A0A068WAZ5_HUMAN Loading...

Urea transporter

AlphaFold DB , UniProt , Accession A0A068WAZ5, Species HUMAN (Homo sapiens, Human), Gene SLC14A1, Length 389 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
1M35.4Very low32.6Very low237 Ų237157.5 Ų157.5100%1.16783%0.834SS**  0104.20-91.7166.8166.100105.9
2E35.2Very low32.4Very low181 Ų181153.3 Ų153.385%0.84683%0.827SS**  trans50.2131.7159-62.7168.5167.800118.3
3D34.4Very low32.6Very low154 Ų154150.3 Ų150.382%0.82482%0.821SS**  cis-165.5143.8-9.9-109.5-19.6000105.7
4S28.3Very low32.2Very low111 Ų111148.9 Ų148.978%0.77682%0.819SS**  trans-78.8-173.3169.6-58.60000110.7
5P51Low32Very low115 Ų115151.6 Ų151.675%0.74783%0.827SS**  cis-136.6168.3-15.919.76.4000116.1
6T34.7Very low31.8Very low124 Ų124150.4 Ų150.476%0.76183%0.826SS**  trans7.1135.8138.6-13.80000121.8
7M29.7Very low31.6Very low197 Ų197155.9 Ų155.997%0.9783%0.831SS**  trans-157.6140.7133.3-110.1-169.5-149.100113.5
8V29.8Very low31.6Very low120 Ų120151 Ų15173%0.72782%0.824SS**  trans-100.6142.4178169.70000109.5
9R25.8Very low31.6Very low230 Ų230152.7 Ų152.787%0.86883%0.826SS**  trans162.3122.3139.1-95.6-179.4172.9167.3-1.6110.6
10V27.3Very low31.4Very low111 Ų111152.8 Ų152.867%0.67383%0.825SS**  92.2129.474.9165.70000112.9
11D26.7Very low31.3Very low152 Ų152154.4 Ų154.481%0.81383%0.828SS**  trans93.4132.5156.6-67.6-23.6000124.2
12S30.3Very low31.1Very low108 Ų108149.2 Ų149.276%0.75581%0.809SS**  trans-67.8173.6-179.9-35.20000113.5
13P34.9Very low30.8Very low114 Ų114145.1 Ų145.174%0.7480%0.8SS**  -149.7156.269.333.6-10.5000117.7
14T27.6Very low30.9Very low131 Ų131143.6 Ų143.680%0.80480%0.799SS**  trans4116.5146.6-2.70000118.2
15M28.6Very low31Very low189 Ų189144.4 Ų144.493%0.93180%0.803SS**  trans-113.2111.3155.9-87.7-161.7170.400110.8R17M15-R17 PolarHBondContact O-N 3.16Å
16V28.6Very low30.3Very low133 Ų133148.7 Ų148.781%0.80681%0.813SS**  trans-57.1115167.1174.90000108.9G18V16-G18 PolarHBondContact O-N 3.17Å
17R29.8Very low30.5Very low243 Ų243146.1 Ų146.192%0.91781%0.811SS**  trans-82.4108.3168.4-161175.7-152.3-149.44.5107.6M15 E19M15-R17 PolarHBondContact O-N 3.16Å; R17-E19 PolarHBondContact O-N 3.35Å; R17-E19 VanDerWaalsContact O-N 3.16Å
18G30.1Very low31.1Very low68 Ų68148.3 Ų148.370%0.70181%0.809SS**  trans-56.7114-179.400000112.6V16V16-G18 PolarHBondContact O-N 3.17Å
19E31.5Very low31.9Very low184 Ų184153.3 Ų153.386%0.8681%0.814SS**  trans-69121.4147.4-69.7-179.1144.100107.7R17R17-E19 PolarHBondContact O-N 3.35Å; R17-E19 VanDerWaalsContact O-N 3.16Å
20N28.1Very low32.9Very low153 Ų153148.6 Ų148.682%0.81882%0.815SS**  trans-165.367.9152.4-97-21000108.6V22N20-V22 VanDerWaalsContact C-N 3.3Å; N20-V22 PolarHBondContact O-N 3.39Å
21Q29.8Very low34.3Very low187 Ų187150 Ų15087%0.87481%0.813SS**  trans-72.494.8151.4-80.2-174.80.400106.9S23Q21-S23 PolarHBondContact O-N 2.96Å
