A0A077Z9E8_TRITR Loading...

Serine/threonine protein phosphatase 2A regulatory subunit

AlphaFold DB , UniProt , Accession A0A077Z9E8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 508 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
1M34.7Very low34.6Very low204 Ų204147.4 Ų147.4100%1.00570%0.698SS**  0-22.80-116.4-171.7-102.900113.8
2F29.2Very low34.7Very low189 Ų189144.1 Ų144.183%0.82970%0.701SS**  trans-69.6-34.6173.3-108-93.9000114.1
3W37.2Very low34.5Very low59 Ų59146.7 Ų146.722%0.22371%0.707CS.*THydrogen-bonded Turntrans-83.9-6.8177.1-68.896.9000114.8L33 F38 F50 I53W3-L33 HydrophobicContact CD2-CD1 3.74Å; W3-L33 HydrophobicContact CE3-CD1 3.91Å; W3-L33 HydrophobicContact CH2-CD1 3.45Å; W3-L33 VanDerWaalsContact CH2-CD1 3.45Å; W3-L33 HydrophobicContact CH2-CD2 3.33Å; W3-L33 HydrophobicContact CH2-CG 3.26Å; W3-L33 HydrophobicContact CZ2-CD1 3.22Å; W3-L33 HydrophobicContact CZ2-CD2 3.93Å; W3-L33 HydrophobicContact CZ2-CG 3.28Å; W3-L33 HydrophobicContact CZ3-CD1 3.76Å; W3-L33 HydrophobicContact CZ3-CD2 3.71Å; W3-L33 HydrophobicContact CZ3-CG 3.94Å; W3-F38 HydrophobicContact CZ2-CZ 4.42Å; W3-F50 HydrophobicContact CB-CD1 3.91Å; W3-F50 HydrophobicContact CB-CE1 3.67Å; W3-F50 HydrophobicContact CB-CZ 4.34Å; W3-F50 AromaticContact CD2-CD1 3.94Å; W3-F50 HydrophobicContact CD2-CD1 3.94Å; W3-F50 HydrophobicContact CD2-CE1 4.48Å; W3-F50 AromaticContact CE3-CD1 3.83Å; W3-F50 HydrophobicContact CE3-CD1 3.83Å; W3-F50 HydrophobicContact CE3-CE1 4.31Å; W3-F50 HydrophobicContact CG-CD1 4.04Å; W3-F50 HydrophobicContact CG-CE1 4.3Å; W3-I53 HydrophobicContact CH2-CB 4.13Å; W3-I53 HydrophobicContact CH2-CG2 3.67Å; W3-I53 HydrophobicContact CZ3-CB 4.03Å; W3-I53 HydrophobicContact CZ3-CD1 4.29Å; W3-I53 HydrophobicContact CZ3-CG2 3.5Å; W3-I53 VanDerWaalsContact CZ3-CG2 3.5Å
4R35Very low35Very low219 Ų219141.1 Ų141.183%0.82669%0.691SS**THydrogen-bonded Turntrans-91.82.7-176.5-87.4-168.8-174.81722.1114
5R31Very low35.6Very low211 Ų211137.1 Ų137.180%0.79667%0.67SS**SBendtrans-118.1100.9177.3-98-179171.4168.3-2.3109.9K7R5-K7 PolarHBondContact O-N 3.06Å
6D31.4Very low36.3Very low158 Ų158142.3 Ų142.385%0.84568%0.682SS**SBendtrans26.968.2146-69.1-25.8000117.2
7K35.8Very low37.2Very low134 Ų134144.9 Ų144.958%0.58369%0.689SS**  trans-144.912.3163.9-80.5-155175.9-170.80114.8R5 E9R5-K7 PolarHBondContact O-N 3.06Å; K7-E9 VanDerWaalsContact C-N 3.34Å
8S33.7Very low38.8Very low103 Ų103138.1 Ų138.172%0.7266%0.661SS**THydrogen-bonded Turntrans-76.4-18.617653.10000113.7
9E33.5Very low41Very low168 Ų168134.3 Ų134.379%0.78565%0.648SS**THydrogen-bonded Turntrans-99-23.4-178.4-71.5-169.7151.200114.7K7K7-E9 VanDerWaalsContact C-N 3.34Å
10D37.6Very low43Very low132 Ų132132.2 Ų132.271%0.70665%0.645SS**THydrogen-bonded Turntrans-90.5-16.9179.8-78.9-27.3000114C12D10-C12 VanDerWaalsContact C-N 3.27Å; D10-C12 PolarHBondContact O-N 2.89Å
11A41.1Very low44.9Very low44 Ų44133.1 Ų133.136%0.36465%0.648SS.*THydrogen-bonded Turntrans-72.1-18.3-177.900000114.1
12C36.4Very low47.4Very low108 Ų108128.6 Ų128.673%0.7363%0.625SS**THydrogen-bonded Turntrans-98.1-6.3-176.4-81.50000114.6D10D10-C12 VanDerWaalsContact C-N 3.27Å; D10-C12 PolarHBondContact O-N 2.89Å
13K32.1Very low50.2Low178 Ų178123.1 Ų123.177%0.77460%0.599SS**SBendtrans-105.6107.5-178.3-75.5177.4-178.7167.50111.4
14S41Very low52.7Low69 Ų69121.5 Ų121.548%0.48359%0.593SS.*  trans87.865.7162.2-175.80000119Y16 K17S14-Y16 VanDerWaalsContact C-N 3.29Å; S14-K17 WeakPolarHBondContact OG-CB 3.14Å; S14-K17 PolarHBondContact OG-N 3.13Å
15Q44.1Very low55.4Low81 Ų81114 Ų11438%0.37957%0.568SS.*SBendtrans-72.2-22.4156.9-80-177.4-19.300113K17 R23 L26Q15-K17 PolarHBondContact O-N 3.42Å; Q15-R23 PolarHBondContact O-NE 3.23Å; Q15-R23 VanDerWaalsContact O-NE 3.1Å; Q15-R23 PolarHBondContact O-NH2 3.5Å; Q15-L26 HydrophobicContact CG-CD2 4.26Å
16Y47.7Very low58.4Low219 Ų219106.2 Ų106.286%0.85954%0.542SS*.SBendtrans-79.6-13.7-175.2-71.3-80.7000115.6S14S14-Y16 VanDerWaalsContact C-N 3.29Å
17K51.5Low61.3Low187 Ų18799.1 Ų99.181%0.81350%0.503SS*.SBendtrans-118.10.8175.1-68.3-177.2174.9179.80115.1S14 Q15S14-K17 WeakPolarHBondContact OG-CB 3.14Å; S14-K17 PolarHBondContact OG-N 3.13Å; Q15-K17 PolarHBondContact O-N 3.42Å
18A65.2Low64.1Low22 Ų2292.9 Ų92.918%0.18248%0.476CS..  trans-73.9139.9179.400000111.2E22 R23A18-E22 WeakPolarHBondContact CA-OE2 3.43Å; A18-E22 HydrophobicContact CB-CB 4.08Å; A18-R23 HydrophobicContact CB-CG 3.82Å; A18-R23 PolarHBondContact O-NE 3.24Å
19T80.7Confident67Low66 Ų6691.4 Ų91.441%0.40546%0.458SS..  trans-61.5157.1171.358.70000110.7E21 E22 R23T19-E21 PolarHBondContact O-N 3.3Å; T19-E22 PolarHBondContact N-OE2 2.76Å; T19-E22 PolarHBondContact O-N 3.26Å; T19-E22 VanDerWaalsContact O-N 3.15Å; T19-E22 WeakPolarHBondContact OG1-CB 3.33Å; T19-E22 WeakPolarHBondContact OG1-CG 3.41Å; T19-E22 PolarHBondContact OG1-N 3.02Å; T19-E22 PolarHBondContact OG1-OE2 3.11Å; T19-R23 WeakPolarHBondContact O-CG 3.31Å; T19-R23 PolarHBondContact O-N 3.29Å
20P80.5Confident69.9Low93 Ų9384.5 Ų84.560%0.60443%0.426SS*.Hα-helixtrans-53.4-38.3177.7-27.335.5000113.4R23 E24P20-R23 WeakPolarHBondContact O-CB 3.21Å; P20-R23 PolarHBondContact O-N 3.21Å; P20-E24 PolarHBondContact O-N 2.84Å
21E83.2Confident72.6Confident151 Ų15178.2 Ų78.271%0.70639%0.392SS*.Hα-helixtrans-67.5-42.2178.1-66169.3179.400112.4T19 R23 E24 E25T19-E21 PolarHBondContact O-N 3.3Å; E21-R23 VanDerWaalsContact C-N 3.31Å; E21-R23 PolarHBondContact O-N 3.37Å; E21-E24 PolarHBondContact O-N 3.49Å; E21-E25 WeakPolarHBondContact O-CB 3.47Å; E21-E25 PolarHBondContact O-N 2.94Å
22E87.2Confident75.2Confident110 Ų11082.1 Ų82.151%0.51440%0.397SS..Hα-helixtrans-65.7-35.6174.9-73.3166.9150.200111.8A18 T19 L26A18-E22 WeakPolarHBondContact CA-OE2 3.43Å; A18-E22 HydrophobicContact CB-CB 4.08Å; T19-E22 PolarHBondContact N-OE2 2.76Å; T19-E22 PolarHBondContact O-N 3.26Å; T19-E22 VanDerWaalsContact O-N 3.15Å; T19-E22 WeakPolarHBondContact OG1-CB 3.33Å; T19-E22 WeakPolarHBondContact OG1-CG 3.41Å; T19-E22 PolarHBondContact OG1-N 3.02Å; T19-E22 PolarHBondContact OG1-OE2 3.11Å; E22-L26 VanDerWaalsContact O-CB 3.3Å; E22-L26 WeakPolarHBondContact O-CB 3.5Å; E22-L26 PolarHBondContact O-N 3.08Å
23R87.7Confident78Confident74 Ų7479.4 Ų79.428%0.27938%0.375SS..Hα-helixtrans-65.3-44.7174.6-70.2175.4175.7175.22111.3Q15 A18 T19 P20 E21 L26 F27Q15-R23 PolarHBondContact O-NE 3.23Å; Q15-R23 VanDerWaalsContact O-NE 3.1Å; Q15-R23 PolarHBondContact O-NH2 3.5Å; A18-R23 HydrophobicContact CB-CG 3.82Å; A18-R23 PolarHBondContact O-NE 3.24Å; T19-R23 WeakPolarHBondContact O-CG 3.31Å; T19-R23 PolarHBondContact O-N 3.29Å; P20-R23 WeakPolarHBondContact O-CB 3.21Å; P20-R23 PolarHBondContact O-N 3.21Å; E21-R23 VanDerWaalsContact C-N 3.31Å; E21-R23 PolarHBondContact O-N 3.37Å; R23-L26 PolarHBondContact O-N 2.9Å; R23-F27 WeakPolarHBondContact O-CB 3.42Å; R23-F27 PolarHBondContact O-N 2.97Å
24E90.4Very high81Confident24 Ų2470.9 Ų70.911%0.11234%0.338CS..Hα-helixtrans-59.7-47.8175.5-168.8-167.2-170.200111.1P20 E21 L26 F27 I28 T73 R75 I76P20-E24 PolarHBondContact O-N 2.84Å; E21-E24 PolarHBondContact O-N 3.49Å; E24-L26 PolarHBondContact O-N 3.42Å; E24-F27 WeakPolarHBondContact O-CB 3.28Å; E24-F27 PolarHBondContact O-N 3.3Å; E24-I28 HydrophobicContact CG-CD1 4.31Å; E24-I28 WeakPolarHBondContact O-CG1 3.34Å; E24-I28 PolarHBondContact O-N 3.29Å; E24-T73 HydrophobicContact CG-CG2 4.5Å; E24-T73 VanDerWaalsContact OE1-CB 3.25Å; E24-T73 WeakPolarHBondContact OE1-CB 3.37Å; E24-T73 PolarHBondContact OE1-OG1 2.96Å; E24-R75 WeakPolarHBondContact OE1-CB 3.27Å; E24-R75 IonicContact OE2-NH1 3.42Å; E24-R75 PolarHBondContact OE2-NH1 2.74Å; E24-I76 HydrophobicContact CG-CD1 3.7Å; E24-I76 HydrophobicContact CG-CG1 4.28Å
25E92.6Very high83.7Confident63 Ų6369.1 Ų69.129%0.29432%0.324SS..Hα-helixtrans-66-39.9-179.5-171.959.1-144.700112.1E21 F27 I28 Q29 R75E21-E25 WeakPolarHBondContact O-CB 3.47Å; E21-E25 PolarHBondContact O-N 2.94Å; E25-F27 VanDerWaalsContact C-N 3.32Å; E25-F27 PolarHBondContact O-N 3.28Å; E25-I28 PolarHBondContact O-N 3.21Å; E25-Q29 WeakPolarHBondContact O-CG 3.29Å; E25-Q29 PolarHBondContact O-N 2.92Å; E25-R75 IonicContact OE2-CZ 2.8Å; E25-R75 IonicContact OE2-NH2 3.26Å; E25-R75 PolarHBondContact OE2-NH2 2.84Å
26L92.1Very high86Confident47 Ų4768 Ų6825%0.24632%0.323CS..Hα-helixtrans-63.2-39.8173.8-177.164.7000111.5Q15 E22 R23 E24 Q29 K30Q15-L26 HydrophobicContact CG-CD2 4.26Å; E22-L26 VanDerWaalsContact O-CB 3.3Å; E22-L26 WeakPolarHBondContact O-CB 3.5Å; E22-L26 PolarHBondContact O-N 3.08Å; R23-L26 PolarHBondContact O-N 2.9Å; E24-L26 PolarHBondContact O-N 3.42Å; L26-Q29 PolarHBondContact O-N 3.47Å; L26-K30 PolarHBondContact O-N 3.22Å
27F93.1Very high88.1Confident8 Ų861.7 Ų61.74%0.03531%0.307CS..Hα-helixtrans-63.1-45.1176.6-173.4-101.7000111.4R23 E24 E25 Q29 K30 I31 L61 Y64 V65 I71 I76 F125R23-F27 WeakPolarHBondContact O-CB 3.42Å; R23-F27 PolarHBondContact O-N 2.97Å; E24-F27 WeakPolarHBondContact O-CB 3.28Å; E24-F27 PolarHBondContact O-N 3.3Å; E25-F27 VanDerWaalsContact C-N 3.32Å; E25-F27 PolarHBondContact O-N 3.28Å; F27-Q29 VanDerWaalsContact C-N 3.34Å; F27-Q29 PolarHBondContact O-N 3.46Å; F27-K30 PolarHBondContact O-N 2.97Å; F27-I31 HydrophobicContact CD1-CD1 3.57Å; F27-I31 HydrophobicContact CD1-CG1 4.43Å; F27-I31 HydrophobicContact CE1-CD1 3.26Å; F27-I31 HydrophobicContact CE1-CG1 4.2Å; F27-I31 HydrophobicContact CG-CD1 4.48Å; F27-I31 HydrophobicContact CZ-CD1 3.93Å; F27-I31 HydrophobicContact CZ-CG1 4.49Å; F27-I31 WeakPolarHBondContact O-CG1 3.37Å; F27-I31 PolarHBondContact O-N 2.97Å; F27-L61 HydrophobicContact CD2-CD2 3.44Å; F27-L61 VanDerWaalsContact CD2-CD2 3.44Å; F27-L61 HydrophobicContact CE2-CB 4.44Å; F27-L61 HydrophobicContact CE2-CD2 3.24Å; F27-L61 HydrophobicContact CE2-CG 4.44Å; F27-L61 HydrophobicContact CG-CD2 4.27Å; F27-L61 HydrophobicContact CZ-CD2 3.94Å; F27-Y64 AromaticContact CD2-CD1 3.57Å; F27-Y64 HydrophobicContact CD2-CD1 3.57Å; F27-Y64 HydrophobicContact CD2-CE1 4.05Å; F27-Y64 HydrophobicContact CD2-CG 4.38Å; F27-Y64 AromaticContact CE2-CD1 3.69Å; F27-Y64 HydrophobicContact CE2-CD1 3.69Å; F27-Y64 HydrophobicContact CE2-CG 4.43Å; F27-V65 HydrophobicContact CE1-CG2 4.49Å; F27-V65 HydrophobicContact CE2-CG2 3.95Å; F27-V65 HydrophobicContact CZ-CG2 3.45Å; F27-V65 VanDerWaalsContact CZ-CG2 3.45Å; F27-I71 HydrophobicContact CB-CD1 3.98Å; F27-I71 HydrophobicContact CD1-CD1 3.94Å; F27-I71 HydrophobicContact CD1-CG1 3.69Å; F27-I71 HydrophobicContact CD2-CG1 4.25Å; F27-I71 HydrophobicContact CE1-CG1 3.85Å; F27-I71 HydrophobicContact CE2-CG1 4.41Å; F27-I71 HydrophobicContact CG-CD1 3.93Å; F27-I71 HydrophobicContact CG-CG1 3.9Å; F27-I71 HydrophobicContact CZ-CG1 4.25Å; F27-I76 HydrophobicContact CD1-CD1 3.67Å; F27-I76 HydrophobicContact CD1-CG1 4.19Å; F27-I76 HydrophobicContact CD1-CG2 4.24Å; F27-I76 HydrophobicContact CE1-CD1 4.14Å; F27-I76 HydrophobicContact CE1-CG2 3.76Å; F27-F125 HydrophobicContact CZ-CE2 4.29Å; F27-F125 HydrophobicContact CZ-CZ 4.13Å
28I94.3Very high90Very high3 Ų353.7 Ų53.72%0.01527%0.273CS..Hα-helixtrans-59.3-44.2173.5-69.2169.3000111.1E24 E25 K30 I31 R32 R75 I76 E79E24-I28 HydrophobicContact CG-CD1 4.31Å; E24-I28 WeakPolarHBondContact O-CG1 3.34Å; E24-I28 PolarHBondContact O-N 3.29Å; E25-I28 PolarHBondContact O-N 3.21Å; I28-K30 VanDerWaalsContact C-N 3.33Å; I28-K30 PolarHBondContact O-N 3.42Å; I28-I31 PolarHBondContact O-N 3.28Å; I28-R32 HydrophobicContact CG2-CG 4.49Å; I28-R32 WeakPolarHBondContact O-CG 3.48Å; I28-R32 PolarHBondContact O-N 2.9Å; I28-R75 HydrophobicContact CD1-CB 4.25Å; I28-I76 HydrophobicContact CD1-CG1 4.29Å; I28-I76 HydrophobicContact CG1-CG1 3.96Å; I28-E79 HydrophobicContact CG1-CG 4.41Å; I28-E79 HydrophobicContact CG2-CG 4Å
29Q94.6Very high91Very high73 Ų7356.4 Ų56.434%0.34128%0.284SS..Hα-helixtrans-60.5-42177.4-74176.430.200112.1E25 L26 F27 R32 L33E25-Q29 WeakPolarHBondContact O-CG 3.29Å; E25-Q29 PolarHBondContact O-N 2.92Å; L26-Q29 PolarHBondContact O-N 3.47Å; F27-Q29 VanDerWaalsContact C-N 3.34Å; F27-Q29 PolarHBondContact O-N 3.46Å; Q29-R32 PolarHBondContact O-N 3.21Å; Q29-L33 WeakPolarHBondContact O-CB 3.47Å; Q29-L33 PolarHBondContact O-N 2.92Å
30K94.8Very high91.4Very high23 Ų2354.9 Ų54.910%0.127%0.272CS..Hα-helixtrans-64.7-40.8175.3-75.2-172.3176.6-168.30112.2L26 F27 I28 L33 C34 T57 E60 L61L26-K30 PolarHBondContact O-N 3.22Å; F27-K30 PolarHBondContact O-N 2.97Å; I28-K30 VanDerWaalsContact C-N 3.33Å; I28-K30 PolarHBondContact O-N 3.42Å; K30-L33 WeakPolarHBondContact O-CB 3.43Å; K30-L33 PolarHBondContact O-N 3.46Å; K30-C34 PolarHBondContact O-N 3.29Å; K30-C34 VanDerWaalsContact O-N 3.08Å; K30-C34 PolarHBondContact O-SG 3.3Å; K30-C34 VanDerWaalsContact O-SG 3.38Å; K30-T57 HydrophobicContact CB-CG2 3.9Å; K30-T57 HydrophobicContact CD-CG2 4.15Å; K30-T57 HydrophobicContact CG-CG2 4.02Å; K30-E60 IonicContact NZ-OE2 2.62Å; K30-E60 PolarHBondContact NZ-OE2 3.24Å; K30-L61 HydrophobicContact CB-CD1 4.31Å; K30-L61 HydrophobicContact CB-CD2 3.76Å; K30-L61 HydrophobicContact CB-CG 4.24Å; K30-L61 HydrophobicContact CD-CD2 4.44Å
31I95.4Very high91.7Very high0 Ų054.5 Ų54.50%027%0.271CS..Hα-helixtrans-61.1-46.8175.1-70.2167.2000111.3F27 I28 L33 C34 T35 L61 I76 E79 V80 M83F27-I31 HydrophobicContact CD1-CD1 3.57Å; F27-I31 HydrophobicContact CD1-CG1 4.43Å; F27-I31 HydrophobicContact CE1-CD1 3.26Å; F27-I31 HydrophobicContact CE1-CG1 4.2Å; F27-I31 HydrophobicContact CG-CD1 4.48Å; F27-I31 HydrophobicContact CZ-CD1 3.93Å; F27-I31 HydrophobicContact CZ-CG1 4.49Å; F27-I31 WeakPolarHBondContact O-CG1 3.37Å; F27-I31 PolarHBondContact O-N 2.97Å; I28-I31 PolarHBondContact O-N 3.28Å; I31-L33 VanDerWaalsContact C-N 3.25Å; I31-L33 PolarHBondContact O-N 3.31Å; I31-C34 CarbonylContact O-C 3.5Å; I31-C34 PolarHBondContact O-N 3.14Å; I31-C34 VanDerWaalsContact O-N 3.1Å; I31-T35 PolarHBondContact O-N 2.94Å; I31-T35 VanDerWaalsContact O-N 3.1Å; I31-T35 PolarHBondContact O-OG1 3.44Å; I31-L61 HydrophobicContact CG1-CD1 4.19Å; I31-L61 HydrophobicContact CG1-CD2 4.17Å; I31-I76 HydrophobicContact CD1-CG2 4.33Å; I31-E79 HydrophobicContact CD1-CB 4.49Å; I31-E79 HydrophobicContact CG2-CB 3.96Å; I31-E79 VanDerWaalsContact CG2-O 3.32Å; I31-E79 WeakPolarHBondContact CG2-O 3.37Å; I31-V80 HydrophobicContact CD1-CG2 3.62Å; I31-M83 HydrophobicContact CG2-CB 3.58Å; I31-M83 HydrophobicContact CG2-CG 4Å
32R95.6Very high91.8Very high126 Ų12651.9 Ų51.948%0.47527%0.269SS..Hα-helixtrans-61.2-36.7177.9-72.3175.6177.5170.5-0112I28 Q29 C34 T35 E79I28-R32 HydrophobicContact CG2-CG 4.49Å; I28-R32 WeakPolarHBondContact O-CG 3.48Å; I28-R32 PolarHBondContact O-N 2.9Å; Q29-R32 PolarHBondContact O-N 3.21Å; R32-C34 VanDerWaalsContact C-N 3.35Å; R32-T35 VanDerWaalsContact O-CB 3.26Å; R32-T35 WeakPolarHBondContact O-CB 3.48Å; R32-T35 PolarHBondContact O-N 2.84Å; R32-T35 PolarHBondContact O-OG1 3.22Å; R32-E79 VanDerWaalsContact CG-OE2 3.26Å; R32-E79 WeakPolarHBondContact CG-OE2 3.47Å; R32-E79 IonicContact CZ-OE1 3.21Å; R32-E79 IonicContact CZ-OE2 3.87Å; R32-E79 IonicContact NE-OE1 2.81Å; R32-E79 PolarHBondContact NE-OE1 2.89Å; R32-E79 IonicContact NE-OE2 3.57Å; R32-E79 PolarHBondContact NE-OE2 3.44Å; R32-E79 IonicContact NH2-OE1 2.87Å; R32-E79 PolarHBondContact NH2-OE1 3.13Å; R32-E79 IonicContact NH2-OE2 3.52Å
33L93.7Very high91.6Very high50 Ų5050.4 Ų50.426%0.26227%0.265SS..Hα-helixtrans-61.9-43.5174.4-168.165.7000111.8W3 Q29 K30 I31 T35 V36W3-L33 HydrophobicContact CD2-CD1 3.74Å; W3-L33 HydrophobicContact CE3-CD1 3.91Å; W3-L33 HydrophobicContact CH2-CD1 3.45Å; W3-L33 VanDerWaalsContact CH2-CD1 3.45Å; W3-L33 HydrophobicContact CH2-CD2 3.33Å; W3-L33 HydrophobicContact CH2-CG 3.26Å; W3-L33 HydrophobicContact CZ2-CD1 3.22Å; W3-L33 HydrophobicContact CZ2-CD2 3.93Å; W3-L33 HydrophobicContact CZ2-CG 3.28Å; W3-L33 HydrophobicContact CZ3-CD1 3.76Å; W3-L33 HydrophobicContact CZ3-CD2 3.71Å; W3-L33 HydrophobicContact CZ3-CG 3.94Å; Q29-L33 WeakPolarHBondContact O-CB 3.47Å; Q29-L33 PolarHBondContact O-N 2.92Å; K30-L33 WeakPolarHBondContact O-CB 3.43Å; K30-L33 PolarHBondContact O-N 3.46Å; I31-L33 VanDerWaalsContact C-N 3.25Å; I31-L33 PolarHBondContact O-N 3.31Å; L33-T35 PolarHBondContact O-N 3.13Å; L33-V36 PolarHBondContact O-N 2.86Å
34C96.5Very high91.4Very high0 Ų050.6 Ų50.60%028%0.276CS..Hα-helixtrans-71.4-10.6176.7-65.90000114.2K30 I31 R32 V36 K54 L58 M83 N87K30-C34 PolarHBondContact O-N 3.29Å; K30-C34 VanDerWaalsContact O-N 3.08Å; K30-C34 PolarHBondContact O-SG 3.3Å; K30-C34 VanDerWaalsContact O-SG 3.38Å; I31-C34 CarbonylContact O-C 3.5Å; I31-C34 PolarHBondContact O-N 3.14Å; I31-C34 VanDerWaalsContact O-N 3.1Å; R32-C34 VanDerWaalsContact C-N 3.35Å; C34-V36 PolarHBondContact O-N 3.42Å; C34-K54 VanDerWaalsContact O-CE 3.23Å; C34-K54 WeakPolarHBondContact O-CE 3.41Å; C34-K54 PolarHBondContact O-NZ 3.44Å; C34-L58 HydrophobicContact CB-CD2 3.81Å; C34-L58 HydrophobicContact CB-CG 4.25Å; C34-M83 HydrophobicContact CB-CG 4.11Å; C34-M83 HydrophobicContact CB-SD 4.33Å; C34-N87 PolarHBondContact O-ND2 3.36Å
35T95.9Very high91.2Very high31 Ų3156 Ų5619%0.1931%0.305CS..THydrogen-bonded Turntrans-72.2-19174.8-52.70000111.8I31 R32 L33 V37 A86I31-T35 PolarHBondContact O-N 2.94Å; I31-T35 VanDerWaalsContact O-N 3.1Å; I31-T35 PolarHBondContact O-OG1 3.44Å; R32-T35 VanDerWaalsContact O-CB 3.26Å; R32-T35 WeakPolarHBondContact O-CB 3.48Å; R32-T35 PolarHBondContact O-N 2.84Å; R32-T35 PolarHBondContact O-OG1 3.22Å; L33-T35 PolarHBondContact O-N 3.13Å; T35-V37 PolarHBondContact O-N 2.9Å; T35-A86 HydrophobicContact CG2-CB 3.62Å
36V93.6Very high91Very high58 Ų5854.3 Ų54.335%0.35230%0.3SS..SBendtrans-71.3118.7176.1-178.60000109.9L33 C34 F38 K54L33-V36 PolarHBondContact O-N 2.86Å; C34-V36 PolarHBondContact O-N 3.42Å; V36-F38 HydrophobicContact CG1-CE2 4.38Å; V36-F38 HydrophobicContact CG1-CZ 4.35Å; V36-K54 PolarHBondContact O-NZ 2.84Å
37V92.2Very high90.8Very high87 Ų8756.1 Ų56.153%0.52731%0.31SS..  trans-84.3137.4176.4-175.70000109.9T35 A86T35-V37 PolarHBondContact O-N 2.9Å; V37-A86 VanDerWaalsContact CG2-O 3.25Å; V37-A86 WeakPolarHBondContact CG2-O 3.42Å
38F90.2Very high90.6Very high19 Ų1960.5 Ų60.58%0.08333%0.333CS..  trans-109.9143.8175-68.6-87.4000109.4W3 V36 F40 D47 F50 K51 K54 H118W3-F38 HydrophobicContact CZ2-CZ 4.42Å; V36-F38 HydrophobicContact CG1-CE2 4.38Å; V36-F38 HydrophobicContact CG1-CZ 4.35Å; F38-F40 HydrophobicContact CB-CE2 4.01Å; F38-F40 WeakPolarHBondContact O-CD2 3.41Å; F38-D47 HydrophobicContact CD1-CB 3.96Å; F38-D47 HydrophobicContact CE1-CB 4.07Å; F38-F50 HydrophobicContact CE1-CB 3.52Å; F38-F50 HydrophobicContact CZ-CB 3.6Å; F38-K51 HydrophobicContact CB-CG 3.93Å; F38-K51 HydrophobicContact CD1-CG 4.09Å; F38-K51 HydrophobicContact CG-CG 3.94Å; F38-K54 HydrophobicContact CD2-CD 3.76Å; F38-K54 HydrophobicContact CE2-CB 4.04Å; F38-K54 HydrophobicContact CE2-CD 3.68Å; F38-H118 AromaticContact CD2-CE1 3.76Å
39D87.6Confident90.5Very high78 Ų7863.8 Ų63.842%0.41736%0.357SS..  trans-84.7126.9175.4-169.1-11.2000110.2S41 S42 K51D39-S41 PolarHBondContact OD1-N 2.89Å; D39-S42 VanDerWaalsContact CG-OG 3.31Å; D39-S42 PolarHBondContact OD1-N 3.12Å; D39-S42 VanDerWaalsContact OD1-N 3.11Å; D39-S42 VanDerWaalsContact OD2-CB 3.32Å; D39-S42 WeakPolarHBondContact OD2-CB 3.35Å; D39-S42 PolarHBondContact OD2-OG 3.49Å; D39-K51 WeakPolarHBondContact O-CE 3.41Å; D39-K51 PolarHBondContact O-NZ 3.22Å
40F88.7Confident90.4Very high35 Ų3563.1 Ų63.115%0.15435%0.352CS..SBendtrans-109-13.3175.8-73.5-97.6000112.6F38 K51 A114 H118F38-F40 HydrophobicContact CB-CE2 4.01Å; F38-F40 WeakPolarHBondContact O-CD2 3.41Å; F40-K51 HydrophobicContact CD1-CD 4.29Å; F40-K51 HydrophobicContact CE1-CD 3.72Å; F40-K51 HydrophobicContact CE1-CG 4.26Å; F40-K51 HydrophobicContact CE2-CD 4.43Å; F40-K51 HydrophobicContact CE2-CG 4.42Å; F40-K51 HydrophobicContact CZ-CB 4.34Å; F40-K51 HydrophobicContact CZ-CD 3.81Å; F40-K51 HydrophobicContact CZ-CG 3.85Å; F40-A114 HydrophobicContact CB-CB 3.89Å; F40-A114 WeakPolarHBondContact CB-O 3.24Å; F40-H118 AromaticContact CE2-CE1 3.88Å; F40-H118 AromaticContact CE2-CG 4Å; F40-H118 AromaticContact CE2-ND1 3.59Å; F40-H118 AromaticContact CZ-CD2 3.99Å; F40-H118 AromaticContact CZ-CE1 3.61Å; F40-H118 AromaticContact CZ-CG 3.91Å; F40-H118 AromaticContact CZ-ND1 3.72Å; F40-H118 AromaticContact CZ-NE2 3.81Å
41S85.8Confident90.3Very high85 Ų8562.5 Ų62.559%0.59435%0.35SS*.SBendtrans-94.1-50.3-170.4-54.20000111.6D39D39-S41 PolarHBondContact OD1-N 2.89Å
42S85.1Confident90.2Very high95 Ų9566.6 Ų66.666%0.66437%0.369SS*.SBendtrans-79.3-36.9-174.975.10000113.1D39D39-S42 VanDerWaalsContact CG-OG 3.31Å; D39-S42 PolarHBondContact OD1-N 3.12Å; D39-S42 VanDerWaalsContact OD1-N 3.11Å; D39-S42 VanDerWaalsContact OD2-CB 3.32Å; D39-S42 WeakPolarHBondContact OD2-CB 3.35Å; D39-S42 PolarHBondContact OD2-OG 3.49Å
43D83.1Confident90.2Very high79 Ų7963.8 Ų63.842%0.42236%0.363SS..  trans-138.787176.7-170.5-10.4000110.5L45 S46 K51D43-L45 PolarHBondContact O-N 2.89Å; D43-L45 PolarHBondContact OD1-N 2.91Å; D43-S46 PolarHBondContact O-N 3.46Å; D43-S46 PolarHBondContact O-OG 3.43Å; D43-S46 PolarHBondContact OD1-N 3.16Å; D43-S46 VanDerWaalsContact OD1-N 3.17Å; D43-S46 WeakPolarHBondContact OD2-CB 3.4Å; D43-K51 PolarHBondContact O-NZ 3.47Å
44P83.4Confident90.3Very high79 Ų7961.5 Ų61.551%0.51335%0.351SS..THydrogen-bonded Turntrans-59.3-29.3-177.9-25.133.9000113.6K51P44-K51 PolarHBondContact O-NZ 3.38Å
45L86Confident90.3Very high137 Ų13766.2 Ų66.272%0.71737%0.368SS*.THydrogen-bonded Turntrans-94.2-2.2-174.9-62.1175.9000113.2D43 L48D43-L45 PolarHBondContact O-N 2.89Å; D43-L45 PolarHBondContact OD1-N 2.91Å; L45-L48 HydrophobicContact CD2-CD1 4.47Å; L45-L48 WeakPolarHBondContact O-CG 3.41Å
46S88.9Confident90.3Very high27 Ų2767.4 Ų67.419%0.18938%0.376CS..THydrogen-bonded Turntrans-70.5148.8173.566.60000112D43 L48 K51D43-S46 PolarHBondContact O-N 3.46Å; D43-S46 PolarHBondContact O-OG 3.43Å; D43-S46 PolarHBondContact OD1-N 3.16Å; D43-S46 VanDerWaalsContact OD1-N 3.17Å; D43-S46 WeakPolarHBondContact OD2-CB 3.4Å; S46-L48 PolarHBondContact O-N 3.23Å; S46-K51 WeakPolarHBondContact O-CD 3.4Å; S46-K51 WeakPolarHBondContact O-CE 3.39Å; S46-K51 PolarHBondContact O-NZ 2.97Å; S46-K51 PolarHBondContact OG-NZ 2.97Å
47D87.4Confident90.4Very high85 Ų8565.2 Ų65.246%0.45536%0.362SS..THydrogen-bonded Turntrans51.828.7168.2-67-36.8000115.5F38 S49 F50 K51F38-D47 HydrophobicContact CD1-CB 3.96Å; F38-D47 HydrophobicContact CE1-CB 4.07Å; D47-S49 PolarHBondContact O-N 2.97Å; D47-S49 VanDerWaalsContact O-N 3.12Å; D47-F50 HydrophobicContact CB-CB 4.37Å; D47-F50 HydrophobicContact CB-CD2 4.16Å; D47-F50 PolarHBondContact O-N 3.45Å; D47-K51 PolarHBondContact O-N 3.32Å
48L90Very high90.6Very high101 Ų10161 Ų6153%0.52934%0.337SS..Hα-helixtrans-51.5-41.8-175.2-69172.7000113L45 S46 K51 E52L45-L48 HydrophobicContact CD2-CD1 4.47Å; L45-L48 WeakPolarHBondContact O-CG 3.41Å; S46-L48 PolarHBondContact O-N 3.23Å; L48-K51 PolarHBondContact O-N 2.94Å; L48-E52 WeakPolarHBondContact O-CB 3.16Å; L48-E52 PolarHBondContact O-N 3.25Å
49S92.6Very high90.9Very high72 Ų7262.2 Ų62.250%0.50334%0.344SS..Hα-helixtrans-63.6-44.5177.156.20000112.2D47 E52 I53D47-S49 PolarHBondContact O-N 2.97Å; D47-S49 VanDerWaalsContact O-N 3.12Å; S49-E52 PolarHBondContact O-N 2.72Å; S49-I53 VanDerWaalsContact O-CG1 3.26Å; S49-I53 WeakPolarHBondContact O-CG1 3.46Å; S49-I53 PolarHBondContact O-N 3.08Å
50F92Very high91.2Very high58 Ų5861.9 Ų61.925%0.25434%0.341SS..Hα-helixtrans-72.7-35179.7-59.3-65.9000112.2W3 F38 D47 E52 I53 K54W3-F50 HydrophobicContact CB-CD1 3.91Å; W3-F50 HydrophobicContact CB-CE1 3.67Å; W3-F50 HydrophobicContact CB-CZ 4.34Å; W3-F50 AromaticContact CD2-CD1 3.94Å; W3-F50 HydrophobicContact CD2-CD1 3.94Å; W3-F50 HydrophobicContact CD2-CE1 4.48Å; W3-F50 AromaticContact CE3-CD1 3.83Å; W3-F50 HydrophobicContact CE3-CD1 3.83Å; W3-F50 HydrophobicContact CE3-CE1 4.31Å; W3-F50 HydrophobicContact CG-CD1 4.04Å; W3-F50 HydrophobicContact CG-CE1 4.3Å; F38-F50 HydrophobicContact CE1-CB 3.52Å; F38-F50 HydrophobicContact CZ-CB 3.6Å; D47-F50 HydrophobicContact CB-CB 4.37Å; D47-F50 HydrophobicContact CB-CD2 4.16Å; D47-F50 PolarHBondContact O-N 3.45Å; F50-E52 VanDerWaalsContact C-N 3.3Å; F50-E52 PolarHBondContact O-N 3.3Å; F50-I53 HydrophobicContact CD1-CD1 4.26Å; F50-I53 PolarHBondContact O-N 2.9Å; F50-K54 PolarHBondContact O-N 3.07Å
51K92.5Very high91.5Very high10 Ų1060.3 Ų60.34%0.04333%0.334CS..Hα-helixtrans-58.2-44.4170.6-75.6171.1171.8160.50110.6F38 D39 F40 D43 P44 S46 D47 L48 K54 R55 H118F38-K51 HydrophobicContact CB-CG 3.93Å; F38-K51 HydrophobicContact CD1-CG 4.09Å; F38-K51 HydrophobicContact CG-CG 3.94Å; D39-K51 WeakPolarHBondContact O-CE 3.41Å; D39-K51 PolarHBondContact O-NZ 3.22Å; F40-K51 HydrophobicContact CD1-CD 4.29Å; F40-K51 HydrophobicContact CE1-CD 3.72Å; F40-K51 HydrophobicContact CE1-CG 4.26Å; F40-K51 HydrophobicContact CE2-CD 4.43Å; F40-K51 HydrophobicContact CE2-CG 4.42Å; F40-K51 HydrophobicContact CZ-CB 4.34Å; F40-K51 HydrophobicContact CZ-CD 3.81Å; F40-K51 HydrophobicContact CZ-CG 3.85Å; D43-K51 PolarHBondContact O-NZ 3.47Å; P44-K51 PolarHBondContact O-NZ 3.38Å; S46-K51 WeakPolarHBondContact O-CD 3.4Å; S46-K51 WeakPolarHBondContact O-CE 3.39Å; S46-K51 PolarHBondContact O-NZ 2.97Å; S46-K51 PolarHBondContact OG-NZ 2.97Å; D47-K51 PolarHBondContact O-N 3.32Å; L48-K51 PolarHBondContact O-N 2.94Å; K51-K54 PolarHBondContact O-N 2.94Å; K51-R55 PolarHBondContact O-N 3.02Å; K51-H118 PolarHBondContact O-CE1 2.89Å; K51-H118 PolarHBondContact O-NE2 3.42Å
52E93.9Very high91.8Very high86 Ų8657.1 Ų57.140%0.40231%0.31SS..Hα-helixtrans-68.9-40.7177.7-175.557.9-165.600112.4L48 S49 F50 K54 R55 T56L48-E52 WeakPolarHBondContact O-CB 3.16Å; L48-E52 PolarHBondContact O-N 3.25Å; S49-E52 PolarHBondContact O-N 2.72Å; F50-E52 VanDerWaalsContact C-N 3.3Å; F50-E52 PolarHBondContact O-N 3.3Å; E52-K54 VanDerWaalsContact C-N 3.33Å; E52-K54 PolarHBondContact O-N 3.34Å; E52-R55 VanDerWaalsContact CD-NE 3.35Å; E52-R55 WeakPolarHBondContact O-CB 3.4Å; E52-R55 PolarHBondContact O-N 3.47Å; E52-R55 VanDerWaalsContact O-N 3.15Å; E52-R55 IonicContact OE1-CZ 2.74Å; E52-R55 IonicContact OE1-NE 2.79Å; E52-R55 PolarHBondContact OE1-NE 3.32Å; E52-R55 VanDerWaalsContact OE1-NE 3.16Å; E52-R55 IonicContact OE1-NH2 3.72Å; E52-R55 PolarHBondContact OE1-NH2 3.13Å; E52-R55 IonicContact OE2-CZ 3.33Å; E52-R55 IonicContact OE2-NE 3.16Å; E52-R55 PolarHBondContact OE2-NE 2.74Å; E52-R55 IonicContact OE2-NH2 2.68Å; E52-T56 PolarHBondContact O-N 3.4Å; E52-T56 PolarHBondContact O-OG1 2.86Å
53I94.9Very high92.1Very high68 Ų6859.2 Ų59.235%0.34931%0.309SS..Hα-helixtrans-61.5-42.6176.1-63.1159.9000110.9W3 S49 F50 R55 T56 T57W3-I53 HydrophobicContact CH2-CB 4.13Å; W3-I53 HydrophobicContact CH2-CG2 3.67Å; W3-I53 HydrophobicContact CZ3-CB 4.03Å; W3-I53 HydrophobicContact CZ3-CD1 4.29Å; W3-I53 HydrophobicContact CZ3-CG2 3.5Å; W3-I53 VanDerWaalsContact CZ3-CG2 3.5Å; S49-I53 VanDerWaalsContact O-CG1 3.26Å; S49-I53 WeakPolarHBondContact O-CG1 3.46Å; S49-I53 PolarHBondContact O-N 3.08Å; F50-I53 HydrophobicContact CD1-CD1 4.26Å; F50-I53 PolarHBondContact O-N 2.9Å; I53-R55 VanDerWaalsContact C-N 3.34Å; I53-R55 PolarHBondContact O-N 2.85Å; I53-T56 PolarHBondContact O-N 2.75Å; I53-T57 WeakPolarHBondContact O-CB 3.39Å; I53-T57 PolarHBondContact O-N 3.49Å; I53-T57 PolarHBondContact O-OG1 3.3Å
54K96.6Very high92.4Very high2 Ų257.1 Ų57.11%0.00930%0.295CS..Hα-helixtrans-61.3-42.9174.9178.6170.5169.6-171.70111.4C34 V36 F38 F50 K51 E52 T56 T57 L58 N87C34-K54 VanDerWaalsContact O-CE 3.23Å; C34-K54 WeakPolarHBondContact O-CE 3.41Å; C34-K54 PolarHBondContact O-NZ 3.44Å; V36-K54 PolarHBondContact O-NZ 2.84Å; F38-K54 HydrophobicContact CD2-CD 3.76Å; F38-K54 HydrophobicContact CE2-CB 4.04Å; F38-K54 HydrophobicContact CE2-CD 3.68Å; F50-K54 PolarHBondContact O-N 3.07Å; K51-K54 PolarHBondContact O-N 2.94Å; E52-K54 VanDerWaalsContact C-N 3.33Å; E52-K54 PolarHBondContact O-N 3.34Å; K54-T56 PolarHBondContact O-N 2.96Å; K54-T57 PolarHBondContact O-N 3.36Å; K54-L58 HydrophobicContact CG-CD1 4.01Å; K54-L58 HydrophobicContact CG-CG 4.42Å; K54-L58 WeakPolarHBondContact O-CG 3.5Å; K54-L58 PolarHBondContact O-N 3.24Å; K54-N87 PolarHBondContact NZ-OD1 3.36Å
55R95.7Very high92.7Very high98 Ų9853.8 Ų53.837%0.3727%0.273SS..Hα-helixtrans-58.1-49.6177.2-166.5-171.173.587.73.4111.5K51 E52 I53 L58 N59 L121K51-R55 PolarHBondContact O-N 3.02Å; E52-R55 VanDerWaalsContact CD-NE 3.35Å; E52-R55 WeakPolarHBondContact O-CB 3.4Å; E52-R55 PolarHBondContact O-N 3.47Å; E52-R55 VanDerWaalsContact O-N 3.15Å; E52-R55 IonicContact OE1-CZ 2.74Å; E52-R55 IonicContact OE1-NE 2.79Å; E52-R55 PolarHBondContact OE1-NE 3.32Å; E52-R55 VanDerWaalsContact OE1-NE 3.16Å; E52-R55 IonicContact OE1-NH2 3.72Å; E52-R55 PolarHBondContact OE1-NH2 3.13Å; E52-R55 IonicContact OE2-CZ 3.33Å; E52-R55 IonicContact OE2-NE 3.16Å; E52-R55 PolarHBondContact OE2-NE 2.74Å; E52-R55 IonicContact OE2-NH2 2.68Å; I53-R55 VanDerWaalsContact C-N 3.34Å; I53-R55 PolarHBondContact O-N 2.85Å; R55-L58 PolarHBondContact O-N 3.47Å; R55-N59 PolarHBondContact O-N 3.35Å; R55-N59 PolarHBondContact O-ND2 2.96Å; R55-L121 HydrophobicContact CB-CD1 4.47Å; R55-L121 HydrophobicContact CG-CD1 3.66Å
56T96.3Very high92.8Very high56 Ų5650.8 Ų50.834%0.34426%0.264SS..Hα-helixtrans-64.8-41.9178.2-55.20000111.4E52 I53 K54 L58 N59 E60E52-T56 PolarHBondContact O-N 3.4Å; E52-T56 PolarHBondContact O-OG1 2.86Å; I53-T56 PolarHBondContact O-N 2.75Å; K54-T56 PolarHBondContact O-N 2.96Å; T56-L58 PolarHBondContact O-N 3.01Å; T56-N59 PolarHBondContact O-N 3.33Å; T56-E60 WeakPolarHBondContact O-CG 3.49Å; T56-E60 PolarHBondContact O-N 3.01Å
57T96Very high92.8Very high12 Ų1253 Ų537%0.07428%0.284CS..Hα-helixtrans-62.5-41.4178.5-53.60000111.9K30 I53 K54 E60 L61K30-T57 HydrophobicContact CB-CG2 3.9Å; K30-T57 HydrophobicContact CD-CG2 4.15Å; K30-T57 HydrophobicContact CG-CG2 4.02Å; I53-T57 WeakPolarHBondContact O-CB 3.39Å; I53-T57 PolarHBondContact O-N 3.49Å; I53-T57 PolarHBondContact O-OG1 3.3Å; K54-T57 PolarHBondContact O-N 3.36Å; T57-E60 PolarHBondContact O-N 2.85Å; T57-L61 HydrophobicContact CG2-CD1 4.36Å; T57-L61 WeakPolarHBondContact O-CB 3.4Å; T57-L61 VanDerWaalsContact O-CG 3.27Å; T57-L61 WeakPolarHBondContact O-CG 3.23Å; T57-L61 PolarHBondContact O-N 3.47Å
58L96.8Very high92.7Very high0 Ų051.7 Ų51.70%028%0.277CS..Hα-helixtrans-63.7-41.4175.9-76.6168.3000112.2C34 K54 R55 T56 L61 M62 M83 L121 V122C34-L58 HydrophobicContact CB-CD2 3.81Å; C34-L58 HydrophobicContact CB-CG 4.25Å; K54-L58 HydrophobicContact CG-CD1 4.01Å; K54-L58 HydrophobicContact CG-CG 4.42Å; K54-L58 WeakPolarHBondContact O-CG 3.5Å; K54-L58 PolarHBondContact O-N 3.24Å; R55-L58 PolarHBondContact O-N 3.47Å; T56-L58 PolarHBondContact O-N 3.01Å; L58-L61 PolarHBondContact O-N 3.29Å; L58-M62 WeakPolarHBondContact O-CB 3.45Å; L58-M62 PolarHBondContact O-N 3.47Å; L58-M83 HydrophobicContact CD2-CE 4.24Å; L58-M83 HydrophobicContact CD2-SD 4.41Å; L58-L121 HydrophobicContact CB-CB 3.92Å; L58-L121 HydrophobicContact CB-CD1 4.01Å; L58-L121 HydrophobicContact CD1-CB 3.96Å; L58-L121 HydrophobicContact CD1-CD1 4.4Å; L58-L121 HydrophobicContact CG-CB 4.49Å; L58-V122 HydrophobicContact CD1-CG2 3.99Å; L58-V122 HydrophobicContact CD2-CG2 4.14Å
59N95.4Very high92.3Very high43 Ų4354.6 Ų54.623%0.2328%0.281CS..Hα-helixtrans-62-45.8175.1-77.7-66.3000111.6R55 T56 L61 M62 E63R55-N59 PolarHBondContact O-N 3.35Å; R55-N59 PolarHBondContact O-ND2 2.96Å; T56-N59 PolarHBondContact O-N 3.33Å; N59-L61 VanDerWaalsContact C-N 3.34Å; N59-L61 PolarHBondContact O-N 3.15Å; N59-M62 WeakPolarHBondContact O-CB 3.43Å; N59-M62 PolarHBondContact O-N 2.65Å; N59-E63 PolarHBondContact O-N 3.26Å
60E93.9Very high91.8Very high72 Ų7259.1 Ų59.134%0.33629%0.294SS..Hα-helixtrans-60.5-42.8175.9-71.4178.5-175.900112.1K30 T56 T57 M62 Y64K30-E60 IonicContact NZ-OE2 2.62Å; K30-E60 PolarHBondContact NZ-OE2 3.24Å; T56-E60 WeakPolarHBondContact O-CG 3.49Å; T56-E60 PolarHBondContact O-N 3.01Å; T57-E60 PolarHBondContact O-N 2.85Å; E60-M62 VanDerWaalsContact C-N 3.29Å; E60-M62 PolarHBondContact O-N 3.38Å; E60-Y64 WeakPolarHBondContact O-CB 3.45Å; E60-Y64 PolarHBondContact O-N 3.37Å
61L94.6Very high91.5Very high2 Ų256.9 Ų56.91%0.0129%0.285CS..Hα-helixtrans-60.4-41176.5-75172.6000111.6F27 K30 I31 T57 L58 N59 Y64 V65 F125F27-L61 HydrophobicContact CD2-CD2 3.44Å; F27-L61 VanDerWaalsContact CD2-CD2 3.44Å; F27-L61 HydrophobicContact CE2-CB 4.44Å; F27-L61 HydrophobicContact CE2-CD2 3.24Å; F27-L61 HydrophobicContact CE2-CG 4.44Å; F27-L61 HydrophobicContact CG-CD2 4.27Å; F27-L61 HydrophobicContact CZ-CD2 3.94Å; K30-L61 HydrophobicContact CB-CD1 4.31Å; K30-L61 HydrophobicContact CB-CD2 3.76Å; K30-L61 HydrophobicContact CB-CG 4.24Å; K30-L61 HydrophobicContact CD-CD2 4.44Å; I31-L61 HydrophobicContact CG1-CD1 4.19Å; I31-L61 HydrophobicContact CG1-CD2 4.17Å; T57-L61 HydrophobicContact CG2-CD1 4.36Å; T57-L61 WeakPolarHBondContact O-CB 3.4Å; T57-L61 VanDerWaalsContact O-CG 3.27Å; T57-L61 WeakPolarHBondContact O-CG 3.23Å; T57-L61 PolarHBondContact O-N 3.47Å; L58-L61 PolarHBondContact O-N 3.29Å; N59-L61 VanDerWaalsContact C-N 3.34Å; N59-L61 PolarHBondContact O-N 3.15Å; L61-Y64 PolarHBondContact O-N 2.67Å; L61-V65 WeakPolarHBondContact O-CG2 3.31Å; L61-V65 PolarHBondContact O-N 3.13Å; L61-F125 HydrophobicContact CB-CD2 4.11Å; L61-F125 HydrophobicContact CB-CE2 3.78Å
62M92.5Very high91.4Very high18 Ų1857.5 Ų57.59%0.08929%0.287CS..Hα-helixtrans-67.9-45.1-179.1-171.9170.470.300112.8L58 N59 E60 Y64 S66 L121 E124 F125 R128L58-M62 WeakPolarHBondContact O-CB 3.45Å; L58-M62 PolarHBondContact O-N 3.47Å; N59-M62 WeakPolarHBondContact O-CB 3.43Å; N59-M62 PolarHBondContact O-N 2.65Å; E60-M62 VanDerWaalsContact C-N 3.29Å; E60-M62 PolarHBondContact O-N 3.38Å; M62-Y64 VanDerWaalsContact C-N 3.3Å; M62-S66 PolarHBondContact O-N 3.41Å; M62-S66 PolarHBondContact O-OG 3.04Å; M62-L121 HydrophobicContact CE-CD2 4.43Å; M62-E124 HydrophobicContact SD-CB 3.71Å; M62-F125 HydrophobicContact CB-CD2 4.33Å; M62-R128 PolarHBondContact SD-NH1 3.3Å
63E91.2Very high91.2Very high139 Ų13955.3 Ų55.365%0.6528%0.28SS*.Hα-helixtrans-61.1-42.5171.5-71.2-178.7-177.400110.8N59 S66 A67N59-E63 PolarHBondContact O-N 3.26Å; E63-S66 PolarHBondContact O-N 2.94Å; E63-A67 WeakPolarHBondContact O-CB 3.4Å; E63-A67 PolarHBondContact O-N 3.24Å
64Y90.1Very high91.1Very high35 Ų3557.7 Ų57.714%0.13729%0.29CS..Hα-helixtrans-64.4-44.9-177.5-166.3-96.4000113F27 E60 L61 M62 S66 A67 N68 I71F27-Y64 AromaticContact CD2-CD1 3.57Å; F27-Y64 HydrophobicContact CD2-CD1 3.57Å; F27-Y64 HydrophobicContact CD2-CE1 4.05Å; F27-Y64 HydrophobicContact CD2-CG 4.38Å; F27-Y64 AromaticContact CE2-CD1 3.69Å; F27-Y64 HydrophobicContact CE2-CD1 3.69Å; F27-Y64 HydrophobicContact CE2-CG 4.43Å; E60-Y64 WeakPolarHBondContact O-CB 3.45Å; E60-Y64 PolarHBondContact O-N 3.37Å; L61-Y64 PolarHBondContact O-N 2.67Å; M62-Y64 VanDerWaalsContact C-N 3.3Å; Y64-S66 VanDerWaalsContact C-N 3.26Å; Y64-S66 PolarHBondContact O-N 3.48Å; Y64-A67 PolarHBondContact O-N 3.33Å; Y64-N68 HydrophobicContact CD1-CB 4.41Å; Y64-N68 WeakPolarHBondContact CD2-ND2 3.41Å; Y64-N68 HydrophobicContact CE1-CB 4.06Å; Y64-N68 HydrophobicContact CE2-CB 4.42Å; Y64-N68 VanDerWaalsContact CE2-ND2 3.28Å; Y64-N68 WeakPolarHBondContact CE2-ND2 3.36Å; Y64-N68 WeakPolarHBondContact O-CB 3.43Å; Y64-N68 PolarHBondContact O-N 2.87Å; Y64-N68 PolarHBondContact O-ND2 3.08Å; Y64-N68 VanDerWaalsContact O-ND2 3.1Å; Y64-I71 HydrophobicContact CD1-CG1 4.23Å; Y64-I71 HydrophobicContact CE1-CB 4.23Å; Y64-I71 HydrophobicContact CE1-CD1 3.91Å; Y64-I71 HydrophobicContact CE1-CG1 3.8Å
65V90.2Very high91Very high8 Ų863.6 Ų63.65%0.04831%0.312CS..Hα-helixtrans-62.7-35.2175.9167.10000111.7F27 L61 I71 F72 F125F27-V65 HydrophobicContact CE1-CG2 4.49Å; F27-V65 HydrophobicContact CE2-CG2 3.95Å; F27-V65 HydrophobicContact CZ-CG2 3.45Å; F27-V65 VanDerWaalsContact CZ-CG2 3.45Å; L61-V65 WeakPolarHBondContact O-CG2 3.31Å; L61-V65 PolarHBondContact O-N 3.13Å; V65-I71 HydrophobicContact CG2-CG2 4.5Å; V65-F72 HydrophobicContact CG1-CE2 4.11Å; V65-F72 HydrophobicContact CG1-CZ 3.73Å; V65-F125 HydrophobicContact CB-CE2 4.33Å; V65-F125 HydrophobicContact CG2-CD2 4.45Å; V65-F125 HydrophobicContact CG2-CE2 3.52Å; V65-F125 HydrophobicContact CG2-CZ 4.09Å
66S87.8Confident90.9Very high74 Ų7459 Ų5952%0.51730%0.295SS..Hα-helixtrans-71.1-35.7178.8-550000112.3M62 E63 Y64 R128M62-S66 PolarHBondContact O-N 3.41Å; M62-S66 PolarHBondContact O-OG 3.04Å; E63-S66 PolarHBondContact O-N 2.94Å; Y64-S66 VanDerWaalsContact C-N 3.26Å; Y64-S66 PolarHBondContact O-N 3.48Å; S66-R128 WeakPolarHBondContact OG-CD 3.45Å
67A87.9Confident90.9Very high75 Ų7556.4 Ų56.462%0.6228%0.278SS*.Hα-helixtrans-89.8-31.3-175.400000114.1E63 Y64E63-A67 WeakPolarHBondContact O-CB 3.4Å; E63-A67 PolarHBondContact O-N 3.24Å; Y64-A67 PolarHBondContact O-N 3.33Å
68N85.2Confident90.9Very high57 Ų5757.5 Ų57.531%0.30529%0.286SS..  trans-11895.5-167.5-59-83.3000111.9Y64 E70 I71Y64-N68 HydrophobicContact CD1-CB 4.41Å; Y64-N68 WeakPolarHBondContact CD2-ND2 3.41Å; Y64-N68 HydrophobicContact CE1-CB 4.06Å; Y64-N68 HydrophobicContact CE2-CB 4.42Å; Y64-N68 VanDerWaalsContact CE2-ND2 3.28Å; Y64-N68 WeakPolarHBondContact CE2-ND2 3.36Å; Y64-N68 WeakPolarHBondContact O-CB 3.43Å; Y64-N68 PolarHBondContact O-N 2.87Å; Y64-N68 PolarHBondContact O-ND2 3.08Å; Y64-N68 VanDerWaalsContact O-ND2 3.1Å; N68-E70 VanDerWaalsContact C-N 3.29Å; N68-E70 PolarHBondContact O-N 2.92Å; N68-I71 WeakPolarHBondContact O-CG2 3.2Å; N68-I71 PolarHBondContact O-N 3.12Å
69R81.5Confident90.9Very high162 Ų16259.2 Ų59.261%0.61129%0.294SS*.G310 helixtrans-64.4-28.5-178.4-70.7-178.7-176-152.910.6114.7I71 F72 E134R69-I71 PolarHBondContact O-N 3.26Å; R69-I71 VanDerWaalsContact O-N 3.14Å; R69-F72 WeakPolarHBondContact O-CD2 3.06Å; R69-E134 HydrophobicContact CB-CG 3.82Å; R69-E134 WeakPolarHBondContact CD-OE1 3.46Å; R69-E134 HydrophobicContact CG-CG 3.9Å; R69-E134 IonicContact CZ-OE1 3.73Å; R69-E134 IonicContact NH1-OE1 3.8Å; R69-E134 PolarHBondContact NH1-OE1 2.76Å
70E82.5Confident91Very high166 Ų16657.1 Ų57.178%0.77628%0.283SS*.G310 helixtrans-68.5-11.5-177.1-61179.6177.500113.3N68 F72N68-E70 VanDerWaalsContact C-N 3.29Å; N68-E70 PolarHBondContact O-N 2.92Å; E70-F72 PolarHBondContact O-N 3.17Å
71I85.9Confident91.1Very high11 Ų1154.1 Ų54.16%0.05627%0.269CS..G310 helixtrans-75.8-8.2-177.2-154.853.2000113.6F27 Y64 V65 N68 R69 T73 I76F27-I71 HydrophobicContact CB-CD1 3.98Å; F27-I71 HydrophobicContact CD1-CD1 3.94Å; F27-I71 HydrophobicContact CD1-CG1 3.69Å; F27-I71 HydrophobicContact CD2-CG1 4.25Å; F27-I71 HydrophobicContact CE1-CG1 3.85Å; F27-I71 HydrophobicContact CE2-CG1 4.41Å; F27-I71 HydrophobicContact CG-CD1 3.93Å; F27-I71 HydrophobicContact CG-CG1 3.9Å; F27-I71 HydrophobicContact CZ-CG1 4.25Å; Y64-I71 HydrophobicContact CD1-CG1 4.23Å; Y64-I71 HydrophobicContact CE1-CB 4.23Å; Y64-I71 HydrophobicContact CE1-CD1 3.91Å; Y64-I71 HydrophobicContact CE1-CG1 3.8Å; V65-I71 HydrophobicContact CG2-CG2 4.5Å; N68-I71 WeakPolarHBondContact O-CG2 3.2Å; N68-I71 PolarHBondContact O-N 3.12Å; R69-I71 PolarHBondContact O-N 3.26Å; R69-I71 VanDerWaalsContact O-N 3.14Å; I71-T73 PolarHBondContact O-N 2.89Å; I71-I76 HydrophobicContact CD1-CD1 3.49Å; I71-I76 VanDerWaalsContact CD1-CD1 3.49Å; I71-I76 HydrophobicContact CG1-CD1 3.65Å; I71-I76 WeakPolarHBondContact O-CD1 3.21Å
72F89.9Confident91.3Very high23 Ų2358.2 Ų58.210%0.10129%0.291CS..  trans-80.250.7-177.1-74.3-100.1000112.7V65 R69 E70 F129 S132 E134 F135V65-F72 HydrophobicContact CG1-CE2 4.11Å; V65-F72 HydrophobicContact CG1-CZ 3.73Å; R69-F72 WeakPolarHBondContact O-CD2 3.06Å; E70-F72 PolarHBondContact O-N 3.17Å; F72-F129 HydrophobicContact CD1-CD2 4.05Å; F72-F129 AromaticContact CD1-CE2 3.66Å; F72-F129 HydrophobicContact CD1-CE2 3.66Å; F72-F129 HydrophobicContact CD1-CZ 4.49Å; F72-F129 AromaticContact CE1-CD2 3.37Å; F72-F129 HydrophobicContact CE1-CD2 3.37Å; F72-F129 AromaticContact CE1-CE2 3.49Å; F72-F129 HydrophobicContact CE1-CE2 3.49Å; F72-F129 VanDerWaalsContact CE1-CE2 3.49Å; F72-F129 HydrophobicContact CE1-CG 4.28Å; F72-F129 HydrophobicContact CE1-CZ 4.47Å; F72-F129 AromaticContact CZ-CD2 3.96Å; F72-F129 HydrophobicContact CZ-CD2 3.96Å; F72-F129 HydrophobicContact CZ-CE2 4.38Å; F72-S132 WeakPolarHBondContact CE2-OG 3.4Å; F72-S132 WeakPolarHBondContact CZ-OG 3.02Å; F72-E134 HydrophobicContact CB-CB 4.11Å; F72-E134 HydrophobicContact CD1-CB 4.42Å; F72-E134 HydrophobicContact CD2-CB 3.9Å; F72-E134 HydrophobicContact CE2-CB 4.45Å; F72-E134 HydrophobicContact CG-CB 3.89Å; F72-F135 HydrophobicContact CE1-CB 4.38Å
73T91.2Very high91.5Very high41 Ų4157.4 Ų57.425%0.25229%0.287SS..  trans-79.6158.517869.60000111.8E24 I71 R75 I76 Y77E24-T73 HydrophobicContact CG-CG2 4.5Å; E24-T73 VanDerWaalsContact OE1-CB 3.25Å; E24-T73 WeakPolarHBondContact OE1-CB 3.37Å; E24-T73 PolarHBondContact OE1-OG1 2.96Å; I71-T73 PolarHBondContact O-N 2.89Å; T73-R75 PolarHBondContact O-N 2.89Å; T73-R75 VanDerWaalsContact O-N 3.15Å; T73-I76 PolarHBondContact O-N 3.03Å; T73-Y77 WeakPolarHBondContact O-CD2 3.14Å
