70 WeakPolarHBondContact O-CB 3.35Å; L66-L70 WeakPolarHBondContact O-CG 3.5Å; L66-L70 PolarHBondContact O-N 3.36Å
67G87Confident85.4Confident4 Ų460 Ų604%0.04132%0.319CS..Hα-helixtrans-60.6-32.3174.300000113.9F63 F64 L65 N71 S106F63-G67 PolarHBondContact O-N 3.02Å; F64-G67 PolarHBondContact O-N 3.39Å; L65-G67 VanDerWaalsContact C-N 3.25Å; L65-G67 PolarHBondContact O-N 2.88Å; G67-N71 WeakPolarHBondContact O-CB 3.41Å; G67-S106 VanDerWaalsContact C-OG 3.27Å; G67-S106 PolarHBondContact O-OG 3.28Å
68F85.3Confident84.5Confident35 Ų3559.8 Ų59.815%0.15432%0.324CS..Hα-helixtrans-73.2-43.9171.1-84.3-91000112.3F64 L65 L66 L70 N71 V74 F99 I102F64-F68 HydrophobicContact CD1-CD2 4.5Å; F64-F68 HydrophobicContact CD1-CE2 4.34Å; F64-F68 HydrophobicContact CD2-CE2 4.27Å; F64-F68 HydrophobicContact CE1-CD2 4.25Å; F64-F68 AromaticContact CE1-CE2 3.73Å; F64-F68 HydrophobicContact CE1-CE2 3.73Å; F64-F68 HydrophobicContact CE2-CD2 4.48Å; F64-F68 AromaticContact CE2-CE2 3.65Å; F64-F68 HydrophobicContact CE2-CE2 3.65Å; F64-F68 HydrophobicContact CZ-CD2 4.27Å; F64-F68 AromaticContact CZ-CE2 3.38Å; F64-F68 HydrophobicContact CZ-CE2 3.38Å; F64-F68 HydrophobicContact CZ-CZ 4.13Å; F64-F68 WeakPolarHBondContact O-CD2 3.32Å; F64-F68 PolarHBondContact O-N 2.78Å; L65-F68 WeakPolarHBondContact O-CB 3.4Å; L65-F68 PolarHBondContact O-N 3.3Å; L66-F68 VanDerWaalsContact C-N 3.26Å; L66-F68 PolarHBondContact O-N 2.81Å; F68-L70 VanDerWaalsContact C-N 3.33Å; F68-L70 PolarHBondContact O-N 3.31Å; F68-N71 PolarHBondContact O-N 2.91Å; F68-N71 VanDerWaalsContact O-N 3.13Å; F68-V74 HydrophobicContact CB-CG2 4.46Å; F68-V74 HydrophobicContact CD1-CG1 4.22Å; F68-V74 HydrophobicContact CD1-CG2 3.74Å; F68-V74 WeakPolarHBondContact O-CG2 3.34Å; F68-F99 HydrophobicContact CE1-CE2 4.1Å; F68-F99 HydrophobicContact CZ-CE2 4.27Å; F68-I102 HydrophobicContact CD1-CG2 3.92Å; F68-I102 HydrophobicContact CE1-CG2 3.68Å; F68-I102 HydrophobicContact CZ-CG2 4.21Å
69V87.3Confident83.7Confident115 Ų11559.9 Ų59.970%0.69732%0.322SS*.Hα-helixtrans-61.7-41.7-179.6173.30000111.5L65 L66 N71L65-V69 WeakPolarHBondContact O-CG2 3.3Å; L65-V69 PolarHBondContact O-N 3.5Å; L66-V69 PolarHBondContact O-N 2.83Å; L66-V69 VanDerWaalsContact O-N 3.17Å; V69-N71 PolarHBondContact O-N 3.39Å
70L78.8Confident82.6Confident78 Ų7859.5 Ų59.541%0.40832%0.318SS..THydrogen-bonded Turntrans-74.5-5.8179.4-65.5177.4000113.5M26 L66 F68M26-L70 HydrophobicContact CG-CD1 4.22Å; M26-L70 HydrophobicContact SD-CD1 3.76Å; L66-L70 HydrophobicContact CD1-CD1 4.16Å; L66-L70 HydrophobicContact CD1-CG 4.11Å; L66-L70 HydrophobicContact CD2-CD1 4.44Å; L66-L70 HydrophobicContact CG-CD1 3.9Å; L66-L70 HydrophobicContact CG-CG 4.25Å; L66-L70 WeakPolarHBondContact O-CB 3.35Å; L66-L70 WeakPolarHBondContact O-CG 3.5Å; L66-L70 PolarHBondContact O-N 3.36Å; F68-L70 VanDerWaalsContact C-N 3.33Å; F68-L70 PolarHBondContact O-N 3.31Å
71N75.1Confident81.5Confident23 Ų2366.2 Ų66.212%0.12334%0.342CS..  trans-97.2104.2-178.2-165.1-32.9000111.2G67 F68 V69 N73 V74 I102G67-N71 WeakPolarHBondContact O-CB 3.41Å; F68-N71 PolarHBondContact O-N 2.91Å; F68-N71 VanDerWaalsContact O-N 3.13Å; V69-N71 PolarHBondContact O-N 3.39Å; N71-N73 PolarHBondContact O-N 3.39Å; N71-N73 WeakPolarHBondContact OD1-CB 3.46Å; N71-N73 PolarHBondContact OD1-N 3.16Å; N71-N73 VanDerWaalsContact OD1-N 3.16Å; N71-V74 HydrophobicContact CB-CG2 3.87Å; N71-V74 WeakPolarHBondContact O-CB 3.42Å; N71-V74 WeakPolarHBondContact O-CG2 3.21Å; N71-V74 PolarHBondContact O-N 2.86Å; N71-I102 HydrophobicContact CB-CG2 4.5Å
72N70.7Confident80.7Confident125 Ų12570.9 Ų70.967%0.66836%0.359SS*.THydrogen-bonded Turntrans-57.2-15.2-179.5-64.9-15.4000114.6S75N72-S75 PolarHBondContact O-OG 3.32Å
73N70Confident79.8Confident39 Ų3968.4 Ų68.421%0.20935%0.35CS..Hα-helixtrans-85.9-10.4178.9-60.9-39.2000113.8N71 L77 I102 R227N71-N73 PolarHBondContact O-N 3.39Å; N71-N73 WeakPolarHBondContact OD1-CB 3.46Å; N71-N73 PolarHBondContact OD1-N 3.16Å; N71-N73 VanDerWaalsContact OD1-N 3.16Å; N73-L77 PolarHBondContact O-N 3.43Å; N73-L77 VanDerWaalsContact O-N 3.1Å; N73-I102 HydrophobicContact CB-CD1 4.07Å; N73-R227 PolarHBondContact OD1-NH1 3.34Å; N73-R227 PolarHBondContact OD1-NH2 3.04Å
74V74.6Confident78.8Confident39 Ų3972.2 Ų72.224%0.23638%0.375CS..Hα-helixtrans-71.1-36.6-176.7173.50000111.9F68 N71 L77 A78 I102F68-V74 HydrophobicContact CB-CG2 4.46Å; F68-V74 HydrophobicContact CD1-CG1 4.22Å; F68-V74 HydrophobicContact CD1-CG2 3.74Å; F68-V74 WeakPolarHBondContact O-CG2 3.34Å; N71-V74 HydrophobicContact CB-CG2 3.87Å; N71-V74 WeakPolarHBondContact O-CB 3.42Å; N71-V74 WeakPolarHBondContact O-CG2 3.21Å; N71-V74 PolarHBondContact O-N 2.86Å; V74-L77 PolarHBondContact O-N 2.88Å; V74-A78 WeakPolarHBondContact O-CB 3.42Å; V74-A78 PolarHBondContact O-N 3.01Å; V74-I102 HydrophobicContact CG2-CD1 4.21Å; V74-I102 HydrophobicContact CG2-CG2 3.9Å
75S72.9Confident77.4Confident84 Ų8475.7 Ų75.759%0.58740%0.401SS*.Hα-helixtrans-62.9-45.9175.453.60000111.8N72 L77 A78 E79N72-S75 PolarHBondContact O-OG 3.32Å; S75-L77 VanDerWaalsContact C-N 3.32Å; S75-L77 PolarHBondContact O-N 2.77Å; S75-A78 PolarHBondContact O-N 2.76Å; S75-E79 PolarHBondContact O-N 3.16Å
76M70.8Confident75.9Confident56 Ų5674.9 Ų74.928%0.27642%0.417SS..Hα-helixtrans-59.5-42.9174.7-176.6-168.1178.100111.6E79 E80M76-E79 PolarHBondContact O-N 3.37Å; M76-E80 PolarHBondContact O-N 3.5Å
77L71.2Confident74.5Confident18 Ų1880.3 Ų80.39%0.09444%0.438CS..Hα-helixtrans-63.9-42.9177.9-173.174.7000111.6N73 V74 S75 W81 L95 M98 F99N73-L77 PolarHBondContact O-N 3.43Å; N73-L77 VanDerWaalsContact O-N 3.1Å; V74-L77 PolarHBondContact O-N 2.88Å; S75-L77 VanDerWaalsContact C-N 3.32Å; S75-L77 PolarHBondContact O-N 2.77Å; L77-W81 WeakPolarHBondContact O-CB 3.31Å; L77-W81 PolarHBondContact O-N 2.85Å; L77-L95 HydrophobicContact CD1-CB 4.3Å; L77-L95 HydrophobicContact CD1-CD2 3.79Å; L77-M98 HydrophobicContact CD1-CB 4.38Å; L77-M98 HydrophobicContact CD1-CE 4.04Å; L77-F99 HydrophobicContact CD2-CB 3.92Å; L77-F99 HydrophobicContact CD2-CD2 3.75Å; L77-F99 HydrophobicContact CD2-CG 4.32Å
78A77.4Confident73.6Confident62 Ų6283.4 Ų83.451%0.51245%0.449SS..Hα-helixtrans-64.5-40178.100000111.9V74 S75 W81 K82V74-A78 WeakPolarHBondContact O-CB 3.42Å; V74-A78 PolarHBondContact O-N 3.01Å; S75-A78 PolarHBondContact O-N 2.76Å; A78-W81 PolarHBondContact O-N 2.92Å; A78-K82 WeakPolarHBondContact O-CB 3.49Å; A78-K82 PolarHBondContact O-N 3.45Å
79E78.4Confident72.6Confident111 Ų11186.9 Ų86.952%0.51947%0.473SS..Hα-helixtrans-66.6-46.2177.9-162.4-168.8145.200112S75 M76 W81 K82 R83S75-E79 PolarHBondContact O-N 3.16Å; M76-E79 PolarHBondContact O-N 3.37Å; E79-W81 VanDerWaalsContact C-N 3.3Å; E79-W81 PolarHBondContact O-N 3.49Å; E79-K82 PolarHBondContact O-N 2.93Å; E79-R83 PolarHBondContact O-N 3.26Å; E79-R83 IonicContact OE1-CZ 3.26Å; E79-R83 IonicContact OE1-NE 3.91Å; E79-R83 IonicContact OE1-NH2 3.12Å; E79-R83 PolarHBondContact OE1-NH2 2.85Å
80E73.8Confident71.5Confident15 Ų1583.6 Ų83.67%0.0745%0.449CS..Hα-helixtrans-65.4-33.4176.4-77.7-65144.100112.3M76 R83 R88 L95M76-E80 PolarHBondContact O-N 3.5Å; E80-R83 PolarHBondContact O-N 2.91Å; E80-R83 IonicContact OE1-CZ 3.34Å; E80-R83 IonicContact OE1-NE 3.74Å; E80-R83 IonicContact OE1-NH1 2.77Å; E80-R83 PolarHBondContact OE1-NH1 2.88Å; E80-R88 PolarHBondContact O-NE 3.34Å; E80-L95 HydrophobicContact CB-CD2 3.79Å; E80-L95 HydrophobicContact CG-CD2 4.44Å
81W72.6Confident71.1Confident150 Ų15083.8 Ų83.857%0.56845%0.45SS*.Hα-helixtrans-70-36175.5-160.7-87.7000112.5L77 A78 E79 R83 R88L77-W81 WeakPolarHBondContact O-CB 3.31Å; L77-W81 PolarHBondContact O-N 2.85Å; A78-W81 PolarHBondContact O-N 2.92Å; E79-W81 VanDerWaalsContact C-N 3.3Å; E79-W81 PolarHBondContact O-N 3.49Å; W81-R83 VanDerWaalsContact C-N 3.26Å; W81-R83 PolarHBondContact O-N 2.87Å; W81-R88 PolarHBondContact O-NH2 2.84Å
82K79.2Confident70.8Confident187 Ų18786 Ų8681%0.81347%0.466SS*.Hα-helixtrans-66.3-25.6177-172178.8179.6-177.60112.7A78 E79A78-K82 WeakPolarHBondContact O-CB 3.49Å; A78-K82 PolarHBondContact O-N 3.45Å; E79-K82 PolarHBondContact O-N 2.93Å
83R78.6Confident70.8Confident85 Ų8584.4 Ų84.432%0.32146%0.461SS..SBendtrans-66.6135178.1-70173.3-173.4-167.6-5.7111E79 E80 W81 R88E79-R83 PolarHBondContact O-N 3.26Å; E79-R83 IonicContact OE1-CZ 3.26Å; E79-R83 IonicContact OE1-NE 3.91Å; E79-R83 IonicContact OE1-NH2 3.12Å; E79-R83 PolarHBondContact OE1-NH2 2.85Å; E80-R83 PolarHBondContact O-N 2.91Å; E80-R83 IonicContact OE1-CZ 3.34Å; E80-R83 IonicContact OE1-NE 3.74Å; E80-R83 IonicContact OE1-NH1 2.77Å; E80-R83 PolarHBondContact OE1-NH1 2.88Å; W81-R83 VanDerWaalsContact C-N 3.26Å; W81-R83 PolarHBondContact O-N 2.87Å; R83-R88 HydrophobicContact CB-CG 4.17Å; R83-R88 PolarHBondContact O-NE 3.31Å; R83-R88 VanDerWaalsContact O-NE 3.1Å
84P74.6Confident70.6Confident84 Ų8485.8 Ų85.855%0.54547%0.467SS..  trans-57.6147.3178.6-22.531000112.7G86 K87P84-G86 PolarHBondContact O-N 2.92Å; P84-G86 VanDerWaalsContact O-N 3.09Å; P84-K87 PolarHBondContact O-N 3.44Å
85T63.1Low70.3Confident131 Ų13184 Ų8480%0.80446%0.456SS*.THydrogen-bonded Turntrans-56.4113.3173.10.60000109.5
86G61.8Low70.3Confident82 Ų8288.1 Ų88.185%0.84546%0.459SS*.THydrogen-bonded Turntrans116.4-21.1-174.300000114.9P84P84-G86 PolarHBondContact O-N 2.92Å; P84-G86 VanDerWaalsContact O-N 3.09Å
87K61Low70.2Confident163 Ų16387.9 Ų87.971%0.70946%0.456SS*.SBendtrans-105.14.5171.2-66-170.5179-175.90113.4P84 V89P84-K87 PolarHBondContact O-N 3.44Å; K87-V89 PolarHBondContact O-N 3.09Å
88R68.7Low70Confident70 Ų7088.7 Ų88.726%0.26446%0.459SS..  trans-75.8123.5177.6-68.7-176.8-176166.6-3.7109.3E80 W81 R83 K90E80-R88 PolarHBondContact O-NE 3.34Å; W81-R88 PolarHBondContact O-NH2 2.84Å; R83-R88 HydrophobicContact CB-CG 4.17Å; R83-R88 PolarHBondContact O-NE 3.31Å; R83-R88 VanDerWaalsContact O-NE 3.1Å; R88-K90 VanDerWaalsContact C-N 3.31Å
89V63.9Low70Confident108 Ų10890.7 Ų90.766%0.65546%0.456SS*.SBendtrans-79.1-22.5178.5-177.70000110.5K87K87-V89 PolarHBondContact O-N 3.09Å
90K63.9Low69.8Low46 Ų4688.7 Ų88.720%0.245%0.452CS..SBendtrans-103.7139.5-178.2-56.5-59.5-180-170.10112.1R88 L95 W219R88-K90 VanDerWaalsContact C-N 3.31Å; K90-L95 HydrophobicContact CB-CD2 4.35Å; K90-L95 HydrophobicContact CB-CG 4.23Å; K90-W219 HydrophobicContact CD-CZ2 4.39Å
91D69.9Low69.7Low82 Ų8288.6 Ų88.644%0.43945%0.453SS..  trans-58.1131172.9-177.2-26.2000110.1T93 I94 L95D91-T93 PolarHBondContact O-N 2.87Å; D91-T93 VanDerWaalsContact O-N 3.11Å; D91-T93 VanDerWaalsContact OD1-CB 3.27Å; D91-T93 WeakPolarHBondContact OD1-CB 3.43Å; D91-T93 PolarHBondContact OD1-N 3.15Å; D91-T93 PolarHBondContact OD1-OG1 3.41Å; D91-I94 HydrophobicContact CB-CD1 3.93Å; D91-I94 HydrophobicContact CB-CG1 4.05Å; D91-I94 WeakPolarHBondContact O-CB 3.17Å; D91-I94 PolarHBondContact O-N 3.31Å; D91-L95 PolarHBondContact O-N 2.88Å
92P69.9Low69.9Low68 Ų6881.6 Ų81.644%0.44243%0.426SS..Hα-helixtrans-53.2-29.1175.921.5-34.2000114L95 R96P92-L95 PolarHBondContact O-N 3.38Å; P92-R96 WeakPolarHBondContact O-CG 3.36Å; P92-R96 PolarHBondContact O-N 3.38Å
93T69.7Low70.1Confident92 Ų9273.9 Ų73.956%0.56440%0.395SS*.Hα-helixtrans-64.9-40176-49.60000111.6D91 Y97D91-T93 PolarHBondContact O-N 2.87Å; D91-T93 VanDerWaalsContact O-N 3.11Å; D91-T93 VanDerWaalsContact OD1-CB 3.27Å; D91-T93 WeakPolarHBondContact OD1-CB 3.43Å; D91-T93 PolarHBondContact OD1-N 3.15Å; D91-T93 PolarHBondContact OD1-OG1 3.41Å; T93-Y97 WeakPolarHBondContact O-CB 3.23Å; T93-Y97 PolarHBondContact O-N 3.01Å
94I67.1Low70.3Confident69 Ų6971.9 Ų71.935%0.35439%0.389SS..Hα-helixtrans-70-41.6177.8-61.5173.5000110.2D91 Y97 M98D91-I94 HydrophobicContact CB-CD1 3.93Å; D91-I94 HydrophobicContact CB-CG1 4.05Å; D91-I94 WeakPolarHBondContact O-CB 3.17Å; D91-I94 PolarHBondContact O-N 3.31Å; I94-Y97 WeakPolarHBondContact O-CB 3.37Å; I94-Y97 PolarHBondContact O-N 2.8Å; I94-M98 WeakPolarHBondContact O-CG 3.5Å; I94-M98 PolarHBondContact O-N 2.95Å
95L68.7Low70.6Confident0 Ų069.5 Ų69.50%037%0.37CS..Hα-helixtrans-60.8-45.6175.9-69.1169.2000111.7L77 E80 K90 D91 P92 Y97 M98 F99L77-L95 HydrophobicContact CD1-CB 4.3Å; L77-L95 HydrophobicContact CD1-CD2 3.79Å; E80-L95 HydrophobicContact CB-CD2 3.79Å; E80-L95 HydrophobicContact CG-CD2 4.44Å; K90-L95 HydrophobicContact CB-CD2 4.35Å; K90-L95 HydrophobicContact CB-CG 4.23Å; D91-L95 PolarHBondContact O-N 2.88Å; P92-L95 PolarHBondContact O-N 3.38Å; L95-Y97 VanDerWaalsContact C-N 3.35Å; L95-Y97 PolarHBondContact O-N 3.12Å; L95-M98 HydrophobicContact CD2-CE 3.69Å; L95-M98 PolarHBondContact O-N 3.29Å; L95-F99 PolarHBondContact O-N 3.21Å
96R72.1Confident71.7Confident172 Ų17263.4 Ų63.465%0.64933%0.332SS*.Hα-helixtrans-60.3-44.2175-73.7175.6-178.3-172.61.2111.7P92 F99 V100P92-R96 WeakPolarHBondContact O-CG 3.36Å; P92-R96 PolarHBondContact O-N 3.38Å; R96-F99 PolarHBondContact O-N 3.02Å; R96-V100 WeakPolarHBondContact O-CG2 3.27Å; R96-V100 PolarHBondContact O-N 3.34Å
97Y67.9Low73.1Confident51 Ų5162.6 Ų62.620%0.231%0.308CS..Hα-helixtrans-60.8-45.8176.6179.6-79.1000112T93 I94 L95 F99 V100 S101 R205 T216T93-Y97 WeakPolarHBondContact O-CB 3.23Å; T93-Y97 PolarHBondContact O-N 3.01Å; I94-Y97 WeakPolarHBondContact O-CB 3.37Å; I94-Y97 PolarHBondContact O-N 2.8Å; L95-Y97 VanDerWaalsContact C-N 3.35Å; L95-Y97 PolarHBondContact O-N 3.12Å; Y97-F99 VanDerWaalsContact C-N 3.34Å; Y97-F99 PolarHBondContact O-N 2.97Å; Y97-V100 PolarHBondContact O-N 2.9Å; Y97-S101 WeakPolarHBondContact O-CB 3.37Å; Y97-S101 PolarHBondContact O-N 2.99Å; Y97-R205 PolarHBondContact OH-NH2 2.88Å; Y97-T216 HydrophobicContact CD1-CG2 3.78Å; Y97-T216 HydrophobicContact CE1-CG2 3.06Å; Y97-T216 HydrophobicContact CE2-CG2 4.48Å; Y97-T216 VanDerWaalsContact CZ-CG2 3.43Å; Y97-T216 WeakPolarHBondContact OH-CG2 3.31Å
98M68.6Low74.4Confident35 Ų3555.9 Ų55.917%0.17228%0.28CS..Hα-helixtrans-60.7-45177.6-73.3-166.4-5500111L77 I94 L95 V100 S101 I102L77-M98 HydrophobicContact CD1-CB 4.38Å; L77-M98 HydrophobicContact CD1-CE 4.04Å; I94-M98 WeakPolarHBondContact O-CG 3.5Å; I94-M98 PolarHBondContact O-N 2.95Å; L95-M98 HydrophobicContact CD2-CE 3.69Å; L95-M98 PolarHBondContact O-N 3.29Å; M98-V100 PolarHBondContact O-N 2.84Å; M98-S101 PolarHBondContact O-N 2.86Å; M98-I102 VanDerWaalsContact O-CG1 3.24Å; M98-I102 WeakPolarHBondContact O-CG1 3.38Å; M98-I102 PolarHBondContact O-N 3.27Å
99F75.9Confident75.5Confident103 Ų10352.6 Ų52.645%0.45227%0.267SS..Hα-helixtrans-58.7-47.9175.9-179.3-104.5000112.4F68 L77 L95 R96 Y97 S101 I102 T103F68-F99 HydrophobicContact CE1-CE2 4.1Å; F68-F99 HydrophobicContact CZ-CE2 4.27Å; L77-F99 HydrophobicContact CD2-CB 3.92Å; L77-F99 HydrophobicContact CD2-CD2 3.75Å; L77-F99 HydrophobicContact CD2-CG 4.32Å; L95-F99 PolarHBondContact O-N 3.21Å; R96-F99 PolarHBondContact O-N 3.02Å; Y97-F99 VanDerWaalsContact C-N 3.34Å; Y97-F99 PolarHBondContact O-N 2.97Å; F99-S101 VanDerWaalsContact C-N 3.32Å; F99-S101 PolarHBondContact O-N 3.48Å; F99-I102 PolarHBondContact O-N 3.37Å; F99-T103 WeakPolarHBondContact O-CB 3.5Å; F99-T103 PolarHBondContact O-N 2.89Å; F99-T103 PolarHBondContact O-OG1 3.42Å
100V74.4Confident77Confident70 Ų7047.8 Ų47.842%0.42424%0.238SC..Hα-helixtrans-61.3-42.2177170.60000110.9R96 Y97 M98 T103 Q104R96-V100 WeakPolarHBondContact O-CG2 3.27Å; R96-V100 PolarHBondContact O-N 3.34Å; Y97-V100 PolarHBondContact O-N 2.9Å; M98-V100 PolarHBondContact O-N 2.84Å; V100-T103 PolarHBondContact O-N 2.84Å; V100-Q104 HydrophobicContact CG1-CG 4.32Å; V100-Q104 WeakPolarHBondContact O-CB 3.48Å; V100-Q104 VanDerWaalsContact O-CG 3.23Å; V100-Q104 WeakPolarHBondContact O-CG 3.42Å; V100-Q104 PolarHBondContact O-N 2.98Å
101S72.8Confident78.4Confident13 Ų1348 Ų489%0.09124%0.24CC..Hα-helixtrans-65.8-37.1178.3179.20000113.2Y97 M98 F99 R105Y97-S101 WeakPolarHBondContact O-CB 3.37Å; Y97-S101 PolarHBondContact O-N 2.99Å; M98-S101 PolarHBondContact O-N 2.86Å; F99-S101 VanDerWaalsContact C-N 3.32Å; F99-S101 PolarHBondContact O-N 3.48Å; S101-R105 WeakPolarHBondContact O-CG 3.4Å; S101-R105 PolarHBondContact O-N 2.83Å; S101-R105 PolarHBondContact O-NE 3.2Å; S101-R105 PolarHBondContact OG-NH2 3.42Å
102I76.1Confident79.6Confident2 Ų246 Ų461%0.0123%0.232CC..Hα-helixtrans-68.5-47.8174.6-68.6167.4000109.5F68 N71 N73 V74 M98 F99 Q104 R105 S106F68-I102 HydrophobicContact CD1-CG2 3.92Å; F68-I102 HydrophobicContact CE1-CG2 3.68Å; F68-I102 HydrophobicContact CZ-CG2 4.21Å; N71-I102 HydrophobicContact CB-CG2 4.5Å; N73-I102 HydrophobicContact CB-CD1 4.07Å; V74-I102 HydrophobicContact CG2-CD1 4.21Å; V74-I102 HydrophobicContact CG2-CG2 3.9Å; M98-I102 VanDerWaalsContact O-CG1 3.24Å; M98-I102 WeakPolarHBondContact O-CG1 3.38Å; M98-I102 PolarHBondContact O-N 3.27Å; F99-I102 PolarHBondContact O-N 3.37Å; I102-Q104 PolarHBondContact O-N 3.5Å; I102-R105 WeakPolarHBondContact O-CB 3.49Å; I102-R105 PolarHBondContact O-N 3.46Å; I102-R105 VanDerWaalsContact O-N 3.12Å; I102-S106 PolarHBondContact O-N 2.86Å; I102-S106 PolarHBondContact O-OG 3.3Å