22V30.5Very low36.6Very low128 Ų128146.7 Ų146.778%0.77680%0.8SS**  trans-67.4100.6170.5179.50000107.5N20N20-V22 VanDerWaalsContact C-N 3.3Å; N20-V22 PolarHBondContact O-N 3.39Å
23S30.2Very low38.8Very low95 Ų95151.2 Ų151.266%0.66481%0.806SS**  trans-63.7131169.1-62.40000108.8Q21 C25Q21-S23 PolarHBondContact O-N 2.96Å; S23-C25 PolarHBondContact O-N 3.31Å
24P36.3Very low41.1Very low123 Ų123149.4 Ų149.480%0.79980%0.8SS**  trans-70.1121.7175.317.8-14.5000109.1Q26P24-Q26 PolarHBondContact O-N 2.76Å
25C30.1Very low43.7Very low127 Ų127146.5 Ų146.586%0.85878%0.779SS**  trans-38.8123.4179.1-67.80000113.1S23 G27S23-C25 PolarHBondContact O-N 3.31Å; C25-G27 PolarHBondContact O-N 3.21Å
26Q35.5Very low46.4Very low206 Ų206139.8 Ų139.896%0.96376%0.758SS**SBendtrans-64.999.4169.1-83.3170.9-31.700110P24P24-Q26 PolarHBondContact O-N 2.76Å
27G39.4Very low49.3Very low70 Ų70136.7 Ų136.772%0.72273%0.733SS**  trans-151.938167.100000110.6C25 R29C25-G27 PolarHBondContact O-N 3.21Å; G27-R29 PolarHBondContact O-N 3.27Å
28R41.4Very low52.3Low243 Ų243126.9 Ų126.992%0.91770%0.7SS**  trans-8399.1-179.5-80.9-175.4176-176.3-1.8109.9C30R28-C30 PolarHBondContact O-N 3.04Å
29R47.9Very low55.5Low224 Ų224126.1 Ų126.185%0.84568%0.682SS**  trans-49.9125.4148.3-81.1178.1173.6176.3-2.7106.8G27 F31G27-R29 PolarHBondContact O-N 3.27Å; R29-F31 PolarHBondContact O-N 3.23Å
30C46.1Very low58.6Low131 Ų131117.5 Ų117.589%0.88564%0.642SS**  trans-70.176-177.3-155.80000109.3R28R28-C30 PolarHBondContact O-N 3.04Å
31F55.9Low61.8Low142 Ų142111.3 Ų111.362%0.62361%0.609SS**  trans-65.5128165.8-105.5-97000107.1R29 K33 L35R29-F31 PolarHBondContact O-N 3.23Å; F31-K33 PolarHBondContact O-N 3.24Å; F31-L35 HydrophobicContact CD1-CD2 3.75Å; F31-L35 HydrophobicContact CD1-CG 4.33Å; F31-L35 HydrophobicContact CE1-CD2 3.67Å; F31-L35 HydrophobicContact CE1-CG 4.47Å
32P75.4Confident65Low82 Ų82102.8 Ų102.853%0.53257%0.569SS.*  trans-54128.1177.1-22.831.6000109.3A34 L35 G36P32-A34 PolarHBondContact O-N 3.29Å; P32-L35 HydrophobicContact CB-CB 4.44Å; P32-L35 WeakPolarHBondContact O-CB 3.45Å; P32-L35 PolarHBondContact O-N 2.87Å; P32-G36 PolarHBondContact O-N 3.42Å
33K76.8Confident68Low203 Ų203100.6 Ų100.688%0.88355%0.549SS*.Hα-helixtrans-50.8-35.6-176.3-72.6-178.2179.3177.60112.9F31 Y37F31-K33 PolarHBondContact O-N 3.24Å; K33-Y37 PolarHBondContact O-N 3.5Å
34A83.6Confident71.1Confident76 Ų76101.5 Ų101.563%0.62854%0.543SS*.Hα-helixtrans-64.2-38177.500000113P32 Y37 V38P32-A34 PolarHBondContact O-N 3.29Å; A34-Y37 PolarHBondContact O-N 3.04Å; A34-V38 PolarHBondContact O-N 3.48Å
35L82.7Confident73.9Confident69 Ų6997.5 Ų97.536%0.36151%0.514SS..Hα-helixtrans-68.2-40.7-179.2-169.460.5000110.9F31 P32 Y37 V38 T39 L251F31-L35 HydrophobicContact CD1-CD2 3.75Å; F31-L35 HydrophobicContact CD1-CG 4.33Å; F31-L35 HydrophobicContact CE1-CD2 3.67Å; F31-L35 HydrophobicContact CE1-CG 4.47Å; P32-L35 HydrophobicContact CB-CB 4.44Å; P32-L35 WeakPolarHBondContact O-CB 3.45Å; P32-L35 PolarHBondContact O-N 2.87Å; L35-Y37 PolarHBondContact O-N 3.14Å; L35-V38 HydrophobicContact CD1-CG2 4.18Å; L35-V38 WeakPolarHBondContact O-CG2 3.44Å; L35-V38 PolarHBondContact O-N 2.68Å; L35-T39 HydrophobicContact CD1-CG2 4.43Å; L35-T39 HydrophobicContact CG-CG2 4.27Å; L35-T39 WeakPolarHBondContact O-CG2 3.17Å; L35-T39 PolarHBondContact O-N 3.21Å; L35-T39 PolarHBondContact O-OG1 3.29Å; L35-L251 HydrophobicContact CD1-CD1 4.37Å