74E91.9Very high91.8Very high118 Ų11850.8 Ų50.855%0.55126%0.256SS*.THydrogen-bonded Turntrans-58.7-28.4178.5-69.8-162.1174.900113.9I76 P78 I139E74-I76 VanDerWaalsContact C-N 3.3Å; E74-I76 PolarHBondContact O-N 3.18Å; E74-P78 WeakPolarHBondContact O-CD 3.24Å; E74-I139 HydrophobicContact CB-CG2 4.38Å; E74-I139 HydrophobicContact CG-CD1 3.68Å; E74-I139 HydrophobicContact CG-CG1 4.07Å; E74-I139 HydrophobicContact CG-CG2 4.13Å
75R94Very high92.2Very high126 Ų12650.1 Ų50.148%0.47526%0.258SS..THydrogen-bonded Turntrans-71-26.1-178.4-64.5175.964.6-157-1.7112.7E24 E25 I28 T73 P78E24-R75 WeakPolarHBondContact OE1-CB 3.27Å; E24-R75 IonicContact OE2-NH1 3.42Å; E24-R75 PolarHBondContact OE2-NH1 2.74Å; E25-R75 IonicContact OE2-CZ 2.8Å; E25-R75 IonicContact OE2-NH2 3.26Å; E25-R75 PolarHBondContact OE2-NH2 2.84Å; I28-R75 HydrophobicContact CD1-CB 4.25Å; T73-R75 PolarHBondContact O-N 2.89Å; T73-R75 VanDerWaalsContact O-N 3.15Å; R75-P78 WeakPolarHBondContact O-CD 3.39Å; R75-P78 WeakPolarHBondContact O-CG 3.27Å
76I94.4Very high92.5Very high1 Ų151.8 Ų51.81%0.00527%0.272CS..Hα-helixtrans-84.6-31-172.5-74.8171.5000112.5E24 F27 I28 I31 I71 T73 E74 E79 V80E24-I76 HydrophobicContact CG-CD1 3.7Å; E24-I76 HydrophobicContact CG-CG1 4.28Å; F27-I76 HydrophobicContact CD1-CD1 3.67Å; F27-I76 HydrophobicContact CD1-CG1 4.19Å; F27-I76 HydrophobicContact CD1-CG2 4.24Å; F27-I76 HydrophobicContact CE1-CD1 4.14Å; F27-I76 HydrophobicContact CE1-CG2 3.76Å; I28-I76 HydrophobicContact CD1-CG1 4.29Å; I28-I76 HydrophobicContact CG1-CG1 3.96Å; I31-I76 HydrophobicContact CD1-CG2 4.33Å; I71-I76 HydrophobicContact CD1-CD1 3.49Å; I71-I76 VanDerWaalsContact CD1-CD1 3.49Å; I71-I76 HydrophobicContact CG1-CD1 3.65Å; I71-I76 WeakPolarHBondContact O-CD1 3.21Å; T73-I76 PolarHBondContact O-N 3.03Å; E74-I76 VanDerWaalsContact C-N 3.3Å; E74-I76 PolarHBondContact O-N 3.18Å; I76-E79 PolarHBondContact O-N 3.34Å; I76-E79 VanDerWaalsContact O-N 3.15Å; I76-V80 HydrophobicContact CG2-CG2 3.69Å; I76-V80 WeakPolarHBondContact O-CG2 3.41Å; I76-V80 PolarHBondContact O-N 3.39Å
77Y96.1Very high92.9Very high1 Ų148.7 Ų48.70%0.00425%0.25CC..Hα-helixtrans-50.9-53.6178.2-76.5-103000114T73 E79 V80 I81 F129 F135 S136 I139 A140T73-Y77 WeakPolarHBondContact O-CD2 3.14Å; Y77-E79 VanDerWaalsContact C-N 3.29Å; Y77-E79 PolarHBondContact O-N 3.11Å; Y77-V80 PolarHBondContact O-N 3.04Å; Y77-I81 WeakPolarHBondContact O-CB 3.49Å; Y77-I81 WeakPolarHBondContact O-CD1 3.36Å; Y77-I81 VanDerWaalsContact O-CG1 3.24Å; Y77-I81 WeakPolarHBondContact O-CG1 3.39Å; Y77-I81 PolarHBondContact O-N 3.07Å; Y77-F129 HydrophobicContact CD1-CE1 4.15Å; Y77-F129 AromaticContact CD1-CZ 3.77Å; Y77-F129 HydrophobicContact CD1-CZ 3.77Å; Y77-F129 HydrophobicContact CD2-CZ 4.38Å; Y77-F129 HydrophobicContact CE1-CE1 4.29Å; Y77-F129 AromaticContact CE1-CZ 3.83Å; Y77-F129 HydrophobicContact CE1-CZ 3.83Å; Y77-F129 HydrophobicContact CE2-CZ 4.41Å; Y77-F129 HydrophobicContact CG-CZ 4.06Å; Y77-F135 HydrophobicContact CD1-CE2 4.16Å; Y77-F135 AromaticContact CE1-CD2 3.77Å; Y77-F135 HydrophobicContact CE1-CD2 3.77Å; Y77-F135 AromaticContact CE1-CE2 3.55Å; Y77-F135 HydrophobicContact CE1-CE2 3.55Å; Y77-F135 HydrophobicContact CE1-CZ 4.21Å; Y77-S136 PolarHBondContact OH-N 3.3Å; Y77-I139 HydrophobicContact CD1-CB 4.41Å; Y77-I139 HydrophobicContact CD1-CG2 4.13Å; Y77-I139 HydrophobicContact CD2-CB 4.4Å; Y77-I139 HydrophobicContact CD2-CG2 3.68Å; Y77-I139 HydrophobicContact CE1-CB 4.36Å; Y77-I139 HydrophobicContact CE1-CG2 4.49Å; Y77-I139 HydrophobicContact CE2-CB 4.38Å; Y77-I139 HydrophobicContact CE2-CD1 4.26Å; Y77-I139 HydrophobicContact CE2-CG2 4.11Å; Y77-I139 HydrophobicContact CG-CB 4.44Å; Y77-I139 HydrophobicContact CG-CG2 3.71Å; Y77-A140 HydrophobicContact CD1-CB 3.69Å; Y77-A140 HydrophobicContact CE1-CB 3.86Å
78P96.5Very high93.4Very high36 Ų3645.1 Ų45.123%0.23422%0.22CC..Hα-helixtrans-62.6-37179.922.6-32.2000112.4E74 R75 N82 Y143E74-P78 WeakPolarHBondContact O-CD 3.24Å; R75-P78 WeakPolarHBondContact O-CD 3.39Å; R75-P78 WeakPolarHBondContact O-CG 3.27Å; P78-N82 WeakPolarHBondContact O-CB 3.2Å; P78-N82 PolarHBondContact O-N 3.16Å; P78-Y143 HydrophobicContact CB-CD1 4.06Å; P78-Y143 HydrophobicContact CB-CE1 3.68Å; P78-Y143 HydrophobicContact CB-CE2 4.28Å; P78-Y143 HydrophobicContact CG-CE1 4.3Å; P78-Y143 HydrophobicContact CG-CE2 4.35Å
79E97Very high93.9Very high35 Ų3544.2 Ų44.216%0.16421%0.214CC..Hα-helixtrans-67.4-45.6-178.8-58.5-70.6163.300111I28 I31 R32 I76 Y77 M83I28-E79 HydrophobicContact CG1-CG 4.41Å; I28-E79 HydrophobicContact CG2-CG 4Å; I31-E79 HydrophobicContact CD1-CB 4.49Å; I31-E79 HydrophobicContact CG2-CB 3.96Å; I31-E79 VanDerWaalsContact CG2-O 3.32Å; I31-E79 WeakPolarHBondContact CG2-O 3.37Å; R32-E79 VanDerWaalsContact CG-OE2 3.26Å; R32-E79 WeakPolarHBondContact CG-OE2 3.47Å; R32-E79 IonicContact CZ-OE1 3.21Å; R32-E79 IonicContact CZ-OE2 3.87Å; R32-E79 IonicContact NE-OE1 2.81Å; R32-E79 PolarHBondContact NE-OE1 2.89Å; R32-E79 IonicContact NE-OE2 3.57Å; R32-E79 PolarHBondContact NE-OE2 3.44Å; R32-E79 IonicContact NH2-OE1 2.87Å; R32-E79 PolarHBondContact NH2-OE1 3.13Å; R32-E79 IonicContact NH2-OE2 3.52Å; I76-E79 PolarHBondContact O-N 3.34Å; I76-E79 VanDerWaalsContact O-N 3.15Å; Y77-E79 VanDerWaalsContact C-N 3.29Å; Y77-E79 PolarHBondContact O-N 3.11Å; E79-M83 VanDerWaalsContact O-CB 3.29Å; E79-M83 WeakPolarHBondContact O-CB 3.42Å; E79-M83 PolarHBondContact O-N 3.09Å
80V96.8Very high94.5Very high0 Ų039.7 Ų39.70%020%0.197CC..Hα-helixtrans-63.3-47.2177.4169.50000111.3I31 I76 Y77 N82 M83 F84 F125 F126 F129I31-V80 HydrophobicContact CD1-CG2 3.62Å; I76-V80 HydrophobicContact CG2-CG2 3.69Å; I76-V80 WeakPolarHBondContact O-CG2 3.41Å; I76-V80 PolarHBondContact O-N 3.39Å; Y77-V80 PolarHBondContact O-N 3.04Å; V80-N82 PolarHBondContact O-N 2.96Å; V80-M83 PolarHBondContact O-N 2.97Å; V80-F84 PolarHBondContact O-N 3.48Å; V80-F125 HydrophobicContact CB-CE1 4.41Å; V80-F125 HydrophobicContact CG1-CE1 3.78Å; V80-F125 HydrophobicContact CG2-CE1 3.99Å; V80-F125 HydrophobicContact CG2-CZ 4.07Å; V80-F126 HydrophobicContact CG1-CD2 3.98Å; V80-F126 HydrophobicContact CG1-CE2 4.34Å; V80-F129 HydrophobicContact CB-CE1 4.29Å; V80-F129 HydrophobicContact CB-CZ 4.42Å; V80-F129 HydrophobicContact CG1-CB 4.46Å; V80-F129 HydrophobicContact CG1-CD1 3.64Å; V80-F129 HydrophobicContact CG1-CD2 4.41Å; V80-F129 HydrophobicContact CG1-CE1 3.87Å; V80-F129 HydrophobicContact CG1-CG 3.92Å; V80-F129 HydrophobicContact CG1-CZ 4.38Å; V80-F129 HydrophobicContact CG2-CE2 4.38Å
81I96.9Very high94.9Very high8 Ų837.5 Ų37.54%0.04120%0.2CC..Hα-helixtrans-66.5-40-177.9-67166.8000110.6Y77 F84 A85 F126 Y143 I144 F148Y77-I81 WeakPolarHBondContact O-CB 3.49Å; Y77-I81 WeakPolarHBondContact O-CD1 3.36Å; Y77-I81 VanDerWaalsContact O-CG1 3.24Å; Y77-I81 WeakPolarHBondContact O-CG1 3.39Å; Y77-I81 PolarHBondContact O-N 3.07Å; I81-F84 PolarHBondContact O-N 3.22Å; I81-A85 WeakPolarHBondContact O-CB 3.16Å; I81-A85 PolarHBondContact O-N 3.45Å; I81-F126 HydrophobicContact CG1-CE2 4.17Å; I81-Y143 VanDerWaalsContact CD1-CB 3.48Å; I81-Y143 HydrophobicContact CD1-CD2 4.21Å; I81-Y143 HydrophobicContact CD1-CG 4.23Å; I81-I144 HydrophobicContact CD1-CD1 4.17Å; I81-I144 HydrophobicContact CD1-CG1 3.7Å; I81-I144 HydrophobicContact CG1-CG1 4.31Å; I81-F148 HydrophobicContact CG2-CD2 3.96Å; I81-F148 HydrophobicContact CG2-CE2 3.68Å
82N97.1Very high95.2Very high89 Ų8939.4 Ų39.448%0.47621%0.21SC..Hα-helixtrans-66.9-40.1174.9-176.567.3000112P78 V80 A85 A86P78-N82 WeakPolarHBondContact O-CB 3.2Å; P78-N82 PolarHBondContact O-N 3.16Å; V80-N82 PolarHBondContact O-N 2.96Å; N82-A85 PolarHBondContact O-N 3Å; N82-A86 VanDerWaalsContact O-CB 3.25Å; N82-A86 WeakPolarHBondContact O-CB 3.28Å; N82-A86 PolarHBondContact O-N 3.23Å
83M97.8Very high95Very high0 Ų042.1 Ų42.10%023%0.23CC..Hα-helixtrans-62.5-43.6175.7-174.1-79.8-7100111.3I31 C34 L58 E79 V80 N87 V122 F125I31-M83 HydrophobicContact CG2-CB 3.58Å; I31-M83 HydrophobicContact CG2-CG 4Å; C34-M83 HydrophobicContact CB-CG 4.11Å; C34-M83 HydrophobicContact CB-SD 4.33Å; L58-M83 HydrophobicContact CD2-CE 4.24Å; L58-M83 HydrophobicContact CD2-SD 4.41Å; E79-M83 VanDerWaalsContact O-CB 3.29Å; E79-M83 WeakPolarHBondContact O-CB 3.42Å; E79-M83 PolarHBondContact O-N 3.09Å; V80-M83 PolarHBondContact O-N 2.97Å; M83-N87 PolarHBondContact O-N 3.36Å; M83-N87 PolarHBondContact O-ND2 3.14Å; M83-V122 HydrophobicContact SD-CG1 4.1Å; M83-V122 HydrophobicContact SD-CG2 4.03Å; M83-F125 HydrophobicContact CE-CD1 3.38Å; M83-F125 HydrophobicContact CE-CE1 3.52Å; M83-F125 HydrophobicContact CE-CG 4.38Å
84F98.1Very high94.8Very high1 Ų145.5 Ų45.50%0.00425%0.252CS..Hα-helixtrans-59.1-56.7173.3178.7-93.1000110.8V80 I81 A86 N87 T88 F89 V122 Y123 F126 F148 L152V80-F84 PolarHBondContact O-N 3.48Å; I81-F84 PolarHBondContact O-N 3.22Å; F84-A86 VanDerWaalsContact C-N 3.33Å; F84-A86 PolarHBondContact O-N 3.16Å; F84-N87 PolarHBondContact O-N 3.02Å; F84-N87 VanDerWaalsContact O-N 3.09Å; F84-T88 HydrophobicContact CD2-CG2 4.01Å; F84-T88 HydrophobicContact CE1-CG2 4.33Å; F84-T88 VanDerWaalsContact CE1-OG1 3.32Å; F84-T88 WeakPolarHBondContact CE1-OG1 3.46Å; F84-T88 HydrophobicContact CE2-CG2 3.72Å; F84-T88 HydrophobicContact CG-CG2 4.46Å; F84-T88 HydrophobicContact CZ-CG2 3.9Å; F84-T88 PolarHBondContact O-N 3.33Å; F84-T88 PolarHBondContact O-OG1 2.69Å; F84-F89 HydrophobicContact CD1-CZ 4.44Å; F84-F89 AromaticContact CE1-CE1 3.95Å; F84-F89 HydrophobicContact CE1-CE1 3.95Å; F84-F89 HydrophobicContact CE1-CZ 4.17Å; F84-V122 HydrophobicContact CD2-CG1 3.91Å; F84-Y123 AromaticContact CE2-CD1 3.64Å; F84-Y123 HydrophobicContact CE2-CD1 3.64Å; F84-Y123 AromaticContact CE2-CE1 3.75Å; F84-Y123 HydrophobicContact CE2-CE1 3.75Å; F84-Y123 HydrophobicContact CZ-CD1 4.07Å; F84-Y123 AromaticContact CZ-CE1 3.75Å; F84-Y123 HydrophobicContact CZ-CE1 3.75Å; F84-F126 HydrophobicContact CB-CD2 3.93Å; F84-F126 HydrophobicContact CB-CE2 4.27Å; F84-F126 HydrophobicContact CB-CG 4.2Å; F84-F126 HydrophobicContact CD1-CD1 4.36Å; F84-F126 HydrophobicContact CD1-CE1 4.29Å; F84-F126 HydrophobicContact CD1-CZ 4.49Å; F84-F126 HydrophobicContact CD2-CB 3.48Å; F84-F126 VanDerWaalsContact CD2-CB 3.48Å; F84-F126 AromaticContact CD2-CD1 3.63Å; F84-F126 HydrophobicContact CD2-CD1 3.63Å; F84-F126 HydrophobicContact CD2-CD2 4.08Å; F84-F126 HydrophobicContact CD2-CE1 4.35Å; F84-F126 AromaticContact CD2-CG 3.46Å; F84-F126 HydrophobicContact CD2-CG 3.46Å; F84-F126 VanDerWaalsContact CD2-CG 3.46Å; F84-F126 HydrophobicContact CE1-CD1 4.36Å; F84-F126 HydrophobicContact CE1-CE1 4.3Å; F84-F126 HydrophobicContact CE2-CB 3.94Å; F84-F126 AromaticContact CE2-CD1 3.63Å; F84-F126 HydrophobicContact CE2-CD1 3.63Å; F84-F126 HydrophobicContact CE2-CE1 4.35Å; F84-F126 AromaticContact CE2-CG 3.92Å; F84-F126 HydrophobicContact CE2-CG 3.92Å; F84-F126 HydrophobicContact CG-CB 4.27Å; F84-F126 AromaticContact CG-CD1 4Å; F84-F126 HydrophobicContact CG-CD1 4Å; F84-F126 HydrophobicContact CG-CD2 4.02Å; F84-F126 HydrophobicContact CG-CE1 4.3Å; F84-F126 HydrophobicContact CG-CE2 4.35Å; F84-F126 AromaticContact CG-CG 3.84Å; F84-F126 HydrophobicContact CG-CG 3.84Å; F84-F126 HydrophobicContact CG-CZ 4.48Å; F84-F126 HydrophobicContact CZ-CD1 4.01Å; F84-F126 HydrophobicContact CZ-CE1 4.32Å; F84-F148 AromaticContact CD1-CE2 3.94Å; F84-F148 HydrophobicContact CD1-CE2 3.94Å; F84-F148 AromaticContact CD1-CZ 3.57Å; F84-F148 HydrophobicContact CD1-CZ 3.57Å; F84-F148 HydrophobicContact CE1-CE1 4.48Å; F84-F148 HydrophobicContact CE1-CE2 4.41Å; F84-F148 AromaticContact CE1-CZ 3.72Å; F84-F148 HydrophobicContact CE1-CZ 3.72Å; F84-L152 HydrophobicContact CE1-CD1 4.02Å; F84-L152 HydrophobicContact CZ-CD1 3.96Å
85A97.4Very high94.3Very high21 Ų2143.2 Ų43.217%0.17425%0.248CC..Hα-helixtrans-57-42.8-177.100000112.9I81 N82 N87 F89 F148I81-A85 WeakPolarHBondContact O-CB 3.16Å; I81-A85 PolarHBondContact O-N 3.45Å; N82-A85 PolarHBondContact O-N 3Å; A85-N87 VanDerWaalsContact C-N 3.29Å; A85-N87 PolarHBondContact O-N 2.94Å; A85-F89 HydrophobicContact CB-CD2 3.49Å; A85-F89 VanDerWaalsContact CB-CD2 3.49Å; A85-F89 HydrophobicContact CB-CE2 3.56Å; A85-F89 HydrophobicContact CB-CG 4.35Å; A85-F89 HydrophobicContact CB-CZ 4.48Å; A85-F89 VanDerWaalsContact O-CB 3.29Å; A85-F89 WeakPolarHBondContact O-CB 3.42Å; A85-F89 PolarHBondContact O-N 3.25Å; A85-F148 HydrophobicContact CB-CE2 4.44Å
86A96.6Very high93.5Very high42 Ų4241.3 Ų41.335%0.34725%0.25SS..Hα-helixtrans-66.8-29.3-179.900000113.3T35 V37 N82 F84T35-A86 HydrophobicContact CG2-CB 3.62Å; V37-A86 VanDerWaalsContact CG2-O 3.25Å; V37-A86 WeakPolarHBondContact CG2-O 3.42Å; N82-A86 VanDerWaalsContact O-CB 3.25Å; N82-A86 WeakPolarHBondContact O-CB 3.28Å; N82-A86 PolarHBondContact O-N 3.23Å; F84-A86 VanDerWaalsContact C-N 3.33Å; F84-A86 PolarHBondContact O-N 3.16Å
87N96.9Very high92.5Very high9 Ų943.2 Ų43.25%0.04826%0.26CS..Hα-helixtrans-87.8-35.7179.1-78.9-82.3000112.5C34 K54 M83 F84 A85 L119 V122C34-N87 PolarHBondContact O-ND2 3.36Å; K54-N87 PolarHBondContact NZ-OD1 3.36Å; M83-N87 PolarHBondContact O-N 3.36Å; M83-N87 PolarHBondContact O-ND2 3.14Å; F84-N87 PolarHBondContact O-N 3.02Å; F84-N87 VanDerWaalsContact O-N 3.09Å; A85-N87 VanDerWaalsContact C-N 3.29Å; A85-N87 PolarHBondContact O-N 2.94Å; N87-L119 HydrophobicContact CB-CD2 4.5Å; N87-L119 VanDerWaalsContact O-CD2 3.31Å; N87-L119 WeakPolarHBondContact O-CD2 3.42Å; N87-V122 HydrophobicContact CB-CG1 4.06Å; N87-V122 HydrophobicContact CB-CG2 4.11Å
88T96.7Very high91.3Very high0 Ų052.4 Ų52.40%030%0.295CS..Hα-helixtrans-97.8-42.8-171.959.50000113.7F84 R90 L119 V122 Y123 L155F84-T88 HydrophobicContact CD2-CG2 4.01Å; F84-T88 HydrophobicContact CE1-CG2 4.33Å; F84-T88 VanDerWaalsContact CE1-OG1 3.32Å; F84-T88 WeakPolarHBondContact CE1-OG1 3.46Å; F84-T88 HydrophobicContact CE2-CG2 3.72Å; F84-T88 HydrophobicContact CG-CG2 4.46Å; F84-T88 HydrophobicContact CZ-CG2 3.9Å; F84-T88 PolarHBondContact O-N 3.33Å; F84-T88 PolarHBondContact O-OG1 2.69Å; T88-R90 PolarHBondContact O-N 3.11Å; T88-R90 PolarHBondContact O-NH1 3.43Å; T88-L119 HydrophobicContact CG2-CD2 4.38Å; T88-V122 HydrophobicContact CG2-CG1 4.18Å; T88-Y123 HydrophobicContact CG2-CE1 3.95Å; T88-Y123 HydrophobicContact CG2-CE2 4.12Å; T88-L155 WeakPolarHBondContact O-CD2 3.43Å
89F96.6Very high90Very high38 Ų3856.7 Ų56.717%0.16732%0.315CS..  trans-74.791.5-173.3-59.4-21.1000111.3F84 A85 F148 Q151 L152 L155F84-F89 HydrophobicContact CD1-CZ 4.44Å; F84-F89 AromaticContact CE1-CE1 3.95Å; F84-F89 HydrophobicContact CE1-CE1 3.95Å; F84-F89 HydrophobicContact CE1-CZ 4.17Å; A85-F89 HydrophobicContact CB-CD2 3.49Å; A85-F89 VanDerWaalsContact CB-CD2 3.49Å; A85-F89 HydrophobicContact CB-CE2 3.56Å; A85-F89 HydrophobicContact CB-CG 4.35Å; A85-F89 HydrophobicContact CB-CZ 4.48Å; A85-F89 VanDerWaalsContact O-CB 3.29Å; A85-F89 WeakPolarHBondContact O-CB 3.42Å; A85-F89 PolarHBondContact O-N 3.25Å; F89-F148 AromaticContact CE2-CD2 3.55Å; F89-F148 HydrophobicContact CE2-CD2 3.55Å; F89-F148 AromaticContact CE2-CE2 3.71Å; F89-F148 HydrophobicContact CE2-CE2 3.71Å; F89-F148 HydrophobicContact CE2-CG 4.14Å; F89-F148 HydrophobicContact CE2-CZ 4.42Å; F89-F148 HydrophobicContact CZ-CD1 4.16Å; F89-F148 AromaticContact CZ-CD2 3.62Å; F89-F148 HydrophobicContact CZ-CD2 3.62Å; F89-F148 HydrophobicContact CZ-CE1 4.07Å; F89-F148 AromaticContact CZ-CE2 3.51Å; F89-F148 HydrophobicContact CZ-CE2 3.51Å; F89-F148 AromaticContact CZ-CG 3.94Å; F89-F148 HydrophobicContact CZ-CG 3.94Å; F89-F148 AromaticContact CZ-CZ 3.76Å; F89-F148 HydrophobicContact CZ-CZ 3.76Å; F89-Q151 HydrophobicContact CB-CB 4.39Å; F89-Q151 HydrophobicContact CD1-CB 3.9Å; F89-Q151 HydrophobicContact CD2-CB 3.76Å; F89-Q151 HydrophobicContact CD2-CG 4.41Å; F89-Q151 HydrophobicContact CE1-CB 4.05Å; F89-Q151 HydrophobicContact CE2-CB 3.91Å; F89-Q151 HydrophobicContact CG-CB 3.77Å; F89-Q151 HydrophobicContact CZ-CB 4.06Å; F89-L152 HydrophobicContact CE1-CB 4.03Å; F89-L152 HydrophobicContact CE1-CD1 4.23Å; F89-L152 HydrophobicContact CZ-CB 4.36Å; F89-L155 HydrophobicContact CD1-CD1 3.9Å; F89-L155 HydrophobicContact CE1-CD1 4.33Å
90R93.8Very high88.7Confident67 Ų6757.1 Ų57.125%0.25333%0.329SS..  trans-132.8157.518069-164.8-175.9-71.8-0.1110T88 E113 E163T88-R90 PolarHBondContact O-N 3.11Å; T88-R90 PolarHBondContact O-NH1 3.43Å; R90-E113 IonicContact CZ-OE2 3.27Å; R90-E113 IonicContact NE-OE2 3.37Å; R90-E113 PolarHBondContact NE-OE2 3.08Å; R90-E113 IonicContact NH2-OE2 3.79Å; R90-E113 PolarHBondContact NH2-OE2 2.92Å; R90-E163 IonicContact CZ-OE1 2.73Å; R90-E163 IonicContact CZ-OE2 2.92Å; R90-E163 IonicContact NH1-OE1 3.96Å; R90-E163 PolarHBondContact NH1-OE1 3.15Å; R90-E163 IonicContact NH1-OE2 3.81Å; R90-E163 IonicContact NH2-OE1 3.45Å; R90-E163 PolarHBondContact NH2-OE1 2.96Å; R90-E163 IonicContact NH2-OE2 3.82Å; R90-E163 PolarHBondContact NH2-OE2 3.1Å
91S90.8Very high87.5Confident120 Ų12061.5 Ų61.584%0.83937%0.365SS*.PPolyproline II helixtrans-69.8131.7166.5-59.20000109.1
92L91.4Very high86.4Confident51 Ų5170 Ų7027%0.26741%0.405SS..PPolyproline II helixtrans-67.1146.3176.2-62.6174.3000110.3L155 D157L92-L155 HydrophobicContact CD2-CD2 4.3Å; L92-D157 VanDerWaalsContact CD1-C 3.45Å; L92-D157 HydrophobicContact CD1-CB 3.75Å
93P87.6Confident85.2Confident80 Ų8070.6 Ų70.652%0.51940%0.404SS..PPolyproline II helixtrans-63159.1175.328.4-34.2000110.8
94P85.8Confident84.2Confident112 Ų11273.6 Ų73.673%0.72742%0.419SS*.PPolyproline II helixtrans-55.7142.5172.1-2232.9000110.9T96P94-T96 PolarHBondContact O-N 3.05Å
95P81.9Confident83.1Confident70 Ų7076.2 Ų76.246%0.45544%0.436SS..PPolyproline II helixtrans-55131.8-179.9-23.631.7000111.2E159P95-E159 WeakPolarHBondContact CA-OE1 3.46Å
96T77.6Confident82Confident87 Ų8780 Ų8053%0.53445%0.451SS..SBendtrans-76.8-30.2176.563.30000112.4P94 A111 E159P94-T96 PolarHBondContact O-N 3.05Å; T96-A111 HydrophobicContact CG2-CB 3.77Å; T96-E159 PolarHBondContact N-OE1 3.49Å; T96-E159 PolarHBondContact OG1-OE2 3.25Å
97N73.6Confident81.1Confident40 Ų4085.6 Ų85.621%0.21447%0.47CS..SBendtrans-81.6146.3-178.1-60.4-33.5000112.6L99 D108N97-L99 PolarHBondContact O-N 3.29Å; N97-D108 WeakPolarHBondContact CB-OD2 3.48Å; N97-D108 WeakPolarHBondContact ND2-CB 3.41Å; N97-D108 PolarHBondContact ND2-OD2 2.8Å
98R69.6Low80.2Confident195 Ų19587.3 Ų87.374%0.73648%0.479SS*.PPolyproline II helixtrans-77.7119.2-178.6-67.7-172.9-177.7-166.53.6109.8G100 F103R98-G100 PolarHBondContact O-N 2.97Å; R98-F103 HydrophobicContact CB-CD2 4.16Å; R98-F103 HydrophobicContact CB-CE1 4.13Å; R98-F103 HydrophobicContact CB-CE2 3.72Å; R98-F103 HydrophobicContact CB-CZ 3.71Å; R98-F103 HydrophobicContact CG-CZ 4.32Å; R98-F103 WeakPolarHBondContact O-CD2 3.44Å; R98-F103 WeakPolarHBondContact O-CG 3.25Å
99L69.3Low79.4Confident126 Ų12695.3 Ų95.366%0.6652%0.516SS*.PPolyproline II helixtrans-72117.7172.5-62.7166.8000109.6N97 H202N97-L99 PolarHBondContact O-N 3.29Å; L99-H202 HydrophobicContact CD2-CB 4.12Å
100G70Confident78.7Confident44 Ų4496.9 Ų96.945%0.45453%0.53SS..SBendtrans-174.1159.7177.800000113.8R98 E102 F103R98-G100 PolarHBondContact O-N 2.97Å; G100-E102 PolarHBondContact O-N 3.27Å; G100-F103 PolarHBondContact O-N 3.04Å
101A73Confident78.3Confident92 Ų9295.2 Ų95.276%0.7653%0.531SS*.THydrogen-bonded Turntrans-71-12.2-178.100000114.4
102E73Confident78.4Confident187 Ų18794.7 Ų94.787%0.87452%0.518SS*.THydrogen-bonded Turntrans-93.3-10.3179.9-61.7177.8-174.600112.4G100G100-E102 PolarHBondContact O-N 3.27Å
103F71.4Confident78.3Confident101 Ų10193.8 Ų93.844%0.44351%0.512SS..  trans-95.2132.2-176.4-71.2-85.8000110.5R98 G100R98-F103 HydrophobicContact CB-CD2 4.16Å; R98-F103 HydrophobicContact CB-CE1 4.13Å; R98-F103 HydrophobicContact CB-CE2 3.72Å; R98-F103 HydrophobicContact CB-CZ 3.71Å; R98-F103 HydrophobicContact CG-CZ 4.32Å; R98-F103 WeakPolarHBondContact O-CD2 3.44Å; R98-F103 WeakPolarHBondContact O-CG 3.25Å; G100-F103 PolarHBondContact O-N 3.04Å
104D77.3Confident78.5Confident62 Ų6292.2 Ų92.233%0.33251%0.506SS..  trans-95.1116.6170.3-170.3-10.5000109E106 E107D104-E106 PolarHBondContact O-N 2.97Å; D104-E106 PolarHBondContact OD1-N 3.28Å; D104-E107 HydrophobicContact CB-CG 4.16Å; D104-E107 PolarHBondContact O-N 3.31Å
105P74.5Confident78.9Confident56 Ų5687.8 Ų87.836%0.36448%0.477SS..THydrogen-bonded Turntrans-58.6-16176.4-25.736.8000114.3E107 V247P105-E107 VanDerWaalsContact C-N 3.28Å; P105-V247 HydrophobicContact CB-CG2 4.18Å
106E74Confident79.6Confident101 Ų10185.3 Ų85.347%0.47246%0.459SS..THydrogen-bonded Turntrans-73.1-20.7172.7-66-173.5108.100113D104 S246 V247D104-E106 PolarHBondContact O-N 2.97Å; D104-E106 PolarHBondContact OD1-N 3.28Å; E106-S246 VanDerWaalsContact CD-CB 3.42Å; E106-S246 WeakPolarHBondContact OE2-CB 3.39Å; E106-S246 PolarHBondContact OE2-OG 3.21Å; E106-V247 HydrophobicContact CG-CG2 4Å
107E79Confident80.4Confident160 Ų16084.2 Ų84.275%0.74845%0.454SS*.SBendtrans-91.6-5.2178.4-63.1-172.7165.500113.4D104 P105 E109D104-E107 HydrophobicContact CB-CG 4.16Å; D104-E107 PolarHBondContact O-N 3.31Å; P105-E107 VanDerWaalsContact C-N 3.28Å; E107-E109 PolarHBondContact O-N 3.17Å
108D78.5Confident81.4Confident45 Ų4582.7 Ų82.724%0.24145%0.445CS..PPolyproline II helixtrans-65.9125-176.8-86.1-5.4000111.8N97 P110N97-D108 WeakPolarHBondContact CB-OD2 3.48Å; N97-D108 WeakPolarHBondContact ND2-CB 3.41Å; N97-D108 PolarHBondContact ND2-OD2 2.8Å; D108-P110 WeakPolarHBondContact O-CD 3.45Å
109E79.7Confident82.7Confident167 Ų16773.6 Ų73.678%0.7841%0.411SS*.PPolyproline II helixtrans-75.1117.1169.8-74.1-170.4177.100109.2E107 A111E107-E109 PolarHBondContact O-N 3.17Å; E109-A111 PolarHBondContact O-N 3.36Å
110P81.5Confident84.1Confident72 Ų7270.9 Ų70.947%0.46840%0.395SS..PPolyproline II helixtrans-70.5126.3-173.226.7-33.5000111.4D108 L112D108-P110 WeakPolarHBondContact O-CD 3.45Å; P110-L112 PolarHBondContact O-N 2.77Å
111A85.4Confident85.4Confident31 Ų3169.6 Ų69.626%0.25638%0.378SS..  trans-67.3114171.100000110.8T96 E109 E159T96-A111 HydrophobicContact CG2-CB 3.77Å; E109-A111 PolarHBondContact O-N 3.36Å; A111-E159 HydrophobicContact CB-CB 4.03Å; A111-E159 HydrophobicContact CB-CG 4.49Å; A111-E159 WeakPolarHBondContact CB-OE2 3.36Å
112L91.8Very high86.6Confident110 Ų11065.2 Ų65.258%0.57634%0.341SS*.  trans-81.1137178.4-59.8-177000111.3P110 A114P110-L112 PolarHBondContact O-N 2.77Å; L112-A114 PolarHBondContact O-N 2.9Å
113E91.1Very high87.8Confident32 Ų3256.3 Ų56.315%0.1530%0.3CS..  trans-70.8122.3179.2174.554.5-111.700111.2R90 S115 W116 L119 D160R90-E113 IonicContact CZ-OE2 3.27Å; R90-E113 IonicContact NE-OE2 3.37Å; R90-E113 PolarHBondContact NE-OE2 3.08Å; R90-E113 IonicContact NH2-OE2 3.79Å; R90-E113 PolarHBondContact NH2-OE2 2.92Å; E113-S115 VanDerWaalsContact C-N 3.28Å; E113-S115 VanDerWaalsContact CD-OG 3.28Å; E113-S115 WeakPolarHBondContact CG-OG 3.33Å; E113-S115 PolarHBondContact O-N 3.49Å; E113-S115 PolarHBondContact OE1-N 3.29Å; E113-S115 PolarHBondContact OE1-OG 3.32Å; E113-W116 WeakPolarHBondContact O-CB 3.49Å; E113-W116 PolarHBondContact O-N 3.43Å; E113-L119 HydrophobicContact CG-CD1 3.54Å; E113-D160 HydrophobicContact CB-CB 4.41Å; E113-D160 PolarHBondContact N-OD2 3.44Å
114A91.9Very high89Confident46 Ų4653.6 Ų53.638%0.3829%0.288SS..THydrogen-bonded Turntrans-66.3-31.2-175.500000112.6F40 L112 W116F40-A114 HydrophobicContact CB-CB 3.89Å; F40-A114 WeakPolarHBondContact CB-O 3.24Å; L112-A114 PolarHBondContact O-N 2.9Å; A114-W116 PolarHBondContact O-N 3.25Å
115S93.7Very high90Very high19 Ų1950.6 Ų50.613%0.13327%0.273CS..THydrogen-bonded Turntrans-82.67.1178.562.80000114.3E113 P117 H118 L119E113-S115 VanDerWaalsContact C-N 3.28Å; E113-S115 VanDerWaalsContact CD-OG 3.28Å; E113-S115 WeakPolarHBondContact CG-OG 3.33Å; E113-S115 PolarHBondContact O-N 3.49Å; E113-S115 PolarHBondContact OE1-N 3.29Å; E113-S115 PolarHBondContact OE1-OG 3.32Å; S115-P117 VanDerWaalsContact C-N 3.34Å; S115-P117 VanDerWaalsContact O-N 3.16Å; S115-H118 PolarHBondContact O-N 3.03Å; S115-L119 PolarHBondContact O-N 2.88Å; S115-L119 VanDerWaalsContact O-N 3.1Å; S115-L119 VanDerWaalsContact OG-CD1 3.24Å; S115-L119 WeakPolarHBondContact OG-CD1 3.48Å
116W95.5Very high91.1Very high18 Ų1848 Ų487%0.06826%0.256CS..Hα-helixtrans-48.5-40.4-178.4-166.9-109.2000115.6E113 A114 H118 L119 Q120 Y123 R162 E163 F166E113-W116 WeakPolarHBondContact O-CB 3.49Å; E113-W116 PolarHBondContact O-N 3.43Å; A114-W116 PolarHBondContact O-N 3.25Å; W116-H118 PolarHBondContact O-N 3.44Å; W116-H118 VanDerWaalsContact O-N 3.09Å; W116-L119 HydrophobicContact CE3-CB 4.18Å; W116-L119 HydrophobicContact CZ3-CB 4.41Å; W116-L119 PolarHBondContact O-N 3.01Å; W116-Q120 HydrophobicContact CD2-CB 4.4Å; W116-Q120 HydrophobicContact CZ2-CB 4.09Å; W116-Q120 HydrophobicContact CZ2-CG 4.35Å; W116-Q120 WeakPolarHBondContact O-CB 3.31Å; W116-Q120 PolarHBondContact O-N 3.05Å; W116-Y123 HydrophobicContact CZ3-CD2 4.43Å; W116-Y123 HydrophobicContact CZ3-CE2 4.41Å; W116-R162 VanDerWaalsContact CD1-CZ 3.43Å; W116-R162 VanDerWaalsContact CD1-NH1 3.3Å; W116-R162 VanDerWaalsContact CH2-C 3.47Å; W116-R162 HydrophobicContact CH2-CB 3.71Å; W116-R162 HydrophobicContact CZ2-CB 3.33Å; W116-R162 HydrophobicContact CZ2-CG 4.44Å; W116-R162 HydrophobicContact CZ3-CB 4.47Å; W116-E163 HydrophobicContact CH2-CB 4.11Å; W116-E163 HydrophobicContact CZ3-CB 3.6Å; W116-E163 HydrophobicContact CZ3-CG 4.14Å; W116-F166 AromaticContact CH2-CD2 3.71Å; W116-F166 HydrophobicContact CH2-CD2 3.71Å; W116-F166 HydrophobicContact CH2-CE2 4.13Å; W116-F166 AromaticContact CZ2-CD2 3.94Å; W116-F166 HydrophobicContact CZ2-CD2 3.94Å; W116-F166 AromaticContact CZ2-CE2 3.88Å; W116-F166 HydrophobicContact CZ2-CE2 3.88Å
117P94.2Very high92.2Very high65 Ų6544 Ų4442%0.42224%0.238SC..Hα-helixtrans-58-26.7178.9-26.536000114.6S115S115-P117 VanDerWaalsContact C-N 3.34Å; S115-P117 VanDerWaalsContact O-N 3.16Å
118H95.8Very high92.9Very high7 Ų741.4 Ų41.43%0.03222%0.221CC..Hα-helixtrans-92.5-44.1172.4-73.7-175.9000111.6F38 F40 K51 S115 W116 Q120 L121 V122F38-H118 AromaticContact CD2-CE1 3.76Å; F40-H118 AromaticContact CE2-CE1 3.88Å; F40-H118 AromaticContact CE2-CG 4Å; F40-H118 AromaticContact CE2-ND1 3.59Å; F40-H118 AromaticContact CZ-CD2 3.99Å; F40-H118 AromaticContact CZ-CE1 3.61Å; F40-H118 AromaticContact CZ-CG 3.91Å; F40-H118 AromaticContact CZ-ND1 3.72Å; F40-H118 AromaticContact CZ-NE2 3.81Å; K51-H118 PolarHBondContact O-CE1 2.89Å; K51-H118 PolarHBondContact O-NE2 3.42Å; S115-H118 PolarHBondContact O-N 3.03Å; W116-H118 PolarHBondContact O-N 3.44Å; W116-H118 VanDerWaalsContact O-N 3.09Å; H118-Q120 PolarHBondContact O-N 2.89Å; H118-L121 PolarHBondContact O-N 3.1Å; H118-V122 WeakPolarHBondContact O-CG2 3.46Å; H118-V122 PolarHBondContact O-N 3.12Å; H118-V122 VanDerWaalsContact O-N 3.09Å
119L96.8Very high93.8Very high4 Ų439.4 Ų39.42%0.02121%0.21CC..Hα-helixtrans-61.2-42.4-176.9-70.9179.5000112.6N87 T88 E113 S115 W116 L121 V122 Y123N87-L119 HydrophobicContact CB-CD2 4.5Å; N87-L119 VanDerWaalsContact O-CD2 3.31Å; N87-L119 WeakPolarHBondContact O-CD2 3.42Å; T88-L119 HydrophobicContact CG2-CD2 4.38Å; E113-L119 HydrophobicContact CG-CD1 3.54Å; S115-L119 PolarHBondContact O-N 2.88Å; S115-L119 VanDerWaalsContact O-N 3.1Å; S115-L119 VanDerWaalsContact OG-CD1 3.24Å; S115-L119 WeakPolarHBondContact OG-CD1 3.48Å; W116-L119 HydrophobicContact CE3-CB 4.18Å; W116-L119 HydrophobicContact CZ3-CB 4.41Å; W116-L119 PolarHBondContact O-N 3.01Å; L119-L121 VanDerWaalsContact C-N 3.27Å; L119-L121 PolarHBondContact O-N 3.13Å; L119-V122 PolarHBondContact O-N 3.4Å; L119-V122 VanDerWaalsContact O-N 3.08Å; L119-Y123 HydrophobicContact CB-CD2 4.39Å; L119-Y123 HydrophobicContact CB-CE2 4.34Å; L119-Y123 WeakPolarHBondContact O-CD2 3.3Å; L119-Y123 PolarHBondContact O-N 3.45Å
120Q97.8Very high94.5Very high70 Ų7031.5 Ų31.533%0.32717%0.173SC..Hα-helixtrans-52.1-49.4176.1-179.1-176.6-11.800110.9W116 H118 V122 Y123 E124 F166W116-Q120 HydrophobicContact CD2-CB 4.4Å; W116-Q120 HydrophobicContact CZ2-CB 4.09Å; W116-Q120 HydrophobicContact CZ2-CG 4.35Å; W116-Q120 WeakPolarHBondContact O-CB 3.31Å; W116-Q120 PolarHBondContact O-N 3.05Å; H118-Q120 PolarHBondContact O-N 2.89Å; Q120-V122 VanDerWaalsContact C-N 3.34Å; Q120-V122 PolarHBondContact O-N 3.32Å; Q120-Y123 PolarHBondContact O-N 3.23Å; Q120-E124 WeakPolarHBondContact CG-OE1 3.33Å; Q120-E124 PolarHBondContact NE2-OE1 2.96Å; Q120-E124 WeakPolarHBondContact O-CB 3.39Å; Q120-E124 WeakPolarHBondContact O-CG 3.42Å; Q120-E124 PolarHBondContact O-N 2.86Å; Q120-F166 HydrophobicContact CG-CE2 4.25Å; Q120-F166 HydrophobicContact CG-CZ 4.31Å
121L97.7Very high95.1Very high16 Ų1632.1 Ų32.18%0.08417%0.17CC..Hα-helixtrans-67.5-34.5-178.9-61.8177.7000112.3R55 L58 M62 H118 L119 F125R55-L121 HydrophobicContact CB-CD1 4.47Å; R55-L121 HydrophobicContact CG-CD1 3.66Å; L58-L121 HydrophobicContact CB-CB 3.92Å; L58-L121 HydrophobicContact CB-CD1 4.01Å; L58-L121 HydrophobicContact CD1-CB 3.96Å; L58-L121 HydrophobicContact CD1-CD1 4.4Å; L58-L121 HydrophobicContact CG-CB 4.49Å; M62-L121 HydrophobicContact CE-CD2 4.43Å; H118-L121 PolarHBondContact O-N 3.1Å; L119-L121 VanDerWaalsContact C-N 3.27Å; L119-L121 PolarHBondContact O-N 3.13Å; L121-F125 WeakPolarHBondContact O-CB 3.44Å; L121-F125 PolarHBondContact O-N 3.21Å
122V98Very high95.5Very high0 Ų031.4 Ų31.40%016%0.163CC..Hα-helixtrans-65.8-44.6174.7172.60000110.9L58 M83 F84 N87 T88 H118 L119 Q120 F126L58-V122 HydrophobicContact CD1-CG2 3.99Å; L58-V122 HydrophobicContact CD2-CG2 4.14Å; M83-V122 HydrophobicContact SD-CG1 4.1Å; M83-V122 HydrophobicContact SD-CG2 4.03Å; F84-V122 HydrophobicContact CD2-CG1 3.91Å; N87-V122 HydrophobicContact CB-CG1 4.06Å; N87-V122 HydrophobicContact CB-CG2 4.11Å; T88-V122 HydrophobicContact CG2-CG1 4.18Å; H118-V122 WeakPolarHBondContact O-CG2 3.46Å; H118-V122 PolarHBondContact O-N 3.12Å; H118-V122 VanDerWaalsContact O-N 3.09Å; L119-V122 PolarHBondContact O-N 3.4Å; L119-V122 VanDerWaalsContact O-N 3.08Å; Q120-V122 VanDerWaalsContact C-N 3.34Å; Q120-V122 PolarHBondContact O-N 3.32Å; V122-F126 WeakPolarHBondContact O-CB 3.23Å; V122-F126 PolarHBondContact O-N 2.9Å
123Y98.2Very high95.5Very high0 Ų031 Ų310%017%0.167CC..Hα-helixtrans-64.3-47.7176-78.9-66.3000111.9F84 T88 W116 L119 Q120 F125 F126 L127 E163 F166 L167F84-Y123 AromaticContact CE2-CD1 3.64Å; F84-Y123 HydrophobicContact CE2-CD1 3.64Å; F84-Y123 AromaticContact CE2-CE1 3.75Å; F84-Y123 HydrophobicContact CE2-CE1 3.75Å; F84-Y123 HydrophobicContact CZ-CD1 4.07Å; F84-Y123 AromaticContact CZ-CE1 3.75Å; F84-Y123 HydrophobicContact CZ-CE1 3.75Å; T88-Y123 HydrophobicContact CG2-CE1 3.95Å; T88-Y123 HydrophobicContact CG2-CE2 4.12Å; W116-Y123 HydrophobicContact CZ3-CD2 4.43Å; W116-Y123 HydrophobicContact CZ3-CE2 4.41Å; L119-Y123 HydrophobicContact CB-CD2 4.39Å; L119-Y123 HydrophobicContact CB-CE2 4.34Å; L119-Y123 WeakPolarHBondContact O-CD2 3.3Å; L119-Y123 PolarHBondContact O-N 3.45Å; Q120-Y123 PolarHBondContact O-N 3.23Å; Y123-F125 VanDerWaalsContact C-N 3.34Å; Y123-F125 PolarHBondContact O-N 2.93Å; Y123-F126 PolarHBondContact O-N 3.34Å; Y123-L127 WeakPolarHBondContact O-CB 3.48Å; Y123-L127 PolarHBondContact O-N 3.33Å; Y123-E163 HydrophobicContact CE2-CG 3.72Å; Y123-E163 WeakPolarHBondContact OH-CG 3.46Å; Y123-E163 PolarHBondContact OH-OE1 3.48Å; Y123-F166 HydrophobicContact CD1-CB 3.9Å; Y123-F166 HydrophobicContact CD2-CB 4.23Å; Y123-F166 HydrophobicContact CD2-CG 4.49Å; Y123-F166 HydrophobicContact CG-CB 3.77Å; Y123-F166 HydrophobicContact CG-CD1 4.35Å; Y123-F166 HydrophobicContact CG-CG 4.05Å; Y123-L167 HydrophobicContact CE1-CD2 3.87Å; Y123-L167 HydrophobicContact CE1-CG 4.31Å
124E97.5Very high95.7Very high44 Ų4433.3 Ų33.321%0.20618%0.178CC..Hα-helixtrans-60-43.6177-75.6-175.1-153.300112.1M62 Q120 L127 R128 F166M62-E124 HydrophobicContact SD-CB 3.71Å; Q120-E124 WeakPolarHBondContact CG-OE1 3.33Å; Q120-E124 PolarHBondContact NE2-OE1 2.96Å; Q120-E124 WeakPolarHBondContact O-CB 3.39Å; Q120-E124 WeakPolarHBondContact O-CG 3.42Å; Q120-E124 PolarHBondContact O-N 2.86Å; E124-L127 PolarHBondContact O-N 3.36Å; E124-R128 WeakPolarHBondContact O-CG 3.21Å; E124-R128 PolarHBondContact O-N 3.22Å; E124-R128 IonicContact OE2-NH1 2.82Å; E124-F166 HydrophobicContact CG-CE1 3.6Å; E124-F166 HydrophobicContact CG-CZ 3.6Å
125F96.9Very high95.8Very high0 Ų031.7 Ų31.70%016%0.162CC..Hα-helixtrans-60.7-47.5176173.9-102.1000111.6F27 L61 M62 V65 V80 M83 L121 Y123 R128 F129F27-F125 HydrophobicContact CZ-CE2 4.29Å; F27-F125 HydrophobicContact CZ-CZ 4.13Å; L61-F125 HydrophobicContact CB-CD2 4.11Å; L61-F125 HydrophobicContact CB-CE2 3.78Å; M62-F125 HydrophobicContact CB-CD2 4.33Å; V65-F125 HydrophobicContact CB-CE2 4.33Å; V65-F125 HydrophobicContact CG2-CD2 4.45Å; V65-F125 HydrophobicContact CG2-CE2 3.52Å; V65-F125 HydrophobicContact CG2-CZ 4.09Å; V80-F125 HydrophobicContact CB-CE1 4.41Å; V80-F125 HydrophobicContact CG1-CE1 3.78Å; V80-F125 HydrophobicContact CG2-CE1 3.99Å; V80-F125 HydrophobicContact CG2-CZ 4.07Å; M83-F125 HydrophobicContact CE-CD1 3.38Å; M83-F125 HydrophobicContact CE-CE1 3.52Å; M83-F125 HydrophobicContact CE-CG 4.38Å; L121-F125 WeakPolarHBondContact O-CB 3.44Å; L121-F125 PolarHBondContact O-N 3.21Å; Y123-F125 VanDerWaalsContact C-N 3.34Å; Y123-F125 PolarHBondContact O-N 2.93Å; F125-R128 PolarHBondContact O-N 3.13Å; F125-F129 WeakPolarHBondContact O-CB 3.37Å; F125-F129 PolarHBondContact O-N 3.32Å
126F97.7Very high95.8Very high1 Ų132.5 Ų32.50%0.00417%0.167CC..Hα-helixtrans-67.2-38.3-179.1-170.1-114.3000112.3V80 I81 F84 V122 Y123 F129 L130 I144 F148 T170V80-F126 HydrophobicContact CG1-CD2 3.98Å; V80-F126 HydrophobicContact CG1-CE2 4.34Å; I81-F126 HydrophobicContact CG1-CE2 4.17Å; F84-F126 HydrophobicContact CB-CD2 3.93Å; F84-F126 HydrophobicContact CB-CE2 4.27Å; F84-F126 HydrophobicContact CB-CG 4.2Å; F84-F126 HydrophobicContact CD1-CD1 4.36Å; F84-F126 HydrophobicContact CD1-CE1 4.29Å; F84-F126 HydrophobicContact CD1-CZ 4.49Å; F84-F126 HydrophobicContact CD2-CB 3.48Å; F84-F126 VanDerWaalsContact CD2-CB 3.48Å; F84-F126 AromaticContact CD2-CD1 3.63Å; F84-F126 HydrophobicContact CD2-CD1 3.63Å; F84-F126 HydrophobicContact CD2-CD2 4.08Å; F84-F126 HydrophobicContact CD2-CE1 4.35Å; F84-F126 AromaticContact CD2-CG 3.46Å; F84-F126 HydrophobicContact CD2-CG 3.46Å; F84-F126 VanDerWaalsContact CD2-CG 3.46Å; F84-F126 HydrophobicContact CE1-CD1 4.36Å; F84-F126 HydrophobicContact CE1-CE1 4.3Å; F84-F126 HydrophobicContact CE2-CB 3.94Å; F84-F126 AromaticContact CE2-CD1 3.63Å; F84-F126 HydrophobicContact CE2-CD1 3.63Å; F84-F126 HydrophobicContact CE2-CE1 4.35Å; F84-F126 AromaticContact CE2-CG 3.92Å; F84-F126 HydrophobicContact CE2-CG 3.92Å; F84-F126 HydrophobicContact CG-CB 4.27Å; F84-F126 AromaticContact CG-CD1 4Å; F84-F126 HydrophobicContact CG-CD1 4Å; F84-F126 HydrophobicContact CG-CD2 4.02Å; F84-F126 HydrophobicContact CG-CE1 4.3Å; F84-F126 HydrophobicContact CG-CE2 4.35Å; F84-F126 AromaticContact CG-CG 3.84Å; F84-F126 HydrophobicContact CG-CG 3.84Å; F84-F126 HydrophobicContact CG-CZ 4.48Å; F84-F126 HydrophobicContact CZ-CD1 4.01Å; F84-F126 HydrophobicContact CZ-CE1 4.32Å; V122-F126 WeakPolarHBondContact O-CB 3.23Å; V122-F126 PolarHBondContact O-N 2.9Å; Y123-F126 PolarHBondContact O-N 3.34Å; F126-F129 HydrophobicContact CD2-CD1 4.48Å; F126-F129 HydrophobicContact CE2-CD1 4.47Å; F126-F129 WeakPolarHBondContact O-CB 3.2Å; F126-F129 PolarHBondContact O-N 3.34Å; F126-L130 HydrophobicContact CD1-CD1 3.82Å; F126-L130 HydrophobicContact CD1-CG 4.32Å; F126-L130 HydrophobicContact CE1-CD1 3.48Å; F126-L130 VanDerWaalsContact CE1-CD1 3.48Å; F126-L130 HydrophobicContact CE1-CG 4.04Å; F126-L130 HydrophobicContact CZ-CD1 4.05Å; F126-L130 HydrophobicContact CZ-CD2 4.29Å; F126-L130 HydrophobicContact CZ-CG 4.17Å; F126-L130 WeakPolarHBondContact O-CG 3.27Å; F126-L130 PolarHBondContact O-N 3.01Å; F126-I144 HydrophobicContact CZ-CD1 4.25Å; F126-F148 HydrophobicContact CE1-CZ 4.21Å; F126-F148 HydrophobicContact CZ-CE1 4.48Å; F126-F148 AromaticContact CZ-CZ 3.92Å; F126-F148 HydrophobicContact CZ-CZ 3.92Å; F126-T170 HydrophobicContact CD1-CG2 3.86Å; F126-T170 HydrophobicContact CE1-CG2 3.81Å
127L96.9Very high95.8Very high18 Ų1833.6 Ų33.69%0.09418%0.177CC..Hα-helixtrans-62.1-48.6172.8-81-178.6000111.7Y123 E124 F129 L130 E131 F166 T169 T170Y123-L127 WeakPolarHBondContact O-CB 3.48Å; Y123-L127 PolarHBondContact O-N 3.33Å; E124-L127 PolarHBondContact O-N 3.36Å; L127-F129 VanDerWaalsContact C-N 3.26Å; L127-F129 PolarHBondContact O-N 2.9Å; L127-L130 PolarHBondContact O-N 3.38Å; L127-L130 VanDerWaalsContact O-N 3.12Å; L127-E131 WeakPolarHBondContact O-CB 3.47Å; L127-E131 WeakPolarHBondContact O-CG 3.44Å; L127-E131 PolarHBondContact O-N 3.07Å; L127-F166 HydrophobicContact CD1-CD1 3.61Å; L127-F166 HydrophobicContact CD1-CE1 4Å; L127-T169 HydrophobicContact CD1-CG2 3.94Å; L127-T169 HydrophobicContact CD2-CG2 3.88Å; L127-T170 WeakPolarHBondContact CD2-OG1 3.14Å
128R95.2Very high95.7Very high105 Ų10536 Ų3640%0.39619%0.186SC..Hα-helixtrans-59.4-38.7176-75.9-165.6172.290-3.6112.1M62 S66 E124 F125 S132M62-R128 PolarHBondContact SD-NH1 3.3Å; S66-R128 WeakPolarHBondContact OG-CD 3.45Å; E124-R128 WeakPolarHBondContact O-CG 3.21Å; E124-R128 PolarHBondContact O-N 3.22Å; E124-R128 IonicContact OE2-NH1 2.82Å; F125-R128 PolarHBondContact O-N 3.13Å; R128-S132 PolarHBondContact O-N 3.06Å; R128-S132 VanDerWaalsContact O-N 3.09Å
129F95.6Very high95.7Very high3 Ų337 Ų371%0.01319%0.192CC..Hα-helixtrans-62.5-45.9173.9179.5-107.3000112.2F72 Y77 V80 F125 F126 L127 F135F72-F129 HydrophobicContact CD1-CD2 4.05Å; F72-F129 AromaticContact CD1-CE2 3.66Å; F72-F129 HydrophobicContact CD1-CE2 3.66Å; F72-F129 HydrophobicContact CD1-CZ 4.49Å; F72-F129 AromaticContact CE1-CD2 3.37Å; F72-F129 HydrophobicContact CE1-CD2 3.37Å; F72-F129 AromaticContact CE1-CE2 3.49Å; F72-F129 HydrophobicContact CE1-CE2 3.49Å; F72-F129 VanDerWaalsContact CE1-CE2 3.49Å; F72-F129 HydrophobicContact CE1-CG 4.28Å; F72-F129 HydrophobicContact CE1-CZ 4.47Å; F72-F129 AromaticContact CZ-CD2 3.96Å; F72-F129 HydrophobicContact CZ-CD2 3.96Å; F72-F129 HydrophobicContact CZ-CE2 4.38Å; Y77-F129 HydrophobicContact CD1-CE1 4.15Å; Y77-F129 AromaticContact CD1-CZ 3.77Å; Y77-F129 HydrophobicContact CD1-CZ 3.77Å; Y77-F129 HydrophobicContact CD2-CZ 4.38Å; Y77-F129 HydrophobicContact CE1-CE1 4.29Å; Y77-F129 AromaticContact CE1-CZ 3.83Å; Y77-F129 HydrophobicContact CE1-CZ 3.83Å; Y77-F129 HydrophobicContact CE2-CZ 4.41Å; Y77-F129 HydrophobicContact CG-CZ 4.06Å; V80-F129 HydrophobicContact CB-CE1 4.29Å; V80-F129 HydrophobicContact CB-CZ 4.42Å; V80-F129 HydrophobicContact CG1-CB 4.46Å; V80-F129 HydrophobicContact CG1-CD1 3.64Å; V80-F129 HydrophobicContact CG1-CD2 4.41Å; V80-F129 HydrophobicContact CG1-CE1 3.87Å; V80-F129 HydrophobicContact CG1-CG 3.92Å; V80-F129 HydrophobicContact CG1-CZ 4.38Å; V80-F129 HydrophobicContact CG2-CE2 4.38Å; F125-F129 WeakPolarHBondContact O-CB 3.37Å; F125-F129 PolarHBondContact O-N 3.32Å; F126-F129 HydrophobicContact CD2-CD1 4.48Å; F126-F129 HydrophobicContact CE2-CD1 4.47Å; F126-F129 WeakPolarHBondContact O-CB 3.2Å; F126-F129 PolarHBondContact O-N 3.34Å; L127-F129 VanDerWaalsContact C-N 3.26Å; L127-F129 PolarHBondContact O-N 2.9Å; F129-F135 HydrophobicContact CD1-CD2 4.06Å; F129-F135 AromaticContact CD1-CE2 3.93Å; F129-F135 HydrophobicContact CD1-CE2 3.93Å; F129-F135 AromaticContact CE1-CD2 3.8Å; F129-F135 HydrophobicContact CE1-CD2 3.8Å; F129-F135 AromaticContact CE1-CE2 3.49Å; F129-F135 HydrophobicContact CE1-CE2 3.49Å; F129-F135 VanDerWaalsContact CE1-CE2 3.49Å; F129-F135 HydrophobicContact CZ-CD2 4.07Å; F129-F135 HydrophobicContact CZ-CE2 4.08Å; F129-F135 WeakPolarHBondContact O-CD2 3.45Å
130L95.6Very high95.6Very high1 Ų136.9 Ų36.91%0.00519%0.191CC..Hα-helixtrans-67.4-37.5177.7-76.1177.8000113F126 L127 F135 I144 T170 I174 K177F126-L130 HydrophobicContact CD1-CD1 3.82Å; F126-L130 HydrophobicContact CD1-CG 4.32Å; F126-L130 HydrophobicContact CE1-CD1 3.48Å; F126-L130 VanDerWaalsContact CE1-CD1 3.48Å; F126-L130 HydrophobicContact CE1-CG 4.04Å; F126-L130 HydrophobicContact CZ-CD1 4.05Å; F126-L130 HydrophobicContact CZ-CD2 4.29Å; F126-L130 HydrophobicContact CZ-CG 4.17Å; F126-L130 WeakPolarHBondContact O-CG 3.27Å; F126-L130 PolarHBondContact O-N 3.01Å; L127-L130 PolarHBondContact O-N 3.38Å; L127-L130 VanDerWaalsContact O-N 3.12Å; L130-F135 HydrophobicContact CD2-CE1 4.13Å; L130-F135 HydrophobicContact CD2-CE2 3.8Å; L130-F135 HydrophobicContact CD2-CZ 3.55Å; L130-I144 HydrophobicContact CD2-CD1 4.29Å; L130-T170 HydrophobicContact CD1-CG2 4.07Å; L130-I174 HydrophobicContact CD1-CG1 4.12Å; L130-K177 WeakPolarHBondContact O-CE 3.15Å; L130-K177 PolarHBondContact O-NZ 2.95Å