103T84.7Confident80.8Confident26 Ų2643 Ų4316%0.1621%0.211CC..Hα-helixtrans-59-46.2179.7-55.80000111.7F64 F99 V100 R105 S106 L107F64-T103 HydrophobicContact CE2-CG2 4.04Å; F64-T103 HydrophobicContact CZ-CG2 4.19Å; F99-T103 WeakPolarHBondContact O-CB 3.5Å; F99-T103 PolarHBondContact O-N 2.89Å; F99-T103 PolarHBondContact O-OG1 3.42Å; V100-T103 PolarHBondContact O-N 2.84Å; T103-R105 VanDerWaalsContact C-N 3.26Å; T103-R105 PolarHBondContact O-N 3.29Å; T103-S106 PolarHBondContact O-N 2.95Å; T103-L107 HydrophobicContact CG2-CD1 4.08Å; T103-L107 HydrophobicContact CG2-CG 4.47Å; T103-L107 VanDerWaalsContact O-CG 3.31Å; T103-L107 WeakPolarHBondContact O-CG 3.49Å; T103-L107 PolarHBondContact O-N 3.44Å
104Q81.4Confident82.1Confident43 Ų4340.5 Ų40.520%0.20119%0.194CC..Hα-helixtrans-58-37.8177-78172.8-12.300112.7V100 I102 I201V100-Q104 HydrophobicContact CG1-CG 4.32Å; V100-Q104 WeakPolarHBondContact O-CB 3.48Å; V100-Q104 VanDerWaalsContact O-CG 3.23Å; V100-Q104 WeakPolarHBondContact O-CG 3.42Å; V100-Q104 PolarHBondContact O-N 2.98Å; I102-Q104 PolarHBondContact O-N 3.5Å; Q104-I201 VanDerWaalsContact NE2-CG2 3.31Å
105R80.2Confident83.4Confident34 Ų3437.9 Ų37.913%0.12818%0.182CC..Hα-helixtrans-69.4-47.2176.1-83-179.9-89.9-172-3.3111.8M19 N20 C23 S101 I102 T103 L107 I108M19-R105 HydrophobicContact CE-CB 4.46Å; M19-R105 HydrophobicContact CE-CG 3.46Å; M19-R105 VanDerWaalsContact CE-CG 3.46Å; M19-R105 HydrophobicContact CG-CG 3.61Å; M19-R105 HydrophobicContact SD-CG 3.49Å; M19-R105 WeakPolarHBondContact SD-CG 3.39Å; N20-R105 PolarHBondContact ND2-NH1 3.32Å; C23-R105 VanDerWaalsContact SG-CB 3.56Å; S101-R105 WeakPolarHBondContact O-CG 3.4Å; S101-R105 PolarHBondContact O-N 2.83Å; S101-R105 PolarHBondContact O-NE 3.2Å; S101-R105 PolarHBondContact OG-NH2 3.42Å; I102-R105 WeakPolarHBondContact O-CB 3.49Å; I102-R105 PolarHBondContact O-N 3.46Å; I102-R105 VanDerWaalsContact O-N 3.12Å; T103-R105 VanDerWaalsContact C-N 3.26Å; T103-R105 PolarHBondContact O-N 3.29Å; R105-L107 PolarHBondContact O-N 3.31Å; R105-I108 WeakPolarHBondContact O-CG1 3.22Å; R105-I108 PolarHBondContact O-N 3.02Å
106S87.4Confident84.7Confident2 Ų240 Ų401%0.01420%0.195CC..Hα-helixtrans-66.3-22-179-57.40000113.6G67 I102 T103 I108 P110G67-S106 VanDerWaalsContact C-OG 3.27Å; G67-S106 PolarHBondContact O-OG 3.28Å; I102-S106 PolarHBondContact O-N 2.86Å; I102-S106 PolarHBondContact O-OG 3.3Å; T103-S106 PolarHBondContact O-N 2.95Å; S106-I108 VanDerWaalsContact C-N 3.33Å; S106-I108 PolarHBondContact O-N 3.48Å; S106-P110 WeakPolarHBondContact O-CD 3.37Å; S106-P110 WeakPolarHBondContact O-CG 3.45Å
107L90.4Very high85.8Confident65 Ų6531.9 Ų31.934%0.3416%0.164SC..THydrogen-bonded Turntrans-76.2-13.8178.3-75.5169.4000114.4F64 T103 R105 P110 M111F64-L107 HydrophobicContact CD2-CD2 3.67Å; F64-L107 HydrophobicContact CD2-CG 4.1Å; F64-L107 HydrophobicContact CE2-CD2 3.67Å; F64-L107 HydrophobicContact CE2-CG 3.86Å; T103-L107 HydrophobicContact CG2-CD1 4.08Å; T103-L107 HydrophobicContact CG2-CG 4.47Å; T103-L107 VanDerWaalsContact O-CG 3.31Å; T103-L107 WeakPolarHBondContact O-CG 3.49Å; T103-L107 PolarHBondContact O-N 3.44Å; R105-L107 PolarHBondContact O-N 3.31Å; L107-P110 WeakPolarHBondContact O-CD 3.31Å; L107-M111 HydrophobicContact CB-CE 4.22Å; L107-M111 WeakPolarHBondContact O-CE 3.44Å; L107-M111 VanDerWaalsContact O-CG 3.26Å; L107-M111 WeakPolarHBondContact O-CG 3.34Å; L107-M111 PolarHBondContact O-N 3.47Å
108I89.3Confident87.1Confident23 Ų2330.1 Ų30.112%0.11816%0.158CC..Hα-helixtrans-63.4-51.3-173.9-62.7169.3000112F18 M19 C23 A27 R105 S106 M111 V112F18-I108 HydrophobicContact CE1-CD1 4.1Å; F18-I108 HydrophobicContact CZ-CD1 4.03Å; M19-I108 HydrophobicContact CE-CD1 3.91Å; C23-I108 HydrophobicContact CB-CD1 3.89Å; A27-I108 HydrophobicContact CB-CG2 4.03Å; R105-I108 WeakPolarHBondContact O-CG1 3.22Å; R105-I108 PolarHBondContact O-N 3.02Å; S106-I108 VanDerWaalsContact C-N 3.33Å; S106-I108 PolarHBondContact O-N 3.48Å; I108-M111 HydrophobicContact CB-CE 4.45Å; I108-M111 HydrophobicContact CG1-CE 4.15Å; I108-M111 PolarHBondContact O-N 2.91Å; I108-V112 WeakPolarHBondContact O-CG2 3.36Å; I108-V112 PolarHBondContact O-N 2.83Å
109A91.1Very high88.3Confident0 Ų030.7 Ų30.70%016%0.161CC..Hα-helixtrans-64.2-44.1178.800000113.4M26 F63 M111 V112 W113M26-A109 HydrophobicContact CB-CB 3.94Å; F63-A109 HydrophobicContact CB-CB 4.21Å; F63-A109 HydrophobicContact CD1-CB 4.2Å; F63-A109 HydrophobicContact CG-CB 4.31Å; A109-M111 VanDerWaalsContact C-N 3.33Å; A109-M111 PolarHBondContact O-N 3.33Å; A109-V112 PolarHBondContact O-N 2.94Å; A109-W113 PolarHBondContact O-N 2.95Å
110P95.7Very high89.2Confident7 Ų728 Ų285%0.04515%0.151CC..Hα-helixtrans-52.8-45.8170.2-29.534.7000113.8P60 F63 F64 S106 L107 W113 I114P60-P110 HydrophobicContact CB-CB 3.95Å; P60-P110 WeakPolarHBondContact O-CG 3.43Å; F63-P110 HydrophobicContact CB-CG 4.05Å; F64-P110 HydrophobicContact CB-CG 3.8Å; S106-P110 WeakPolarHBondContact O-CD 3.37Å; S106-P110 WeakPolarHBondContact O-CG 3.45Å; L107-P110 WeakPolarHBondContact O-CD 3.31Å; P110-W113 PolarHBondContact O-N 2.85Å; P110-I114 WeakPolarHBondContact O-CG1 3.48Å; P110-I114 PolarHBondContact O-N 3.47Å; P110-I114 VanDerWaalsContact O-N 3.1Å
111M94.1Very high90.1Very high50 Ų5024.6 Ų24.625%0.24613%0.131CC..Hα-helixtrans-61.3-45.6177.4-73.4-176-70.200111.5L107 I108 A109 W113 I114 S115 F190 M194L107-M111 HydrophobicContact CB-CE 4.22Å; L107-M111 WeakPolarHBondContact O-CE 3.44Å; L107-M111 VanDerWaalsContact O-CG 3.26Å; L107-M111 WeakPolarHBondContact O-CG 3.34Å; L107-M111 PolarHBondContact O-N 3.47Å; I108-M111 HydrophobicContact CB-CE 4.45Å; I108-M111 HydrophobicContact CG1-CE 4.15Å; I108-M111 PolarHBondContact O-N 2.91Å; A109-M111 VanDerWaalsContact C-N 3.33Å; A109-M111 PolarHBondContact O-N 3.33Å; M111-W113 PolarHBondContact O-N 2.86Å; M111-I114 PolarHBondContact O-N 3.33Å; M111-S115 WeakPolarHBondContact O-CB 3.11Å; M111-S115 PolarHBondContact O-N 3.43Å; M111-S115 PolarHBondContact O-OG 3.22Å; M111-F190 HydrophobicContact CG-CZ 4.38Å; M111-M194 HydrophobicContact CG-CE 3.87Å; M111-M194 HydrophobicContact SD-CB 4.2Å; M111-M194 HydrophobicContact SD-CE 3.17Å; M111-M194 WeakPolarHBondContact SD-CE 3.41Å; M111-M194 HydrophobicContact SD-CG 4.14Å; M111-M194 HydrophobicContact SD-SD 4.47Å
112V93.9Very high91.1Very high42 Ų4227.9 Ų27.926%0.25514%0.144SC..Hα-helixtrans-61.2-44.9178.7171.80000111.1A27 S30 A31 I108 A109 I114 S115 V116A27-V112 HydrophobicContact CB-CG2 4.12Å; S30-V112 WeakPolarHBondContact OG-CG1 3.33Å; A31-V112 HydrophobicContact CB-CG1 4.22Å; I108-V112 WeakPolarHBondContact O-CG2 3.36Å; I108-V112 PolarHBondContact O-N 2.83Å; A109-V112 PolarHBondContact O-N 2.94Å; V112-I114 PolarHBondContact O-N 3.26Å; V112-S115 PolarHBondContact O-N 3.37Å; V112-V116 HydrophobicContact CG1-CG2 4.27Å; V112-V116 VanDerWaalsContact O-CG2 3.31Å; V112-V116 WeakPolarHBondContact O-CG2 3.17Å; V112-V116 PolarHBondContact O-N 3.3Å
113W96.1Very high92Very high4 Ų428 Ų282%0.01514%0.144CC..Hα-helixtrans-57.3-50.5176.9-177.5-82.4000112.3S30 L33 Y34 L55 P59 P60 F63 A109 P110 M111 S115 V116 T117S30-W113 WeakPolarHBondContact O-CZ3 3.41Å; L33-W113 HydrophobicContact CB-CZ3 4.28Å; L33-W113 HydrophobicContact CD2-CH2 3.64Å; L33-W113 HydrophobicContact CD2-CZ3 3.51Å; Y34-W113 HydrophobicContact CD2-CD2 4.45Å; Y34-W113 HydrophobicContact CD2-CH2 4.04Å; Y34-W113 AromaticContact CD2-CZ2 3.89Å; Y34-W113 HydrophobicContact CD2-CZ2 3.89Å; Y34-W113 HydrophobicContact CD2-CZ3 4.36Å; L55-W113 PolarHBondContact O-NE1 3.44Å; P59-W113 HydrophobicContact CB-CD2 3.85Å; P59-W113 HydrophobicContact CB-CE3 4.4Å; P59-W113 HydrophobicContact CB-CG 4.33Å; P59-W113 HydrophobicContact CB-CH2 4.12Å; P59-W113 HydrophobicContact CB-CZ2 3.54Å; P59-W113 HydrophobicContact CG-CH2 4.34Å; P59-W113 HydrophobicContact CG-CZ2 3.5Å; P59-W113 VanDerWaalsContact CG-CZ2 3.5Å; P60-W113 VanDerWaalsContact CD-CD1 3.47Å; P60-W113 HydrophobicContact CG-CB 4.26Å; P60-W113 VanDerWaalsContact CG-CD1 3.46Å; P60-W113 HydrophobicContact CG-CG 4.04Å; F63-W113 HydrophobicContact CD2-CE3 4.3Å; F63-W113 HydrophobicContact CE2-CD2 4.21Å; F63-W113 AromaticContact CE2-CE3 3.53Å; F63-W113 HydrophobicContact CE2-CE3 3.53Å; F63-W113 AromaticContact CE2-CZ3 3.91Å; F63-W113 HydrophobicContact CE2-CZ3 3.91Å; F63-W113 HydrophobicContact CZ-CE3 4.36Å; A109-W113 PolarHBondContact O-N 2.95Å; P110-W113 PolarHBondContact O-N 2.85Å; M111-W113 PolarHBondContact O-N 2.86Å; W113-S115 VanDerWaalsContact C-N 3.34Å; W113-S115 PolarHBondContact O-N 2.82Å; W113-V116 PolarHBondContact O-N 3.15Å; W113-T117 PolarHBondContact NE1-OG1 2.66Å; W113-T117 WeakPolarHBondContact O-CB 3.44Å; W113-T117 PolarHBondContact O-N 3.01Å; W113-T117 PolarHBondContact O-OG1 3.29Å
114I96.5Very high92.5Very high40 Ų4028.1 Ų28.121%0.20514%0.143CC..Hα-helixtrans-59.9-46.6179.7-67.4169.2000110.1L56 P60 P110 M111 V112 V116 T117 L118 F190L56-I114 HydrophobicContact CD1-CG2 4.38Å; P60-I114 HydrophobicContact CB-CD1 4.16Å; P60-I114 HydrophobicContact CB-CG1 4.21Å; P60-I114 HydrophobicContact CG-CD1 4.07Å; P60-I114 HydrophobicContact CG-CG1 3.6Å; P110-I114 WeakPolarHBondContact O-CG1 3.48Å; P110-I114 PolarHBondContact O-N 3.47Å; P110-I114 VanDerWaalsContact O-N 3.1Å; M111-I114 PolarHBondContact O-N 3.33Å; V112-I114 PolarHBondContact O-N 3.26Å; I114-V116 PolarHBondContact O-N 3.13Å; I114-T117 PolarHBondContact O-N 3.17Å; I114-L118 HydrophobicContact CG2-CD1 3.74Å; I114-L118 HydrophobicContact CG2-CG 4.32Å; I114-L118 WeakPolarHBondContact O-CB 3.34Å; I114-L118 VanDerWaalsContact O-CG 3.32Å; I114-L118 WeakPolarHBondContact O-CG 3.47Å; I114-L118 PolarHBondContact O-N 3Å; I114-F190 HydrophobicContact CB-CE1 4.12Å; I114-F190 HydrophobicContact CB-CZ 4.15Å; I114-F190 HydrophobicContact CD1-CZ 4.35Å; I114-F190 HydrophobicContact CG2-CD1 4.16Å; I114-F190 HydrophobicContact CG2-CD2 4.46Å; I114-F190 HydrophobicContact CG2-CE1 3.85Å; I114-F190 HydrophobicContact CG2-CE2 4.18Å; I114-F190 HydrophobicContact CG2-CG 4.45Å; I114-F190 HydrophobicContact CG2-CZ 3.86Å
115S95.2Very high93.2Very high14 Ų1426.5 Ų26.510%0.09814%0.136CC..Hα-helixtrans-59.7-47.7178.5-62.20000112.5M111 V112 W113 L118 M119 F190 L191M111-S115 WeakPolarHBondContact O-CB 3.11Å; M111-S115 PolarHBondContact O-N 3.43Å; M111-S115 PolarHBondContact O-OG 3.22Å; V112-S115 PolarHBondContact O-N 3.37Å; W113-S115 VanDerWaalsContact C-N 3.34Å; W113-S115 PolarHBondContact O-N 2.82Å; S115-L118 PolarHBondContact O-N 3.04Å; S115-M119 WeakPolarHBondContact O-CB 3.24Å; S115-M119 WeakPolarHBondContact O-CG 3.39Å; S115-M119 PolarHBondContact O-N 3.28Å; S115-F190 WeakPolarHBondContact OG-CD1 3.26Å; S115-F190 WeakPolarHBondContact OG-CE1 3.34Å; S115-L191 WeakPolarHBondContact OG-CD2 3.23Å
116V94.6Very high93.9Very high43 Ų4324.9 Ų24.926%0.26113%0.129SC..Hα-helixtrans-65.1-42.2179.9175.50000110.8Y34 V112 W113 I114 L118 M119 D120Y34-V116 HydrophobicContact CD1-CG1 3.34Å; Y34-V116 HydrophobicContact CD2-CG1 4.47Å; Y34-V116 HydrophobicContact CE1-CG1 3.76Å; Y34-V116 HydrophobicContact CG-CG1 3.76Å; V112-V116 HydrophobicContact CG1-CG2 4.27Å; V112-V116 VanDerWaalsContact O-CG2 3.31Å; V112-V116 WeakPolarHBondContact O-CG2 3.17Å; V112-V116 PolarHBondContact O-N 3.3Å; W113-V116 PolarHBondContact O-N 3.15Å; I114-V116 PolarHBondContact O-N 3.13Å; V116-L118 PolarHBondContact O-N 2.9Å; V116-M119 PolarHBondContact O-N 2.88Å; V116-D120 PolarHBondContact O-N 3.39Å
117T95.3Very high94.3Very high2 Ų225 Ų251%0.01213%0.13CC..Hα-helixtrans-62.6-43.7179.1-55.70000111.9Y34 L56 W113 I114 G121Y34-T117 HydrophobicContact CE2-CG2 4.01Å; Y34-T117 WeakPolarHBondContact CE2-OG1 3.35Å; L56-T117 HydrophobicContact CD1-CG2 3.71Å; W113-T117 PolarHBondContact NE1-OG1 2.66Å; W113-T117 WeakPolarHBondContact O-CB 3.44Å; W113-T117 PolarHBondContact O-N 3.01Å; W113-T117 PolarHBondContact O-OG1 3.29Å; I114-T117 PolarHBondContact O-N 3.17Å; T117-G121 PolarHBondContact O-N 3.29Å
118L95.7Very high94.5Very high15 Ų1524.7 Ų24.78%0.07913%0.126CC..Hα-helixtrans-68.2-37.3177.2-71.4173000112.3L56 I114 S115 V116 G121 F124 S183 F190L56-L118 HydrophobicContact CD1-CD2 4.12Å; L56-L118 HydrophobicContact CD1-CG 4.11Å; L56-L118 HydrophobicContact CD2-CD2 4.39Å; I114-L118 HydrophobicContact CG2-CD1 3.74Å; I114-L118 HydrophobicContact CG2-CG 4.32Å; I114-L118 WeakPolarHBondContact O-CB 3.34Å; I114-L118 VanDerWaalsContact O-CG 3.32Å; I114-L118 WeakPolarHBondContact O-CG 3.47Å; I114-L118 PolarHBondContact O-N 3Å; S115-L118 PolarHBondContact O-N 3.04Å; V116-L118 PolarHBondContact O-N 2.9Å; L118-G121 PolarHBondContact O-N 3.48Å; L118-F124 HydrophobicContact CD2-CD2 4.34Å; L118-S183 CarbonylContact O-C 3.39Å; L118-S183 WeakPolarHBondContact O-CB 3.21Å; L118-S183 PolarHBondContact O-OG 3.45Å; L118-F190 HydrophobicContact CD1-CB 4.34Å
119M94.4Very high94.6Very high46 Ų4623.6 Ų23.623%0.22712%0.121CC..Hα-helixtrans-69.9-36.3179-72.6-62.6167.900113.2S115 V116 Q184 W188 L191S115-M119 WeakPolarHBondContact O-CB 3.24Å; S115-M119 WeakPolarHBondContact O-CG 3.39Å; S115-M119 PolarHBondContact O-N 3.28Å; V116-M119 PolarHBondContact O-N 2.88Å; M119-Q184 WeakPolarHBondContact O-CG 3.4Å; M119-Q184 PolarHBondContact O-NE2 2.83Å; M119-Q184 VanDerWaalsContact O-NE2 3.15Å; M119-Q184 HydrophobicContact SD-CB 4.43Å; M119-Q184 HydrophobicContact SD-CG 4.32Å; M119-W188 HydrophobicContact CE-CB 4.29Å; M119-W188 HydrophobicContact CE-CD2 3.74Å; M119-W188 HydrophobicContact CE-CE3 4.42Å; M119-W188 HydrophobicContact CE-CG 3.66Å; M119-W188 VanDerWaalsContact CE-N 3.31Å; M119-L191 HydrophobicContact CE-CD1 3.77Å
120D93.9Very high94.6Very high46 Ų4625.1 Ų25.125%0.24613%0.13CC..Hα-helixtrans-73.3-34.2173.7-173.333000111.7Y34 V116 K122Y34-D120 HydrophobicContact CE1-CB 3.97Å; Y34-D120 WeakPolarHBondContact CE1-OD2 3.45Å; Y34-D120 VanDerWaalsContact OH-CB 3.28Å; Y34-D120 WeakPolarHBondContact OH-CB 3.16Å; Y34-D120 PolarHBondContact OH-OD2 3.48Å; V116-D120 PolarHBondContact O-N 3.39Å; D120-K122 PolarHBondContact O-N 3.27Å; D120-K122 VanDerWaalsContact O-N 3.16Å; D120-K122 WeakPolarHBondContact OD1-CE 3.42Å; D120-K122 IonicContact OD1-NZ 2.86Å; D120-K122 PolarHBondContact OD1-NZ 2.88Å; D120-K122 VanDerWaalsContact OD1-NZ 3.12Å; D120-K122 VanDerWaalsContact OD2-CD 3.32Å; D120-K122 WeakPolarHBondContact OD2-CD 3.31Å; D120-K122 WeakPolarHBondContact OD2-CE 3.25Å; D120-K122 IonicContact OD2-NZ 2.81Å; D120-K122 PolarHBondContact OD2-NZ 3.46Å
121G93.9Very high94.2Very high0 Ų030.3 Ų30.30%016%0.157CC..  trans72.33.8169.300000115.9T117 L118 F124 L125 S183T117-G121 PolarHBondContact O-N 3.29Å; L118-G121 PolarHBondContact O-N 3.48Å; G121-F124 PolarHBondContact O-N 2.9Å; G121-L125 VanDerWaalsContact O-CB 3.27Å; G121-L125 WeakPolarHBondContact O-CB 3.23Å; G121-L125 PolarHBondContact O-N 2.72Å; G121-S183 WeakPolarHBondContact CA-OG 3.44Å
122K94.2Very high93.8Very high82 Ų8228.8 Ų28.836%0.35715%0.15SC..Hα-helixtrans-66.1-42.4177.8-63.5-177-169.1122.40112.8F39 D120 L125 C126F39-K122 HydrophobicContact CB-CD 4.24Å; F39-K122 HydrophobicContact CD1-CB 3.82Å; F39-K122 HydrophobicContact CD1-CD 4.22Å; F39-K122 HydrophobicContact CD2-CB 4.34Å; F39-K122 HydrophobicContact CE1-CB 3.84Å; F39-K122 HydrophobicContact CE2-CB 4.37Å; F39-K122 HydrophobicContact CG-CB 4.08Å; F39-K122 HydrophobicContact CG-CD 4.31Å; F39-K122 HydrophobicContact CZ-CB 4.14Å; F39-K122 VanDerWaalsContact CZ-O 3.26Å; F39-K122 WeakPolarHBondContact CZ-O 2.89Å; D120-K122 PolarHBondContact O-N 3.27Å; D120-K122 VanDerWaalsContact O-N 3.16Å; D120-K122 WeakPolarHBondContact OD1-CE 3.42Å; D120-K122 IonicContact OD1-NZ 2.86Å; D120-K122 PolarHBondContact OD1-NZ 2.88Å; D120-K122 VanDerWaalsContact OD1-NZ 3.12Å; D120-K122 VanDerWaalsContact OD2-CD 3.32Å; D120-K122 WeakPolarHBondContact OD2-CD 3.31Å; D120-K122 WeakPolarHBondContact OD2-CE 3.25Å; D120-K122 IonicContact OD2-NZ 2.81Å; D120-K122 PolarHBondContact OD2-NZ 3.46Å; K122-L125 PolarHBondContact O-N 3Å; K122-C126 PolarHBondContact O-N 3.06Å
123S94.6Very high93.2Very high3 Ų330.5 Ų30.52%0.02116%0.157CC..Hα-helixtrans-61-46.7175.6152.90000111.1G52 C126 A127G52-S123 PolarHBondContact O-OG 2.96Å; S123-C126 PolarHBondContact O-N 3.12Å; S123-A127 WeakPolarHBondContact O-CB 3.31Å; S123-A127 PolarHBondContact O-N 3.14Å