36G83.7Confident77Confident48 Ų4892.9 Ų92.950%0.49549%0.485SS..Hα-helixtrans-63.4-23.3176.300000114.4P32 T39P32-G36 PolarHBondContact O-N 3.42Å; G36-T39 PolarHBondContact O-OG1 3.21Å
37Y90.5Very high79.8Confident69 Ų6987.3 Ų87.327%0.27146%0.462SS..Hα-helixtrans-80.1-27.3178.1-171.1-92.6000112.9K33 A34 L35 M42 E44 L45 Q48K33-Y37 PolarHBondContact O-N 3.5Å; A34-Y37 PolarHBondContact O-N 3.04Å; L35-Y37 PolarHBondContact O-N 3.14Å; Y37-M42 HydrophobicContact CD1-CE 4.21Å; Y37-M42 HydrophobicContact CE1-CE 4.17Å; Y37-E44 HydrophobicContact CD2-CB 4.41Å; Y37-E44 HydrophobicContact CD2-CG 4.42Å; Y37-E44 HydrophobicContact CE2-CB 3.99Å; Y37-E44 HydrophobicContact CE2-CG 3.83Å; Y37-L45 HydrophobicContact CE1-CB 4.18Å; Y37-L45 WeakPolarHBondContact OH-CA 3.31Å; Y37-Q48 PolarHBondContact OH-OE1 2.98Å
38V93.8Very high82.4Confident36 Ų3688.1 Ų88.122%0.21845%0.447CS..Hα-helixtrans-100.7-7-177.2-60.80000114A34 L35 M42 N74 V76 L251A34-V38 PolarHBondContact O-N 3.48Å; L35-V38 HydrophobicContact CD1-CG2 4.18Å; L35-V38 WeakPolarHBondContact O-CG2 3.44Å; L35-V38 PolarHBondContact O-N 2.68Å; V38-M42 HydrophobicContact CB-CE 4.46Å; V38-M42 HydrophobicContact CG1-CE 4.16Å; V38-N74 PolarHBondContact O-ND2 2.82Å; V38-V76 HydrophobicContact CG1-CG2 4.38Å; V38-L251 HydrophobicContact CG2-CD1 3.83Å
39T96Very high85Confident53 Ų5377.7 Ų77.733%0.32541%0.41SS..SBendtrans-82.3163.7176.452.70000112.9L35 G36 L251L35-T39 HydrophobicContact CD1-CG2 4.43Å; L35-T39 HydrophobicContact CG-CG2 4.27Å; L35-T39 WeakPolarHBondContact O-CG2 3.17Å; L35-T39 PolarHBondContact O-N 3.21Å; L35-T39 PolarHBondContact O-OG1 3.29Å; G36-T39 PolarHBondContact O-OG1 3.21Å; T39-L251 WeakPolarHBondContact CA-O 3.34Å; T39-L251 WeakPolarHBondContact CG2-O 3.45Å
40G96.2Very high87.1Confident2 Ų273.2 Ų73.22%0.02140%0.396CS..THydrogen-bonded Turntrans63.3-141.7179.400000111.8N74 S252G40-N74 PolarHBondContact O-ND2 3.29Å; G40-S252 WeakPolarHBondContact CA-O 3.43Å; G40-S252 PolarHBondContact N-O 3.23Å; G40-S252 PolarHBondContact O-OG 3.2Å
41D95.4Very high89.4Confident23 Ų2373.8 Ų73.812%0.12339%0.391CS..THydrogen-bonded Turntrans-958.5-177.461.7-17.1000114.6K43 R64 N73D41-K43 VanDerWaalsContact C-N 3.32Å; D41-K43 PolarHBondContact O-N 3.38Å; D41-K43 WeakPolarHBondContact OD1-CE 3.45Å; D41-K43 VanDerWaalsContact OD1-CG 3.31Å; D41-K43 WeakPolarHBondContact OD1-CG 3.41Å; D41-K43 WeakPolarHBondContact OD2-CE 3.39Å; D41-K43 WeakPolarHBondContact OD2-CG 3.34Å; D41-K43 IonicContact OD2-NZ 2.9Å; D41-R64 PolarHBondContact O-NH1 3.23Å; D41-N73 CarbonylContact C-O 3.58Å; D41-N73 WeakPolarHBondContact CA-O 3.46Å; D41-N73 HydrophobicContact CB-CB 4.08Å; D41-N73 VanDerWaalsContact O-O 3.07Å