131E94.2Very high95.5Very high85 Ų8538.5 Ų38.540%0.39720%0.197SC..Hα-helixtrans-81.2-18.2-175.6-70.6-173.215200113.5L127 R173L127-E131 WeakPolarHBondContact O-CB 3.47Å; L127-E131 WeakPolarHBondContact O-CG 3.44Å; L127-E131 PolarHBondContact O-N 3.07Å; E131-R173 HydrophobicContact CG-CG 4.23Å; E131-R173 IonicContact OE1-CZ 2.61Å; E131-R173 VanDerWaalsContact OE1-CZ 3.24Å; E131-R173 IonicContact OE1-NE 2.69Å; E131-R173 PolarHBondContact OE1-NE 3.42Å; E131-R173 IonicContact OE1-NH2 3.17Å; E131-R173 PolarHBondContact OE1-NH2 3.09Å
132S93.8Very high95.3Very high16 Ų1644.1 Ų44.111%0.11222%0.221CC..  trans-50.7137.3176.7177.90000112F72 R128 E134 F135F72-S132 WeakPolarHBondContact CE2-OG 3.4Å; F72-S132 WeakPolarHBondContact CZ-OG 3.02Å; R128-S132 PolarHBondContact O-N 3.06Å; R128-S132 VanDerWaalsContact O-N 3.09Å; S132-E134 PolarHBondContact O-N 3.25Å; S132-E134 PolarHBondContact OG-N 2.87Å; S132-F135 VanDerWaalsContact O-CB 3.24Å; S132-F135 WeakPolarHBondContact O-CB 3.42Å; S132-F135 PolarHBondContact O-N 3.03Å; S132-F135 VanDerWaalsContact O-N 3.17Å
133P92Very high95.2Very high101 Ų10148.3 Ų48.366%0.65624%0.237SC*.THydrogen-bonded Turntrans-65-24.6175.227.1-34.3000112.5F135P133-F135 VanDerWaalsContact C-N 3.26Å; P133-F135 PolarHBondContact O-N 3.06Å
134E93.7Very high95.2Very high81 Ų8148.3 Ų48.338%0.37924%0.237SC..THydrogen-bonded Turntrans-82.7-5.5179-49.1-57.6152.600112.4R69 F72 S132 S136R69-E134 HydrophobicContact CB-CG 3.82Å; R69-E134 WeakPolarHBondContact CD-OE1 3.46Å; R69-E134 HydrophobicContact CG-CG 3.9Å; R69-E134 IonicContact CZ-OE1 3.73Å; R69-E134 IonicContact NH1-OE1 3.8Å; R69-E134 PolarHBondContact NH1-OE1 2.76Å; F72-E134 HydrophobicContact CB-CB 4.11Å; F72-E134 HydrophobicContact CD1-CB 4.42Å; F72-E134 HydrophobicContact CD2-CB 3.9Å; F72-E134 HydrophobicContact CE2-CB 4.45Å; F72-E134 HydrophobicContact CG-CB 3.89Å; S132-E134 PolarHBondContact O-N 3.25Å; S132-E134 PolarHBondContact OG-N 2.87Å; E134-S136 PolarHBondContact O-N 3.16Å
135F94.2Very high95.1Very high11 Ų1149.8 Ų49.85%0.04825%0.247CC..  trans-67.2124.3176.8-179.1-92000111F72 Y77 F129 L130 S132 P133 P137 A140 K177 F178F72-F135 HydrophobicContact CE1-CB 4.38Å; Y77-F135 HydrophobicContact CD1-CE2 4.16Å; Y77-F135 AromaticContact CE1-CD2 3.77Å; Y77-F135 HydrophobicContact CE1-CD2 3.77Å; Y77-F135 AromaticContact CE1-CE2 3.55Å; Y77-F135 HydrophobicContact CE1-CE2 3.55Å; Y77-F135 HydrophobicContact CE1-CZ 4.21Å; F129-F135 HydrophobicContact CD1-CD2 4.06Å; F129-F135 AromaticContact CD1-CE2 3.93Å; F129-F135 HydrophobicContact CD1-CE2 3.93Å; F129-F135 AromaticContact CE1-CD2 3.8Å; F129-F135 HydrophobicContact CE1-CD2 3.8Å; F129-F135 AromaticContact CE1-CE2 3.49Å; F129-F135 HydrophobicContact CE1-CE2 3.49Å; F129-F135 VanDerWaalsContact CE1-CE2 3.49Å; F129-F135 HydrophobicContact CZ-CD2 4.07Å; F129-F135 HydrophobicContact CZ-CE2 4.08Å; F129-F135 WeakPolarHBondContact O-CD2 3.45Å; L130-F135 HydrophobicContact CD2-CE1 4.13Å; L130-F135 HydrophobicContact CD2-CE2 3.8Å; L130-F135 HydrophobicContact CD2-CZ 3.55Å; S132-F135 VanDerWaalsContact O-CB 3.24Å; S132-F135 WeakPolarHBondContact O-CB 3.42Å; S132-F135 PolarHBondContact O-N 3.03Å; S132-F135 VanDerWaalsContact O-N 3.17Å; P133-F135 VanDerWaalsContact C-N 3.26Å; P133-F135 PolarHBondContact O-N 3.06Å; F135-P137 HydrophobicContact CD1-CG 4.3Å; F135-P137 HydrophobicContact CE1-CG 4.22Å; F135-P137 WeakPolarHBondContact O-CD 3.29Å; F135-A140 HydrophobicContact CE1-CB 4.18Å; F135-A140 HydrophobicContact CE2-CB 4.03Å; F135-A140 HydrophobicContact CZ-CB 3.43Å; F135-A140 VanDerWaalsContact CZ-CB 3.43Å; F135-K177 HydrophobicContact CD1-CD 3.92Å; F135-K177 HydrophobicContact CE1-CD 4.12Å; F135-F178 HydrophobicContact CE1-CE2 4.35Å; F135-F178 AromaticContact CE1-CZ 3.86Å; F135-F178 HydrophobicContact CE1-CZ 3.86Å; F135-F178 HydrophobicContact CZ-CE2 4.38Å; F135-F178 AromaticContact CZ-CZ 3.8Å; F135-F178 HydrophobicContact CZ-CZ 3.8Å
136S94.8Very high95.1Very high36 Ų3654.8 Ų54.825%0.25227%0.27SS..  trans-105.5108-179.6179.30000111.3Y77 E134 N138 I139 A140Y77-S136 PolarHBondContact OH-N 3.3Å; E134-S136 PolarHBondContact O-N 3.16Å; S136-N138 PolarHBondContact O-N 2.72Å; S136-N138 VanDerWaalsContact O-N 3.15Å; S136-I139 PolarHBondContact O-N 2.94Å; S136-A140 PolarHBondContact O-N 3Å
137P94.5Very high95.1Very high42 Ų4261.1 Ų61.127%0.27330%0.297SS..Hα-helixtrans-60-26.2176.2-23.534.2000113.2F135 I139 K141 K177 F178F135-P137 HydrophobicContact CD1-CG 4.3Å; F135-P137 HydrophobicContact CE1-CG 4.22Å; F135-P137 WeakPolarHBondContact O-CD 3.29Å; P137-I139 VanDerWaalsContact C-N 3.34Å; P137-I139 PolarHBondContact O-N 3.19Å; P137-K141 WeakPolarHBondContact O-CB 3.27Å; P137-K141 PolarHBondContact O-N 3.46Å; P137-K177 HydrophobicContact CG-CB 4.3Å; P137-F178 HydrophobicContact CB-CD1 4.15Å; P137-F178 HydrophobicContact CB-CE1 3.88Å; P137-F178 HydrophobicContact CB-CZ 4.5Å; P137-F178 WeakPolarHBondContact O-CE1 3.43Å
138N93.5Very high95.1Very high115 Ų11560.6 Ų60.662%0.61529%0.294SS*.Hα-helixtrans-68.9-30.6-178.8-75.4-34.8000113.5S136 K141S136-N138 PolarHBondContact O-N 2.72Å; S136-N138 VanDerWaalsContact O-N 3.15Å; N138-K141 WeakPolarHBondContact O-CE 3.41Å; N138-K141 WeakPolarHBondContact O-CG 3.42Å
139I95.1Very high95.3Very high29 Ų2955.6 Ų55.615%0.14928%0.276CS..Hα-helixtrans-81.8-49174.5-61.8164.5000108.7E74 Y77 S136 P137 K141 K142E74-I139 HydrophobicContact CB-CG2 4.38Å; E74-I139 HydrophobicContact CG-CD1 3.68Å; E74-I139 HydrophobicContact CG-CG1 4.07Å; E74-I139 HydrophobicContact CG-CG2 4.13Å; Y77-I139 HydrophobicContact CD1-CB 4.41Å; Y77-I139 HydrophobicContact CD1-CG2 4.13Å; Y77-I139 HydrophobicContact CD2-CB 4.4Å; Y77-I139 HydrophobicContact CD2-CG2 3.68Å; Y77-I139 HydrophobicContact CE1-CB 4.36Å; Y77-I139 HydrophobicContact CE1-CG2 4.49Å; Y77-I139 HydrophobicContact CE2-CB 4.38Å; Y77-I139 HydrophobicContact CE2-CD1 4.26Å; Y77-I139 HydrophobicContact CE2-CG2 4.11Å; Y77-I139 HydrophobicContact CG-CB 4.44Å; Y77-I139 HydrophobicContact CG-CG2 3.71Å; S136-I139 PolarHBondContact O-N 2.94Å; P137-I139 VanDerWaalsContact C-N 3.34Å; P137-I139 PolarHBondContact O-N 3.19Å; I139-K141 VanDerWaalsContact C-N 3.25Å; I139-K141 PolarHBondContact O-N 3.28Å; I139-K142 PolarHBondContact O-N 3.47Å
140A95.5Very high95.4Very high0 Ų058.3 Ų58.30%029%0.29CS..Hα-helixtrans-60.5-29.3-176.800000114.1Y77 F135 S136 K142 Y143 I144 F178Y77-A140 HydrophobicContact CD1-CB 3.69Å; Y77-A140 HydrophobicContact CE1-CB 3.86Å; F135-A140 HydrophobicContact CE1-CB 4.18Å; F135-A140 HydrophobicContact CE2-CB 4.03Å; F135-A140 HydrophobicContact CZ-CB 3.43Å; F135-A140 VanDerWaalsContact CZ-CB 3.43Å; S136-A140 PolarHBondContact O-N 3Å; A140-K142 PolarHBondContact O-N 2.57Å; A140-Y143 PolarHBondContact O-N 3.26Å; A140-I144 HydrophobicContact CB-CD1 4.45Å; A140-I144 PolarHBondContact O-N 2.99Å; A140-F178 HydrophobicContact CB-CE1 3.86Å; A140-F178 HydrophobicContact CB-CZ 3.66Å
141K94.8Very high95.5Very high104 Ų10461.2 Ų61.245%0.45230%0.303SS..THydrogen-bonded Turntrans-58.5-19.5-178.976.7-176.7-177.9179.10115P137 N138 I139 Y143 Y180P137-K141 WeakPolarHBondContact O-CB 3.27Å; P137-K141 PolarHBondContact O-N 3.46Å; N138-K141 WeakPolarHBondContact O-CE 3.41Å; N138-K141 WeakPolarHBondContact O-CG 3.42Å; I139-K141 VanDerWaalsContact C-N 3.25Å; I139-K141 PolarHBondContact O-N 3.28Å; K141-Y143 PolarHBondContact O-N 3.45Å; K141-Y180 VanDerWaalsContact CA-OH 3.27Å; K141-Y180 WeakPolarHBondContact CA-OH 3.24Å; K141-Y180 HydrophobicContact CB-CE1 3.63Å; K141-Y180 VanDerWaalsContact CB-OH 3.26Å; K141-Y180 WeakPolarHBondContact CB-OH 3.43Å
142K94.3Very high95.7Very high135 Ų13557.2 Ų57.259%0.58729%0.285SS*.THydrogen-bonded Turntrans-72.7-18.2176.2-62.8178.2-174.9171.50112.4I139 A140I139-K142 PolarHBondContact O-N 3.47Å; A140-K142 PolarHBondContact O-N 2.57Å
143Y95.9Very high95.9Very high88 Ų8856.5 Ų56.535%0.34528%0.279SS..THydrogen-bonded Turntrans-124.3-31.2-169.5-51.1-66.4000112.5P78 I81 A140 K141 D145P78-Y143 HydrophobicContact CB-CD1 4.06Å; P78-Y143 HydrophobicContact CB-CE1 3.68Å; P78-Y143 HydrophobicContact CB-CE2 4.28Å; P78-Y143 HydrophobicContact CG-CE1 4.3Å; P78-Y143 HydrophobicContact CG-CE2 4.35Å; I81-Y143 VanDerWaalsContact CD1-CB 3.48Å; I81-Y143 HydrophobicContact CD1-CD2 4.21Å; I81-Y143 HydrophobicContact CD1-CG 4.23Å; A140-Y143 PolarHBondContact O-N 3.26Å; K141-Y143 PolarHBondContact O-N 3.45Å; Y143-D145 PolarHBondContact O-N 3.07Å
144I96.8Very high96.1Very high0 Ų057.1 Ų57.10%027%0.274CS..SBendtrans-91.782.3171.2-54.8-171.6000108I81 F126 L130 A140 F148 I174 F178 Y180 L181I81-I144 HydrophobicContact CD1-CD1 4.17Å; I81-I144 HydrophobicContact CD1-CG1 3.7Å; I81-I144 HydrophobicContact CG1-CG1 4.31Å; F126-I144 HydrophobicContact CZ-CD1 4.25Å; L130-I144 HydrophobicContact CD2-CD1 4.29Å; A140-I144 HydrophobicContact CB-CD1 4.45Å; A140-I144 PolarHBondContact O-N 2.99Å; I144-F148 HydrophobicContact CG2-CD1 3.81Å; I144-F148 HydrophobicContact CG2-CE1 4.28Å; I144-F148 HydrophobicContact CG2-CG 4.36Å; I144-I174 HydrophobicContact CG2-CD1 4.5Å; I144-I174 HydrophobicContact CG2-CG2 4.3Å; I144-F178 HydrophobicContact CB-CZ 4.37Å; I144-F178 HydrophobicContact CD1-CE2 3.86Å; I144-F178 HydrophobicContact CD1-CZ 3.77Å; I144-F178 HydrophobicContact CG1-CZ 4.46Å; I144-F178 HydrophobicContact CG2-CE2 4.37Å; I144-Y180 PolarHBondContact O-OH 3.28Å; I144-L181 HydrophobicContact CG2-CD1 4.02Å
145D95.6Very high96.3Very high75 Ų7553.3 Ų53.340%0.40126%0.256SS..  trans-99.9-172.5-179.671.5-1.4000112.3Y143 K147 F148 V149Y143-D145 PolarHBondContact O-N 3.07Å; D145-K147 PolarHBondContact O-N 3.41Å; D145-K147 WeakPolarHBondContact OD1-CA 3.49Å; D145-K147 WeakPolarHBondContact OD1-CB 3.23Å; D145-K147 PolarHBondContact OD1-N 3.06Å; D145-F148 PolarHBondContact O-N 3.43Å; D145-F148 PolarHBondContact OD1-N 3.08Å; D145-V149 PolarHBondContact O-N 3.27Å; D145-V149 VanDerWaalsContact O-N 3.15Å
146Q97.7Very high96.4Very high105 Ų10552.8 Ų52.849%0.49125%0.254SS..Hα-helixtrans-63.4-30.8177.6-71.4-176.4-2.100113L150 L181 Y184Q146-L150 WeakPolarHBondContact O-CB 3.15Å; Q146-L150 PolarHBondContact O-N 2.87Å; Q146-L181 HydrophobicContact CG-CD2 4.18Å; Q146-Y184 HydrophobicContact CB-CD1 4.04Å; Q146-Y184 HydrophobicContact CB-CD2 4.23Å; Q146-Y184 HydrophobicContact CB-CE1 3.71Å; Q146-Y184 HydrophobicContact CB-CE2 3.91Å; Q146-Y184 HydrophobicContact CB-CG 4.29Å; Q146-Y184 VanDerWaalsContact CD-CD2 3.42Å; Q146-Y184 HydrophobicContact CG-CD1 3.87Å; Q146-Y184 HydrophobicContact CG-CD2 3.76Å; Q146-Y184 HydrophobicContact CG-CE1 4.06Å; Q146-Y184 HydrophobicContact CG-CE2 3.96Å; Q146-Y184 HydrophobicContact CG-CG 3.72Å; Q146-Y184 WeakPolarHBondContact O-CE1 3.3Å; Q146-Y184 PolarHBondContact O-OH 2.94Å
147K97.1Very high96.5Very high133 Ų13353.4 Ų53.458%0.57825%0.254SS*.Hα-helixtrans-70.1-45.1177.9-178.1-176.4175.2-175.20110.1D145 V149 L150 Q151D145-K147 PolarHBondContact O-N 3.41Å; D145-K147 WeakPolarHBondContact OD1-CA 3.49Å; D145-K147 WeakPolarHBondContact OD1-CB 3.23Å; D145-K147 PolarHBondContact OD1-N 3.06Å; K147-V149 VanDerWaalsContact C-N 3.29Å; K147-V149 PolarHBondContact O-N 3.22Å; K147-L150 PolarHBondContact O-N 2.95Å; K147-L150 VanDerWaalsContact O-N 3.15Å; K147-Q151 WeakPolarHBondContact O-CG 3.49Å; K147-Q151 PolarHBondContact O-N 3.37Å
148F97.7Very high96.5Very high8 Ų851.9 Ų51.94%0.03524%0.244CC..Hα-helixtrans-55.1-46.6174.2-175.3-81.8000111.4I81 F84 A85 F89 F126 I144 D145 L150 Q151 L152 I174I81-F148 HydrophobicContact CG2-CD2 3.96Å; I81-F148 HydrophobicContact CG2-CE2 3.68Å; F84-F148 AromaticContact CD1-CE2 3.94Å; F84-F148 HydrophobicContact CD1-CE2 3.94Å; F84-F148 AromaticContact CD1-CZ 3.57Å; F84-F148 HydrophobicContact CD1-CZ 3.57Å; F84-F148 HydrophobicContact CE1-CE1 4.48Å; F84-F148 HydrophobicContact CE1-CE2 4.41Å; F84-F148 AromaticContact CE1-CZ 3.72Å; F84-F148 HydrophobicContact CE1-CZ 3.72Å; A85-F148 HydrophobicContact CB-CE2 4.44Å; F89-F148 AromaticContact CE2-CD2 3.55Å; F89-F148 HydrophobicContact CE2-CD2 3.55Å; F89-F148 AromaticContact CE2-CE2 3.71Å; F89-F148 HydrophobicContact CE2-CE2 3.71Å; F89-F148 HydrophobicContact CE2-CG 4.14Å; F89-F148 HydrophobicContact CE2-CZ 4.42Å; F89-F148 HydrophobicContact CZ-CD1 4.16Å; F89-F148 AromaticContact CZ-CD2 3.62Å; F89-F148 HydrophobicContact CZ-CD2 3.62Å; F89-F148 HydrophobicContact CZ-CE1 4.07Å; F89-F148 AromaticContact CZ-CE2 3.51Å; F89-F148 HydrophobicContact CZ-CE2 3.51Å; F89-F148 AromaticContact CZ-CG 3.94Å; F89-F148 HydrophobicContact CZ-CG 3.94Å; F89-F148 AromaticContact CZ-CZ 3.76Å; F89-F148 HydrophobicContact CZ-CZ 3.76Å; F126-F148 HydrophobicContact CE1-CZ 4.21Å; F126-F148 HydrophobicContact CZ-CE1 4.48Å; F126-F148 AromaticContact CZ-CZ 3.92Å; F126-F148 HydrophobicContact CZ-CZ 3.92Å; I144-F148 HydrophobicContact CG2-CD1 3.81Å; I144-F148 HydrophobicContact CG2-CE1 4.28Å; I144-F148 HydrophobicContact CG2-CG 4.36Å; D145-F148 PolarHBondContact O-N 3.43Å; D145-F148 PolarHBondContact OD1-N 3.08Å; F148-L150 PolarHBondContact O-N 3.3Å; F148-Q151 PolarHBondContact O-N 3.01Å; F148-L152 HydrophobicContact CE1-CD2 4.45Å; F148-L152 WeakPolarHBondContact O-CB 3.5Å; F148-L152 PolarHBondContact O-N 3.42Å; F148-I174 HydrophobicContact CE1-CD1 3.99Å
149V98.1Very high96.4Very high0 Ų047.3 Ų47.30%022%0.219CC..Hα-helixtrans-62.7-40.8177.7170.50000112.2D145 K147 L152 L153 I174 L181 Y184 I185D145-V149 PolarHBondContact O-N 3.27Å; D145-V149 VanDerWaalsContact O-N 3.15Å; K147-V149 VanDerWaalsContact C-N 3.29Å; K147-V149 PolarHBondContact O-N 3.22Å; V149-L152 PolarHBondContact O-N 3.18Å; V149-L153 HydrophobicContact CG1-CD1 4Å; V149-L153 WeakPolarHBondContact O-CB 3.31Å; V149-L153 WeakPolarHBondContact O-CG 3.44Å; V149-L153 PolarHBondContact O-N 3.22Å; V149-I174 HydrophobicContact CG2-CG2 4.43Å; V149-L181 HydrophobicContact CG2-CD1 3.85Å; V149-L181 HydrophobicContact CG2-CD2 4.38Å; V149-Y184 HydrophobicContact CB-CD1 4.32Å; V149-Y184 HydrophobicContact CB-CE1 4.21Å; V149-Y184 HydrophobicContact CG1-CD1 4.01Å; V149-Y184 HydrophobicContact CG1-CE1 4.08Å; V149-I185 HydrophobicContact CG1-CD1 4.5Å; V149-I185 HydrophobicContact CG1-CG1 3.6Å; V149-I185 HydrophobicContact CG2-CG1 4.46Å
150L97.8Very high96.4Very high60 Ų6046 Ų4631%0.31421%0.212SC..Hα-helixtrans-63.3-48.6178.9-178.463.6000111.1Q146 K147 F148 L152 L153 E154Q146-L150 WeakPolarHBondContact O-CB 3.15Å; Q146-L150 PolarHBondContact O-N 2.87Å; K147-L150 PolarHBondContact O-N 2.95Å; K147-L150 VanDerWaalsContact O-N 3.15Å; F148-L150 PolarHBondContact O-N 3.3Å; L150-L152 VanDerWaalsContact C-N 3.28Å; L150-L152 PolarHBondContact O-N 3.18Å; L150-L153 WeakPolarHBondContact O-CB 3.34Å; L150-L153 PolarHBondContact O-N 3.25Å; L150-L153 VanDerWaalsContact O-N 3.1Å; L150-E154 WeakPolarHBondContact O-CG 3.43Å; L150-E154 PolarHBondContact O-N 2.9Å
151Q97.8Very high96.4Very high62 Ų6248.5 Ų48.529%0.2923%0.228SC..Hα-helixtrans-63.9-34.2178-64.6-173-82.300112.1F89 K147 F148F89-Q151 HydrophobicContact CB-CB 4.39Å; F89-Q151 HydrophobicContact CD1-CB 3.9Å; F89-Q151 HydrophobicContact CD2-CB 3.76Å; F89-Q151 HydrophobicContact CD2-CG 4.41Å; F89-Q151 HydrophobicContact CE1-CB 4.05Å; F89-Q151 HydrophobicContact CE2-CB 3.91Å; F89-Q151 HydrophobicContact CG-CB 3.77Å; F89-Q151 HydrophobicContact CZ-CB 4.06Å; K147-Q151 WeakPolarHBondContact O-CG 3.49Å; K147-Q151 PolarHBondContact O-N 3.37Å; F148-Q151 PolarHBondContact O-N 3.01Å
152L98.1Very high96.5Very high0 Ų047.8 Ų47.80%022%0.223CC..Hα-helixtrans-66.1-39.8173.1-174.569.7000112.1F84 F89 F148 V149 L150 L155 L167 T170 L171 I174F84-L152 HydrophobicContact CE1-CD1 4.02Å; F84-L152 HydrophobicContact CZ-CD1 3.96Å; F89-L152 HydrophobicContact CE1-CB 4.03Å; F89-L152 HydrophobicContact CE1-CD1 4.23Å; F89-L152 HydrophobicContact CZ-CB 4.36Å; F148-L152 HydrophobicContact CE1-CD2 4.45Å; F148-L152 WeakPolarHBondContact O-CB 3.5Å; F148-L152 PolarHBondContact O-N 3.42Å; V149-L152 PolarHBondContact O-N 3.18Å; L150-L152 VanDerWaalsContact C-N 3.28Å; L150-L152 PolarHBondContact O-N 3.18Å; L152-L155 PolarHBondContact O-N 3.48Å; L152-L167 HydrophobicContact CD1-CD2 3.47Å; L152-L167 VanDerWaalsContact CD1-CD2 3.47Å; L152-L167 HydrophobicContact CG-CD2 4.27Å; L152-T170 HydrophobicContact CD2-CG2 4.22Å; L152-L171 HydrophobicContact CD2-CB 4.37Å; L152-L171 HydrophobicContact CD2-CD1 4.21Å; L152-I174 HydrophobicContact CD2-CD1 3.72Å
153L98.1Very high96.6Very high1 Ų141.4 Ų41.41%0.00520%0.195CC..Hα-helixtrans-68.2-37.1177.9-82.7169.5000112.4V149 L150 L155 F156 L171 Q188 I189 I192 Y203 L209V149-L153 HydrophobicContact CG1-CD1 4Å; V149-L153 WeakPolarHBondContact O-CB 3.31Å; V149-L153 WeakPolarHBondContact O-CG 3.44Å; V149-L153 PolarHBondContact O-N 3.22Å; L150-L153 WeakPolarHBondContact O-CB 3.34Å; L150-L153 PolarHBondContact O-N 3.25Å; L150-L153 VanDerWaalsContact O-N 3.1Å; L153-L155 PolarHBondContact O-N 2.85Å; L153-F156 HydrophobicContact CD2-CD2 4.32Å; L153-F156 HydrophobicContact CD2-CE2 4.36Å; L153-F156 WeakPolarHBondContact O-CB 3.41Å; L153-F156 PolarHBondContact O-N 3.03Å; L153-F156 VanDerWaalsContact O-N 3.08Å; L153-L171 HydrophobicContact CD2-CD2 3.52Å; L153-L171 HydrophobicContact CG-CD2 4.38Å; L153-Q188 HydrophobicContact CD1-CB 3.49Å; L153-Q188 VanDerWaalsContact CD1-CB 3.49Å; L153-Q188 HydrophobicContact CD1-CG 4.37Å; L153-I189 HydrophobicContact CD2-CG1 4Å; L153-I192 HydrophobicContact CB-CD1 4.13Å; L153-I192 HydrophobicContact CD2-CD1 4.18Å; L153-Y203 PolarHBondContact O-OH 2.95Å; L153-L209 HydrophobicContact CD2-CD2 3.97Å
154E96.6Very high96.7Very high114 Ų11438.8 Ų38.853%0.53319%0.185SC..Hα-helixtrans-58.4-27.2175.7-73.3169.2179.200112.6L150 F156L150-E154 WeakPolarHBondContact O-CG 3.43Å; L150-E154 PolarHBondContact O-N 2.9Å; E154-F156 VanDerWaalsContact C-N 3.32Å; E154-F156 PolarHBondContact O-N 3.01Å
155L97.6Very high96.8Very high2 Ų242.4 Ų42.41%0.0120%0.204CC..G310 helixtrans-74.7-16.3178-63.1177000114.1T88 F89 L92 L152 L153 D157 T158 L167T88-L155 WeakPolarHBondContact O-CD2 3.43Å; F89-L155 HydrophobicContact CD1-CD1 3.9Å; F89-L155 HydrophobicContact CE1-CD1 4.33Å; L92-L155 HydrophobicContact CD2-CD2 4.3Å; L152-L155 PolarHBondContact O-N 3.48Å; L153-L155 PolarHBondContact O-N 2.85Å; L155-D157 PolarHBondContact O-N 3.47Å; L155-D157 VanDerWaalsContact O-N 3.13Å; L155-T158 WeakPolarHBondContact O-CB 3.35Å; L155-T158 WeakPolarHBondContact O-CG2 3.42Å; L155-T158 PolarHBondContact O-N 3.11Å; L155-T158 VanDerWaalsContact O-N 3.08Å; L155-L167 VanDerWaalsContact C-CD1 3.5Å; L155-L167 HydrophobicContact CB-CD1 3.61Å; L155-L167 HydrophobicContact CB-CD2 3.9Å; L155-L167 HydrophobicContact CB-CG 4.42Å; L155-L167 HydrophobicContact CD1-CD2 4.02Å; L155-L167 VanDerWaalsContact O-CD1 3.3Å; L155-L167 WeakPolarHBondContact O-CD1 3.34Å
156F97.8Very high96.9Very high0 Ų040.6 Ų40.60%019%0.193CC..G310 helixtrans-65.1-15.9-179.5-88.7-101.4000113.1L153 E154 T158 R164 L167 K168 L171 Y203 G205 E208 L209 I212L153-F156 HydrophobicContact CD2-CD2 4.32Å; L153-F156 HydrophobicContact CD2-CE2 4.36Å; L153-F156 WeakPolarHBondContact O-CB 3.41Å; L153-F156 PolarHBondContact O-N 3.03Å; L153-F156 VanDerWaalsContact O-N 3.08Å; E154-F156 VanDerWaalsContact C-N 3.32Å; E154-F156 PolarHBondContact O-N 3.01Å; F156-T158 PolarHBondContact O-N 3.11Å; F156-R164 WeakPolarHBondContact O-CD 3.49Å; F156-L167 HydrophobicContact CD2-CB 4.05Å; F156-L167 HydrophobicContact CD2-CD1 4.32Å; F156-L167 HydrophobicContact CE1-CB 4.16Å; F156-L167 HydrophobicContact CE2-CB 3.68Å; F156-L167 HydrophobicContact CG-CB 4.46Å; F156-L167 HydrophobicContact CG-CD1 4.5Å; F156-L167 VanDerWaalsContact CZ-C 3.43Å; F156-L167 HydrophobicContact CZ-CB 3.74Å; F156-L167 WeakPolarHBondContact CZ-O 3.28Å; F156-K168 HydrophobicContact CE1-CB 4.41Å; F156-L171 HydrophobicContact CE2-CB 4.14Å; F156-L171 HydrophobicContact CE2-CD2 3.73Å; F156-L171 HydrophobicContact CZ-CB 4.01Å; F156-L171 HydrophobicContact CZ-CD2 3.75Å; F156-Y203 HydrophobicContact CB-CE1 4.15Å; F156-Y203 VanDerWaalsContact CB-OH 3.26Å; F156-Y203 WeakPolarHBondContact CB-OH 3.5Å; F156-G205 VanDerWaalsContact O-CA 3.25Å; F156-G205 WeakPolarHBondContact O-CA 3.39Å; F156-G205 PolarHBondContact O-N 3.25Å; F156-E208 HydrophobicContact CD1-CB 4.28Å; F156-E208 HydrophobicContact CE1-CB 4.06Å; F156-L209 HydrophobicContact CD1-CD2 3.73Å; F156-L209 HydrophobicContact CD1-CG 3.88Å; F156-L209 HydrophobicContact CD2-CD2 4.34Å; F156-L209 HydrophobicContact CE1-CD2 3.7Å; F156-L209 HydrophobicContact CE1-CG 4.2Å; F156-L209 HydrophobicContact CE2-CD2 4.31Å; F156-L209 HydrophobicContact CG-CD2 4.04Å; F156-L209 HydrophobicContact CG-CG 4.36Å; F156-L209 HydrophobicContact CZ-CD2 3.99Å; F156-I212 HydrophobicContact CE1-CD1 4.2Å; F156-I212 HydrophobicContact CZ-CD1 3.96Å
157D95.4Very high96.9Very high49 Ų4935.6 Ų35.626%0.26217%0.169SC..G310 helixtrans-81.74.7175.6-156.228.7000113.4L92 L155 Y203 N204L92-D157 VanDerWaalsContact CD1-C 3.45Å; L92-D157 HydrophobicContact CD1-CB 3.75Å; L155-D157 PolarHBondContact O-N 3.47Å; L155-D157 VanDerWaalsContact O-N 3.13Å; D157-Y203 HydrophobicContact CB-CD2 4.11Å; D157-Y203 HydrophobicContact CB-CE2 3.72Å; D157-Y203 WeakPolarHBondContact OD1-CA 3.25Å; D157-N204 PolarHBondContact O-ND2 2.91Å; D157-N204 PolarHBondContact OD1-N 3.4Å
158T94.6Very high97Very high9 Ų930.9 Ų30.96%0.05515%0.149CC..  trans-60138.1174.4-172.50000111.5L155 F156 D160 E163 R164 L167L155-T158 WeakPolarHBondContact O-CB 3.35Å; L155-T158 WeakPolarHBondContact O-CG2 3.42Å; L155-T158 PolarHBondContact O-N 3.11Å; L155-T158 VanDerWaalsContact O-N 3.08Å; F156-T158 PolarHBondContact O-N 3.11Å; T158-D160 PolarHBondContact O-N 3.14Å; T158-E163 HydrophobicContact CG2-CB 3.78Å; T158-E163 HydrophobicContact CG2-CG 3.97Å; T158-E163 PolarHBondContact OG1-OE2 3.24Å; T158-E163 VanDerWaalsContact OG1-OE2 3.12Å; T158-R164 HydrophobicContact CG2-CG 3.49Å; T158-R164 VanDerWaalsContact CG2-CG 3.49Å; T158-R164 WeakPolarHBondContact O-CD 3.09Å; T158-R164 PolarHBondContact O-NH1 2.98Å; T158-L167 HydrophobicContact CG2-CD1 4.29Å
159E92.5Very high97Very high20 Ų2032.4 Ų32.49%0.09316%0.159CC..SBendtrans-69.1-24.1177.5-66.1-175.5-121.800111.8P95 T96 A111 P161 R164P95-E159 WeakPolarHBondContact CA-OE1 3.46Å; T96-E159 PolarHBondContact N-OE1 3.49Å; T96-E159 PolarHBondContact OG1-OE2 3.25Å; A111-E159 HydrophobicContact CB-CB 4.03Å; A111-E159 HydrophobicContact CB-CG 4.49Å; A111-E159 WeakPolarHBondContact CB-OE2 3.36Å; E159-P161 VanDerWaalsContact O-CD 3.24Å; E159-P161 WeakPolarHBondContact O-CD 3.44Å; E159-R164 PolarHBondContact O-NH1 2.86Å
160D94.5Very high97Very high1 Ų132.4 Ų32.41%0.00516%0.159CC..  trans-76.7110.1-177.5-165.5-36.6000111.9E113 T158 R162 E163 R164E113-D160 HydrophobicContact CB-CB 4.41Å; E113-D160 PolarHBondContact N-OD2 3.44Å; T158-D160 PolarHBondContact O-N 3.14Å; D160-R162 PolarHBondContact O-N 2.75Å; D160-R162 VanDerWaalsContact O-N 3.15Å; D160-R162 WeakPolarHBondContact OD1-CB 3.46Å; D160-R162 WeakPolarHBondContact OD1-CG 3.47Å; D160-R162 IonicContact OD1-CZ 3.59Å; D160-R162 PolarHBondContact OD1-N 3.26Å; D160-R162 IonicContact OD1-NE 2.85Å; D160-R162 PolarHBondContact OD1-NE 2.85Å; D160-R162 IonicContact OD1-NH2 3.67Å; D160-R162 IonicContact OD2-CZ 2.93Å; D160-R162 IonicContact OD2-NE 3.34Å; D160-R162 PolarHBondContact OD2-NE 3Å; D160-R162 IonicContact OD2-NH2 3.7Å; D160-R162 PolarHBondContact OD2-NH2 3.35Å; D160-E163 HydrophobicContact CB-CB 4.26Å; D160-E163 PolarHBondContact O-N 3.46Å; D160-E163 VanDerWaalsContact O-N 3.14Å; D160-R164 PolarHBondContact O-N 3.17Å
161P95Very high97.1Very high52 Ų5229.6 Ų29.634%0.33814%0.144SC..Hα-helixtrans-62.6-26-178.225.3-34.2000112.9E159 R164 D165E159-P161 VanDerWaalsContact O-CD 3.24Å; E159-P161 WeakPolarHBondContact O-CD 3.44Å; P161-R164 PolarHBondContact O-N 3.01Å; P161-D165 PolarHBondContact O-N 2.9Å
162R96.9Very high97.1Very high90 Ų9029.1 Ų29.134%0.3414%0.142SC..Hα-helixtrans-68.5-42179.3-50.7170.2-66.9-1784.8110W116 D160 D165 F166W116-R162 VanDerWaalsContact CD1-CZ 3.43Å; W116-R162 VanDerWaalsContact CD1-NH1 3.3Å; W116-R162 VanDerWaalsContact CH2-C 3.47Å; W116-R162 HydrophobicContact CH2-CB 3.71Å; W116-R162 HydrophobicContact CZ2-CB 3.33Å; W116-R162 HydrophobicContact CZ2-CG 4.44Å; W116-R162 HydrophobicContact CZ3-CB 4.47Å; D160-R162 PolarHBondContact O-N 2.75Å; D160-R162 VanDerWaalsContact O-N 3.15Å; D160-R162 WeakPolarHBondContact OD1-CB 3.46Å; D160-R162 WeakPolarHBondContact OD1-CG 3.47Å; D160-R162 IonicContact OD1-CZ 3.59Å; D160-R162 PolarHBondContact OD1-N 3.26Å; D160-R162 IonicContact OD1-NE 2.85Å; D160-R162 PolarHBondContact OD1-NE 2.85Å; D160-R162 IonicContact OD1-NH2 3.67Å; D160-R162 IonicContact OD2-CZ 2.93Å; D160-R162 IonicContact OD2-NE 3.34Å; D160-R162 PolarHBondContact OD2-NE 3Å; D160-R162 IonicContact OD2-NH2 3.7Å; D160-R162 PolarHBondContact OD2-NH2 3.35Å; R162-D165 PolarHBondContact O-N 3.23Å; R162-F166 WeakPolarHBondContact O-CD2 3.48Å; R162-F166 PolarHBondContact O-N 3.47Å
163E97.7Very high97Very high0 Ų033.3 Ų33.30%016%0.158CC..Hα-helixtrans-64.7-42.9176.2-170.1166.4-157.100110.7R90 W116 Y123 T158 D160 D165 F166 L167R90-E163 IonicContact CZ-OE1 2.73Å; R90-E163 IonicContact CZ-OE2 2.92Å; R90-E163 IonicContact NH1-OE1 3.96Å; R90-E163 PolarHBondContact NH1-OE1 3.15Å; R90-E163 IonicContact NH1-OE2 3.81Å; R90-E163 IonicContact NH2-OE1 3.45Å; R90-E163 PolarHBondContact NH2-OE1 2.96Å; R90-E163 IonicContact NH2-OE2 3.82Å; R90-E163 PolarHBondContact NH2-OE2 3.1Å; W116-E163 HydrophobicContact CH2-CB 4.11Å; W116-E163 HydrophobicContact CZ3-CB 3.6Å; W116-E163 HydrophobicContact CZ3-CG 4.14Å; Y123-E163 HydrophobicContact CE2-CG 3.72Å; Y123-E163 WeakPolarHBondContact OH-CG 3.46Å; Y123-E163 PolarHBondContact OH-OE1 3.48Å; T158-E163 HydrophobicContact CG2-CB 3.78Å; T158-E163 HydrophobicContact CG2-CG 3.97Å; T158-E163 PolarHBondContact OG1-OE2 3.24Å; T158-E163 VanDerWaalsContact OG1-OE2 3.12Å; D160-E163 HydrophobicContact CB-CB 4.26Å; D160-E163 PolarHBondContact O-N 3.46Å; D160-E163 VanDerWaalsContact O-N 3.14Å; E163-D165 VanDerWaalsContact C-N 3.33Å; E163-D165 PolarHBondContact O-N 3.47Å; E163-F166 PolarHBondContact O-N 2.98Å; E163-L167 HydrophobicContact CG-CD1 4.01Å; E163-L167 HydrophobicContact CG-CG 4.31Å; E163-L167 WeakPolarHBondContact O-CB 3.45Å; E163-L167 VanDerWaalsContact O-CG 3.24Å; E163-L167 WeakPolarHBondContact O-CG 3.43Å; E163-L167 PolarHBondContact O-N 3.42Å
164R97.6Very high97Very high34 Ų3433.3 Ų33.313%0.12816%0.157CC..Hα-helixtrans-59-40176.4-63.3-162.4-58.4-88.84.1113.1F156 T158 E159 D160 P161 L167 K168 E208F156-R164 WeakPolarHBondContact O-CD 3.49Å; T158-R164 HydrophobicContact CG2-CG 3.49Å; T158-R164 VanDerWaalsContact CG2-CG 3.49Å; T158-R164 WeakPolarHBondContact O-CD 3.09Å; T158-R164 PolarHBondContact O-NH1 2.98Å; E159-R164 PolarHBondContact O-NH1 2.86Å; D160-R164 PolarHBondContact O-N 3.17Å; P161-R164 PolarHBondContact O-N 3.01Å; R164-L167 PolarHBondContact O-N 2.93Å; R164-K168 VanDerWaalsContact O-CB 3.3Å; R164-K168 WeakPolarHBondContact O-CB 3.46Å; R164-K168 PolarHBondContact O-N 3.42Å; R164-E208 HydrophobicContact CB-CG 3.97Å; R164-E208 IonicContact CZ-OE1 3.72Å; R164-E208 IonicContact NE-OE1 2.66Å; R164-E208 PolarHBondContact NE-OE1 2.99Å; R164-E208 IonicContact NE-OE2 2.84Å; R164-E208 IonicContact NH2-OE1 3.71Å
165D98Very high97.1Very high76 Ų7628.6 Ų28.641%0.40614%0.135SC..Hα-helixtrans-66.5-38.5178-169.460.7000112.9P161 R162 E163 K168 T169P161-D165 PolarHBondContact O-N 2.9Å; R162-D165 PolarHBondContact O-N 3.23Å; E163-D165 VanDerWaalsContact C-N 3.33Å; E163-D165 PolarHBondContact O-N 3.47Å; D165-K168 WeakPolarHBondContact O-CB 3.35Å; D165-K168 PolarHBondContact O-N 2.95Å; D165-K168 WeakPolarHBondContact OD1-CE 3.42Å; D165-K168 IonicContact OD1-NZ 3.29Å; D165-K168 PolarHBondContact OD1-NZ 3.47Å; D165-T169 PolarHBondContact O-N 3.46Å; D165-T169 VanDerWaalsContact O-N 3.1Å; D165-T169 PolarHBondContact O-OG1 3Å; D165-T169 VanDerWaalsContact O-OG1 3.11Å
166F98.4Very high97Very high37 Ų3730.2 Ų30.216%0.16215%0.152CC..Hα-helixtrans-66.9-42.4172.3-85.7-73.4000112.3W116 Q120 Y123 E124 L127 R162 E163 K168 T169 T170W116-F166 AromaticContact CH2-CD2 3.71Å; W116-F166 HydrophobicContact CH2-CD2 3.71Å; W116-F166 HydrophobicContact CH2-CE2 4.13Å; W116-F166 AromaticContact CZ2-CD2 3.94Å; W116-F166 HydrophobicContact CZ2-CD2 3.94Å; W116-F166 AromaticContact CZ2-CE2 3.88Å; W116-F166 HydrophobicContact CZ2-CE2 3.88Å; Q120-F166 HydrophobicContact CG-CE2 4.25Å; Q120-F166 HydrophobicContact CG-CZ 4.31Å; Y123-F166 HydrophobicContact CD1-CB 3.9Å; Y123-F166 HydrophobicContact CD2-CB 4.23Å; Y123-F166 HydrophobicContact CD2-CG 4.49Å; Y123-F166 HydrophobicContact CG-CB 3.77Å; Y123-F166 HydrophobicContact CG-CD1 4.35Å; Y123-F166 HydrophobicContact CG-CG 4.05Å; E124-F166 HydrophobicContact CG-CE1 3.6Å; E124-F166 HydrophobicContact CG-CZ 3.6Å; L127-F166 HydrophobicContact CD1-CD1 3.61Å; L127-F166 HydrophobicContact CD1-CE1 4Å; R162-F166 WeakPolarHBondContact O-CD2 3.48Å; R162-F166 PolarHBondContact O-N 3.47Å; E163-F166 PolarHBondContact O-N 2.98Å; F166-K168 VanDerWaalsContact C-N 3.33Å; F166-T169 PolarHBondContact O-N 3.07Å; F166-T170 VanDerWaalsContact O-CB 3.29Å; F166-T170 WeakPolarHBondContact O-CB 3.42Å; F166-T170 PolarHBondContact O-N 3.25Å; F166-T170 PolarHBondContact O-OG1 3.33Å
167L98.5Very high96.9Very high0 Ų033.5 Ų33.50%017%0.166CC..Hα-helixtrans-60.7-43.8175.3-71.3169.1000111Y123 L152 L155 F156 T158 E163 R164 T169 T170 L171Y123-L167 HydrophobicContact CE1-CD2 3.87Å; Y123-L167 HydrophobicContact CE1-CG 4.31Å; L152-L167 HydrophobicContact CD1-CD2 3.47Å; L152-L167 VanDerWaalsContact CD1-CD2 3.47Å; L152-L167 HydrophobicContact CG-CD2 4.27Å; L155-L167 VanDerWaalsContact C-CD1 3.5Å; L155-L167 HydrophobicContact CB-CD1 3.61Å; L155-L167 HydrophobicContact CB-CD2 3.9Å; L155-L167 HydrophobicContact CB-CG 4.42Å; L155-L167 HydrophobicContact CD1-CD2 4.02Å; L155-L167 VanDerWaalsContact O-CD1 3.3Å; L155-L167 WeakPolarHBondContact O-CD1 3.34Å; F156-L167 HydrophobicContact CD2-CB 4.05Å; F156-L167 HydrophobicContact CD2-CD1 4.32Å; F156-L167 HydrophobicContact CE1-CB 4.16Å; F156-L167 HydrophobicContact CE2-CB 3.68Å; F156-L167 HydrophobicContact CG-CB 4.46Å; F156-L167 HydrophobicContact CG-CD1 4.5Å; F156-L167 VanDerWaalsContact CZ-C 3.43Å; F156-L167 HydrophobicContact CZ-CB 3.74Å; F156-L167 WeakPolarHBondContact CZ-O 3.28Å; T158-L167 HydrophobicContact CG2-CD1 4.29Å; E163-L167 HydrophobicContact CG-CD1 4.01Å; E163-L167 HydrophobicContact CG-CG 4.31Å; E163-L167 WeakPolarHBondContact O-CB 3.45Å; E163-L167 VanDerWaalsContact O-CG 3.24Å; E163-L167 WeakPolarHBondContact O-CG 3.43Å; E163-L167 PolarHBondContact O-N 3.42Å; R164-L167 PolarHBondContact O-N 2.93Å; L167-T169 PolarHBondContact O-N 3.28Å; L167-T170 PolarHBondContact O-N 3.07Å; L167-L171 WeakPolarHBondContact O-CB 3.31Å; L167-L171 PolarHBondContact O-N 3.45Å
168K98.5Very high96.9Very high34 Ų3431.2 Ų31.215%0.14815%0.154CC..Hα-helixtrans-53.4-55175.7-177.1-175.465.5-173.50111.2F156 R164 D165 F166 T170 H172 E208 E211 I212F156-K168 HydrophobicContact CE1-CB 4.41Å; R164-K168 VanDerWaalsContact O-CB 3.3Å; R164-K168 WeakPolarHBondContact O-CB 3.46Å; R164-K168 PolarHBondContact O-N 3.42Å; D165-K168 WeakPolarHBondContact O-CB 3.35Å; D165-K168 PolarHBondContact O-N 2.95Å; D165-K168 WeakPolarHBondContact OD1-CE 3.42Å; D165-K168 IonicContact OD1-NZ 3.29Å; D165-K168 PolarHBondContact OD1-NZ 3.47Å; F166-K168 VanDerWaalsContact C-N 3.33Å; K168-T170 PolarHBondContact O-N 3.03Å; K168-H172 WeakPolarHBondContact O-CB 3.28Å; K168-H172 PolarHBondContact O-N 3.36Å; K168-E208 HydrophobicContact CB-CB 4.12Å; K168-E208 HydrophobicContact CB-CG 4.49Å; K168-E208 HydrophobicContact CD-CB 4.1Å; K168-E208 HydrophobicContact CD-CG 4.29Å; K168-E208 HydrophobicContact CG-CB 4.21Å; K168-E211 HydrophobicContact CD-CB 4Å; K168-E211 WeakPolarHBondContact CD-OE2 3.43Å; K168-E211 IonicContact NZ-OE1 3.82Å; K168-E211 IonicContact NZ-OE2 3.06Å; K168-E211 PolarHBondContact NZ-OE2 3.42Å; K168-I212 HydrophobicContact CG-CD1 4.1Å; K168-I212 HydrophobicContact CG-CG1 3.75Å
169T98.2Very high96.9Very high40 Ų4036.4 Ų36.425%0.24518%0.181CC..Hα-helixtrans-63.5-43.9-179.4-56.90000111.1L127 D165 F166 L167 H172 R173L127-T169 HydrophobicContact CD1-CG2 3.94Å; L127-T169 HydrophobicContact CD2-CG2 3.88Å; D165-T169 PolarHBondContact O-N 3.46Å; D165-T169 VanDerWaalsContact O-N 3.1Å; D165-T169 PolarHBondContact O-OG1 3Å; D165-T169 VanDerWaalsContact O-OG1 3.11Å; F166-T169 PolarHBondContact O-N 3.07Å; L167-T169 PolarHBondContact O-N 3.28Å; T169-H172 PolarHBondContact O-N 3.45Å; T169-R173 WeakPolarHBondContact O-CG 3.5Å; T169-R173 PolarHBondContact O-N 2.9Å
170T98.1Very high97Very high0 Ų040.8 Ų40.80%020%0.197CC..Hα-helixtrans-62.1-50.2-179.6-58.10000111.6F126 L127 L130 L152 F166 L167 K168 H172 R173 I174F126-T170 HydrophobicContact CD1-CG2 3.86Å; F126-T170 HydrophobicContact CE1-CG2 3.81Å; L127-T170 WeakPolarHBondContact CD2-OG1 3.14Å; L130-T170 HydrophobicContact CD1-CG2 4.07Å; L152-T170 HydrophobicContact CD2-CG2 4.22Å; F166-T170 VanDerWaalsContact O-CB 3.29Å; F166-T170 WeakPolarHBondContact O-CB 3.42Å; F166-T170 PolarHBondContact O-N 3.25Å; F166-T170 PolarHBondContact O-OG1 3.33Å; L167-T170 PolarHBondContact O-N 3.07Å; K168-T170 PolarHBondContact O-N 3.03Å; T170-H172 VanDerWaalsContact C-N 3.33Å; T170-H172 PolarHBondContact O-N 3.28Å; T170-R173 PolarHBondContact O-N 3.23Å; T170-I174 HydrophobicContact CG2-CD1 4.08Å; T170-I174 WeakPolarHBondContact O-CG1 3.5Å; T170-I174 PolarHBondContact O-N 3.43Å
171L98.6Very high97.1Very high0 Ų040.8 Ų40.80%020%0.197CC..Hα-helixtrans-64-39.2179.7-177.665000111.4L152 L153 F156 L167 I174 Y175 I185 I189 L209 I212L152-L171 HydrophobicContact CD2-CB 4.37Å; L152-L171 HydrophobicContact CD2-CD1 4.21Å; L153-L171 HydrophobicContact CD2-CD2 3.52Å; L153-L171 HydrophobicContact CG-CD2 4.38Å; F156-L171 HydrophobicContact CE2-CB 4.14Å; F156-L171 HydrophobicContact CE2-CD2 3.73Å; F156-L171 HydrophobicContact CZ-CB 4.01Å; F156-L171 HydrophobicContact CZ-CD2 3.75Å; L167-L171 WeakPolarHBondContact O-CB 3.31Å; L167-L171 PolarHBondContact O-N 3.45Å; L171-I174 PolarHBondContact O-N 3.04Å; L171-Y175 WeakPolarHBondContact O-CB 3.36Å; L171-Y175 PolarHBondContact O-N 2.94Å; L171-I185 HydrophobicContact CD1-CD1 4.24Å; L171-I185 HydrophobicContact CD1-CG1 4.37Å; L171-I185 HydrophobicContact CD1-CG2 4.23Å; L171-I189 HydrophobicContact CD2-CD1 4.43Å; L171-L209 HydrophobicContact CD2-CD2 4.16Å; L171-I212 HydrophobicContact CB-CD1 4.1Å; L171-I212 HydrophobicContact CD2-CD1 3.79Å; L171-I212 HydrophobicContact CG-CD1 4.2Å
172H98.1Very high97.2Very high53 Ų5342.3 Ų42.325%0.24520%0.196CC..Hα-helixtrans-61.1-44.8175.1-176.8-164.3000111.7K168 T169 T170 I174 Y175 G176 I212K168-H172 WeakPolarHBondContact O-CB 3.28Å; K168-H172 PolarHBondContact O-N 3.36Å; T169-H172 PolarHBondContact O-N 3.45Å; T170-H172 VanDerWaalsContact C-N 3.33Å; T170-H172 PolarHBondContact O-N 3.28Å; H172-I174 PolarHBondContact O-N 3.11Å; H172-Y175 PolarHBondContact O-N 3.43Å; H172-G176 PolarHBondContact O-N 3.4Å; H172-I212 HydrophobicContact CB-CG1 4.42Å; H172-I212 HydrophobicContact CB-CG2 4.32Å
173R97.3Very high97.1Very high88 Ų8841 Ų4133%0.33220%0.204SC..Hα-helixtrans-62.4-42.1175.3-66.9-55-175.3-142.6-1.3112.3E131 T169 T170 G176 K177E131-R173 HydrophobicContact CG-CG 4.23Å; E131-R173 IonicContact OE1-CZ 2.61Å; E131-R173 VanDerWaalsContact OE1-CZ 3.24Å; E131-R173 IonicContact OE1-NE 2.69Å; E131-R173 PolarHBondContact OE1-NE 3.42Å; E131-R173 IonicContact OE1-NH2 3.17Å; E131-R173 PolarHBondContact OE1-NH2 3.09Å; T169-R173 WeakPolarHBondContact O-CG 3.5Å; T169-R173 PolarHBondContact O-N 2.9Å; T170-R173 PolarHBondContact O-N 3.23Å; R173-G176 PolarHBondContact O-N 3.33Å; R173-K177 PolarHBondContact O-N 2.88Å
174I97.8Very high97.1Very high0 Ų042.7 Ų42.70%021%0.211CC..Hα-helixtrans-61.1-47.6175.6-68.5173.7000110.1L130 I144 F148 V149 L152 T170 L171 H172 G176 K177 F178 L181 I185L130-I174 HydrophobicContact CD1-CG1 4.12Å; I144-I174 HydrophobicContact CG2-CD1 4.5Å; I144-I174 HydrophobicContact CG2-CG2 4.3Å; F148-I174 HydrophobicContact CE1-CD1 3.99Å; V149-I174 HydrophobicContact CG2-CG2 4.43Å; L152-I174 HydrophobicContact CD2-CD1 3.72Å; T170-I174 HydrophobicContact CG2-CD1 4.08Å; T170-I174 WeakPolarHBondContact O-CG1 3.5Å; T170-I174 PolarHBondContact O-N 3.43Å; L171-I174 PolarHBondContact O-N 3.04Å; H172-I174 PolarHBondContact O-N 3.11Å; I174-G176 VanDerWaalsContact C-N 3.29Å; I174-G176 PolarHBondContact O-N 3.01Å; I174-K177 PolarHBondContact O-N 3.29Å; I174-F178 HydrophobicContact CB-CD2 4.23Å; I174-F178 HydrophobicContact CG1-CE2 4.46Å; I174-F178 HydrophobicContact CG2-CD2 3.75Å; I174-F178 HydrophobicContact CG2-CE2 4.4Å; I174-F178 WeakPolarHBondContact O-CB 3.43Å; I174-F178 WeakPolarHBondContact O-CD2 3.4Å; I174-F178 PolarHBondContact O-N 3.04Å; I174-L181 HydrophobicContact CG2-CD1 4.08Å; I174-I185 HydrophobicContact CG2-CD1 4.27Å
175Y97.6Very high97.2Very high16 Ų1641.1 Ų41.16%0.06321%0.205CC..Hα-helixtrans-59.3-40.6178.1-176.6-87.1000112.6L171 H172 R182 I185 R186 I216L171-Y175 WeakPolarHBondContact O-CB 3.36Å; L171-Y175 PolarHBondContact O-N 2.94Å; H172-Y175 PolarHBondContact O-N 3.43Å; Y175-R182 HydrophobicContact CD1-CG 4.32Å; Y175-R182 HydrophobicContact CD2-CB 4.19Å; Y175-R182 HydrophobicContact CD2-CG 3.91Å; Y175-R182 HydrophobicContact CE1-CG 4.03Å; Y175-R182 HydrophobicContact CE2-CB 3.57Å; Y175-R182 HydrophobicContact CE2-CG 3.61Å; Y175-R182 HydrophobicContact CG-CG 4.26Å; Y175-R182 WeakPolarHBondContact O-CG 3.25Å; Y175-R182 PolarHBondContact O-NE 3.33Å; Y175-I185 HydrophobicContact CD2-CB 4.12Å; Y175-I185 HydrophobicContact CD2-CD1 3.94Å; Y175-I185 HydrophobicContact CD2-CG2 4Å; Y175-R186 HydrophobicContact CE2-CG 4.16Å; Y175-R186 PolarHBondContact OH-NH1 3.49Å; Y175-I216 HydrophobicContact CD1-CD1 3.82Å; Y175-I216 HydrophobicContact CD1-CG1 3.74Å; Y175-I216 HydrophobicContact CD2-CD1 3.77Å; Y175-I216 HydrophobicContact CE1-CB 4.28Å; Y175-I216 HydrophobicContact CE1-CD1 3.71Å; Y175-I216 HydrophobicContact CE1-CG1 3.45Å; Y175-I216 VanDerWaalsContact CE1-CG1 3.45Å; Y175-I216 HydrophobicContact CE1-CG2 4.03Å; Y175-I216 HydrophobicContact CE2-CD1 3.63Å; Y175-I216 HydrophobicContact CE2-CG1 4.31Å; Y175-I216 HydrophobicContact CG-CD1 3.86Å; Y175-I216 HydrophobicContact CG-CG1 4.3Å; Y175-I216 VanDerWaalsContact OH-CG2 3.25Å; Y175-I216 WeakPolarHBondContact OH-CG2 3.37Å
176G95.5Very high97.1Very high36 Ų3639.2 Ų39.237%0.37119%0.192SC..Hα-helixtrans-62.7-52.2177.100000112.4H172 R173 I174 R182H172-G176 PolarHBondContact O-N 3.4Å; R173-G176 PolarHBondContact O-N 3.33Å; I174-G176 VanDerWaalsContact C-N 3.29Å; I174-G176 PolarHBondContact O-N 3.01Å; G176-R182 PolarHBondContact O-NH2 3.04Å
177K95.4Very high97.1Very high68 Ų6843.8 Ų43.830%0.29621%0.212SC..Hα-helixtrans-80.6-30.9-172.3-66.8-166176.9-144.60114.5L130 F135 P137 R173 I174L130-K177 WeakPolarHBondContact O-CE 3.15Å; L130-K177 PolarHBondContact O-NZ 2.95Å; F135-K177 HydrophobicContact CD1-CD 3.92Å; F135-K177 HydrophobicContact CE1-CD 4.12Å; P137-K177 HydrophobicContact CG-CB 4.3Å; R173-K177 PolarHBondContact O-N 2.88Å; I174-K177 PolarHBondContact O-N 3.29Å
178F96.5Very high97.1Very high2 Ų245.4 Ų45.41%0.00922%0.22CC..  trans-108.183.7-174.3-61-78000112.3F135 P137 A140 I144 I174 Y180 L181F135-F178 HydrophobicContact CE1-CE2 4.35Å; F135-F178 AromaticContact CE1-CZ 3.86Å; F135-F178 HydrophobicContact CE1-CZ 3.86Å; F135-F178 HydrophobicContact CZ-CE2 4.38Å; F135-F178 AromaticContact CZ-CZ 3.8Å; F135-F178 HydrophobicContact CZ-CZ 3.8Å; P137-F178 HydrophobicContact CB-CD1 4.15Å; P137-F178 HydrophobicContact CB-CE1 3.88Å; P137-F178 HydrophobicContact CB-CZ 4.5Å; P137-F178 WeakPolarHBondContact O-CE1 3.43Å; A140-F178 HydrophobicContact CB-CE1 3.86Å; A140-F178 HydrophobicContact CB-CZ 3.66Å; I144-F178 HydrophobicContact CB-CZ 4.37Å; I144-F178 HydrophobicContact CD1-CE2 3.86Å; I144-F178 HydrophobicContact CD1-CZ 3.77Å; I144-F178 HydrophobicContact CG1-CZ 4.46Å; I144-F178 HydrophobicContact CG2-CE2 4.37Å; I174-F178 HydrophobicContact CB-CD2 4.23Å; I174-F178 HydrophobicContact CG1-CE2 4.46Å; I174-F178 HydrophobicContact CG2-CD2 3.75Å; I174-F178 HydrophobicContact CG2-CE2 4.4Å; I174-F178 WeakPolarHBondContact O-CB 3.43Å; I174-F178 WeakPolarHBondContact O-CD2 3.4Å; I174-F178 PolarHBondContact O-N 3.04Å; F178-Y180 HydrophobicContact CB-CD1 4.47Å; F178-Y180 HydrophobicContact CB-CE1 4Å; F178-Y180 AromaticContact CD1-CE1 3.72Å; F178-Y180 HydrophobicContact CD1-CE1 3.72Å; F178-Y180 HydrophobicContact CG-CE1 4.31Å; F178-Y180 PolarHBondContact O-N 3.37Å; F178-Y180 VanDerWaalsContact O-N 3.13Å; F178-L181 HydrophobicContact CB-CB 4.18Å; F178-L181 HydrophobicContact CB-CD1 3.74Å; F178-L181 HydrophobicContact CB-CG 4.06Å; F178-L181 HydrophobicContact CD2-CD1 4.49Å; F178-L181 HydrophobicContact CG-CD1 4.12Å; F178-L181 PolarHBondContact O-N 2.66Å