124F95.1Very high92.4Very high29 Ų2930.7 Ų30.713%0.12716%0.159CC..Hα-helixtrans-65.4-41.1178-153-94.9000111.8L118 G121 A127 F128 I179 I182 S183 F186L118-F124 HydrophobicContact CD2-CD2 4.34Å; G121-F124 PolarHBondContact O-N 2.9Å; F124-A127 PolarHBondContact O-N 3.48Å; F124-F128 AromaticContact CD1-CD2 3.75Å; F124-F128 HydrophobicContact CD1-CD2 3.75Å; F124-F128 HydrophobicContact CD1-CE2 4.4Å; F124-F128 AromaticContact CD2-CD2 3.79Å; F124-F128 HydrophobicContact CD2-CD2 3.79Å; F124-F128 AromaticContact CD2-CE2 3.65Å; F124-F128 HydrophobicContact CD2-CE2 3.65Å; F124-F128 AromaticContact CE1-CD2 3.65Å; F124-F128 HydrophobicContact CE1-CD2 3.65Å; F124-F128 HydrophobicContact CE1-CE2 4.15Å; F124-F128 HydrophobicContact CE1-CG 4.29Å; F124-F128 AromaticContact CE2-CD2 3.71Å; F124-F128 HydrophobicContact CE2-CD2 3.71Å; F124-F128 AromaticContact CE2-CE2 3.36Å; F124-F128 HydrophobicContact CE2-CE2 3.36Å; F124-F128 HydrophobicContact CE2-CZ 4.29Å; F124-F128 AromaticContact CG-CD2 3.8Å; F124-F128 HydrophobicContact CG-CD2 3.8Å; F124-F128 HydrophobicContact CG-CE2 4.16Å; F124-F128 AromaticContact CZ-CD2 3.63Å; F124-F128 HydrophobicContact CZ-CD2 3.63Å; F124-F128 AromaticContact CZ-CE2 3.62Å; F124-F128 HydrophobicContact CZ-CE2 3.62Å; F124-F128 HydrophobicContact CZ-CG 4.44Å; F124-F128 HydrophobicContact CZ-CZ 4.42Å; F124-F128 WeakPolarHBondContact O-CD2 3.17Å; F124-F128 PolarHBondContact O-N 3Å; F124-I179 HydrophobicContact CD1-CG2 3.6Å; F124-I179 HydrophobicContact CE1-CG2 4.28Å; F124-I182 HydrophobicContact CE1-CB 4.47Å; F124-I182 HydrophobicContact CE1-CG2 3.77Å; F124-I182 HydrophobicContact CZ-CG2 4.2Å; F124-S183 VanDerWaalsContact CB-OG 3.31Å; F124-S183 WeakPolarHBondContact CB-OG 3.46Å; F124-F186 HydrophobicContact CE2-CD2 4.17Å; F124-F186 HydrophobicContact CE2-CE2 4.49Å; F124-F186 AromaticContact CZ-CD2 3.83Å; F124-F186 HydrophobicContact CZ-CD2 3.83Å; F124-F186 AromaticContact CZ-CE2 3.85Å; F124-F186 HydrophobicContact CZ-CE2 3.85Å
125L94.7Very high91.3Very high10 Ų1036 Ų365%0.05218%0.176CC..Hα-helixtrans-58.5-48.1172.8176.861.8000112.2G121 K122 S129 I158 P159 I179G121-L125 VanDerWaalsContact O-CB 3.27Å; G121-L125 WeakPolarHBondContact O-CB 3.23Å; G121-L125 PolarHBondContact O-N 2.72Å; K122-L125 PolarHBondContact O-N 3Å; L125-S129 WeakPolarHBondContact O-CB 3.31Å; L125-S129 PolarHBondContact O-N 3.25Å; L125-S129 VanDerWaalsContact O-N 3.07Å; L125-S129 PolarHBondContact O-OG 3.45Å; L125-I158 HydrophobicContact CD1-CG2 4.29Å; L125-P159 HydrophobicContact CG-CB 4.35Å; L125-P159 HydrophobicContact CG-CG 4.27Å; L125-I179 HydrophobicContact CB-CG2 4.36Å; L125-I179 HydrophobicContact CD1-CB 4.09Å; L125-I179 HydrophobicContact CD1-CD1 3.52Å; L125-I179 HydrophobicContact CD1-CG1 4.36Å; L125-I179 HydrophobicContact CD1-CG2 4.43Å
126C95.4Very high90.4Very high0 Ų040.9 Ų40.90%020%0.198CC..Hα-helixtrans-63-46.8177.8-172.20000110.8F39 C41 N48 K122 S123 F128 S129F39-C126 HydrophobicContact CE1-CB 4.1Å; F39-C126 HydrophobicContact CZ-CB 3.63Å; C41-C126 HydrophobicContact CB-CB 3.88Å; C41-C126 WeakPolarHBondContact CB-SG 3.43Å; C41-C126 WeakPolarHBondContact SG-CB 3.27Å; C41-C126 CovalentContact SG-SG 2.05Å; C41-C126 PolarHBondContact SG-SG 3.47Å; N48-C126 WeakPolarHBondContact CB-O 3.49Å; K122-C126 PolarHBondContact O-N 3.06Å; S123-C126 PolarHBondContact O-N 3.12Å; C126-F128 PolarHBondContact O-N 2.7Å; C126-S129 PolarHBondContact O-OG 3.07Å; C126-S129 VanDerWaalsContact O-OG 3.05Å
127A96.1Very high89.5Confident3 Ų341.1 Ų41.13%0.02520%0.195CC..Hα-helixtrans-66.4-39.9-175.600000114.4Y49 I53 S123 F124Y49-A127 HydrophobicContact CD2-CB 4.29Å; I53-A127 HydrophobicContact CD1-CB 4.03Å; I53-A127 HydrophobicContact CG1-CB 4.02Å; S123-A127 WeakPolarHBondContact O-CB 3.31Å; S123-A127 PolarHBondContact O-N 3.14Å; F124-A127 PolarHBondContact O-N 3.48Å
128F94.6Very high88.3Confident60 Ų6041.8 Ų41.826%0.26320%0.203SC..Hα-helixtrans-108.22-170.9-65.5-74.8000114.4Y49 I53 F124 C126 V130 N131Y49-F128 HydrophobicContact CE2-CE1 4.17Å; Y49-F128 HydrophobicContact CE2-CZ 4.24Å; I53-F128 HydrophobicContact CD1-CE2 4.14Å; I53-F128 HydrophobicContact CD1-CZ 4.3Å; F124-F128 AromaticContact CD1-CD2 3.75Å; F124-F128 HydrophobicContact CD1-CD2 3.75Å; F124-F128 HydrophobicContact CD1-CE2 4.4Å; F124-F128 AromaticContact CD2-CD2 3.79Å; F124-F128 HydrophobicContact CD2-CD2 3.79Å; F124-F128 AromaticContact CD2-CE2 3.65Å; F124-F128 HydrophobicContact CD2-CE2 3.65Å; F124-F128 AromaticContact CE1-CD2 3.65Å; F124-F128 HydrophobicContact CE1-CD2 3.65Å; F124-F128 HydrophobicContact CE1-CE2 4.15Å; F124-F128 HydrophobicContact CE1-CG 4.29Å; F124-F128 AromaticContact CE2-CD2 3.71Å; F124-F128 HydrophobicContact CE2-CD2 3.71Å; F124-F128 AromaticContact CE2-CE2 3.36Å; F124-F128 HydrophobicContact CE2-CE2 3.36Å; F124-F128 HydrophobicContact CE2-CZ 4.29Å; F124-F128 AromaticContact CG-CD2 3.8Å; F124-F128 HydrophobicContact CG-CD2 3.8Å; F124-F128 HydrophobicContact CG-CE2 4.16Å; F124-F128 AromaticContact CZ-CD2 3.63Å; F124-F128 HydrophobicContact CZ-CD2 3.63Å; F124-F128 AromaticContact CZ-CE2 3.62Å; F124-F128 HydrophobicContact CZ-CE2 3.62Å; F124-F128 HydrophobicContact CZ-CG 4.44Å; F124-F128 HydrophobicContact CZ-CZ 4.42Å; F124-F128 WeakPolarHBondContact O-CD2 3.17Å; F124-F128 PolarHBondContact O-N 3Å; C126-F128 PolarHBondContact O-N 2.7Å; F128-V130 PolarHBondContact O-N 3.48Å; F128-N131 PolarHBondContact O-N 3.49Å
129S91.7Very high87.4Confident0 Ų045 Ų450%022%0.22CC..G310 helixtrans-51.1-41.5176.351.80000113.5N48 L125 C126 N131 L132 L155N48-S129 PolarHBondContact ND2-OG 3.43Å; L125-S129 WeakPolarHBondContact O-CB 3.31Å; L125-S129 PolarHBondContact O-N 3.25Å; L125-S129 VanDerWaalsContact O-N 3.07Å; L125-S129 PolarHBondContact O-OG 3.45Å; C126-S129 PolarHBondContact O-OG 3.07Å; C126-S129 VanDerWaalsContact O-OG 3.05Å; S129-N131 VanDerWaalsContact C-N 3.3Å; S129-N131 PolarHBondContact O-N 3.5Å; S129-L132 PolarHBondContact O-N 3.5Å; S129-L155 WeakPolarHBondContact CB-O 3.31Å
130V90.1Very high86.5Confident32 Ų3245.3 Ų45.319%0.19423%0.226CC..G310 helixtrans-70.3-23-179.5179.60000113.2P45 F128 L132 V152 L155 A156P45-V130 HydrophobicContact CB-CG2 4.31Å; F128-V130 PolarHBondContact O-N 3.48Å; V130-L132 VanDerWaalsContact C-N 3.32Å; V130-V152 HydrophobicContact CG1-CG1 3.82Å; V130-V152 HydrophobicContact CG1-CG2 4.37Å; V130-L155 WeakPolarHBondContact O-CD1 3.43Å; V130-A156 HydrophobicContact CG2-CB 3.89Å
131N87.7Confident85.5Confident115 Ų11547.9 Ų47.962%0.61524%0.244SC*.G310 helixtrans-93.712.1-177.9-64.3-37.4000112.9F128 S129F128-N131 PolarHBondContact O-N 3.49Å; S129-N131 VanDerWaalsContact C-N 3.3Å; S129-N131 PolarHBondContact O-N 3.5Å
132L85.9Confident84.4Confident18 Ų1851.8 Ų51.89%0.09426%0.264CS..  trans-72.6133.5177.5-83173.3000111.5S129 V130 I134 F137 L155 I158 A175 Y178 I179S129-L132 PolarHBondContact O-N 3.5Å; V130-L132 VanDerWaalsContact C-N 3.32Å; L132-I134 PolarHBondContact O-N 3.17Å; L132-I134 VanDerWaalsContact O-N 3.07Å; L132-F137 HydrophobicContact CD2-CE2 4.21Å; L132-L155 HydrophobicContact CB-CD2 3.9Å; L132-L155 HydrophobicContact CD1-CD2 4.41Å; L132-I158 HydrophobicContact CD1-CD1 3.79Å; L132-A175 HydrophobicContact CD1-CB 3.91Å; L132-Y178 HydrophobicContact CD2-CD1 3.86Å; L132-Y178 HydrophobicContact CD2-CE1 4.07Å; L132-I179 HydrophobicContact CD1-CD1 3.43Å; L132-I179 VanDerWaalsContact CD1-CD1 3.43Å; L132-I179 HydrophobicContact CD1-CG1 4.18Å; L132-I179 HydrophobicContact CD2-CD1 3.84Å; L132-I179 HydrophobicContact CD2-CG1 3.72Å; L132-I179 HydrophobicContact CG-CD1 3.67Å; L132-I179 HydrophobicContact CG-CG1 4.16Å
133D82.4Confident83.6Confident78 Ų7848.4 Ų48.442%0.41725%0.25SC..  trans-73.698.7166.5-177.79000109.8R135 Q136 F137D133-R135 PolarHBondContact O-N 2.94Å; D133-R135 WeakPolarHBondContact OD1-CB 3.43Å; D133-R135 PolarHBondContact OD1-N 3.21Å; D133-R135 VanDerWaalsContact OD1-N 3.16Å; D133-Q136 PolarHBondContact O-N 2.86Å; D133-Q136 PolarHBondContact OD2-NE2 3.01Å; D133-F137 WeakPolarHBondContact O-CD2 3.34Å
134I77.4Confident82.7Confident9 Ų955 Ų555%0.04628%0.281CS..G310 helixtrans-58.4-28.7-179.1-68.5-179.6000112.1L132 Q136 F137 G138 I143 I151 L155 I170L132-I134 PolarHBondContact O-N 3.17Å; L132-I134 VanDerWaalsContact O-N 3.07Å; I134-Q136 PolarHBondContact O-N 3.39Å; I134-Q136 VanDerWaalsContact O-N 3.11Å; I134-F137 PolarHBondContact O-N 2.82Å; I134-G138 PolarHBondContact O-N 3.38Å; I134-I143 HydrophobicContact CG2-CD1 3.33Å; I134-I143 HydrophobicContact CG2-CG1 3.61Å; I134-I143 HydrophobicContact CG2-CG2 4.16Å; I134-I151 HydrophobicContact CD1-CB 4.09Å; I134-I151 HydrophobicContact CD1-CG1 4.12Å; I134-I151 HydrophobicContact CD1-CG2 3.36Å; I134-L155 HydrophobicContact CD1-CD1 3.74Å; I134-L155 HydrophobicContact CD1-CD2 3.76Å; I134-L155 HydrophobicContact CD1-CG 3.66Å; I134-L155 HydrophobicContact CG1-CD1 3.87Å; I134-L155 HydrophobicContact CG1-CD2 3.45Å; I134-L155 VanDerWaalsContact CG1-CD2 3.45Å; I134-L155 HydrophobicContact CG1-CG 3.89Å; I134-I170 HydrophobicContact CB-CD1 4.13Å; I134-I170 HydrophobicContact CD1-CD1 3.96Å; I134-I170 HydrophobicContact CG1-CD1 3.73Å; I134-I170 HydrophobicContact CG2-CD1 3.49Å; I134-I170 VanDerWaalsContact CG2-CD1 3.49Å; I134-I170 HydrophobicContact CG2-CG1 4.06Å
135R74.9Confident82Confident151 Ų15157.1 Ų57.157%0.5731%0.31SS*.G310 helixtrans-62.7-23.4-175.6-64.5-177.4176.7-88.1-0.7112.8D133D133-R135 PolarHBondContact O-N 2.94Å; D133-R135 WeakPolarHBondContact OD1-CB 3.43Å; D133-R135 PolarHBondContact OD1-N 3.21Å; D133-R135 VanDerWaalsContact OD1-N 3.16Å
136Q75.6Confident81.4Confident117 Ų11758.5 Ų58.555%0.54732%0.317SS..G310 helixtrans-82-18.4178.3-63.8177.936.100113.4D133 I134D133-Q136 PolarHBondContact O-N 2.86Å; D133-Q136 PolarHBondContact OD2-NE2 3.01Å; I134-Q136 PolarHBondContact O-N 3.39Å; I134-Q136 VanDerWaalsContact O-N 3.11Å
137F75Confident81Confident48 Ų4862.2 Ų62.221%0.21134%0.339CS..THydrogen-bonded Turntrans-126.4-13.3-169.3-58.6-73000114.9L132 D133 I134 I170 A174 Y178L132-F137 HydrophobicContact CD2-CE2 4.21Å; D133-F137 WeakPolarHBondContact O-CD2 3.34Å; I134-F137 PolarHBondContact O-N 2.82Å; F137-I170 HydrophobicContact CB-CG2 4.42Å; F137-A174 HydrophobicContact CD1-CB 4.34Å; F137-Y178 HydrophobicContact CE1-CD2 4.39Å; F137-Y178 HydrophobicContact CE1-CG 4.05Å; F137-Y178 AromaticContact CE2-CD1 3.98Å; F137-Y178 HydrophobicContact CE2-CD1 3.98Å; F137-Y178 HydrophobicContact CE2-CE1 4.25Å; F137-Y178 HydrophobicContact CE2-CG 4.28Å; F137-Y178 AromaticContact CZ-CD1 3.55Å; F137-Y178 HydrophobicContact CZ-CD1 3.55Å; F137-Y178 AromaticContact CZ-CD2 3.78Å; F137-Y178 HydrophobicContact CZ-CD2 3.78Å; F137-Y178 HydrophobicContact CZ-CE1 4.03Å; F137-Y178 HydrophobicContact CZ-CE2 4.23Å; F137-Y178 AromaticContact CZ-CG 3.4Å; F137-Y178 HydrophobicContact CZ-CG 3.4Å; F137-Y178 VanDerWaalsContact CZ-CG 3.4Å
138G71.9Confident80.5Confident16 Ų1669.5 Ų69.517%0.16537%0.373CS..BIsolated β-bridgetrans-120.6167.8-176.400000114.3I134 S140 V169I134-G138 PolarHBondContact O-N 3.38Å; G138-S140 PolarHBondContact O-N 2.9Å; G138-V169 CarbonylContact C-O 3.59Å; G138-V169 WeakPolarHBondContact CA-O 3.26Å
139N76.2Confident80.1Confident82 Ų8271 Ų7144%0.43939%0.387SS..  trans-74.5109178.7-171.6-11.1000110.4T141 L142 I143 V169N139-T141 PolarHBondContact O-N 2.91Å; N139-T141 PolarHBondContact OD1-OG1 3.32Å; N139-L142 HydrophobicContact CB-CB 4.43Å; N139-L142 HydrophobicContact CB-CD1 3.96Å; N139-L142 PolarHBondContact O-N 2.88Å; N139-I143 WeakPolarHBondContact O-CD1 3.43Å; N139-I143 VanDerWaalsContact O-CG1 3.32Å; N139-I143 WeakPolarHBondContact O-CG1 3.31Å; N139-I143 PolarHBondContact O-N 2.92Å; N139-I143 VanDerWaalsContact O-N 3.17Å; N139-V169 PolarHBondContact N-O 3.46Å; N139-V169 VanDerWaalsContact N-O 3.14Å
140S74.5Confident79.9Confident52 Ų5275.7 Ų75.736%0.36441%0.409SS..Hα-helixtrans-53.6-33-171.5-67.30000113.5G138 I143 E144G138-S140 PolarHBondContact O-N 2.9Å; S140-I143 PolarHBondContact O-N 3.47Å; S140-E144 WeakPolarHBondContact O-CG 3.32Å; S140-E144 PolarHBondContact O-N 3.31Å
141T72.8Confident79.8Confident100 Ų10076 Ų7661%0.61341%0.409SS*.Hα-helixtrans-72.8-34.7-179.658.10000113.4N139N139-T141 PolarHBondContact O-N 2.91Å; N139-T141 PolarHBondContact OD1-OG1 3.32Å
142L71.3Confident79.9Confident82 Ų8272.6 Ų72.643%0.42939%0.392SS..Hα-helixtrans-74.9-31.3175.4-83.8148.8000111.5N139 G145 V169N139-L142 HydrophobicContact CB-CB 4.43Å; N139-L142 HydrophobicContact CB-CD1 3.96Å; N139-L142 PolarHBondContact O-N 2.88Å; L142-G145 PolarHBondContact O-N 3.39Å; L142-V169 HydrophobicContact CB-CG1 4.34Å
143I76.9Confident80Confident11 Ų1177.6 Ų77.66%0.05641%0.413CS..Hα-helixtrans-71-37179.5-62.8155000111.4I134 N139 S140 G145 M146 I151 V169I134-I143 HydrophobicContact CG2-CD1 3.33Å; I134-I143 HydrophobicContact CG2-CG1 3.61Å; I134-I143 HydrophobicContact CG2-CG2 4.16Å; N139-I143 WeakPolarHBondContact O-CD1 3.43Å; N139-I143 VanDerWaalsContact O-CG1 3.32Å; N139-I143 WeakPolarHBondContact O-CG1 3.31Å; N139-I143 PolarHBondContact O-N 2.92Å; N139-I143 VanDerWaalsContact O-N 3.17Å; S140-I143 PolarHBondContact O-N 3.47Å; I143-G145 PolarHBondContact O-N 3.28Å; I143-M146 PolarHBondContact O-N 2.91Å; I143-I151 HydrophobicContact CG2-CD1 4.22Å; I143-V169 HydrophobicContact CG1-CG1 4.34Å
144E77.3Confident80.3Confident143 Ų14374.4 Ų74.467%0.66840%0.396SS*.THydrogen-bonded Turntrans-63.9-22.1177.4-78.2176.3179.400113.5S140S140-E144 WeakPolarHBondContact O-CG 3.32Å; S140-E144 PolarHBondContact O-N 3.31Å
145G78.9Confident80.8Confident72 Ų7274.2 Ų74.274%0.74240%0.395SS*.THydrogen-bonded Turntrans-85-6.7177.200000115.3L142 I143L142-G145 PolarHBondContact O-N 3.39Å; I143-G145 PolarHBondContact O-N 3.28Å
146M82.3Confident81.6Confident40 Ų4067 Ų6720%0.19737%0.368CS..SBendtrans-103.1153.2-176-61-168.2-28.300112.7I143 I151 M154I143-M146 PolarHBondContact O-N 2.91Å; M146-I151 HydrophobicContact CB-CG1 4.27Å; M146-I151 HydrophobicContact CE-CB 4.29Å; M146-I151 HydrophobicContact CE-CD1 4.33Å; M146-I151 HydrophobicContact CE-CG1 3.29Å; M146-M154 HydrophobicContact CE-CE 3.55Å; M146-M154 HydrophobicContact SD-CE 4.1Å
147T87.4Confident82.3Confident77 Ų7764.7 Ų64.747%0.47236%0.356SS..  trans-78.7155.1171.464.80000111.6V149 E150 I151T147-V149 PolarHBondContact O-N 3.38Å; T147-E150 PolarHBondContact N-OE2 2.92Å; T147-E150 PolarHBondContact O-N 3.44Å; T147-E150 VanDerWaalsContact O-N 3.11Å; T147-E150 WeakPolarHBondContact OG1-CG 3.45Å; T147-E150 PolarHBondContact OG1-N 3.34Å; T147-E150 PolarHBondContact OG1-OE2 3.45Å; T147-I151 PolarHBondContact O-N 2.86Å
148E85.7Confident83Confident157 Ų15762.4 Ų62.473%0.73435%0.346SS*.Hα-helixtrans-57.8-35178-171.3179.2177.500112.7I151 V152E148-I151 WeakPolarHBondContact O-CB 3.37Å; E148-I151 PolarHBondContact O-N 3.27Å; E148-V152 WeakPolarHBondContact O-CG2 3.15Å; E148-V152 PolarHBondContact O-N 3.38Å
149V87.3Confident83.9Confident91 Ų9162.7 Ų62.755%0.55235%0.345SS*.Hα-helixtrans-68.4-38.2178.2179.60000111.5T147 K153T147-V149 PolarHBondContact O-N 3.38Å; V149-K153 HydrophobicContact CG1-CD 4.26Å; V149-K153 WeakPolarHBondContact O-CB 3.45Å; V149-K153 VanDerWaalsContact O-CG 3.31Å; V149-K153 WeakPolarHBondContact O-CG 3.38Å; V149-K153 PolarHBondContact O-N 3.03Å
150E87.3Confident84.6Confident99 Ų9959.9 Ų59.946%0.46333%0.331SS..Hα-helixtrans-68.5-40.8176-71.7163.515400111.3T147 K153 M154T147-E150 PolarHBondContact N-OE2 2.92Å; T147-E150 PolarHBondContact O-N 3.44Å; T147-E150 VanDerWaalsContact O-N 3.11Å; T147-E150 WeakPolarHBondContact OG1-CG 3.45Å; T147-E150 PolarHBondContact OG1-N 3.34Å; T147-E150 PolarHBondContact OG1-OE2 3.45Å; E150-K153 PolarHBondContact O-N 3.39Å; E150-M154 WeakPolarHBondContact O-CB 3.35Å; E150-M154 PolarHBondContact O-N 3.21Å
151I86.6Confident84.9Confident37 Ų3765 Ų6519%0.1935%0.347CS..Hα-helixtrans-53.8-54.5171.6-78.6171.3000110.5I134 I143 M146 T147 E148 K153 M154 L155I134-I151 HydrophobicContact CD1-CB 4.09Å; I134-I151 HydrophobicContact CD1-CG1 4.12Å; I134-I151 HydrophobicContact CD1-CG2 3.36Å; I143-I151 HydrophobicContact CG2-CD1 4.22Å; M146-I151 HydrophobicContact CB-CG1 4.27Å; M146-I151 HydrophobicContact CE-CB 4.29Å; M146-I151 HydrophobicContact CE-CD1 4.33Å; M146-I151 HydrophobicContact CE-CG1 3.29Å; T147-I151 PolarHBondContact O-N 2.86Å; E148-I151 WeakPolarHBondContact O-CB 3.37Å; E148-I151 PolarHBondContact O-N 3.27Å; I151-K153 PolarHBondContact O-N 3.49Å; I151-M154 PolarHBondContact O-N 2.92Å; I151-L155 HydrophobicContact CG2-CD1 4.04Å; I151-L155 WeakPolarHBondContact O-CG 3.39Å; I151-L155 PolarHBondContact O-N 3.48Å
152V89.6Confident85Confident45 Ų4567.4 Ų67.427%0.27336%0.356SS..Hα-helixtrans-61.9-43.2-178.61650000111.9P45 V130 E148 M154 L155 A156P45-V152 HydrophobicContact CB-CG1 3.62Å; P45-V152 HydrophobicContact CG-CG1 4.24Å; V130-V152 HydrophobicContact CG1-CG1 3.82Å; V130-V152 HydrophobicContact CG1-CG2 4.37Å; E148-V152 WeakPolarHBondContact O-CG2 3.15Å; E148-V152 PolarHBondContact O-N 3.38Å; V152-M154 VanDerWaalsContact C-N 3.33Å; V152-M154 PolarHBondContact O-N 3.32Å; V152-L155 PolarHBondContact O-N 3.02Å; V152-A156 WeakPolarHBondContact O-CB 3.49Å; V152-A156 PolarHBondContact O-N 3.1Å
153K88.8Confident85.3Confident122 Ų12267.2 Ų67.253%0.5336%0.355SS..Hα-helixtrans-64.3-37.5177.1-75.9176.1-179.6176.20112.3V149 E150 I151 K157V149-K153 HydrophobicContact CG1-CD 4.26Å; V149-K153 WeakPolarHBondContact O-CB 3.45Å; V149-K153 VanDerWaalsContact O-CG 3.31Å; V149-K153 WeakPolarHBondContact O-CG 3.38Å; V149-K153 PolarHBondContact O-N 3.03Å; E150-K153 PolarHBondContact O-N 3.39Å; I151-K153 PolarHBondContact O-N 3.49Å; K153-K157 WeakPolarHBondContact O-CG 3.45Å