42M97.2Very high91.4Very high9 Ų972.1 Ų72.14%0.04438%0.383CS..  trans49.246.4177.8-60.1-176.569.700113.7Y37 V38 E44 L45 A46 R64 N74 P75 V76Y37-M42 HydrophobicContact CD1-CE 4.21Å; Y37-M42 HydrophobicContact CE1-CE 4.17Å; V38-M42 HydrophobicContact CB-CE 4.46Å; V38-M42 HydrophobicContact CG1-CE 4.16Å; M42-E44 PolarHBondContact O-N 2.91Å; M42-L45 HydrophobicContact CB-CB 4.28Å; M42-L45 HydrophobicContact CE-CB 4.18Å; M42-L45 HydrophobicContact CE-CD2 3.54Å; M42-L45 HydrophobicContact CE-CG 4.48Å; M42-L45 PolarHBondContact O-N 2.98Å; M42-L45 HydrophobicContact SD-CD2 4.49Å; M42-A46 PolarHBondContact O-N 3.17Å; M42-A46 VanDerWaalsContact O-N 3.12Å; M42-R64 PolarHBondContact O-NH2 3.45Å; M42-N74 PolarHBondContact SD-OD1 3.32Å; M42-P75 HydrophobicContact SD-CG 3.91Å; M42-V76 HydrophobicContact CE-CG2 3.93Å; M42-V76 HydrophobicContact SD-CB 4.34Å; M42-V76 HydrophobicContact SD-CG2 3.73Å
43K94.3Very high92.4Very high82 Ų8272.3 Ų72.336%0.35738%0.384SS..Hα-helixtrans-55.1-34.1179.5-64.5172.7-168.3169.80113.1D41 A46 N47 E372D41-K43 VanDerWaalsContact C-N 3.32Å; D41-K43 PolarHBondContact O-N 3.38Å; D41-K43 WeakPolarHBondContact OD1-CE 3.45Å; D41-K43 VanDerWaalsContact OD1-CG 3.31Å; D41-K43 WeakPolarHBondContact OD1-CG 3.41Å; D41-K43 WeakPolarHBondContact OD2-CE 3.39Å; D41-K43 WeakPolarHBondContact OD2-CG 3.34Å; D41-K43 IonicContact OD2-NZ 2.9Å; K43-A46 PolarHBondContact O-N 3.09Å; K43-N47 WeakPolarHBondContact O-CB 3.32Å; K43-N47 PolarHBondContact O-N 3.39Å; K43-N47 PolarHBondContact O-ND2 3.18Å; K43-E372 IonicContact NZ-OE1 3.79Å; K43-E372 PolarHBondContact NZ-OE1 2.95Å; K43-E372 IonicContact NZ-OE2 2.74Å; K43-E372 PolarHBondContact NZ-OE2 3.33Å
44E94.9Very high93.3Very high114 Ų11467.4 Ų67.453%0.53337%0.371SS..Hα-helixtrans-65-46.4-179.8-167.2176.3167.800111.4Y37 M42 N47 Q48Y37-E44 HydrophobicContact CD2-CB 4.41Å; Y37-E44 HydrophobicContact CD2-CG 4.42Å; Y37-E44 HydrophobicContact CE2-CB 3.99Å; Y37-E44 HydrophobicContact CE2-CG 3.83Å; M42-E44 PolarHBondContact O-N 2.91Å; E44-N47 PolarHBondContact O-N 3.43Å; E44-Q48 VanDerWaalsContact O-CG 3.31Å; E44-Q48 WeakPolarHBondContact O-CG 3.47Å; E44-Q48 PolarHBondContact O-N 3.44Å
45L94.8Very high94Very high38 Ų3868.4 Ų68.420%0.19937%0.369CS..Hα-helixtrans-60.3-46.8173.217863.9000111Y37 M42 N47 Q48 L49 P75Y37-L45 HydrophobicContact CE1-CB 4.18Å; Y37-L45 WeakPolarHBondContact OH-CA 3.31Å; M42-L45 HydrophobicContact CB-CB 4.28Å; M42-L45 HydrophobicContact CE-CB 4.18Å; M42-L45 HydrophobicContact CE-CD2 3.54Å; M42-L45 HydrophobicContact CE-CG 4.48Å; M42-L45 PolarHBondContact O-N 2.98Å; M42-L45 HydrophobicContact SD-CD2 4.49Å; L45-N47 VanDerWaalsContact C-N 3.27Å; L45-N47 PolarHBondContact O-N 2.9Å; L45-Q48 PolarHBondContact O-N 3.46Å; L45-Q48 VanDerWaalsContact O-N 3.14Å; L45-L49 HydrophobicContact CD1-CD1 4.05Å; L45-L49 HydrophobicContact CD1-CG 4.01Å; L45-L49 HydrophobicContact CD2-CD1 4.43Å; L45-L49 HydrophobicContact CG-CD1 3.85Å; L45-L49 HydrophobicContact CG-CG 4.24Å; L45-L49 WeakPolarHBondContact O-CB 3.39Å; L45-L49 WeakPolarHBondContact O-CG 3.44Å; L45-L49 PolarHBondContact O-N 3.44Å; L45-P75 HydrophobicContact CD2-CG 3.82Å