179L94.2Very high97Very high118 Ų11843.8 Ų43.862%0.61821%0.213SC*.G310 helixtrans-53.3-37.7-177.6-59.6-179.2000113.8L181 R182L179-L181 VanDerWaalsContact C-N 3.28Å; L179-L181 PolarHBondContact O-N 3.02Å; L179-R182 VanDerWaalsContact CD2-NH2 3.28Å; L179-R182 WeakPolarHBondContact O-CB 3.25Å; L179-R182 WeakPolarHBondContact O-CG 3.17Å; L179-R182 PolarHBondContact O-N 3.06Å
180Y95Very high97Very high112 Ų11243.4 Ų43.444%0.43921%0.209SC..G310 helixtrans-71.4-19.3-178.570.8-88.3000113.5K141 I144 F178K141-Y180 VanDerWaalsContact CA-OH 3.27Å; K141-Y180 WeakPolarHBondContact CA-OH 3.24Å; K141-Y180 HydrophobicContact CB-CE1 3.63Å; K141-Y180 VanDerWaalsContact CB-OH 3.26Å; K141-Y180 WeakPolarHBondContact CB-OH 3.43Å; I144-Y180 PolarHBondContact O-OH 3.28Å; F178-Y180 HydrophobicContact CB-CD1 4.47Å; F178-Y180 HydrophobicContact CB-CE1 4Å; F178-Y180 AromaticContact CD1-CE1 3.72Å; F178-Y180 HydrophobicContact CD1-CE1 3.72Å; F178-Y180 HydrophobicContact CG-CE1 4.31Å; F178-Y180 PolarHBondContact O-N 3.37Å; F178-Y180 VanDerWaalsContact O-N 3.13Å
181L97.2Very high97Very high0 Ų047 Ų470%023%0.228CC..G310 helixtrans-87.3-15.5176.4-67.2175.3000112.8I144 Q146 V149 I174 F178 L179 A183 Y184 I185I144-L181 HydrophobicContact CG2-CD1 4.02Å; Q146-L181 HydrophobicContact CG-CD2 4.18Å; V149-L181 HydrophobicContact CG2-CD1 3.85Å; V149-L181 HydrophobicContact CG2-CD2 4.38Å; I174-L181 HydrophobicContact CG2-CD1 4.08Å; F178-L181 HydrophobicContact CB-CB 4.18Å; F178-L181 HydrophobicContact CB-CD1 3.74Å; F178-L181 HydrophobicContact CB-CG 4.06Å; F178-L181 HydrophobicContact CD2-CD1 4.49Å; F178-L181 HydrophobicContact CG-CD1 4.12Å; F178-L181 PolarHBondContact O-N 2.66Å; L179-L181 VanDerWaalsContact C-N 3.28Å; L179-L181 PolarHBondContact O-N 3.02Å; L181-A183 PolarHBondContact O-N 3.33Å; L181-Y184 WeakPolarHBondContact O-CB 3.46Å; L181-Y184 PolarHBondContact O-N 2.98Å; L181-I185 HydrophobicContact CB-CD1 4.01Å; L181-I185 HydrophobicContact CB-CG1 4.43Å; L181-I185 WeakPolarHBondContact O-CG1 3.48Å; L181-I185 PolarHBondContact O-N 2.84Å
182R96.2Very high96.9Very high84 Ų8448.6 Ų48.632%0.31724%0.237SC..Hα-helixtrans-55.8-45.6-172.7-69.8-173.4172.6179.42.4113.7Y175 G176 L179 Y184 R186Y175-R182 HydrophobicContact CD1-CG 4.32Å; Y175-R182 HydrophobicContact CD2-CB 4.19Å; Y175-R182 HydrophobicContact CD2-CG 3.91Å; Y175-R182 HydrophobicContact CE1-CG 4.03Å; Y175-R182 HydrophobicContact CE2-CB 3.57Å; Y175-R182 HydrophobicContact CE2-CG 3.61Å; Y175-R182 HydrophobicContact CG-CG 4.26Å; Y175-R182 WeakPolarHBondContact O-CG 3.25Å; Y175-R182 PolarHBondContact O-NE 3.33Å; G176-R182 PolarHBondContact O-NH2 3.04Å; L179-R182 VanDerWaalsContact CD2-NH2 3.28Å; L179-R182 WeakPolarHBondContact O-CB 3.25Å; L179-R182 WeakPolarHBondContact O-CG 3.17Å; L179-R182 PolarHBondContact O-N 3.06Å; R182-Y184 VanDerWaalsContact C-N 3.33Å; R182-R186 WeakPolarHBondContact O-CG 3.36Å; R182-R186 PolarHBondContact O-N 2.99Å; R182-R186 VanDerWaalsContact O-N 3.1Å
183A95.4Very high96.9Very high62 Ų6246.1 Ų46.151%0.51223%0.225SC..Hα-helixtrans-65.3-39178.800000111.8L181 K187L181-A183 PolarHBondContact O-N 3.33Å; A183-K187 WeakPolarHBondContact O-CB 3.29Å; A183-K187 PolarHBondContact O-N 2.79Å
184Y97.9Very high96.9Very high37 Ų3745.8 Ų45.815%0.14523%0.225CC..Hα-helixtrans-67.2-47178-175.8-98.1000111.7Q146 V149 L181 R182 R186 K187 Q188Q146-Y184 HydrophobicContact CB-CD1 4.04Å; Q146-Y184 HydrophobicContact CB-CD2 4.23Å; Q146-Y184 HydrophobicContact CB-CE1 3.71Å; Q146-Y184 HydrophobicContact CB-CE2 3.91Å; Q146-Y184 HydrophobicContact CB-CG 4.29Å; Q146-Y184 VanDerWaalsContact CD-CD2 3.42Å; Q146-Y184 HydrophobicContact CG-CD1 3.87Å; Q146-Y184 HydrophobicContact CG-CD2 3.76Å; Q146-Y184 HydrophobicContact CG-CE1 4.06Å; Q146-Y184 HydrophobicContact CG-CE2 3.96Å; Q146-Y184 HydrophobicContact CG-CG 3.72Å; Q146-Y184 WeakPolarHBondContact O-CE1 3.3Å; Q146-Y184 PolarHBondContact O-OH 2.94Å; V149-Y184 HydrophobicContact CB-CD1 4.32Å; V149-Y184 HydrophobicContact CB-CE1 4.21Å; V149-Y184 HydrophobicContact CG1-CD1 4.01Å; V149-Y184 HydrophobicContact CG1-CE1 4.08Å; L181-Y184 WeakPolarHBondContact O-CB 3.46Å; L181-Y184 PolarHBondContact O-N 2.98Å; R182-Y184 VanDerWaalsContact C-N 3.33Å; Y184-R186 PolarHBondContact O-N 2.92Å; Y184-K187 PolarHBondContact O-N 2.88Å; Y184-Q188 HydrophobicContact CD1-CG 4.09Å; Y184-Q188 HydrophobicContact CE1-CG 3.66Å; Y184-Q188 HydrophobicContact CE2-CG 4.16Å; Y184-Q188 VanDerWaalsContact CZ-NE2 3.31Å; Y184-Q188 WeakPolarHBondContact O-CG 3.5Å; Y184-Q188 PolarHBondContact O-N 3.43Å; Y184-Q188 PolarHBondContact OH-NE2 2.84Å
185I98.3Very high96.9Very high0 Ų046.5 Ų46.50%023%0.232CC..Hα-helixtrans-56.8-51.4176.9-68.3165.4000110.4V149 L171 I174 Y175 L181 K187 Q188 I189V149-I185 HydrophobicContact CG1-CD1 4.5Å; V149-I185 HydrophobicContact CG1-CG1 3.6Å; V149-I185 HydrophobicContact CG2-CG1 4.46Å; L171-I185 HydrophobicContact CD1-CD1 4.24Å; L171-I185 HydrophobicContact CD1-CG1 4.37Å; L171-I185 HydrophobicContact CD1-CG2 4.23Å; I174-I185 HydrophobicContact CG2-CD1 4.27Å; Y175-I185 HydrophobicContact CD2-CB 4.12Å; Y175-I185 HydrophobicContact CD2-CD1 3.94Å; Y175-I185 HydrophobicContact CD2-CG2 4Å; L181-I185 HydrophobicContact CB-CD1 4.01Å; L181-I185 HydrophobicContact CB-CG1 4.43Å; L181-I185 WeakPolarHBondContact O-CG1 3.48Å; L181-I185 PolarHBondContact O-N 2.84Å; I185-K187 VanDerWaalsContact C-N 3.3Å; I185-K187 PolarHBondContact O-N 3.24Å; I185-Q188 PolarHBondContact O-N 3.38Å; I185-I189 HydrophobicContact CG2-CD1 3.75Å; I185-I189 HydrophobicContact CG2-CG1 4.37Å; I185-I189 WeakPolarHBondContact O-CG1 3.43Å; I185-I189 PolarHBondContact O-N 2.72Å
186R97.4Very high96.8Very high37 Ų3745.9 Ų45.914%0.1423%0.23CC..Hα-helixtrans-58-42.8177.9-70.8-167.9-56.2-91.74.9112Y175 R182 Y184 Q188 N190 E227Y175-R186 HydrophobicContact CE2-CG 4.16Å; Y175-R186 PolarHBondContact OH-NH1 3.49Å; R182-R186 WeakPolarHBondContact O-CG 3.36Å; R182-R186 PolarHBondContact O-N 2.99Å; R182-R186 VanDerWaalsContact O-N 3.1Å; Y184-R186 PolarHBondContact O-N 2.92Å; R186-Q188 PolarHBondContact O-N 2.87Å; R186-N190 PolarHBondContact O-N 3.17Å; R186-N190 PolarHBondContact O-OD1 3.25Å; R186-E227 IonicContact NH2-OE1 2.79Å; R186-E227 PolarHBondContact NH2-OE1 3.38Å
187K97Very high96.8Very high133 Ų13345.2 Ų45.258%0.57822%0.217SC*.Hα-helixtrans-62.3-42.9178.2-176.2178.9177.5-1770111.8A183 Y184 I185 N190 N191A183-K187 WeakPolarHBondContact O-CB 3.29Å; A183-K187 PolarHBondContact O-N 2.79Å; Y184-K187 PolarHBondContact O-N 2.88Å; I185-K187 VanDerWaalsContact C-N 3.3Å; I185-K187 PolarHBondContact O-N 3.24Å; K187-N190 WeakPolarHBondContact O-CB 3.48Å; K187-N190 PolarHBondContact O-N 3.18Å; K187-N191 VanDerWaalsContact O-CG 3.27Å; K187-N191 PolarHBondContact O-N 2.78Å; K187-N191 PolarHBondContact O-ND2 3Å; K187-N191 PolarHBondContact O-OD1 3.06Å
188Q98Very high96.9Very high33 Ų3348.1 Ų48.115%0.15423%0.227CC..Hα-helixtrans-71.6-39.4-179.4-65.3-57-8.500112.6L153 Y184 I185 R186 N190 N191 I192L153-Q188 HydrophobicContact CD1-CB 3.49Å; L153-Q188 VanDerWaalsContact CD1-CB 3.49Å; L153-Q188 HydrophobicContact CD1-CG 4.37Å; Y184-Q188 HydrophobicContact CD1-CG 4.09Å; Y184-Q188 HydrophobicContact CE1-CG 3.66Å; Y184-Q188 HydrophobicContact CE2-CG 4.16Å; Y184-Q188 VanDerWaalsContact CZ-NE2 3.31Å; Y184-Q188 WeakPolarHBondContact O-CG 3.5Å; Y184-Q188 PolarHBondContact O-N 3.43Å; Y184-Q188 PolarHBondContact OH-NE2 2.84Å; I185-Q188 PolarHBondContact O-N 3.38Å; R186-Q188 PolarHBondContact O-N 2.87Å; Q188-N190 VanDerWaalsContact C-N 3.27Å; Q188-N190 PolarHBondContact O-N 2.98Å; Q188-N191 WeakPolarHBondContact O-CB 3.39Å; Q188-N191 PolarHBondContact O-N 3.26Å; Q188-N191 VanDerWaalsContact O-N 3.12Å; Q188-N191 PolarHBondContact OE1-ND2 3.46Å; Q188-I192 WeakPolarHBondContact O-CG1 3.31Å; Q188-I192 PolarHBondContact O-N 3.26Å
189I98.3Very high96.8Very high0 Ų055.8 Ų55.80%026%0.263CS..Hα-helixtrans-59.4-41.3172-64.7173000110.5L153 L171 I185 N191 I192 F193 L209 L213L153-I189 HydrophobicContact CD2-CG1 4Å; L171-I189 HydrophobicContact CD2-CD1 4.43Å; I185-I189 HydrophobicContact CG2-CD1 3.75Å; I185-I189 HydrophobicContact CG2-CG1 4.37Å; I185-I189 WeakPolarHBondContact O-CG1 3.43Å; I185-I189 PolarHBondContact O-N 2.72Å; I189-N191 VanDerWaalsContact C-N 3.34Å; I189-N191 PolarHBondContact O-N 3.09Å; I189-I192 PolarHBondContact O-N 3.16Å; I189-F193 HydrophobicContact CG2-CD2 4Å; I189-F193 HydrophobicContact CG2-CE1 4.46Å; I189-F193 HydrophobicContact CG2-CE2 3.65Å; I189-F193 HydrophobicContact CG2-CZ 3.9Å; I189-F193 PolarHBondContact O-N 3.09Å; I189-L209 HydrophobicContact CD1-CD2 4.22Å; I189-L209 HydrophobicContact CG1-CD2 4.17Å; I189-L209 HydrophobicContact CG2-CB 4.48Å; I189-L209 HydrophobicContact CG2-CD1 4.48Å; I189-L213 HydrophobicContact CG2-CD1 3.72Å; I189-L213 HydrophobicContact CG2-CG 4.4Å
190N97.2Very high96.7Very high33 Ų3354.4 Ų54.418%0.17626%0.259CS..Hα-helixtrans-61.6-41.3175-68.1-1.7000112.4R186 K187 Q188 I192 F193 Y194 F231R186-N190 PolarHBondContact O-N 3.17Å; R186-N190 PolarHBondContact O-OD1 3.25Å; K187-N190 WeakPolarHBondContact O-CB 3.48Å; K187-N190 PolarHBondContact O-N 3.18Å; Q188-N190 VanDerWaalsContact C-N 3.27Å; Q188-N190 PolarHBondContact O-N 2.98Å; N190-I192 VanDerWaalsContact C-N 3.34Å; N190-F193 PolarHBondContact O-N 3.14Å; N190-Y194 HydrophobicContact CB-CE2 4.29Å; N190-Y194 WeakPolarHBondContact O-CD2 3.18Å; N190-Y194 PolarHBondContact O-N 3.37Å; N190-F231 WeakPolarHBondContact OD1-CD2 3.37Å; N190-F231 WeakPolarHBondContact OD1-CE2 3.44Å
191N97.4Very high96.4Very high74 Ų7452.8 Ų52.840%0.39626%0.256SS..Hα-helixtrans-62.4-42.7176.9-66.6-20.5000111.5K187 Q188 I189 Y194 G195K187-N191 VanDerWaalsContact O-CG 3.27Å; K187-N191 PolarHBondContact O-N 2.78Å; K187-N191 PolarHBondContact O-ND2 3Å; K187-N191 PolarHBondContact O-OD1 3.06Å; Q188-N191 WeakPolarHBondContact O-CB 3.39Å; Q188-N191 PolarHBondContact O-N 3.26Å; Q188-N191 VanDerWaalsContact O-N 3.12Å; Q188-N191 PolarHBondContact OE1-ND2 3.46Å; I189-N191 VanDerWaalsContact C-N 3.34Å; I189-N191 PolarHBondContact O-N 3.09Å; N191-Y194 PolarHBondContact O-N 3.38Å; N191-G195 PolarHBondContact O-N 3.26Å
192I97.8Very high96Very high35 Ų3554.9 Ų54.918%0.17927%0.266CS..Hα-helixtrans-58.8-49.4175.1-68.8165.9000109.9L153 Q188 I189 N190 Y194 G195 F196 Y203 L209L153-I192 HydrophobicContact CB-CD1 4.13Å; L153-I192 HydrophobicContact CD2-CD1 4.18Å; Q188-I192 WeakPolarHBondContact O-CG1 3.31Å; Q188-I192 PolarHBondContact O-N 3.26Å; I189-I192 PolarHBondContact O-N 3.16Å; N190-I192 VanDerWaalsContact C-N 3.34Å; I192-Y194 VanDerWaalsContact C-N 3.32Å; I192-Y194 PolarHBondContact O-N 3Å; I192-G195 PolarHBondContact O-N 3.18Å; I192-F196 WeakPolarHBondContact O-CB 3.43Å; I192-F196 PolarHBondContact O-N 2.97Å; I192-Y203 HydrophobicContact CG2-CD1 4.17Å; I192-Y203 HydrophobicContact CG2-CD2 3.99Å; I192-Y203 HydrophobicContact CG2-CE1 3.83Å; I192-Y203 HydrophobicContact CG2-CE2 3.61Å; I192-Y203 HydrophobicContact CG2-CG 4.23Å; I192-L209 HydrophobicContact CD1-CD1 4.48Å; I192-L209 HydrophobicContact CG2-CD1 4.15Å
193F98.1Very high95.9Very high0 Ų052.7 Ų52.70%026%0.258CS..Hα-helixtrans-63.2-36177.6-69.4-21.7000113.1I189 N190 F196 I197 V206 L209 L210 L213 V235 L239I189-F193 HydrophobicContact CG2-CD2 4Å; I189-F193 HydrophobicContact CG2-CE1 4.46Å; I189-F193 HydrophobicContact CG2-CE2 3.65Å; I189-F193 HydrophobicContact CG2-CZ 3.9Å; I189-F193 PolarHBondContact O-N 3.09Å; N190-F193 PolarHBondContact O-N 3.14Å; F193-F196 PolarHBondContact O-N 3.27Å; F193-I197 HydrophobicContact CB-CD1 4.41Å; F193-I197 WeakPolarHBondContact O-CB 3.38Å; F193-I197 VanDerWaalsContact O-CD1 3.29Å; F193-I197 WeakPolarHBondContact O-CD1 3.38Å; F193-I197 WeakPolarHBondContact O-CG1 3.27Å; F193-I197 PolarHBondContact O-N 3.15Å; F193-V206 HydrophobicContact CE1-CG1 4.02Å; F193-L209 HydrophobicContact CE1-CB 4.12Å; F193-L209 HydrophobicContact CE1-CD1 4.14Å; F193-L209 HydrophobicContact CZ-CB 3.91Å; F193-L210 HydrophobicContact CE2-CD2 4.11Å; F193-L210 HydrophobicContact CZ-CD2 4Å; F193-L210 HydrophobicContact CZ-CG 4Å; F193-L213 HydrophobicContact CD2-CD1 4.48Å; F193-L213 HydrophobicContact CE2-CD1 3.38Å; F193-L213 HydrophobicContact CZ-CD1 3.84Å; F193-V235 HydrophobicContact CB-CG1 3.57Å; F193-V235 HydrophobicContact CD2-CG1 3.56Å; F193-V235 HydrophobicContact CG-CG1 4.05Å; F193-L239 HydrophobicContact CD1-CD2 4.38Å; F193-L239 HydrophobicContact CD2-CD1 4.18Å; F193-L239 HydrophobicContact CE2-CD1 4.16Å; F193-L239 HydrophobicContact CG-CD1 4.41Å; F193-L239 HydrophobicContact CG-CD2 4.41Å; F193-L239 HydrophobicContact CZ-CD1 4.43Å
194Y97.4Very high95.8Very high82 Ų8251.6 Ų51.632%0.32224%0.243SC..Hα-helixtrans-64-45174.2-73.1-46.8000112.4N190 N191 I192 F196 I197 Y198 V235N190-Y194 HydrophobicContact CB-CE2 4.29Å; N190-Y194 WeakPolarHBondContact O-CD2 3.18Å; N190-Y194 PolarHBondContact O-N 3.37Å; N191-Y194 PolarHBondContact O-N 3.38Å; I192-Y194 VanDerWaalsContact C-N 3.32Å; I192-Y194 PolarHBondContact O-N 3Å; Y194-F196 VanDerWaalsContact C-N 3.33Å; Y194-F196 PolarHBondContact O-N 3.44Å; Y194-I197 PolarHBondContact O-N 3.48Å; Y194-Y198 AromaticContact CD1-CD2 3.97Å; Y194-Y198 HydrophobicContact CD1-CD2 3.97Å; Y194-Y198 AromaticContact CD1-CE2 3.66Å; Y194-Y198 HydrophobicContact CD1-CE2 3.66Å; Y194-Y198 HydrophobicContact CE1-CE2 4.16Å; Y194-Y198 WeakPolarHBondContact O-CB 3.34Å; Y194-Y198 WeakPolarHBondContact O-CD2 3.29Å; Y194-Y198 PolarHBondContact O-N 3.04Å; Y194-V235 HydrophobicContact CE1-CG2 3.84Å; Y194-V235 HydrophobicContact CE2-CG2 4.31Å; Y194-V235 WeakPolarHBondContact OH-CG2 3.45Å
195G96.9Very high95.7Very high15 Ų1549.8 Ų49.816%0.15524%0.236CC..Hα-helixtrans-59-45.6173.400000111.6N191 I192 E199 T200N191-G195 PolarHBondContact O-N 3.26Å; I192-G195 PolarHBondContact O-N 3.18Å; G195-E199 WeakPolarHBondContact O-CA 3.15Å; G195-E199 VanDerWaalsContact O-CB 3.27Å; G195-E199 WeakPolarHBondContact O-CB 3.4Å; G195-E199 PolarHBondContact O-N 3.12Å; G195-T200 PolarHBondContact O-N 3.43Å
196F96.2Very high95.7Very high3 Ų350 Ų501%0.01324%0.237CC..Iπ-helixtrans-60.1-51.1176.4171.9-113.1000112.7I192 F193 Y194 E201 V206 L239 A242 Y248I192-F196 WeakPolarHBondContact O-CB 3.43Å; I192-F196 PolarHBondContact O-N 2.97Å; F193-F196 PolarHBondContact O-N 3.27Å; Y194-F196 VanDerWaalsContact C-N 3.33Å; Y194-F196 PolarHBondContact O-N 3.44Å; F196-E201 WeakPolarHBondContact O-CA 3.46Å; F196-E201 PolarHBondContact O-N 3.38Å; F196-V206 HydrophobicContact CD1-CG2 4.1Å; F196-V206 HydrophobicContact CD2-CG2 4.33Å; F196-V206 HydrophobicContact CE1-CG1 4.5Å; F196-V206 HydrophobicContact CE1-CG2 4.09Å; F196-V206 HydrophobicContact CE2-CG2 4.32Å; F196-V206 HydrophobicContact CG-CG2 4.23Å; F196-V206 HydrophobicContact CZ-CG2 4.21Å; F196-L239 HydrophobicContact CD1-CD2 3.61Å; F196-L239 HydrophobicContact CE1-CD2 3.74Å; F196-A242 HydrophobicContact CE1-CB 4.02Å; F196-A242 HydrophobicContact CZ-CB 3.78Å; F196-Y248 HydrophobicContact CE1-CE1 4.01Å; F196-Y248 AromaticContact CE1-CZ 3.96Å; F196-Y248 AromaticContact CZ-CE1 3.82Å; F196-Y248 HydrophobicContact CZ-CE1 3.82Å
197I96Very high95.7Very high21 Ų2148.7 Ų48.711%0.10824%0.235CC..Iπ-helixtrans-69.7-38.5-174.2-65.4157.4000112.3F193 Y194 P238 L239F193-I197 HydrophobicContact CB-CD1 4.41Å; F193-I197 WeakPolarHBondContact O-CB 3.38Å; F193-I197 VanDerWaalsContact O-CD1 3.29Å; F193-I197 WeakPolarHBondContact O-CD1 3.38Å; F193-I197 WeakPolarHBondContact O-CG1 3.27Å; F193-I197 PolarHBondContact O-N 3.15Å; Y194-I197 PolarHBondContact O-N 3.48Å; I197-P238 HydrophobicContact CD1-CB 4.15Å; I197-P238 HydrophobicContact CG2-CB 4.11Å; I197-L239 HydrophobicContact CD1-CD2 3.78Å; I197-L239 HydrophobicContact CD1-CG 3.95Å; I197-L239 HydrophobicContact CG1-CD2 3.66Å; I197-L239 HydrophobicContact CG1-CG 4.28Å
198Y95.7Very high95.7Very high130 Ų13043.4 Ų43.451%0.5121%0.212SC..Iπ-helixtrans-113.2-16-164.8-61.7-61.5000114.6Y194Y194-Y198 AromaticContact CD1-CD2 3.97Å; Y194-Y198 HydrophobicContact CD1-CD2 3.97Å; Y194-Y198 AromaticContact CD1-CE2 3.66Å; Y194-Y198 HydrophobicContact CD1-CE2 3.66Å; Y194-Y198 HydrophobicContact CE1-CE2 4.16Å; Y194-Y198 WeakPolarHBondContact O-CB 3.34Å; Y194-Y198 WeakPolarHBondContact O-CD2 3.29Å; Y194-Y198 PolarHBondContact O-N 3.04Å
199E95Very high95.8Very high163 Ų16341.9 Ų41.976%0.76221%0.205SC*.Iπ-helixtrans-119.2-59.8-173.9-55.2178.6-151.300112.3G195G195-E199 WeakPolarHBondContact O-CA 3.15Å; G195-E199 VanDerWaalsContact O-CB 3.27Å; G195-E199 WeakPolarHBondContact O-CB 3.4Å; G195-E199 PolarHBondContact O-N 3.12Å
200T91.4Very high95.8Very high88 Ų8841.9 Ų41.954%0.5421%0.205SC..Iπ-helixtrans-101.8-31.1-167.363.90000114.5G195 H202G195-T200 PolarHBondContact O-N 3.43Å; T200-H202 PolarHBondContact O-N 3Å; T200-H202 PolarHBondContact OG1-N 3.37Å; T200-H202 PolarHBondContact OG1-O 3.34Å
201E89.5Confident95.8Very high78 Ų7842.7 Ų42.736%0.36421%0.207SC..SBendtrans52.819.3-168.7-150.1179-177.300113.8F196 A242 K243F196-E201 WeakPolarHBondContact O-CA 3.46Å; F196-E201 PolarHBondContact O-N 3.38Å; E201-A242 HydrophobicContact CG-CB 4.1Å; E201-A242 WeakPolarHBondContact OE1-CA 3.38Å; E201-K243 WeakPolarHBondContact OE1-CG 3.37Å; E201-K243 PolarHBondContact OE1-N 3.12Å
202H89.5Confident95.9Very high45 Ų4539.3 Ų39.321%0.20819%0.189CC..  trans-139.5125.4178.8-17873.9000109.9L99 T200L99-H202 HydrophobicContact CD2-CB 4.12Å; T200-H202 PolarHBondContact O-N 3Å; T200-H202 PolarHBondContact OG1-N 3.37Å; T200-H202 PolarHBondContact OG1-O 3.34Å
203Y93.2Very high95.9Very high37 Ų3737.8 Ų37.815%0.14518%0.182CC..  trans-167.6125.7172.6-167.3-94.5000108.7L153 F156 D157 I192 V206 L209L153-Y203 PolarHBondContact O-OH 2.95Å; F156-Y203 HydrophobicContact CB-CE1 4.15Å; F156-Y203 VanDerWaalsContact CB-OH 3.26Å; F156-Y203 WeakPolarHBondContact CB-OH 3.5Å; D157-Y203 HydrophobicContact CB-CD2 4.11Å; D157-Y203 HydrophobicContact CB-CE2 3.72Å; D157-Y203 WeakPolarHBondContact OD1-CA 3.25Å; I192-Y203 HydrophobicContact CG2-CD1 4.17Å; I192-Y203 HydrophobicContact CG2-CD2 3.99Å; I192-Y203 HydrophobicContact CG2-CE1 3.83Å; I192-Y203 HydrophobicContact CG2-CE2 3.61Å; I192-Y203 HydrophobicContact CG2-CG 4.23Å; Y203-V206 HydrophobicContact CD1-CG2 3.83Å; Y203-V206 HydrophobicContact CG-CG2 4.32Å; Y203-L209 HydrophobicContact CE1-CD1 3.84Å
204N93.2Very high95.8Very high39 Ų3937.8 Ų37.821%0.20918%0.182CC..THydrogen-bonded Turntrans-76.4-31.2-171.9-65.4-49.7000113.4D157 V206D157-N204 PolarHBondContact O-ND2 2.91Å; D157-N204 PolarHBondContact OD1-N 3.4Å; N204-V206 PolarHBondContact O-N 3.21Å
205G96.1Very high95.8Very high0 Ų035 Ų350%017%0.174CC..THydrogen-bonded Turntrans-9321.9-171.900000116.6F156 E208 L209F156-G205 VanDerWaalsContact O-CA 3.25Å; F156-G205 WeakPolarHBondContact O-CA 3.39Å; F156-G205 PolarHBondContact O-N 3.25Å; G205-E208 VanDerWaalsContact CA-OE2 3.32Å; G205-E208 WeakPolarHBondContact CA-OE2 3.48Å; G205-L209 WeakPolarHBondContact O-CB 3.45Å; G205-L209 VanDerWaalsContact O-CG 3.27Å; G205-L209 WeakPolarHBondContact O-CG 3.17Å; G205-L209 PolarHBondContact O-N 2.91Å; G205-L209 VanDerWaalsContact O-N 3.15Å
206V97.7Very high95.8Very high3 Ų334.7 Ų34.72%0.01817%0.169CC..Hα-helixtrans-64.5-43.6-176.2178.80000111.2F193 F196 Y203 N204 L209 L210 Y248F193-V206 HydrophobicContact CE1-CG1 4.02Å; F196-V206 HydrophobicContact CD1-CG2 4.1Å; F196-V206 HydrophobicContact CD2-CG2 4.33Å; F196-V206 HydrophobicContact CE1-CG1 4.5Å; F196-V206 HydrophobicContact CE1-CG2 4.09Å; F196-V206 HydrophobicContact CE2-CG2 4.32Å; F196-V206 HydrophobicContact CG-CG2 4.23Å; F196-V206 HydrophobicContact CZ-CG2 4.21Å; Y203-V206 HydrophobicContact CD1-CG2 3.83Å; Y203-V206 HydrophobicContact CG-CG2 4.32Å; N204-V206 PolarHBondContact O-N 3.21Å; V206-L209 PolarHBondContact O-N 3.41Å; V206-L210 HydrophobicContact CG1-CD1 3.92Å; V206-L210 HydrophobicContact CG1-CG 4.43Å; V206-L210 WeakPolarHBondContact O-CB 3.48Å; V206-L210 WeakPolarHBondContact O-CG 3.4Å; V206-L210 PolarHBondContact O-N 3.36Å; V206-Y248 HydrophobicContact CB-CD1 3.97Å; V206-Y248 HydrophobicContact CB-CG 4.19Å; V206-Y248 HydrophobicContact CG1-CD1 3.69Å; V206-Y248 HydrophobicContact CG1-CD2 3.89Å; V206-Y248 HydrophobicContact CG1-CE1 4.07Å; V206-Y248 HydrophobicContact CG1-CE2 4.27Å; V206-Y248 HydrophobicContact CG1-CG 3.58Å
207A97.5Very high95.8Very high11 Ų1134.5 Ų34.59%0.09117%0.168CC..Hα-helixtrans-61.1-48.1-17900000111.5L209 L210 E211 Q251A207-L209 PolarHBondContact O-N 2.8Å; A207-L210 WeakPolarHBondContact O-CB 3.42Å; A207-L210 PolarHBondContact O-N 2.98Å; A207-L210 VanDerWaalsContact O-N 3.15Å; A207-E211 PolarHBondContact O-N 3.15Å; A207-Q251 HydrophobicContact CB-CG 4.44Å
208E98.3Very high95.8Very high22 Ų2236.5 Ų36.510%0.10318%0.179CC..Hα-helixtrans-66.5-39.1-178.3-6584.6170.100111.8F156 R164 K168 G205 L210 E211 I212F156-E208 HydrophobicContact CD1-CB 4.28Å; F156-E208 HydrophobicContact CE1-CB 4.06Å; R164-E208 HydrophobicContact CB-CG 3.97Å; R164-E208 IonicContact CZ-OE1 3.72Å; R164-E208 IonicContact NE-OE1 2.66Å; R164-E208 PolarHBondContact NE-OE1 2.99Å; R164-E208 IonicContact NE-OE2 2.84Å; R164-E208 IonicContact NH2-OE1 3.71Å; K168-E208 HydrophobicContact CB-CB 4.12Å; K168-E208 HydrophobicContact CB-CG 4.49Å; K168-E208 HydrophobicContact CD-CB 4.1Å; K168-E208 HydrophobicContact CD-CG 4.29Å; K168-E208 HydrophobicContact CG-CB 4.21Å; G205-E208 VanDerWaalsContact CA-OE2 3.32Å; G205-E208 WeakPolarHBondContact CA-OE2 3.48Å; E208-L210 VanDerWaalsContact C-N 3.32Å; E208-L210 PolarHBondContact O-N 3.2Å; E208-E211 PolarHBondContact O-N 3.48Å; E208-I212 WeakPolarHBondContact O-CG1 3.4Å; E208-I212 PolarHBondContact O-N 3.15Å
209L98.6Very high95.7Very high0 Ų033 Ų330%018%0.182CC..Hα-helixtrans-63.8-38.8173.6-70.5178000111.6L153 F156 L171 I189 I192 F193 Y203 G205 V206 A207 I212 L213L153-L209 HydrophobicContact CD2-CD2 3.97Å; F156-L209 HydrophobicContact CD1-CD2 3.73Å; F156-L209 HydrophobicContact CD1-CG 3.88Å; F156-L209 HydrophobicContact CD2-CD2 4.34Å; F156-L209 HydrophobicContact CE1-CD2 3.7Å; F156-L209 HydrophobicContact CE1-CG 4.2Å; F156-L209 HydrophobicContact CE2-CD2 4.31Å; F156-L209 HydrophobicContact CG-CD2 4.04Å; F156-L209 HydrophobicContact CG-CG 4.36Å; F156-L209 HydrophobicContact CZ-CD2 3.99Å; L171-L209 HydrophobicContact CD2-CD2 4.16Å; I189-L209 HydrophobicContact CD1-CD2 4.22Å; I189-L209 HydrophobicContact CG1-CD2 4.17Å; I189-L209 HydrophobicContact CG2-CB 4.48Å; I189-L209 HydrophobicContact CG2-CD1 4.48Å; I192-L209 HydrophobicContact CD1-CD1 4.48Å; I192-L209 HydrophobicContact CG2-CD1 4.15Å; F193-L209 HydrophobicContact CE1-CB 4.12Å; F193-L209 HydrophobicContact CE1-CD1 4.14Å; F193-L209 HydrophobicContact CZ-CB 3.91Å; Y203-L209 HydrophobicContact CE1-CD1 3.84Å; G205-L209 WeakPolarHBondContact O-CB 3.45Å; G205-L209 VanDerWaalsContact O-CG 3.27Å; G205-L209 WeakPolarHBondContact O-CG 3.17Å; G205-L209 PolarHBondContact O-N 2.91Å; G205-L209 VanDerWaalsContact O-N 3.15Å; V206-L209 PolarHBondContact O-N 3.41Å; A207-L209 PolarHBondContact O-N 2.8Å; L209-I212 HydrophobicContact CD2-CD1 4.48Å; L209-I212 PolarHBondContact O-N 3.31Å; L209-L213 VanDerWaalsContact O-CG 3.32Å; L209-L213 WeakPolarHBondContact O-CG 3.39Å; L209-L213 PolarHBondContact O-N 3.4Å
210L98.7Very high95.7Very high0 Ų026.3 Ų26.30%015%0.151CC..Hα-helixtrans-67.1-36.7175.3-75.1170.7000112.5F193 V206 A207 E208 I212 L213 G214 L236 L239 Y248 Q251 L252 C255F193-L210 HydrophobicContact CE2-CD2 4.11Å; F193-L210 HydrophobicContact CZ-CD2 4Å; F193-L210 HydrophobicContact CZ-CG 4Å; V206-L210 HydrophobicContact CG1-CD1 3.92Å; V206-L210 HydrophobicContact CG1-CG 4.43Å; V206-L210 WeakPolarHBondContact O-CB 3.48Å; V206-L210 WeakPolarHBondContact O-CG 3.4Å; V206-L210 PolarHBondContact O-N 3.36Å; A207-L210 WeakPolarHBondContact O-CB 3.42Å; A207-L210 PolarHBondContact O-N 2.98Å; A207-L210 VanDerWaalsContact O-N 3.15Å; E208-L210 VanDerWaalsContact C-N 3.32Å; E208-L210 PolarHBondContact O-N 3.2Å; L210-I212 VanDerWaalsContact C-N 3.34Å; L210-I212 PolarHBondContact O-N 3.29Å; L210-L213 HydrophobicContact CD2-CD1 4.3Å; L210-L213 CarbonylContact O-C 3.59Å; L210-L213 PolarHBondContact O-N 3.17Å; L210-G214 PolarHBondContact O-N 2.99Å; L210-L236 HydrophobicContact CD2-CD2 3.76Å; L210-L239 HydrophobicContact CD1-CD1 4.38Å; L210-L239 HydrophobicContact CD2-CD1 3.99Å; L210-Y248 HydrophobicContact CD1-CD2 3.7Å; L210-Y248 HydrophobicContact CD1-CG 4.21Å; L210-Q251 HydrophobicContact CB-CB 3.71Å; L210-Q251 HydrophobicContact CD1-CB 4.42Å; L210-L252 HydrophobicContact CD1-CB 3.91Å; L210-L252 HydrophobicContact CD1-CD1 4.41Å; L210-L252 HydrophobicContact CD2-CD1 4.13Å; L210-C255 PolarHBondContact O-SG 2.77Å
211E98Very high95.8Very high50 Ų5026 Ų2623%0.23416%0.157CC..Hα-helixtrans-59.5-44.9173.5-74.9-177-12900111.9K168 A207 E208 L213 G214 S215 Q251K168-E211 HydrophobicContact CD-CB 4Å; K168-E211 WeakPolarHBondContact CD-OE2 3.43Å; K168-E211 IonicContact NZ-OE1 3.82Å; K168-E211 IonicContact NZ-OE2 3.06Å; K168-E211 PolarHBondContact NZ-OE2 3.42Å; A207-E211 PolarHBondContact O-N 3.15Å; E208-E211 PolarHBondContact O-N 3.48Å; E211-L213 VanDerWaalsContact C-N 3.32Å; E211-L213 PolarHBondContact O-N 2.92Å; E211-G214 PolarHBondContact O-N 3.22Å; E211-S215 PolarHBondContact O-N 3.15Å; E211-Q251 HydrophobicContact CG-CB 4.5Å; E211-Q251 HydrophobicContact CG-CG 3.62Å
212I98.3Very high96Very high3 Ų327.6 Ų27.62%0.01517%0.168CC..Hα-helixtrans-61.5-46.5176.1-58.3167.6000109.6F156 K168 L171 H172 E208 L209 L210 G214 S215 I216F156-I212 HydrophobicContact CE1-CD1 4.2Å; F156-I212 HydrophobicContact CZ-CD1 3.96Å; K168-I212 HydrophobicContact CG-CD1 4.1Å; K168-I212 HydrophobicContact CG-CG1 3.75Å; L171-I212 HydrophobicContact CB-CD1 4.1Å; L171-I212 HydrophobicContact CD2-CD1 3.79Å; L171-I212 HydrophobicContact CG-CD1 4.2Å; H172-I212 HydrophobicContact CB-CG1 4.42Å; H172-I212 HydrophobicContact CB-CG2 4.32Å; E208-I212 WeakPolarHBondContact O-CG1 3.4Å; E208-I212 PolarHBondContact O-N 3.15Å; L209-I212 HydrophobicContact CD2-CD1 4.48Å; L209-I212 PolarHBondContact O-N 3.31Å; L210-I212 VanDerWaalsContact C-N 3.34Å; L210-I212 PolarHBondContact O-N 3.29Å; I212-G214 VanDerWaalsContact C-N 3.33Å; I212-G214 PolarHBondContact O-N 3.27Å; I212-S215 WeakPolarHBondContact O-CB 3.35Å; I212-S215 PolarHBondContact O-N 3.06Å; I212-I216 HydrophobicContact CG2-CD1 3.79Å; I212-I216 HydrophobicContact CG2-CG1 4.34Å; I212-I216 VanDerWaalsContact O-CG1 3.28Å; I212-I216 WeakPolarHBondContact O-CG1 3.29Å; I212-I216 PolarHBondContact O-N 3.49Å
213L98.2Very high96.2Very high3 Ų331.1 Ų31.12%0.01620%0.195CC..Hα-helixtrans-62-39.1179.2-75.7166.5000112.4I189 F193 L209 L210 E211 S215 I216 I217 F231I189-L213 HydrophobicContact CG2-CD1 3.72Å; I189-L213 HydrophobicContact CG2-CG 4.4Å; F193-L213 HydrophobicContact CD2-CD1 4.48Å; F193-L213 HydrophobicContact CE2-CD1 3.38Å; F193-L213 HydrophobicContact CZ-CD1 3.84Å; L209-L213 VanDerWaalsContact O-CG 3.32Å; L209-L213 WeakPolarHBondContact O-CG 3.39Å; L209-L213 PolarHBondContact O-N 3.4Å; L210-L213 HydrophobicContact CD2-CD1 4.3Å; L210-L213 CarbonylContact O-C 3.59Å; L210-L213 PolarHBondContact O-N 3.17Å; E211-L213 VanDerWaalsContact C-N 3.32Å; E211-L213 PolarHBondContact O-N 2.92Å; L213-S215 VanDerWaalsContact C-N 3.29Å; L213-S215 PolarHBondContact O-N 3.33Å; L213-I216 HydrophobicContact CD2-CD1 4.42Å; L213-I216 CarbonylContact O-C 3.57Å; L213-I216 WeakPolarHBondContact O-CA 3.41Å; L213-I216 WeakPolarHBondContact O-CB 2.97Å; L213-I216 PolarHBondContact O-N 3.18Å; L213-I216 VanDerWaalsContact O-N 3.09Å; L213-I217 WeakPolarHBondContact O-CB 3.35Å; L213-I217 WeakPolarHBondContact O-CD1 3.3Å; L213-I217 WeakPolarHBondContact O-CG1 3.47Å; L213-I217 PolarHBondContact O-N 3.16Å; L213-F231 HydrophobicContact CD1-CZ 3.73Å; L213-F231 HydrophobicContact CD2-CE1 4.3Å; L213-F231 HydrophobicContact CD2-CZ 3.95Å; L213-F231 HydrophobicContact CG-CZ 4.38Å
214G97.3Very high96.2Very high0 Ų030 Ų300%019%0.191CC..Hα-helixtrans-57.3-43.9174.700000111.8L210 E211 I212 I217 N218 C255L210-G214 PolarHBondContact O-N 2.99Å; E211-G214 PolarHBondContact O-N 3.22Å; I212-G214 VanDerWaalsContact C-N 3.33Å; I212-G214 PolarHBondContact O-N 3.27Å; G214-I217 PolarHBondContact O-N 2.93Å; G214-N218 PolarHBondContact O-N 2.6Å; G214-N218 VanDerWaalsContact O-N 3.12Å; G214-C255 PolarHBondContact N-SG 3.41Å
215S96.3Very high96.3Very high23 Ų2334.1 Ų34.116%0.16121%0.207CC..Hα-helixtrans-64.7-41.3173.8-163.60000112.5E211 I212 L213 N218 G219 H498E211-S215 PolarHBondContact O-N 3.15Å; I212-S215 WeakPolarHBondContact O-CB 3.35Å; I212-S215 PolarHBondContact O-N 3.06Å; L213-S215 VanDerWaalsContact C-N 3.29Å; L213-S215 PolarHBondContact O-N 3.33Å; S215-N218 PolarHBondContact O-N 2.92Å; S215-G219 PolarHBondContact O-N 3.04Å; S215-H498 PolarHBondContact OG-CE1 2.9Å; S215-H498 VanDerWaalsContact OG-CE1 3.31Å
216I96.7Very high96.3Very high9 Ų940.6 Ų40.65%0.04624%0.237CC..Hα-helixtrans-62.5-44.8177.2-68.6172.8000111.7Y175 I212 L213 N218 G219 F220Y175-I216 HydrophobicContact CD1-CD1 3.82Å; Y175-I216 HydrophobicContact CD1-CG1 3.74Å; Y175-I216 HydrophobicContact CD2-CD1 3.77Å; Y175-I216 HydrophobicContact CE1-CB 4.28Å; Y175-I216 HydrophobicContact CE1-CD1 3.71Å; Y175-I216 HydrophobicContact CE1-CG1 3.45Å; Y175-I216 VanDerWaalsContact CE1-CG1 3.45Å; Y175-I216 HydrophobicContact CE1-CG2 4.03Å; Y175-I216 HydrophobicContact CE2-CD1 3.63Å; Y175-I216 HydrophobicContact CE2-CG1 4.31Å; Y175-I216 HydrophobicContact CG-CD1 3.86Å; Y175-I216 HydrophobicContact CG-CG1 4.3Å; Y175-I216 VanDerWaalsContact OH-CG2 3.25Å; Y175-I216 WeakPolarHBondContact OH-CG2 3.37Å; I212-I216 HydrophobicContact CG2-CD1 3.79Å; I212-I216 HydrophobicContact CG2-CG1 4.34Å; I212-I216 VanDerWaalsContact O-CG1 3.28Å; I212-I216 WeakPolarHBondContact O-CG1 3.29Å; I212-I216 PolarHBondContact O-N 3.49Å; L213-I216 HydrophobicContact CD2-CD1 4.42Å; L213-I216 CarbonylContact O-C 3.57Å; L213-I216 WeakPolarHBondContact O-CA 3.41Å; L213-I216 WeakPolarHBondContact O-CB 2.97Å; L213-I216 PolarHBondContact O-N 3.18Å; L213-I216 VanDerWaalsContact O-N 3.09Å; I216-N218 VanDerWaalsContact C-N 3.35Å; I216-G219 CarbonylContact O-C 3.43Å; I216-G219 WeakPolarHBondContact O-CA 3.05Å; I216-G219 PolarHBondContact O-N 3.37Å; I216-G219 VanDerWaalsContact O-N 3.1Å; I216-F220 HydrophobicContact CG2-CD1 4.36Å; I216-F220 HydrophobicContact CG2-CE1 3.51Å; I216-F220 HydrophobicContact CG2-CZ 3.91Å; I216-F220 WeakPolarHBondContact O-CD1 3.46Å; I216-F220 PolarHBondContact O-N 3.31Å
217I97Very high96.1Very high0 Ų044.9 Ų44.90%026%0.257CS..Hα-helixtrans-62.9-43.9-179.3-67.8158.6000110L213 G214 G219 F220 F231 L236 C255 Q258 F259L213-I217 WeakPolarHBondContact O-CB 3.35Å; L213-I217 WeakPolarHBondContact O-CD1 3.3Å; L213-I217 WeakPolarHBondContact O-CG1 3.47Å; L213-I217 PolarHBondContact O-N 3.16Å; G214-I217 PolarHBondContact O-N 2.93Å; I217-G219 PolarHBondContact O-N 3.22Å; I217-F220 HydrophobicContact CB-CD2 4.36Å; I217-F220 HydrophobicContact CB-CE2 4.21Å; I217-F220 HydrophobicContact CG1-CD2 4.47Å; I217-F220 HydrophobicContact CG1-CE2 3.84Å; I217-F220 HydrophobicContact CG1-CZ 4.28Å; I217-F220 HydrophobicContact CG2-CD2 4.29Å; I217-F220 HydrophobicContact CG2-CE2 4.42Å; I217-F220 WeakPolarHBondContact O-CB 3.32Å; I217-F220 PolarHBondContact O-N 3.26Å; I217-F231 HydrophobicContact CD1-CE1 4.43Å; I217-L236 HydrophobicContact CD1-CD1 4.23Å; I217-C255 HydrophobicContact CD1-CB 3.81Å; I217-Q258 HydrophobicContact CG2-CB 3.89Å; I217-F259 HydrophobicContact CB-CE2 4.48Å; I217-F259 HydrophobicContact CD1-CD2 3.77Å; I217-F259 HydrophobicContact CD1-CE2 3.47Å; I217-F259 VanDerWaalsContact CD1-CE2 3.47Å; I217-F259 HydrophobicContact CD1-CZ 4.46Å; I217-F259 HydrophobicContact CG1-CD2 4.11Å; I217-F259 HydrophobicContact CG1-CE2 3.6Å; I217-F259 HydrophobicContact CG1-CZ 4.13Å; I217-F259 HydrophobicContact CG2-CD1 4.44Å; I217-F259 HydrophobicContact CG2-CD2 3.79Å; I217-F259 HydrophobicContact CG2-CE2 4Å; I217-F259 HydrophobicContact CG2-CG 4.04Å; I217-F259 HydrophobicContact CG2-CZ 4.42Å
218N95.3Very high96.1Very high62 Ų6245 Ų4533%0.33226%0.256SS..Hα-helixtrans-59-31.7175.7-170.223.4000112.3G214 S215 I216 K262G214-N218 PolarHBondContact O-N 2.6Å; G214-N218 VanDerWaalsContact O-N 3.12Å; S215-N218 PolarHBondContact O-N 2.92Å; I216-N218 VanDerWaalsContact C-N 3.35Å; N218-K262 WeakPolarHBondContact O-CE 3.43Å; N218-K262 PolarHBondContact O-NZ 3.39Å; N218-K262 PolarHBondContact OD1-NZ 3.06Å
219G94.7Very high96Very high57 Ų5746 Ų4659%0.58826%0.26SS*.THydrogen-bonded Turntrans-82.61.7176.400000116S215 I216 I217S215-G219 PolarHBondContact O-N 3.04Å; I216-G219 CarbonylContact O-C 3.43Å; I216-G219 WeakPolarHBondContact O-CA 3.05Å; I216-G219 PolarHBondContact O-N 3.37Å; I216-G219 VanDerWaalsContact O-N 3.1Å; I217-G219 PolarHBondContact O-N 3.22Å
220F94.4Very high95.9Very high23 Ų2349.1 Ų49.110%0.10128%0.279CS..PPolyproline II helixtrans-66.7140179.4-72.1-21.6000112.7I216 I217 L224 H228 F259I216-F220 HydrophobicContact CG2-CD1 4.36Å; I216-F220 HydrophobicContact CG2-CE1 3.51Å; I216-F220 HydrophobicContact CG2-CZ 3.91Å; I216-F220 WeakPolarHBondContact O-CD1 3.46Å; I216-F220 PolarHBondContact O-N 3.31Å; I217-F220 HydrophobicContact CB-CD2 4.36Å; I217-F220 HydrophobicContact CB-CE2 4.21Å; I217-F220 HydrophobicContact CG1-CD2 4.47Å; I217-F220 HydrophobicContact CG1-CE2 3.84Å; I217-F220 HydrophobicContact CG1-CZ 4.28Å; I217-F220 HydrophobicContact CG2-CD2 4.29Å; I217-F220 HydrophobicContact CG2-CE2 4.42Å; I217-F220 WeakPolarHBondContact O-CB 3.32Å; I217-F220 PolarHBondContact O-N 3.26Å; F220-L224 HydrophobicContact CB-CD2 3.79Å; F220-L224 HydrophobicContact CD2-CD2 3.98Å; F220-L224 HydrophobicContact CG-CD2 4.33Å; F220-H228 AromaticContact CD1-CD2 3.97Å; F220-H228 AromaticContact CD1-NE2 3.85Å; F220-H228 HydrophobicContact CD2-CB 4.25Å; F220-H228 AromaticContact CD2-CD2 3.8Å; F220-H228 AromaticContact CE1-CD2 3.97Å; F220-H228 AromaticContact CE1-CE1 3.78Å; F220-H228 AromaticContact CE1-NE2 3.71Å; F220-H228 HydrophobicContact CE2-CB 3.83Å; F220-H228 AromaticContact CE2-CD2 3.8Å; F220-H228 AromaticContact CE2-CG 3.6Å; F220-H228 AromaticContact CG-CD2 3.89Å; F220-H228 HydrophobicContact CZ-CB 4.37Å; F220-H228 AromaticContact CZ-CD2 3.9Å; F220-H228 AromaticContact CZ-CE1 3.83Å; F220-H228 AromaticContact CZ-CG 3.73Å; F220-H228 AromaticContact CZ-ND1 3.65Å; F220-H228 AromaticContact CZ-NE2 3.99Å; F220-F259 HydrophobicContact CD2-CE1 4.32Å; F220-F259 HydrophobicContact CD2-CZ 4.39Å; F220-F259 HydrophobicContact CE2-CE1 4.1Å; F220-F259 AromaticContact CE2-CZ 3.75Å; F220-F259 HydrophobicContact CE2-CZ 3.75Å
221A93.4Very high95.8Very high81 Ų8149.8 Ų49.867%0.66928%0.282SS*.PPolyproline II helixtrans-77.5146.7172.700000110.5P223A221-P223 CarbonylContact O-C 3.58Å
222L92.9Very high95.8Very high112 Ų11247.4 Ų47.459%0.58627%0.271SS*.SBendtrans-96.6140.4172.1-60.4179.6000110.1L224 K262L222-L224 HydrophobicContact CD2-CD2 4.22Å; L222-L224 HydrophobicContact CD2-CG 4.12Å; L222-K262 HydrophobicContact CD2-CB 4.08Å; L222-K262 HydrophobicContact CD2-CD 4.39Å; L222-K262 VanDerWaalsContact CD2-O 3.31Å; L222-K262 WeakPolarHBondContact CD2-O 3.47Å
223P94Very high95.8Very high119 Ų11949.3 Ų49.377%0.77328%0.281SS*.SBendcis-71.7149.6-1.730.9-35.6000112.8A221 K225A221-P223 CarbonylContact O-C 3.58Å; P223-K225 PolarHBondContact O-N 3.26Å
224L94.4Very high95.8Very high14 Ų1457.2 Ų57.27%0.07331%0.31CS..PPolyproline II helixtrans-60.2135.5177.2-70.3-177.9000111F220 L222 F259 K262 D263 L266F220-L224 HydrophobicContact CB-CD2 3.79Å; F220-L224 HydrophobicContact CD2-CD2 3.98Å; F220-L224 HydrophobicContact CG-CD2 4.33Å; L222-L224 HydrophobicContact CD2-CD2 4.22Å; L222-L224 HydrophobicContact CD2-CG 4.12Å; L224-F259 HydrophobicContact CD1-CD1 3.97Å; L224-F259 HydrophobicContact CD1-CE1 4.21Å; L224-K262 HydrophobicContact CD1-CB 4.2Å; L224-K262 HydrophobicContact CD2-CB 4.29Å; L224-K262 HydrophobicContact CG-CB 4.43Å; L224-D263 HydrophobicContact CD1-CB 3.54Å; L224-D263 HydrophobicContact CG-CB 4.23Å; L224-L266 HydrophobicContact CD1-CD1 3.99Å
225K94.8Very high95.8Very high125 Ų12557.2 Ų57.254%0.54331%0.31SS..PPolyproline II helixtrans-70.9149.8174.7-60.7-177.2-178.5179.80111.4P223 E227 H228 K229P223-K225 PolarHBondContact O-N 3.26Å; K225-E227 HydrophobicContact CB-CG 3.82Å; K225-E227 HydrophobicContact CD-CG 4.29Å; K225-E227 PolarHBondContact O-N 3.35Å; K225-H228 WeakPolarHBondContact O-CB 3.39Å; K225-H228 PolarHBondContact O-N 3.41Å; K225-K229 PolarHBondContact O-N 2.99Å
226E95.3Very high95.9Very high135 Ų13556.1 Ų56.163%0.63130%0.303SS*.Hα-helixtrans-59.8-32178.2-161.456.9-144.600113.1H228 K229 T230E226-H228 VanDerWaalsContact C-N 3.26Å; E226-H228 PolarHBondContact O-N 3.14Å; E226-K229 PolarHBondContact O-N 2.93Å; E226-T230 WeakPolarHBondContact O-CB 3.25Å; E226-T230 PolarHBondContact O-N 3.18Å; E226-T230 PolarHBondContact O-OG1 3.18Å
227E94.7Very high95.9Very high94 Ų9456 Ų5644%0.43930%0.302SS..Hα-helixtrans-60.8-34.5173.557.1164.9-17400112.5R186 K225 F231R186-E227 IonicContact NH2-OE1 2.79Å; R186-E227 PolarHBondContact NH2-OE1 3.38Å; K225-E227 HydrophobicContact CB-CG 3.82Å; K225-E227 HydrophobicContact CD-CG 4.29Å; K225-E227 PolarHBondContact O-N 3.35Å; E227-F231 WeakPolarHBondContact O-CB 3.4Å; E227-F231 PolarHBondContact O-N 2.95Å
228H96Very high96Very high13 Ų1356.1 Ų56.16%0.0630%0.303CS..Hα-helixtrans-77.6-37.6179.8-55.7-26.1000111.1F220 K225 E226 T230 F231 L232 F259F220-H228 AromaticContact CD1-CD2 3.97Å; F220-H228 AromaticContact CD1-NE2 3.85Å; F220-H228 HydrophobicContact CD2-CB 4.25Å; F220-H228 AromaticContact CD2-CD2 3.8Å; F220-H228 AromaticContact CE1-CD2 3.97Å; F220-H228 AromaticContact CE1-CE1 3.78Å; F220-H228 AromaticContact CE1-NE2 3.71Å; F220-H228 HydrophobicContact CE2-CB 3.83Å; F220-H228 AromaticContact CE2-CD2 3.8Å; F220-H228 AromaticContact CE2-CG 3.6Å; F220-H228 AromaticContact CG-CD2 3.89Å; F220-H228 HydrophobicContact CZ-CB 4.37Å; F220-H228 AromaticContact CZ-CD2 3.9Å; F220-H228 AromaticContact CZ-CE1 3.83Å; F220-H228 AromaticContact CZ-CG 3.73Å; F220-H228 AromaticContact CZ-ND1 3.65Å; F220-H228 AromaticContact CZ-NE2 3.99Å; K225-H228 WeakPolarHBondContact O-CB 3.39Å; K225-H228 PolarHBondContact O-N 3.41Å; E226-H228 VanDerWaalsContact C-N 3.26Å; E226-H228 PolarHBondContact O-N 3.14Å; H228-T230 VanDerWaalsContact C-N 3.34Å; H228-F231 WeakPolarHBondContact O-CB 3.31Å; H228-F231 PolarHBondContact O-N 3.12Å; H228-L232 PolarHBondContact O-N 3.45Å; H228-F259 HydrophobicContact CB-CE1 4.02Å; H228-F259 HydrophobicContact CB-CZ 4.18Å; H228-F259 WeakPolarHBondContact O-CZ 3.24Å
229K96.9Very high96.1Very high43 Ų4353.1 Ų53.119%0.18729%0.287CS..Hα-helixtrans-62.1-43.5171.8-61.8-172174.7-152.50111.2K225 E226 F231 L232 L233 D263 L266K225-K229 PolarHBondContact O-N 2.99Å; E226-K229 PolarHBondContact O-N 2.93Å; K229-F231 VanDerWaalsContact C-N 3.34Å; K229-F231 PolarHBondContact O-N 3.43Å; K229-L232 PolarHBondContact O-N 3.38Å; K229-L233 WeakPolarHBondContact O-CG 3.47Å; K229-L233 PolarHBondContact O-N 3.28Å; K229-L233 VanDerWaalsContact O-N 3.1Å; K229-D263 VanDerWaalsContact CE-OD2 3.23Å; K229-D263 WeakPolarHBondContact CE-OD2 3.47Å; K229-D263 IonicContact NZ-OD2 3.84Å; K229-D263 PolarHBondContact NZ-OD2 2.87Å; K229-L266 HydrophobicContact CD-CD2 4.06Å; K229-L266 HydrophobicContact CG-CD1 4.36Å; K229-L266 HydrophobicContact CG-CD2 4.19Å
230T96.7Very high96.3Very high66 Ų6650.4 Ų50.441%0.40526%0.259SS..Hα-helixtrans-61.3-43.5174.6-58.60000111.2E226 H228 L233 R234E226-T230 WeakPolarHBondContact O-CB 3.25Å; E226-T230 PolarHBondContact O-N 3.18Å; E226-T230 PolarHBondContact O-OG1 3.18Å; H228-T230 VanDerWaalsContact C-N 3.34Å; T230-L233 PolarHBondContact O-N 2.95Å; T230-R234 HydrophobicContact CG2-CB 4.37Å; T230-R234 HydrophobicContact CG2-CG 3.91Å; T230-R234 WeakPolarHBondContact O-CB 3.37Å; T230-R234 WeakPolarHBondContact O-CG 3.16Å; T230-R234 PolarHBondContact O-N 3.36Å
231F97.4Very high96.3Very high14 Ų1454 Ų546%0.06128%0.275CS..Hα-helixtrans-58.6-46.6176.5171.5-112.1000112.6N190 L213 I217 E227 H228 K229 L233 V235 L236 F259N190-F231 WeakPolarHBondContact OD1-CD2 3.37Å; N190-F231 WeakPolarHBondContact OD1-CE2 3.44Å; L213-F231 HydrophobicContact CD1-CZ 3.73Å; L213-F231 HydrophobicContact CD2-CE1 4.3Å; L213-F231 HydrophobicContact CD2-CZ 3.95Å; L213-F231 HydrophobicContact CG-CZ 4.38Å; I217-F231 HydrophobicContact CD1-CE1 4.43Å; E227-F231 WeakPolarHBondContact O-CB 3.4Å; E227-F231 PolarHBondContact O-N 2.95Å; H228-F231 WeakPolarHBondContact O-CB 3.31Å; H228-F231 PolarHBondContact O-N 3.12Å; K229-F231 VanDerWaalsContact C-N 3.34Å; K229-F231 PolarHBondContact O-N 3.43Å; F231-L233 PolarHBondContact O-N 3.03Å; F231-V235 HydrophobicContact CD2-CB 3.74Å; F231-V235 HydrophobicContact CD2-CG1 4.22Å; F231-V235 HydrophobicContact CD2-CG2 3.84Å; F231-V235 HydrophobicContact CE2-CB 3.86Å; F231-V235 HydrophobicContact CE2-CG1 3.87Å; F231-V235 HydrophobicContact CE2-CG2 4.33Å; F231-V235 WeakPolarHBondContact O-CA 3.37Å; F231-V235 VanDerWaalsContact O-CB 3.28Å; F231-V235 WeakPolarHBondContact O-CB 3.41Å; F231-V235 PolarHBondContact O-N 3.27Å; F231-L236 HydrophobicContact CD1-CD1 4.23Å; F231-L236 HydrophobicContact CD1-CG 4.26Å; F231-L236 HydrophobicContact CE1-CD1 3.72Å; F231-L236 HydrophobicContact CE1-CD2 3.9Å; F231-L236 HydrophobicContact CE1-CG 3.73Å; F231-L236 HydrophobicContact CE2-CD2 4.3Å; F231-L236 HydrophobicContact CE2-CG 4.43Å; F231-L236 HydrophobicContact CZ-CD1 4.27Å; F231-L236 HydrophobicContact CZ-CD2 3.57Å; F231-L236 HydrophobicContact CZ-CG 3.82Å; F231-L236 PolarHBondContact O-N 2.9Å; F231-L236 VanDerWaalsContact O-N 3.15Å; F231-F259 AromaticContact CD1-CE2 3.97Å; F231-F259 HydrophobicContact CD1-CE2 3.97Å; F231-F259 HydrophobicContact CD1-CZ 4Å; F231-F259 HydrophobicContact CE1-CE2 4.21Å