154M88Confident85.2Confident12 Ų1268 Ų686%0.05936%0.358CS..Hα-helixtrans-69.5-46.2176.8179.7-118.5-79.600111.4M146 E150 I151 V152 A156 K157 F164 V169 I170M146-M154 HydrophobicContact CE-CE 3.55Å; M146-M154 HydrophobicContact SD-CE 4.1Å; E150-M154 WeakPolarHBondContact O-CB 3.35Å; E150-M154 PolarHBondContact O-N 3.21Å; I151-M154 PolarHBondContact O-N 2.92Å; V152-M154 VanDerWaalsContact C-N 3.33Å; V152-M154 PolarHBondContact O-N 3.32Å; M154-A156 VanDerWaalsContact C-N 3.3Å; M154-A156 PolarHBondContact O-N 3.11Å; M154-K157 WeakPolarHBondContact O-CB 3.32Å; M154-K157 PolarHBondContact O-N 3.14Å; M154-F164 HydrophobicContact CG-CE2 4.3Å; M154-V169 HydrophobicContact CE-CB 4.23Å; M154-V169 HydrophobicContact CE-CG1 3.74Å; M154-I170 HydrophobicContact CE-CD1 3.98Å; M154-I170 HydrophobicContact CE-CG1 4.3Å; M154-I170 HydrophobicContact SD-CB 4.5Å; M154-I170 HydrophobicContact SD-CD1 3.4Å; M154-I170 WeakPolarHBondContact SD-CD1 3.36Å; M154-I170 HydrophobicContact SD-CG1 4.06Å
155L89.1Confident85Confident4 Ų466.9 Ų66.92%0.02136%0.357CS..Hα-helixtrans-57.5-42.6176-74.5173.5000112.2S129 V130 L132 I134 I151 V152 K157 I158 I170S129-L155 WeakPolarHBondContact CB-O 3.31Å; V130-L155 WeakPolarHBondContact O-CD1 3.43Å; L132-L155 HydrophobicContact CB-CD2 3.9Å; L132-L155 HydrophobicContact CD1-CD2 4.41Å; I134-L155 HydrophobicContact CD1-CD1 3.74Å; I134-L155 HydrophobicContact CD1-CD2 3.76Å; I134-L155 HydrophobicContact CD1-CG 3.66Å; I134-L155 HydrophobicContact CG1-CD1 3.87Å; I134-L155 HydrophobicContact CG1-CD2 3.45Å; I134-L155 VanDerWaalsContact CG1-CD2 3.45Å; I134-L155 HydrophobicContact CG1-CG 3.89Å; I151-L155 HydrophobicContact CG2-CD1 4.04Å; I151-L155 WeakPolarHBondContact O-CG 3.39Å; I151-L155 PolarHBondContact O-N 3.48Å; V152-L155 PolarHBondContact O-N 3.02Å; L155-K157 PolarHBondContact O-N 2.62Å; L155-K157 VanDerWaalsContact O-N 3.11Å; L155-I158 HydrophobicContact CB-CD1 4.47Å; L155-I158 HydrophobicContact CD2-CD1 3.54Å; L155-I158 WeakPolarHBondContact O-CB 3.39Å; L155-I158 WeakPolarHBondContact O-CG1 3.49Å; L155-I158 PolarHBondContact O-N 2.83Å; L155-I158 VanDerWaalsContact O-N 3.1Å; L155-I170 HydrophobicContact CD2-CD1 4.42Å
156A91.1Very high84.5Confident0 Ų067.2 Ų67.20%034%0.339CS..Hα-helixtrans-59-24.9178.500000113.4C43 P45 N48 V130 V152 M154 P159C43-A156 VanDerWaalsContact CA-O 3.27Å; C43-A156 WeakPolarHBondContact CA-O 3.46Å; C43-A156 WeakPolarHBondContact CB-O 3.31Å; P45-A156 HydrophobicContact CB-CB 4.01Å; P45-A156 HydrophobicContact CG-CB 4.42Å; N48-A156 WeakPolarHBondContact ND2-CA 3.35Å; N48-A156 PolarHBondContact ND2-O 3.04Å; V130-A156 HydrophobicContact CG2-CB 3.89Å; V152-A156 WeakPolarHBondContact O-CB 3.49Å; V152-A156 PolarHBondContact O-N 3.1Å; M154-A156 VanDerWaalsContact C-N 3.3Å; M154-A156 PolarHBondContact O-N 3.11Å; A156-P159 WeakPolarHBondContact O-CD 3.36Å
157K90.9Very high83.7Confident69 Ų6970 Ų7030%0.336%0.36SS..Hα-helixtrans-87.1-13-179.8-68171.3168.3-162.50114.1K153 M154 L155 P159 C160 I163 F164 D165K153-K157 WeakPolarHBondContact O-CG 3.45Å; M154-K157 WeakPolarHBondContact O-CB 3.32Å; M154-K157 PolarHBondContact O-N 3.14Å; L155-K157 PolarHBondContact O-N 2.62Å; L155-K157 VanDerWaalsContact O-N 3.11Å; K157-P159 VanDerWaalsContact C-N 3.3Å; K157-C160 PolarHBondContact O-N 2.83Å; K157-I163 HydrophobicContact CD-CG2 4.06Å; K157-I163 HydrophobicContact CG-CG2 4.14Å; K157-F164 HydrophobicContact CB-CD2 4.44Å; K157-D165 IonicContact NZ-OD2 3.97Å
158I89.9Confident82.6Confident0 Ų074.6 Ų74.60%038%0.376CS..THydrogen-bonded Turntrans-48.9-43179.7-69.2173.2000113.3L125 L132 L155 C160 F164 R172 A175L125-I158 HydrophobicContact CD1-CG2 4.29Å; L132-I158 HydrophobicContact CD1-CD1 3.79Å; L155-I158 HydrophobicContact CB-CD1 4.47Å; L155-I158 HydrophobicContact CD2-CD1 3.54Å; L155-I158 WeakPolarHBondContact O-CB 3.39Å; L155-I158 WeakPolarHBondContact O-CG1 3.49Å; L155-I158 PolarHBondContact O-N 2.83Å; L155-I158 VanDerWaalsContact O-N 3.1Å; I158-C160 VanDerWaalsContact C-N 3.27Å; I158-C160 PolarHBondContact O-N 3.48Å; I158-F164 HydrophobicContact CG1-CD2 4.47Å; I158-F164 HydrophobicContact CG1-CE2 4.09Å; I158-R172 HydrophobicContact CG2-CG 4.28Å; I158-R172 PolarHBondContact O-NE 3.47Å; I158-A175 HydrophobicContact CD1-CB 4.31Å; I158-A175 HydrophobicContact CG2-CB 4.38Å
159P90.2Very high81.7Confident21 Ų2167.8 Ų67.814%0.13635%0.345CS..THydrogen-bonded Turntrans-61.1-34178.9-21.933.9000113.1C41 L125 A156 K157 R172C41-P159 HydrophobicContact CB-CB 4.03Å; L125-P159 HydrophobicContact CG-CB 4.35Å; L125-P159 HydrophobicContact CG-CG 4.27Å; A156-P159 WeakPolarHBondContact O-CD 3.36Å; K157-P159 VanDerWaalsContact C-N 3.3Å; P159-R172 PolarHBondContact O-NH2 3.36Å
160C90.3Very high81.1Confident23 Ų2363.7 Ų63.716%0.15532%0.32CS..  trans-88.8119.5-174.7-67.80000112.5C43 K157 I158 I163 F164C43-C160 HydrophobicContact CB-CB 3.97Å; C43-C160 WeakPolarHBondContact CB-SG 3.43Å; C43-C160 WeakPolarHBondContact SG-CB 3.39Å; C43-C160 PolarHBondContact SG-N 3.44Å; C43-C160 VanDerWaalsContact SG-N 3.4Å; C43-C160 CovalentContact SG-SG 2.02Å; C43-C160 PolarHBondContact SG-SG 2.85Å; K157-C160 PolarHBondContact O-N 2.83Å; I158-C160 VanDerWaalsContact C-N 3.27Å; I158-C160 PolarHBondContact O-N 3.48Å; C160-I163 HydrophobicContact CB-CB 4.14Å; C160-I163 HydrophobicContact CB-CD1 4.08Å; C160-I163 HydrophobicContact CB-CG1 4.24Å; C160-F164 WeakPolarHBondContact O-CB 3.36Å
161K81.8Confident80.9Confident159 Ų15961.9 Ų61.969%0.69132%0.318SS*.SBendtrans-70.1-36.4179.9-170180177.1-174.70113.2
162N75.2Confident80.8Confident152 Ų15262.9 Ų62.981%0.81332%0.32SS*.SBendtrans-87.8-7.1-170.3-58.9-17.2000114
163I76.4Confident80.6Confident78 Ų7864.9 Ų64.940%0.433%0.326SS..SBendtrans-117.3-3.9-173.9-51.4172.1000110.5K157 C160 D165K157-I163 HydrophobicContact CD-CG2 4.06Å; K157-I163 HydrophobicContact CG-CG2 4.14Å; C160-I163 HydrophobicContact CB-CB 4.14Å; C160-I163 HydrophobicContact CB-CD1 4.08Å; C160-I163 HydrophobicContact CB-CG1 4.24Å; I163-D165 PolarHBondContact O-N 3.46Å
164F76.3Confident80.5Confident27 Ų2760.9 Ų60.912%0.11832%0.316CS..  trans-88.7104.8-177.9-174-94.3000110.1M154 K157 I158 C160 Q166 I170 R172M154-F164 HydrophobicContact CG-CE2 4.3Å; K157-F164 HydrophobicContact CB-CD2 4.44Å; I158-F164 HydrophobicContact CG1-CD2 4.47Å; I158-F164 HydrophobicContact CG1-CE2 4.09Å; C160-F164 WeakPolarHBondContact O-CB 3.36Å; F164-Q166 VanDerWaalsContact CE1-C 3.44Å; F164-Q166 WeakPolarHBondContact CE1-O 3.11Å; F164-Q166 WeakPolarHBondContact CZ-O 3.44Å; F164-I170 HydrophobicContact CZ-CB 4.48Å; F164-R172 HydrophobicContact CD1-CB 4.09Å; F164-R172 HydrophobicContact CE1-CB 3.9Å; F164-R172 HydrophobicContact CZ-CB 4.19Å
165D71.4Confident80.5Confident120 Ų12060.3 Ų60.364%0.64231%0.313SS*.  trans-102.44.3-170.4-53.4-45.4000113.9K157 I163 P167K157-D165 IonicContact NZ-OD2 3.97Å; I163-D165 PolarHBondContact O-N 3.46Å; D165-P167 WeakPolarHBondContact O-CD 3.41Å
166Q68.6Low80.5Confident78 Ų7860.5 Ų60.536%0.36432%0.315SS..  trans-124.660.7-173.5-67.9-170.3-11.800114.4F164 E168 V169 I170F164-Q166 VanDerWaalsContact CE1-C 3.44Å; F164-Q166 WeakPolarHBondContact CE1-O 3.11Å; F164-Q166 WeakPolarHBondContact CZ-O 3.44Å; Q166-E168 PolarHBondContact O-N 3.39Å; Q166-V169 HydrophobicContact CB-CB 4.41Å; Q166-V169 HydrophobicContact CB-CG2 4.31Å; Q166-V169 PolarHBondContact O-N 3.28Å; Q166-I170 PolarHBondContact O-N 3.05Å
167P67Low80.5Confident98 Ų9868.2 Ų68.264%0.63634%0.344SS*.THydrogen-bonded Turntrans-66.6-22.1177.129.1-34.7000113.8D165D165-P167 WeakPolarHBondContact O-CD 3.41Å
168E62.4Low80.6Confident174 Ų17469.7 Ų69.781%0.81335%0.348SS*.THydrogen-bonded Turntrans-77.2-24.4-179.7-62.7-177.4175.700113.2Q166Q166-E168 PolarHBondContact O-N 3.39Å
169V67.5Low80.7Confident15 Ų1569.9 Ų69.99%0.09135%0.35CS..THydrogen-bonded Turntrans-93.1-41.6-175.9-174.10000111.4G138 N139 L142 I143 M154 Q166G138-V169 CarbonylContact C-O 3.59Å; G138-V169 WeakPolarHBondContact CA-O 3.26Å; N139-V169 PolarHBondContact N-O 3.46Å; N139-V169 VanDerWaalsContact N-O 3.14Å; L142-V169 HydrophobicContact CB-CG1 4.34Å; I143-V169 HydrophobicContact CG1-CG1 4.34Å; M154-V169 HydrophobicContact CE-CB 4.23Å; M154-V169 HydrophobicContact CE-CG1 3.74Å; Q166-V169 HydrophobicContact CB-CB 4.41Å; Q166-V169 HydrophobicContact CB-CG2 4.31Å; Q166-V169 PolarHBondContact O-N 3.28Å
170I75.9Confident80.9Confident4 Ų472.1 Ų72.12%0.02136%0.357CS..BIsolated β-bridgetrans-138134.5179.4-66.4-177.1000110.5I134 F137 M154 L155 F164 Q166 R172 A175I134-I170 HydrophobicContact CB-CD1 4.13Å; I134-I170 HydrophobicContact CD1-CD1 3.96Å; I134-I170 HydrophobicContact CG1-CD1 3.73Å; I134-I170 HydrophobicContact CG2-CD1 3.49Å; I134-I170 VanDerWaalsContact CG2-CD1 3.49Å; I134-I170 HydrophobicContact CG2-CG1 4.06Å; F137-I170 HydrophobicContact CB-CG2 4.42Å; M154-I170 HydrophobicContact CE-CD1 3.98Å; M154-I170 HydrophobicContact CE-CG1 4.3Å; M154-I170 HydrophobicContact SD-CB 4.5Å; M154-I170 HydrophobicContact SD-CD1 3.4Å; M154-I170 WeakPolarHBondContact SD-CD1 3.36Å; M154-I170 HydrophobicContact SD-CG1 4.06Å; L155-I170 HydrophobicContact CD2-CD1 4.42Å; F164-I170 HydrophobicContact CZ-CB 4.48Å; Q166-I170 PolarHBondContact O-N 3.05Å; I170-R172 PolarHBondContact O-N 3.01Å; I170-A175 HydrophobicContact CG2-CB 4.5Å
171S81.4Confident81.1Confident62 Ų6274.8 Ų74.843%0.43438%0.375SS..  trans-73.695.6166.2-178.20000110.6E173 A174 A175S171-E173 PolarHBondContact O-N 3.27Å; S171-A174 PolarHBondContact O-N 2.93Å; S171-A174 PolarHBondContact OG-N 3.34Å; S171-A175 PolarHBondContact O-N 2.91Å; S171-A175 VanDerWaalsContact O-N 3.08Å
172R85.1Confident81.7Confident57 Ų5769.6 Ų69.622%0.21535%0.354CS..Hα-helixtrans-48.8-41.7174.3174.8-175.4172.9-95.1-2.7112.1I158 P159 F164 I170 A175 S176I158-R172 HydrophobicContact CG2-CG 4.28Å; I158-R172 PolarHBondContact O-NE 3.47Å; P159-R172 PolarHBondContact O-NH2 3.36Å; F164-R172 HydrophobicContact CD1-CB 4.09Å; F164-R172 HydrophobicContact CE1-CB 3.9Å; F164-R172 HydrophobicContact CZ-CB 4.19Å; I170-R172 PolarHBondContact O-N 3.01Å; R172-A175 PolarHBondContact O-N 2.89Å; R172-S176 WeakPolarHBondContact O-CB 3.49Å; R172-S176 PolarHBondContact O-N 3.32Å
173E85.5Confident82.7Confident87 Ų8762.4 Ų62.441%0.40732%0.316SS..Hα-helixtrans-65.7-40.7-178-174.562.1-162.700111.3S171 R177S171-E173 PolarHBondContact O-N 3.27Å; E173-R177 WeakPolarHBondContact O-CB 3.44Å; E173-R177 WeakPolarHBondContact O-CG 3.41Å; E173-R177 PolarHBondContact O-N 2.96Å; E173-R177 IonicContact OE1-CZ 2.66Å; E173-R177 VanDerWaalsContact OE1-CZ 3.26Å; E173-R177 IonicContact OE1-NE 3.16Å; E173-R177 PolarHBondContact OE1-NE 3.38Å; E173-R177 IonicContact OE1-NH2 2.77Å; E173-R177 PolarHBondContact OE1-NH2 3.18Å
174A86.6Confident83.7Confident38 Ų3862.8 Ų62.831%0.31432%0.316SS..Hα-helixtrans-65.7-47.9176.100000111.7F137 S171 S176 R177 Y178F137-A174 HydrophobicContact CD1-CB 4.34Å; S171-A174 PolarHBondContact O-N 2.93Å; S171-A174 PolarHBondContact OG-N 3.34Å; A174-S176 PolarHBondContact O-N 3.04Å; A174-R177 PolarHBondContact O-N 3.33Å; A174-Y178 WeakPolarHBondContact O-CB 3.35Å; A174-Y178 PolarHBondContact O-N 3.48Å
175A87.8Confident84.7Confident1 Ų164 Ų641%0.00833%0.331CS..Hα-helixtrans-60.9-4417800000112.2L132 I158 I170 S171 R172 Y178 I179L132-A175 HydrophobicContact CD1-CB 3.91Å; I158-A175 HydrophobicContact CD1-CB 4.31Å; I158-A175 HydrophobicContact CG2-CB 4.38Å; I170-A175 HydrophobicContact CG2-CB 4.5Å; S171-A175 PolarHBondContact O-N 2.91Å; S171-A175 VanDerWaalsContact O-N 3.08Å; R172-A175 PolarHBondContact O-N 2.89Å; A175-Y178 PolarHBondContact O-N 2.86Å; A175-I179 PolarHBondContact O-N 2.66Å
176S90.3Very high85.9Confident8 Ų863.7 Ų63.76%0.05632%0.324CS..Hα-helixtrans-61.6-44.6176.1178.60000112R172 A174 K180R172-S176 WeakPolarHBondContact O-CB 3.49Å; R172-S176 PolarHBondContact O-N 3.32Å; A174-S176 PolarHBondContact O-N 3.04Å; S176-K180 WeakPolarHBondContact O-CB 3.23Å; S176-K180 VanDerWaalsContact O-CG 3.26Å; S176-K180 WeakPolarHBondContact O-CG 3.37Å; S176-K180 PolarHBondContact O-N 3.04Å
177R91.1Very high87.2Confident161 Ų16160 Ų6061%0.60831%0.307SS*.Hα-helixtrans-63.2-42.2176.6-75.2173.9-171.8-170.45.3112.2E173 A174 K180 C181E173-R177 WeakPolarHBondContact O-CB 3.44Å; E173-R177 WeakPolarHBondContact O-CG 3.41Å; E173-R177 PolarHBondContact O-N 2.96Å; E173-R177 IonicContact OE1-CZ 2.66Å; E173-R177 VanDerWaalsContact OE1-CZ 3.26Å; E173-R177 IonicContact OE1-NE 3.16Å; E173-R177 PolarHBondContact OE1-NE 3.38Å; E173-R177 IonicContact OE1-NH2 2.77Å; E173-R177 PolarHBondContact OE1-NH2 3.18Å; A174-R177 PolarHBondContact O-N 3.33Å; R177-K180 PolarHBondContact O-N 3.44Å; R177-C181 WeakPolarHBondContact O-CB 3.44Å; R177-C181 PolarHBondContact O-N 2.96Å
178Y91.4Very high88.6Confident100 Ų10063.5 Ų63.539%0.39231%0.308SS..Hα-helixtrans-59.7-52.5177.6175.2-103.9000111.7L132 F137 A174 A175 K180 C181 I182L132-Y178 HydrophobicContact CD2-CD1 3.86Å; L132-Y178 HydrophobicContact CD2-CE1 4.07Å; F137-Y178 HydrophobicContact CE1-CD2 4.39Å; F137-Y178 HydrophobicContact CE1-CG 4.05Å; F137-Y178 AromaticContact CE2-CD1 3.98Å; F137-Y178 HydrophobicContact CE2-CD1 3.98Å; F137-Y178 HydrophobicContact CE2-CE1 4.25Å; F137-Y178 HydrophobicContact CE2-CG 4.28Å; F137-Y178 AromaticContact CZ-CD1 3.55Å; F137-Y178 HydrophobicContact CZ-CD1 3.55Å; F137-Y178 AromaticContact CZ-CD2 3.78Å; F137-Y178 HydrophobicContact CZ-CD2 3.78Å; F137-Y178 HydrophobicContact CZ-CE1 4.03Å; F137-Y178 HydrophobicContact CZ-CE2 4.23Å; F137-Y178 AromaticContact CZ-CG 3.4Å; F137-Y178 HydrophobicContact CZ-CG 3.4Å; F137-Y178 VanDerWaalsContact CZ-CG 3.4Å; A174-Y178 WeakPolarHBondContact O-CB 3.35Å; A174-Y178 PolarHBondContact O-N 3.48Å; A175-Y178 PolarHBondContact O-N 2.86Å; Y178-K180 VanDerWaalsContact C-N 3.35Å; Y178-K180 PolarHBondContact O-N 3.17Å; Y178-C181 WeakPolarHBondContact O-CB 3.32Å; Y178-C181 PolarHBondContact O-N 3.14Å; Y178-I182 HydrophobicContact CD1-CD1 3.99Å; Y178-I182 HydrophobicContact CD2-CD1 4.48Å; Y178-I182 HydrophobicContact CE1-CD1 3.43Å; Y178-I182 VanDerWaalsContact CE1-CD1 3.43Å; Y178-I182 HydrophobicContact CE2-CD1 3.99Å; Y178-I182 HydrophobicContact CG-CD1 4.49Å; Y178-I182 VanDerWaalsContact CZ-CD1 3.44Å; Y178-I182 PolarHBondContact O-N 3.08Å; Y178-I182 VanDerWaalsContact O-N 3.11Å
179I92.3Very high90.3Very high5 Ų559 Ų593%0.02629%0.292CS..Hα-helixtrans-64.1-40.9179.7-61.4169.9000111.4F124 L125 L132 A175 C181 I182 S183F124-I179 HydrophobicContact CD1-CG2 3.6Å; F124-I179 HydrophobicContact CE1-CG2 4.28Å; L125-I179 HydrophobicContact CB-CG2 4.36Å; L125-I179 HydrophobicContact CD1-CB 4.09Å; L125-I179 HydrophobicContact CD1-CD1 3.52Å; L125-I179 HydrophobicContact CD1-CG1 4.36Å; L125-I179 HydrophobicContact CD1-CG2 4.43Å; L132-I179 HydrophobicContact CD1-CD1 3.43Å; L132-I179 VanDerWaalsContact CD1-CD1 3.43Å; L132-I179 HydrophobicContact CD1-CG1 4.18Å; L132-I179 HydrophobicContact CD2-CD1 3.84Å; L132-I179 HydrophobicContact CD2-CG1 3.72Å; L132-I179 HydrophobicContact CG-CD1 3.67Å; L132-I179 HydrophobicContact CG-CG1 4.16Å; A175-I179 PolarHBondContact O-N 2.66Å; I179-C181 VanDerWaalsContact C-N 3.32Å; I179-C181 PolarHBondContact O-N 3.35Å; I179-I182 PolarHBondContact O-N 3.3Å; I179-S183 PolarHBondContact O-N 2.95Å
180K94.3Very high91.7Very high67 Ų6760.4 Ų60.429%0.29130%0.297SS..Hα-helixtrans-63-38.7177.2-76.4-179.2178.3-172.60112.2S176 R177 Y178 S183 Q184S176-K180 WeakPolarHBondContact O-CB 3.23Å; S176-K180 VanDerWaalsContact O-CG 3.26Å; S176-K180 WeakPolarHBondContact O-CG 3.37Å; S176-K180 PolarHBondContact O-N 3.04Å; R177-K180 PolarHBondContact O-N 3.44Å; Y178-K180 VanDerWaalsContact C-N 3.35Å; Y178-K180 PolarHBondContact O-N 3.17Å; K180-S183 WeakPolarHBondContact O-CB 3.46Å; K180-S183 PolarHBondContact O-N 2.92Å; K180-Q184 WeakPolarHBondContact O-CB 3.37Å; K180-Q184 VanDerWaalsContact O-CG 3.31Å; K180-Q184 WeakPolarHBondContact O-CG 3.39Å; K180-Q184 PolarHBondContact O-N 2.93Å
181C95.3Very high92.6Very high79 Ų7962.9 Ų62.953%0.53431%0.31SS..Hα-helixtrans-60.4-45.9174.8179.90000111.2R177 Y178 I179 S183 Q184 A185R177-C181 WeakPolarHBondContact O-CB 3.44Å; R177-C181 PolarHBondContact O-N 2.96Å; Y178-C181 WeakPolarHBondContact O-CB 3.32Å; Y178-C181 PolarHBondContact O-N 3.14Å; I179-C181 VanDerWaalsContact C-N 3.32Å; I179-C181 PolarHBondContact O-N 3.35Å; C181-S183 PolarHBondContact O-N 3.5Å; C181-Q184 PolarHBondContact O-N 3.3Å; C181-A185 PolarHBondContact O-N 2.93Å