46A94.6Very high94.7Very high30 Ų3069.2 Ų69.225%0.24837%0.374CS..Hα-helixtrans-58.1-39.8178.700000112.1M42 K43M42-A46 PolarHBondContact O-N 3.17Å; M42-A46 VanDerWaalsContact O-N 3.12Å; K43-A46 PolarHBondContact O-N 3.09Å
47N94.9Very high95.4Very high89 Ų8968.9 Ų68.948%0.47636%0.359SS..Hα-helixtrans-68.7-41.9175.9-74.8-34000112.3K43 E44 L45 L49 K50K43-N47 WeakPolarHBondContact O-CB 3.32Å; K43-N47 PolarHBondContact O-N 3.39Å; K43-N47 PolarHBondContact O-ND2 3.18Å; E44-N47 PolarHBondContact O-N 3.43Å; L45-N47 VanDerWaalsContact C-N 3.27Å; L45-N47 PolarHBondContact O-N 2.9Å; N47-L49 VanDerWaalsContact C-N 3.3Å; N47-L49 PolarHBondContact O-N 3.3Å; N47-K50 PolarHBondContact O-N 2.93Å; N47-K50 PolarHBondContact OD1-NZ 3.12Å
48Q95.1Very high95.7Very high88 Ų8867.6 Ų67.641%0.41136%0.355SS..Hα-helixtrans-66.5-31.1178.1-71.7172.4-5.600112.9Y37 E44 L45 K50 K52Y37-Q48 PolarHBondContact OH-OE1 2.98Å; E44-Q48 VanDerWaalsContact O-CG 3.31Å; E44-Q48 WeakPolarHBondContact O-CG 3.47Å; E44-Q48 PolarHBondContact O-N 3.44Å; L45-Q48 PolarHBondContact O-N 3.46Å; L45-Q48 VanDerWaalsContact O-N 3.14Å; Q48-K50 VanDerWaalsContact C-N 3.33Å; Q48-K52 VanDerWaalsContact O-CG 3.32Å; Q48-K52 WeakPolarHBondContact O-CG 2.75Å
49L95.1Very high96Very high24 Ų2469.9 Ų69.913%0.12637%0.365CS..Hα-helixtrans-73.2-20179.7-76.9174.7000113.8L45 N47 D51 K52 L56 Q57 D60L45-L49 HydrophobicContact CD1-CD1 4.05Å; L45-L49 HydrophobicContact CD1-CG 4.01Å; L45-L49 HydrophobicContact CD2-CD1 4.43Å; L45-L49 HydrophobicContact CG-CD1 3.85Å; L45-L49 HydrophobicContact CG-CG 4.24Å; L45-L49 WeakPolarHBondContact O-CB 3.39Å; L45-L49 WeakPolarHBondContact O-CG 3.44Å; L45-L49 PolarHBondContact O-N 3.44Å; N47-L49 VanDerWaalsContact C-N 3.3Å; N47-L49 PolarHBondContact O-N 3.3Å; L49-D51 PolarHBondContact O-N 3.2Å; L49-K52 HydrophobicContact CD2-CB 4.24Å; L49-K52 HydrophobicContact CD2-CG 4.25Å; L49-K52 WeakPolarHBondContact O-CB 3.14Å; L49-K52 PolarHBondContact O-N 2.86Å; L49-L56 HydrophobicContact CD2-CB 4.31Å; L49-Q57 HydrophobicContact CB-CG 4.47Å; L49-Q57 VanDerWaalsContact O-CD 3.28Å; L49-Q57 VanDerWaalsContact O-CG 3.22Å; L49-Q57 WeakPolarHBondContact O-CG 3.32Å; L49-Q57 PolarHBondContact O-NE2 3.26Å; L49-Q57 VanDerWaalsContact O-NE2 3.17Å; L49-D60 HydrophobicContact CD1-CB 3.61Å
50K93.2Very high96.1Very high130 Ų13067.9 Ų67.957%0.56535%0.352SS*.THydrogen-bonded Turntrans-56.2-34.5-179.4-72.4172.6179.4168.10113N47 Q48 Q57N47-K50 PolarHBondContact O-N 2.93Å; N47-K50 PolarHBondContact OD1-NZ 3.12Å; Q48-K50 VanDerWaalsContact C-N 3.33Å; K50-Q57 PolarHBondContact O-NE2 3.39Å; K50-Q57 VanDerWaalsContact O-NE2 3.09Å