232L98.1Very high96.3Very high0 Ų050.4 Ų50.40%025%0.245CC..Iπ-helixtrans-55.9-52.7174.7173.664.5000111.7H228 K229 L236 L237 I256 F259 L266 V270H228-L232 PolarHBondContact O-N 3.45Å; K229-L232 PolarHBondContact O-N 3.38Å; L232-L236 HydrophobicContact CD1-CB 4.33Å; L232-L236 HydrophobicContact CD1-CD1 4.09Å; L232-L236 PolarHBondContact O-N 2.92Å; L232-L237 PolarHBondContact O-N 3.45Å; L232-I256 HydrophobicContact CD1-CD1 3.41Å; L232-I256 VanDerWaalsContact CD1-CD1 3.41Å; L232-F259 HydrophobicContact CB-CD1 4.4Å; L232-F259 HydrophobicContact CB-CD2 4.24Å; L232-F259 HydrophobicContact CB-CE1 4.32Å; L232-F259 HydrophobicContact CB-CE2 4.15Å; L232-F259 HydrophobicContact CB-CG 4.35Å; L232-F259 HydrophobicContact CB-CZ 4.19Å; L232-F259 HydrophobicContact CD1-CB 4.12Å; L232-F259 HydrophobicContact CD1-CD2 3.86Å; L232-F259 HydrophobicContact CD1-CE2 4.47Å; L232-F259 HydrophobicContact CD1-CG 4.05Å; L232-F259 HydrophobicContact CD2-CB 4.01Å; L232-F259 HydrophobicContact CD2-CD1 4.15Å; L232-F259 HydrophobicContact CD2-CG 4.02Å; L232-F259 HydrophobicContact CG-CD2 4.45Å; L232-F259 HydrophobicContact CG-CG 4.37Å; L232-L266 HydrophobicContact CD2-CB 4.17Å; L232-L266 HydrophobicContact CD2-CD1 3.79Å; L232-L266 HydrophobicContact CD2-CG 4.47Å; L232-V270 HydrophobicContact CD1-CG2 4.24Å; L232-V270 HydrophobicContact CD2-CG2 3.8Å; L232-V270 HydrophobicContact CG-CG2 4.18Å
233L97.6Very high96.2Very high43 Ų4350.9 Ų50.923%0.22524%0.242CC..Iπ-helixtrans-78.7-29.8-170.8-61.8176.9000114K229 T230 F231 L237 Q269K229-L233 WeakPolarHBondContact O-CG 3.47Å; K229-L233 PolarHBondContact O-N 3.28Å; K229-L233 VanDerWaalsContact O-N 3.1Å; T230-L233 PolarHBondContact O-N 2.95Å; F231-L233 PolarHBondContact O-N 3.03Å; L233-L237 HydrophobicContact CD2-CD1 3.69Å; L233-Q269 VanDerWaalsContact CD1-OE1 3.26Å; L233-Q269 HydrophobicContact CD2-CB 3.86Å
234R97Very high96.1Very high168 Ų16846 Ų4663%0.63421%0.211SC*.Iπ-helixtrans-104.3-15.3-173.5-60-62.4-174156.4-0.9114.1T230 P238T230-R234 HydrophobicContact CG2-CB 4.37Å; T230-R234 HydrophobicContact CG2-CG 3.91Å; T230-R234 WeakPolarHBondContact O-CB 3.37Å; T230-R234 WeakPolarHBondContact O-CG 3.16Å; T230-R234 PolarHBondContact O-N 3.36Å; R234-P238 WeakPolarHBondContact O-CG 3.39Å
235V97.8Very high96.2Very high0 Ų045.4 Ų45.40%021%0.208CC..Iπ-helixtrans-122-60.6-179.2-169.10000110.9F193 Y194 F231 P238 L239F193-V235 HydrophobicContact CB-CG1 3.57Å; F193-V235 HydrophobicContact CD2-CG1 3.56Å; F193-V235 HydrophobicContact CG-CG1 4.05Å; Y194-V235 HydrophobicContact CE1-CG2 3.84Å; Y194-V235 HydrophobicContact CE2-CG2 4.31Å; Y194-V235 WeakPolarHBondContact OH-CG2 3.45Å; F231-V235 HydrophobicContact CD2-CB 3.74Å; F231-V235 HydrophobicContact CD2-CG1 4.22Å; F231-V235 HydrophobicContact CD2-CG2 3.84Å; F231-V235 HydrophobicContact CE2-CB 3.86Å; F231-V235 HydrophobicContact CE2-CG1 3.87Å; F231-V235 HydrophobicContact CE2-CG2 4.33Å; F231-V235 WeakPolarHBondContact O-CA 3.37Å; F231-V235 VanDerWaalsContact O-CB 3.28Å; F231-V235 WeakPolarHBondContact O-CB 3.41Å; F231-V235 PolarHBondContact O-N 3.27Å; V235-P238 WeakPolarHBondContact O-CD 3.4Å; V235-L239 WeakPolarHBondContact O-CG 3.35Å; V235-L239 PolarHBondContact O-N 3.29Å
236L98.4Very high96.2Very high0 Ų040.2 Ų40.20%019%0.187CC..Iπ-helixtrans-64.1-46.8-176-62.4-176.2000112.7L210 I217 F231 L232 L239 H240 L252 C255 I256 F259L210-L236 HydrophobicContact CD2-CD2 3.76Å; I217-L236 HydrophobicContact CD1-CD1 4.23Å; F231-L236 HydrophobicContact CD1-CD1 4.23Å; F231-L236 HydrophobicContact CD1-CG 4.26Å; F231-L236 HydrophobicContact CE1-CD1 3.72Å; F231-L236 HydrophobicContact CE1-CD2 3.9Å; F231-L236 HydrophobicContact CE1-CG 3.73Å; F231-L236 HydrophobicContact CE2-CD2 4.3Å; F231-L236 HydrophobicContact CE2-CG 4.43Å; F231-L236 HydrophobicContact CZ-CD1 4.27Å; F231-L236 HydrophobicContact CZ-CD2 3.57Å; F231-L236 HydrophobicContact CZ-CG 3.82Å; F231-L236 PolarHBondContact O-N 2.9Å; F231-L236 VanDerWaalsContact O-N 3.15Å; L232-L236 HydrophobicContact CD1-CB 4.33Å; L232-L236 HydrophobicContact CD1-CD1 4.09Å; L232-L236 PolarHBondContact O-N 2.92Å; L236-L239 HydrophobicContact CD2-CD1 4.18Å; L236-L239 WeakPolarHBondContact O-CB 3.38Å; L236-L239 PolarHBondContact O-N 3.4Å; L236-H240 PolarHBondContact O-ND1 3.37Å; L236-L252 HydrophobicContact CB-CD1 4.09Å; L236-L252 HydrophobicContact CD2-CD1 3.99Å; L236-C255 HydrophobicContact CD1-CB 4.05Å; L236-I256 HydrophobicContact CB-CD1 3.78Å; L236-I256 HydrophobicContact CD1-CD1 4.32Å; L236-F259 HydrophobicContact CD1-CD2 3.83Å; L236-F259 HydrophobicContact CD1-CE2 3.65Å
237L98.1Very high96.1Very high6 Ų636.9 Ų36.93%0.03118%0.176CC..Hα-helixtrans-60.9-48.8177.8-77.5-179.8000112.7L232 L233 L239 H240 I256 V270 L274 Y277L232-L237 PolarHBondContact O-N 3.45Å; L233-L237 HydrophobicContact CD2-CD1 3.69Å; L237-L239 PolarHBondContact O-N 3.04Å; L237-H240 WeakPolarHBondContact O-CB 3.26Å; L237-H240 PolarHBondContact O-N 3.36Å; L237-H240 PolarHBondContact O-ND1 3.17Å; L237-I256 HydrophobicContact CD2-CD1 4.33Å; L237-V270 HydrophobicContact CD2-CG1 4.15Å; L237-L274 HydrophobicContact CD2-CD2 4.31Å; L237-L274 HydrophobicContact CD2-CG 4.33Å; L237-Y277 HydrophobicContact CB-CE2 4.47Å
238P98.1Very high96.3Very high3 Ų332.6 Ų32.62%0.01916%0.156CC..Hα-helixtrans-62-21175.4-29.438.9000116.1I197 R234 V235 H240 K241I197-P238 HydrophobicContact CD1-CB 4.15Å; I197-P238 HydrophobicContact CG2-CB 4.11Å; R234-P238 WeakPolarHBondContact O-CG 3.39Å; V235-P238 WeakPolarHBondContact O-CD 3.4Å; P238-H240 PolarHBondContact O-N 3.12Å; P238-K241 HydrophobicContact CB-CD 4.42Å; P238-K241 VanDerWaalsContact O-CB 3.25Å; P238-K241 WeakPolarHBondContact O-CB 3.15Å; P238-K241 WeakPolarHBondContact O-CG 3.4Å; P238-K241 PolarHBondContact O-N 3.34Å
239L98Very high96.4Very high0 Ų032.6 Ų32.60%016%0.156CC..Hα-helixtrans-59.3-24.2174.2-77.6172.3000112.6F193 F196 I197 L210 V235 L236 L237 K241 Y248 L252F193-L239 HydrophobicContact CD1-CD2 4.38Å; F193-L239 HydrophobicContact CD2-CD1 4.18Å; F193-L239 HydrophobicContact CE2-CD1 4.16Å; F193-L239 HydrophobicContact CG-CD1 4.41Å; F193-L239 HydrophobicContact CG-CD2 4.41Å; F193-L239 HydrophobicContact CZ-CD1 4.43Å; F196-L239 HydrophobicContact CD1-CD2 3.61Å; F196-L239 HydrophobicContact CE1-CD2 3.74Å; I197-L239 HydrophobicContact CD1-CD2 3.78Å; I197-L239 HydrophobicContact CD1-CG 3.95Å; I197-L239 HydrophobicContact CG1-CD2 3.66Å; I197-L239 HydrophobicContact CG1-CG 4.28Å; L210-L239 HydrophobicContact CD1-CD1 4.38Å; L210-L239 HydrophobicContact CD2-CD1 3.99Å; V235-L239 WeakPolarHBondContact O-CG 3.35Å; V235-L239 PolarHBondContact O-N 3.29Å; L236-L239 HydrophobicContact CD2-CD1 4.18Å; L236-L239 WeakPolarHBondContact O-CB 3.38Å; L236-L239 PolarHBondContact O-N 3.4Å; L237-L239 PolarHBondContact O-N 3.04Å; L239-K241 PolarHBondContact O-N 3.2Å; L239-Y248 HydrophobicContact CB-CE2 4.21Å; L239-Y248 PolarHBondContact O-OH 2.9Å; L239-L252 HydrophobicContact CB-CD1 4.31Å; L239-L252 HydrophobicContact CB-CD2 3.63Å; L239-L252 HydrophobicContact CD1-CD1 4.07Å
240H98.1Very high96.4Very high0 Ų033.6 Ų33.60%017%0.167CC..THydrogen-bonded Turntrans-66.8-14.4174.7-60.686.2000113.5L236 L237 P238 L245 L252 K285 F289 E292L236-H240 PolarHBondContact O-ND1 3.37Å; L237-H240 WeakPolarHBondContact O-CB 3.26Å; L237-H240 PolarHBondContact O-N 3.36Å; L237-H240 PolarHBondContact O-ND1 3.17Å; P238-H240 PolarHBondContact O-N 3.12Å; H240-L245 HydrophobicContact CB-CD2 4.49Å; H240-L252 WeakPolarHBondContact CE1-CD2 2.85Å; H240-L252 VanDerWaalsContact NE2-CD2 3.29Å; H240-L252 WeakPolarHBondContact NE2-CD2 3.31Å; H240-K285 PolarHBondContact O-NZ 3.21Å; H240-F289 HydrophobicContact CB-CE2 4.14Å; H240-F289 HydrophobicContact CB-CZ 3.7Å; H240-E292 IonicContact CD2-OE2 2.76Å; H240-E292 PolarHBondContact CD2-OE2 3.19Å; H240-E292 VanDerWaalsContact CD2-OE2 3.25Å; H240-E292 IonicContact CE1-OE1 3.83Å; H240-E292 IonicContact NE2-OE1 3.33Å; H240-E292 PolarHBondContact NE2-OE1 3.46Å; H240-E292 IonicContact NE2-OE2 3.5Å; H240-E292 PolarHBondContact NE2-OE2 2.92Å
241K95.6Very high96.5Very high98 Ų9832.7 Ų32.743%0.42616%0.158SC..THydrogen-bonded Turntrans-73.3-35.8-178.5-67.8174.765.4-1440113P238 L239 Y277 K285P238-K241 HydrophobicContact CB-CD 4.42Å; P238-K241 VanDerWaalsContact O-CB 3.25Å; P238-K241 WeakPolarHBondContact O-CB 3.15Å; P238-K241 WeakPolarHBondContact O-CG 3.4Å; P238-K241 PolarHBondContact O-N 3.34Å; L239-K241 PolarHBondContact O-N 3.2Å; K241-Y277 HydrophobicContact CD-CD1 4.21Å; K241-Y277 HydrophobicContact CD-CE1 3.93Å; K241-Y277 HydrophobicContact CG-CD1 3.96Å; K241-Y277 HydrophobicContact CG-CD2 4.31Å; K241-Y277 HydrophobicContact CG-CE1 4.18Å; K241-Y277 HydrophobicContact CG-CG 4.05Å; K241-K285 PolarHBondContact O-NZ 3.18Å
242A93.4Very high96.6Very high5 Ų532 Ų324%0.04116%0.155CC..SBendtrans-62.4148-171.900000111.6F196 E201 S244 Y248 K285F196-A242 HydrophobicContact CE1-CB 4.02Å; F196-A242 HydrophobicContact CZ-CB 3.78Å; E201-A242 HydrophobicContact CG-CB 4.1Å; E201-A242 WeakPolarHBondContact OE1-CA 3.38Å; A242-S244 VanDerWaalsContact C-N 3.35Å; A242-Y248 WeakPolarHBondContact CB-OH 3.4Å; A242-K285 PolarHBondContact O-NZ 3.33Å
243K90.6Very high96.6Very high122 Ų12232 Ų3253%0.5316%0.155SC..G310 helixtrans-65.1-40.4-179.3-68.1168.1-171.8170.70112E201 L245E201-K243 WeakPolarHBondContact OE1-CG 3.37Å; E201-K243 PolarHBondContact OE1-N 3.12Å; K243-L245 PolarHBondContact O-N 3.41Å
244S92Very high96.6Very high18 Ų1833 Ų3313%0.12616%0.157CC..G310 helixtrans-73.425.4178.855.80000114.6A242 S246 V247 Y248A242-S244 VanDerWaalsContact C-N 3.35Å; S244-S246 PolarHBondContact O-N 3.08Å; S244-V247 PolarHBondContact O-N 2.95Å; S244-Y248 WeakPolarHBondContact O-CD1 3.23Å; S244-Y248 VanDerWaalsContact O-CE1 3.22Å; S244-Y248 WeakPolarHBondContact O-CE1 3.5Å
245L95.6Very high96.7Very high0 Ų025 Ų250%013%0.126CC..G310 helixtrans-58.4-33.8-178.1177.860.2000112H240 K243 V247 Y248 H249 L252 K285 F289H240-L245 HydrophobicContact CB-CD2 4.49Å; K243-L245 PolarHBondContact O-N 3.41Å; L245-V247 PolarHBondContact O-N 3.17Å; L245-Y248 HydrophobicContact CD1-CD2 4.13Å; L245-Y248 HydrophobicContact CD1-CE2 3.47Å; L245-Y248 VanDerWaalsContact CD1-CE2 3.47Å; L245-Y248 PolarHBondContact O-N 3.29Å; L245-H249 HydrophobicContact CD1-CB 4.16Å; L245-H249 HydrophobicContact CG-CB 4.09Å; L245-H249 WeakPolarHBondContact O-CA 3.22Å; L245-H249 VanDerWaalsContact O-CB 3.23Å; L245-H249 WeakPolarHBondContact O-CB 3.27Å; L245-H249 PolarHBondContact O-N 3.32Å; L245-L252 HydrophobicContact CD1-CD2 4Å; L245-K285 HydrophobicContact CB-CD 4.33Å; L245-F289 HydrophobicContact CD2-CD2 4.26Å; L245-F289 HydrophobicContact CD2-CE2 3.68Å
246S94.9Very high96.7Very high17 Ų1725 Ų2512%0.11913%0.126CC..G310 helixtrans-53-38.8-178.4500000113.4E106 S244 Y248E106-S246 VanDerWaalsContact CD-CB 3.42Å; E106-S246 WeakPolarHBondContact OE2-CB 3.39Å; E106-S246 PolarHBondContact OE2-OG 3.21Å; S244-S246 PolarHBondContact O-N 3.08Å; S246-Y248 VanDerWaalsContact C-N 3.29Å; S246-Y248 PolarHBondContact O-N 3.25Å
247V94.3Very high96.7Very high65 Ų6525.8 Ų25.839%0.39413%0.131SC..G310 helixtrans-62.8-31.1-176.8-176.20000113.4P105 E106 S244 L245P105-V247 HydrophobicContact CB-CG2 4.18Å; E106-V247 HydrophobicContact CG-CG2 4Å; S244-V247 PolarHBondContact O-N 2.95Å; L245-V247 PolarHBondContact O-N 3.17Å
248Y97Very high96.7Very high3 Ų326.1 Ų26.11%0.01213%0.132CC..THydrogen-bonded Turntrans-131.55.7-172.861.9-98.2000114.3F196 V206 L210 L239 A242 S244 L245 S246 Q251 L252F196-Y248 HydrophobicContact CE1-CE1 4.01Å; F196-Y248 AromaticContact CE1-CZ 3.96Å; F196-Y248 AromaticContact CZ-CE1 3.82Å; F196-Y248 HydrophobicContact CZ-CE1 3.82Å; V206-Y248 HydrophobicContact CB-CD1 3.97Å; V206-Y248 HydrophobicContact CB-CG 4.19Å; V206-Y248 HydrophobicContact CG1-CD1 3.69Å; V206-Y248 HydrophobicContact CG1-CD2 3.89Å; V206-Y248 HydrophobicContact CG1-CE1 4.07Å; V206-Y248 HydrophobicContact CG1-CE2 4.27Å; V206-Y248 HydrophobicContact CG1-CG 3.58Å; L210-Y248 HydrophobicContact CD1-CD2 3.7Å; L210-Y248 HydrophobicContact CD1-CG 4.21Å; L239-Y248 HydrophobicContact CB-CE2 4.21Å; L239-Y248 PolarHBondContact O-OH 2.9Å; A242-Y248 WeakPolarHBondContact CB-OH 3.4Å; S244-Y248 WeakPolarHBondContact O-CD1 3.23Å; S244-Y248 VanDerWaalsContact O-CE1 3.22Å; S244-Y248 WeakPolarHBondContact O-CE1 3.5Å; L245-Y248 HydrophobicContact CD1-CD2 4.13Å; L245-Y248 HydrophobicContact CD1-CE2 3.47Å; L245-Y248 VanDerWaalsContact CD1-CE2 3.47Å; L245-Y248 PolarHBondContact O-N 3.29Å; S246-Y248 VanDerWaalsContact C-N 3.29Å; S246-Y248 PolarHBondContact O-N 3.25Å; Y248-Q251 VanDerWaalsContact C-OE1 3.29Å; Y248-Q251 PolarHBondContact O-N 2.95Å; Y248-Q251 PolarHBondContact O-OE1 3.32Å; Y248-L252 HydrophobicContact CD2-CB 4.28Å; Y248-L252 HydrophobicContact CD2-CD2 4.29Å; Y248-L252 HydrophobicContact CE2-CD2 3.92Å; Y248-L252 PolarHBondContact O-N 3.02Å
249H98.3Very high96.7Very high13 Ų1326 Ų266%0.0613%0.132CC..Hα-helixtrans-55.7-47.2-176.8175.4-98.5000113.4L245 Q251 L252 A253 M288 E292L245-H249 HydrophobicContact CD1-CB 4.16Å; L245-H249 HydrophobicContact CG-CB 4.09Å; L245-H249 WeakPolarHBondContact O-CA 3.22Å; L245-H249 VanDerWaalsContact O-CB 3.23Å; L245-H249 WeakPolarHBondContact O-CB 3.27Å; L245-H249 PolarHBondContact O-N 3.32Å; H249-Q251 VanDerWaalsContact C-N 3.3Å; H249-Q251 PolarHBondContact O-N 3.01Å; H249-L252 PolarHBondContact O-N 3.31Å; H249-L252 VanDerWaalsContact O-N 3.14Å; H249-A253 WeakPolarHBondContact O-CB 3.17Å; H249-A253 PolarHBondContact O-N 3.19Å; H249-M288 HydrophobicContact CB-SD 4.35Å; H249-M288 PolarHBondContact CE1-O 3.44Å; H249-M288 VanDerWaalsContact CE1-O 3.26Å; H249-M288 PolarHBondContact NE2-O 2.97Å; H249-E292 IonicContact NE2-OE2 2.74Å
250P98.1Very high96.6Very high65 Ų6526.2 Ų26.242%0.42213%0.133SC..Hα-helixtrans-58.2-41.1-179.8-24.635.2000113.1Y254P250-Y254 WeakPolarHBondContact O-CB 3.5Å; P250-Y254 PolarHBondContact O-N 3.47Å
251Q98.4Very high96.5Very high46 Ų4631.8 Ų31.822%0.21516%0.159CC..Hα-helixtrans-69.5-36.7179.1-62.275.47.300111.2A207 L210 E211 Y248 H249 C255A207-Q251 HydrophobicContact CB-CG 4.44Å; L210-Q251 HydrophobicContact CB-CB 3.71Å; L210-Q251 HydrophobicContact CD1-CB 4.42Å; E211-Q251 HydrophobicContact CG-CB 4.5Å; E211-Q251 HydrophobicContact CG-CG 3.62Å; Y248-Q251 VanDerWaalsContact C-OE1 3.29Å; Y248-Q251 PolarHBondContact O-N 2.95Å; Y248-Q251 PolarHBondContact O-OE1 3.32Å; H249-Q251 VanDerWaalsContact C-N 3.3Å; H249-Q251 PolarHBondContact O-N 3.01Å; Q251-C255 PolarHBondContact O-N 3.36Å; Q251-C255 VanDerWaalsContact O-N 3.11Å; Q251-C255 PolarHBondContact O-SG 3.38Å
252L98.7Very high96.5Very high0 Ų029.6 Ų29.60%015%0.149CC..Hα-helixtrans-67.9-50176.4-177.354.7000111.6L210 L236 L239 H240 L245 Y248 H249 Y254 C255 I256L210-L252 HydrophobicContact CD1-CB 3.91Å; L210-L252 HydrophobicContact CD1-CD1 4.41Å; L210-L252 HydrophobicContact CD2-CD1 4.13Å; L236-L252 HydrophobicContact CB-CD1 4.09Å; L236-L252 HydrophobicContact CD2-CD1 3.99Å; L239-L252 HydrophobicContact CB-CD1 4.31Å; L239-L252 HydrophobicContact CB-CD2 3.63Å; L239-L252 HydrophobicContact CD1-CD1 4.07Å; H240-L252 WeakPolarHBondContact CE1-CD2 2.85Å; H240-L252 VanDerWaalsContact NE2-CD2 3.29Å; H240-L252 WeakPolarHBondContact NE2-CD2 3.31Å; L245-L252 HydrophobicContact CD1-CD2 4Å; Y248-L252 HydrophobicContact CD2-CB 4.28Å; Y248-L252 HydrophobicContact CD2-CD2 4.29Å; Y248-L252 HydrophobicContact CE2-CD2 3.92Å; Y248-L252 PolarHBondContact O-N 3.02Å; H249-L252 PolarHBondContact O-N 3.31Å; H249-L252 VanDerWaalsContact O-N 3.14Å; L252-Y254 VanDerWaalsContact C-N 3.28Å; L252-Y254 PolarHBondContact O-N 2.9Å; L252-C255 WeakPolarHBondContact O-CA 3.32Å; L252-C255 WeakPolarHBondContact O-CB 3.33Å; L252-C255 PolarHBondContact O-N 3.26Å; L252-I256 HydrophobicContact CD1-CG1 4.48Å; L252-I256 WeakPolarHBondContact O-CG1 3.25Å; L252-I256 PolarHBondContact O-N 2.97Å
253A98.5Very high96.6Very high1 Ų130.7 Ų30.71%0.00815%0.154CC..Hα-helixtrans-55.5-45.3176.600000110.8H249 C255 I256 V257 E292H249-A253 WeakPolarHBondContact O-CB 3.17Å; H249-A253 PolarHBondContact O-N 3.19Å; A253-C255 VanDerWaalsContact C-N 3.34Å; A253-C255 PolarHBondContact O-N 3.02Å; A253-I256 PolarHBondContact O-N 2.93Å; A253-I256 VanDerWaalsContact O-N 3.12Å; A253-V257 WeakPolarHBondContact O-CG2 3.22Å; A253-V257 PolarHBondContact O-N 3.43Å; A253-E292 HydrophobicContact CB-CB 4.26Å; A253-E292 HydrophobicContact CB-CG 3.86Å
254Y98.3Very high96.9Very high64 Ų6426.4 Ų26.425%0.25114%0.139SC..Hα-helixtrans-55.7-46.7172.9177.2-106.5000112.2P250 L252 I256 V257 Q258 F494P250-Y254 WeakPolarHBondContact O-CB 3.5Å; P250-Y254 PolarHBondContact O-N 3.47Å; L252-Y254 VanDerWaalsContact C-N 3.28Å; L252-Y254 PolarHBondContact O-N 2.9Å; Y254-I256 VanDerWaalsContact C-N 3.32Å; Y254-I256 PolarHBondContact O-N 3.12Å; Y254-V257 PolarHBondContact O-N 3.37Å; Y254-Q258 HydrophobicContact CD1-CG 4.21Å; Y254-Q258 HydrophobicContact CD2-CG 4.07Å; Y254-Q258 HydrophobicContact CE1-CG 3.86Å; Y254-Q258 HydrophobicContact CE2-CG 3.71Å; Y254-Q258 HydrophobicContact CG-CG 4.32Å; Y254-Q258 WeakPolarHBondContact O-CB 3.47Å; Y254-Q258 WeakPolarHBondContact O-CG 3.44Å; Y254-Q258 PolarHBondContact O-N 3.26Å; Y254-Q258 PolarHBondContact OH-NE2 3.45Å; Y254-F494 HydrophobicContact CE1-CE1 4.42Å
255C98.6Very high97.1Very high0 Ų028.4 Ų28.40%015%0.153CC..Hα-helixtrans-60.9-40.2177.1-69.50000112.8L210 G214 I217 L236 Q251 L252 A253 F259L210-C255 PolarHBondContact O-SG 2.77Å; G214-C255 PolarHBondContact N-SG 3.41Å; I217-C255 HydrophobicContact CD1-CB 3.81Å; L236-C255 HydrophobicContact CD1-CB 4.05Å; Q251-C255 PolarHBondContact O-N 3.36Å; Q251-C255 VanDerWaalsContact O-N 3.11Å; Q251-C255 PolarHBondContact O-SG 3.38Å; L252-C255 WeakPolarHBondContact O-CA 3.32Å; L252-C255 WeakPolarHBondContact O-CB 3.33Å; L252-C255 PolarHBondContact O-N 3.26Å; A253-C255 VanDerWaalsContact C-N 3.34Å; A253-C255 PolarHBondContact O-N 3.02Å; C255-F259 WeakPolarHBondContact O-CD2 3.46Å; C255-F259 PolarHBondContact O-N 2.96Å
256I98.6Very high97.2Very high0 Ų028.6 Ų28.60%015%0.154CC..Hα-helixtrans-64.7-51.8178.3-63.9-61.2000110.4L232 L236 L237 L252 A253 Y254 Q258 F259 L260 V270 E292 I296L232-I256 HydrophobicContact CD1-CD1 3.41Å; L232-I256 VanDerWaalsContact CD1-CD1 3.41Å; L236-I256 HydrophobicContact CB-CD1 3.78Å; L236-I256 HydrophobicContact CD1-CD1 4.32Å; L237-I256 HydrophobicContact CD2-CD1 4.33Å; L252-I256 HydrophobicContact CD1-CG1 4.48Å; L252-I256 WeakPolarHBondContact O-CG1 3.25Å; L252-I256 PolarHBondContact O-N 2.97Å; A253-I256 PolarHBondContact O-N 2.93Å; A253-I256 VanDerWaalsContact O-N 3.12Å; Y254-I256 VanDerWaalsContact C-N 3.32Å; Y254-I256 PolarHBondContact O-N 3.12Å; I256-Q258 VanDerWaalsContact C-N 3.3Å; I256-Q258 PolarHBondContact O-N 3.01Å; I256-F259 WeakPolarHBondContact O-CB 3.42Å; I256-F259 PolarHBondContact O-N 2.98Å; I256-L260 PolarHBondContact O-N 2.91Å; I256-L260 VanDerWaalsContact O-N 3.17Å; I256-V270 HydrophobicContact CG2-CG1 3.56Å; I256-E292 WeakPolarHBondContact CG1-OE1 3.47Å; I256-I296 HydrophobicContact CG2-CD1 3.97Å; I256-I296 HydrophobicContact CG2-CG1 4.36Å
257V97.9Very high97.3Very high16 Ų1627.9 Ų27.910%0.09715%0.149CC..Hα-helixtrans-58-43.7178.9173.10000110.9A253 Y254 F259 L260 E261 E295 I296 V299A253-V257 WeakPolarHBondContact O-CG2 3.22Å; A253-V257 PolarHBondContact O-N 3.43Å; Y254-V257 PolarHBondContact O-N 3.37Å; V257-F259 VanDerWaalsContact C-N 3.26Å; V257-F259 PolarHBondContact O-N 2.87Å; V257-L260 PolarHBondContact O-N 3.33Å; V257-E261 PolarHBondContact O-N 3.18Å; V257-E295 HydrophobicContact CG2-CB 4Å; V257-I296 HydrophobicContact CG2-CG1 4.35Å; V257-V299 HydrophobicContact CG1-CG1 4.12Å; V257-V299 HydrophobicContact CG1-CG2 4.18Å
258Q97.6Very high97.5Very high13 Ų1328.4 Ų28.46%0.06115%0.147CC..Hα-helixtrans-61.3-32.1177-69.2-68.166.900113.2I217 Y254 I256 E261 K262I217-Q258 HydrophobicContact CG2-CB 3.89Å; Y254-Q258 HydrophobicContact CD1-CG 4.21Å; Y254-Q258 HydrophobicContact CD2-CG 4.07Å; Y254-Q258 HydrophobicContact CE1-CG 3.86Å; Y254-Q258 HydrophobicContact CE2-CG 3.71Å; Y254-Q258 HydrophobicContact CG-CG 4.32Å; Y254-Q258 WeakPolarHBondContact O-CB 3.47Å; Y254-Q258 WeakPolarHBondContact O-CG 3.44Å; Y254-Q258 PolarHBondContact O-N 3.26Å; Y254-Q258 PolarHBondContact OH-NE2 3.45Å; I256-Q258 VanDerWaalsContact C-N 3.3Å; I256-Q258 PolarHBondContact O-N 3.01Å; Q258-E261 PolarHBondContact OE1-OE2 2.77Å; Q258-K262 VanDerWaalsContact O-CG 3.23Å; Q258-K262 WeakPolarHBondContact O-CG 3.23Å; Q258-K262 PolarHBondContact O-N 3.28Å
259F97.6Very high97.5Very high0 Ų033.2 Ų33.20%017%0.17CC..Hα-helixtrans-68.7-40.4173.1-101.6-71.3000112.2I217 F220 L224 H228 F231 L232 L236 C255 I256 V257 K262 D263 L266I217-F259 HydrophobicContact CB-CE2 4.48Å; I217-F259 HydrophobicContact CD1-CD2 3.77Å; I217-F259 HydrophobicContact CD1-CE2 3.47Å; I217-F259 VanDerWaalsContact CD1-CE2 3.47Å; I217-F259 HydrophobicContact CD1-CZ 4.46Å; I217-F259 HydrophobicContact CG1-CD2 4.11Å; I217-F259 HydrophobicContact CG1-CE2 3.6Å; I217-F259 HydrophobicContact CG1-CZ 4.13Å; I217-F259 HydrophobicContact CG2-CD1 4.44Å; I217-F259 HydrophobicContact CG2-CD2 3.79Å; I217-F259 HydrophobicContact CG2-CE2 4Å; I217-F259 HydrophobicContact CG2-CG 4.04Å; I217-F259 HydrophobicContact CG2-CZ 4.42Å; F220-F259 HydrophobicContact CD2-CE1 4.32Å; F220-F259 HydrophobicContact CD2-CZ 4.39Å; F220-F259 HydrophobicContact CE2-CE1 4.1Å; F220-F259 AromaticContact CE2-CZ 3.75Å; F220-F259 HydrophobicContact CE2-CZ 3.75Å; L224-F259 HydrophobicContact CD1-CD1 3.97Å; L224-F259 HydrophobicContact CD1-CE1 4.21Å; H228-F259 HydrophobicContact CB-CE1 4.02Å; H228-F259 HydrophobicContact CB-CZ 4.18Å; H228-F259 WeakPolarHBondContact O-CZ 3.24Å; F231-F259 AromaticContact CD1-CE2 3.97Å; F231-F259 HydrophobicContact CD1-CE2 3.97Å; F231-F259 HydrophobicContact CD1-CZ 4Å; F231-F259 HydrophobicContact CE1-CE2 4.21Å; L232-F259 HydrophobicContact CB-CD1 4.4Å; L232-F259 HydrophobicContact CB-CD2 4.24Å; L232-F259 HydrophobicContact CB-CE1 4.32Å; L232-F259 HydrophobicContact CB-CE2 4.15Å; L232-F259 HydrophobicContact CB-CG 4.35Å; L232-F259 HydrophobicContact CB-CZ 4.19Å; L232-F259 HydrophobicContact CD1-CB 4.12Å; L232-F259 HydrophobicContact CD1-CD2 3.86Å; L232-F259 HydrophobicContact CD1-CE2 4.47Å; L232-F259 HydrophobicContact CD1-CG 4.05Å; L232-F259 HydrophobicContact CD2-CB 4.01Å; L232-F259 HydrophobicContact CD2-CD1 4.15Å; L232-F259 HydrophobicContact CD2-CG 4.02Å; L232-F259 HydrophobicContact CG-CD2 4.45Å; L232-F259 HydrophobicContact CG-CG 4.37Å; L236-F259 HydrophobicContact CD1-CD2 3.83Å; L236-F259 HydrophobicContact CD1-CE2 3.65Å; C255-F259 WeakPolarHBondContact O-CD2 3.46Å; C255-F259 PolarHBondContact O-N 2.96Å; I256-F259 WeakPolarHBondContact O-CB 3.42Å; I256-F259 PolarHBondContact O-N 2.98Å; V257-F259 VanDerWaalsContact C-N 3.26Å; V257-F259 PolarHBondContact O-N 2.87Å; F259-K262 PolarHBondContact O-N 3.32Å; F259-D263 PolarHBondContact O-N 3.25Å; F259-L266 HydrophobicContact CD1-CD1 4.44Å
260L97.3Very high97.5Very high5 Ų532.6 Ų32.63%0.02617%0.167CC..Hα-helixtrans-70.3-37.6-178.8-60.6-173.7000112.1I256 V257 K262 D263 L266 T267 V270 I296 V299I256-L260 PolarHBondContact O-N 2.91Å; I256-L260 VanDerWaalsContact O-N 3.17Å; V257-L260 PolarHBondContact O-N 3.33Å; L260-K262 PolarHBondContact O-N 2.99Å; L260-D263 CarbonylContact O-C 3.59Å; L260-D263 PolarHBondContact O-N 2.7Å; L260-L266 HydrophobicContact CD2-CB 4.1Å; L260-T267 HydrophobicContact CD1-CG2 4.31Å; L260-V270 HydrophobicContact CD1-CG1 4.39Å; L260-V270 HydrophobicContact CD2-CB 4.28Å; L260-V270 HydrophobicContact CD2-CG2 3.97Å; L260-I296 HydrophobicContact CD1-CB 4.27Å; L260-I296 HydrophobicContact CD1-CD1 4.48Å; L260-I296 HydrophobicContact CD1-CG1 3.95Å; L260-I296 HydrophobicContact CD1-CG2 3.59Å; L260-V299 HydrophobicContact CB-CG2 4.4Å
261E96.1Very high97.5Very high116 Ų11629.6 Ų29.654%0.54215%0.147SC..Hα-helixtrans-61.2-29.9172.3-71.5-165.3162.800112.5V257 Q258 V299V257-E261 PolarHBondContact O-N 3.18Å; Q258-E261 PolarHBondContact OE1-OE2 2.77Å; E261-V299 HydrophobicContact CG-CB 4.41Å; E261-V299 HydrophobicContact CG-CG1 4.16Å
262K94.8Very high97.5Very high52 Ų5230.5 Ų30.523%0.22615%0.153CC..Hα-helixtrans-81.1-37.8178.6-66.9-66.4-177.5-168.10113.1N218 L222 L224 Q258 F259 L260N218-K262 WeakPolarHBondContact O-CE 3.43Å; N218-K262 PolarHBondContact O-NZ 3.39Å; N218-K262 PolarHBondContact OD1-NZ 3.06Å; L222-K262 HydrophobicContact CD2-CB 4.08Å; L222-K262 HydrophobicContact CD2-CD 4.39Å; L222-K262 VanDerWaalsContact CD2-O 3.31Å; L222-K262 WeakPolarHBondContact CD2-O 3.47Å; L224-K262 HydrophobicContact CD1-CB 4.2Å; L224-K262 HydrophobicContact CD2-CB 4.29Å; L224-K262 HydrophobicContact CG-CB 4.43Å; Q258-K262 VanDerWaalsContact O-CG 3.23Å; Q258-K262 WeakPolarHBondContact O-CG 3.23Å; Q258-K262 PolarHBondContact O-N 3.28Å; F259-K262 PolarHBondContact O-N 3.32Å; L260-K262 PolarHBondContact O-N 2.99Å
263D96Very high97.5Very high28 Ų2831 Ų3115%0.1516%0.159CC..  trans-14791.7-179.2-173.4-4.7000110.5L224 K229 F259 L260 S265 L266L224-D263 HydrophobicContact CD1-CB 3.54Å; L224-D263 HydrophobicContact CG-CB 4.23Å; K229-D263 VanDerWaalsContact CE-OD2 3.23Å; K229-D263 WeakPolarHBondContact CE-OD2 3.47Å; K229-D263 IonicContact NZ-OD2 3.84Å; K229-D263 PolarHBondContact NZ-OD2 2.87Å; F259-D263 PolarHBondContact O-N 3.25Å; L260-D263 CarbonylContact O-C 3.59Å; L260-D263 PolarHBondContact O-N 2.7Å; D263-S265 VanDerWaalsContact CG-OG 3.31Å; D263-S265 PolarHBondContact O-N 3.33Å; D263-S265 VanDerWaalsContact O-N 3.07Å; D263-S265 WeakPolarHBondContact OD1-CB 3.16Å; D263-S265 PolarHBondContact OD1-N 3.23Å; D263-S265 PolarHBondContact OD1-OG 3.39Å; D263-S265 PolarHBondContact OD2-OG 3.33Å; D263-L266 HydrophobicContact CB-CD1 3.97Å; D263-L266 HydrophobicContact CB-CG 4.23Å; D263-L266 WeakPolarHBondContact O-CB 3.49Å; D263-L266 PolarHBondContact O-N 3.38Å; D263-L266 VanDerWaalsContact O-N 3.16Å
264P96.4Very high97.5Very high33 Ų3331 Ų3121%0.21416%0.158CC..G310 helixtrans-58.6-22.6-178.7-27.535.6000114.1L266 T267 E301 E304P264-L266 PolarHBondContact O-N 2.94Å; P264-T267 VanDerWaalsContact O-CB 3.31Å; P264-T267 WeakPolarHBondContact O-CB 3.18Å; P264-T267 PolarHBondContact O-N 3.19Å; P264-T267 PolarHBondContact O-OG1 2.93Å; P264-E301 HydrophobicContact CB-CG 4.22Å; P264-E301 HydrophobicContact CG-CG 4.4Å; P264-E304 HydrophobicContact CB-CG 4.44Å
265S96.1Very high97.5Very high59 Ų5929.3 Ų29.341%0.41315%0.154SC..G310 helixtrans-63.6-15.1179.374.70000113.8D263 T267D263-S265 VanDerWaalsContact CG-OG 3.31Å; D263-S265 PolarHBondContact O-N 3.33Å; D263-S265 VanDerWaalsContact O-N 3.07Å; D263-S265 WeakPolarHBondContact OD1-CB 3.16Å; D263-S265 PolarHBondContact OD1-N 3.23Å; D263-S265 PolarHBondContact OD1-OG 3.39Å; D263-S265 PolarHBondContact OD2-OG 3.33Å; S265-T267 VanDerWaalsContact C-N 3.34Å
266L97.3Very high97.4Very high4 Ų436.9 Ų36.92%0.02119%0.187CC..G310 helixtrans-81.1-14.4177-60.9174.8000112.9L224 K229 L232 F259 L260 D263 P264 E268 Q269 V270L224-L266 HydrophobicContact CD1-CD1 3.99Å; K229-L266 HydrophobicContact CD-CD2 4.06Å; K229-L266 HydrophobicContact CG-CD1 4.36Å; K229-L266 HydrophobicContact CG-CD2 4.19Å; L232-L266 HydrophobicContact CD2-CB 4.17Å; L232-L266 HydrophobicContact CD2-CD1 3.79Å; L232-L266 HydrophobicContact CD2-CG 4.47Å; F259-L266 HydrophobicContact CD1-CD1 4.44Å; L260-L266 HydrophobicContact CD2-CB 4.1Å; D263-L266 HydrophobicContact CB-CD1 3.97Å; D263-L266 HydrophobicContact CB-CG 4.23Å; D263-L266 WeakPolarHBondContact O-CB 3.49Å; D263-L266 PolarHBondContact O-N 3.38Å; D263-L266 VanDerWaalsContact O-N 3.16Å; P264-L266 PolarHBondContact O-N 2.94Å; L266-E268 VanDerWaalsContact C-N 3.35Å; L266-E268 PolarHBondContact O-N 2.87Å; L266-Q269 PolarHBondContact O-N 3.18Å; L266-Q269 VanDerWaalsContact O-N 3.13Å; L266-V270 PolarHBondContact O-N 3.35Å
267T97.8Very high97.3Very high3 Ų340 Ų402%0.01820%0.199CC..Hα-helixtrans-57.9-44.4-172.5-52.70000112.5L260 P264 S265 Q269 V270 V271 I296 I300L260-T267 HydrophobicContact CD1-CG2 4.31Å; P264-T267 VanDerWaalsContact O-CB 3.31Å; P264-T267 WeakPolarHBondContact O-CB 3.18Å; P264-T267 PolarHBondContact O-N 3.19Å; P264-T267 PolarHBondContact O-OG1 2.93Å; S265-T267 VanDerWaalsContact C-N 3.34Å; T267-Q269 VanDerWaalsContact C-N 3.29Å; T267-Q269 PolarHBondContact O-N 3.01Å; T267-V270 PolarHBondContact O-N 2.9Å; T267-V271 HydrophobicContact CG2-CG2 3.96Å; T267-V271 WeakPolarHBondContact O-CG2 3.46Å; T267-V271 PolarHBondContact O-N 2.86Å; T267-I296 HydrophobicContact CG2-CG2 4.29Å; T267-I300 HydrophobicContact CG2-CD1 3.5Å; T267-I300 VanDerWaalsContact CG2-CD1 3.5Å; T267-I300 HydrophobicContact CG2-CG1 3.83Å
268E97.8Very high97.3Very high76 Ų7640 Ų4036%0.35520%0.197SC..Hα-helixtrans-57-43.6179.2-176.6-177.7178.800112.2L266 N272 K307 V308L266-E268 VanDerWaalsContact C-N 3.35Å; L266-E268 PolarHBondContact O-N 2.87Å; E268-N272 VanDerWaalsContact O-CB 3.27Å; E268-N272 WeakPolarHBondContact O-CB 3.38Å; E268-N272 VanDerWaalsContact O-CG 3.28Å; E268-N272 PolarHBondContact O-N 3.46Å; E268-N272 VanDerWaalsContact O-N 3.1Å; E268-N272 PolarHBondContact O-ND2 3.42Å; E268-K307 HydrophobicContact CB-CD 4.48Å; E268-K307 HydrophobicContact CG-CB 4.24Å; E268-K307 VanDerWaalsContact OE2-CD 3.28Å; E268-K307 WeakPolarHBondContact OE2-CD 3.49Å; E268-V308 HydrophobicContact CB-CG1 4.19Å; E268-V308 HydrophobicContact CG-CG1 4.11Å
269Q97.9Very high97.3Very high104 Ų10440 Ų4049%0.48620%0.199SC..Hα-helixtrans-71.7-37.6-179.1-66.8-178.375.900111.9L233 L266 T267 G273L233-Q269 VanDerWaalsContact CD1-OE1 3.26Å; L233-Q269 HydrophobicContact CD2-CB 3.86Å; L266-Q269 PolarHBondContact O-N 3.18Å; L266-Q269 VanDerWaalsContact O-N 3.13Å; T267-Q269 VanDerWaalsContact C-N 3.29Å; T267-Q269 PolarHBondContact O-N 3.01Å; Q269-G273 PolarHBondContact O-N 3.04Å
270V98.5Very high97.1Very high0 Ų049.3 Ų49.30%024%0.239CC..Hα-helixtrans-65.8-52.3177.5167.80000111L232 L237 I256 L260 L266 T267 N272 G273 L274 I296L232-V270 HydrophobicContact CD1-CG2 4.24Å; L232-V270 HydrophobicContact CD2-CG2 3.8Å; L232-V270 HydrophobicContact CG-CG2 4.18Å; L237-V270 HydrophobicContact CD2-CG1 4.15Å; I256-V270 HydrophobicContact CG2-CG1 3.56Å; L260-V270 HydrophobicContact CD1-CG1 4.39Å; L260-V270 HydrophobicContact CD2-CB 4.28Å; L260-V270 HydrophobicContact CD2-CG2 3.97Å; L266-V270 PolarHBondContact O-N 3.35Å; T267-V270 PolarHBondContact O-N 2.9Å; V270-N272 PolarHBondContact O-N 3.1Å; V270-G273 CarbonylContact O-C 3.36Å; V270-G273 WeakPolarHBondContact O-CA 3.32Å; V270-G273 PolarHBondContact O-N 3.01Å; V270-L274 HydrophobicContact CG1-CD1 4.41Å; V270-L274 PolarHBondContact O-N 2.99Å; V270-I296 HydrophobicContact CG1-CD1 4.09Å
271V98.4Very high96.8Very high2 Ų256 Ų561%0.01228%0.28CS..Hα-helixtrans-61.7-45.6-179.6174.60000110.6T267 G273 L274 L275 L293 I296 V308T267-V271 HydrophobicContact CG2-CG2 3.96Å; T267-V271 WeakPolarHBondContact O-CG2 3.46Å; T267-V271 PolarHBondContact O-N 2.86Å; V271-G273 PolarHBondContact O-N 2.86Å; V271-L274 PolarHBondContact O-N 3.36Å; V271-L275 HydrophobicContact CG1-CD1 4.02Å; V271-L275 HydrophobicContact CG1-CG 4.33Å; V271-L275 WeakPolarHBondContact O-CB 3.36Å; V271-L275 VanDerWaalsContact O-CG 3.27Å; V271-L275 WeakPolarHBondContact O-CG 3.44Å; V271-L275 PolarHBondContact O-N 2.96Å; V271-L293 HydrophobicContact CG1-CD2 4.3Å; V271-L293 HydrophobicContact CG2-CD2 4.45Å; V271-I296 HydrophobicContact CG2-CG2 4.04Å; V271-V308 HydrophobicContact CB-CB 4.29Å; V271-V308 HydrophobicContact CB-CG1 3.99Å; V271-V308 HydrophobicContact CG1-CB 3.92Å; V271-V308 HydrophobicContact CG1-CG1 4.14Å; V271-V308 HydrophobicContact CG1-CG2 4.35Å
272N98Very high96.7Very high64 Ų6454.4 Ų54.434%0.34227%0.272SS..Hα-helixtrans-63.1-32.5175.2-75.2-41.2000112.5E268 V270 K276E268-N272 VanDerWaalsContact O-CB 3.27Å; E268-N272 WeakPolarHBondContact O-CB 3.38Å; E268-N272 VanDerWaalsContact O-CG 3.28Å; E268-N272 PolarHBondContact O-N 3.46Å; E268-N272 VanDerWaalsContact O-N 3.1Å; E268-N272 PolarHBondContact O-ND2 3.42Å; V270-N272 PolarHBondContact O-N 3.1Å; N272-K276 VanDerWaalsContact O-CB 3.31Å; N272-K276 WeakPolarHBondContact O-CB 3.45Å; N272-K276 PolarHBondContact O-N 3.04Å
273G98Very high96.7Very high11 Ų1153.8 Ų53.811%0.11327%0.274CS..Hα-helixtrans-64.4-47.8172.900000112.9Q269 V270 V271 K276 Y277Q269-G273 PolarHBondContact O-N 3.04Å; V270-G273 CarbonylContact O-C 3.36Å; V270-G273 WeakPolarHBondContact O-CA 3.32Å; V270-G273 PolarHBondContact O-N 3.01Å; V271-G273 PolarHBondContact O-N 2.86Å; G273-K276 WeakPolarHBondContact O-CB 3.34Å; G273-K276 PolarHBondContact O-N 3.14Å; G273-Y277 WeakPolarHBondContact O-CD2 3.47Å; G273-Y277 PolarHBondContact O-N 3.22Å; G273-Y277 VanDerWaalsContact O-N 3.11Å
274L98.4Very high96.6Very high0 Ų055.3 Ų55.30%029%0.287CS..Hα-helixtrans-62.1-46.2175.4-69.6176.2000111.2L237 V270 V271 K276 Y277 W278 F289 E292 L293 I296L237-L274 HydrophobicContact CD2-CD2 4.31Å; L237-L274 HydrophobicContact CD2-CG 4.33Å; V270-L274 HydrophobicContact CG1-CD1 4.41Å; V270-L274 PolarHBondContact O-N 2.99Å; V271-L274 PolarHBondContact O-N 3.36Å; L274-K276 PolarHBondContact O-N 3.11Å; L274-Y277 CarbonylContact O-C 3.57Å; L274-Y277 PolarHBondContact O-N 3.19Å; L274-W278 PolarHBondContact O-N 3.29Å; L274-F289 HydrophobicContact CB-CD1 4.48Å; L274-F289 HydrophobicContact CD2-CD1 4.45Å; L274-F289 HydrophobicContact CD2-CE1 4.23Å; L274-F289 WeakPolarHBondContact O-CE1 3.46Å; L274-E292 HydrophobicContact CD1-CG 4.43Å; L274-L293 HydrophobicContact CD1-CD2 3.98Å; L274-L293 HydrophobicContact CD1-CG 4.4Å; L274-I296 HydrophobicContact CD1-CD1 3.46Å; L274-I296 VanDerWaalsContact CD1-CD1 3.46Å
275L98Very high96.6Very high30 Ų3054.5 Ų54.516%0.15728%0.28CS..Hα-helixtrans-61.4-33176.4-67.9177.6000112.6V271 W278 P311 Q315V271-L275 HydrophobicContact CG1-CD1 4.02Å; V271-L275 HydrophobicContact CG1-CG 4.33Å; V271-L275 WeakPolarHBondContact O-CB 3.36Å; V271-L275 VanDerWaalsContact O-CG 3.27Å; V271-L275 WeakPolarHBondContact O-CG 3.44Å; V271-L275 PolarHBondContact O-N 2.96Å; L275-W278 HydrophobicContact CD2-CE3 4.08Å; L275-W278 HydrophobicContact CD2-CZ3 4.32Å; L275-W278 WeakPolarHBondContact O-CB 3.46Å; L275-P311 HydrophobicContact CD1-CB 3.87Å; L275-P311 HydrophobicContact CD1-CG 4.35Å; L275-Q315 HydrophobicContact CD2-CB 3.68Å; L275-Q315 HydrophobicContact CD2-CG 3.8Å
276K97.6Very high96.6Very high159 Ų15953.3 Ų53.369%0.69127%0.268SS*.Hα-helixtrans-67.8-37173.9179.2-175.8176.9-174.70112.3N272 G273 L274 W278N272-K276 VanDerWaalsContact O-CB 3.31Å; N272-K276 WeakPolarHBondContact O-CB 3.45Å; N272-K276 PolarHBondContact O-N 3.04Å; G273-K276 WeakPolarHBondContact O-CB 3.34Å; G273-K276 PolarHBondContact O-N 3.14Å; L274-K276 PolarHBondContact O-N 3.11Å; K276-W278 VanDerWaalsContact C-N 3.32Å
277Y97Very high96.7Very high64 Ų6454.6 Ų54.625%0.25128%0.276SS..THydrogen-bonded Turntrans-92.310.8179.8-60.3-38.3000113.9L237 K241 G273 L274L237-Y277 HydrophobicContact CB-CE2 4.47Å; K241-Y277 HydrophobicContact CD-CD1 4.21Å; K241-Y277 HydrophobicContact CD-CE1 3.93Å; K241-Y277 HydrophobicContact CG-CD1 3.96Å; K241-Y277 HydrophobicContact CG-CD2 4.31Å; K241-Y277 HydrophobicContact CG-CE1 4.18Å; K241-Y277 HydrophobicContact CG-CG 4.05Å; G273-Y277 WeakPolarHBondContact O-CD2 3.47Å; G273-Y277 PolarHBondContact O-N 3.22Å; G273-Y277 VanDerWaalsContact O-N 3.11Å; L274-Y277 CarbonylContact O-C 3.57Å; L274-Y277 PolarHBondContact O-N 3.19Å
278W97.5Very high96.6Very high17 Ų1755.5 Ų55.56%0.06428%0.28CS..  trans-51.3123.9-176.4-160.4-89.5000112.4L274 L275 K276 K280 E286 F289 L290 L293 Q315 C319L274-W278 PolarHBondContact O-N 3.29Å; L275-W278 HydrophobicContact CD2-CE3 4.08Å; L275-W278 HydrophobicContact CD2-CZ3 4.32Å; L275-W278 WeakPolarHBondContact O-CB 3.46Å; K276-W278 VanDerWaalsContact C-N 3.32Å; W278-K280 PolarHBondContact O-N 3.3Å; W278-E286 HydrophobicContact CZ2-CG 3.92Å; W278-E286 PolarHBondContact NE1-OE1 2.79Å; W278-F289 HydrophobicContact CD2-CD1 4.45Å; W278-F289 HydrophobicContact CE3-CB 4.23Å; W278-F289 AromaticContact CE3-CD1 3.77Å; W278-F289 HydrophobicContact CE3-CD1 3.77Å; W278-F289 HydrophobicContact CE3-CG 4.44Å; W278-F289 HydrophobicContact CH2-CB 3.86Å; W278-F289 HydrophobicContact CZ2-CB 4.43Å; W278-F289 HydrophobicContact CZ3-CB 3.73Å; W278-F289 AromaticContact CZ3-CD1 3.99Å; W278-F289 HydrophobicContact CZ3-CD1 3.99Å; W278-F289 HydrophobicContact CZ3-CG 4.37Å; W278-L290 HydrophobicContact CH2-CD2 3.85Å; W278-L290 HydrophobicContact CH2-CG 4.02Å; W278-L290 HydrophobicContact CZ2-CD2 4.05Å; W278-L290 HydrophobicContact CZ2-CG 4.07Å; W278-L293 HydrophobicContact CH2-CD1 3.73Å; W278-L293 HydrophobicContact CZ3-CD1 3.36Å; W278-L293 HydrophobicContact CZ3-CG 4.36Å; W278-Q315 VanDerWaalsContact CD1-NE2 3.32Å; W278-Q315 HydrophobicContact CD2-CG 3.73Å; W278-Q315 HydrophobicContact CE3-CG 4.07Å; W278-Q315 HydrophobicContact CG-CG 4.2Å; W278-Q315 HydrophobicContact CH2-CG 4.39Å; W278-Q315 HydrophobicContact CZ2-CG 4.08Å; W278-Q315 HydrophobicContact CZ3-CG 4.4Å; W278-C319 VanDerWaalsContact CZ2-SG 3.5Å
279P96Very high96.7Very high14 Ų1451.9 Ų51.99%0.09126%0.263CS..  trans-62130.6178.7-22.233.6000111.4K285 E286 F289P279-K285 HydrophobicContact CB-CB 3.95Å; P279-K285 HydrophobicContact CG-CB 3.58Å; P279-E286 HydrophobicContact CB-CB 4.44Å; P279-F289 HydrophobicContact CG-CD2 3.8Å; P279-F289 HydrophobicContact CG-CE1 4.48Å; P279-F289 HydrophobicContact CG-CE2 3.7Å; P279-F289 HydrophobicContact CG-CG 4.2Å; P279-F289 HydrophobicContact CG-CZ 4.04Å
280K93.6Very high96.7Very high194 Ų19446.9 Ų46.984%0.84324%0.24SC*.SBendtrans-110.3-14.7178.8-62.3-177.2-176.9177.20114.3W278W278-K280 PolarHBondContact O-N 3.3Å
281V92.6Very high96.6Very high145 Ų14549.6 Ų49.688%0.87925%0.254SS*.SBendtrans-133.29.8-172.6-61.80000112.5
282H92.8Very high96.6Very high84 Ų8449.5 Ų49.539%0.38925%0.254SS..  trans-140.491.9-174.8-163.7-43.9000110.4S284 K285 E286H282-S284 PolarHBondContact O-N 3.31Å; H282-K285 HydrophobicContact CB-CB 4.26Å; H282-K285 HydrophobicContact CB-CD 4.41Å; H282-K285 HydrophobicContact CB-CG 4.43Å; H282-K285 PolarHBondContact ND1-N 3.09Å; H282-K285 PolarHBondContact O-N 2.68Å; H282-E286 PolarHBondContact O-N 2.83Å; H282-E286 VanDerWaalsContact O-N 3.09Å
283S94.5Very high96.6Very high39 Ų3946.5 Ų46.527%0.27324%0.238SC..Hα-helixtrans-61.8-39.4-172.5-44.90000113.4K285 E286 V287 H324S283-K285 PolarHBondContact O-N 3Å; S283-E286 WeakPolarHBondContact O-CA 3.47Å; S283-E286 WeakPolarHBondContact O-CB 3.45Å; S283-E286 PolarHBondContact O-N 3.38Å; S283-V287 PolarHBondContact O-N 3.32Å; S283-H324 WeakPolarHBondContact CB-NE2 3.43Å; S283-H324 PolarHBondContact OG-CD2 2.79Å; S283-H324 VanDerWaalsContact OG-CD2 3.26Å
284S94.5Very high96.6Very high59 Ų5947.5 Ų47.541%0.41324%0.24SC..Hα-helixtrans-59.4-45.9177.2176.20000111.9H282 E286 V287 M288H282-S284 PolarHBondContact O-N 3.31Å; S284-E286 VanDerWaalsContact C-N 3.3Å; S284-E286 PolarHBondContact O-N 3.5Å; S284-V287 WeakPolarHBondContact O-CB 3.25Å; S284-V287 PolarHBondContact O-N 3.33Å; S284-V287 VanDerWaalsContact O-N 3.15Å; S284-M288 WeakPolarHBondContact O-CG 3.38Å; S284-M288 PolarHBondContact O-N 3.44Å; S284-M288 WeakPolarHBondContact OG-CE 3.28Å
285K96.2Very high96.6Very high16 Ų1651.4 Ų51.47%0.0726%0.258CS..Hα-helixtrans-61.7-36.1172-71.3-172.262.6167.40112.9H240 K241 A242 L245 P279 H282 S283 V287 M288 F289H240-K285 PolarHBondContact O-NZ 3.21Å; K241-K285 PolarHBondContact O-NZ 3.18Å; A242-K285 PolarHBondContact O-NZ 3.33Å; L245-K285 HydrophobicContact CB-CD 4.33Å; P279-K285 HydrophobicContact CB-CB 3.95Å; P279-K285 HydrophobicContact CG-CB 3.58Å; H282-K285 HydrophobicContact CB-CB 4.26Å; H282-K285 HydrophobicContact CB-CD 4.41Å; H282-K285 HydrophobicContact CB-CG 4.43Å; H282-K285 PolarHBondContact ND1-N 3.09Å; H282-K285 PolarHBondContact O-N 2.68Å; S283-K285 PolarHBondContact O-N 3Å; K285-V287 VanDerWaalsContact C-N 3.3Å; K285-V287 PolarHBondContact O-N 3.38Å; K285-M288 WeakPolarHBondContact O-CB 3.44Å; K285-M288 PolarHBondContact O-N 3.48Å; K285-F289 WeakPolarHBondContact O-CD2 3.28Å; K285-F289 PolarHBondContact O-N 3.05Å