182I94.7Very high93.3Very high51 Ų5165.2 Ų65.226%0.26232%0.317SS..Hα-helixtrans-60.9-46.2175.4-67.5171.8000111F124 Y178 I179 Q184 A185 F186F124-I182 HydrophobicContact CE1-CB 4.47Å; F124-I182 HydrophobicContact CE1-CG2 3.77Å; F124-I182 HydrophobicContact CZ-CG2 4.2Å; Y178-I182 HydrophobicContact CD1-CD1 3.99Å; Y178-I182 HydrophobicContact CD2-CD1 4.48Å; Y178-I182 HydrophobicContact CE1-CD1 3.43Å; Y178-I182 VanDerWaalsContact CE1-CD1 3.43Å; Y178-I182 HydrophobicContact CE2-CD1 3.99Å; Y178-I182 HydrophobicContact CG-CD1 4.49Å; Y178-I182 VanDerWaalsContact CZ-CD1 3.44Å; Y178-I182 PolarHBondContact O-N 3.08Å; Y178-I182 VanDerWaalsContact O-N 3.11Å; I179-I182 PolarHBondContact O-N 3.3Å; I182-Q184 VanDerWaalsContact C-N 3.31Å; I182-Q184 PolarHBondContact O-N 2.97Å; I182-A185 WeakPolarHBondContact O-CB 3.2Å; I182-A185 PolarHBondContact O-N 3.48Å; I182-A185 VanDerWaalsContact O-N 3.16Å; I182-F186 HydrophobicContact CG2-CD2 3.7Å; I182-F186 HydrophobicContact CG2-CE2 3.54Å; I182-F186 VanDerWaalsContact O-CD2 3.29Å; I182-F186 WeakPolarHBondContact O-CD2 3.42Å; I182-F186 PolarHBondContact O-N 3.41Å
183S96.3Very high93.8Very high0 Ų067.3 Ų67.30%033%0.332CS..Hα-helixtrans-58.4-43.1177.3-172.50000112.1L118 G121 F124 I179 K180 C181 F186 G187L118-S183 CarbonylContact O-C 3.39Å; L118-S183 WeakPolarHBondContact O-CB 3.21Å; L118-S183 PolarHBondContact O-OG 3.45Å; G121-S183 WeakPolarHBondContact CA-OG 3.44Å; F124-S183 VanDerWaalsContact CB-OG 3.31Å; F124-S183 WeakPolarHBondContact CB-OG 3.46Å; I179-S183 PolarHBondContact O-N 2.95Å; K180-S183 WeakPolarHBondContact O-CB 3.46Å; K180-S183 PolarHBondContact O-N 2.92Å; C181-S183 PolarHBondContact O-N 3.5Å; S183-F186 PolarHBondContact O-N 2.85Å; S183-G187 PolarHBondContact O-N 2.83Å
184Q96.3Very high94.1Very high86 Ų8666.3 Ų66.340%0.40233%0.328SS..Hα-helixtrans-66.3-38.3176.6-74.2175.2-4.100112M119 K180 C181 I182 G187 W188M119-Q184 WeakPolarHBondContact O-CG 3.4Å; M119-Q184 PolarHBondContact O-NE2 2.83Å; M119-Q184 VanDerWaalsContact O-NE2 3.15Å; M119-Q184 HydrophobicContact SD-CB 4.43Å; M119-Q184 HydrophobicContact SD-CG 4.32Å; K180-Q184 WeakPolarHBondContact O-CB 3.37Å; K180-Q184 VanDerWaalsContact O-CG 3.31Å; K180-Q184 WeakPolarHBondContact O-CG 3.39Å; K180-Q184 PolarHBondContact O-N 2.93Å; C181-Q184 PolarHBondContact O-N 3.3Å; I182-Q184 VanDerWaalsContact C-N 3.31Å; I182-Q184 PolarHBondContact O-N 2.97Å; Q184-G187 PolarHBondContact O-N 2.97Å; Q184-W188 PolarHBondContact O-N 3.37Å
185A97.4Very high94.2Very high53 Ų5368.9 Ų68.944%0.43834%0.34SS..Hα-helixtrans-60.5-47.1173.200000111.1C181 I182 G187 W188 V189C181-A185 PolarHBondContact O-N 2.93Å; I182-A185 WeakPolarHBondContact O-CB 3.2Å; I182-A185 PolarHBondContact O-N 3.48Å; I182-A185 VanDerWaalsContact O-N 3.16Å; A185-G187 VanDerWaalsContact C-N 3.3Å; A185-G187 PolarHBondContact O-N 3Å; A185-W188 PolarHBondContact O-N 2.85Å; A185-V189 VanDerWaalsContact O-CG2 3.32Å; A185-V189 WeakPolarHBondContact O-CG2 3.42Å; A185-V189 PolarHBondContact O-N 3.37Å
186F96.4Very high94.4Very high114 Ų11473.2 Ų73.250%0.536%0.362SS..Hα-helixtrans-59.4-40.4172.2-81.6-68.5000112.3F124 I182 S183 W188 V189 F190F124-F186 HydrophobicContact CE2-CD2 4.17Å; F124-F186 HydrophobicContact CE2-CE2 4.49Å; F124-F186 AromaticContact CZ-CD2 3.83Å; F124-F186 HydrophobicContact CZ-CD2 3.83Å; F124-F186 AromaticContact CZ-CE2 3.85Å; F124-F186 HydrophobicContact CZ-CE2 3.85Å; I182-F186 HydrophobicContact CG2-CD2 3.7Å; I182-F186 HydrophobicContact CG2-CE2 3.54Å; I182-F186 VanDerWaalsContact O-CD2 3.29Å; I182-F186 WeakPolarHBondContact O-CD2 3.42Å; I182-F186 PolarHBondContact O-N 3.41Å; S183-F186 PolarHBondContact O-N 2.85Å; F186-W188 PolarHBondContact O-N 3.03Å; F186-V189 PolarHBondContact O-N 3.15Å; F186-F190 VanDerWaalsContact O-CB 3.23Å; F186-F190 WeakPolarHBondContact O-CB 3.48Å; F186-F190 PolarHBondContact O-N 2.91Å
187G96.1Very high94.3Very high0 Ų074.9 Ų74.90%038%0.377CS..Hα-helixtrans-59.1-44.7174.800000112.7S183 Q184 A185 F190 L191S183-G187 PolarHBondContact O-N 2.83Å; Q184-G187 PolarHBondContact O-N 2.97Å; A185-G187 VanDerWaalsContact C-N 3.3Å; A185-G187 PolarHBondContact O-N 3Å; G187-F190 PolarHBondContact O-N 3.35Å; G187-L191 WeakPolarHBondContact O-CG 3.29Å; G187-L191 PolarHBondContact O-N 2.89Å
188W97.4Very high93.9Very high171 Ų17168.8 Ų68.865%0.64836%0.361SS*.Hα-helixtrans-69.5-42.6178.5-81.6113.5000112.2M119 Q184 A185 F186 F190 L191 L192M119-W188 HydrophobicContact CE-CB 4.29Å; M119-W188 HydrophobicContact CE-CD2 3.74Å; M119-W188 HydrophobicContact CE-CE3 4.42Å; M119-W188 HydrophobicContact CE-CG 3.66Å; M119-W188 VanDerWaalsContact CE-N 3.31Å; Q184-W188 PolarHBondContact O-N 3.37Å; A185-W188 PolarHBondContact O-N 2.85Å; F186-W188 PolarHBondContact O-N 3.03Å; W188-F190 VanDerWaalsContact C-N 3.31Å; W188-F190 PolarHBondContact O-N 3.45Å; W188-L191 HydrophobicContact CE3-CD1 4.25Å; W188-L191 HydrophobicContact CZ3-CD1 4.4Å; W188-L191 PolarHBondContact O-N 3.18Å; W188-L192 WeakPolarHBondContact O-CB 3.25Å; W188-L192 PolarHBondContact O-N 3.48Å
189V97.7Very high93.6Very high80 Ų8070.4 Ų70.449%0.48537%0.37SS..Hα-helixtrans-59.8-44.9174170.40000110.3A185 F186 L192 L193A185-V189 VanDerWaalsContact O-CG2 3.32Å; A185-V189 WeakPolarHBondContact O-CG2 3.42Å; A185-V189 PolarHBondContact O-N 3.37Å; F186-V189 PolarHBondContact O-N 3.15Å; V189-L192 PolarHBondContact O-N 2.75Å; V189-L193 HydrophobicContact CG1-CD1 3.89Å; V189-L193 HydrophobicContact CG1-CG 4.34Å; V189-L193 WeakPolarHBondContact O-CB 3.47Å; V189-L193 VanDerWaalsContact O-CG 3.27Å; V189-L193 WeakPolarHBondContact O-CG 3.48Å; V189-L193 PolarHBondContact O-N 3.36Å
190F96.4Very high93Very high44 Ų4474.8 Ų74.819%0.19339%0.391CS..Hα-helixtrans-59.8-49.2175.9176.3-99.2000111.8M111 I114 S115 L118 F186 G187 W188 L192 L193 M194M111-F190 HydrophobicContact CG-CZ 4.38Å; I114-F190 HydrophobicContact CB-CE1 4.12Å; I114-F190 HydrophobicContact CB-CZ 4.15Å; I114-F190 HydrophobicContact CD1-CZ 4.35Å; I114-F190 HydrophobicContact CG2-CD1 4.16Å; I114-F190 HydrophobicContact CG2-CD2 4.46Å; I114-F190 HydrophobicContact CG2-CE1 3.85Å; I114-F190 HydrophobicContact CG2-CE2 4.18Å; I114-F190 HydrophobicContact CG2-CG 4.45Å; I114-F190 HydrophobicContact CG2-CZ 3.86Å; S115-F190 WeakPolarHBondContact OG-CD1 3.26Å; S115-F190 WeakPolarHBondContact OG-CE1 3.34Å; L118-F190 HydrophobicContact CD1-CB 4.34Å; F186-F190 VanDerWaalsContact O-CB 3.23Å; F186-F190 WeakPolarHBondContact O-CB 3.48Å; F186-F190 PolarHBondContact O-N 2.91Å; G187-F190 PolarHBondContact O-N 3.35Å; W188-F190 VanDerWaalsContact C-N 3.31Å; W188-F190 PolarHBondContact O-N 3.45Å; F190-L192 VanDerWaalsContact C-N 3.32Å; F190-L192 PolarHBondContact O-N 2.95Å; F190-L193 PolarHBondContact O-N 3.21Å; F190-M194 HydrophobicContact CD1-CG 4.26Å; F190-M194 HydrophobicContact CD2-CG 4.16Å; F190-M194 HydrophobicContact CE1-CG 3.88Å; F190-M194 HydrophobicContact CE2-CG 3.77Å; F190-M194 HydrophobicContact CE2-SD 3.97Å; F190-M194 HydrophobicContact CG-CG 4.4Å; F190-M194 HydrophobicContact CZ-CG 3.62Å; F190-M194 HydrophobicContact CZ-SD 4.21Å; F190-M194 VanDerWaalsContact O-CG 3.31Å; F190-M194 WeakPolarHBondContact O-CG 3.28Å; F190-M194 PolarHBondContact O-N 3.45Å
191L94.4Very high92.1Very high57 Ų5775.1 Ų75.130%0.29840%0.396SS..Hα-helixtrans-59.1-42.4177.1-77.8173.2000112.4S115 M119 G187 W188 T195S115-L191 WeakPolarHBondContact OG-CD2 3.23Å; M119-L191 HydrophobicContact CE-CD1 3.77Å; G187-L191 WeakPolarHBondContact O-CG 3.29Å; G187-L191 PolarHBondContact O-N 2.89Å; W188-L191 HydrophobicContact CE3-CD1 4.25Å; W188-L191 HydrophobicContact CZ3-CD1 4.4Å; W188-L191 PolarHBondContact O-N 3.18Å; L191-T195 VanDerWaalsContact O-CB 3.31Å; L191-T195 WeakPolarHBondContact O-CB 3.47Å; L191-T195 PolarHBondContact O-N 3.16Å; L191-T195 PolarHBondContact O-OG1 3.41Å
192L96.5Very high91Very high110 Ų11078.5 Ų78.558%0.57640%0.397SS*.Hα-helixtrans-62.1-49.6177-175.169.3000110.9W188 V189 F190 M194 T195 L196W188-L192 WeakPolarHBondContact O-CB 3.25Å; W188-L192 PolarHBondContact O-N 3.48Å; V189-L192 PolarHBondContact O-N 2.75Å; F190-L192 VanDerWaalsContact C-N 3.32Å; F190-L192 PolarHBondContact O-N 2.95Å; L192-M194 PolarHBondContact O-N 3.39Å; L192-T195 PolarHBondContact O-N 2.95Å; L192-L196 HydrophobicContact CG-CD1 4.1Å; L192-L196 WeakPolarHBondContact O-CB 3.19Å; L192-L196 VanDerWaalsContact O-CG 3.31Å; L192-L196 WeakPolarHBondContact O-CG 3.46Å; L192-L196 PolarHBondContact O-N 3.19Å
193L95.4Very high90Very high102 Ų10278 Ų7853%0.53440%0.401SS..Hα-helixtrans-60.5-45.5178.7-72.7173.6000112V189 F190 T195 L196 A197V189-L193 HydrophobicContact CG1-CD1 3.89Å; V189-L193 HydrophobicContact CG1-CG 4.34Å; V189-L193 WeakPolarHBondContact O-CB 3.47Å; V189-L193 VanDerWaalsContact O-CG 3.27Å; V189-L193 WeakPolarHBondContact O-CG 3.48Å; V189-L193 PolarHBondContact O-N 3.36Å; F190-L193 PolarHBondContact O-N 3.21Å; L193-T195 VanDerWaalsContact C-N 3.33Å; L193-T195 PolarHBondContact O-N 2.85Å; L193-L196 PolarHBondContact O-N 3.49Å; L193-A197 WeakPolarHBondContact O-CB 3.29Å; L193-A197 PolarHBondContact O-N 3.47Å
194M91.6Very high88.8Confident65 Ų6581.9 Ų81.932%0.3242%0.421SS..Hα-helixtrans-66.1-36.9178.5-65.2-44-70.400112M111 F190 L192 A197 A198M111-M194 HydrophobicContact CG-CE 3.87Å; M111-M194 HydrophobicContact SD-CB 4.2Å; M111-M194 HydrophobicContact SD-CE 3.17Å; M111-M194 WeakPolarHBondContact SD-CE 3.41Å; M111-M194 HydrophobicContact SD-CG 4.14Å; M111-M194 HydrophobicContact SD-SD 4.47Å; F190-M194 HydrophobicContact CD1-CG 4.26Å; F190-M194 HydrophobicContact CD2-CG 4.16Å; F190-M194 HydrophobicContact CE1-CG 3.88Å; F190-M194 HydrophobicContact CE2-CG 3.77Å; F190-M194 HydrophobicContact CE2-SD 3.97Å; F190-M194 HydrophobicContact CG-CG 4.4Å; F190-M194 HydrophobicContact CZ-CG 3.62Å; F190-M194 HydrophobicContact CZ-SD 4.21Å; F190-M194 VanDerWaalsContact O-CG 3.31Å; F190-M194 WeakPolarHBondContact O-CG 3.28Å; F190-M194 PolarHBondContact O-N 3.45Å; L192-M194 PolarHBondContact O-N 3.39Å; M194-A197 PolarHBondContact O-N 2.94Å; M194-A198 VanDerWaalsContact O-CB 3.31Å; M194-A198 WeakPolarHBondContact O-CB 3.42Å; M194-A198 PolarHBondContact O-N 3.36Å
195T89.3Confident87.2Confident92 Ų9280.6 Ų80.656%0.56441%0.412SS*.Hα-helixtrans-67.8-43.9176.6-56.90000111.2L191 L192 L193 A198 F199L191-T195 VanDerWaalsContact O-CB 3.31Å; L191-T195 WeakPolarHBondContact O-CB 3.47Å; L191-T195 PolarHBondContact O-N 3.16Å; L191-T195 PolarHBondContact O-OG1 3.41Å; L192-T195 PolarHBondContact O-N 2.95Å; L193-T195 VanDerWaalsContact C-N 3.33Å; L193-T195 PolarHBondContact O-N 2.85Å; T195-A198 PolarHBondContact O-N 3.48Å; T195-F199 WeakPolarHBondContact O-CB 3.33Å; T195-F199 PolarHBondContact O-N 2.93Å
196L92.4Very high85.6Confident92 Ų9280.9 Ų80.948%0.48241%0.409SS..Hα-helixtrans-61.6-45.7174.3-72.5172000111.2L192 L193 A198 F199 M200L192-L196 HydrophobicContact CG-CD1 4.1Å; L192-L196 WeakPolarHBondContact O-CB 3.19Å; L192-L196 VanDerWaalsContact O-CG 3.31Å; L192-L196 WeakPolarHBondContact O-CG 3.46Å; L192-L196 PolarHBondContact O-N 3.19Å; L193-L196 PolarHBondContact O-N 3.49Å; L196-A198 VanDerWaalsContact C-N 3.33Å; L196-A198 PolarHBondContact O-N 3.45Å; L196-F199 WeakPolarHBondContact O-CB 3.33Å; L196-F199 PolarHBondContact O-N 3.34Å; L196-M200 VanDerWaalsContact O-CG 3.28Å; L196-M200 WeakPolarHBondContact O-CG 3.19Å; L196-M200 PolarHBondContact O-N 3.01Å
197A87.6Confident84.1Confident43 Ų4380.2 Ų80.236%0.35542%0.418SS..Hα-helixtrans-59.4-44.4175.400000111.5L193 M194 F199 M200 I201L193-A197 WeakPolarHBondContact O-CB 3.29Å; L193-A197 PolarHBondContact O-N 3.47Å; M194-A197 PolarHBondContact O-N 2.94Å; A197-F199 VanDerWaalsContact C-N 3.34Å; A197-F199 PolarHBondContact O-N 3.02Å; A197-M200 PolarHBondContact O-N 2.97Å; A197-I201 WeakPolarHBondContact O-CB 3.41Å; A197-I201 WeakPolarHBondContact O-CD1 3.49Å; A197-I201 WeakPolarHBondContact O-CG1 3.2Å; A197-I201 PolarHBondContact O-N 2.65Å
198A82.7Confident82.3Confident33 Ų3388.3 Ų88.327%0.27345%0.453SS..Hα-helixtrans-63.4-38.6176.500000112.6M194 T195 L196 R202M194-A198 VanDerWaalsContact O-CB 3.31Å; M194-A198 WeakPolarHBondContact O-CB 3.42Å; M194-A198 PolarHBondContact O-N 3.36Å; T195-A198 PolarHBondContact O-N 3.48Å; L196-A198 VanDerWaalsContact C-N 3.33Å; L196-A198 PolarHBondContact O-N 3.45Å; A198-R202 WeakPolarHBondContact O-CB 3.31Å; A198-R202 WeakPolarHBondContact O-CG 3.32Å; A198-R202 PolarHBondContact O-N 3.27Å
199F85.3Confident80.4Confident134 Ų13482.2 Ų82.259%0.58844%0.435SS*.Hα-helixtrans-64.7-50.1174175.7-99.6000111.2T195 L196 A197 I201 R202 A203T195-F199 WeakPolarHBondContact O-CB 3.33Å; T195-F199 PolarHBondContact O-N 2.93Å; L196-F199 WeakPolarHBondContact O-CB 3.33Å; L196-F199 PolarHBondContact O-N 3.34Å; A197-F199 VanDerWaalsContact C-N 3.34Å; A197-F199 PolarHBondContact O-N 3.02Å; F199-I201 VanDerWaalsContact C-N 3.33Å; F199-I201 PolarHBondContact O-N 3.04Å; F199-R202 CarbonylContact O-C 3.52Å; F199-R202 PolarHBondContact O-N 3.19Å; F199-R202 VanDerWaalsContact O-N 3.07Å; F199-A203 HydrophobicContact CE1-CB 4.46Å; F199-A203 WeakPolarHBondContact O-CB 3.44Å; F199-A203 PolarHBondContact O-N 3.33Å
200M80.4Confident78.1Confident97 Ų9785.5 Ų85.548%0.47845%0.445SS..Hα-helixtrans-59-44.6177.7-68.1-57.5-64.800111.3L196 A197 R202 A203 I204L196-M200 VanDerWaalsContact O-CG 3.28Å; L196-M200 WeakPolarHBondContact O-CG 3.19Å; L196-M200 PolarHBondContact O-N 3.01Å; A197-M200 PolarHBondContact O-N 2.97Å; M200-R202 VanDerWaalsContact C-N 3.31Å; M200-R202 PolarHBondContact O-N 3.35Å; M200-A203 PolarHBondContact O-N 3.48Å; M200-I204 HydrophobicContact CB-CD1 4.4Å; M200-I204 HydrophobicContact CE-CD1 3.8Å; M200-I204 HydrophobicContact CE-CG1 4.37Å; M200-I204 WeakPolarHBondContact O-CB 3.39Å; M200-I204 VanDerWaalsContact O-CG1 3.23Å; M200-I204 WeakPolarHBondContact O-CG1 3.25Å; M200-I204 PolarHBondContact O-N 3.49Å
201I74.4Confident76.1Confident75 Ų7587 Ų8739%0.38547%0.465SS..Hα-helixtrans-58.7-44.2174.9-72.1165.4000110.8Q104 A197 F199 R205Q104-I201 VanDerWaalsContact NE2-CG2 3.31Å; A197-I201 WeakPolarHBondContact O-CB 3.41Å; A197-I201 WeakPolarHBondContact O-CD1 3.49Å; A197-I201 WeakPolarHBondContact O-CG1 3.2Å; A197-I201 PolarHBondContact O-N 2.65Å; F199-I201 VanDerWaalsContact C-N 3.33Å; F199-I201 PolarHBondContact O-N 3.04Å; I201-R205 WeakPolarHBondContact O-CB 3.43Å; I201-R205 PolarHBondContact O-N 3.23Å; I201-R205 VanDerWaalsContact O-N 3.14Å
202R72.4Confident74.2Confident150 Ų15086.1 Ų86.157%0.56647%0.467SS*.Hα-helixtrans-71.1-32.6179.2-79.5-175.5166.486.7-3.8113.3A198 F199 M200 P206A198-R202 WeakPolarHBondContact O-CB 3.31Å; A198-R202 WeakPolarHBondContact O-CG 3.32Å; A198-R202 PolarHBondContact O-N 3.27Å; F199-R202 CarbonylContact O-C 3.52Å; F199-R202 PolarHBondContact O-N 3.19Å; F199-R202 VanDerWaalsContact O-N 3.07Å; M200-R202 VanDerWaalsContact C-N 3.31Å; M200-R202 PolarHBondContact O-N 3.35Å; R202-P206 WeakPolarHBondContact O-CD 3.48Å; R202-P206 WeakPolarHBondContact O-CG 3.42Å
203A74.3Confident72Confident41 Ų4185.4 Ų85.434%0.33946%0.459SS..Hα-helixtrans-79-42.7179.800000112.2F199 M200 P206 C207F199-A203 HydrophobicContact CE1-CB 4.46Å; F199-A203 WeakPolarHBondContact O-CB 3.44Å; F199-A203 PolarHBondContact O-N 3.33Å; M200-A203 PolarHBondContact O-N 3.48Å; A203-P206 WeakPolarHBondContact O-CD 3.34Å; A203-C207 PolarHBondContact O-SG 3.14Å
204I71.3Confident70.1Confident80 Ų8086.3 Ų86.341%0.4146%0.464SS..Hα-helixtrans-72.9-36.8-179.1-69.7174.5000111.4M200 C207 F208M200-I204 HydrophobicContact CB-CD1 4.4Å; M200-I204 HydrophobicContact CE-CD1 3.8Å; M200-I204 HydrophobicContact CE-CG1 4.37Å; M200-I204 WeakPolarHBondContact O-CB 3.39Å; M200-I204 VanDerWaalsContact O-CG1 3.23Å; M200-I204 WeakPolarHBondContact O-CG1 3.25Å; M200-I204 PolarHBondContact O-N 3.49Å; I204-C207 PolarHBondContact O-N 2.84Å; I204-C207 VanDerWaalsContact O-N 3.08Å; I204-F208 HydrophobicContact CG2-CD2 3.51Å; I204-F208 HydrophobicContact CG2-CE2 3.71Å; I204-F208 WeakPolarHBondContact O-CD2 3.38Å; I204-F208 PolarHBondContact O-N 3.08Å
205R62.7Low68.2Low59 Ų5989 Ų8922%0.22347%0.474CS..Hα-helixtrans-56.3-49.4-175.2-179.3-176.8-163.3143.1-1.1112.4Y97 I201 C207 T209Y97-R205 PolarHBondContact OH-NH2 2.88Å; I201-R205 WeakPolarHBondContact O-CB 3.43Å; I201-R205 PolarHBondContact O-N 3.23Å; I201-R205 VanDerWaalsContact O-N 3.14Å; R205-C207 PolarHBondContact O-N 2.93Å; R205-T209 PolarHBondContact O-N 3Å; R205-T209 PolarHBondContact O-OG1 2.91Å
206P62.3Low66.4Low59 Ų5986 Ų8638%0.38346%0.456SS..Hα-helixtrans-60-39.3172.9-24.533.7000114.2R202 A203 F208R202-P206 WeakPolarHBondContact O-CD 3.48Å; R202-P206 WeakPolarHBondContact O-CG 3.42Å; A203-P206 WeakPolarHBondContact O-CD 3.34Å; P206-F208 VanDerWaalsContact C-N 3.35Å; P206-F208 PolarHBondContact O-N 3.39Å
207C65.3Low64.6Low100 Ų10089.2 Ų89.268%0.67647%0.466SS*.Hα-helixtrans-65.4-32.1-174.7-63.30000114A203 I204 R205A203-C207 PolarHBondContact O-SG 3.14Å; I204-C207 PolarHBondContact O-N 2.84Å; I204-C207 VanDerWaalsContact O-N 3.08Å; R205-C207 PolarHBondContact O-N 2.93Å
208F58.3Low62.8Low170 Ų17094.8 Ų94.875%0.74648%0.479SS*.Hα-helixtrans-104.1-15.8-178.4-69.2-79.8000114.1I204 P206I204-F208 HydrophobicContact CG2-CD2 3.51Å; I204-F208 HydrophobicContact CG2-CE2 3.71Å; I204-F208 WeakPolarHBondContact O-CD2 3.38Å; I204-F208 PolarHBondContact O-N 3.08Å; P206-F208 VanDerWaalsContact C-N 3.35Å; P206-F208 PolarHBondContact O-N 3.39Å