51D94.2Very high96.2Very high143 Ų14369 Ų6977%0.76536%0.356SS*.THydrogen-bonded Turntrans-9914-179.6-52.9-43000113L49L49-D51 PolarHBondContact O-N 3.2Å
52K96.1Very high96.4Very high106 Ų10668.1 Ų68.146%0.46135%0.351SS..SBendtrans-105164.2-178.9-58.8-62.1176.9-1190111Q48 L49 V54 Q57Q48-K52 VanDerWaalsContact O-CG 3.32Å; Q48-K52 WeakPolarHBondContact O-CG 2.75Å; L49-K52 HydrophobicContact CD2-CB 4.24Å; L49-K52 HydrophobicContact CD2-CG 4.25Å; L49-K52 WeakPolarHBondContact O-CB 3.14Å; L49-K52 PolarHBondContact O-N 2.86Å; K52-V54 PolarHBondContact O-N 2.88Å; K52-Q57 PolarHBondContact O-NE2 3.36Å
53P97.1Very high96.5Very high87 Ų8768.9 Ų68.957%0.56536%0.355SS*.  trans-49.4137.6178.9-29.835.8000113V55 L56 Q57P53-V55 PolarHBondContact O-N 2.79Å; P53-V55 VanDerWaalsContact O-N 3.08Å; P53-L56 WeakPolarHBondContact O-CB 3.31Å; P53-L56 PolarHBondContact O-N 3.06Å; P53-Q57 PolarHBondContact O-N 3.04Å
54V96.4Very high96.7Very high100 Ų10065.2 Ų65.261%0.60634%0.339SS*.Hα-helixtrans-56.1-30.6-176.166.60000113.2K52 L56 Q57 F58K52-V54 PolarHBondContact O-N 2.88Å; V54-L56 VanDerWaalsContact C-N 3.33Å; V54-L56 PolarHBondContact O-N 3.37Å; V54-Q57 PolarHBondContact O-N 3.25Å; V54-F58 WeakPolarHBondContact O-CB 3.21Å; V54-F58 PolarHBondContact O-N 2.9Å
55V97.8Very high96.9Very high96 Ų9659.8 Ų59.858%0.58231%0.314SS*.Hα-helixtrans-63.1-39.4176.7-179.90000111.3P53 F58 I59P53-V55 PolarHBondContact O-N 2.79Å; P53-V55 VanDerWaalsContact O-N 3.08Å; V55-F58 PolarHBondContact O-N 3.25Å; V55-I59 HydrophobicContact CG1-CD1 4.12Å; V55-I59 VanDerWaalsContact O-CG1 3.3Å; V55-I59 WeakPolarHBondContact O-CG1 3.4Å; V55-I59 PolarHBondContact O-N 2.86Å
56L97.6Very high97.1Very high87 Ų8758 Ų5846%0.45531%0.305SS..Hα-helixtrans-69.8-38.9176.8-62.9-177.9000111.5L49 P53 V54 F58 I59 D60L49-L56 HydrophobicContact CD2-CB 4.31Å; P53-L56 WeakPolarHBondContact O-CB 3.31Å; P53-L56 PolarHBondContact O-N 3.06Å; V54-L56 VanDerWaalsContact C-N 3.33Å; V54-L56 PolarHBondContact O-N 3.37Å; L56-F58 VanDerWaalsContact C-N 3.32Å; L56-I59 PolarHBondContact O-N 3.39Å; L56-D60 PolarHBondContact O-N 3.13Å
57Q97.7Very high97.3Very high41 Ų4156.6 Ų56.619%0.19229%0.293CS..Hα-helixtrans-61.5-44.7172.9-59.1-172.940.600110.5L49 K50 K52 P53 V54 I59 D60 W61L49-Q57 HydrophobicContact CB-CG 4.47Å; L49-Q57 VanDerWaalsContact O-CD 3.28Å; L49-Q57 VanDerWaalsContact O-CG 3.22Å; L49-Q57 WeakPolarHBondContact O-CG 3.32Å; L49-Q57 PolarHBondContact O-NE2 3.26Å; L49-Q57 VanDerWaalsContact O-NE2 3.17Å; K50-Q57 PolarHBondContact O-NE2 3.39Å; K50-Q57 VanDerWaalsContact O-NE2 3.09Å; K52-Q57 PolarHBondContact O-NE2 3.36Å; P53-Q57 PolarHBondContact O-N 3.04Å; V54-Q57 PolarHBondContact O-N 3.25Å; Q57-I59 PolarHBondContact O-N 2.98Å; Q57-D60 WeakPolarHBondContact O-CB 3.25Å; Q57-D60 PolarHBondContact O-N 3.37Å; Q57-W61 HydrophobicContact CB-CZ2 3.83Å; Q57-W61 PolarHBondContact O-N 3.18Å; Q57-W61 PolarHBondContact O-NE1 2.92Å