286E97.2Very high96.6Very high34 Ų3450 Ų5016%0.15925%0.251CS..Hα-helixtrans-63.1-39176-171.4167.2-155.900111.6W278 P279 H282 S283 S284 F289 L290 C319 V327W278-E286 HydrophobicContact CZ2-CG 3.92Å; W278-E286 PolarHBondContact NE1-OE1 2.79Å; P279-E286 HydrophobicContact CB-CB 4.44Å; H282-E286 PolarHBondContact O-N 2.83Å; H282-E286 VanDerWaalsContact O-N 3.09Å; S283-E286 WeakPolarHBondContact O-CA 3.47Å; S283-E286 WeakPolarHBondContact O-CB 3.45Å; S283-E286 PolarHBondContact O-N 3.38Å; S284-E286 VanDerWaalsContact C-N 3.3Å; S284-E286 PolarHBondContact O-N 3.5Å; E286-F289 PolarHBondContact O-N 2.61Å; E286-L290 WeakPolarHBondContact O-CG 3.5Å; E286-L290 PolarHBondContact O-N 3.3Å; E286-C319 PolarHBondContact OE1-SG 3.48Å; E286-V327 HydrophobicContact CB-CG2 4.08Å; E286-V327 VanDerWaalsContact CD-CG1 3.5Å; E286-V327 HydrophobicContact CG-CG1 3.83Å; E286-V327 HydrophobicContact CG-CG2 4.1Å
287V97.5Very high96.6Very high31 Ų3142.6 Ų42.619%0.18822%0.218CC..Hα-helixtrans-63.5-40.3171.8175.70000111.4S283 S284 K285 L290 N291 Q326 V327 R330S283-V287 PolarHBondContact O-N 3.32Å; S284-V287 WeakPolarHBondContact O-CB 3.25Å; S284-V287 PolarHBondContact O-N 3.33Å; S284-V287 VanDerWaalsContact O-N 3.15Å; K285-V287 VanDerWaalsContact C-N 3.3Å; K285-V287 PolarHBondContact O-N 3.38Å; V287-L290 PolarHBondContact O-N 3.42Å; V287-N291 PolarHBondContact O-N 3.25Å; V287-N291 PolarHBondContact O-ND2 3.11Å; V287-Q326 HydrophobicContact CG2-CB 4.15Å; V287-V327 HydrophobicContact CG2-CG2 4.03Å; V287-R330 HydrophobicContact CG1-CB 4.39Å; V287-R330 HydrophobicContact CG1-CG 4.14Å
288M97.6Very high96.6Very high22 Ų2243.4 Ų43.411%0.10823%0.227CC..Hα-helixtrans-61.4-46.7174.8-68.2168.8-172.700112.1H249 S284 K285 L290 N291 E292H249-M288 HydrophobicContact CB-SD 4.35Å; H249-M288 PolarHBondContact CE1-O 3.44Å; H249-M288 VanDerWaalsContact CE1-O 3.26Å; H249-M288 PolarHBondContact NE2-O 2.97Å; S284-M288 WeakPolarHBondContact O-CG 3.38Å; S284-M288 PolarHBondContact O-N 3.44Å; S284-M288 WeakPolarHBondContact OG-CE 3.28Å; K285-M288 WeakPolarHBondContact O-CB 3.44Å; K285-M288 PolarHBondContact O-N 3.48Å; M288-L290 VanDerWaalsContact C-N 3.29Å; M288-L290 PolarHBondContact O-N 3.38Å; M288-N291 WeakPolarHBondContact O-CA 3.46Å; M288-N291 WeakPolarHBondContact O-CB 3.12Å; M288-N291 PolarHBondContact O-N 3.39Å; M288-E292 PolarHBondContact O-N 3.2Å
289F98.4Very high96.6Very high0 Ų045 Ų450%024%0.238CC..Hα-helixtrans-61.9-37.5176-85.5-123.8000112H240 L245 L274 W278 P279 K285 E286 L293H240-F289 HydrophobicContact CB-CE2 4.14Å; H240-F289 HydrophobicContact CB-CZ 3.7Å; L245-F289 HydrophobicContact CD2-CD2 4.26Å; L245-F289 HydrophobicContact CD2-CE2 3.68Å; L274-F289 HydrophobicContact CB-CD1 4.48Å; L274-F289 HydrophobicContact CD2-CD1 4.45Å; L274-F289 HydrophobicContact CD2-CE1 4.23Å; L274-F289 WeakPolarHBondContact O-CE1 3.46Å; W278-F289 HydrophobicContact CD2-CD1 4.45Å; W278-F289 HydrophobicContact CE3-CB 4.23Å; W278-F289 AromaticContact CE3-CD1 3.77Å; W278-F289 HydrophobicContact CE3-CD1 3.77Å; W278-F289 HydrophobicContact CE3-CG 4.44Å; W278-F289 HydrophobicContact CH2-CB 3.86Å; W278-F289 HydrophobicContact CZ2-CB 4.43Å; W278-F289 HydrophobicContact CZ3-CB 3.73Å; W278-F289 AromaticContact CZ3-CD1 3.99Å; W278-F289 HydrophobicContact CZ3-CD1 3.99Å; W278-F289 HydrophobicContact CZ3-CG 4.37Å; P279-F289 HydrophobicContact CG-CD2 3.8Å; P279-F289 HydrophobicContact CG-CE1 4.48Å; P279-F289 HydrophobicContact CG-CE2 3.7Å; P279-F289 HydrophobicContact CG-CG 4.2Å; P279-F289 HydrophobicContact CG-CZ 4.04Å; K285-F289 WeakPolarHBondContact O-CD2 3.28Å; K285-F289 PolarHBondContact O-N 3.05Å; E286-F289 PolarHBondContact O-N 2.61Å; F289-L293 VanDerWaalsContact O-CB 3.3Å; F289-L293 WeakPolarHBondContact O-CB 3.41Å; F289-L293 WeakPolarHBondContact O-CG 3.46Å; F289-L293 PolarHBondContact O-N 2.69Å
290L98.1Very high96.7Very high0 Ų044.4 Ų44.40%024%0.235CC..Hα-helixtrans-66.8-35.5173.1-72.6168.9000112.1W278 E286 V287 M288 E294 L316 C319 V327 R330 A331 Y334W278-L290 HydrophobicContact CH2-CD2 3.85Å; W278-L290 HydrophobicContact CH2-CG 4.02Å; W278-L290 HydrophobicContact CZ2-CD2 4.05Å; W278-L290 HydrophobicContact CZ2-CG 4.07Å; E286-L290 WeakPolarHBondContact O-CG 3.5Å; E286-L290 PolarHBondContact O-N 3.3Å; V287-L290 PolarHBondContact O-N 3.42Å; M288-L290 VanDerWaalsContact C-N 3.29Å; M288-L290 PolarHBondContact O-N 3.38Å; L290-E294 PolarHBondContact O-N 3.12Å; L290-L316 HydrophobicContact CD2-CD2 3.59Å; L290-C319 HydrophobicContact CD1-CB 4.42Å; L290-V327 HydrophobicContact CD1-CG1 4.1Å; L290-R330 HydrophobicContact CB-CG 3.73Å; L290-R330 HydrophobicContact CD1-CB 4.09Å; L290-R330 HydrophobicContact CD1-CG 4.1Å; L290-A331 HydrophobicContact CD1-CB 4.11Å; L290-A331 HydrophobicContact CD2-CB 4.23Å; L290-Y334 WeakPolarHBondContact O-CE1 3.49Å; L290-Y334 PolarHBondContact O-OH 2.93Å
291N97.4Very high96.8Very high56 Ų5639.9 Ų39.930%0.29922%0.217SC..Hα-helixtrans-62.3-54172.1-79.7-45.2000111.4V287 M288 L293 E294 E295 R330V287-N291 PolarHBondContact O-N 3.25Å; V287-N291 PolarHBondContact O-ND2 3.11Å; M288-N291 WeakPolarHBondContact O-CA 3.46Å; M288-N291 WeakPolarHBondContact O-CB 3.12Å; M288-N291 PolarHBondContact O-N 3.39Å; N291-L293 VanDerWaalsContact C-N 3.34Å; N291-L293 PolarHBondContact O-N 3.13Å; N291-E294 PolarHBondContact O-N 3Å; N291-E294 VanDerWaalsContact O-N 3.12Å; N291-E295 PolarHBondContact O-N 3.38Å; N291-R330 PolarHBondContact OD1-NE 3.35Å; N291-R330 PolarHBondContact OD1-NH2 3.13Å
292E98.4Very high97Very high0 Ų036.2 Ų36.20%020%0.196CC..Hα-helixtrans-61.7-41.8-178.1-176.6-175.917700112.1H240 H249 A253 I256 L274 M288 E294 E295 I296H240-E292 IonicContact CD2-OE2 2.76Å; H240-E292 PolarHBondContact CD2-OE2 3.19Å; H240-E292 VanDerWaalsContact CD2-OE2 3.25Å; H240-E292 IonicContact CE1-OE1 3.83Å; H240-E292 IonicContact NE2-OE1 3.33Å; H240-E292 PolarHBondContact NE2-OE1 3.46Å; H240-E292 IonicContact NE2-OE2 3.5Å; H240-E292 PolarHBondContact NE2-OE2 2.92Å; H249-E292 IonicContact NE2-OE2 2.74Å; A253-E292 HydrophobicContact CB-CB 4.26Å; A253-E292 HydrophobicContact CB-CG 3.86Å; I256-E292 WeakPolarHBondContact CG1-OE1 3.47Å; L274-E292 HydrophobicContact CD1-CG 4.43Å; M288-E292 PolarHBondContact O-N 3.2Å; E292-E294 VanDerWaalsContact C-N 3.26Å; E292-E294 PolarHBondContact O-N 3.47Å; E292-E295 PolarHBondContact O-N 3.26Å; E292-I296 HydrophobicContact CG-CD1 4.03Å; E292-I296 WeakPolarHBondContact O-CG1 3.43Å; E292-I296 PolarHBondContact O-N 3.45Å
293L98.2Very high97.2Very high2 Ų235 Ų351%0.0120%0.201CC..Hα-helixtrans-62.2-33.2176.7-85.9-179.3000112.7V271 L274 W278 F289 N291 I296 L297 L312 Y334V271-L293 HydrophobicContact CG1-CD2 4.3Å; V271-L293 HydrophobicContact CG2-CD2 4.45Å; L274-L293 HydrophobicContact CD1-CD2 3.98Å; L274-L293 HydrophobicContact CD1-CG 4.4Å; W278-L293 HydrophobicContact CH2-CD1 3.73Å; W278-L293 HydrophobicContact CZ3-CD1 3.36Å; W278-L293 HydrophobicContact CZ3-CG 4.36Å; F289-L293 VanDerWaalsContact O-CB 3.3Å; F289-L293 WeakPolarHBondContact O-CB 3.41Å; F289-L293 WeakPolarHBondContact O-CG 3.46Å; F289-L293 PolarHBondContact O-N 2.69Å; N291-L293 VanDerWaalsContact C-N 3.34Å; N291-L293 PolarHBondContact O-N 3.13Å; L293-I296 PolarHBondContact O-N 3.12Å; L293-L297 VanDerWaalsContact O-CG 3.26Å; L293-L297 WeakPolarHBondContact O-CG 3.41Å; L293-L297 PolarHBondContact O-N 3.18Å; L293-L312 HydrophobicContact CD1-CD1 3.66Å; L293-L312 HydrophobicContact CD2-CD1 4.19Å; L293-L312 HydrophobicContact CG-CD1 4.48Å; L293-Y334 WeakPolarHBondContact CB-OH 3.49Å
294E97.7Very high97.4Very high31 Ų3134.2 Ų34.215%0.14519%0.192CC..Hα-helixtrans-68.2-44175.4-169.5175.9179.500110.6L290 N291 E292 I296 L297 D298 R330 Y334 N337L290-E294 PolarHBondContact O-N 3.12Å; N291-E294 PolarHBondContact O-N 3Å; N291-E294 VanDerWaalsContact O-N 3.12Å; E292-E294 VanDerWaalsContact C-N 3.26Å; E292-E294 PolarHBondContact O-N 3.47Å; E294-I296 VanDerWaalsContact C-N 3.26Å; E294-I296 PolarHBondContact O-N 3.18Å; E294-L297 CarbonylContact O-C 3.58Å; E294-L297 WeakPolarHBondContact O-CA 3.26Å; E294-L297 WeakPolarHBondContact O-CB 3.34Å; E294-L297 PolarHBondContact O-N 3.05Å; E294-D298 PolarHBondContact O-N 2.98Å; E294-R330 IonicContact OE2-CZ 3.25Å; E294-R330 IonicContact OE2-NH1 3.22Å; E294-R330 PolarHBondContact OE2-NH1 2.88Å; E294-R330 IonicContact OE2-NH2 2.99Å; E294-R330 PolarHBondContact OE2-NH2 2.99Å; E294-Y334 HydrophobicContact CB-CD1 4.4Å; E294-Y334 HydrophobicContact CB-CE1 3.71Å; E294-Y334 HydrophobicContact CG-CD1 4.46Å; E294-Y334 HydrophobicContact CG-CE1 4.24Å; E294-Y334 PolarHBondContact N-OH 3.1Å; E294-Y334 VanDerWaalsContact N-OH 3.08Å; E294-N337 WeakPolarHBondContact OE1-CB 3.25Å; E294-N337 PolarHBondContact OE1-ND2 2.79Å
295E97.5Very high97.6Very high82 Ų8231.4 Ų31.438%0.38317%0.173SC..Hα-helixtrans-61.3-36.2176.1-64.6-175.2-160.300112V257 N291 E292 D298V257-E295 HydrophobicContact CG2-CB 4Å; N291-E295 PolarHBondContact O-N 3.38Å; E292-E295 PolarHBondContact O-N 3.26Å; E295-D298 PolarHBondContact O-N 3.29Å
296I98.4Very high97.7Very high1 Ų136.7 Ų36.71%0.00520%0.196CC..Hα-helixtrans-65.9-41.6172.6-69.6168.1000111I256 V257 L260 T267 V270 V271 L274 E292 L293 E294 D298 V299 I300I256-I296 HydrophobicContact CG2-CD1 3.97Å; I256-I296 HydrophobicContact CG2-CG1 4.36Å; V257-I296 HydrophobicContact CG2-CG1 4.35Å; L260-I296 HydrophobicContact CD1-CB 4.27Å; L260-I296 HydrophobicContact CD1-CD1 4.48Å; L260-I296 HydrophobicContact CD1-CG1 3.95Å; L260-I296 HydrophobicContact CD1-CG2 3.59Å; T267-I296 HydrophobicContact CG2-CG2 4.29Å; V270-I296 HydrophobicContact CG1-CD1 4.09Å; V271-I296 HydrophobicContact CG2-CG2 4.04Å; L274-I296 HydrophobicContact CD1-CD1 3.46Å; L274-I296 VanDerWaalsContact CD1-CD1 3.46Å; E292-I296 HydrophobicContact CG-CD1 4.03Å; E292-I296 WeakPolarHBondContact O-CG1 3.43Å; E292-I296 PolarHBondContact O-N 3.45Å; L293-I296 PolarHBondContact O-N 3.12Å; E294-I296 VanDerWaalsContact C-N 3.26Å; E294-I296 PolarHBondContact O-N 3.18Å; I296-D298 VanDerWaalsContact C-N 3.28Å; I296-D298 PolarHBondContact O-N 2.91Å; I296-V299 WeakPolarHBondContact O-CG2 3.46Å; I296-V299 PolarHBondContact O-N 3.38Å; I296-I300 PolarHBondContact O-N 3.05Å; I296-I300 VanDerWaalsContact O-N 3.11Å
297L97.9Very high97.7Very high3 Ų339.6 Ų39.62%0.01621%0.208CC..Hα-helixtrans-67-28.3177.3-73.2175.3000112.6L293 E294 V299 I300 F305 L312 Y334 Y339 V340L293-L297 VanDerWaalsContact O-CG 3.26Å; L293-L297 WeakPolarHBondContact O-CG 3.41Å; L293-L297 PolarHBondContact O-N 3.18Å; E294-L297 CarbonylContact O-C 3.58Å; E294-L297 WeakPolarHBondContact O-CA 3.26Å; E294-L297 WeakPolarHBondContact O-CB 3.34Å; E294-L297 PolarHBondContact O-N 3.05Å; L297-V299 PolarHBondContact O-N 2.92Å; L297-I300 HydrophobicContact CD2-CD1 4.42Å; L297-I300 HydrophobicContact CD2-CG2 4.06Å; L297-I300 VanDerWaalsContact O-CG2 3.25Å; L297-I300 WeakPolarHBondContact O-CG2 3.37Å; L297-I300 PolarHBondContact O-N 3.46Å; L297-F305 HydrophobicContact CD2-CD2 3.85Å; L297-F305 HydrophobicContact CD2-CE2 3.9Å; L297-L312 HydrophobicContact CD1-CD2 4.14Å; L297-L312 HydrophobicContact CD2-CD2 3.82Å; L297-L312 HydrophobicContact CG-CD2 4.38Å; L297-Y334 HydrophobicContact CD1-CD2 3.99Å; L297-Y334 HydrophobicContact CD1-CE2 3.62Å; L297-Y339 VanDerWaalsContact O-CD1 3.25Å; L297-Y339 WeakPolarHBondContact O-CD1 3.03Å; L297-Y339 WeakPolarHBondContact O-CE1 3.39Å; L297-V340 HydrophobicContact CB-CG2 3.9Å; L297-V340 HydrophobicContact CD1-CG1 4.38Å; L297-V340 HydrophobicContact CD1-CG2 4.03Å
298D96.9Very high97.7Very high81 Ų8138.1 Ų38.143%0.43320%0.199SC..Hα-helixtrans-65.6-25.2175.7-80.8-21000113.1E294 E295 I296 N337E294-D298 PolarHBondContact O-N 2.98Å; E295-D298 PolarHBondContact O-N 3.29Å; I296-D298 VanDerWaalsContact C-N 3.28Å; I296-D298 PolarHBondContact O-N 2.91Å; D298-N337 PolarHBondContact OD1-ND2 2.87Å
299V96.9Very high97.7Very high50 Ų5037.9 Ų37.930%0.30320%0.198SC..Hα-helixtrans-108.3-2.2179.7-58.40000113.9V257 L260 E261 I296 L297V257-V299 HydrophobicContact CG1-CG1 4.12Å; V257-V299 HydrophobicContact CG1-CG2 4.18Å; L260-V299 HydrophobicContact CB-CG2 4.4Å; E261-V299 HydrophobicContact CG-CB 4.41Å; E261-V299 HydrophobicContact CG-CG1 4.16Å; I296-V299 WeakPolarHBondContact O-CG2 3.46Å; I296-V299 PolarHBondContact O-N 3.38Å; L297-V299 PolarHBondContact O-N 2.92Å
300I97.9Very high97.7Very high3 Ų342.2 Ų42.22%0.01522%0.218CC..  trans-70.9136.3-176.1-161.6163000111.8T267 I296 L297 E304 F305 V308 Y339 L343T267-I300 HydrophobicContact CG2-CD1 3.5Å; T267-I300 VanDerWaalsContact CG2-CD1 3.5Å; T267-I300 HydrophobicContact CG2-CG1 3.83Å; I296-I300 PolarHBondContact O-N 3.05Å; I296-I300 VanDerWaalsContact O-N 3.11Å; L297-I300 HydrophobicContact CD2-CD1 4.42Å; L297-I300 HydrophobicContact CD2-CG2 4.06Å; L297-I300 VanDerWaalsContact O-CG2 3.25Å; L297-I300 WeakPolarHBondContact O-CG2 3.37Å; L297-I300 PolarHBondContact O-N 3.46Å; I300-E304 HydrophobicContact CG1-CB 4.1Å; I300-F305 HydrophobicContact CD1-CB 3.99Å; I300-F305 HydrophobicContact CD1-CD2 4.33Å; I300-F305 HydrophobicContact CG1-CB 4.2Å; I300-F305 HydrophobicContact CG2-CB 4.2Å; I300-F305 HydrophobicContact CG2-CD2 4.32Å; I300-V308 HydrophobicContact CD1-CG2 3.92Å; I300-Y339 HydrophobicContact CG2-CE1 4.32Å; I300-Y339 PolarHBondContact O-OH 3.48Å; I300-L343 HydrophobicContact CG2-CD1 3.63Å
301E96.6Very high97.7Very high99 Ų9944.5 Ų44.546%0.46323%0.233SC..  trans-78.3145.1170.3-65.7-173.7174.200111.1P264 A303 E304 F305P264-E301 HydrophobicContact CB-CG 4.22Å; P264-E301 HydrophobicContact CG-CG 4.4Å; E301-A303 PolarHBondContact O-N 3.13Å; E301-E304 PolarHBondContact O-N 3.23Å; E301-F305 PolarHBondContact O-N 2.72Å
302P97.3Very high97.7Very high67 Ų6741.9 Ų41.944%0.43522%0.219SC..Hα-helixtrans-55.8-30.9-179.7-28.335000114.6K306 L343P302-K306 WeakPolarHBondContact O-CG 3.19Å; P302-K306 PolarHBondContact O-N 2.96Å; P302-L343 HydrophobicContact CB-CD2 4.34Å; P302-L343 HydrophobicContact CG-CD2 4.22Å
303A97.4Very high97.7Very high60 Ų6042 Ų4250%0.49622%0.219SC..Hα-helixtrans-69-38.6177.400000112.4E301E301-A303 PolarHBondContact O-N 3.13Å
304E97.6Very high97.7Very high21 Ų2146.2 Ų46.210%0.09824%0.238CC..Hα-helixtrans-76.6-37177.2-63.1-57.3136.600111.2P264 I300 E301 K306 K307P264-E304 HydrophobicContact CB-CG 4.44Å; I300-E304 HydrophobicContact CG1-CB 4.1Å; E301-E304 PolarHBondContact O-N 3.23Å; E304-K306 VanDerWaalsContact C-N 3.29Å; E304-K306 PolarHBondContact O-N 3.45Å; E304-K307 WeakPolarHBondContact O-CB 3.49Å; E304-K307 PolarHBondContact O-N 3.47Å; E304-K307 IonicContact OE1-NZ 2.67Å; E304-K307 PolarHBondContact OE1-NZ 2.86Å; E304-K307 WeakPolarHBondContact OE2-CE 3.5Å; E304-K307 IonicContact OE2-NZ 3.33Å; E304-K307 PolarHBondContact OE2-NZ 3.44Å
305F98.1Very high97.7Very high0 Ų045.9 Ų45.90%024%0.236CC..Hα-helixtrans-54.6-43.7175.3178.5-104000112.4L297 I300 E301 K307 V308 M309 L312 F313 L343 N347 I351L297-F305 HydrophobicContact CD2-CD2 3.85Å; L297-F305 HydrophobicContact CD2-CE2 3.9Å; I300-F305 HydrophobicContact CD1-CB 3.99Å; I300-F305 HydrophobicContact CD1-CD2 4.33Å; I300-F305 HydrophobicContact CG1-CB 4.2Å; I300-F305 HydrophobicContact CG2-CB 4.2Å; I300-F305 HydrophobicContact CG2-CD2 4.32Å; E301-F305 PolarHBondContact O-N 2.72Å; F305-K307 PolarHBondContact O-N 3.37Å; F305-K307 VanDerWaalsContact O-N 3.11Å; F305-V308 WeakPolarHBondContact O-CG2 3.47Å; F305-V308 PolarHBondContact O-N 3.38Å; F305-M309 HydrophobicContact CD1-CB 4.18Å; F305-M309 HydrophobicContact CE1-CB 3.76Å; F305-M309 HydrophobicContact CE1-SD 4.25Å; F305-M309 HydrophobicContact CE2-CB 4.23Å; F305-M309 HydrophobicContact CZ-CB 3.8Å; F305-M309 WeakPolarHBondContact O-CB 3.44Å; F305-M309 PolarHBondContact O-N 3.15Å; F305-L312 HydrophobicContact CE2-CD2 4.43Å; F305-F313 AromaticContact CE2-CE2 3.89Å; F305-F313 HydrophobicContact CE2-CE2 3.89Å; F305-F313 AromaticContact CZ-CE2 3.63Å; F305-F313 HydrophobicContact CZ-CE2 3.63Å; F305-F313 HydrophobicContact CZ-CZ 4.31Å; F305-L343 HydrophobicContact CB-CD2 4.39Å; F305-L343 HydrophobicContact CD1-CB 4.13Å; F305-L343 HydrophobicContact CD1-CD2 4.24Å; F305-L343 HydrophobicContact CD2-CD1 3.98Å; F305-L343 HydrophobicContact CE1-CB 3.87Å; F305-L343 HydrophobicContact CE2-CB 4.28Å; F305-L343 HydrophobicContact CE2-CD1 4.25Å; F305-L343 HydrophobicContact CG-CB 4.45Å; F305-L343 HydrophobicContact CG-CD1 4.19Å; F305-L343 HydrophobicContact CG-CD2 4.24Å; F305-L343 HydrophobicContact CZ-CB 3.94Å; F305-N347 HydrophobicContact CE1-CB 4.38Å; F305-I351 HydrophobicContact CE1-CD1 4.02Å; F305-I351 HydrophobicContact CZ-CD1 3.93Å
306K97.9Very high97.6Very high127 Ų12742 Ų4255%0.55222%0.218SC*.Hα-helixtrans-57.9-27.6178.5-75.3-178.6-179.3-172.80113.9P302 E304 N347P302-K306 WeakPolarHBondContact O-CG 3.19Å; P302-K306 PolarHBondContact O-N 2.96Å; E304-K306 VanDerWaalsContact C-N 3.29Å; E304-K306 PolarHBondContact O-N 3.45Å; K306-N347 VanDerWaalsContact CE-OD1 3.24Å; K306-N347 WeakPolarHBondContact CE-OD1 3.27Å
307K97.8Very high97.5Very high95 Ų9542.6 Ų42.641%0.41322%0.223SC..Hα-helixtrans-76.7-27.2179.3-53.8-178.2-164.4160.90112.4E268 E304 F305E268-K307 HydrophobicContact CB-CD 4.48Å; E268-K307 HydrophobicContact CG-CB 4.24Å; E268-K307 VanDerWaalsContact OE2-CD 3.28Å; E268-K307 WeakPolarHBondContact OE2-CD 3.49Å; E304-K307 WeakPolarHBondContact O-CB 3.49Å; E304-K307 PolarHBondContact O-N 3.47Å; E304-K307 IonicContact OE1-NZ 2.67Å; E304-K307 PolarHBondContact OE1-NZ 2.86Å; E304-K307 WeakPolarHBondContact OE2-CE 3.5Å; E304-K307 IonicContact OE2-NZ 3.33Å; E304-K307 PolarHBondContact OE2-NZ 3.44Å; F305-K307 PolarHBondContact O-N 3.37Å; F305-K307 VanDerWaalsContact O-N 3.11Å
308V97.8Very high97.4Very high0 Ų050.5 Ų50.50%025%0.252CS..Hα-helixtrans-113-13.6-172.6-60.30000114.3E268 V271 I300 F305 E310 P311 L312E268-V308 HydrophobicContact CB-CG1 4.19Å; E268-V308 HydrophobicContact CG-CG1 4.11Å; V271-V308 HydrophobicContact CB-CB 4.29Å; V271-V308 HydrophobicContact CB-CG1 3.99Å; V271-V308 HydrophobicContact CG1-CB 3.92Å; V271-V308 HydrophobicContact CG1-CG1 4.14Å; V271-V308 HydrophobicContact CG1-CG2 4.35Å; I300-V308 HydrophobicContact CD1-CG2 3.92Å; F305-V308 WeakPolarHBondContact O-CG2 3.47Å; F305-V308 PolarHBondContact O-N 3.38Å; V308-E310 VanDerWaalsContact C-N 3.31Å; V308-E310 PolarHBondContact O-N 3.03Å; V308-P311 WeakPolarHBondContact O-CD 3.36Å; V308-P311 VanDerWaalsContact O-CG 3.27Å; V308-P311 WeakPolarHBondContact O-CG 3.32Å; V308-L312 WeakPolarHBondContact O-CB 3.45Å; V308-L312 PolarHBondContact O-N 3Å
309M97.6Very high97.3Very high18 Ų1846.7 Ų46.79%0.08923%0.232CC..Hα-helixtrans-56.6-41.2-173.865.9178.9-179.900113F305 F313 N347 V350F305-M309 HydrophobicContact CD1-CB 4.18Å; F305-M309 HydrophobicContact CE1-CB 3.76Å; F305-M309 HydrophobicContact CE1-SD 4.25Å; F305-M309 HydrophobicContact CE2-CB 4.23Å; F305-M309 HydrophobicContact CZ-CB 3.8Å; F305-M309 WeakPolarHBondContact O-CB 3.44Å; F305-M309 PolarHBondContact O-N 3.15Å; M309-F313 HydrophobicContact CB-CD2 4.43Å; M309-F313 WeakPolarHBondContact O-CB 3.27Å; M309-F313 VanDerWaalsContact O-CD2 3.24Å; M309-F313 WeakPolarHBondContact O-CD2 3.49Å; M309-F313 PolarHBondContact O-N 3.37Å; M309-N347 HydrophobicContact SD-CB 3.71Å; M309-V350 HydrophobicContact CE-CB 3.92Å; M309-V350 HydrophobicContact CE-CG1 3.94Å; M309-V350 HydrophobicContact CE-CG2 3.87Å
310E98.2Very high97.1Very high91 Ų9144.3 Ų44.343%0.42522%0.218SC..Hα-helixtrans-63.3-56.9-179.6-81.9-161-122.800113.8V308 L312 K314 V350 L354V308-E310 VanDerWaalsContact C-N 3.31Å; V308-E310 PolarHBondContact O-N 3.03Å; E310-L312 VanDerWaalsContact C-N 3.31Å; E310-L312 PolarHBondContact O-N 3.02Å; E310-K314 WeakPolarHBondContact O-CB 3.49Å; E310-K314 WeakPolarHBondContact O-CD 3.38Å; E310-K314 WeakPolarHBondContact O-CG 3.33Å; E310-K314 PolarHBondContact O-N 3.1Å; E310-K314 IonicContact OE2-NZ 2.84Å; E310-K314 PolarHBondContact OE2-NZ 3.37Å; E310-V350 HydrophobicContact CG-CG1 3.73Å; E310-L354 HydrophobicContact CB-CD1 4.46Å; E310-L354 HydrophobicContact CG-CD1 4.22Å
311P98Very high96.8Very high47 Ų4746.7 Ų46.731%0.30523%0.234SC..Hα-helixtrans-65.1-35.4178.525.2-34.5000112.3L275 V308 Q315L275-P311 HydrophobicContact CD1-CB 3.87Å; L275-P311 HydrophobicContact CD1-CG 4.35Å; V308-P311 WeakPolarHBondContact O-CD 3.36Å; V308-P311 VanDerWaalsContact O-CG 3.27Å; V308-P311 WeakPolarHBondContact O-CG 3.32Å; P311-Q315 PolarHBondContact O-N 3.39Å; P311-Q315 VanDerWaalsContact O-N 3.13Å
312L98Very high96.2Very high2 Ų243.1 Ų43.11%0.0122%0.224CC..Hα-helixtrans-61.2-53.7176.9175.464.5000111.8L293 L297 F305 V308 E310 K314 Q315 L316L293-L312 HydrophobicContact CD1-CD1 3.66Å; L293-L312 HydrophobicContact CD2-CD1 4.19Å; L293-L312 HydrophobicContact CG-CD1 4.48Å; L297-L312 HydrophobicContact CD1-CD2 4.14Å; L297-L312 HydrophobicContact CD2-CD2 3.82Å; L297-L312 HydrophobicContact CG-CD2 4.38Å; F305-L312 HydrophobicContact CE2-CD2 4.43Å; V308-L312 WeakPolarHBondContact O-CB 3.45Å; V308-L312 PolarHBondContact O-N 3Å; E310-L312 VanDerWaalsContact C-N 3.31Å; E310-L312 PolarHBondContact O-N 3.02Å; L312-K314 VanDerWaalsContact C-N 3.33Å; L312-K314 PolarHBondContact O-N 2.94Å; L312-Q315 WeakPolarHBondContact O-CA 3.44Å; L312-Q315 WeakPolarHBondContact O-CB 3.5Å; L312-Q315 PolarHBondContact O-N 3.15Å; L312-L316 HydrophobicContact CD1-CD1 4.43Å; L312-L316 HydrophobicContact CG-CD1 4.2Å; L312-L316 PolarHBondContact O-N 3.46Å
313F98Very high95.6Very high2 Ų245.1 Ų45.11%0.00924%0.238CC..Hα-helixtrans-72.3-27.2-177.9-80.3-95.5000112.6F305 M309 Q315 L316 A317 I344 I351 L354 M355F305-F313 AromaticContact CE2-CE2 3.89Å; F305-F313 HydrophobicContact CE2-CE2 3.89Å; F305-F313 AromaticContact CZ-CE2 3.63Å; F305-F313 HydrophobicContact CZ-CE2 3.63Å; F305-F313 HydrophobicContact CZ-CZ 4.31Å; M309-F313 HydrophobicContact CB-CD2 4.43Å; M309-F313 WeakPolarHBondContact O-CB 3.27Å; M309-F313 VanDerWaalsContact O-CD2 3.24Å; M309-F313 WeakPolarHBondContact O-CD2 3.49Å; M309-F313 PolarHBondContact O-N 3.37Å; F313-Q315 PolarHBondContact O-N 3Å; F313-L316 HydrophobicContact CD1-CD1 4.05Å; F313-L316 HydrophobicContact CE1-CD1 4.08Å; F313-L316 HydrophobicContact CG-CD1 4.3Å; F313-L316 HydrophobicContact CZ-CD1 4.34Å; F313-L316 PolarHBondContact O-N 3.24Å; F313-A317 VanDerWaalsContact O-CB 3.29Å; F313-A317 WeakPolarHBondContact O-CB 3.27Å; F313-A317 PolarHBondContact O-N 3.34Å; F313-I344 HydrophobicContact CE1-CD1 3.88Å; F313-I344 HydrophobicContact CE1-CG1 3.9Å; F313-I344 HydrophobicContact CZ-CD1 3.86Å; F313-I344 HydrophobicContact CZ-CG1 3.56Å; F313-I351 HydrophobicContact CD1-CG2 3.52Å; F313-I351 HydrophobicContact CD2-CD1 4.36Å; F313-I351 HydrophobicContact CD2-CG1 4.25Å; F313-I351 HydrophobicContact CE1-CG2 3.64Å; F313-I351 HydrophobicContact CE2-CD1 4.02Å; F313-I351 HydrophobicContact CE2-CG1 4.4Å; F313-I351 HydrophobicContact CG-CG1 4.36Å; F313-I351 HydrophobicContact CG-CG2 4.02Å; F313-I351 HydrophobicContact CZ-CD1 4.14Å; F313-I351 HydrophobicContact CZ-CG2 4.25Å; F313-L354 HydrophobicContact CB-CD1 4.44Å; F313-M355 HydrophobicContact CB-CG 4.45Å; F313-M355 HydrophobicContact CB-SD 4.13Å; F313-M355 HydrophobicContact CD1-CG 3.7Å; F313-M355 HydrophobicContact CD1-SD 3.78Å; F313-M355 HydrophobicContact CG-SD 4.46Å
314K97.5Very high95.3Very high91 Ų9145.2 Ų45.240%0.39623%0.228SC..Hα-helixtrans-60.8-35.5166.6-76.1166.8-169.7156.60111.7E310 L312 R318 L354E310-K314 WeakPolarHBondContact O-CB 3.49Å; E310-K314 WeakPolarHBondContact O-CD 3.38Å; E310-K314 WeakPolarHBondContact O-CG 3.33Å; E310-K314 PolarHBondContact O-N 3.1Å; E310-K314 IonicContact OE2-NZ 2.84Å; E310-K314 PolarHBondContact OE2-NZ 3.37Å; L312-K314 VanDerWaalsContact C-N 3.33Å; L312-K314 PolarHBondContact O-N 2.94Å; K314-R318 WeakPolarHBondContact O-CG 3.42Å; K314-L354 HydrophobicContact CD-CD2 4.45Å; K314-L354 HydrophobicContact CG-CD1 4.45Å; K314-L354 HydrophobicContact CG-CD2 4.01Å
315Q97.6Very high95Very high24 Ų2447.8 Ų47.811%0.11224%0.24CC..Hα-helixtrans-76.1-44.5175.6-171.354.545.500111.8L275 W278 P311 L312 F313 A317 R318 C319L275-Q315 HydrophobicContact CD2-CB 3.68Å; L275-Q315 HydrophobicContact CD2-CG 3.8Å; W278-Q315 VanDerWaalsContact CD1-NE2 3.32Å; W278-Q315 HydrophobicContact CD2-CG 3.73Å; W278-Q315 HydrophobicContact CE3-CG 4.07Å; W278-Q315 HydrophobicContact CG-CG 4.2Å; W278-Q315 HydrophobicContact CH2-CG 4.39Å; W278-Q315 HydrophobicContact CZ2-CG 4.08Å; W278-Q315 HydrophobicContact CZ3-CG 4.4Å; P311-Q315 PolarHBondContact O-N 3.39Å; P311-Q315 VanDerWaalsContact O-N 3.13Å; L312-Q315 WeakPolarHBondContact O-CA 3.44Å; L312-Q315 WeakPolarHBondContact O-CB 3.5Å; L312-Q315 PolarHBondContact O-N 3.15Å; F313-Q315 PolarHBondContact O-N 3Å; Q315-A317 VanDerWaalsContact C-N 3.27Å; Q315-A317 PolarHBondContact O-N 3.44Å; Q315-R318 WeakPolarHBondContact O-CA 3.41Å; Q315-R318 WeakPolarHBondContact O-CB 3.26Å; Q315-R318 PolarHBondContact O-N 3.27Å; Q315-C319 PolarHBondContact O-N 3.15Å; Q315-C319 PolarHBondContact O-SG 3.35Å
316L96.7Very high94.9Very high1 Ų152.4 Ų52.41%0.00526%0.261CS..Hα-helixtrans-57.7-39.8174.8-69.2169.4000112.1L290 L312 F313 R318 C319 V320 A331 Y334 M355L290-L316 HydrophobicContact CD2-CD2 3.59Å; L312-L316 HydrophobicContact CD1-CD1 4.43Å; L312-L316 HydrophobicContact CG-CD1 4.2Å; L312-L316 PolarHBondContact O-N 3.46Å; F313-L316 HydrophobicContact CD1-CD1 4.05Å; F313-L316 HydrophobicContact CE1-CD1 4.08Å; F313-L316 HydrophobicContact CG-CD1 4.3Å; F313-L316 HydrophobicContact CZ-CD1 4.34Å; F313-L316 PolarHBondContact O-N 3.24Å; L316-R318 PolarHBondContact O-N 3.15Å; L316-C319 PolarHBondContact O-N 3.16Å; L316-C319 VanDerWaalsContact O-N 3.11Å; L316-V320 WeakPolarHBondContact O-CG2 3.47Å; L316-V320 PolarHBondContact O-N 2.86Å; L316-A331 HydrophobicContact CD2-CB 4.43Å; L316-Y334 HydrophobicContact CD1-CD2 3.88Å; L316-Y334 HydrophobicContact CD1-CE2 3.98Å; L316-Y334 HydrophobicContact CD2-CD2 4.1Å; L316-Y334 HydrophobicContact CD2-CE2 3.82Å; L316-M355 HydrophobicContact CB-SD 4.28Å
317A96.1Very high94.8Very high12 Ų1246.4 Ų46.410%0.09924%0.235CC..Hα-helixtrans-57.3-36.617400000112.7F313 Q315 S321 M355 A358F313-A317 VanDerWaalsContact O-CB 3.29Å; F313-A317 WeakPolarHBondContact O-CB 3.27Å; F313-A317 PolarHBondContact O-N 3.34Å; Q315-A317 VanDerWaalsContact C-N 3.27Å; Q315-A317 PolarHBondContact O-N 3.44Å; A317-S321 WeakPolarHBondContact O-CB 3.43Å; A317-S321 PolarHBondContact O-N 3.49Å; A317-S321 PolarHBondContact O-OG 2.92Å; A317-M355 HydrophobicContact CB-CE 4.06Å; A317-M355 HydrophobicContact CB-SD 3.78Å; A317-A358 HydrophobicContact CB-CB 3.86Å; A317-A358 VanDerWaalsContact O-CB 3.3Å; A317-A358 WeakPolarHBondContact O-CB 3.32Å
318R95.3Very high94.7Very high170 Ų17041.9 Ų41.964%0.64222%0.215SC*.Hα-helixtrans-70.5-43.3174.5-66.7170.9177170.2-1.7111.5K314 Q315 L316 V320 S321 G322K314-R318 WeakPolarHBondContact O-CG 3.42Å; Q315-R318 WeakPolarHBondContact O-CA 3.41Å; Q315-R318 WeakPolarHBondContact O-CB 3.26Å; Q315-R318 PolarHBondContact O-N 3.27Å; L316-R318 PolarHBondContact O-N 3.15Å; R318-V320 VanDerWaalsContact C-N 3.35Å; R318-V320 PolarHBondContact O-N 3.3Å; R318-S321 CarbonylContact O-C 3.34Å; R318-S321 PolarHBondContact O-N 2.88Å; R318-S321 VanDerWaalsContact O-N 3.14Å; R318-G322 PolarHBondContact O-N 2.9Å
319C95.5Very high94.5Very high1 Ų144 Ų441%0.00723%0.225CC..Hα-helixtrans-60.3-44.3178.3-57.30000111.6W278 E286 L290 Q315 L316 S321 G322 V327 A331W278-C319 VanDerWaalsContact CZ2-SG 3.5Å; E286-C319 PolarHBondContact OE1-SG 3.48Å; L290-C319 HydrophobicContact CD1-CB 4.42Å; Q315-C319 PolarHBondContact O-N 3.15Å; Q315-C319 PolarHBondContact O-SG 3.35Å; L316-C319 PolarHBondContact O-N 3.16Å; L316-C319 VanDerWaalsContact O-N 3.11Å; C319-S321 VanDerWaalsContact C-N 3.28Å; C319-S321 PolarHBondContact O-N 3.21Å; C319-G322 PolarHBondContact O-N 3.35Å; C319-G322 VanDerWaalsContact O-N 3.11Å; C319-V327 HydrophobicContact CB-CG1 3.85Å; C319-A331 HydrophobicContact CB-CB 3.8Å
320V93.2Very high94.5Very high0 Ų044.8 Ų44.80%023%0.227CC..Hα-helixtrans-64.3-33.1175.9173.80000112.1L316 R318 G322 A331 L332 W335 M355 L359L316-V320 WeakPolarHBondContact O-CG2 3.47Å; L316-V320 PolarHBondContact O-N 2.86Å; R318-V320 VanDerWaalsContact C-N 3.35Å; R318-V320 PolarHBondContact O-N 3.3Å; V320-G322 VanDerWaalsContact C-N 3.28Å; V320-A331 HydrophobicContact CG2-CB 3.87Å; V320-L332 HydrophobicContact CG1-CD2 4.01Å; V320-L332 HydrophobicContact CG1-CG 4.33Å; V320-L332 HydrophobicContact CG2-CD2 4.08Å; V320-L332 HydrophobicContact CG2-CG 4.14Å; V320-W335 HydrophobicContact CG2-CH2 4.38Å; V320-W335 HydrophobicContact CG2-CZ3 4.39Å; V320-M355 HydrophobicContact CG2-CE 4.29Å; V320-L359 HydrophobicContact CG1-CD2 3.8Å
321S90.7Very high94.4Very high52 Ų5240.5 Ų40.536%0.36421%0.207SC..THydrogen-bonded Turntrans-82.8-3.7176.5-53.30000113.7A317 R318 C319 A358 N362A317-S321 WeakPolarHBondContact O-CB 3.43Å; A317-S321 PolarHBondContact O-N 3.49Å; A317-S321 PolarHBondContact O-OG 2.92Å; R318-S321 CarbonylContact O-C 3.34Å; R318-S321 PolarHBondContact O-N 2.88Å; R318-S321 VanDerWaalsContact O-N 3.14Å; C319-S321 VanDerWaalsContact C-N 3.28Å; C319-S321 PolarHBondContact O-N 3.21Å; S321-A358 VanDerWaalsContact OG-CB 3.23Å; S321-A358 WeakPolarHBondContact OG-CB 3.46Å; S321-N362 WeakPolarHBondContact CA-ND2 3.24Å; S321-N362 PolarHBondContact OG-ND2 2.85Å
322G84.1Confident94.3Very high24 Ų2438.4 Ų38.425%0.24719%0.194CC..  trans-67.9143.6-178.800000111.5R318 C319 V320 H324R318-G322 PolarHBondContact O-N 2.9Å; C319-G322 PolarHBondContact O-N 3.35Å; C319-G322 VanDerWaalsContact O-N 3.11Å; V320-G322 VanDerWaalsContact C-N 3.28Å; G322-H324 PolarHBondContact O-N 3.34Å
323C83.5Confident94.1Very high109 Ų10942.2 Ų42.274%0.73621%0.208SC*.SBendtrans-71-13.5176.660.50000113.4W367C323-W367 PolarHBondContact O-NE1 3.41Å; C323-W367 VanDerWaalsContact O-NE1 3.14Å
324H92.1Very high94.1Very high62 Ų6242.2 Ų42.229%0.28721%0.208SC..  trans-85.7110.7-177.1-164.6-80.1000111.1S283 G322 Q326 V327 A328S283-H324 WeakPolarHBondContact CB-NE2 3.43Å; S283-H324 PolarHBondContact OG-CD2 2.79Å; S283-H324 VanDerWaalsContact OG-CD2 3.26Å; G322-H324 PolarHBondContact O-N 3.34Å; H324-Q326 PolarHBondContact CE1-OE1 3.21Å; H324-Q326 PolarHBondContact O-N 2.94Å; H324-V327 HydrophobicContact CB-CB 4.39Å; H324-V327 HydrophobicContact CB-CG2 4.26Å; H324-V327 PolarHBondContact O-N 3.48Å; H324-V327 VanDerWaalsContact O-N 3.09Å; H324-A328 PolarHBondContact O-N 3.3Å; H324-A328 VanDerWaalsContact O-N 3.16Å
325F92Very high93.9Very high76 Ų7638.4 Ų38.433%0.33319%0.191SC..Hα-helixtrans-59.4-40.5-17078.9-81.8000113.4V327 A328 E329 W367 I371F325-V327 VanDerWaalsContact C-N 3.26Å; F325-V327 PolarHBondContact O-N 3.21Å; F325-A328 PolarHBondContact O-N 2.99Å; F325-E329 WeakPolarHBondContact O-CB 3.37Å; F325-E329 PolarHBondContact O-N 3.32Å; F325-W367 HydrophobicContact CB-CH2 4.05Å; F325-W367 HydrophobicContact CB-CZ2 3.83Å; F325-W367 HydrophobicContact CD1-CH2 4.08Å; F325-W367 HydrophobicContact CD1-CZ2 4.32Å; F325-W367 HydrophobicContact CG-CH2 4.31Å; F325-W367 HydrophobicContact CG-CZ2 4.47Å; F325-I371 HydrophobicContact CB-CD1 4.5Å; F325-I371 HydrophobicContact CB-CG1 4.31Å; F325-I371 WeakPolarHBondContact O-CD1 3.4Å
326Q95.1Very high93.7Very high96 Ų9641.6 Ų41.645%0.44921%0.209SC..Hα-helixtrans-63.5-32.4-179.7-61.9-179.4-69.100112.7V287 H324 R330V287-Q326 HydrophobicContact CG2-CB 4.15Å; H324-Q326 PolarHBondContact CE1-OE1 3.21Å; H324-Q326 PolarHBondContact O-N 2.94Å; Q326-R330 WeakPolarHBondContact O-CB 3.45Å; Q326-R330 PolarHBondContact O-N 2.95Å
327V96.5Very high93.6Very high1 Ų142.5 Ų42.51%0.00621%0.214CC..Hα-helixtrans-73.6-47.7178.51720000109.6E286 V287 L290 C319 H324 F325 R330 A331E286-V327 HydrophobicContact CB-CG2 4.08Å; E286-V327 VanDerWaalsContact CD-CG1 3.5Å; E286-V327 HydrophobicContact CG-CG1 3.83Å; E286-V327 HydrophobicContact CG-CG2 4.1Å; V287-V327 HydrophobicContact CG2-CG2 4.03Å; L290-V327 HydrophobicContact CD1-CG1 4.1Å; C319-V327 HydrophobicContact CB-CG1 3.85Å; H324-V327 HydrophobicContact CB-CB 4.39Å; H324-V327 HydrophobicContact CB-CG2 4.26Å; H324-V327 PolarHBondContact O-N 3.48Å; H324-V327 VanDerWaalsContact O-N 3.09Å; F325-V327 VanDerWaalsContact C-N 3.26Å; F325-V327 PolarHBondContact O-N 3.21Å; V327-R330 PolarHBondContact O-N 3.27Å; V327-A331 WeakPolarHBondContact O-CB 3.45Å; V327-A331 PolarHBondContact O-N 3.46Å
328A94.7Very high93.6Very high0 Ų050.1 Ų50.10%025%0.248CC..Hα-helixtrans-63.3-44.5178.500000111.7H324 F325 A331 L332 I371H324-A328 PolarHBondContact O-N 3.3Å; H324-A328 VanDerWaalsContact O-N 3.16Å; F325-A328 PolarHBondContact O-N 2.99Å; A328-A331 PolarHBondContact O-N 3.4Å; A328-L332 WeakPolarHBondContact O-CB 3.21Å; A328-L332 WeakPolarHBondContact O-CD1 3.43Å; A328-L332 VanDerWaalsContact O-CG 3.25Å; A328-L332 WeakPolarHBondContact O-CG 3.29Å; A328-L332 PolarHBondContact O-N 3.08Å; A328-I371 HydrophobicContact CB-CD1 4.15Å; A328-I371 HydrophobicContact CB-CG2 4.13Å
329E94.5Very high93.7Very high44 Ų4445.9 Ų45.921%0.20623%0.232CC..Hα-helixtrans-58-51.9175.5-178.4172.2-112.200110.5F325 A331 L332 Y333 I371 L374F325-E329 WeakPolarHBondContact O-CB 3.37Å; F325-E329 PolarHBondContact O-N 3.32Å; E329-A331 VanDerWaalsContact C-N 3.31Å; E329-A331 PolarHBondContact O-N 3.08Å; E329-L332 PolarHBondContact O-N 3.38Å; E329-L332 VanDerWaalsContact O-N 3.14Å; E329-Y333 HydrophobicContact CG-CD2 3.8Å; E329-Y333 HydrophobicContact CG-CE2 3.4Å; E329-Y333 VanDerWaalsContact CG-CE2 3.4Å; E329-Y333 VanDerWaalsContact O-CD2 3.24Å; E329-Y333 WeakPolarHBondContact O-CD2 3.3Å; E329-Y333 PolarHBondContact O-N 3.31Å; E329-I371 HydrophobicContact CB-CD1 3.54Å; E329-I371 HydrophobicContact CG-CD1 4.44Å; E329-L374 HydrophobicContact CG-CD1 4.13Å
330R96.6Very high93.8Very high36 Ų3645.9 Ų45.914%0.13623%0.232CC..Hα-helixtrans-62.2-38.9-178-176.761-172.994.3-9.8112.9V287 L290 N291 E294 Q326 V327 Y333V287-R330 HydrophobicContact CG1-CB 4.39Å; V287-R330 HydrophobicContact CG1-CG 4.14Å; L290-R330 HydrophobicContact CB-CG 3.73Å; L290-R330 HydrophobicContact CD1-CB 4.09Å; L290-R330 HydrophobicContact CD1-CG 4.1Å; N291-R330 PolarHBondContact OD1-NE 3.35Å; N291-R330 PolarHBondContact OD1-NH2 3.13Å; E294-R330 IonicContact OE2-CZ 3.25Å; E294-R330 IonicContact OE2-NH1 3.22Å; E294-R330 PolarHBondContact OE2-NH1 2.88Å; E294-R330 IonicContact OE2-NH2 2.99Å; E294-R330 PolarHBondContact OE2-NH2 2.99Å; Q326-R330 WeakPolarHBondContact O-CB 3.45Å; Q326-R330 PolarHBondContact O-N 2.95Å; V327-R330 PolarHBondContact O-N 3.27Å; R330-Y333 PolarHBondContact O-N 2.97Å
331A96.7Very high93.9Very high0 Ų047.1 Ų47.10%024%0.238CC..Hα-helixtrans-66.2-43.217500000111.4L290 L316 C319 V320 V327 A328 E329 Y333 Y334 W335L290-A331 HydrophobicContact CD1-CB 4.11Å; L290-A331 HydrophobicContact CD2-CB 4.23Å; L316-A331 HydrophobicContact CD2-CB 4.43Å; C319-A331 HydrophobicContact CB-CB 3.8Å; V320-A331 HydrophobicContact CG2-CB 3.87Å; V327-A331 WeakPolarHBondContact O-CB 3.45Å; V327-A331 PolarHBondContact O-N 3.46Å; A328-A331 PolarHBondContact O-N 3.4Å; E329-A331 VanDerWaalsContact C-N 3.31Å; E329-A331 PolarHBondContact O-N 3.08Å; A331-Y333 PolarHBondContact O-N 3.19Å; A331-Y334 WeakPolarHBondContact O-CB 3.42Å; A331-Y334 PolarHBondContact O-N 2.81Å; A331-W335 VanDerWaalsContact O-CZ3 3.31Å; A331-W335 WeakPolarHBondContact O-CZ3 3.36Å
332L95.3Very high94.2Very high4 Ų448.1 Ų48.12%0.02124%0.242CC..Hα-helixtrans-66.9-22.7178.2-72.6165000113.3V320 A328 E329 Y334 W335 L359 I371 L374 I375 A378V320-L332 HydrophobicContact CG1-CD2 4.01Å; V320-L332 HydrophobicContact CG1-CG 4.33Å; V320-L332 HydrophobicContact CG2-CD2 4.08Å; V320-L332 HydrophobicContact CG2-CG 4.14Å; A328-L332 WeakPolarHBondContact O-CB 3.21Å; A328-L332 WeakPolarHBondContact O-CD1 3.43Å; A328-L332 VanDerWaalsContact O-CG 3.25Å; A328-L332 WeakPolarHBondContact O-CG 3.29Å; A328-L332 PolarHBondContact O-N 3.08Å; E329-L332 PolarHBondContact O-N 3.38Å; E329-L332 VanDerWaalsContact O-N 3.14Å; L332-Y334 PolarHBondContact O-N 3.4Å; L332-W335 HydrophobicContact CD2-CE3 4.34Å; L332-W335 HydrophobicContact CD2-CZ3 4.14Å; L332-W335 PolarHBondContact O-N 2.88Å; L332-L359 HydrophobicContact CD2-CD2 3.87Å; L332-I371 HydrophobicContact CD1-CG2 3.91Å; L332-L374 HydrophobicContact CB-CB 4.06Å; L332-L374 HydrophobicContact CB-CD1 4.28Å; L332-L374 HydrophobicContact CD1-CB 3.72Å; L332-L374 HydrophobicContact CD1-CD1 4.47Å; L332-L374 HydrophobicContact CG-CB 4.39Å; L332-I375 HydrophobicContact CD1-CG1 3.74Å; L332-I375 HydrophobicContact CD2-CG1 4.16Å; L332-A378 HydrophobicContact CD2-CB 4.23Å
333Y95.2Very high94.9Very high82 Ų8247.1 Ų47.132%0.32223%0.231SC..G310 helixtrans-65-17.8173.8-88.3-60.9000114.1E329 R330 A331 W335 N336E329-Y333 HydrophobicContact CG-CD2 3.8Å; E329-Y333 HydrophobicContact CG-CE2 3.4Å; E329-Y333 VanDerWaalsContact CG-CE2 3.4Å; E329-Y333 VanDerWaalsContact O-CD2 3.24Å; E329-Y333 WeakPolarHBondContact O-CD2 3.3Å; E329-Y333 PolarHBondContact O-N 3.31Å; R330-Y333 PolarHBondContact O-N 2.97Å; A331-Y333 PolarHBondContact O-N 3.19Å; Y333-W335 PolarHBondContact O-N 2.8Å; Y333-W335 VanDerWaalsContact O-N 3.17Å; Y333-N336 VanDerWaalsContact CD1-ND2 3.28Å; Y333-N336 WeakPolarHBondContact CD1-ND2 3.33Å; Y333-N336 WeakPolarHBondContact O-CB 3.18Å; Y333-N336 PolarHBondContact O-N 3.41Å
334Y96.3Very high95.5Very high2 Ų242 Ų421%0.00820%0.197CC..G310 helixtrans-59.6-27.8174.8-81.635000112.5L290 L293 E294 L297 L316 A331 L332 N336 N337 V340L290-Y334 WeakPolarHBondContact O-CE1 3.49Å; L290-Y334 PolarHBondContact O-OH 2.93Å; L293-Y334 WeakPolarHBondContact CB-OH 3.49Å; E294-Y334 HydrophobicContact CB-CD1 4.4Å; E294-Y334 HydrophobicContact CB-CE1 3.71Å; E294-Y334 HydrophobicContact CG-CD1 4.46Å; E294-Y334 HydrophobicContact CG-CE1 4.24Å; E294-Y334 PolarHBondContact N-OH 3.1Å; E294-Y334 VanDerWaalsContact N-OH 3.08Å; L297-Y334 HydrophobicContact CD1-CD2 3.99Å; L297-Y334 HydrophobicContact CD1-CE2 3.62Å; L316-Y334 HydrophobicContact CD1-CD2 3.88Å; L316-Y334 HydrophobicContact CD1-CE2 3.98Å; L316-Y334 HydrophobicContact CD2-CD2 4.1Å; L316-Y334 HydrophobicContact CD2-CE2 3.82Å; A331-Y334 WeakPolarHBondContact O-CB 3.42Å; A331-Y334 PolarHBondContact O-N 2.81Å; L332-Y334 PolarHBondContact O-N 3.4Å; Y334-N336 PolarHBondContact O-N 3.32Å; Y334-N337 WeakPolarHBondContact O-CB 3.24Å; Y334-N337 PolarHBondContact O-N 2.85Å; Y334-V340 HydrophobicContact CD2-CG1 4.46Å
335W94.7Very high95.7Very high11 Ų1142.6 Ų42.64%0.04220%0.202CC..G310 helixtrans-71.3-11.1176.8-78.1-99.5000113.4V320 A331 L332 Y333 M341 M355 L359 A378 L381V320-W335 HydrophobicContact CG2-CH2 4.38Å; V320-W335 HydrophobicContact CG2-CZ3 4.39Å; A331-W335 VanDerWaalsContact O-CZ3 3.31Å; A331-W335 WeakPolarHBondContact O-CZ3 3.36Å; L332-W335 HydrophobicContact CD2-CE3 4.34Å; L332-W335 HydrophobicContact CD2-CZ3 4.14Å; L332-W335 PolarHBondContact O-N 2.88Å; Y333-W335 PolarHBondContact O-N 2.8Å; Y333-W335 VanDerWaalsContact O-N 3.17Å; W335-M341 HydrophobicContact CB-SD 4.17Å; W335-M341 HydrophobicContact CG-SD 4.19Å; W335-M341 VanDerWaalsContact O-CG 3.27Å; W335-M341 WeakPolarHBondContact O-CG 3.34Å; W335-M355 HydrophobicContact CH2-CE 3.57Å; W335-M355 HydrophobicContact CZ2-CE 4.01Å; W335-L359 HydrophobicContact CZ2-CD1 4.24Å; W335-A378 HydrophobicContact CD2-CB 3.97Å; W335-A378 HydrophobicContact CG-CB 3.98Å; W335-L381 HydrophobicContact CB-CD1 4.18Å
336N93.2Very high96Very high90 Ų9044.1 Ų44.148%0.48121%0.214SC..G310 helixtrans-91.7-9.9174.1-64.8-11.3000112.4Y333 Y334Y333-N336 VanDerWaalsContact CD1-ND2 3.28Å; Y333-N336 WeakPolarHBondContact CD1-ND2 3.33Å; Y333-N336 WeakPolarHBondContact O-CB 3.18Å; Y333-N336 PolarHBondContact O-N 3.41Å; Y334-N336 PolarHBondContact O-N 3.32Å
337N94.8Very high96.1Very high21 Ų2140.4 Ų40.411%0.11220%0.197CC..  trans-83.5115.9177.3-177.4-41.4000109.9E294 D298 Y334 Y339 V340 M341E294-N337 WeakPolarHBondContact OE1-CB 3.25Å; E294-N337 PolarHBondContact OE1-ND2 2.79Å; D298-N337 PolarHBondContact OD1-ND2 2.87Å; Y334-N337 WeakPolarHBondContact O-CB 3.24Å; Y334-N337 PolarHBondContact O-N 2.85Å; N337-Y339 VanDerWaalsContact C-N 3.33Å; N337-Y339 PolarHBondContact O-N 2.78Å; N337-Y339 PolarHBondContact OD1-N 2.88Å; N337-V340 HydrophobicContact CB-CB 3.96Å; N337-V340 HydrophobicContact CB-CG2 3.91Å; N337-V340 PolarHBondContact O-N 3.24Å; N337-V340 PolarHBondContact OD1-N 2.93Å; N337-V340 VanDerWaalsContact OD1-N 3.12Å; N337-M341 WeakPolarHBondContact O-CB 3.48Å; N337-M341 WeakPolarHBondContact O-CG 3.41Å; N337-M341 PolarHBondContact O-N 2.9Å
338E95.7Very high96.1Very high172 Ų17241 Ų4180%0.80420%0.199SC*.Hα-helixtrans-61.8-37.8-175-64.4-173.2165.200113T342E338-T342 PolarHBondContact O-N 3.01Å; E338-T342 PolarHBondContact O-OG1 2.83Å
339Y97.6Very high96.1Very high81 Ų8148.2 Ų48.232%0.31823%0.233SC..Hα-helixtrans-72.9-46-179.5-175.1-119000111.2L297 I300 N337 M341 T342 L343L297-Y339 VanDerWaalsContact O-CD1 3.25Å; L297-Y339 WeakPolarHBondContact O-CD1 3.03Å; L297-Y339 WeakPolarHBondContact O-CE1 3.39Å; I300-Y339 HydrophobicContact CG2-CE1 4.32Å; I300-Y339 PolarHBondContact O-OH 3.48Å; N337-Y339 VanDerWaalsContact C-N 3.33Å; N337-Y339 PolarHBondContact O-N 2.78Å; N337-Y339 PolarHBondContact OD1-N 2.88Å; Y339-M341 VanDerWaalsContact C-N 3.25Å; Y339-M341 PolarHBondContact O-N 3.28Å; Y339-T342 WeakPolarHBondContact O-CB 3.3Å; Y339-T342 PolarHBondContact O-N 2.88Å; Y339-L343 HydrophobicContact CD1-CD1 4.15Å; Y339-L343 HydrophobicContact CE1-CD1 3.8Å; Y339-L343 HydrophobicContact CE1-CG 4.35Å; Y339-L343 PolarHBondContact O-N 3.45Å