209T56.9Low61.3Low44 Ų4495.9 Ų95.927%0.2748%0.476SS..  trans-130.337.1-169.363.90000113.7R205 A211 A212 F213R205-T209 PolarHBondContact O-N 3Å; R205-T209 PolarHBondContact O-OG1 2.91Å; T209-A211 PolarHBondContact O-N 3.35Å; T209-A212 CarbonylContact O-C 3.53Å; T209-A212 PolarHBondContact O-N 3.33Å; T209-F213 WeakPolarHBondContact O-CB 3.39Å; T209-F213 PolarHBondContact O-N 3.31Å
210Q50.7Low59.6Low149 Ų14992.8 Ų92.870%0.69647%0.471SS*.Hα-helixtrans-60.3-43.5-175.2-157.1163-48.100113.7L214Q210-L214 WeakPolarHBondContact O-CD1 3.43Å; Q210-L214 PolarHBondContact O-N 3Å
211A54.3Low58.2Low74 Ų7494.3 Ų94.361%0.61248%0.477SS*.Hα-helixtrans-73.3-36.6174.700000112.8T209 F213 K215T209-A211 PolarHBondContact O-N 3.35Å; A211-F213 VanDerWaalsContact C-N 3.35Å; A211-K215 WeakPolarHBondContact O-CB 3.43Å; A211-K215 WeakPolarHBondContact O-CG 3.5Å; A211-K215 PolarHBondContact O-N 2.91Å; A211-K215 VanDerWaalsContact O-N 3.14Å
212A54.7Low56.9Low40 Ų4095 Ų9533%0.33148%0.475SS..Hα-helixtrans-71.5-28.8176.200000111.9T209 K215 T216T209-A212 CarbonylContact O-C 3.53Å; T209-A212 PolarHBondContact O-N 3.33Å; A212-K215 CarbonylContact O-C 3.54Å; A212-K215 PolarHBondContact O-N 3.2Å; A212-T216 WeakPolarHBondContact O-CB 3.43Å; A212-T216 PolarHBondContact O-N 3.34Å; A212-T216 PolarHBondContact O-OG1 3.41Å
213F50.5Low55.8Low94 Ų9488.7 Ų88.741%0.41245%0.453SS..Hα-helixtrans-69.7-43.3178.4-178.6-98.7000112T209 A211 T216 K217T209-F213 WeakPolarHBondContact O-CB 3.39Å; T209-F213 PolarHBondContact O-N 3.31Å; A211-F213 VanDerWaalsContact C-N 3.35Å; F213-T216 PolarHBondContact O-N 2.95Å; F213-K217 WeakPolarHBondContact O-CB 3.49Å; F213-K217 PolarHBondContact O-N 3.43Å
214L54.1Low54.6Low122 Ų12290.8 Ų90.864%0.63946%0.459SS*.Hα-helixtrans-63.1-44.6170.1-85.7104.2000111.1Q210 T216 K217 Y218Q210-L214 WeakPolarHBondContact O-CD1 3.43Å; Q210-L214 PolarHBondContact O-N 3Å; L214-T216 VanDerWaalsContact C-N 3.3Å; L214-T216 PolarHBondContact O-N 3.41Å; L214-K217 PolarHBondContact O-N 3.4Å; L214-Y218 VanDerWaalsContact O-CB 3.31Å; L214-Y218 WeakPolarHBondContact O-CB 3.3Å; L214-Y218 PolarHBondContact O-N 3.4Å
215K52.2Low54Low120 Ų12091 Ų9152%0.52246%0.459SS..Hα-helixtrans-61.2-36.3175.2-73.9-176.5177-1740111.8A211 A212 W219 V359A211-K215 WeakPolarHBondContact O-CB 3.43Å; A211-K215 WeakPolarHBondContact O-CG 3.5Å; A211-K215 PolarHBondContact O-N 2.91Å; A211-K215 VanDerWaalsContact O-N 3.14Å; A212-K215 CarbonylContact O-C 3.54Å; A212-K215 PolarHBondContact O-N 3.2Å; K215-W219 WeakPolarHBondContact O-CB 3.45Å; K215-W219 PolarHBondContact O-N 3.28Å; K215-V359 PolarHBondContact NZ-O 3.41Å; K215-V359 PolarHBondContact NZ-OXT 3.33Å; K215-V359 VanDerWaalsContact NZ-OXT 3.09Å
216T52.2Low53.2Low31 Ų3192.5 Ų92.519%0.1947%0.469CS..Hα-helixtrans-76.8-37.1177.1-46.90000112.7Y97 A212 F213 L214 Y218 W219 S220Y97-T216 HydrophobicContact CD1-CG2 3.78Å; Y97-T216 HydrophobicContact CE1-CG2 3.06Å; Y97-T216 HydrophobicContact CE2-CG2 4.48Å; Y97-T216 VanDerWaalsContact CZ-CG2 3.43Å; Y97-T216 WeakPolarHBondContact OH-CG2 3.31Å; A212-T216 WeakPolarHBondContact O-CB 3.43Å; A212-T216 PolarHBondContact O-N 3.34Å; A212-T216 PolarHBondContact O-OG1 3.41Å; F213-T216 PolarHBondContact O-N 2.95Å; L214-T216 VanDerWaalsContact C-N 3.3Å; L214-T216 PolarHBondContact O-N 3.41Å; T216-Y218 VanDerWaalsContact C-N 3.33Å; T216-W219 PolarHBondContact O-N 3.33Å; T216-S220 VanDerWaalsContact O-CB 3.3Å; T216-S220 WeakPolarHBondContact O-CB 3.41Å; T216-S220 PolarHBondContact O-N 2.93Å
217K54Low52.5Low158 Ų15894.2 Ų94.269%0.68747%0.468SS*.Hα-helixtrans-63.6-43.6174-170.5174.9-178.41770110.3F213 L214 H221F213-K217 WeakPolarHBondContact O-CB 3.49Å; F213-K217 PolarHBondContact O-N 3.43Å; L214-K217 PolarHBondContact O-N 3.4Å; K217-H221 WeakPolarHBondContact O-CB 3.31Å; K217-H221 PolarHBondContact O-N 3.48Å; K217-H221 VanDerWaalsContact O-N 3.1Å
218Y50.8Low52.2Low160 Ų16096 Ų9663%0.62746%0.464SS*.Hα-helixtrans-61.4-47171177.8-96.6000111.7L214 T216 S220 H221 Y222L214-Y218 VanDerWaalsContact O-CB 3.31Å; L214-Y218 WeakPolarHBondContact O-CB 3.3Å; L214-Y218 PolarHBondContact O-N 3.4Å; T216-Y218 VanDerWaalsContact C-N 3.33Å; Y218-S220 PolarHBondContact O-N 2.84Å; Y218-H221 PolarHBondContact O-N 3.12Å; Y218-Y222 WeakPolarHBondContact O-CB 3.22Å; Y218-Y222 PolarHBondContact O-N 3.38Å
219W51.4Low51.9Low56 Ų5692.8 Ų92.821%0.21245%0.454CS..Hα-helixtrans-65.2-39.3-179.2-169.8-105.8000112.9K90 K215 T216 Y222 V223K90-W219 HydrophobicContact CD-CZ2 4.39Å; K215-W219 WeakPolarHBondContact O-CB 3.45Å; K215-W219 PolarHBondContact O-N 3.28Å; T216-W219 PolarHBondContact O-N 3.33Å; W219-Y222 AromaticContact CE3-CD1 3.88Å; W219-Y222 HydrophobicContact CE3-CD1 3.88Å; W219-Y222 HydrophobicContact CE3-CE1 4.46Å; W219-Y222 AromaticContact CH2-CD1 3.8Å; W219-Y222 HydrophobicContact CH2-CD1 3.8Å; W219-Y222 AromaticContact CH2-CE1 3.67Å; W219-Y222 HydrophobicContact CH2-CE1 3.67Å; W219-Y222 HydrophobicContact CZ2-CD1 4.5Å; W219-Y222 AromaticContact CZ3-CD1 3.5Å; W219-Y222 HydrophobicContact CZ3-CD1 3.5Å; W219-Y222 AromaticContact CZ3-CE1 3.63Å; W219-Y222 HydrophobicContact CZ3-CE1 3.63Å; W219-Y222 HydrophobicContact CZ3-CG 4.45Å; W219-Y222 PolarHBondContact O-N 3.03Å; W219-V223 HydrophobicContact CD2-CG2 4.24Å; W219-V223 HydrophobicContact CG-CG2 4.44Å; W219-V223 HydrophobicContact CZ2-CG2 3.82Å; W219-V223 WeakPolarHBondContact O-CB 3.36Å; W219-V223 VanDerWaalsContact O-CG2 3.26Å; W219-V223 WeakPolarHBondContact O-CG2 3.31Å; W219-V223 PolarHBondContact O-N 3.16Å
220S48.8Very low51.4Low70 Ų7097.4 Ų97.449%0.4947%0.471SS..Hα-helixtrans-64.7-44.3175.4-168.70000111T216 Y218 D224T216-S220 VanDerWaalsContact O-CB 3.3Å; T216-S220 WeakPolarHBondContact O-CB 3.41Å; T216-S220 PolarHBondContact O-N 2.93Å; Y218-S220 PolarHBondContact O-N 2.84Å; S220-D224 PolarHBondContact O-N 3.41Å
221H50.3Low51.4Low129 Ų12994 Ų9460%0.59746%0.458SS*.Hα-helixtrans-67.3-40.1176.1-168.4-79.9000111.5K217 Y218 I225K217-H221 WeakPolarHBondContact O-CB 3.31Å; K217-H221 PolarHBondContact O-N 3.48Å; K217-H221 VanDerWaalsContact O-N 3.1Å; Y218-H221 PolarHBondContact O-N 3.12Å; H221-I225 WeakPolarHBondContact O-CB 3.16Å; H221-I225 WeakPolarHBondContact O-CG1 3.38Å; H221-I225 PolarHBondContact O-N 3.41Å
222Y47.7Very low52Low90 Ų9096.4 Ų96.435%0.35346%0.456SS..Hα-helixtrans-62.7-48.1177.4173.4-96.4000111.7Y218 W219 D224 I225 E226Y218-Y222 WeakPolarHBondContact O-CB 3.22Å; Y218-Y222 PolarHBondContact O-N 3.38Å; W219-Y222 AromaticContact CE3-CD1 3.88Å; W219-Y222 HydrophobicContact CE3-CD1 3.88Å; W219-Y222 HydrophobicContact CE3-CE1 4.46Å; W219-Y222 AromaticContact CH2-CD1 3.8Å; W219-Y222 HydrophobicContact CH2-CD1 3.8Å; W219-Y222 AromaticContact CH2-CE1 3.67Å; W219-Y222 HydrophobicContact CH2-CE1 3.67Å; W219-Y222 HydrophobicContact CZ2-CD1 4.5Å; W219-Y222 AromaticContact CZ3-CD1 3.5Å; W219-Y222 HydrophobicContact CZ3-CD1 3.5Å; W219-Y222 AromaticContact CZ3-CE1 3.63Å; W219-Y222 HydrophobicContact CZ3-CE1 3.63Å; W219-Y222 HydrophobicContact CZ3-CG 4.45Å; W219-Y222 PolarHBondContact O-N 3.03Å; Y222-D224 VanDerWaalsContact C-N 3.34Å; Y222-D224 PolarHBondContact O-N 2.63Å; Y222-I225 PolarHBondContact O-N 2.98Å; Y222-E226 HydrophobicContact CE1-CB 4.41Å; Y222-E226 VanDerWaalsContact CE1-OE2 3.3Å; Y222-E226 WeakPolarHBondContact CE1-OE2 3.48Å; Y222-E226 VanDerWaalsContact O-CB 3.22Å; Y222-E226 WeakPolarHBondContact O-CB 3.29Å; Y222-E226 PolarHBondContact O-N 3.49Å
223V49.5Very low52.1Low16 Ų1697.4 Ų97.410%0.09746%0.458CS..Hα-helixtrans-64.7-37.9-179.6168.60000111.8W219 R227W219-V223 HydrophobicContact CD2-CG2 4.24Å; W219-V223 HydrophobicContact CG-CG2 4.44Å; W219-V223 HydrophobicContact CZ2-CG2 3.82Å; W219-V223 WeakPolarHBondContact O-CB 3.36Å; W219-V223 VanDerWaalsContact O-CG2 3.26Å; W219-V223 WeakPolarHBondContact O-CG2 3.31Å; W219-V223 PolarHBondContact O-N 3.16Å; V223-R227 WeakPolarHBondContact O-CB 3.5Å; V223-R227 WeakPolarHBondContact O-CG 3.49Å; V223-R227 PolarHBondContact O-N 2.96Å
224D49.5Very low52.1Low86 Ų8695.5 Ų95.546%0.4646%0.456SS..Hα-helixtrans-67.8-38.7175.7-81.8-9000111.8S220 Y222 K228S220-D224 PolarHBondContact O-N 3.41Å; Y222-D224 VanDerWaalsContact C-N 3.34Å; Y222-D224 PolarHBondContact O-N 2.63Å; D224-K228 WeakPolarHBondContact O-CG 3.47Å; D224-K228 PolarHBondContact O-N 3.44Å
225I57.1Low52.7Low83 Ų8395.7 Ų95.743%0.42645%0.452SS..Hα-helixtrans-69.1-43.8174.4-68-69.4000111.2H221 Y222 R227 K228 L229H221-I225 WeakPolarHBondContact O-CB 3.16Å; H221-I225 WeakPolarHBondContact O-CG1 3.38Å; H221-I225 PolarHBondContact O-N 3.41Å; Y222-I225 PolarHBondContact O-N 2.98Å; I225-R227 PolarHBondContact O-N 3.5Å; I225-K228 PolarHBondContact O-N 3.45Å; I225-L229 VanDerWaalsContact O-CB 3.3Å; I225-L229 WeakPolarHBondContact O-CB 3.41Å; I225-L229 PolarHBondContact O-N 2.84Å
226E46.1Very low53.7Low92 Ų9296.5 Ų96.543%0.4346%0.457SS..Hα-helixtrans-58.9-45.8178.2-178-177.2-163.800110.7Y222 L229 F230Y222-E226 HydrophobicContact CE1-CB 4.41Å; Y222-E226 VanDerWaalsContact CE1-OE2 3.3Å; Y222-E226 WeakPolarHBondContact CE1-OE2 3.48Å; Y222-E226 VanDerWaalsContact O-CB 3.22Å; Y222-E226 WeakPolarHBondContact O-CB 3.29Å; Y222-E226 PolarHBondContact O-N 3.49Å; E226-L229 PolarHBondContact O-N 3.16Å; E226-F230 WeakPolarHBondContact O-CB 3.42Å; E226-F230 PolarHBondContact O-N 2.94Å
227R47.4Very low54.2Low95 Ų95101.4 Ų101.436%0.35848%0.478SS..Hα-helixtrans-63.7-42.7176.5-79-179175.9158.32.1113.1N73 V223 I225 D231N73-R227 PolarHBondContact OD1-NH1 3.34Å; N73-R227 PolarHBondContact OD1-NH2 3.04Å; V223-R227 WeakPolarHBondContact O-CB 3.5Å; V223-R227 WeakPolarHBondContact O-CG 3.49Å; V223-R227 PolarHBondContact O-N 2.96Å; I225-R227 PolarHBondContact O-N 3.5Å; R227-D231 WeakPolarHBondContact O-CB 3.41Å; R227-D231 PolarHBondContact O-N 3.02Å
228K59.8Low54.8Low137 Ų13796.7 Ų96.760%0.59647%0.468SS*.Hα-helixtrans-62.7-48.9176.5-76.2177.1-178.4178.40110.9D224 I225 F230 D231 E232D224-K228 WeakPolarHBondContact O-CG 3.47Å; D224-K228 PolarHBondContact O-N 3.44Å; I225-K228 PolarHBondContact O-N 3.45Å; K228-F230 VanDerWaalsContact C-N 3.34Å; K228-F230 PolarHBondContact O-N 3.34Å; K228-D231 PolarHBondContact O-N 3.49Å; K228-E232 WeakPolarHBondContact O-CB 3.28Å; K228-E232 WeakPolarHBondContact O-CG 3.38Å; K228-E232 PolarHBondContact O-N 3.31Å
229L52.3Low55.9Low103 Ų10395.5 Ų95.554%0.53947%0.466SS..Hα-helixtrans-65.5-38.5-179-169.766.7000111.7I225 E226 T233I225-L229 VanDerWaalsContact O-CB 3.3Å; I225-L229 WeakPolarHBondContact O-CB 3.41Å; I225-L229 PolarHBondContact O-N 2.84Å; E226-L229 PolarHBondContact O-N 3.16Å; L229-T233 VanDerWaalsContact O-CB 3.25Å; L229-T233 WeakPolarHBondContact O-CB 3.33Å; L229-T233 PolarHBondContact O-N 3.29Å; L229-T233 PolarHBondContact O-OG1 3.11Å
230F46Very low57.1Low141 Ų14196.4 Ų96.462%0.61848%0.478SS*.Hα-helixtrans-63.8-47.3175.5-177.6-96.1000111.7E226 K228 E232 T233 C234E226-F230 WeakPolarHBondContact O-CB 3.42Å; E226-F230 PolarHBondContact O-N 2.94Å; K228-F230 VanDerWaalsContact C-N 3.34Å; K228-F230 PolarHBondContact O-N 3.34Å; F230-E232 PolarHBondContact O-N 3.44Å; F230-T233 PolarHBondContact O-N 2.89Å; F230-C234 WeakPolarHBondContact O-CB 3.18Å; F230-C234 PolarHBondContact O-N 3.44Å; F230-C234 PolarHBondContact O-SG 2.68Å; F230-C234 VanDerWaalsContact O-SG 3.37Å
231D50Low57.8Low78 Ų7897.3 Ų97.342%0.41747%0.474SS..Hα-helixtrans-63.8-41.3178.3-172.356.8000111.9R227 K228 C234 K235R227-D231 WeakPolarHBondContact O-CB 3.41Å; R227-D231 PolarHBondContact O-N 3.02Å; K228-D231 PolarHBondContact O-N 3.49Å; D231-C234 PolarHBondContact O-N 2.89Å; D231-K235 WeakPolarHBondContact O-CB 3.46Å; D231-K235 VanDerWaalsContact O-CG 3.27Å; D231-K235 WeakPolarHBondContact O-CG 3.35Å; D231-K235 PolarHBondContact O-N 3.41Å; D231-K235 VanDerWaalsContact OD2-CE 3.23Å; D231-K235 WeakPolarHBondContact OD2-CE 3.11Å; D231-K235 IonicContact OD2-NZ 2.85Å; D231-K235 PolarHBondContact OD2-NZ 3.15Å
232E68.3Low58.9Low124 Ų12493.1 Ų93.158%0.57946%0.461SS*.Hα-helixtrans-62.9-46.2174.5-74.9-179166.900112.1K228 F230 C234 K235 E236K228-E232 WeakPolarHBondContact O-CB 3.28Å; K228-E232 WeakPolarHBondContact O-CG 3.38Å; K228-E232 PolarHBondContact O-N 3.31Å; F230-E232 PolarHBondContact O-N 3.44Å; E232-C234 PolarHBondContact O-N 3.29Å; E232-K235 PolarHBondContact O-N 3.02Å; E232-E236 WeakPolarHBondContact O-CB 3.1Å; E232-E236 PolarHBondContact O-N 3.31Å
233T55.6Low60.2Low60 Ų6095 Ų9537%0.36847%0.471SS..Hα-helixtrans-64.3-42.2178.4-57.10000111.2L229 F230 E236 H237L229-T233 VanDerWaalsContact O-CB 3.25Å; L229-T233 WeakPolarHBondContact O-CB 3.33Å; L229-T233 PolarHBondContact O-N 3.29Å; L229-T233 PolarHBondContact O-OG1 3.11Å; F230-T233 PolarHBondContact O-N 2.89Å; T233-E236 PolarHBondContact O-N 3.26Å; T233-H237 WeakPolarHBondContact O-CB 3.26Å; T233-H237 PolarHBondContact O-CD2 3.04Å; T233-H237 VanDerWaalsContact O-CD2 3.23Å; T233-H237 PolarHBondContact O-N 3.49Å
234C50.7Low61.3Low55 Ų5598 Ų9837%0.37249%0.49SS..Hα-helixtrans-63.3-41.7174.5-77.20000112.1F230 D231 E232 A238F230-C234 WeakPolarHBondContact O-CB 3.18Å; F230-C234 PolarHBondContact O-N 3.44Å; F230-C234 PolarHBondContact O-SG 2.68Å; F230-C234 VanDerWaalsContact O-SG 3.37Å; D231-C234 PolarHBondContact O-N 2.89Å; E232-C234 PolarHBondContact O-N 3.29Å; C234-A238 WeakPolarHBondContact O-CB 3.41Å; C234-A238 PolarHBondContact O-N 3.16Å
235K66.8Low62.2Low126 Ų12695.2 Ų95.255%0.54848%0.476SS..Hα-helixtrans-63.1-41.8175.2-79.7168.9176.9163.50111.9D231 E232 A238 K239D231-K235 WeakPolarHBondContact O-CB 3.46Å; D231-K235 VanDerWaalsContact O-CG 3.27Å; D231-K235 WeakPolarHBondContact O-CG 3.35Å; D231-K235 PolarHBondContact O-N 3.41Å; D231-K235 VanDerWaalsContact OD2-CE 3.23Å; D231-K235 WeakPolarHBondContact OD2-CE 3.11Å; D231-K235 IonicContact OD2-NZ 2.85Å; D231-K235 PolarHBondContact OD2-NZ 3.15Å; E232-K235 PolarHBondContact O-N 3.02Å; K235-A238 PolarHBondContact O-N 2.88Å; K235-K239 VanDerWaalsContact O-CB 3.22Å; K235-K239 WeakPolarHBondContact O-CB 3.46Å; K235-K239 PolarHBondContact O-N 3.48Å
236E74.3Confident63Low136 Ų13694.7 Ų94.764%0.63647%0.473SS*.Hα-helixtrans-67.2-43.9178.5-173.3168.3-160.200112E232 T233 K239 T240E232-E236 WeakPolarHBondContact O-CB 3.1Å; E232-E236 PolarHBondContact O-N 3.31Å; T233-E236 PolarHBondContact O-N 3.26Å; E236-K239 PolarHBondContact O-N 3.39Å; E236-T240 WeakPolarHBondContact O-CB 3.28Å; E236-T240 PolarHBondContact O-N 3.29Å; E236-T240 PolarHBondContact O-OG1 3.09Å
237H62.4Low64.4Low134 Ų13495.7 Ų95.762%0.6248%0.478SS*.Hα-helixtrans-61.6-45.3172.6-82.8-63.3000112T233 K239 T240 F241T233-H237 WeakPolarHBondContact O-CB 3.26Å; T233-H237 PolarHBondContact O-CD2 3.04Å; T233-H237 VanDerWaalsContact O-CD2 3.23Å; T233-H237 PolarHBondContact O-N 3.49Å; H237-K239 VanDerWaalsContact C-N 3.33Å; H237-K239 PolarHBondContact O-N 3.19Å; H237-T240 PolarHBondContact O-N 3.43Å; H237-F241 WeakPolarHBondContact O-CB 3.46Å; H237-F241 PolarHBondContact O-N 3.37Å
238A66.3Low65.4Low59 Ų5997.5 Ų97.549%0.48849%0.491SS..Hα-helixtrans-62.6-39.717700000111.8C234 K235 A242C234-A238 WeakPolarHBondContact O-CB 3.41Å; C234-A238 PolarHBondContact O-N 3.16Å; K235-A238 PolarHBondContact O-N 2.88Å; A238-A242 WeakPolarHBondContact O-CB 3.44Å; A238-A242 PolarHBondContact O-N 2.9Å
239K74.1Confident66.1Low136 Ų13692.9 Ų92.959%0.59147%0.47SS*.Hα-helixtrans-66.7-41.3176.5-172.5177.6-175.3178.40111.8K235 E236 H237 A242 K243K235-K239 VanDerWaalsContact O-CB 3.22Å; K235-K239 WeakPolarHBondContact O-CB 3.46Å; K235-K239 PolarHBondContact O-N 3.48Å; E236-K239 PolarHBondContact O-N 3.39Å; H237-K239 VanDerWaalsContact C-N 3.33Å; H237-K239 PolarHBondContact O-N 3.19Å; K239-A242 PolarHBondContact O-N 3.44Å; K239-K243 WeakPolarHBondContact O-CB 3.27Å; K239-K243 VanDerWaalsContact O-CG 3.31Å; K239-K243 WeakPolarHBondContact O-CG 3.28Å; K239-K243 PolarHBondContact O-N 3.03Å
240T76.8Confident67.1Low75 Ų7590.5 Ų90.546%0.4646%0.455SS..Hα-helixtrans-67.4-44.7177.8-55.80000110.8E236 H237 K243 V244E236-T240 WeakPolarHBondContact O-CB 3.28Å; E236-T240 PolarHBondContact O-N 3.29Å; E236-T240 PolarHBondContact O-OG1 3.09Å; H237-T240 PolarHBondContact O-N 3.43Å; T240-K243 WeakPolarHBondContact O-CB 3.32Å; T240-K243 PolarHBondContact O-N 3.13Å; T240-V244 WeakPolarHBondContact O-CG2 3.26Å; T240-V244 PolarHBondContact O-N 3.47Å; T240-V244 VanDerWaalsContact O-N 3.09Å
241F63.6Low68.3Low89 Ų8988.7 Ų88.739%0.3945%0.448SS..Hα-helixtrans-61.7-46174.3-174.8-98.4000111.6H237 K243 V244 C245 L308H237-F241 WeakPolarHBondContact O-CB 3.46Å; H237-F241 PolarHBondContact O-N 3.37Å; F241-K243 VanDerWaalsContact C-N 3.33Å; F241-K243 PolarHBondContact O-N 2.98Å; F241-V244 PolarHBondContact O-N 3.01Å; F241-V244 VanDerWaalsContact O-N 3.16Å; F241-C245 WeakPolarHBondContact CE1-SG 3.48Å; F241-C245 PolarHBondContact O-N 3.47Å; F241-C245 PolarHBondContact O-SG 3.07Å; F241-C245 VanDerWaalsContact O-SG 3.36Å; F241-L308 HydrophobicContact CE1-CD2 4.21Å