58F98.4Very high97.4Very high41 Ų4153.2 Ų53.218%0.1827%0.274CS..Hα-helixtrans-60.9-45.7178.1-172-101.2000111.8V54 V55 L56 D60 W61 I62 V101 T104 L105 L108V54-F58 WeakPolarHBondContact O-CB 3.21Å; V54-F58 PolarHBondContact O-N 2.9Å; V55-F58 PolarHBondContact O-N 3.25Å; L56-F58 VanDerWaalsContact C-N 3.32Å; F58-D60 VanDerWaalsContact C-N 3.33Å; F58-D60 PolarHBondContact O-N 3.13Å; F58-W61 AromaticContact CD2-CE3 3.95Å; F58-W61 HydrophobicContact CD2-CE3 3.95Å; F58-W61 HydrophobicContact CD2-CZ3 4.24Å; F58-W61 WeakPolarHBondContact O-CB 3.35Å; F58-W61 PolarHBondContact O-N 2.89Å; F58-W61 VanDerWaalsContact O-N 3.15Å; F58-I62 HydrophobicContact CD1-CG1 4.16Å; F58-I62 HydrophobicContact CE1-CD1 4Å; F58-I62 HydrophobicContact CE1-CG1 3.85Å; F58-I62 HydrophobicContact CE2-CD1 4.38Å; F58-I62 HydrophobicContact CZ-CD1 3.84Å; F58-I62 HydrophobicContact CZ-CG1 4.21Å; F58-I62 WeakPolarHBondContact O-CG1 3.43Å; F58-I62 PolarHBondContact O-N 2.74Å; F58-V101 HydrophobicContact CE1-CG1 4.23Å; F58-V101 HydrophobicContact CZ-CG1 4.22Å; F58-T104 HydrophobicContact CD2-CG2 4.19Å; F58-T104 HydrophobicContact CE2-CG2 3.58Å; F58-T104 HydrophobicContact CZ-CG2 4.26Å; F58-L105 HydrophobicContact CE2-CD2 3.77Å; F58-L105 HydrophobicContact CE2-CG 4.13Å; F58-L105 HydrophobicContact CZ-CD2 3.76Å; F58-L105 HydrophobicContact CZ-CG 3.79Å; F58-L108 HydrophobicContact CD2-CD1 4.15Å; F58-L108 HydrophobicContact CE2-CD1 3.94Å
59I98.6Very high97.6Very high84 Ų8449.1 Ų49.143%0.43126%0.255SS..Hα-helixtrans-59.5-43.2175.4-68.1164.6000111.2V55 L56 Q57 W61 I62 L63V55-I59 HydrophobicContact CG1-CD1 4.12Å; V55-I59 VanDerWaalsContact O-CG1 3.3Å; V55-I59 WeakPolarHBondContact O-CG1 3.4Å; V55-I59 PolarHBondContact O-N 2.86Å; L56-I59 PolarHBondContact O-N 3.39Å; Q57-I59 PolarHBondContact O-N 2.98Å; I59-W61 VanDerWaalsContact C-N 3.33Å; I59-W61 PolarHBondContact O-N 3.35Å; I59-I62 PolarHBondContact O-N 2.82Å; I59-L63 HydrophobicContact CG2-CD1 3.94Å; I59-L63 HydrophobicContact CG2-CG 4.37Å; I59-L63 WeakPolarHBondContact O-CG 3.12Å; I59-L63 PolarHBondContact O-N 2.64Å
60D98.6Very high97.8Very high11 Ų1148 Ų486%0.05925%0.25CC..Hα-helixtrans-58.4-43.4174.5173.577.6000111.7L49 L56 Q57 F58 I62 L63 R64 P75L49-D60 HydrophobicContact CD1-CB 3.61Å; L56-D60 PolarHBondContact O-N 3.13Å; Q57-D60 WeakPolarHBondContact O-CB 3.25Å; Q57-D60 PolarHBondContact O-N 3.37Å; F58-D60 VanDerWaalsContact C-N 3.33Å; F58-D60 PolarHBondContact O-N 3.13Å; D60-I62 PolarHBondContact O-N 3.02Å; D60-L63 PolarHBondContact O-N 3.09Å; D60-R64 WeakPolarHBondContact O-CB 3.46Å; D60-R64 VanDerWaalsContact O-CG 3.27Å; D60-R64 WeakPolarHBondContact O-CG 3.36Å; D60-R64 PolarHBondContact O-N 3.37Å; D60-R64 IonicContact OD1-CZ 2.74Å; D60-R64 IonicContact OD1-NE 3.63Å; D60-R64 PolarHBondContact OD1-NE 2.96Å; D60-R64 IonicContact OD1-NH2 3.46Å; D60-R64 PolarHBondContact OD1-NH2 3.27Å; D60-R64 WeakPolarHBondContact OD2-CD 3.35Å; D60-R64 IonicContact OD2-CZ 2.89Å; D60-R64 IonicContact OD2-NE 3.86Å; D60-R64 PolarHBondContact OD2-NE 3.37Å; D60-P75 WeakPolarHBondContact OD1-CG 3.27Å