340V97.1Very high96.3Very high0 Ų048.6 Ų48.60%024%0.239CC..Hα-helixtrans-57.2-42.2173.3176.60000110.7L297 Y334 N337 T342 L343 I344L297-V340 HydrophobicContact CB-CG2 3.9Å; L297-V340 HydrophobicContact CD1-CG1 4.38Å; L297-V340 HydrophobicContact CD1-CG2 4.03Å; Y334-V340 HydrophobicContact CD2-CG1 4.46Å; N337-V340 HydrophobicContact CB-CB 3.96Å; N337-V340 HydrophobicContact CB-CG2 3.91Å; N337-V340 PolarHBondContact O-N 3.24Å; N337-V340 PolarHBondContact OD1-N 2.93Å; N337-V340 VanDerWaalsContact OD1-N 3.12Å; V340-T342 VanDerWaalsContact C-N 3.31Å; V340-T342 PolarHBondContact O-N 3.47Å; V340-L343 WeakPolarHBondContact O-CB 3.47Å; V340-L343 PolarHBondContact O-N 3.1Å; V340-I344 HydrophobicContact CG1-CD1 3.87Å; V340-I344 HydrophobicContact CG1-CG1 4.4Å; V340-I344 VanDerWaalsContact O-CG1 3.29Å; V340-I344 WeakPolarHBondContact O-CG1 3.05Å; V340-I344 PolarHBondContact O-N 3.41Å
341M96Very high96.3Very high26 Ų2647 Ų4713%0.12823%0.233CC..Hα-helixtrans-63.3-35.3176.9-77.6-64.9-7300113.2W335 N337 Y339 I344 N345 L381 M385W335-M341 HydrophobicContact CB-SD 4.17Å; W335-M341 HydrophobicContact CG-SD 4.19Å; W335-M341 VanDerWaalsContact O-CG 3.27Å; W335-M341 WeakPolarHBondContact O-CG 3.34Å; N337-M341 WeakPolarHBondContact O-CB 3.48Å; N337-M341 WeakPolarHBondContact O-CG 3.41Å; N337-M341 PolarHBondContact O-N 2.9Å; Y339-M341 VanDerWaalsContact C-N 3.25Å; Y339-M341 PolarHBondContact O-N 3.28Å; M341-I344 PolarHBondContact O-N 2.81Å; M341-I344 HydrophobicContact SD-CD1 4.19Å; M341-N345 WeakPolarHBondContact O-CB 3.42Å; M341-N345 PolarHBondContact O-N 2.82Å; M341-L381 HydrophobicContact CE-CB 3.95Å; M341-L381 HydrophobicContact CE-CD1 3.93Å; M341-L381 HydrophobicContact CE-CD2 4.23Å; M341-L381 HydrophobicContact CE-CG 4.26Å; M341-M385 HydrophobicContact CE-CE 3.17Å; M341-M385 HydrophobicContact SD-CE 3.97Å
342T97.1Very high96.2Very high74 Ų7447 Ų4745%0.45423%0.233SC..Hα-helixtrans-65.6-46.1173.6-55.80000110.9E338 Y339 V340 I344 N345 D346E338-T342 PolarHBondContact O-N 3.01Å; E338-T342 PolarHBondContact O-OG1 2.83Å; Y339-T342 WeakPolarHBondContact O-CB 3.3Å; Y339-T342 PolarHBondContact O-N 2.88Å; V340-T342 VanDerWaalsContact C-N 3.31Å; V340-T342 PolarHBondContact O-N 3.47Å; T342-I344 VanDerWaalsContact C-N 3.29Å; T342-I344 PolarHBondContact O-N 2.8Å; T342-N345 PolarHBondContact O-N 3.01Å; T342-D346 PolarHBondContact O-N 2.92Å
343L97.4Very high96.3Very high3 Ų349.6 Ų49.62%0.01625%0.25CC..Hα-helixtrans-60.6-38.5175.7-67.1172.8000112.3I300 P302 F305 Y339 V340 N347I300-L343 HydrophobicContact CG2-CD1 3.63Å; P302-L343 HydrophobicContact CB-CD2 4.34Å; P302-L343 HydrophobicContact CG-CD2 4.22Å; F305-L343 HydrophobicContact CB-CD2 4.39Å; F305-L343 HydrophobicContact CD1-CB 4.13Å; F305-L343 HydrophobicContact CD1-CD2 4.24Å; F305-L343 HydrophobicContact CD2-CD1 3.98Å; F305-L343 HydrophobicContact CE1-CB 3.87Å; F305-L343 HydrophobicContact CE2-CB 4.28Å; F305-L343 HydrophobicContact CE2-CD1 4.25Å; F305-L343 HydrophobicContact CG-CB 4.45Å; F305-L343 HydrophobicContact CG-CD1 4.19Å; F305-L343 HydrophobicContact CG-CD2 4.24Å; F305-L343 HydrophobicContact CZ-CB 3.94Å; Y339-L343 HydrophobicContact CD1-CD1 4.15Å; Y339-L343 HydrophobicContact CE1-CD1 3.8Å; Y339-L343 HydrophobicContact CE1-CG 4.35Å; Y339-L343 PolarHBondContact O-N 3.45Å; V340-L343 WeakPolarHBondContact O-CB 3.47Å; V340-L343 PolarHBondContact O-N 3.1Å; L343-N347 PolarHBondContact O-N 3.33Å; L343-N347 PolarHBondContact O-ND2 3.25Å
344I97.1Very high96.3Very high2 Ų247.8 Ų47.81%0.0125%0.245CC..Hα-helixtrans-64.1-48.1175.2-69.7167.1000110.6F313 V340 M341 T342 D346 N347 I348 I351 L382 M385F313-I344 HydrophobicContact CE1-CD1 3.88Å; F313-I344 HydrophobicContact CE1-CG1 3.9Å; F313-I344 HydrophobicContact CZ-CD1 3.86Å; F313-I344 HydrophobicContact CZ-CG1 3.56Å; V340-I344 HydrophobicContact CG1-CD1 3.87Å; V340-I344 HydrophobicContact CG1-CG1 4.4Å; V340-I344 VanDerWaalsContact O-CG1 3.29Å; V340-I344 WeakPolarHBondContact O-CG1 3.05Å; V340-I344 PolarHBondContact O-N 3.41Å; M341-I344 PolarHBondContact O-N 2.81Å; M341-I344 HydrophobicContact SD-CD1 4.19Å; T342-I344 VanDerWaalsContact C-N 3.29Å; T342-I344 PolarHBondContact O-N 2.8Å; I344-D346 VanDerWaalsContact C-N 3.33Å; I344-D346 PolarHBondContact O-N 3.02Å; I344-N347 CarbonylContact O-C 3.59Å; I344-N347 PolarHBondContact O-N 3.2Å; I344-N347 VanDerWaalsContact O-N 3.16Å; I344-I348 HydrophobicContact CG2-CD1 4.03Å; I344-I348 WeakPolarHBondContact O-CA 3.5Å; I344-I348 PolarHBondContact O-N 3.01Å; I344-I351 HydrophobicContact CB-CD1 4.38Å; I344-I351 HydrophobicContact CG1-CD1 4.19Å; I344-I351 HydrophobicContact CG2-CG2 4.15Å; I344-L382 HydrophobicContact CG2-CD2 4.28Å; I344-M385 HydrophobicContact CG2-CE 4.18Å; I344-M385 HydrophobicContact CG2-SD 3.91Å
345N96.6Very high96.3Very high73 Ų7347.7 Ų47.739%0.3925%0.245SC..Hα-helixtrans-58.7-45.1-179-174.765.4000111.8M341 T342 N347 I348 M385M341-N345 WeakPolarHBondContact O-CB 3.42Å; M341-N345 PolarHBondContact O-N 2.82Å; T342-N345 PolarHBondContact O-N 3.01Å; N345-N347 PolarHBondContact O-N 2.98Å; N345-I348 PolarHBondContact O-N 3.44Å; N345-M385 HydrophobicContact CB-CE 4.08Å; N345-M385 HydrophobicContact CB-SD 4.38Å
346D96.9Very high96.3Very high109 Ų10947.2 Ų47.258%0.58324%0.243SC*.Hα-helixtrans-68-19.5-179-71.5-6.5000113.5T342 I344T342-D346 PolarHBondContact O-N 2.92Å; I344-D346 VanDerWaalsContact C-N 3.33Å; I344-D346 PolarHBondContact O-N 3.02Å
347N97.3Very high96.3Very high18 Ų1845.1 Ų45.110%0.09623%0.234CC..THydrogen-bonded Turntrans-124.625.7-177.6-57.8-83.6000112.4F305 K306 M309 L343 I344 N345 E349 V350 I351F305-N347 HydrophobicContact CE1-CB 4.38Å; K306-N347 VanDerWaalsContact CE-OD1 3.24Å; K306-N347 WeakPolarHBondContact CE-OD1 3.27Å; M309-N347 HydrophobicContact SD-CB 3.71Å; L343-N347 PolarHBondContact O-N 3.33Å; L343-N347 PolarHBondContact O-ND2 3.25Å; I344-N347 CarbonylContact O-C 3.59Å; I344-N347 PolarHBondContact O-N 3.2Å; I344-N347 VanDerWaalsContact O-N 3.16Å; N345-N347 PolarHBondContact O-N 2.98Å; N347-E349 PolarHBondContact O-N 2.98Å; N347-E349 VanDerWaalsContact O-N 3.16Å; N347-V350 PolarHBondContact O-N 3.38Å; N347-V350 VanDerWaalsContact O-N 3.07Å; N347-I351 HydrophobicContact CB-CD1 3.89Å; N347-I351 HydrophobicContact CB-CG1 4.5Å; N347-I351 PolarHBondContact O-N 3.47Å; N347-I351 VanDerWaalsContact O-N 3.13Å
348I96.5Very high96.2Very high12 Ų1244.4 Ų44.46%0.06223%0.232CC..Hα-helixtrans-60.3-31.5-171.3-16662.8000112.9I344 N345 V350 I351 L352 L382 M385 N386 L389I344-I348 HydrophobicContact CG2-CD1 4.03Å; I344-I348 WeakPolarHBondContact O-CA 3.5Å; I344-I348 PolarHBondContact O-N 3.01Å; N345-I348 PolarHBondContact O-N 3.44Å; I348-V350 PolarHBondContact O-N 3.24Å; I348-I351 PolarHBondContact O-N 3.23Å; I348-L352 HydrophobicContact CD1-CB 3.88Å; I348-L352 HydrophobicContact CG1-CB 4.1Å; I348-L352 HydrophobicContact CG1-CD2 4.44Å; I348-L352 VanDerWaalsContact O-CB 3.25Å; I348-L352 WeakPolarHBondContact O-CB 3.38Å; I348-L352 PolarHBondContact O-N 3.31Å; I348-L382 HydrophobicContact CD1-CD2 3.73Å; I348-M385 HydrophobicContact CD1-CB 4.31Å; I348-M385 HydrophobicContact CD1-SD 3.8Å; I348-M385 HydrophobicContact CG1-CB 4.24Å; I348-N386 HydrophobicContact CG1-CB 4.32Å; I348-N386 HydrophobicContact CG2-CB 4.22Å; I348-L389 WeakPolarHBondContact O-CD2 3.32Å
349E96.4Very high96.1Very high152 Ų15236.2 Ų36.271%0.7119%0.194SC*.Hα-helixtrans-58.3-31.4178.3-64.5-171.3171.400113.1N347 P353N347-E349 PolarHBondContact O-N 2.98Å; N347-E349 VanDerWaalsContact O-N 3.16Å; E349-P353 WeakPolarHBondContact O-CD 3.37Å; E349-P353 WeakPolarHBondContact O-CG 3.4Å
350V97.2Very high95.7Very high53 Ų5332.7 Ų32.732%0.32118%0.18SC..Hα-helixtrans-96.5-39.9178.4-175.10000111.3M309 E310 N347 I348 L354M309-V350 HydrophobicContact CE-CB 3.92Å; M309-V350 HydrophobicContact CE-CG1 3.94Å; M309-V350 HydrophobicContact CE-CG2 3.87Å; E310-V350 HydrophobicContact CG-CG1 3.73Å; N347-V350 PolarHBondContact O-N 3.38Å; N347-V350 VanDerWaalsContact O-N 3.07Å; I348-V350 PolarHBondContact O-N 3.24Å; V350-L354 HydrophobicContact CG1-CD1 4.4Å; V350-L354 WeakPolarHBondContact O-CG 3.24Å
351I97.1Very high95.3Very high1 Ų136.9 Ų36.91%0.00520%0.201CC..Hα-helixtrans-75-42.1-172.1-68.1167.7000112.1F305 F313 I344 N347 I348 L354 M355F305-I351 HydrophobicContact CE1-CD1 4.02Å; F305-I351 HydrophobicContact CZ-CD1 3.93Å; F313-I351 HydrophobicContact CD1-CG2 3.52Å; F313-I351 HydrophobicContact CD2-CD1 4.36Å; F313-I351 HydrophobicContact CD2-CG1 4.25Å; F313-I351 HydrophobicContact CE1-CG2 3.64Å; F313-I351 HydrophobicContact CE2-CD1 4.02Å; F313-I351 HydrophobicContact CE2-CG1 4.4Å; F313-I351 HydrophobicContact CG-CG1 4.36Å; F313-I351 HydrophobicContact CG-CG2 4.02Å; F313-I351 HydrophobicContact CZ-CD1 4.14Å; F313-I351 HydrophobicContact CZ-CG2 4.25Å; I344-I351 HydrophobicContact CB-CD1 4.38Å; I344-I351 HydrophobicContact CG1-CD1 4.19Å; I344-I351 HydrophobicContact CG2-CG2 4.15Å; N347-I351 HydrophobicContact CB-CD1 3.89Å; N347-I351 HydrophobicContact CB-CG1 4.5Å; N347-I351 PolarHBondContact O-N 3.47Å; N347-I351 VanDerWaalsContact O-N 3.13Å; I348-I351 PolarHBondContact O-N 3.23Å; I351-L354 WeakPolarHBondContact O-CB 3.37Å; I351-L354 PolarHBondContact O-N 3.15Å; I351-L354 VanDerWaalsContact O-N 3.12Å; I351-M355 HydrophobicContact CG2-CG 4.14Å; I351-M355 PolarHBondContact O-N 3.48Å; I351-M355 VanDerWaalsContact O-N 3.08Å
352L95.7Very high94.9Very high0 Ų036.6 Ų36.60%020%0.2CC..Hα-helixtrans-60.3-48.2-175.7178.956.4000112.5I348 L354 M355 F356 L382 L389 F390I348-L352 HydrophobicContact CD1-CB 3.88Å; I348-L352 HydrophobicContact CG1-CB 4.1Å; I348-L352 HydrophobicContact CG1-CD2 4.44Å; I348-L352 VanDerWaalsContact O-CB 3.25Å; I348-L352 WeakPolarHBondContact O-CB 3.38Å; I348-L352 PolarHBondContact O-N 3.31Å; L352-L354 PolarHBondContact O-N 3.19Å; L352-L354 VanDerWaalsContact O-N 3.17Å; L352-M355 PolarHBondContact O-N 2.75Å; L352-F356 HydrophobicContact CD1-CB 4.28Å; L352-F356 HydrophobicContact CD1-CD2 4.38Å; L352-F356 WeakPolarHBondContact O-CB 3.09Å; L352-F356 PolarHBondContact O-N 3.28Å; L352-L382 HydrophobicContact CD1-CB 3.87Å; L352-L382 HydrophobicContact CD1-CD1 3.82Å; L352-L382 HydrophobicContact CD1-CD2 4.16Å; L352-L382 HydrophobicContact CD1-CG 4.16Å; L352-L389 HydrophobicContact CB-CD2 4.06Å; L352-L389 HydrophobicContact CD2-CB 4.13Å; L352-L389 HydrophobicContact CD2-CD2 3.92Å; L352-L389 HydrophobicContact CD2-CG 3.88Å; L352-L389 HydrophobicContact CG-CD2 4.46Å; L352-F390 HydrophobicContact CD1-CD2 4.3Å; L352-F390 HydrophobicContact CD2-CB 4.15Å; L352-F390 HydrophobicContact CD2-CD2 4.46Å
353P95.8Very high94.3Very high59 Ų5933.1 Ų33.138%0.38318%0.179SC..Hα-helixtrans-59.6-27.2176.5-2534.6000114.6E349 P357E349-P353 WeakPolarHBondContact O-CD 3.37Å; E349-P353 WeakPolarHBondContact O-CG 3.4Å; P353-P357 WeakPolarHBondContact O-CD 3.34Å
354L96.2Very high93.7Very high44 Ų4436.4 Ų36.423%0.2319%0.193CC..Hα-helixtrans-78.1-41.4179-64.2175.8000112.1E310 F313 K314 V350 I351 L352E310-L354 HydrophobicContact CB-CD1 4.46Å; E310-L354 HydrophobicContact CG-CD1 4.22Å; F313-L354 HydrophobicContact CB-CD1 4.44Å; K314-L354 HydrophobicContact CD-CD2 4.45Å; K314-L354 HydrophobicContact CG-CD1 4.45Å; K314-L354 HydrophobicContact CG-CD2 4.01Å; V350-L354 HydrophobicContact CG1-CD1 4.4Å; V350-L354 WeakPolarHBondContact O-CG 3.24Å; I351-L354 WeakPolarHBondContact O-CB 3.37Å; I351-L354 PolarHBondContact O-N 3.15Å; I351-L354 VanDerWaalsContact O-N 3.12Å; L352-L354 PolarHBondContact O-N 3.19Å; L352-L354 VanDerWaalsContact O-N 3.17Å
355M96.1Very high92.7Very high0 Ų040.4 Ų40.40%022%0.221CC..Hα-helixtrans-85.4-29.9-176.2-69-55.5-49.100113.6F313 L316 A317 V320 W335 I351 L352 A358 L359F313-M355 HydrophobicContact CB-CG 4.45Å; F313-M355 HydrophobicContact CB-SD 4.13Å; F313-M355 HydrophobicContact CD1-CG 3.7Å; F313-M355 HydrophobicContact CD1-SD 3.78Å; F313-M355 HydrophobicContact CG-SD 4.46Å; L316-M355 HydrophobicContact CB-SD 4.28Å; A317-M355 HydrophobicContact CB-CE 4.06Å; A317-M355 HydrophobicContact CB-SD 3.78Å; V320-M355 HydrophobicContact CG2-CE 4.29Å; W335-M355 HydrophobicContact CH2-CE 3.57Å; W335-M355 HydrophobicContact CZ2-CE 4.01Å; I351-M355 HydrophobicContact CG2-CG 4.14Å; I351-M355 PolarHBondContact O-N 3.48Å; I351-M355 VanDerWaalsContact O-N 3.08Å; L352-M355 PolarHBondContact O-N 2.75Å; M355-A358 PolarHBondContact O-N 3.26Å; M355-L359 HydrophobicContact CB-CD1 4.26Å; M355-L359 PolarHBondContact O-N 3.39Å; M355-L359 VanDerWaalsContact O-N 3.12Å
356F94.4Very high92Very high2 Ų238.2 Ų38.21%0.00921%0.209CC..Hα-helixtrans-55.4-47.6-172.8-176.7-88.2000113.8L352 A358 L359 Y360 F390 C393 T394 Y397L352-F356 HydrophobicContact CD1-CB 4.28Å; L352-F356 HydrophobicContact CD1-CD2 4.38Å; L352-F356 WeakPolarHBondContact O-CB 3.09Å; L352-F356 PolarHBondContact O-N 3.28Å; F356-A358 VanDerWaalsContact C-N 3.32Å; F356-A358 PolarHBondContact O-N 2.74Å; F356-L359 PolarHBondContact O-N 2.99Å; F356-Y360 AromaticContact CE1-CD2 3.88Å; F356-Y360 HydrophobicContact CE1-CD2 3.88Å; F356-Y360 HydrophobicContact CE1-CG 4.01Å; F356-Y360 HydrophobicContact CE2-CD2 4.33Å; F356-Y360 AromaticContact CZ-CD2 3.52Å; F356-Y360 HydrophobicContact CZ-CD2 3.52Å; F356-Y360 HydrophobicContact CZ-CE2 4.23Å; F356-Y360 HydrophobicContact CZ-CG 4.11Å; F356-Y360 VanDerWaalsContact O-CB 3.24Å; F356-Y360 WeakPolarHBondContact O-CB 3.35Å; F356-Y360 PolarHBondContact O-N 2.91Å; F356-F390 HydrophobicContact CD2-CD2 4.25Å; F356-F390 HydrophobicContact CD2-CE2 4.01Å; F356-F390 HydrophobicContact CD2-CZ 4.39Å; F356-F390 HydrophobicContact CE2-CD1 4.39Å; F356-F390 HydrophobicContact CE2-CD2 4.16Å; F356-F390 HydrophobicContact CE2-CE1 4.01Å; F356-F390 AromaticContact CE2-CE2 3.76Å; F356-F390 HydrophobicContact CE2-CE2 3.76Å; F356-F390 HydrophobicContact CE2-CG 4.46Å; F356-F390 AromaticContact CE2-CZ 3.69Å; F356-F390 HydrophobicContact CE2-CZ 3.69Å; F356-C393 HydrophobicContact CB-CB 4.23Å; F356-C393 HydrophobicContact CD1-CB 4.07Å; F356-C393 HydrophobicContact CD2-CB 4.09Å; F356-C393 HydrophobicContact CG-CB 3.86Å; F356-T394 HydrophobicContact CZ-CG2 4.41Å; F356-T394 WeakPolarHBondContact CZ-OG1 3.11Å; F356-Y397 HydrophobicContact CE1-CG 4.23Å
357P92.6Very high91.4Very high45 Ų4541.3 Ų41.329%0.29221%0.212SC..Hα-helixtrans-58.5-43.1-179.6-24.735.4000112.8P353 I361 Y397P353-P357 WeakPolarHBondContact O-CD 3.34Å; P357-I361 WeakPolarHBondContact O-CB 3.22Å; P357-I361 WeakPolarHBondContact O-CD1 3.41Å; P357-I361 WeakPolarHBondContact O-CG1 3.4Å; P357-I361 PolarHBondContact O-N 2.79Å; P357-I361 VanDerWaalsContact O-N 3.08Å; P357-Y397 HydrophobicContact CB-CD2 3.99Å; P357-Y397 HydrophobicContact CB-CE2 3.92Å; P357-Y397 HydrophobicContact CG-CD2 4.24Å
358A93Very high91Very high7 Ų741.8 Ų41.86%0.05822%0.215CC..Hα-helixtrans-64.3-47179.700000111.8A317 S321 M355 F356 N362A317-A358 HydrophobicContact CB-CB 3.86Å; A317-A358 VanDerWaalsContact O-CB 3.3Å; A317-A358 WeakPolarHBondContact O-CB 3.32Å; S321-A358 VanDerWaalsContact OG-CB 3.23Å; S321-A358 WeakPolarHBondContact OG-CB 3.46Å; M355-A358 PolarHBondContact O-N 3.26Å; F356-A358 VanDerWaalsContact C-N 3.32Å; F356-A358 PolarHBondContact O-N 2.74Å; A358-N362 PolarHBondContact O-N 3.33Å; A358-N362 PolarHBondContact O-ND2 3.18Å
359L93.1Very high90.6Very high0 Ų048.4 Ų48.40%024%0.243CC..Hα-helixtrans-67.9-41.4179.3-68.3168.9000112V320 L332 W335 M355 F356 N362 S363 I375 A378 L379 L382V320-L359 HydrophobicContact CG1-CD2 3.8Å; L332-L359 HydrophobicContact CD2-CD2 3.87Å; W335-L359 HydrophobicContact CZ2-CD1 4.24Å; M355-L359 HydrophobicContact CB-CD1 4.26Å; M355-L359 PolarHBondContact O-N 3.39Å; M355-L359 VanDerWaalsContact O-N 3.12Å; F356-L359 PolarHBondContact O-N 2.99Å; L359-N362 PolarHBondContact O-N 2.86Å; L359-S363 WeakPolarHBondContact O-CB 3.32Å; L359-S363 PolarHBondContact O-N 2.67Å; L359-I375 HydrophobicContact CB-CG2 4.32Å; L359-I375 HydrophobicContact CD2-CB 4.48Å; L359-I375 HydrophobicContact CD2-CG1 4.27Å; L359-I375 HydrophobicContact CD2-CG2 4.09Å; L359-I375 VanDerWaalsContact O-CG2 3.27Å; L359-I375 WeakPolarHBondContact O-CG2 3.47Å; L359-A378 HydrophobicContact CD1-CB 4.39Å; L359-A378 HydrophobicContact CD2-CB 4.16Å; L359-L379 HydrophobicContact CB-CD1 4.46Å; L359-L379 HydrophobicContact CB-CD2 3.71Å; L359-L379 HydrophobicContact CB-CG 3.97Å; L359-L379 HydrophobicContact CD1-CD2 4.37Å; L359-L382 HydrophobicContact CD1-CD1 3.45Å; L359-L382 VanDerWaalsContact CD1-CD1 3.45Å
360Y90.1Very high90.2Very high6 Ų643 Ų432%0.02422%0.221CC..Hα-helixtrans-66.8-41.9-178-170.8-87000112.6F356 S363 Y397 E455 M457F356-Y360 AromaticContact CE1-CD2 3.88Å; F356-Y360 HydrophobicContact CE1-CD2 3.88Å; F356-Y360 HydrophobicContact CE1-CG 4.01Å; F356-Y360 HydrophobicContact CE2-CD2 4.33Å; F356-Y360 AromaticContact CZ-CD2 3.52Å; F356-Y360 HydrophobicContact CZ-CD2 3.52Å; F356-Y360 HydrophobicContact CZ-CE2 4.23Å; F356-Y360 HydrophobicContact CZ-CG 4.11Å; F356-Y360 VanDerWaalsContact O-CB 3.24Å; F356-Y360 WeakPolarHBondContact O-CB 3.35Å; F356-Y360 PolarHBondContact O-N 2.91Å; Y360-S363 PolarHBondContact O-N 3.22Å; Y360-S363 PolarHBondContact O-OG 3.17Å; Y360-Y397 AromaticContact CD1-CD1 3.91Å; Y360-Y397 HydrophobicContact CD1-CD1 3.91Å; Y360-Y397 AromaticContact CD1-CE1 3.51Å; Y360-Y397 HydrophobicContact CD1-CE1 3.51Å; Y360-Y397 HydrophobicContact CE1-CD1 4.15Å; Y360-Y397 AromaticContact CE1-CE1 3.82Å; Y360-Y397 HydrophobicContact CE1-CE1 3.82Å; Y360-Y397 HydrophobicContact CG-CE1 4.42Å; Y360-E455 PolarHBondContact OH-O 2.93Å; Y360-M457 HydrophobicContact CD2-CE 3.46Å; Y360-M457 VanDerWaalsContact CD2-CE 3.46Å; Y360-M457 HydrophobicContact CD2-CG 4.23Å; Y360-M457 HydrophobicContact CD2-SD 4.46Å; Y360-M457 HydrophobicContact CE2-CB 3.85Å; Y360-M457 HydrophobicContact CE2-CE 3.82Å; Y360-M457 HydrophobicContact CE2-CG 3.6Å; Y360-M457 HydrophobicContact CE2-SD 4.4Å
361I88.5Confident89.9Confident88 Ų8840.5 Ų40.545%0.45121%0.205SC..Hα-helixtrans-62.5-47.8177.8-69.9165.7000110.3P357 S363 K364 Y397P357-I361 WeakPolarHBondContact O-CB 3.22Å; P357-I361 WeakPolarHBondContact O-CD1 3.41Å; P357-I361 WeakPolarHBondContact O-CG1 3.4Å; P357-I361 PolarHBondContact O-N 2.79Å; P357-I361 VanDerWaalsContact O-N 3.08Å; I361-S363 VanDerWaalsContact C-N 3.31Å; I361-S363 PolarHBondContact O-N 3.12Å; I361-K364 PolarHBondContact O-N 3.33Å; I361-Y397 HydrophobicContact CD1-CE2 4.34Å; I361-Y397 WeakPolarHBondContact CD1-OH 3.25Å; I361-Y397 HydrophobicContact CG1-CE2 4.4Å; I361-Y397 WeakPolarHBondContact CG1-OH 3.46Å
362N86.9Confident89.6Confident20 Ų2042.7 Ų42.711%0.10722%0.215CC..Hα-helixtrans-77.4-15.8-175.1-68-77.9000113S321 A358 L359 K364 S365 H366 I375S321-N362 WeakPolarHBondContact CA-ND2 3.24Å; S321-N362 PolarHBondContact OG-ND2 2.85Å; A358-N362 PolarHBondContact O-N 3.33Å; A358-N362 PolarHBondContact O-ND2 3.18Å; L359-N362 PolarHBondContact O-N 2.86Å; N362-K364 VanDerWaalsContact C-N 3.32Å; N362-S365 CarbonylContact O-C 3.57Å; N362-H366 WeakPolarHBondContact O-CB 3.41Å; N362-I375 HydrophobicContact CB-CD1 3.48Å; N362-I375 VanDerWaalsContact CB-CD1 3.48Å
363S85.8Confident89.4Confident1 Ų143 Ų431%0.00722%0.218CC..Hα-helixtrans-73.7-22.817174.80000113.2L359 Y360 I361 H372 Y376L359-S363 WeakPolarHBondContact O-CB 3.32Å; L359-S363 PolarHBondContact O-N 2.67Å; Y360-S363 PolarHBondContact O-N 3.22Å; Y360-S363 PolarHBondContact O-OG 3.17Å; I361-S363 VanDerWaalsContact C-N 3.31Å; I361-S363 PolarHBondContact O-N 3.12Å; S363-H372 PolarHBondContact O-CD2 3.14Å; S363-H372 PolarHBondContact O-NE2 3.15Å; S363-Y376 PolarHBondContact O-OH 2.89Å
364K84Confident89.2Confident72 Ų7240.4 Ų40.431%0.31320%0.202SC..Hα-helixtrans-78-40.7177.4-67.8-69.1-173.1170.90112.4I361 N362 E455I361-K364 PolarHBondContact O-N 3.33Å; N362-K364 VanDerWaalsContact C-N 3.32Å; K364-E455 PolarHBondContact NZ-O 2.97Å
365S76.5Confident89.1Confident87 Ų8738.3 Ų38.361%0.60819%0.191SC*.  trans-153.2112.6170.9750000111.3N362N362-S365 CarbonylContact O-C 3.57Å
366H81.2Confident88.8Confident26 Ų2639.3 Ų39.312%0.1220%0.195CC..  trans-125.3135.4164.2-166.6-84.5000108.6N362 N368 H372N362-H366 WeakPolarHBondContact O-CB 3.41Å; H366-N368 VanDerWaalsContact C-N 3.27Å; H366-N368 PolarHBondContact ND1-N 2.94Å; H366-N368 VanDerWaalsContact ND1-N 3.15Å; H366-N368 PolarHBondContact ND1-O 2.95Å; H366-N368 VanDerWaalsContact ND1-O 3.15Å; H366-N368 PolarHBondContact O-N 3.3Å; H366-H372 HydrophobicContact CB-CB 4.42Å
367W85.8Confident88.7Confident174 Ų17440 Ų4066%0.65920%0.198SC*.SBendtrans-68.1-28.3-174.266.2-92.8000112.8C323 F325C323-W367 PolarHBondContact O-NE1 3.41Å; C323-W367 VanDerWaalsContact O-NE1 3.14Å; F325-W367 HydrophobicContact CB-CH2 4.05Å; F325-W367 HydrophobicContact CB-CZ2 3.83Å; F325-W367 HydrophobicContact CD1-CH2 4.08Å; F325-W367 HydrophobicContact CD1-CZ2 4.32Å; F325-W367 HydrophobicContact CG-CH2 4.31Å; F325-W367 HydrophobicContact CG-CZ2 4.47Å
368N87.1Confident88.8Confident28 Ų2837.9 Ų37.915%0.1519%0.185CC..  trans-95.8121.3177-174.3-47.5000110.6H366 T370 I371 H372H366-N368 VanDerWaalsContact C-N 3.27Å; H366-N368 PolarHBondContact ND1-N 2.94Å; H366-N368 VanDerWaalsContact ND1-N 3.15Å; H366-N368 PolarHBondContact ND1-O 2.95Å; H366-N368 VanDerWaalsContact ND1-O 3.15Å; H366-N368 PolarHBondContact O-N 3.3Å; N368-T370 WeakPolarHBondContact OD1-CB 3.38Å; N368-T370 PolarHBondContact OD1-N 3.37Å; N368-I371 HydrophobicContact CB-CB 4.31Å; N368-I371 HydrophobicContact CB-CG1 3.87Å; N368-I371 PolarHBondContact OD1-N 3.41Å; N368-H372 PolarHBondContact O-N 3.46Å; N368-H372 VanDerWaalsContact O-N 3.15Å
369K88.2Confident88.8Confident151 Ų15137.6 Ų37.666%0.65718%0.182SC*.Hα-helixtrans-65.1-37.1-178.8-67.5-175.3176.5-174.70113.9H372 G373K369-H372 WeakPolarHBondContact O-CB 3.29Å; K369-H372 PolarHBondContact O-N 3.04Å; K369-G373 PolarHBondContact O-N 2.9Å
370T89.6Confident88.8Confident39 Ų3939.9 Ų39.924%0.23919%0.192CC..Hα-helixtrans-63.2-46.9179-52.40000110.6N368 H372 G373 L374 M473N368-T370 WeakPolarHBondContact OD1-CB 3.38Å; N368-T370 PolarHBondContact OD1-N 3.37Å; T370-H372 VanDerWaalsContact C-N 3.31Å; T370-H372 PolarHBondContact O-N 3.41Å; T370-G373 PolarHBondContact O-N 3.29Å; T370-L374 WeakPolarHBondContact O-CG 3.42Å; T370-L374 PolarHBondContact O-N 3.5Å; T370-M473 HydrophobicContact CG2-SD 4.42Å
371I90.3Very high88.9Confident0 Ų041.4 Ų41.40%020%0.201CC..Hα-helixtrans-60-44.3175.5-56.6-58.9000110.8F325 A328 E329 L332 N368 G373 L374 I375F325-I371 HydrophobicContact CB-CD1 4.5Å; F325-I371 HydrophobicContact CB-CG1 4.31Å; F325-I371 WeakPolarHBondContact O-CD1 3.4Å; A328-I371 HydrophobicContact CB-CD1 4.15Å; A328-I371 HydrophobicContact CB-CG2 4.13Å; E329-I371 HydrophobicContact CB-CD1 3.54Å; E329-I371 HydrophobicContact CG-CD1 4.44Å; L332-I371 HydrophobicContact CD1-CG2 3.91Å; N368-I371 HydrophobicContact CB-CB 4.31Å; N368-I371 HydrophobicContact CB-CG1 3.87Å; N368-I371 PolarHBondContact OD1-N 3.41Å; I371-G373 VanDerWaalsContact C-N 3.27Å; I371-G373 PolarHBondContact O-N 2.91Å; I371-L374 PolarHBondContact O-N 3.04Å; I371-I375 HydrophobicContact CG2-CD1 3.77Å; I371-I375 HydrophobicContact CG2-CG1 4.3Å; I371-I375 VanDerWaalsContact O-CG1 3.28Å; I371-I375 WeakPolarHBondContact O-CG1 3.48Å; I371-I375 PolarHBondContact O-N 3.45Å
372H89.9Confident89.1Confident47 Ų4737.3 Ų37.322%0.21818%0.179CC..Hα-helixtrans-56.4-44.1177-168-118.3000111.5S363 H366 N368 K369 T370 I375 Y376S363-H372 PolarHBondContact O-CD2 3.14Å; S363-H372 PolarHBondContact O-NE2 3.15Å; H366-H372 HydrophobicContact CB-CB 4.42Å; N368-H372 PolarHBondContact O-N 3.46Å; N368-H372 VanDerWaalsContact O-N 3.15Å; K369-H372 WeakPolarHBondContact O-CB 3.29Å; K369-H372 PolarHBondContact O-N 3.04Å; T370-H372 VanDerWaalsContact C-N 3.31Å; T370-H372 PolarHBondContact O-N 3.41Å; H372-I375 PolarHBondContact O-N 3.38Å; H372-Y376 AromaticContact CE1-CE2 3.41Å; H372-Y376 VanDerWaalsContact CE1-CE2 3.41Å; H372-Y376 WeakPolarHBondContact CE1-CE2 3.42Å; H372-Y376 AromaticContact ND1-CE2 3.87Å; H372-Y376 AromaticContact NE2-CE2 3.54Å; H372-Y376 VanDerWaalsContact O-CD2 3.31Å; H372-Y376 WeakPolarHBondContact O-CD2 3.38Å; H372-Y376 PolarHBondContact O-N 3.24Å; H372-Y376 VanDerWaalsContact O-N 3.12Å
373G91.2Very high89.4Confident6 Ų636.5 Ų36.56%0.06218%0.175CC..Hα-helixtrans-64.7-42174.800000114.6K369 T370 I371 I375 Y376 N377K369-G373 PolarHBondContact O-N 2.9Å; T370-G373 PolarHBondContact O-N 3.29Å; I371-G373 VanDerWaalsContact C-N 3.27Å; I371-G373 PolarHBondContact O-N 2.91Å; G373-I375 VanDerWaalsContact C-N 3.34Å; G373-Y376 PolarHBondContact O-N 3.47Å; G373-N377 PolarHBondContact O-N 3.12Å
374L92.8Very high89.7Confident6 Ų641.6 Ų41.63%0.03120%0.199CC..Hα-helixtrans-63.4-39175.1-71.9173.4000111.9E329 L332 T370 I371 N377 A378 M473E329-L374 HydrophobicContact CG-CD1 4.13Å; L332-L374 HydrophobicContact CB-CB 4.06Å; L332-L374 HydrophobicContact CB-CD1 4.28Å; L332-L374 HydrophobicContact CD1-CB 3.72Å; L332-L374 HydrophobicContact CD1-CD1 4.47Å; L332-L374 HydrophobicContact CG-CB 4.39Å; T370-L374 WeakPolarHBondContact O-CG 3.42Å; T370-L374 PolarHBondContact O-N 3.5Å; I371-L374 PolarHBondContact O-N 3.04Å; L374-N377 PolarHBondContact O-N 3.34Å; L374-A378 WeakPolarHBondContact O-CB 3.24Å; L374-A378 PolarHBondContact O-N 2.84Å; L374-M473 HydrophobicContact CD2-CE 4.2Å; L374-M473 HydrophobicContact CD2-SD 3.96Å; L374-M473 HydrophobicContact CG-SD 4.3Å
375I93.2Very high90.2Very high0 Ų040.3 Ų40.30%019%0.194CC..Hα-helixtrans-61.9-46.3175.4-71.1164.8000110.8L332 L359 N362 I371 H372 G373 N377 A378 L379L332-I375 HydrophobicContact CD1-CG1 3.74Å; L332-I375 HydrophobicContact CD2-CG1 4.16Å; L359-I375 HydrophobicContact CB-CG2 4.32Å; L359-I375 HydrophobicContact CD2-CB 4.48Å; L359-I375 HydrophobicContact CD2-CG1 4.27Å; L359-I375 HydrophobicContact CD2-CG2 4.09Å; L359-I375 VanDerWaalsContact O-CG2 3.27Å; L359-I375 WeakPolarHBondContact O-CG2 3.47Å; N362-I375 HydrophobicContact CB-CD1 3.48Å; N362-I375 VanDerWaalsContact CB-CD1 3.48Å; I371-I375 HydrophobicContact CG2-CD1 3.77Å; I371-I375 HydrophobicContact CG2-CG1 4.3Å; I371-I375 VanDerWaalsContact O-CG1 3.28Å; I371-I375 WeakPolarHBondContact O-CG1 3.48Å; I371-I375 PolarHBondContact O-N 3.45Å; H372-I375 PolarHBondContact O-N 3.38Å; G373-I375 VanDerWaalsContact C-N 3.34Å; I375-N377 VanDerWaalsContact C-N 3.33Å; I375-N377 PolarHBondContact O-N 2.73Å; I375-A378 PolarHBondContact O-N 3.11Å; I375-L379 HydrophobicContact CG2-CD1 3.83Å; I375-L379 HydrophobicContact CG2-CG 4.41Å; I375-L379 WeakPolarHBondContact O-CB 3.24Å; I375-L379 WeakPolarHBondContact O-CG 3.49Å; I375-L379 PolarHBondContact O-N 3.34Å
376Y91.2Very high91Very high21 Ų2138.4 Ų38.48%0.08218%0.177CC..Hα-helixtrans-63.8-38.7176.8-84.6-67.6000112.6S363 H372 G373 L379 K380 M457 E465S363-Y376 PolarHBondContact O-OH 2.89Å; H372-Y376 AromaticContact CE1-CE2 3.41Å; H372-Y376 VanDerWaalsContact CE1-CE2 3.41Å; H372-Y376 WeakPolarHBondContact CE1-CE2 3.42Å; H372-Y376 AromaticContact ND1-CE2 3.87Å; H372-Y376 AromaticContact NE2-CE2 3.54Å; H372-Y376 VanDerWaalsContact O-CD2 3.31Å; H372-Y376 WeakPolarHBondContact O-CD2 3.38Å; H372-Y376 PolarHBondContact O-N 3.24Å; H372-Y376 VanDerWaalsContact O-N 3.12Å; G373-Y376 PolarHBondContact O-N 3.47Å; Y376-L379 HydrophobicContact CD1-CD1 4.42Å; Y376-L379 PolarHBondContact O-N 2.68Å; Y376-K380 WeakPolarHBondContact O-CB 3.21Å; Y376-K380 PolarHBondContact O-N 2.88Å; Y376-M457 HydrophobicContact CE1-SD 3.94Å; Y376-E465 HydrophobicContact CD1-CB 3.65Å; Y376-E465 HydrophobicContact CD1-CG 4.41Å; Y376-E465 HydrophobicContact CD2-CB 3.67Å; Y376-E465 HydrophobicContact CD2-CG 4.45Å; Y376-E465 HydrophobicContact CE1-CB 3.77Å; Y376-E465 HydrophobicContact CE1-CG 4.01Å; Y376-E465 HydrophobicContact CE2-CB 3.77Å; Y376-E465 HydrophobicContact CE2-CG 4.03Å; Y376-E465 HydrophobicContact CG-CB 3.61Å
377N92.5Very high91.6Very high16 Ų1639.7 Ų39.79%0.08618%0.183CC..Hα-helixtrans-61.4-44.4173.4-174.162.1000111.3G373 L374 I375 K380 L381 K470G373-N377 PolarHBondContact O-N 3.12Å; L374-N377 PolarHBondContact O-N 3.34Å; I375-N377 VanDerWaalsContact C-N 3.33Å; I375-N377 PolarHBondContact O-N 2.73Å; N377-K380 WeakPolarHBondContact O-CB 3.19Å; N377-K380 PolarHBondContact O-N 2.74Å; N377-L381 WeakPolarHBondContact O-CG 3.31Å; N377-L381 PolarHBondContact O-N 3.17Å; N377-K470 VanDerWaalsContact OD1-CE 3.25Å; N377-K470 WeakPolarHBondContact OD1-CE 3.37Å
378A94.1Very high92Very high1 Ų138.4 Ų38.41%0.00818%0.182CC..Hα-helixtrans-62.8-4517600000112.4L332 W335 L359 L374 I375 K380 L381 L382L332-A378 HydrophobicContact CD2-CB 4.23Å; W335-A378 HydrophobicContact CD2-CB 3.97Å; W335-A378 HydrophobicContact CG-CB 3.98Å; L359-A378 HydrophobicContact CD1-CB 4.39Å; L359-A378 HydrophobicContact CD2-CB 4.16Å; L374-A378 WeakPolarHBondContact O-CB 3.24Å; L374-A378 PolarHBondContact O-N 2.84Å; I375-A378 PolarHBondContact O-N 3.11Å; A378-K380 VanDerWaalsContact C-N 3.32Å; A378-K380 PolarHBondContact O-N 2.84Å; A378-L381 PolarHBondContact O-N 3.32Å; A378-L382 WeakPolarHBondContact O-CG 3.33Å; A378-L382 PolarHBondContact O-N 2.7Å
379L93.4Very high92.3Very high0 Ų038.2 Ų38.20%018%0.181CC..Hα-helixtrans-60-41.4175.5-76.3164.5000112L359 I375 Y376 L382 M383 F390 M457 V462L359-L379 HydrophobicContact CB-CD1 4.46Å; L359-L379 HydrophobicContact CB-CD2 3.71Å; L359-L379 HydrophobicContact CB-CG 3.97Å; L359-L379 HydrophobicContact CD1-CD2 4.37Å; I375-L379 HydrophobicContact CG2-CD1 3.83Å; I375-L379 HydrophobicContact CG2-CG 4.41Å; I375-L379 WeakPolarHBondContact O-CB 3.24Å; I375-L379 WeakPolarHBondContact O-CG 3.49Å; I375-L379 PolarHBondContact O-N 3.34Å; Y376-L379 HydrophobicContact CD1-CD1 4.42Å; Y376-L379 PolarHBondContact O-N 2.68Å; L379-L382 PolarHBondContact O-N 3.05Å; L379-M383 WeakPolarHBondContact O-CB 3.2Å; L379-M383 PolarHBondContact O-N 2.98Å; L379-F390 HydrophobicContact CD2-CE2 3.96Å; L379-F390 HydrophobicContact CD2-CZ 4.11Å; L379-M457 HydrophobicContact CD1-CE 3.47Å; L379-M457 VanDerWaalsContact CD1-CE 3.47Å; L379-M457 HydrophobicContact CD1-SD 4.05Å; L379-M457 HydrophobicContact CD2-CE 3.83Å; L379-M457 HydrophobicContact CG-CE 4.15Å; L379-V462 HydrophobicContact CB-CG1 4.1Å
380K91.9Very high92.6Very high48 Ų4831 Ų3121%0.20915%0.15CC..Hα-helixtrans-60.2-49.5175.7-179.2176.4170.31680111.3Y376 N377 A378 L382 M383 E384 V462 A466Y376-K380 WeakPolarHBondContact O-CB 3.21Å; Y376-K380 PolarHBondContact O-N 2.88Å; N377-K380 WeakPolarHBondContact O-CB 3.19Å; N377-K380 PolarHBondContact O-N 2.74Å; A378-K380 VanDerWaalsContact C-N 3.32Å; A378-K380 PolarHBondContact O-N 2.84Å; K380-L382 VanDerWaalsContact C-N 3.32Å; K380-L382 PolarHBondContact O-N 3.37Å; K380-M383 WeakPolarHBondContact O-CB 3.26Å; K380-M383 PolarHBondContact O-N 2.72Å; K380-E384 WeakPolarHBondContact CE-OE1 3.25Å; K380-E384 IonicContact NZ-OE1 2.86Å; K380-E384 WeakPolarHBondContact O-CG 3.25Å; K380-E384 PolarHBondContact O-N 3.48Å; K380-V462 HydrophobicContact CB-CG1 3.81Å; K380-A466 HydrophobicContact CB-CB 4.25Å; K380-A466 HydrophobicContact CD-CB 3.93Å
381L93.4Very high92.7Very high39 Ų3932.4 Ų32.420%0.20416%0.156CC..Hα-helixtrans-60.2-42.5179.5-69.6167.3000111.7W335 M341 N377 A378 M383 E384 M385W335-L381 HydrophobicContact CB-CD1 4.18Å; M341-L381 HydrophobicContact CE-CB 3.95Å; M341-L381 HydrophobicContact CE-CD1 3.93Å; M341-L381 HydrophobicContact CE-CD2 4.23Å; M341-L381 HydrophobicContact CE-CG 4.26Å; N377-L381 WeakPolarHBondContact O-CG 3.31Å; N377-L381 PolarHBondContact O-N 3.17Å; A378-L381 PolarHBondContact O-N 3.32Å; L381-M383 VanDerWaalsContact C-N 3.34Å; L381-M383 PolarHBondContact O-N 3.29Å; L381-E384 PolarHBondContact O-N 3.09Å; L381-M385 WeakPolarHBondContact O-CG 3.29Å; L381-M385 PolarHBondContact O-N 3.32Å; L381-M385 VanDerWaalsContact O-N 3.08Å
382L92.9Very high92.9Very high1 Ų136.7 Ų36.71%0.00518%0.176CC..Hα-helixtrans-64.4-37.5176.7-70.4171.7000112.8I344 I348 L352 L359 A378 L379 K380 M385 N386 F390I344-L382 HydrophobicContact CG2-CD2 4.28Å; I348-L382 HydrophobicContact CD1-CD2 3.73Å; L352-L382 HydrophobicContact CD1-CB 3.87Å; L352-L382 HydrophobicContact CD1-CD1 3.82Å; L352-L382 HydrophobicContact CD1-CD2 4.16Å; L352-L382 HydrophobicContact CD1-CG 4.16Å; L359-L382 HydrophobicContact CD1-CD1 3.45Å; L359-L382 VanDerWaalsContact CD1-CD1 3.45Å; A378-L382 WeakPolarHBondContact O-CG 3.33Å; A378-L382 PolarHBondContact O-N 2.7Å; L379-L382 PolarHBondContact O-N 3.05Å; K380-L382 VanDerWaalsContact C-N 3.32Å; K380-L382 PolarHBondContact O-N 3.37Å; L382-M385 HydrophobicContact CD2-SD 4.33Å; L382-M385 PolarHBondContact O-N 3.34Å; L382-N386 PolarHBondContact O-N 3.18Å; L382-F390 HydrophobicContact CB-CD2 4.41Å
383M92.4Very high93.1Very high3 Ų335 Ų352%0.01517%0.17CC..Hα-helixtrans-68.5-38175.8-176.9176.261.100112L379 K380 L381 M385 N386 Q387 F390 R459 V462 E463L379-M383 WeakPolarHBondContact O-CB 3.2Å; L379-M383 PolarHBondContact O-N 2.98Å; K380-M383 WeakPolarHBondContact O-CB 3.26Å; K380-M383 PolarHBondContact O-N 2.72Å; L381-M383 VanDerWaalsContact C-N 3.34Å; L381-M383 PolarHBondContact O-N 3.29Å; M383-M385 VanDerWaalsContact C-N 3.32Å; M383-N386 CarbonylContact O-C 3.47Å; M383-Q387 WeakPolarHBondContact O-CA 3.45Å; M383-Q387 PolarHBondContact O-N 2.92Å; M383-Q387 VanDerWaalsContact O-N 3.14Å; M383-F390 HydrophobicContact CB-CD1 4.4Å; M383-F390 HydrophobicContact CB-CD2 3.93Å; M383-F390 HydrophobicContact CB-CE2 4.1Å; M383-F390 HydrophobicContact CB-CG 4.08Å; M383-F390 HydrophobicContact CB-CZ 4.41Å; M383-F390 HydrophobicContact CG-CD1 4.25Å; M383-F390 HydrophobicContact CG-CG 4.27Å; M383-F390 HydrophobicContact SD-CD1 4.5Å; M383-F390 HydrophobicContact SD-CE1 4.38Å; M383-R459 HydrophobicContact CE-CB 4.05Å; M383-R459 HydrophobicContact CE-CG 3.63Å; M383-R459 HydrophobicContact SD-CB 3.73Å; M383-R459 HydrophobicContact SD-CG 3.88Å; M383-V462 HydrophobicContact CE-CB 4.07Å; M383-V462 HydrophobicContact CE-CG1 4.02Å; M383-E463 HydrophobicContact CE-CG 4.3Å
384E92.8Very high93Very high109 Ų10935.1 Ų35.151%0.50917%0.169SC..Hα-helixtrans-65.2-34.2175-73.5174.9177.500112.4K380 L381K380-E384 WeakPolarHBondContact CE-OE1 3.25Å; K380-E384 IonicContact NZ-OE1 2.86Å; K380-E384 WeakPolarHBondContact O-CG 3.25Å; K380-E384 PolarHBondContact O-N 3.48Å; L381-E384 PolarHBondContact O-N 3.09Å
385M93.5Very high93Very high45 Ų4541.3 Ų41.322%0.22220%0.198CC..Hα-helixtrans-67.3-48.4176-70.8171.6171.900112.6M341 I344 N345 I348 L381 L382 M383M341-M385 HydrophobicContact CE-CE 3.17Å; M341-M385 HydrophobicContact SD-CE 3.97Å; I344-M385 HydrophobicContact CG2-CE 4.18Å; I344-M385 HydrophobicContact CG2-SD 3.91Å; N345-M385 HydrophobicContact CB-CE 4.08Å; N345-M385 HydrophobicContact CB-SD 4.38Å; I348-M385 HydrophobicContact CD1-CB 4.31Å; I348-M385 HydrophobicContact CD1-SD 3.8Å; I348-M385 HydrophobicContact CG1-CB 4.24Å; L381-M385 WeakPolarHBondContact O-CG 3.29Å; L381-M385 PolarHBondContact O-N 3.32Å; L381-M385 VanDerWaalsContact O-N 3.08Å; L382-M385 HydrophobicContact CD2-SD 4.33Å; L382-M385 PolarHBondContact O-N 3.34Å; M383-M385 VanDerWaalsContact C-N 3.32Å
386N93.6Very high92.9Very high47 Ų4745.1 Ų45.125%0.25122%0.224SC..  trans-153.688.5-179.7-167.4-28000112.5I348 L382 M383 K388 L389 F390I348-N386 HydrophobicContact CG1-CB 4.32Å; I348-N386 HydrophobicContact CG2-CB 4.22Å; L382-N386 PolarHBondContact O-N 3.18Å; M383-N386 CarbonylContact O-C 3.47Å; N386-K388 VanDerWaalsContact C-N 3.33Å; N386-K388 PolarHBondContact O-N 2.66Å; N386-K388 PolarHBondContact OD1-N 3.27Å; N386-L389 HydrophobicContact CB-CB 4.08Å; N386-L389 VanDerWaalsContact CG-CB 3.48Å; N386-L389 PolarHBondContact O-N 3.01Å; N386-L389 WeakPolarHBondContact OD1-CB 3.22Å; N386-L389 PolarHBondContact OD1-N 2.79Å; N386-F390 WeakPolarHBondContact O-CB 3.38Å; N386-F390 PolarHBondContact O-N 2.97Å
387Q93.1Very high92.8Very high52 Ų5246 Ų4624%0.24323%0.228CC..Hα-helixtrans-55.2-44.7179.2-176.971.657.500112.9M383 L389 F390 D391M383-Q387 WeakPolarHBondContact O-CA 3.45Å; M383-Q387 PolarHBondContact O-N 2.92Å; M383-Q387 VanDerWaalsContact O-N 3.14Å; Q387-L389 PolarHBondContact O-N 2.95Å; Q387-F390 WeakPolarHBondContact O-CB 3.45Å; Q387-F390 PolarHBondContact O-N 2.93Å; Q387-D391 PolarHBondContact NE2-OD1 3.3Å; Q387-D391 VanDerWaalsContact NE2-OD1 3.09Å; Q387-D391 VanDerWaalsContact O-CG 3.27Å; Q387-D391 PolarHBondContact O-N 2.87Å
388K94.7Very high92.6Very high147 Ų14748 Ų4864%0.63924%0.236SC*.Hα-helixtrans-63.5-46.6-175.5-174.8-172.8175.7-1590110.7N386 F390 D391 E392N386-K388 VanDerWaalsContact C-N 3.33Å; N386-K388 PolarHBondContact O-N 2.66Å; N386-K388 PolarHBondContact OD1-N 3.27Å; K388-F390 VanDerWaalsContact C-N 3.3Å; K388-F390 PolarHBondContact O-N 2.89Å; K388-D391 PolarHBondContact O-N 3.29Å; K388-E392 WeakPolarHBondContact CE-OE1 3.49Å; K388-E392 IonicContact NZ-OE1 3.76Å; K388-E392 WeakPolarHBondContact O-CG 3.47Å; K388-E392 PolarHBondContact O-N 3.43Å
389L94.3Very high92.5Very high24 Ų2454.1 Ų54.113%0.12626%0.262CS..Hα-helixtrans-66.6-34.6178-173.966.4000111.7I348 L352 N386 Q387 E392 C393I348-L389 WeakPolarHBondContact O-CD2 3.32Å; L352-L389 HydrophobicContact CB-CD2 4.06Å; L352-L389 HydrophobicContact CD2-CB 4.13Å; L352-L389 HydrophobicContact CD2-CD2 3.92Å; L352-L389 HydrophobicContact CD2-CG 3.88Å; L352-L389 HydrophobicContact CG-CD2 4.46Å; N386-L389 HydrophobicContact CB-CB 4.08Å; N386-L389 VanDerWaalsContact CG-CB 3.48Å; N386-L389 PolarHBondContact O-N 3.01Å; N386-L389 WeakPolarHBondContact OD1-CB 3.22Å; N386-L389 PolarHBondContact OD1-N 2.79Å; Q387-L389 PolarHBondContact O-N 2.95Å; L389-E392 PolarHBondContact O-N 2.89Å; L389-C393 WeakPolarHBondContact O-CB 3.5Å; L389-C393 PolarHBondContact O-N 2.95Å; L389-C393 PolarHBondContact O-SG 3.27Å
390F93.3Very high92.3Very high1 Ų162.7 Ų62.70%0.00429%0.294CS..Hα-helixtrans-62.1-44.1174.6-171-84.4000112.1L352 F356 L379 L382 M383 N386 Q387 K388 C393 T394 M457L352-F390 HydrophobicContact CD1-CD2 4.3Å; L352-F390 HydrophobicContact CD2-CB 4.15Å; L352-F390 HydrophobicContact CD2-CD2 4.46Å; F356-F390 HydrophobicContact CD2-CD2 4.25Å; F356-F390 HydrophobicContact CD2-CE2 4.01Å; F356-F390 HydrophobicContact CD2-CZ 4.39Å; F356-F390 HydrophobicContact CE2-CD1 4.39Å; F356-F390 HydrophobicContact CE2-CD2 4.16Å; F356-F390 HydrophobicContact CE2-CE1 4.01Å; F356-F390 AromaticContact CE2-CE2 3.76Å; F356-F390 HydrophobicContact CE2-CE2 3.76Å; F356-F390 HydrophobicContact CE2-CG 4.46Å; F356-F390 AromaticContact CE2-CZ 3.69Å; F356-F390 HydrophobicContact CE2-CZ 3.69Å; L379-F390 HydrophobicContact CD2-CE2 3.96Å; L379-F390 HydrophobicContact CD2-CZ 4.11Å; L382-F390 HydrophobicContact CB-CD2 4.41Å; M383-F390 HydrophobicContact CB-CD1 4.4Å; M383-F390 HydrophobicContact CB-CD2 3.93Å; M383-F390 HydrophobicContact CB-CE2 4.1Å; M383-F390 HydrophobicContact CB-CG 4.08Å; M383-F390 HydrophobicContact CB-CZ 4.41Å; M383-F390 HydrophobicContact CG-CD1 4.25Å; M383-F390 HydrophobicContact CG-CG 4.27Å; M383-F390 HydrophobicContact SD-CD1 4.5Å; M383-F390 HydrophobicContact SD-CE1 4.38Å; N386-F390 WeakPolarHBondContact O-CB 3.38Å; N386-F390 PolarHBondContact O-N 2.97Å; Q387-F390 WeakPolarHBondContact O-CB 3.45Å; Q387-F390 PolarHBondContact O-N 2.93Å; K388-F390 VanDerWaalsContact C-N 3.3Å; K388-F390 PolarHBondContact O-N 2.89Å; F390-C393 PolarHBondContact O-N 3.15Å; F390-T394 PolarHBondContact O-N 2.91Å; F390-T394 PolarHBondContact O-OG1 3.44Å; F390-M457 HydrophobicContact CZ-CE 4.14Å
391D92.5Very high92Very high68 Ų6864 Ų6436%0.36430%0.3SS..Hα-helixtrans-65.7-41176.4-63-24.3000111.2Q387 K388 T394 Q395Q387-D391 PolarHBondContact NE2-OD1 3.3Å; Q387-D391 VanDerWaalsContact NE2-OD1 3.09Å; Q387-D391 VanDerWaalsContact O-CG 3.27Å; Q387-D391 PolarHBondContact O-N 2.87Å; K388-D391 PolarHBondContact O-N 3.29Å; D391-T394 WeakPolarHBondContact O-CB 3.41Å; D391-T394 PolarHBondContact O-N 3.43Å; D391-Q395 WeakPolarHBondContact O-CG 3.42Å; D391-Q395 PolarHBondContact O-N 2.88Å
392E94.1Very high91.8Very high90 Ų9067 Ų6742%0.42131%0.313SS..Hα-helixtrans-61.6-43.6174.1-73.2174.1-170.700112K388 L389 T394 Q395 S396K388-E392 WeakPolarHBondContact CE-OE1 3.49Å; K388-E392 IonicContact NZ-OE1 3.76Å; K388-E392 WeakPolarHBondContact O-CG 3.47Å; K388-E392 PolarHBondContact O-N 3.43Å; L389-E392 PolarHBondContact O-N 2.89Å; E392-T394 VanDerWaalsContact C-N 3.33Å; E392-T394 PolarHBondContact O-N 3.08Å; E392-Q395 PolarHBondContact O-N 2.73Å; E392-S396 VanDerWaalsContact O-CB 3.31Å; E392-S396 WeakPolarHBondContact O-CB 3.34Å; E392-S396 PolarHBondContact O-N 2.87Å