242A73.1Confident69.1Low41 Ų4188.4 Ų88.434%0.33945%0.453SS..Hα-helixtrans-60-41.5176.200000112A238 K239 V244 C245 I246A238-A242 WeakPolarHBondContact O-CB 3.44Å; A238-A242 PolarHBondContact O-N 2.9Å; K239-A242 PolarHBondContact O-N 3.44Å; A242-V244 VanDerWaalsContact C-N 3.34Å; A242-V244 PolarHBondContact O-N 3.07Å; A242-C245 PolarHBondContact O-N 3.05Å; A242-I246 VanDerWaalsContact O-CB 3.24Å; A242-I246 WeakPolarHBondContact O-CB 3.33Å; A242-I246 WeakPolarHBondContact O-CD1 3.42Å; A242-I246 WeakPolarHBondContact O-CG1 3.47Å; A242-I246 PolarHBondContact O-N 2.94Å
243K73.9Confident68.9Low129 Ų12983.9 Ų83.956%0.56143%0.432SS*.Hα-helixtrans-59.1-44.4174.5-78.8176.6177.6-174.90112K239 T240 F241 I246 Q247K239-K243 WeakPolarHBondContact O-CB 3.27Å; K239-K243 VanDerWaalsContact O-CG 3.31Å; K239-K243 WeakPolarHBondContact O-CG 3.28Å; K239-K243 PolarHBondContact O-N 3.03Å; T240-K243 WeakPolarHBondContact O-CB 3.32Å; T240-K243 PolarHBondContact O-N 3.13Å; F241-K243 VanDerWaalsContact C-N 3.33Å; F241-K243 PolarHBondContact O-N 2.98Å; K243-I246 PolarHBondContact O-N 3.37Å; K243-Q247 VanDerWaalsContact O-CB 3.25Å; K243-Q247 WeakPolarHBondContact O-CB 3.39Å; K243-Q247 PolarHBondContact O-N 2.05Å
244V73.6Confident69.2Low80 Ų8082.4 Ų82.449%0.48542%0.424SS..Hα-helixtrans-65.2-46.71781750000110.9T240 F241 A242 I246 Q247 Q248T240-V244 WeakPolarHBondContact O-CG2 3.26Å; T240-V244 PolarHBondContact O-N 3.47Å; T240-V244 VanDerWaalsContact O-N 3.09Å; F241-V244 PolarHBondContact O-N 3.01Å; F241-V244 VanDerWaalsContact O-N 3.16Å; A242-V244 VanDerWaalsContact C-N 3.34Å; A242-V244 PolarHBondContact O-N 3.07Å; V244-I246 VanDerWaalsContact C-N 3.34Å; V244-I246 PolarHBondContact O-N 3.42Å; V244-Q247 PolarHBondContact O-N 3.02Å; V244-Q248 VanDerWaalsContact O-CB 3.3Å; V244-Q248 WeakPolarHBondContact O-CB 3.31Å; V244-Q248 PolarHBondContact O-N 3.22Å
245C67.9Low69.7Low26 Ų2681.5 Ų81.518%0.17643%0.425CS..Hα-helixtrans-62.5-40.5177.5-650000112.5F241 A242 Y249 W301F241-C245 WeakPolarHBondContact CE1-SG 3.48Å; F241-C245 PolarHBondContact O-N 3.47Å; F241-C245 PolarHBondContact O-SG 3.07Å; F241-C245 VanDerWaalsContact O-SG 3.36Å; A242-C245 PolarHBondContact O-N 3.05Å; C245-Y249 WeakPolarHBondContact O-CB 3.37Å; C245-Y249 PolarHBondContact O-N 2.93Å; C245-W301 HydrophobicContact CB-CH2 4.31Å
246I74.6Confident69.3Low72 Ų7279.9 Ų79.937%0.36942%0.422SS..Hα-helixtrans-65.1-48176.7-72.3167.3000109.7A242 K243 V244 Y249 F250 W301A242-I246 VanDerWaalsContact O-CB 3.24Å; A242-I246 WeakPolarHBondContact O-CB 3.33Å; A242-I246 WeakPolarHBondContact O-CD1 3.42Å; A242-I246 WeakPolarHBondContact O-CG1 3.47Å; A242-I246 PolarHBondContact O-N 2.94Å; K243-I246 PolarHBondContact O-N 3.37Å; V244-I246 VanDerWaalsContact C-N 3.34Å; V244-I246 PolarHBondContact O-N 3.42Å; I246-Y249 PolarHBondContact O-N 3.11Å; I246-F250 HydrophobicContact CG2-CD2 3.61Å; I246-F250 HydrophobicContact CG2-CE2 3.73Å; I246-F250 VanDerWaalsContact O-CD2 3.23Å; I246-F250 WeakPolarHBondContact O-CD2 3.34Å; I246-F250 PolarHBondContact O-N 3.41Å; I246-W301 HydrophobicContact CG1-CH2 4.14Å; I246-W301 HydrophobicContact CG1-CZ2 4.02Å
247Q74.4Confident68.3Low114 Ų11475.4 Ų75.453%0.53340%0.401SS..Hα-helixtrans-62.4-46.1179.9-175.1174.2-11.700111.4K243 V244 Y249 F250 E251K243-Q247 VanDerWaalsContact O-CB 3.25Å; K243-Q247 WeakPolarHBondContact O-CB 3.39Å; K243-Q247 PolarHBondContact O-N 2.05Å; V244-Q247 PolarHBondContact O-N 3.02Å; Q247-Y249 VanDerWaalsContact C-N 3.32Å; Q247-Y249 PolarHBondContact O-N 3.11Å; Q247-F250 PolarHBondContact O-N 2.91Å; Q247-E251 HydrophobicContact CG-CG 4.41Å; Q247-E251 WeakPolarHBondContact CG-OE1 3.44Å; Q247-E251 PolarHBondContact NE2-OE1 3.36Å; Q247-E251 WeakPolarHBondContact O-CB 3.27Å; Q247-E251 WeakPolarHBondContact O-CG 3.41Å; Q247-E251 PolarHBondContact O-N 3.16Å
248Q69Low67.9Low132 Ų13277.9 Ų77.962%0.61741%0.405SS*.Hα-helixtrans-64.3-36.6177.6-166.9174.36.300112.2V244 S252V244-Q248 VanDerWaalsContact O-CB 3.3Å; V244-Q248 WeakPolarHBondContact O-CB 3.31Å; V244-Q248 PolarHBondContact O-N 3.22Å; Q248-S252 WeakPolarHBondContact O-CB 3.45Å; Q248-S252 PolarHBondContact O-N 3.33Å
249Y74.4Confident67.2Low41 Ų4177.9 Ų77.916%0.16140%0.402CS..Hα-helixtrans-64.9-48.3174.2176-102.1000112C245 I246 Q247 S252 I253 V297 W301C245-Y249 WeakPolarHBondContact O-CB 3.37Å; C245-Y249 PolarHBondContact O-N 2.93Å; I246-Y249 PolarHBondContact O-N 3.11Å; Q247-Y249 VanDerWaalsContact C-N 3.32Å; Q247-Y249 PolarHBondContact O-N 3.11Å; Y249-S252 PolarHBondContact O-N 2.9Å; Y249-I253 HydrophobicContact CD1-CD1 4.14Å; Y249-I253 HydrophobicContact CD2-CD1 4.16Å; Y249-I253 HydrophobicContact CE1-CD1 3.51Å; Y249-I253 HydrophobicContact CE2-CD1 3.52Å; Y249-I253 HydrophobicContact CE2-CG1 4.35Å; Y249-I253 HydrophobicContact CG-CD1 4.44Å; Y249-I253 WeakPolarHBondContact O-CB 3.42Å; Y249-I253 WeakPolarHBondContact O-CG1 3.35Å; Y249-I253 PolarHBondContact O-N 3.31Å; Y249-I253 VanDerWaalsContact OH-CD1 3.32Å; Y249-I253 WeakPolarHBondContact OH-CD1 3.34Å; Y249-V297 HydrophobicContact CE1-CG1 3.82Å; Y249-V297 PolarHBondContact OH-O 3.16Å; Y249-W301 HydrophobicContact CD1-CD2 4.48Å; Y249-W301 AromaticContact CD1-CE3 3.68Å; Y249-W301 HydrophobicContact CD1-CE3 3.68Å; Y249-W301 HydrophobicContact CD1-CZ3 4.15Å; Y249-W301 AromaticContact CD2-CE3 3.75Å; Y249-W301 HydrophobicContact CD2-CE3 3.75Å; Y249-W301 HydrophobicContact CD2-CZ3 4.02Å; Y249-W301 HydrophobicContact CE1-CB 3.98Å; Y249-W301 HydrophobicContact CE1-CD2 4.41Å; Y249-W301 AromaticContact CE1-CE3 3.86Å; Y249-W301 HydrophobicContact CE1-CE3 3.86Å; Y249-W301 AromaticContact CE2-CE3 3.93Å; Y249-W301 HydrophobicContact CE2-CE3 3.93Å; Y249-W301 AromaticContact CG-CE3 3.6Å; Y249-W301 HydrophobicContact CG-CE3 3.6Å; Y249-W301 AromaticContact CG-CZ3 3.74Å; Y249-W301 HydrophobicContact CG-CZ3 3.74Å; Y249-W301 AromaticContact CZ-CE3 3.98Å; Y249-W301 PolarHBondContact OH-N 3.19Å
250F72.5Confident66Low53 Ų5378.9 Ų78.923%0.23241%0.406CS..Hα-helixtrans-69.5-34.4178.6-81.4-73.3000112.6I246 Q247 S254 I288 V297I246-F250 HydrophobicContact CG2-CD2 3.61Å; I246-F250 HydrophobicContact CG2-CE2 3.73Å; I246-F250 VanDerWaalsContact O-CD2 3.23Å; I246-F250 WeakPolarHBondContact O-CD2 3.34Å; I246-F250 PolarHBondContact O-N 3.41Å; Q247-F250 PolarHBondContact O-N 2.91Å; F250-S254 WeakPolarHBondContact O-CB 3.43Å; F250-S254 PolarHBondContact O-N 2.9Å; F250-S254 PolarHBondContact O-OG 3.44Å; F250-I288 HydrophobicContact CD1-CD1 4.27Å; F250-I288 HydrophobicContact CE1-CD1 3.79Å; F250-V297 HydrophobicContact CE1-CG1 3.91Å; F250-V297 HydrophobicContact CZ-CG1 4.4Å
251E71.4Confident64.7Low102 Ų10281.1 Ų81.148%0.47741%0.411SS..Hα-helixtrans-64.3-47.2172.8-78.1174.7-169.700111.2Q247 I253 S254 G255Q247-E251 HydrophobicContact CG-CG 4.41Å; Q247-E251 WeakPolarHBondContact CG-OE1 3.44Å; Q247-E251 PolarHBondContact NE2-OE1 3.36Å; Q247-E251 WeakPolarHBondContact O-CB 3.27Å; Q247-E251 WeakPolarHBondContact O-CG 3.41Å; Q247-E251 PolarHBondContact O-N 3.16Å; E251-I253 PolarHBondContact O-N 2.64Å; E251-S254 WeakPolarHBondContact CA-OG 3.21Å; E251-S254 PolarHBondContact O-N 3.34Å; E251-S254 PolarHBondContact O-OG 2.92Å; E251-G255 PolarHBondContact O-N 3.46Å
252S66.5Low63.9Low73 Ų7385 Ų8551%0.5143%0.428SS..Hα-helixtrans-58.1-48.3174.8-172.70000111.9Q248 Y249 S254 G255 D256Q248-S252 WeakPolarHBondContact O-CB 3.45Å; Q248-S252 PolarHBondContact O-N 3.33Å; Y249-S252 PolarHBondContact O-N 2.9Å; S252-S254 PolarHBondContact O-N 3.5Å; S252-G255 PolarHBondContact O-N 3.13Å; S252-D256 PolarHBondContact O-N 3.23Å
253I64.8Low62.6Low29 Ų2990.5 Ų90.515%0.14945%0.446CS..Hα-helixtrans-67.8-36.3179.7-75.6-170.5000112.2Y249 E251 G255 D256 M257 V297Y249-I253 HydrophobicContact CD1-CD1 4.14Å; Y249-I253 HydrophobicContact CD2-CD1 4.16Å; Y249-I253 HydrophobicContact CE1-CD1 3.51Å; Y249-I253 HydrophobicContact CE2-CD1 3.52Å; Y249-I253 HydrophobicContact CE2-CG1 4.35Å; Y249-I253 HydrophobicContact CG-CD1 4.44Å; Y249-I253 WeakPolarHBondContact O-CB 3.42Å; Y249-I253 WeakPolarHBondContact O-CG1 3.35Å; Y249-I253 PolarHBondContact O-N 3.31Å; Y249-I253 VanDerWaalsContact OH-CD1 3.32Å; Y249-I253 WeakPolarHBondContact OH-CD1 3.34Å; E251-I253 PolarHBondContact O-N 2.64Å; I253-G255 VanDerWaalsContact C-N 3.34Å; I253-D256 PolarHBondContact O-N 3.36Å; I253-M257 HydrophobicContact CG2-CE 3.28Å; I253-M257 WeakPolarHBondContact O-CB 3.32Å; I253-M257 PolarHBondContact O-N 3.11Å; I253-V297 HydrophobicContact CD1-CG1 4.1Å; I253-V297 HydrophobicContact CG2-CG2 4.3Å
254S62.9Low61.1Low28 Ų2894.1 Ų94.120%0.19646%0.457CS..Hα-helixtrans-69.3-33.1176.373.80000112.4F250 E251 S252 R258F250-S254 WeakPolarHBondContact O-CB 3.43Å; F250-S254 PolarHBondContact O-N 2.9Å; F250-S254 PolarHBondContact O-OG 3.44Å; E251-S254 WeakPolarHBondContact CA-OG 3.21Å; E251-S254 PolarHBondContact O-N 3.34Å; E251-S254 PolarHBondContact O-OG 2.92Å; S252-S254 PolarHBondContact O-N 3.5Å; S254-R258 WeakPolarHBondContact O-CB 3.36Å; S254-R258 WeakPolarHBondContact O-CG 3.35Å; S254-R258 PolarHBondContact O-N 3.41Å
255G60.5Low59.6Low37 Ų3794.4 Ų94.438%0.38146%0.462SS..Hα-helixtrans-65.2-45171.300000111.6E251 S252 I253 R258 S259E251-G255 PolarHBondContact O-N 3.46Å; S252-G255 PolarHBondContact O-N 3.13Å; I253-G255 VanDerWaalsContact C-N 3.34Å; G255-R258 PolarHBondContact O-N 2.99Å; G255-S259 PolarHBondContact O-N 3.07Å
256D58.5Low58.2Low91 Ų9197.8 Ų97.849%0.48749%0.486SS..Hα-helixtrans-63.1-46.1175.3-68.6-22.7000111.2S252 I253 R258 S259 F260S252-D256 PolarHBondContact O-N 3.23Å; I253-D256 PolarHBondContact O-N 3.36Å; D256-R258 PolarHBondContact O-N 2.93Å; D256-S259 WeakPolarHBondContact O-CB 3.02Å; D256-S259 PolarHBondContact O-N 2.77Å; D256-S259 VanDerWaalsContact O-N 3.14Å; D256-S259 PolarHBondContact O-OG 3.12Å; D256-F260 VanDerWaalsContact O-CD2 3.31Å; D256-F260 WeakPolarHBondContact O-CD2 3.32Å; D256-F260 PolarHBondContact O-N 3.42Å
257M52.6Low56.6Low42 Ų42102.8 Ų102.821%0.20751%0.505CS..Hα-helixtrans-64.6-37.9176.3-86.2-166.4-98.100113.2I253 S259 F260 H261 I288 V297I253-M257 HydrophobicContact CG2-CE 3.28Å; I253-M257 WeakPolarHBondContact O-CB 3.32Å; I253-M257 PolarHBondContact O-N 3.11Å; M257-S259 VanDerWaalsContact C-N 3.3Å; M257-S259 PolarHBondContact O-N 3.41Å; M257-F260 PolarHBondContact O-N 3.38Å; M257-H261 PolarHBondContact O-CD2 3.03Å; M257-H261 PolarHBondContact O-N 3.45Å; M257-I288 HydrophobicContact CE-CG1 4.13Å; M257-V297 HydrophobicContact CE-CG2 4.36Å
258R53.7Low54.8Low187 Ų187104.5 Ų104.571%0.70652%0.518SS*.Hα-helixtrans-62.8-36.8171.9-84.5-178.4175.4-173.6-1.1111.6S254 G255 D256 H261 K262S254-R258 WeakPolarHBondContact O-CB 3.36Å; S254-R258 WeakPolarHBondContact O-CG 3.35Å; S254-R258 PolarHBondContact O-N 3.41Å; G255-R258 PolarHBondContact O-N 2.99Å; D256-R258 PolarHBondContact O-N 2.93Å; R258-H261 PolarHBondContact O-N 3.23Å; R258-K262 WeakPolarHBondContact O-CB 3.18Å; R258-K262 PolarHBondContact O-N 2.98Å
259S51.5Low53.2Low58 Ų58106.1 Ų106.141%0.40653%0.53SS..Hα-helixtrans-65.2-40.4174.287.60000112G255 D256 M257 K262 H263G255-S259 PolarHBondContact O-N 3.07Å; D256-S259 WeakPolarHBondContact O-CB 3.02Å; D256-S259 PolarHBondContact O-N 2.77Å; D256-S259 VanDerWaalsContact O-N 3.14Å; D256-S259 PolarHBondContact O-OG 3.12Å; M257-S259 VanDerWaalsContact C-N 3.3Å; M257-S259 PolarHBondContact O-N 3.41Å; S259-K262 PolarHBondContact O-N 3.03Å; S259-H263 PolarHBondContact O-N 3.43Å; S259-H263 VanDerWaalsContact O-N 3.07Å
260F49.3Very low51.5Low157 Ų157108.6 Ų108.669%0.68955%0.554SS**Hα-helixtrans-66.6-40176-89.5-76.5000112.4D256 M257 H263 R264D256-F260 VanDerWaalsContact O-CD2 3.31Å; D256-F260 WeakPolarHBondContact O-CD2 3.32Å; D256-F260 PolarHBondContact O-N 3.42Å; M257-F260 PolarHBondContact O-N 3.38Å; F260-H263 PolarHBondContact O-N 2.9Å; F260-R264 PolarHBondContact O-N 3.47Å
261H50.8Low49.8Very low123 Ų123113.1 Ų113.157%0.56958%0.581SS**Hα-helixtrans-72.6-34.3176.2-83.8-72.5000113.1M257 R258 H263 R264 S265M257-H261 PolarHBondContact O-CD2 3.03Å; M257-H261 PolarHBondContact O-N 3.45Å; R258-H261 PolarHBondContact O-N 3.23Å; H261-H263 VanDerWaalsContact C-N 3.31Å; H261-H263 PolarHBondContact O-N 3.36Å; H261-R264 PolarHBondContact O-N 2.92Å; H261-R264 VanDerWaalsContact O-N 3.14Å; H261-S265 PolarHBondContact O-N 3.49Å
262K46.9Very low48Very low169 Ų169115 Ų11574%0.73559%0.594SS**Hα-helixtrans-66.5-34.8174.1-142.4178.8-173.4-174.70111.8R258 S259 R264 S265 S266R258-K262 WeakPolarHBondContact O-CB 3.18Å; R258-K262 PolarHBondContact O-N 2.98Å; S259-K262 PolarHBondContact O-N 3.03Å; K262-R264 VanDerWaalsContact C-N 3.3Å; K262-R264 PolarHBondContact O-N 3.44Å; K262-S265 PolarHBondContact O-N 3Å; K262-S266 PolarHBondContact O-N 3.22Å; K262-S266 VanDerWaalsContact O-N 3.17Å
263H44.2Very low46.6Very low158 Ų158118.4 Ų118.473%0.73161%0.606SS**Hα-helixtrans-72-22.3172.3-104.2-59.5000114.1S259 F260 H261S259-H263 PolarHBondContact O-N 3.43Å; S259-H263 VanDerWaalsContact O-N 3.07Å; F260-H263 PolarHBondContact O-N 2.9Å; H261-H263 VanDerWaalsContact C-N 3.31Å; H261-H263 PolarHBondContact O-N 3.36Å
264R42.6Very low45.3Very low205 Ų205123.9 Ų123.977%0.77464%0.636SS**Hα-helixtrans-86.4-25.4175.3-145.6176.8178.3-172-2.5112.9F260 H261 K262F260-R264 PolarHBondContact O-N 3.47Å; H261-R264 PolarHBondContact O-N 2.92Å; H261-R264 VanDerWaalsContact O-N 3.14Å; K262-R264 VanDerWaalsContact C-N 3.3Å; K262-R264 PolarHBondContact O-N 3.44Å
265S42.1Very low44Very low85 Ų85130.2 Ų130.259%0.59467%0.668SS**Hα-helixtrans-83.5-22.8174.4158.50000113.5H261 K262 K267H261-S265 PolarHBondContact O-N 3.49Å; K262-S265 PolarHBondContact O-N 3Å; S265-K267 PolarHBondContact O-N 3.1Å; S265-K267 VanDerWaalsContact O-N 3.08Å
266S39.9Very low43.3Very low97 Ų97136.1 Ų136.168%0.67869%0.69SS**THydrogen-bonded Turntrans-75.912.7176.5-174.50000114.1K262K262-S266 PolarHBondContact O-N 3.22Å; K262-S266 VanDerWaalsContact O-N 3.17Å
267K39.7Very low42.4Very low178 Ų178141.2 Ų141.277%0.77471%0.708SS**THydrogen-bonded Turntrans-137.325.7-177.8-141.9179.1-175.1174.40115S265S265-K267 PolarHBondContact O-N 3.1Å; S265-K267 VanDerWaalsContact O-N 3.08Å
268D37.1Very low41.5Very low150 Ų150148.4 Ų148.480%0.80274%0.738SS**  trans-152.182.4158.1-88-35.7000107.9
269D35.5Very low40.9Very low165 Ų165149.7 Ų149.788%0.88275%0.749SS**  trans-89.1104.9155.3-85.4-31.3000107
270S37.9Very low40.2Very low94 Ų94150 Ų15066%0.65775%0.752SS**  trans-165111.314058.10000110.7
271D37.4Very low39.8Very low148 Ų148149.4 Ų149.479%0.79176%0.755SS**  trans94.7131.3140.7-54.9-18.8000121.8
272D33.8Very low39.2Very low142 Ų142149.2 Ų149.276%0.75976%0.755SS**  trans85.8104.8150.8-67.4-12000122.5
273D36.8Very low38.9Very low143 Ų143148.4 Ų148.477%0.76576%0.758SS**  48.6136.6124.8-72.3-17.5000123.5
274D38.7Very low38.7Very low144 Ų144149.8 Ų149.877%0.7776%0.762SS**  trans52.6110.7150.2-71.6-23.6000119.6
275D34.2Very low38.8Very low162 Ų162146.2 Ų146.287%0.86676%0.758SS**  -178.6127103.3-110.5-31.6000111.4
276D45.6Very low39.2Very low160 Ų160147.4 Ų147.486%0.85676%0.757SS**  trans-59.8151.5160.8-109-39.8000109.9
277K40.5Very low39.5Very low198 Ų198145.1 Ų145.186%0.86175%0.749SS**  trans93.776.7158.8-146.2-179.4-158.1170.40117.5
278K34.1Very low40.1Very low193 Ų193138.3 Ų138.384%0.83972%0.72SS**  trans-163.478.7131-111.2170.4-173.8175.10111S280K278-S280 PolarHBondContact O-N 3.07Å
279K40.9Very low40.8Very low215 Ų215141.7 Ų141.794%0.93572%0.722SS**  trans-69.674.2157.8-162.1176.1-171.2172.80107.5
280S37.3Very low41.8Very low65 Ų65138.4 Ų138.446%0.45570%0.704SS.*  trans-119.994.6-172.3160.60000107.4K278 E282K278-S280 PolarHBondContact O-N 3.07Å; S280-E282 PolarHBondContact O-N 2.92Å
281D39.3Very low42.5Very low144 Ų144141.2 Ų141.277%0.7771%0.707SS**SBendtrans43.8-4150.7-61.5-28.2000121.4
282E38.4Very low43.3Very low119 Ų119139.8 Ų139.856%0.55670%0.7SS**G310 helixtrans-79.1-20.3178.9-71-151.2166.300112.1S280 K284 L285 R289S280-E282 PolarHBondContact O-N 2.92Å; E282-K284 PolarHBondContact O-N 3.34Å; E282-K284 VanDerWaalsContact O-N 3.14Å; E282-L285 PolarHBondContact O-N 3.26Å; E282-L285 VanDerWaalsContact O-N 3.11Å; E282-R289 IonicContact OE2-NH1 3.76Å; E282-R289 PolarHBondContact OE2-NH1 3.06Å; E282-R289 VanDerWaalsContact OE2-NH1 3.16Å
283D40.9Very low44.4Very low151 Ų151136.7 Ų136.781%0.80768%0.683SS**G310 helixtrans-71.8-1.6174.7-81.5-26.5000114
284K40.8Very low45.4Very low187 Ų187133.3 Ų133.381%0.81366%0.663SS**G310 helixtrans-97.4-3.9170.2-96.6179179.61730114.1E282 L286E282-K284 PolarHBondContact O-N 3.34Å; E282-K284 VanDerWaalsContact O-N 3.14Å; K284-L286 PolarHBondContact O-N 3.24Å
285L44.8Very low46.5Very low131 Ų131130.6 Ų130.669%0.68665%0.649SS**SBendtrans-94.496.2172.1-70165.1000107.6E282 G287E282-L285 PolarHBondContact O-N 3.26Å; E282-L285 VanDerWaalsContact O-N 3.11Å; L285-G287 WeakPolarHBondContact O-CA 3.21Å; L285-G287 PolarHBondContact O-N 3.1Å
286L49Very low48Very low109 Ų109129.4 Ų129.457%0.57164%0.636SS**  trans-45.1108.5170-69.3160.3000108.3K284 I288K284-L286 PolarHBondContact O-N 3.24Å; L286-I288 PolarHBondContact O-N 3.11Å