393C93.4Very high91.8Very high12 Ų1271.6 Ų71.68%0.08133%0.334CS..Hα-helixtrans-62.6-40.3175.4-71.50000111.5F356 L389 F390 Q395 S396 Y397F356-C393 HydrophobicContact CB-CB 4.23Å; F356-C393 HydrophobicContact CD1-CB 4.07Å; F356-C393 HydrophobicContact CD2-CB 4.09Å; F356-C393 HydrophobicContact CG-CB 3.86Å; L389-C393 WeakPolarHBondContact O-CB 3.5Å; L389-C393 PolarHBondContact O-N 2.95Å; L389-C393 PolarHBondContact O-SG 3.27Å; F390-C393 PolarHBondContact O-N 3.15Å; C393-Q395 PolarHBondContact O-N 2.97Å; C393-S396 PolarHBondContact O-N 3.31Å; C393-Y397 VanDerWaalsContact O-CB 3.23Å; C393-Y397 WeakPolarHBondContact O-CB 3.37Å; C393-Y397 PolarHBondContact O-N 3.15Å
394T90.9Very high91.5Very high8 Ų877 Ų775%0.04936%0.36CS..Hα-helixtrans-60.6-45.8175.7-57.70000111.3F356 F390 D391 E392 K398 V456F356-T394 HydrophobicContact CZ-CG2 4.41Å; F356-T394 WeakPolarHBondContact CZ-OG1 3.11Å; F390-T394 PolarHBondContact O-N 2.91Å; F390-T394 PolarHBondContact O-OG1 3.44Å; D391-T394 WeakPolarHBondContact O-CB 3.41Å; D391-T394 PolarHBondContact O-N 3.43Å; E392-T394 VanDerWaalsContact C-N 3.33Å; E392-T394 PolarHBondContact O-N 3.08Å; T394-K398 WeakPolarHBondContact O-CG 3.1Å; T394-K398 PolarHBondContact O-N 3.38Å; T394-K398 VanDerWaalsContact O-N 3.13Å; T394-V456 HydrophobicContact CG2-CG1 4.5Å
395Q91.9Very high91.2Very high136 Ų13678.3 Ų78.364%0.63636%0.36SS*.Hα-helixtrans-67.1-44.2177.7-68.4174.926.600112.1D391 E392 C393 Y397 K398 K399D391-Q395 WeakPolarHBondContact O-CG 3.42Å; D391-Q395 PolarHBondContact O-N 2.88Å; E392-Q395 PolarHBondContact O-N 2.73Å; C393-Q395 PolarHBondContact O-N 2.97Å; Q395-Y397 VanDerWaalsContact C-N 3.34Å; Q395-Y397 PolarHBondContact O-N 3.32Å; Q395-K398 PolarHBondContact O-N 2.97Å; Q395-K399 WeakPolarHBondContact O-CB 3.41Å; Q395-K399 PolarHBondContact O-N 3.49Å
396S91.8Very high91.2Very high79 Ų7982 Ų8255%0.55238%0.375SS*.Hα-helixtrans-61.1-43177.9-173.80000111.5E392 C393 K399 R400E392-S396 VanDerWaalsContact O-CB 3.31Å; E392-S396 WeakPolarHBondContact O-CB 3.34Å; E392-S396 PolarHBondContact O-N 2.87Å; C393-S396 PolarHBondContact O-N 3.31Å; S396-K399 PolarHBondContact O-N 3.17Å; S396-R400 WeakPolarHBondContact O-CB 3.43Å; S396-R400 PolarHBondContact O-N 2.88Å
397Y89.4Confident91.1Very high40 Ų4088.9 Ų88.916%0.15740%0.397CS..Hα-helixtrans-60.9-47.1176-179.3-98.8000111.9F356 P357 Y360 I361 C393 Q395 K399 R400 K401F356-Y397 HydrophobicContact CE1-CG 4.23Å; P357-Y397 HydrophobicContact CB-CD2 3.99Å; P357-Y397 HydrophobicContact CB-CE2 3.92Å; P357-Y397 HydrophobicContact CG-CD2 4.24Å; Y360-Y397 AromaticContact CD1-CD1 3.91Å; Y360-Y397 HydrophobicContact CD1-CD1 3.91Å; Y360-Y397 AromaticContact CD1-CE1 3.51Å; Y360-Y397 HydrophobicContact CD1-CE1 3.51Å; Y360-Y397 HydrophobicContact CE1-CD1 4.15Å; Y360-Y397 AromaticContact CE1-CE1 3.82Å; Y360-Y397 HydrophobicContact CE1-CE1 3.82Å; Y360-Y397 HydrophobicContact CG-CE1 4.42Å; I361-Y397 HydrophobicContact CD1-CE2 4.34Å; I361-Y397 WeakPolarHBondContact CD1-OH 3.25Å; I361-Y397 HydrophobicContact CG1-CE2 4.4Å; I361-Y397 WeakPolarHBondContact CG1-OH 3.46Å; C393-Y397 VanDerWaalsContact O-CB 3.23Å; C393-Y397 WeakPolarHBondContact O-CB 3.37Å; C393-Y397 PolarHBondContact O-N 3.15Å; Q395-Y397 VanDerWaalsContact C-N 3.34Å; Q395-Y397 PolarHBondContact O-N 3.32Å; Y397-K399 PolarHBondContact O-N 2.93Å; Y397-R400 PolarHBondContact O-N 3.32Å; Y397-K401 PolarHBondContact O-N 3.29Å
398K87.7Confident91Very high58 Ų5889.5 Ų89.525%0.25240%0.402SS..Hα-helixtrans-58.9-47.3175.5-74.3-174.4176.2-157.60112.2T394 Q395 R400 K401 E402 G454T394-K398 WeakPolarHBondContact O-CG 3.1Å; T394-K398 PolarHBondContact O-N 3.38Å; T394-K398 VanDerWaalsContact O-N 3.13Å; Q395-K398 PolarHBondContact O-N 2.97Å; K398-R400 VanDerWaalsContact C-N 3.34Å; K398-R400 PolarHBondContact O-N 2.82Å; K398-K401 PolarHBondContact O-N 3.17Å; K398-E402 PolarHBondContact O-N 2.51Å; K398-G454 PolarHBondContact NZ-O 3.4Å
399K91Very high90.8Very high129 Ų12987.4 Ų87.456%0.56139%0.393SS*.Hα-helixtrans-59.4-45.4177.9-174.4-177.6176.8-170.60111.4Q395 S396 Y397 K401 E402 E403Q395-K399 WeakPolarHBondContact O-CB 3.41Å; Q395-K399 PolarHBondContact O-N 3.49Å; S396-K399 PolarHBondContact O-N 3.17Å; Y397-K399 PolarHBondContact O-N 2.93Å; K399-K401 VanDerWaalsContact C-N 3.33Å; K399-K401 PolarHBondContact O-N 2.51Å; K399-E402 PolarHBondContact O-N 3.11Å; K399-E403 WeakPolarHBondContact CE-OE1 3.17Å; K399-E403 WeakPolarHBondContact O-CG 3.32Å; K399-E403 PolarHBondContact O-N 2.8Å
400R90.2Very high90.7Very high180 Ų18092 Ų9268%0.67941%0.413SS*.Hα-helixtrans-61.4-41.8177.8-170.3177.8-177.9132.9-0.1111.7S396 Y397 K398 E403 E404S396-R400 WeakPolarHBondContact O-CB 3.43Å; S396-R400 PolarHBondContact O-N 2.88Å; Y397-R400 PolarHBondContact O-N 3.32Å; K398-R400 VanDerWaalsContact C-N 3.34Å; K398-R400 PolarHBondContact O-N 2.82Å; R400-E403 PolarHBondContact O-N 3.09Å; R400-E404 WeakPolarHBondContact O-CB 3.4Å; R400-E404 PolarHBondContact O-N 3.37Å
401K85.6Confident90.7Very high75 Ų7593.8 Ų93.833%0.32643%0.429SS..Hα-helixtrans-64.1-40.2176.4-165.5179.2-176.8179.40112.2Y397 K398 K399 E404 R405 D452Y397-K401 PolarHBondContact O-N 3.29Å; K398-K401 PolarHBondContact O-N 3.17Å; K399-K401 VanDerWaalsContact C-N 3.33Å; K399-K401 PolarHBondContact O-N 2.51Å; K401-E404 PolarHBondContact O-N 3.3Å; K401-R405 WeakPolarHBondContact O-CB 3.41Å; K401-R405 PolarHBondContact O-N 2.78Å; K401-D452 WeakPolarHBondContact CD-OD2 3.42Å; K401-D452 IonicContact NZ-OD1 3.84Å; K401-D452 IonicContact NZ-OD2 3.57Å; K401-D452 PolarHBondContact NZ-OD2 3.48Å
402E89.3Confident90.6Very high103 Ų10395.8 Ų95.848%0.48144%0.436SS..Hα-helixtrans-65.3-40.9174.2-74.2-175.1174.700112.9K398 K399 R405 K406K398-E402 PolarHBondContact O-N 2.51Å; K399-E402 PolarHBondContact O-N 3.11Å; E402-R405 PolarHBondContact O-N 3.42Å; E402-K406 WeakPolarHBondContact O-CG 3.23Å; E402-K406 PolarHBondContact O-N 3.44Å
403E91.5Very high90.6Very high97 Ų9798.4 Ų98.445%0.45345%0.446SS..Hα-helixtrans-64.7-41.1175.4-74174.7179.600111.8K399 R400 K406 R407K399-E403 WeakPolarHBondContact CE-OE1 3.17Å; K399-E403 WeakPolarHBondContact O-CG 3.32Å; K399-E403 PolarHBondContact O-N 2.8Å; R400-E403 PolarHBondContact O-N 3.09Å; E403-K406 PolarHBondContact O-N 2.84Å; E403-R407 PolarHBondContact O-N 3.1Å
404E87.9Confident90.6Very high117 Ų117103.1 Ų103.155%0.54747%0.47SS..Hα-helixtrans-63.4-43.6175.1-171.7162.9-155.500111.3R400 K401 K406 R407 L408R400-E404 WeakPolarHBondContact O-CB 3.4Å; R400-E404 PolarHBondContact O-N 3.37Å; K401-E404 PolarHBondContact O-N 3.3Å; E404-K406 VanDerWaalsContact C-N 3.31Å; E404-K406 PolarHBondContact O-N 3.34Å; E404-R407 PolarHBondContact O-N 2.93Å; E404-L408 WeakPolarHBondContact O-CG 3.26Å; E404-L408 PolarHBondContact O-N 3.34Å
405R86.3Confident90.6Very high136 Ų136111.4 Ų111.451%0.51350%0.5SS..Hα-helixtrans-60.1-39.3172.6-171.7-178.766.5161-4.3112.5K401 E402 K409K401-R405 WeakPolarHBondContact O-CB 3.41Å; K401-R405 PolarHBondContact O-N 2.78Å; E402-R405 PolarHBondContact O-N 3.42Å; R405-K409 WeakPolarHBondContact O-CG 3.41Å; R405-K409 PolarHBondContact O-N 3.28Å; R405-K409 VanDerWaalsContact O-N 3.16Å
406K92.2Very high90.6Very high123 Ų123107.1 Ų107.154%0.53549%0.485SS..Hα-helixtrans-65.6-45.5175.3-75.3175.7-176.1174.30111.2E402 E403 E404 L408 K409 E410E402-K406 WeakPolarHBondContact O-CG 3.23Å; E402-K406 PolarHBondContact O-N 3.44Å; E403-K406 PolarHBondContact O-N 2.84Å; E404-K406 VanDerWaalsContact C-N 3.31Å; E404-K406 PolarHBondContact O-N 3.34Å; K406-L408 VanDerWaalsContact C-N 3.33Å; K406-L408 PolarHBondContact O-N 3.01Å; K406-K409 PolarHBondContact O-N 3.09Å; K406-E410 WeakPolarHBondContact O-CG 3.43Å; K406-E410 PolarHBondContact O-N 3.01Å
407R92.3Very high90.6Very high191 Ų191109 Ų10972%0.72149%0.485SS*.Hα-helixtrans-58.9-42.1175.7-87.7-174.6172.2179-0.6112.6E403 E404 E410 A411E403-R407 PolarHBondContact O-N 3.1Å; E404-R407 PolarHBondContact O-N 2.93Å; R407-E410 PolarHBondContact O-N 3.34Å; R407-A411 WeakPolarHBondContact O-CB 3.32Å; R407-A411 PolarHBondContact O-N 2.96Å
408L90.1Very high90.7Very high65 Ų65110.5 Ų110.534%0.3450%0.498SS..Hα-helixtrans-61.2-45.8176.4-74.9170.2000111.5E404 K406 E410 A411 E412 Y445E404-L408 WeakPolarHBondContact O-CG 3.26Å; E404-L408 PolarHBondContact O-N 3.34Å; K406-L408 VanDerWaalsContact C-N 3.33Å; K406-L408 PolarHBondContact O-N 3.01Å; L408-E410 VanDerWaalsContact C-N 3.34Å; L408-E410 PolarHBondContact O-N 3.2Å; L408-A411 PolarHBondContact O-N 3.1Å; L408-E412 WeakPolarHBondContact O-CB 3.43Å; L408-E412 PolarHBondContact O-N 3.38Å; L408-Y445 HydrophobicContact CD1-CD1 4.3Å; L408-Y445 HydrophobicContact CD2-CD1 3.58Å; L408-Y445 HydrophobicContact CD2-CE1 3.43Å; L408-Y445 VanDerWaalsContact CD2-CE1 3.43Å; L408-Y445 HydrophobicContact CD2-CG 4.46Å; L408-Y445 HydrophobicContact CG-CD1 4.49Å
409K91.4Very high90.6Very high103 Ų103113.6 Ų113.645%0.44851%0.514SS..Hα-helixtrans-64.3-35.8175.7-71.1-179.4179.1-169.70113.2R405 K406 K413R405-K409 WeakPolarHBondContact O-CG 3.41Å; R405-K409 PolarHBondContact O-N 3.28Å; R405-K409 VanDerWaalsContact O-N 3.16Å; K406-K409 PolarHBondContact O-N 3.09Å; K409-K413 WeakPolarHBondContact O-CG 3.45Å; K409-K413 PolarHBondContact O-N 3.08Å; K409-K413 VanDerWaalsContact O-N 3.13Å
410E92.7Very high90.5Very high120 Ų120113.9 Ų113.956%0.56152%0.515SS*.Hα-helixtrans-68.3-43.3174.7-74.9171.8-17800111.5K406 R407 L408 K413 L414K406-E410 WeakPolarHBondContact O-CG 3.43Å; K406-E410 PolarHBondContact O-N 3.01Å; R407-E410 PolarHBondContact O-N 3.34Å; L408-E410 VanDerWaalsContact C-N 3.34Å; L408-E410 PolarHBondContact O-N 3.2Å; E410-K413 PolarHBondContact O-N 3.43Å; E410-L414 PolarHBondContact O-N 3.09Å
411A92.4Very high90.5Very high39 Ų39111 Ų11132%0.32251%0.512SS..Hα-helixtrans-61.6-43.7175.600000111.5R407 L408 K413 L414 W415R407-A411 WeakPolarHBondContact O-CB 3.32Å; R407-A411 PolarHBondContact O-N 2.96Å; L408-A411 PolarHBondContact O-N 3.1Å; A411-K413 VanDerWaalsContact C-N 3.35Å; A411-K413 PolarHBondContact O-N 3.1Å; A411-L414 WeakPolarHBondContact O-CB 3.13Å; A411-L414 PolarHBondContact O-N 3.44Å; A411-W415 PolarHBondContact O-N 3.18Å
412E91Very high90.5Very high111 Ų111109.6 Ų109.652%0.51952%0.515SS..Hα-helixtrans-60.3-42176-172.3-176.3-172.500112.4L408 W415 S416L408-E412 WeakPolarHBondContact O-CB 3.43Å; L408-E412 PolarHBondContact O-N 3.38Å; E412-W415 PolarHBondContact O-N 3.24Å; E412-S416 WeakPolarHBondContact O-CB 3.4Å; E412-S416 PolarHBondContact O-N 2.96Å; E412-S416 PolarHBondContact O-OG 3.38Å
413K92.8Very high90.3Very high145 Ų145108.6 Ų108.663%0.6351%0.512SS*.Hα-helixtrans-62.5-45173.6-76.3177.3-179.5-177.30112K409 E410 A411 S416 E417K409-K413 WeakPolarHBondContact O-CG 3.45Å; K409-K413 PolarHBondContact O-N 3.08Å; K409-K413 VanDerWaalsContact O-N 3.13Å; E410-K413 PolarHBondContact O-N 3.43Å; A411-K413 VanDerWaalsContact C-N 3.35Å; A411-K413 PolarHBondContact O-N 3.1Å; K413-S416 WeakPolarHBondContact O-CB 3.42Å; K413-S416 PolarHBondContact O-N 3.42Å; K413-E417 WeakPolarHBondContact O-CG 2.98Å; K413-E417 PolarHBondContact O-N 2.94Å
414L93.9Very high90Very high111 Ų111111.2 Ų111.258%0.58152%0.524SS*.Hα-helixtrans-60.2-45.9177.6-115.1140.7000111.3E410 A411 S416 E417 V418E410-L414 PolarHBondContact O-N 3.09Å; A411-L414 WeakPolarHBondContact O-CB 3.13Å; A411-L414 PolarHBondContact O-N 3.44Å; L414-S416 VanDerWaalsContact C-N 3.33Å; L414-S416 PolarHBondContact O-N 3.23Å; L414-E417 PolarHBondContact O-N 3.23Å; L414-V418 WeakPolarHBondContact O-CG2 3.43Å; L414-V418 PolarHBondContact O-N 2.85Å
415W91.5Very high89.9Confident182 Ų182108.5 Ų108.569%0.68952%0.518SS*.Hα-helixtrans-62.1-40.4174.8-79.6116000112.3A411 E412 E417 V418 E419A411-W415 PolarHBondContact O-N 3.18Å; E412-W415 PolarHBondContact O-N 3.24Å; W415-E417 VanDerWaalsContact C-N 3.31Å; W415-E417 PolarHBondContact O-N 3.44Å; W415-V418 PolarHBondContact O-N 2.87Å; W415-E419 WeakPolarHBondContact O-CB 3.44Å; W415-E419 PolarHBondContact O-N 3.21Å
416S91.5Very high89.6Confident45 Ų45107.9 Ų107.932%0.31553%0.531SS..Hα-helixtrans-63.9-34.6175.3-60.40000112.6E412 K413 L414 K420E412-S416 WeakPolarHBondContact O-CB 3.4Å; E412-S416 PolarHBondContact O-N 2.96Å; E412-S416 PolarHBondContact O-OG 3.38Å; K413-S416 WeakPolarHBondContact O-CB 3.42Å; K413-S416 PolarHBondContact O-N 3.42Å; L414-S416 VanDerWaalsContact C-N 3.33Å; L414-S416 PolarHBondContact O-N 3.23Å; S416-K420 VanDerWaalsContact O-CG 3.29Å; S416-K420 WeakPolarHBondContact O-CG 3.34Å; S416-K420 PolarHBondContact O-N 3.21Å; S416-K420 VanDerWaalsContact O-N 3.08Å
417E91.8Very high89Confident119 Ų119106.6 Ų106.656%0.55653%0.531SS*.Hα-helixtrans-70.9-42.1174.7-75.1179.8-178.400112K413 L414 W415 E419 K420 L421K413-E417 WeakPolarHBondContact O-CG 2.98Å; K413-E417 PolarHBondContact O-N 2.94Å; L414-E417 PolarHBondContact O-N 3.23Å; W415-E417 VanDerWaalsContact C-N 3.31Å; W415-E417 PolarHBondContact O-N 3.44Å; E417-E419 VanDerWaalsContact C-N 3.3Å; E417-E419 PolarHBondContact O-N 3.49Å; E417-K420 PolarHBondContact O-N 2.96Å; E417-L421 WeakPolarHBondContact O-CG 3.15Å; E417-L421 PolarHBondContact O-N 3.35Å
418V91Very high88.4Confident72 Ų72101.3 Ų101.344%0.43651%0.511SS..Hα-helixtrans-59.1-44.1173.3172.10000110.5L414 W415 L421 A422L414-V418 WeakPolarHBondContact O-CG2 3.43Å; L414-V418 PolarHBondContact O-N 2.85Å; W415-V418 PolarHBondContact O-N 2.87Å; V418-L421 PolarHBondContact O-N 2.82Å; V418-A422 WeakPolarHBondContact O-CB 3.42Å; V418-A422 PolarHBondContact O-N 3.14Å
419E86.8Confident87.7Confident122 Ų122106.5 Ų106.557%0.5753%0.531SS*.Hα-helixtrans-61.4-45.4177-172.4175.1-157.800111.8W415 E417 L421 A422 I423W415-E419 WeakPolarHBondContact O-CB 3.44Å; W415-E419 PolarHBondContact O-N 3.21Å; E417-E419 VanDerWaalsContact C-N 3.3Å; E417-E419 PolarHBondContact O-N 3.49Å; E419-L421 PolarHBondContact O-N 3.24Å; E419-A422 WeakPolarHBondContact O-CB 3.34Å; E419-A422 PolarHBondContact O-N 3.41Å; E419-I423 HydrophobicContact CG-CD1 4.14Å; E419-I423 WeakPolarHBondContact O-CD1 3.34Å; E419-I423 VanDerWaalsContact O-CG1 3.28Å; E419-I423 WeakPolarHBondContact O-CG1 3.42Å; E419-I423 PolarHBondContact O-N 3.33Å
420K89.1Confident87Confident135 Ų135108.3 Ų108.359%0.58754%0.541SS*.Hα-helixtrans-60.7-41.8175.5-74.5171.1-173.8174.10112.7S416 E417 Q424S416-K420 VanDerWaalsContact O-CG 3.29Å; S416-K420 WeakPolarHBondContact O-CG 3.34Å; S416-K420 PolarHBondContact O-N 3.21Å; S416-K420 VanDerWaalsContact O-N 3.08Å; E417-K420 PolarHBondContact O-N 2.96Å; K420-Q424 WeakPolarHBondContact O-CG 3.45Å; K420-Q424 PolarHBondContact O-N 3.23Å
421L88.5Confident86.2Confident119 Ų119106.1 Ų106.162%0.62354%0.536SS*.Hα-helixtrans-67.3-39.5176.4-74.8168.7000111.5E417 V418 E419 I423 Q424 S425E417-L421 WeakPolarHBondContact O-CG 3.15Å; E417-L421 PolarHBondContact O-N 3.35Å; V418-L421 PolarHBondContact O-N 2.82Å; E419-L421 PolarHBondContact O-N 3.24Å; L421-I423 PolarHBondContact O-N 2.99Å; L421-Q424 PolarHBondContact O-N 3.42Å; L421-S425 PolarHBondContact O-N 3.17Å
422A85.8Confident85.4Confident46 Ų46105.9 Ų105.938%0.3853%0.534SS..Hα-helixtrans-61.5-43.4176.400000111.4V418 E419 Q424 S425 Y428V418-A422 WeakPolarHBondContact O-CB 3.42Å; V418-A422 PolarHBondContact O-N 3.14Å; E419-A422 WeakPolarHBondContact O-CB 3.34Å; E419-A422 PolarHBondContact O-N 3.41Å; A422-Q424 PolarHBondContact O-N 3.27Å; A422-S425 WeakPolarHBondContact O-CB 3.34Å; A422-S425 PolarHBondContact O-N 3.5Å; A422-S425 VanDerWaalsContact O-N 3.13Å; A422-Y428 WeakPolarHBondContact O-CB 3.35Å; A422-Y428 VanDerWaalsContact O-CD2 3.31Å; A422-Y428 WeakPolarHBondContact O-CD2 3.5Å
423I85.3Confident84.5Confident83 Ų83108.7 Ų108.743%0.42655%0.547SS..Hα-helixtrans-59.6-33.7177-68.7160.4000112.4E419 L421 S425 Y428E419-I423 HydrophobicContact CG-CD1 4.14Å; E419-I423 WeakPolarHBondContact O-CD1 3.34Å; E419-I423 VanDerWaalsContact O-CG1 3.28Å; E419-I423 WeakPolarHBondContact O-CG1 3.42Å; E419-I423 PolarHBondContact O-N 3.33Å; L421-I423 PolarHBondContact O-N 2.99Å; I423-S425 VanDerWaalsContact C-N 3.31Å; I423-S425 PolarHBondContact O-N 2.8Å; I423-Y428 HydrophobicContact CB-CE1 4.39Å; I423-Y428 HydrophobicContact CB-CE2 4.44Å; I423-Y428 HydrophobicContact CG1-CD2 4.45Å; I423-Y428 HydrophobicContact CG1-CE1 4.06Å; I423-Y428 HydrophobicContact CG1-CE2 3.82Å; I423-Y428 HydrophobicContact CG2-CD1 4.46Å; I423-Y428 HydrophobicContact CG2-CE1 4.28Å
424Q85.6Confident83.6Confident152 Ų152108.9 Ų108.971%0.7155%0.554SS**Hα-helixtrans-79.4-11.4-179.5-68175.525.400113.8K420 L421 A422K420-Q424 WeakPolarHBondContact O-CG 3.45Å; K420-Q424 PolarHBondContact O-N 3.23Å; L421-Q424 PolarHBondContact O-N 3.42Å; A422-Q424 PolarHBondContact O-N 3.27Å
425S84.8Confident82.4Confident59 Ų59108 Ų10841%0.41355%0.549SS..SBendtrans-71.6136.9-177.7-165.50000111.2L421 A422 I423 N427 Y428L421-S425 PolarHBondContact O-N 3.17Å; A422-S425 WeakPolarHBondContact O-CB 3.34Å; A422-S425 PolarHBondContact O-N 3.5Å; A422-S425 VanDerWaalsContact O-N 3.13Å; I423-S425 VanDerWaalsContact C-N 3.31Å; I423-S425 PolarHBondContact O-N 2.8Å; S425-N427 PolarHBondContact O-N 2.85Å; S425-Y428 WeakPolarHBondContact O-CB 3.39Å; S425-Y428 PolarHBondContact O-N 2.97Å
426P80.9Confident81.1Confident123 Ų123104.1 Ų104.180%0.79955%0.547SS*.THydrogen-bonded Turntrans-59-26.3-175.78.8-16.7000113.9Y428P426-Y428 VanDerWaalsContact C-N 3.34Å
427N80.4Confident79.4Confident97 Ų97111.4 Ų111.452%0.51957%0.574SS.*THydrogen-bonded Turntrans-85.8-3.5178.1-64.2-14000113.4S425 K429 Q430 V431S425-N427 PolarHBondContact O-N 2.85Å; N427-K429 PolarHBondContact O-N 3.21Å; N427-Q430 PolarHBondContact O-N 2.97Å; N427-V431 PolarHBondContact O-N 3.18Å
428Y79.3Confident77.2Confident79 Ų79114.7 Ų114.731%0.3159%0.589SS.*Hα-helixtrans-55.3-40.8-176.7-179.6-106.4000112.2A422 I423 S425 P426 Q430 V431 A432A422-Y428 WeakPolarHBondContact O-CB 3.35Å; A422-Y428 VanDerWaalsContact O-CD2 3.31Å; A422-Y428 WeakPolarHBondContact O-CD2 3.5Å; I423-Y428 HydrophobicContact CB-CE1 4.39Å; I423-Y428 HydrophobicContact CB-CE2 4.44Å; I423-Y428 HydrophobicContact CG1-CD2 4.45Å; I423-Y428 HydrophobicContact CG1-CE1 4.06Å; I423-Y428 HydrophobicContact CG1-CE2 3.82Å; I423-Y428 HydrophobicContact CG2-CD1 4.46Å; I423-Y428 HydrophobicContact CG2-CE1 4.28Å; S425-Y428 WeakPolarHBondContact O-CB 3.39Å; S425-Y428 PolarHBondContact O-N 2.97Å; P426-Y428 VanDerWaalsContact C-N 3.34Å; Y428-Q430 VanDerWaalsContact C-N 3.27Å; Y428-Q430 PolarHBondContact O-N 3.4Å; Y428-V431 PolarHBondContact O-N 3.27Å; Y428-V431 VanDerWaalsContact O-N 3.11Å; Y428-A432 HydrophobicContact CD1-CB 4.26Å; Y428-A432 HydrophobicContact CE1-CB 3.91Å; Y428-A432 HydrophobicContact CE2-CB 4.42Å; Y428-A432 WeakPolarHBondContact O-CB 3.27Å; Y428-A432 PolarHBondContact O-N 3.4Å
429K74.7Confident74.8Confident175 Ų175115.1 Ų115.176%0.76160%0.595SS**Hα-helixtrans-59.2-35.4178.4-73.3-174.4177.1-179.10113.3N427N427-K429 PolarHBondContact O-N 3.21Å
430Q76.5Confident72.7Confident140 Ų140114.3 Ų114.365%0.65460%0.603SS**Hα-helixtrans-74.8-31178.5-68.2177.22.800112.1N427 Y428N427-Q430 PolarHBondContact O-N 2.97Å; Y428-Q430 VanDerWaalsContact C-N 3.27Å; Y428-Q430 PolarHBondContact O-N 3.4Å
431V76.8Confident70.5Confident75 Ų75112.6 Ų112.646%0.45560%0.604SS.*Hα-helixtrans-86.5-33.9-179.7-176.70000111.7N427 Y428 E433 L434 L435N427-V431 PolarHBondContact O-N 3.18Å; Y428-V431 PolarHBondContact O-N 3.27Å; Y428-V431 VanDerWaalsContact O-N 3.11Å; V431-E433 PolarHBondContact O-N 3.47Å; V431-L434 WeakPolarHBondContact O-CA 3.35Å; V431-L434 WeakPolarHBondContact O-CB 3.3Å; V431-L434 PolarHBondContact O-N 3.48Å; V431-L435 PolarHBondContact O-N 3.34Å; V431-L435 VanDerWaalsContact O-N 3.14Å
432A75.6Confident68.2Low33 Ų33111.5 Ų111.527%0.27360%0.603SS.*Hα-helixtrans-62.3-29.6179.200000112.8Y428 L434 L435Y428-A432 HydrophobicContact CD1-CB 4.26Å; Y428-A432 HydrophobicContact CE1-CB 3.91Å; Y428-A432 HydrophobicContact CE2-CB 4.42Å; Y428-A432 WeakPolarHBondContact O-CB 3.27Å; Y428-A432 PolarHBondContact O-N 3.4Å; A432-L434 VanDerWaalsContact C-N 3.26Å; A432-L434 PolarHBondContact O-N 2.81Å; A432-L435 PolarHBondContact O-N 3.47Å
433E72.6Confident66.3Low170 Ų170111.3 Ų111.379%0.79460%0.599SS**THydrogen-bonded Turntrans-70.7-21.4172.8-73.9-178.4168.100113.4V431V431-E433 PolarHBondContact O-N 3.47Å
434L73.4Confident64.3Low149 Ų149114.2 Ų114.278%0.7862%0.615SS**THydrogen-bonded Turntrans-94.1-15177.8-63.5169.3000112.8V431 A432V431-L434 WeakPolarHBondContact O-CA 3.35Å; V431-L434 WeakPolarHBondContact O-CB 3.3Å; V431-L434 PolarHBondContact O-N 3.48Å; A432-L434 VanDerWaalsContact C-N 3.26Å; A432-L434 PolarHBondContact O-N 2.81Å
435L69Low62.2Low92 Ų92112 Ų11248%0.48260%0.601SS.*SBendtrans-75.3136.9178.1-78.2167.5000110.3V431 A432 K437V431-L435 PolarHBondContact O-N 3.34Å; V431-L435 VanDerWaalsContact O-N 3.14Å; A432-L435 PolarHBondContact O-N 3.47Å; L435-K437 PolarHBondContact O-N 3.05Å; L435-K437 VanDerWaalsContact O-N 3.12Å
436P64.3Low60Low101 Ų101115.1 Ų115.166%0.65661%0.609SS**  trans-56.5120.6175.8-20.230.6000110E438P436-E438 PolarHBondContact O-N 2.7Å
437K55.7Low57.8Low198 Ų198117 Ų11786%0.86161%0.612SS**THydrogen-bonded Turntrans-67.2105.4173.5-71.2-178179.7177.60107.8L435L435-K437 PolarHBondContact O-N 3.05Å; L435-K437 VanDerWaalsContact O-N 3.12Å
438E45.4Very low55.9Low189 Ų189116.7 Ų116.788%0.88362%0.618SS**THydrogen-bonded Turntrans53.276.8174.9-64179173.500113.7P436P436-E438 PolarHBondContact O-N 2.7Å
439S40.8Very low54Low80 Ų80119 Ų11956%0.55963%0.631SS**  trans-84104.3130.4580000105V441S439-V441 PolarHBondContact O-N 3.31Å
440S42Very low52.3Low105 Ų105114.6 Ų114.673%0.73463%0.627SS**  trans-50.992.3151.351.70000105.4P442S440-P442 VanDerWaalsContact C-N 3.31Å; S440-P442 WeakPolarHBondContact O-CD 3.49Å
441V43.4Very low50.7Low100 Ų100114.5 Ų114.561%0.60663%0.631SS**  trans-64107.8163.7-173.90000100.7S439 S443S439-V441 PolarHBondContact O-N 3.31Å; V441-S443 PolarHBondContact O-N 3.18Å; V441-S443 VanDerWaalsContact O-N 3.08Å
442P40.7Very low49.4Very low95 Ų95113.8 Ų113.862%0.61763%0.625SS**  trans-50.8130.1171.2-16.531.1000103.9S440 L444S440-P442 VanDerWaalsContact C-N 3.31Å; S440-P442 WeakPolarHBondContact O-CD 3.49Å; P442-L444 VanDerWaalsContact C-N 3.34Å; P442-L444 PolarHBondContact O-N 2.89Å
443S44.7Very low48.1Very low42 Ų42118.4 Ų118.429%0.29465%0.645SS.*  trans-44.9111.7171.6167.80000105.4V441 Y445 E446V441-S443 PolarHBondContact O-N 3.18Å; V441-S443 VanDerWaalsContact O-N 3.08Å; S443-Y445 PolarHBondContact O-N 3.44Å; S443-E446 PolarHBondContact O-N 3.48Å; S443-E446 VanDerWaalsContact O-N 3.07Å
444L43.4Very low47Very low144 Ų144112.9 Ų112.975%0.75463%0.634SS**THydrogen-bonded Turntrans-58.9-4.3-176.5-89.2158.9000111P442P442-L444 VanDerWaalsContact C-N 3.34Å; P442-L444 PolarHBondContact O-N 2.89Å
445Y42.6Very low46.2Very low107 Ų107111.6 Ų111.642%0.4262%0.624SS.*THydrogen-bonded Turntrans-107.4-24.1-172.4-45-67.9000113.1L408 S443 N447 S448L408-Y445 HydrophobicContact CD1-CD1 4.3Å; L408-Y445 HydrophobicContact CD2-CD1 3.58Å; L408-Y445 HydrophobicContact CD2-CE1 3.43Å; L408-Y445 VanDerWaalsContact CD2-CE1 3.43Å; L408-Y445 HydrophobicContact CD2-CG 4.46Å; L408-Y445 HydrophobicContact CG-CD1 4.49Å; S443-Y445 PolarHBondContact O-N 3.44Å; Y445-N447 PolarHBondContact O-N 2.95Å; Y445-S448 PolarHBondContact O-N 2.86Å; Y445-S448 PolarHBondContact O-OG 3.15Å
446E37.6Very low45.9Very low123 Ų123110.7 Ų110.758%0.57562%0.622SS**G310 helixtrans-66.4-33-174.5-88.7177.6167.300113.5S443 S448 E449S443-E446 PolarHBondContact O-N 3.48Å; S443-E446 VanDerWaalsContact O-N 3.07Å; E446-S448 PolarHBondContact O-N 3.5Å; E446-S448 VanDerWaalsContact O-N 3.15Å; E446-E449 PolarHBondContact O-N 2.91Å
447N35.1Very low46.1Very low163 Ų163106.2 Ų106.287%0.87259%0.593SS**G310 helixtrans-72.5-8.1-177.8-80.1-16.3000114.6Y445Y445-N447 PolarHBondContact O-N 2.95Å
448S39.4Very low46.8Very low90 Ų9099.7 Ų99.763%0.62957%0.57SS**G310 helixtrans-95.8-7.7176.368.60000113.7Y445 E446Y445-S448 PolarHBondContact O-N 2.86Å; Y445-S448 PolarHBondContact O-OG 3.15Å; E446-S448 PolarHBondContact O-N 3.5Å; E446-S448 VanDerWaalsContact O-N 3.15Å
449E40Very low48.1Very low128 Ų12896.4 Ų96.460%0.59855%0.549SS*.SBendtrans-84.7-17.5-166.2-62.3-165.4139.100114.8E446E446-E449 PolarHBondContact O-N 2.91Å
450A40.2Very low49.8Very low82 Ų8298.4 Ų98.468%0.67855%0.553SS**SBendtrans-92-13.2-16100000117.1
451N41.6Very low51.6Low138 Ų13896.1 Ų96.174%0.73853%0.532SS*.SBendtrans-121.34.9-166.1-76.6-8.3000116.5D453N451-D453 PolarHBondContact O-N 3.31Å
452D50Low53.2Low61 Ų6191.3 Ų91.333%0.32650%0.503SS..  trans-101.669.6175.2-164.448000110.7K401 G454K401-D452 WeakPolarHBondContact CD-OD2 3.42Å; K401-D452 IonicContact NZ-OD1 3.84Å; K401-D452 IonicContact NZ-OD2 3.57Å; K401-D452 PolarHBondContact NZ-OD2 3.48Å; D452-G454 PolarHBondContact O-N 2.94Å; D452-G454 VanDerWaalsContact O-N 3.13Å
453D47.4Very low55.1Low129 Ų12989.6 Ų89.669%0.6949%0.487SS*.  trans-55118.1156.2-71-32.8000106N451 E455N451-D453 PolarHBondContact O-N 3.31Å; D453-E455 PolarHBondContact O-N 2.99Å
454G49.9Very low56.8Low55 Ų5594.8 Ų94.857%0.56750%0.504SS*.  trans-61.920.9-17200000116.1K398 D452 V456K398-G454 PolarHBondContact NZ-O 3.4Å; D452-G454 PolarHBondContact O-N 2.94Å; D452-G454 VanDerWaalsContact O-N 3.13Å; G454-V456 PolarHBondContact O-N 3Å
455E57.1Low58.6Low121 Ų12191.5 Ų91.557%0.56548%0.484SS*.  trans-50.8107171.5-130.3-178.7-165.500109.7Y360 K364 D453 M457Y360-E455 PolarHBondContact OH-O 2.93Å; K364-E455 PolarHBondContact NZ-O 2.97Å; D453-E455 PolarHBondContact O-N 2.99Å; E455-M457 PolarHBondContact O-N 3.24Å
456V62Low60.3Low74 Ų7486.4 Ų86.445%0.44847%0.465SS..  trans-57.1126.4172.2179.90000106.6T394 G454 T458T394-V456 HydrophobicContact CG2-CG1 4.5Å; G454-V456 PolarHBondContact O-N 3Å; V456-T458 VanDerWaalsContact C-N 3.32Å; V456-T458 PolarHBondContact O-N 3.34Å
457M68.8Low62.2Low7 Ų783 Ų833%0.03446%0.458CS..  trans-63.4104.3165.7-89.2-144.2-57.700106.8Y360 Y376 L379 F390 E455 V462Y360-M457 HydrophobicContact CD2-CE 3.46Å; Y360-M457 VanDerWaalsContact CD2-CE 3.46Å; Y360-M457 HydrophobicContact CD2-CG 4.23Å; Y360-M457 HydrophobicContact CD2-SD 4.46Å; Y360-M457 HydrophobicContact CE2-CB 3.85Å; Y360-M457 HydrophobicContact CE2-CE 3.82Å; Y360-M457 HydrophobicContact CE2-CG 3.6Å; Y360-M457 HydrophobicContact CE2-SD 4.4Å; Y376-M457 HydrophobicContact CE1-SD 3.94Å; L379-M457 HydrophobicContact CD1-CE 3.47Å; L379-M457 VanDerWaalsContact CD1-CE 3.47Å; L379-M457 HydrophobicContact CD1-SD 4.05Å; L379-M457 HydrophobicContact CD2-CE 3.83Å; L379-M457 HydrophobicContact CG-CE 4.15Å; F390-M457 HydrophobicContact CZ-CE 4.14Å; E455-M457 PolarHBondContact O-N 3.24Å; M457-V462 HydrophobicContact CB-CG2 4.26Å; M457-V462 HydrophobicContact CE-CG2 4.07Å; M457-V462 HydrophobicContact SD-CG2 3.67Å
458T71Confident64.3Low61 Ų6177.4 Ų77.437%0.37443%0.434SS..  trans-82.6156173.961.50000109.1V456 D460 M461 V462V456-T458 VanDerWaalsContact C-N 3.32Å; V456-T458 PolarHBondContact O-N 3.34Å; T458-D460 PolarHBondContact O-N 3.43Å; T458-M461 WeakPolarHBondContact O-CB 3.33Å; T458-M461 PolarHBondContact O-N 3.46Å; T458-M461 VanDerWaalsContact OG1-CG 3.3Å; T458-M461 WeakPolarHBondContact OG1-CG 3.21Å; T458-M461 PolarHBondContact OG1-N 2.95Å; T458-V462 PolarHBondContact O-N 2.94Å; T458-V462 VanDerWaalsContact O-N 3.09Å
459R73.2Confident65.8Low120 Ų12073.7 Ų73.745%0.45341%0.409SS..Hα-helixtrans-49.6-44.2173173.4164.1-177157.70.1112.2M383 M461 V462 E463M383-R459 HydrophobicContact CE-CB 4.05Å; M383-R459 HydrophobicContact CE-CG 3.63Å; M383-R459 HydrophobicContact SD-CB 3.73Å; M383-R459 HydrophobicContact SD-CG 3.88Å; R459-M461 VanDerWaalsContact C-N 3.35Å; R459-M461 PolarHBondContact O-N 3.47Å; R459-V462 PolarHBondContact O-N 2.98Å; R459-E463 HydrophobicContact CG-CG 4.32Å; R459-E463 WeakPolarHBondContact CG-OE1 3.5Å; R459-E463 IonicContact CZ-OE1 2.74Å; R459-E463 IonicContact NE-OE1 3.24Å; R459-E463 PolarHBondContact NE-OE1 3.15Å; R459-E463 IonicContact NH2-OE1 2.69Å; R459-E463 PolarHBondContact NH2-OE1 2.95Å; R459-E463 WeakPolarHBondContact O-CB 3.43Å; R459-E463 WeakPolarHBondContact O-CG 3.42Å; R459-E463 PolarHBondContact O-N 3.37Å
460D75.8Confident67.2Low121 Ų12173.3 Ų73.365%0.64741%0.405SS*.Hα-helixtrans-62.7-38.6179.3-63.7-17.1000112.7T458 K464T458-D460 PolarHBondContact O-N 3.43Å; D460-K464 WeakPolarHBondContact O-CB 3.47Å; D460-K464 PolarHBondContact O-N 3.35Å
461M78.9Confident68.5Low57 Ų5776.4 Ų76.428%0.28141%0.406SS..Hα-helixtrans-65.2-48175.6-70.6172.88100110.9T458 R459 E463 K464 E465T458-M461 WeakPolarHBondContact O-CB 3.33Å; T458-M461 PolarHBondContact O-N 3.46Å; T458-M461 VanDerWaalsContact OG1-CG 3.3Å; T458-M461 WeakPolarHBondContact OG1-CG 3.21Å; T458-M461 PolarHBondContact OG1-N 2.95Å; R459-M461 VanDerWaalsContact C-N 3.35Å; R459-M461 PolarHBondContact O-N 3.47Å; M461-E463 PolarHBondContact O-N 3.43Å; M461-K464 PolarHBondContact O-N 2.92Å; M461-E465 WeakPolarHBondContact O-CB 3.28Å; M461-E465 WeakPolarHBondContact O-CG 3.44Å; M461-E465 PolarHBondContact O-N 3.43Å
462V78.6Confident69.4Low0 Ų075 Ų750%040%0.395CS..Hα-helixtrans-62-44179.6176.40000110.9L379 K380 M383 M457 T458 R459 A466L379-V462 HydrophobicContact CB-CG1 4.1Å; K380-V462 HydrophobicContact CB-CG1 3.81Å; M383-V462 HydrophobicContact CE-CB 4.07Å; M383-V462 HydrophobicContact CE-CG1 4.02Å; M457-V462 HydrophobicContact CB-CG2 4.26Å; M457-V462 HydrophobicContact CE-CG2 4.07Å; M457-V462 HydrophobicContact SD-CG2 3.67Å; T458-V462 PolarHBondContact O-N 2.94Å; T458-V462 VanDerWaalsContact O-N 3.09Å; R459-V462 PolarHBondContact O-N 2.98Å; V462-A466 WeakPolarHBondContact O-CB 3.25Å; V462-A466 PolarHBondContact O-N 3.2Å
463E79.3Confident69.8Low59 Ų5975.4 Ų75.428%0.27640%0.395SS..Hα-helixtrans-66.2-41.4178.6-74-177.5-172.800112.4M383 R459 M461 A467M383-E463 HydrophobicContact CE-CG 4.3Å; R459-E463 HydrophobicContact CG-CG 4.32Å; R459-E463 WeakPolarHBondContact CG-OE1 3.5Å; R459-E463 IonicContact CZ-OE1 2.74Å; R459-E463 IonicContact NE-OE1 3.24Å; R459-E463 PolarHBondContact NE-OE1 3.15Å; R459-E463 IonicContact NH2-OE1 2.69Å; R459-E463 PolarHBondContact NH2-OE1 2.95Å; R459-E463 WeakPolarHBondContact O-CB 3.43Å; R459-E463 WeakPolarHBondContact O-CG 3.42Å; R459-E463 PolarHBondContact O-N 3.37Å; M461-E463 PolarHBondContact O-N 3.43Å; E463-A467 VanDerWaalsContact O-CB 3.31Å; E463-A467 WeakPolarHBondContact O-CB 3.48Å; E463-A467 PolarHBondContact O-N 3.21Å
464K81.7Confident70.1Confident151 Ų15172.5 Ų72.566%0.65740%0.396SS*.Hα-helixtrans-66.7-48.4179.2-177.5-174.9173.2-167.40112D460 M461 A467 A468D460-K464 WeakPolarHBondContact O-CB 3.47Å; D460-K464 PolarHBondContact O-N 3.35Å; M461-K464 PolarHBondContact O-N 2.92Å; K464-A467 PolarHBondContact O-N 3.1Å; K464-A468 PolarHBondContact O-N 2.97Å
465E81.4Confident70.1Confident74 Ų7478.3 Ų78.335%0.34641%0.405SS..Hα-helixtrans-67.2-40.8179.7-68.4-63153.700111.2Y376 M461 A467 A468 A469Y376-E465 HydrophobicContact CD1-CB 3.65Å; Y376-E465 HydrophobicContact CD1-CG 4.41Å; Y376-E465 HydrophobicContact CD2-CB 3.67Å; Y376-E465 HydrophobicContact CD2-CG 4.45Å; Y376-E465 HydrophobicContact CE1-CB 3.77Å; Y376-E465 HydrophobicContact CE1-CG 4.01Å; Y376-E465 HydrophobicContact CE2-CB 3.77Å; Y376-E465 HydrophobicContact CE2-CG 4.03Å; Y376-E465 HydrophobicContact CG-CB 3.61Å; M461-E465 WeakPolarHBondContact O-CB 3.28Å; M461-E465 WeakPolarHBondContact O-CG 3.44Å; M461-E465 PolarHBondContact O-N 3.43Å; E465-A467 VanDerWaalsContact C-N 3.3Å; E465-A467 PolarHBondContact O-N 2.92Å; E465-A468 PolarHBondContact O-N 3.36Å; E465-A469 WeakPolarHBondContact O-CB 3.26Å; E465-A469 PolarHBondContact O-N 2.99Å
466A77.5Confident69.2Low1 Ų179.2 Ų79.21%0.00841%0.409CS..Hα-helixtrans-62.9-35.9174.300000112.5K380 V462 K470K380-A466 HydrophobicContact CB-CB 4.25Å; K380-A466 HydrophobicContact CD-CB 3.93Å; V462-A466 WeakPolarHBondContact O-CB 3.25Å; V462-A466 PolarHBondContact O-N 3.2Å; A466-K470 PolarHBondContact O-N 2.82Å; A466-K470 VanDerWaalsContact O-N 3.12Å
467A78.1Confident67.8Low52 Ų5286.8 Ų86.843%0.4343%0.43SS..Hα-helixtrans-69.6-40.8175.300000112.3E463 K464 E465 K470 Q471E463-A467 VanDerWaalsContact O-CB 3.31Å; E463-A467 WeakPolarHBondContact O-CB 3.48Å; E463-A467 PolarHBondContact O-N 3.21Å; K464-A467 PolarHBondContact O-N 3.1Å; E465-A467 VanDerWaalsContact C-N 3.3Å; E465-A467 PolarHBondContact O-N 2.92Å; A467-K470 PolarHBondContact O-N 3.06Å; A467-Q471 PolarHBondContact O-N 3.3Å
468A78.1Confident66.3Low44 Ų4490.5 Ų90.536%0.36446%0.455SS..Hα-helixtrans-62.1-44.5174.800000111.3K464 E465 K470 Q471 E472K464-A468 PolarHBondContact O-N 2.97Å; E465-A468 PolarHBondContact O-N 3.36Å; A468-K470 PolarHBondContact O-N 2.97Å; A468-Q471 PolarHBondContact O-N 3.02Å; A468-Q471 VanDerWaalsContact O-N 3.13Å; A468-E472 PolarHBondContact O-N 2.94Å; A468-E472 VanDerWaalsContact O-N 3.11Å
469A71.6Confident64.5Low12 Ų1296 Ų9610%0.09948%0.478CS..Hα-helixtrans-58.4-43.7175.200000113E465 Q471 E472 M473E465-A469 WeakPolarHBondContact O-CB 3.26Å; E465-A469 PolarHBondContact O-N 2.99Å; A469-Q471 VanDerWaalsContact C-N 3.29Å; A469-Q471 PolarHBondContact O-N 3.12Å; A469-E472 PolarHBondContact O-N 3Å; A469-M473 WeakPolarHBondContact O-CG 3.19Å; A469-M473 PolarHBondContact O-N 3.5Å
470K69.9Low62.6Low121 Ų12197.3 Ų97.353%0.52649%0.494SS..Hα-helixtrans-63.2-33.7176.2-77.8-174.3-179.2-174.40112.8N377 A466 A467 A468 G474N377-K470 VanDerWaalsContact OD1-CE 3.25Å; N377-K470 WeakPolarHBondContact OD1-CE 3.37Å; A466-K470 PolarHBondContact O-N 2.82Å; A466-K470 VanDerWaalsContact O-N 3.12Å; A467-K470 PolarHBondContact O-N 3.06Å; A468-K470 PolarHBondContact O-N 2.97Å; K470-G474 PolarHBondContact O-N 2.95Å
471Q66.7Low60.6Low147 Ų14799.7 Ų99.769%0.68750%0.503SS*.Hα-helixtrans-71.8-32.7175.7-77.3-174.2-1.400113.1A467 A468 A469A467-Q471 PolarHBondContact O-N 3.3Å; A468-Q471 PolarHBondContact O-N 3.02Å; A468-Q471 VanDerWaalsContact O-N 3.13Å; A469-Q471 VanDerWaalsContact C-N 3.29Å; A469-Q471 PolarHBondContact O-N 3.12Å
472E61.3Low58.3Low109 Ų109100.6 Ų100.651%0.50952%0.515SS..Hα-helixtrans-77.1-42.1175.3-74.4-156.5150.600112.6A468 A469 G474 K475 E476A468-E472 PolarHBondContact O-N 2.94Å; A468-E472 VanDerWaalsContact O-N 3.11Å; A469-E472 PolarHBondContact O-N 3Å; E472-G474 PolarHBondContact O-N 3.36Å; E472-K475 WeakPolarHBondContact O-CA 3.46Å; E472-K475 WeakPolarHBondContact O-CB 3.49Å; E472-K475 PolarHBondContact O-N 2.82Å; E472-E476 PolarHBondContact O-N 3.42Å; E472-E476 VanDerWaalsContact O-N 3.16Å
473M57.5Low56Low69 Ų69105.9 Ų105.934%0.3454%0.543SS..Hα-helixtrans-63.3-24.3175.2-69.5-158.8-56.500113.1T370 L374 A469 K475 E476T370-M473 HydrophobicContact CG2-SD 4.42Å; L374-M473 HydrophobicContact CD2-CE 4.2Å; L374-M473 HydrophobicContact CD2-SD 3.96Å; L374-M473 HydrophobicContact CG-SD 4.3Å; A469-M473 WeakPolarHBondContact O-CG 3.19Å; A469-M473 PolarHBondContact O-N 3.5Å; M473-K475 VanDerWaalsContact C-N 3.25Å; M473-K475 PolarHBondContact O-N 3.21Å; M473-E476 VanDerWaalsContact O-O 3.14Å
474G52.9Low53.8Low68 Ų68108 Ų10870%0.70156%0.562SS**THydrogen-bonded Turntrans-71.3-17.1171.100000114.2K470 E472K470-G474 PolarHBondContact O-N 2.95Å; E472-G474 PolarHBondContact O-N 3.36Å
475K50.5Low51.6Low177 Ų177105.9 Ų105.977%0.7756%0.561SS**THydrogen-bonded Turntrans-98.1-35-179.4-69178.2-178.7175.10112.7E472 M473E472-K475 WeakPolarHBondContact O-CA 3.46Å; E472-K475 WeakPolarHBondContact O-CB 3.49Å; E472-K475 PolarHBondContact O-N 2.82Å; M473-K475 VanDerWaalsContact C-N 3.25Å; M473-K475 PolarHBondContact O-N 3.21Å
476E38.9Very low49.5Very low139 Ų139108 Ų10865%0.6558%0.575SS**  trans-100.290.8170.2-72.4-176.3167.800108.5E472 M473 P478E472-E476 PolarHBondContact O-N 3.42Å; E472-E476 VanDerWaalsContact O-N 3.16Å; M473-E476 VanDerWaalsContact O-O 3.14Å; E476-P478 VanDerWaalsContact O-CD 3.27Å; E476-P478 WeakPolarHBondContact O-CD 3.42Å; E476-P478 VanDerWaalsContact O-N 3.16Å
477R33Very low47.1Very low234 Ų234114 Ų11488%0.88361%0.607SS**  trans-55.6121153.9-101.6-177.4176.6-177.2-2.1105.5M479R477-M479 PolarHBondContact O-N 2.68Å
478P36.1Very low44.7Very low84 Ų84116.5 Ų116.555%0.54562%0.621SS.*  trans-58.1120.7169.4-15.228.4000105.7E476 L480E476-P478 VanDerWaalsContact O-CD 3.27Å; E476-P478 WeakPolarHBondContact O-CD 3.42Å; E476-P478 VanDerWaalsContact O-N 3.16Å; P478-L480 PolarHBondContact O-N 3.16Å
479M33.3Very low42.4Very low176 Ų176117.8 Ų117.887%0.86764%0.639SS**  trans-60.590.9147.4-70.2-169.1-151.100104.2R477 M481R477-M479 PolarHBondContact O-N 2.68Å; M479-M481 PolarHBondContact O-N 2.62Å
480L34Very low40.5Very low149 Ų149120.7 Ų120.778%0.7866%0.658SS**  trans-5098.9130.6-76.9162.4000103.2P478 S482P478-L480 PolarHBondContact O-N 3.16Å; L480-S482 PolarHBondContact O-N 2.89Å
481M32.8Very low38.8Very low171 Ų171123.7 Ų123.784%0.84267%0.671SS**  trans-55.486.3131-78.8-138.6-168.800103.7M479 D483M479-M481 PolarHBondContact O-N 2.62Å; M481-D483 PolarHBondContact O-N 2.84Å
482S30.6Very low37.1Very low76 Ų76125.5 Ų125.553%0.53168%0.677SS.*  trans-46.197.2137.949.20000103.4L480 P484L480-S482 PolarHBondContact O-N 2.89Å; S482-P484 VanDerWaalsContact O-CD 3.22Å; S482-P484 WeakPolarHBondContact O-CD 3.48Å; S482-P484 VanDerWaalsContact O-N 3.12Å
483D31.2Very low35.7Very low111 Ų111125.5 Ų125.559%0.59468%0.68SS**  trans-45.6118.5140.9-107.9-34.7000104.6M481 T485 L486M481-D483 PolarHBondContact O-N 2.84Å; D483-T485 PolarHBondContact O-N 3.23Å; D483-L486 PolarHBondContact O-N 3.1Å
484P32.7Very low34.7Very low103 Ų103126.3 Ų126.367%0.66968%0.682SS**THydrogen-bonded Turntrans-60.64.2-179-20.832.4000113.2S482S482-P484 VanDerWaalsContact O-CD 3.22Å; S482-P484 WeakPolarHBondContact O-CD 3.48Å; S482-P484 VanDerWaalsContact O-N 3.12Å
485T36.3Very low33.6Very low106 Ų106134 Ų13465%0.6569%0.69SS**THydrogen-bonded Turntrans-98.1-6.8-178.153.20000114.2D483D483-T485 PolarHBondContact O-N 3.23Å
486L36.4Very low32.7Very low119 Ų119132.5 Ų132.562%0.62369%0.688SS**THydrogen-bonded Turntrans-123.7-7.6-176.2-71.2173000117D483D483-L486 PolarHBondContact O-N 3.1Å
487D27.6Very low32.3Very low127 Ų127132.8 Ų132.868%0.67969%0.689SS**SBendtrans-15263.2173.9-151.914.7000113.9
488S27.4Very low32.5Very low105 Ų105126.2 Ų126.273%0.73467%0.668SS**SBendtrans-160.893154.260.80000111.2
489G29.2Very low32.1Very low71 Ų71127.2 Ų127.273%0.73268%0.677SS**SBendtrans121.772.3165.100000114.9
490S32.1Very low31.9Very low73 Ų73123 Ų12351%0.5166%0.664SS.*SBendtrans-170.1-17.8152.2-88.50000114.1K492 F494S490-K492 VanDerWaalsContact C-N 3.27Å; S490-K492 PolarHBondContact O-N 2.94Å; S490-F494 PolarHBondContact O-N 3.46Å
491K33.8Very low31.7Very low184 Ų184121 Ų12180%0.866%0.663SS**THydrogen-bonded Turntrans-69.7-12.1-177.9-78.1-178.6176.6173.10115.8
492K32Very low31.6Very low184 Ų184120.7 Ų120.780%0.866%0.664SS**THydrogen-bonded Turntrans-105.8-19.1177.6-83.3-174176.6176.90115.7S490S490-K492 VanDerWaalsContact C-N 3.27Å; S490-K492 PolarHBondContact O-N 2.94Å
493D32.3Very low31.5Very low110 Ų110123.9 Ų123.959%0.58868%0.68SS**THydrogen-bonded Turntrans-93.2-22.1178.5-68.2-35.5000113.1R495 M496D493-R495 VanDerWaalsContact C-N 3.31Å; D493-R495 PolarHBondContact O-N 3.49Å; D493-M496 PolarHBondContact O-N 3.32Å
494F35.4Very low31.4Very low85 Ų85122 Ų12237%0.37369%0.687SS.*THydrogen-bonded Turntrans-67-24.4-178.7-109.7-92.3000115Y254 S490Y254-F494 HydrophobicContact CE1-CE1 4.42Å; S490-F494 PolarHBondContact O-N 3.46Å
495R30.4Very low31.4Very low229 Ų229126 Ų12686%0.86470%0.697SS**THydrogen-bonded Turntrans-92.4-16.2177.6-101.2-177.6178.7174.91.7114.3D493D493-R495 VanDerWaalsContact C-N 3.31Å; D493-R495 PolarHBondContact O-N 3.49Å
496M31Very low31Very low147 Ų147131.1 Ų131.172%0.72471%0.71SS**THydrogen-bonded Turntrans-97.8-13.6-169.5-73.4-101.9-167.700114.5D493D493-M496 PolarHBondContact O-N 3.32Å
497H31.1Very low31Very low145 Ų145130.9 Ų130.967%0.67172%0.718SS**SBendtrans-106.44.5179.8-79-65000115.8
498H36.2Very low31.5Very low96 Ų96133.3 Ų133.344%0.44476%0.756SS.*SBendtrans-106.410.8-178.2-80-57.2000115.6S215S215-H498 PolarHBondContact OG-CE1 2.9Å; S215-H498 VanDerWaalsContact OG-CE1 3.31Å
499S29.1Very low31.7Very low105 Ų105134.7 Ų134.773%0.73476%0.757SS**SBendtrans-108.74.2179.955.90000115.6
500S28.5Very low31.8Very low86 Ų86138.1 Ų138.160%0.60176%0.758SS**SBendtrans-125.4107.617154.30000108.9
501S28.9Very low31.8Very low107 Ų107141.7 Ų141.775%0.74877%0.772SS**SBendtrans167.7-49.3-160.3930000114.9
502L30.8Very low31.7Very low165 Ų165139.2 Ų139.286%0.86477%0.77SS**  trans-133.162.1-167-73.4163.8000111.7
503T28.8Very low31.7Very low143 Ų143136.4 Ų136.488%0.87777%0.768SS**  trans-126.873.5159.955.30000108.4
504G30.3Very low31.7Very low71 Ų71138.1 Ų138.173%0.73278%0.78SS**  trans-105.9106.7165.100000109.1
505E31.2Very low31.4Very low189 Ų189141.9 Ų141.988%0.88381%0.81SS**  trans53.486.9151.6-64.1175.3161.100118
506K27.7Very low31.5Very low212 Ų212135.2 Ų135.292%0.92281%0.805SS**  trans-100.7105.8136.4-82.7-174.2177.51790107.6
507S37.6Very low31.5Very low115 Ų115134.3 Ų134.380%0.80481%0.812SS**  trans-136.7135.6160.6-58.10000108.1
508A37.8Very low31.5Very low177 Ų177133.3 Ų133.3100%1.46383%0.825SS**  trans-62.10176.900000113.1

Retrieved 508 of 508 residues in 747.1 ms (Link to these results)

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