287G47.7Very low48.9Very low49 Ų49122.4 Ų122.451%0.50560%0.599SS.*SBendtrans-51.991.3-156.800000116.1L285L285-G287 WeakPolarHBondContact O-CA 3.21Å; L285-G287 PolarHBondContact O-N 3.1Å
288I51Low49.9Very low35 Ų35117 Ų11718%0.17958%0.579CS.*  trans-135.195.9163.4-55.2177.3000106.1F250 M257 L286 D293 M294 V297F250-I288 HydrophobicContact CD1-CD1 4.27Å; F250-I288 HydrophobicContact CE1-CD1 3.79Å; M257-I288 HydrophobicContact CE-CG1 4.13Å; L286-I288 PolarHBondContact O-N 3.11Å; I288-D293 HydrophobicContact CG2-CB 4.39Å; I288-M294 HydrophobicContact CB-CE 3.97Å; I288-M294 HydrophobicContact CD1-CE 4.05Å; I288-M294 HydrophobicContact CD1-SD 4.03Å; I288-M294 HydrophobicContact CG2-CB 3.79Å; I288-M294 HydrophobicContact CG2-CE 3.71Å; I288-M294 HydrophobicContact CG2-SD 4.26Å; I288-V297 HydrophobicContact CD1-CG1 4.49Å; I288-V297 HydrophobicContact CD1-CG2 4.5Å
289R52Low51.3Low222 Ų222116.2 Ų116.284%0.83857%0.571SS**  trans-98.4-8.8-179.3-82.2175.766.5149.6-2.9113.6E282E282-R289 IonicContact OE2-NH1 3.76Å; E282-R289 PolarHBondContact OE2-NH1 3.06Å; E282-R289 VanDerWaalsContact OE2-NH1 3.16Å
290D56Low52.4Low96 Ų96109.8 Ų109.851%0.51355%0.547SS..SBendtrans-119.9141.4-176.9-143.4-27.4000112.6D292 D293 M294D290-D292 VanDerWaalsContact C-N 3.34Å; D290-D292 PolarHBondContact O-N 2.02Å; D290-D293 HydrophobicContact CB-CB 4.44Å; D290-D293 PolarHBondContact O-N 3.5Å; D290-M294 PolarHBondContact O-N 3.43Å; D290-M294 VanDerWaalsContact O-N 3.16Å
291Q52.9Low53.6Low152 Ų152110.1 Ų110.171%0.7154%0.538SS*.Hα-helixtrans-71.1-31.3-172.8-175.5168.2-20.900112N295Q291-N295 WeakPolarHBondContact O-CB 3.4Å; Q291-N295 PolarHBondContact O-N 3.42Å; Q291-N295 PolarHBondContact O-ND2 3.21Å
292D54.5Low54.7Low119 Ų119110.7 Ų110.764%0.63654%0.536SS*.Hα-helixtrans-72.3-35.4177.6-69.4-26000112.1D290 N295 K296D290-D292 VanDerWaalsContact C-N 3.34Å; D290-D292 PolarHBondContact O-N 2.02Å; D292-N295 PolarHBondContact O-N 3.4Å; D292-K296 WeakPolarHBondContact O-CB 3.21Å; D292-K296 PolarHBondContact O-N 2.89Å
293D56.9Low55.4Low76 Ų76108.8 Ų108.841%0.40653%0.532SS..Hα-helixtrans-69.5-39.5174.3-74.4-27.4000111.6I288 D290 K296 V297I288-D293 HydrophobicContact CG2-CB 4.39Å; D290-D293 HydrophobicContact CB-CB 4.44Å; D290-D293 PolarHBondContact O-N 3.5Å; D293-K296 PolarHBondContact O-N 3.01Å; D293-V297 WeakPolarHBondContact O-CB 3.32Å; D293-V297 VanDerWaalsContact O-CG2 3.26Å; D293-V297 WeakPolarHBondContact O-CG2 3.43Å; D293-V297 PolarHBondContact O-N 3.5Å
294M58Low56.1Low73 Ų73105.9 Ų105.936%0.3652%0.523SS..Hα-helixtrans-59.6-47.7171.6-174.766.375.900111.3I288 D290 K296 V297 L298I288-M294 HydrophobicContact CB-CE 3.97Å; I288-M294 HydrophobicContact CD1-CE 4.05Å; I288-M294 HydrophobicContact CD1-SD 4.03Å; I288-M294 HydrophobicContact CG2-CB 3.79Å; I288-M294 HydrophobicContact CG2-CE 3.71Å; I288-M294 HydrophobicContact CG2-SD 4.26Å; D290-M294 PolarHBondContact O-N 3.43Å; D290-M294 VanDerWaalsContact O-N 3.16Å; M294-K296 VanDerWaalsContact C-N 3.31Å; M294-K296 PolarHBondContact O-N 3.08Å; M294-V297 PolarHBondContact O-N 3.28Å; M294-L298 HydrophobicContact CG-CD1 3.96Å; M294-L298 HydrophobicContact CG-CG 4.46Å; M294-L298 WeakPolarHBondContact O-CB 3.05Å; M294-L298 VanDerWaalsContact O-CG 3.25Å; M294-L298 WeakPolarHBondContact O-CG 3.5Å; M294-L298 PolarHBondContact O-N 3.45Å; M294-L298 HydrophobicContact SD-CD1 4.46Å
295N61.1Low56.7Low87 Ų87105 Ų10547%0.46552%0.519SS..Hα-helixtrans-60.5-41.8178.3-81.4-24.2000111.6Q291 D292 L298 W299Q291-N295 WeakPolarHBondContact O-CB 3.4Å; Q291-N295 PolarHBondContact O-N 3.42Å; Q291-N295 PolarHBondContact O-ND2 3.21Å; D292-N295 PolarHBondContact O-N 3.4Å; N295-L298 PolarHBondContact O-N 3.44Å; N295-W299 WeakPolarHBondContact O-CB 3.32Å; N295-W299 PolarHBondContact O-N 3.06Å
296K66.3Low56.8Low137 Ų137101.7 Ų101.760%0.59651%0.506SS*.Hα-helixtrans-66-40.9177.5-167.9176.7-179.3-177.60112.5D292 D293 M294 W299 N300D292-K296 WeakPolarHBondContact O-CB 3.21Å; D292-K296 PolarHBondContact O-N 2.89Å; D293-K296 PolarHBondContact O-N 3.01Å; M294-K296 VanDerWaalsContact C-N 3.31Å; M294-K296 PolarHBondContact O-N 3.08Å; K296-W299 PolarHBondContact O-N 3Å; K296-N300 WeakPolarHBondContact O-CB 3.4Å; K296-N300 PolarHBondContact O-N 2.89Å
297V64.2Low56.8Low13 Ų13102.2 Ų102.28%0.07952%0.516CS..Hα-helixtrans-66.7-40.2176.4171.30000111.6Y249 F250 I253 M257 I288 D293 M294 N300 W301Y249-V297 HydrophobicContact CE1-CG1 3.82Å; Y249-V297 PolarHBondContact OH-O 3.16Å; F250-V297 HydrophobicContact CE1-CG1 3.91Å; F250-V297 HydrophobicContact CZ-CG1 4.4Å; I253-V297 HydrophobicContact CD1-CG1 4.1Å; I253-V297 HydrophobicContact CG2-CG2 4.3Å; M257-V297 HydrophobicContact CE-CG2 4.36Å; I288-V297 HydrophobicContact CD1-CG1 4.49Å; I288-V297 HydrophobicContact CD1-CG2 4.5Å; D293-V297 WeakPolarHBondContact O-CB 3.32Å; D293-V297 VanDerWaalsContact O-CG2 3.26Å; D293-V297 WeakPolarHBondContact O-CG2 3.43Å; D293-V297 PolarHBondContact O-N 3.5Å; M294-V297 PolarHBondContact O-N 3.28Å; V297-N300 PolarHBondContact O-N 2.81Å; V297-W301 WeakPolarHBondContact O-CB 3.47Å; V297-W301 PolarHBondContact O-N 2.77Å
298L62.5Low56.5Low85 Ų85106.9 Ų106.945%0.44553%0.528SS..Hα-helixtrans-66.6-39.3175-70.9171.1000111.9M294 N295 W301 H302M294-L298 HydrophobicContact CG-CD1 3.96Å; M294-L298 HydrophobicContact CG-CG 4.46Å; M294-L298 WeakPolarHBondContact O-CB 3.05Å; M294-L298 VanDerWaalsContact O-CG 3.25Å; M294-L298 WeakPolarHBondContact O-CG 3.5Å; M294-L298 PolarHBondContact O-N 3.45Å; M294-L298 HydrophobicContact SD-CD1 4.46Å; N295-L298 PolarHBondContact O-N 3.44Å; L298-W301 PolarHBondContact O-N 2.88Å; L298-H302 WeakPolarHBondContact O-CB 3.49Å; L298-H302 PolarHBondContact O-N 3.45Å
299W63.2Low56.1Low176 Ų176108.6 Ų108.667%0.66755%0.547SS*.Hα-helixtrans-65.9-43.8176-140.395.5000111.4N295 K296 W301 H302 T303N295-W299 WeakPolarHBondContact O-CB 3.32Å; N295-W299 PolarHBondContact O-N 3.06Å; K296-W299 PolarHBondContact O-N 3Å; W299-W301 PolarHBondContact O-N 3.26Å; W299-H302 PolarHBondContact O-N 3.21Å; W299-T303 HydrophobicContact CZ3-CG2 4.03Å; W299-T303 WeakPolarHBondContact CZ3-OG1 3.35Å; W299-T303 WeakPolarHBondContact O-CB 3.01Å; W299-T303 PolarHBondContact O-N 2.89Å; W299-T303 PolarHBondContact O-OG1 3.17Å
300N63.9Low55.6Low80 Ų80106.2 Ų106.243%0.42855%0.55SS.*Hα-helixtrans-63.3-39.8174.6-81-10000112.3K296 V297 T303 C304K296-N300 WeakPolarHBondContact O-CB 3.4Å; K296-N300 PolarHBondContact O-N 2.89Å; V297-N300 PolarHBondContact O-N 2.81Å; N300-T303 PolarHBondContact O-N 3.19Å; N300-C304 WeakPolarHBondContact O-CB 3.35Å; N300-C304 PolarHBondContact O-N 3.03Å
301W61.7Low54.6Low71 Ų71111.8 Ų111.827%0.26956%0.564SS.*Hα-helixtrans-63.2-42.7174.7173.6-103.6000112.5C245 I246 Y249 V297 L298 W299 T303 K305 P306C245-W301 HydrophobicContact CB-CH2 4.31Å; I246-W301 HydrophobicContact CG1-CH2 4.14Å; I246-W301 HydrophobicContact CG1-CZ2 4.02Å; Y249-W301 HydrophobicContact CD1-CD2 4.48Å; Y249-W301 AromaticContact CD1-CE3 3.68Å; Y249-W301 HydrophobicContact CD1-CE3 3.68Å; Y249-W301 HydrophobicContact CD1-CZ3 4.15Å; Y249-W301 AromaticContact CD2-CE3 3.75Å; Y249-W301 HydrophobicContact CD2-CE3 3.75Å; Y249-W301 HydrophobicContact CD2-CZ3 4.02Å; Y249-W301 HydrophobicContact CE1-CB 3.98Å; Y249-W301 HydrophobicContact CE1-CD2 4.41Å; Y249-W301 AromaticContact CE1-CE3 3.86Å; Y249-W301 HydrophobicContact CE1-CE3 3.86Å; Y249-W301 AromaticContact CE2-CE3 3.93Å; Y249-W301 HydrophobicContact CE2-CE3 3.93Å; Y249-W301 AromaticContact CG-CE3 3.6Å; Y249-W301 HydrophobicContact CG-CE3 3.6Å; Y249-W301 AromaticContact CG-CZ3 3.74Å; Y249-W301 HydrophobicContact CG-CZ3 3.74Å; Y249-W301 AromaticContact CZ-CE3 3.98Å; Y249-W301 PolarHBondContact OH-N 3.19Å; V297-W301 WeakPolarHBondContact O-CB 3.47Å; V297-W301 PolarHBondContact O-N 2.77Å; L298-W301 PolarHBondContact O-N 2.88Å; W299-W301 PolarHBondContact O-N 3.26Å; W301-T303 VanDerWaalsContact C-N 3.29Å; W301-T303 PolarHBondContact O-N 3.45Å; W301-K305 PolarHBondContact O-N 2.96Å; W301-P306 HydrophobicContact CH2-CG 4.35Å; W301-P306 HydrophobicContact CZ3-CG 4.06Å
302H63Low53.7Low157 Ų157114.5 Ų114.573%0.72757%0.574SS**Hα-helixtrans-64.4-35.3178.2-177.9-91.2000112.2L298 W299L298-H302 WeakPolarHBondContact O-CB 3.49Å; L298-H302 PolarHBondContact O-N 3.45Å; W299-H302 PolarHBondContact O-N 3.21Å
303T52.7Low52.8Low78 Ų78116.9 Ų116.948%0.47958%0.581SS.*Hα-helixtrans-91.3-30.4-173.1-39.50000112.9W299 N300 W301W299-T303 HydrophobicContact CZ3-CG2 4.03Å; W299-T303 WeakPolarHBondContact CZ3-OG1 3.35Å; W299-T303 WeakPolarHBondContact O-CB 3.01Å; W299-T303 PolarHBondContact O-N 2.89Å; W299-T303 PolarHBondContact O-OG1 3.17Å; N300-T303 PolarHBondContact O-N 3.19Å; W301-T303 VanDerWaalsContact C-N 3.29Å; W301-T303 PolarHBondContact O-N 3.45Å
304C56.7Low51.5Low91 Ų91121 Ų12162%0.61560%0.598SS**SBendtrans-119.549.9-176.2-61.30000111.3N300 P306N300-C304 WeakPolarHBondContact O-CB 3.35Å; N300-C304 PolarHBondContact O-N 3.03Å; C304-P306 WeakPolarHBondContact O-CD 3.38Å
305K52Low50.3Low168 Ų168123.3 Ų123.373%0.7362%0.619SS**PPolyproline II helixtrans-57.7120.4176.8-168.3175.7-175.9179.40109.4W301W301-K305 PolarHBondContact O-N 2.96Å
306P47.8Very low48.8Very low62 Ų62126 Ų12640%0.40363%0.633SS.*PPolyproline II helixtrans-63145-174.421.1-30.1000111.2W301 C304W301-P306 HydrophobicContact CH2-CG 4.35Å; W301-P306 HydrophobicContact CZ3-CG 4.06Å; C304-P306 WeakPolarHBondContact O-CD 3.38Å
307P49.7Very low47.1Very low120 Ų120122.9 Ų122.978%0.77964%0.64SS**PPolyproline II helixtrans-63.2147.5179.125.2-32.1000111.1A309P307-A309 VanDerWaalsContact C-N 3.33Å; P307-A309 PolarHBondContact O-N 3.31Å
308L41.4Very low45.5Very low146 Ų146131.1 Ų131.176%0.76468%0.677SS**  trans-62.587.2177.7-73.3150.7000110.5F241 L310F241-L308 HydrophobicContact CE1-CD2 4.21Å; L308-L310 PolarHBondContact O-N 3.01Å
309A41.3Very low43.9Very low71 Ų71131.7 Ų131.759%0.58769%0.688SS**  trans-81.2103.8174.100000109.8P307 R311P307-A309 VanDerWaalsContact C-N 3.33Å; P307-A309 PolarHBondContact O-N 3.31Å; A309-R311 PolarHBondContact O-N 3.07Å
310L41.1Very low42.2Very low172 Ų172132.2 Ų132.290%0.90170%0.698SS**  trans-81.14.1177-72.8167.8000113.7L308L308-L310 PolarHBondContact O-N 3.01Å
311R35.6Very low40.6Very low214 Ų214137.3 Ų137.381%0.80872%0.719SS**  trans-102.1111.2-175.9-132-178.8-173.2-1481.6109.9A309 E313A309-R311 PolarHBondContact O-N 3.07Å; R311-E313 PolarHBondContact O-N 3.48Å
312K35.1Very low38.9Very low208 Ų208137.5 Ų137.590%0.90474%0.743SS**  trans-73.899.9167-159.2179.2-172.2-177.70106.7Q314K312-Q314 PolarHBondContact O-N 3.14Å
313E34.6Very low37.2Very low169 Ų169138.5 Ų138.579%0.7975%0.752SS**  trans-71125.7166.3-76.1-176166.500108.3R311R311-E313 PolarHBondContact O-N 3.48Å
314Q28.9Very low36Very low162 Ų162142.1 Ų142.176%0.75777%0.767SS**  trans-87.8131.5177.6-161.91672.700106.9K312 D316K312-Q314 PolarHBondContact O-N 3.14Å; Q314-D316 PolarHBondContact O-N 3.03Å
315P32.9Very low35.4Very low123 Ų123142.5 Ų142.580%0.79977%0.769SS**  trans-83.7101.5-178.831.5-28.5000108.9
316D31.1Very low34.2Very low144 Ų144142.1 Ų142.177%0.7777%0.774SS**  trans-101.4121.3164.7-68.5-21.4000108.4Q314Q314-D316 PolarHBondContact O-N 3.03Å
317G30.1Very low33.1Very low71 Ų71142 Ų14273%0.73279%0.785SS**  trans-76.4148.4-179.900000113.8
318E30.2Very low32Very low185 Ų185144 Ų14486%0.86479%0.789SS**  trans61.196.7144-66.8-176.7162.200120.6
319S29.1Very low31.2Very low98 Ų98141.8 Ų141.869%0.68578%0.781SS**  49.8121.4122.860.20000121.6
320H27.9Very low30.6Very low186 Ų186147.5 Ų147.586%0.86180%0.795SS**  -154.5140.4116.7-111-75000112.2
321E29.1Very low29.8Very low188 Ų188142.2 Ų142.288%0.87978%0.782SS**  trans-61.5157.1-178.9-65.3166.7111.100115.3
322G26.8Very low29.3Very low74 Ų74138.5 Ų138.576%0.76378%0.783SS**  trans159.593.6155.500000116.7
323L26.9Very low28.9Very low178 Ų178134.2 Ų134.293%0.93278%0.78SS**  trans12.1128.3154.4-9063000121.5
324I28.3Very low28.5Very low155 Ų155129.9 Ų129.980%0.79578%0.78SS**  trans-71.6167.3155.7-24.3176.7000108.3
325P43.5Very low28.3Very low98 Ų98125.8 Ų125.864%0.63678%0.781SS**  cis-154.4-179.524.439.3-13.6000121.2
326N27.2Very low28.4Very low160 Ų160125.3 Ų125.386%0.85678%0.778SS**  trans82.7140.9162.5-57.2-24.8000115.7
327G24.4Very low28.2Very low60 Ų60126.1 Ų126.162%0.61978%0.782SS**  cis151.3149.213.500000106.5
328D25.7Very low28Very low163 Ų163126.2 Ų126.287%0.87278%0.783SS**  trans70.4152.2166.5-58.9-24000117.9
329V26.1Very low27.7Very low98 Ų98128.1 Ų128.159%0.59478%0.784SS**  cis-178.6151.7-11.7137.90000103.7
330H27.6Very low27.6Very low192 Ų192129.4 Ų129.489%0.88979%0.788SS**  trans66.8141.8168-65.2-38.4000117
331G24.6Very low27.5Very low61 Ų61127.6 Ų127.663%0.62978%0.784SS**  cis142.2141.114.100000108.1
332V26.1Very low27.4Very low136 Ų136128 Ų12882%0.82479%0.786SS**  trans81.6105.2150.3-174.80000118.4
333S25.3Very low27.4Very low118 Ų118133.3 Ų133.383%0.82579%0.791SS**  59.3134123.1-49.40000122.9
334G27.2Very low27.5Very low77 Ų77129 Ų12979%0.79478%0.781SS**  trans129100.9137.300000115.2
335G25.3Very low27.9Very low76 Ų76126.9 Ų126.978%0.78478%0.777SS**  trans-75.7-155.2159.100000111.5
336P33.6Very low27.1Very low113 Ų113129.1 Ų129.173%0.73478%0.784SS**  cis-129.1178.5-40.736.4-20.6000111.7
337N26.3Very low27.3Very low162 Ų162129.1 Ų129.187%0.86678%0.783SS**  trans91.2127.7159.6-61.9-18.3000120.2
338G26.1Very low27.7Very low72 Ų72131.6 Ų131.674%0.74279%0.788SS**  trans155.489.6153.400000116.2
339Y23.9Very low28Very low226 Ų226133.4 Ų133.489%0.88679%0.788SS**  trans-25.9150160.8-69-99.2000116.6
340T28.1Very low28.2Very low125 Ų125140 Ų14077%0.76780%0.802SS**  -168.7143.850.2390000113.3
341N25.7Very low28.2Very low147 Ų147139.8 Ų139.879%0.78680%0.801SS**  trans20.7127.9146.9-73.4-10.5000123.6
342H27.4Very low28.5Very low198 Ų198148.2 Ų148.292%0.91781%0.814SS**  trans-149.6131.1132.5-105.4-74.2000111.3
343H26.9Very low28.5Very low185 Ų185145.5 Ų145.586%0.85681%0.807SS**  trans-58.3152.2169-74.2-79.1000111.3
344A27.8Very low28.8Very low88 Ų88145.3 Ų145.373%0.72780%0.8SS**  cis-169.4-163.938.400000108.9
345P36.9Very low28.8Very low110 Ų110152 Ų15271%0.71480%0.803SS**  -121.1-177.2-65.236.2-19.5000113.7
346D26.9Very low28.9Very low145 Ų145158.3 Ų158.378%0.77581%0.805SS**  trans96.8114.8154.9-65.2-22.4000123.1
347L32.5Very low28.6Very low159 Ų159158.7 Ų158.783%0.83281%0.81SS**  trans126.9133.8133.2-80.3133.8000116.5
348P31.9Very low28.6Very low112 Ų112160.4 Ų160.473%0.72781%0.809SS**  trans-82.3123.6-157.632.4-32.2000112.2R350P348-R350 PolarHBondContact O-N 2.83Å
349K32.2Very low28.8Very low201 Ų201165.5 Ų165.587%0.87483%0.826SS**  trans-74.8112.5164.3-86.9179.5176.6174.30109.1E351K349-E351 PolarHBondContact O-N 3.2Å; K349-E351 VanDerWaalsContact O-N 3.17Å
350R31Very low29Very low236 Ų236162.5 Ų162.589%0.89182%0.823SS**  trans-54.8114.2169.3-79.7178.3165.8178.5-4.1109.9P348P348-R350 PolarHBondContact O-N 2.83Å
351E26.3Very low29.1Very low188 Ų188164.5 Ų164.588%0.87983%0.826SS**  trans-63.7127.6167.5-66.7178.3150.400109.7K349 A353K349-E351 PolarHBondContact O-N 3.2Å; K349-E351 VanDerWaalsContact O-N 3.17Å; E351-A353 PolarHBondContact O-N 2.86Å
352W30.7Very low29.3Very low238 Ų238165.4 Ų165.490%0.90283%0.828SS**  trans-83.3108.9162.4-70.992.8000107.5V354W352-V354 PolarHBondContact O-N 3.18Å; W352-V354 VanDerWaalsContact O-N 3.09Å
353A27.4Very low29.4Very low80 Ų80163.5 Ų163.566%0.66182%0.823SS**  trans-61.7108.7177.200000110.6E351 Y355E351-A353 PolarHBondContact O-N 2.86Å; A353-Y355 HydrophobicContact CB-CD2 4.23Å; A353-Y355 HydrophobicContact CB-CE2 3.99Å; A353-Y355 PolarHBondContact O-N 3.4Å
354V30.5Very low29.5Very low113 Ų113162.2 Ų162.269%0.68582%0.821SS**  trans-83101.1169.1-179.90000107.7W352 Y356W352-V354 PolarHBondContact O-N 3.18Å; W352-V354 VanDerWaalsContact O-N 3.09Å; V354-Y356 HydrophobicContact CG1-CD2 3.72Å; V354-Y356 HydrophobicContact CG1-CE2 3.63Å; V354-Y356 PolarHBondContact O-N 3.4Å
355Y26.6Very low29.7Very low218 Ų218167.1 Ų167.186%0.85583%0.827SS**  trans-79.897.8171.4-84.4-87.7000110.3A353A353-Y355 HydrophobicContact CB-CD2 4.23Å; A353-Y355 HydrophobicContact CB-CE2 3.99Å; A353-Y355 PolarHBondContact O-N 3.4Å
356Y28.7Very low29.2Very low209 Ų209171.2 Ų171.282%0.8284%0.835SS**  trans-77.5114.8156-82.4-87.8000108.6V354V354-Y356 HydrophobicContact CG1-CD2 3.72Å; V354-Y356 HydrophobicContact CG1-CE2 3.63Å; V354-Y356 PolarHBondContact O-N 3.4Å
357S26.4Very low29.3Very low121 Ų121173.2 Ų173.285%0.84684%0.84SS**  trans-91.6103.5163.7-1740000109.2
358K26.7Very low29.1Very low197 Ų197174.4 Ų174.486%0.85784%0.84SS**  trans-77.1122.7162-128.7176.6-177.8176.10106.7
359V30.3Very low28.8Very low180 Ų180180.1 Ų180.1100%1.09185%0.851SS**  trans152.50146.2175.20000111.8K215K215-V359 PolarHBondContact NZ-O 3.41Å; K215-V359 PolarHBondContact NZ-OXT 3.33Å; K215-V359 VanDerWaalsContact NZ-OXT 3.09Å

Retrieved 359 of 359 residues in 1273.7 ms (Link to these results)

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