61W98.7Very high98.1Very high25 Ų2542.5 Ų42.510%0.09523%0.225CC..Hα-helixtrans-64.1-39.2177.4-52.8-14.5000112.4Q57 F58 I59 G65 T104 L108 I117 A118Q57-W61 HydrophobicContact CB-CZ2 3.83Å; Q57-W61 PolarHBondContact O-N 3.18Å; Q57-W61 PolarHBondContact O-NE1 2.92Å; F58-W61 AromaticContact CD2-CE3 3.95Å; F58-W61 HydrophobicContact CD2-CE3 3.95Å; F58-W61 HydrophobicContact CD2-CZ3 4.24Å; F58-W61 WeakPolarHBondContact O-CB 3.35Å; F58-W61 PolarHBondContact O-N 2.89Å; F58-W61 VanDerWaalsContact O-N 3.15Å; I59-W61 VanDerWaalsContact C-N 3.33Å; I59-W61 PolarHBondContact O-N 3.35Å; W61-G65 PolarHBondContact O-N 3.01Å; W61-T104 HydrophobicContact CB-CG2 4.44Å; W61-T104 HydrophobicContact CE3-CG2 4.31Å; W61-L108 HydrophobicContact CZ3-CD1 4.14Å; W61-L108 HydrophobicContact CZ3-CD2 3.85Å; W61-I117 HydrophobicContact CD2-CG2 4.13Å; W61-I117 HydrophobicContact CE3-CG2 3.71Å; W61-I117 HydrophobicContact CZ3-CG2 4.2Å; W61-A118 VanDerWaalsContact CD1-CA 3.42Å
62I98.8Very high98.3Very high6 Ų635.7 Ų35.73%0.03119%0.189CC..Hα-helixtrans-63.7-48.3175.4-61.7-47.5000110.8F58 I59 D60 G65 I66 T100 V101 T104F58-I62 HydrophobicContact CD1-CG1 4.16Å; F58-I62 HydrophobicContact CE1-CD1 4Å; F58-I62 HydrophobicContact CE1-CG1 3.85Å; F58-I62 HydrophobicContact CE2-CD1 4.38Å; F58-I62 HydrophobicContact CZ-CD1 3.84Å; F58-I62 HydrophobicContact CZ-CG1 4.21Å; F58-I62 WeakPolarHBondContact O-CG1 3.43Å; F58-I62 PolarHBondContact O-N 2.74Å; I59-I62 PolarHBondContact O-N 2.82Å; D60-I62 PolarHBondContact O-N 3.02Å; I62-G65 CarbonylContact O-C 3.58Å; I62-G65 WeakPolarHBondContact O-CA 3.36Å; I62-G65 PolarHBondContact O-N 3.34Å; I62-G65 VanDerWaalsContact O-N 3.08Å; I62-I66 HydrophobicContact CG2-CD1 4.29Å; I62-I66 WeakPolarHBondContact O-CG1 3.36Å; I62-I66 PolarHBondContact O-N 3.19Å; I62-T100 HydrophobicContact CB-CG2 4.45Å; I62-T100 HydrophobicContact CD1-CG2 4.13Å; I62-T100 HydrophobicContact CG2-CG2 3.88Å; I62-V101 HydrophobicContact CD1-CB 4.45Å; I62-V101 HydrophobicContact CD1-CG2 4.06Å; I62-V101 HydrophobicContact CG1-CG2 4.1Å; I62-V101 HydrophobicContact CG2-CG2 4.31Å; I62-T104 HydrophobicContact CD1-CG2 3.96Å; I62-T104 WeakPolarHBondContact CD1-OG1 3.43Å
63L98.9Very high98.4Very high25 Ų2532.2 Ų32.213%0.13118%0.176CC..Hα-helixtrans-65.4-41.3-178.8-66.8172.5000111.9I59 D60 G65 I66 S67 P75 G78 I79I59-L63 HydrophobicContact CG2-CD1 3.94Å; I59-L63 HydrophobicContact CG2-CG 4.37Å; I59-L63 WeakPolarHBondContact O-CG 3.12Å; I59-L63 PolarHBondContact O-N 2.64Å; D60-L63 PolarHBondContact O-N 3.09Å; L63-G65 VanDerWaalsContact C-N 3.29Å; L63-G65 PolarHBondContact O-N 2.93Å; L63-I66 PolarHBondContact O-N 3.04Å; L63-S67 PolarHBondContact O-N 3.47Å; L63-S67 VanDerWaalsContact O-N 3.12Å; L63-P75 HydrophobicContact CB-CB 3.79Å; L63-P75 HydrophobicContact CD1-CB 4.17Å; L63-G78 WeakPolarHBondContact O-CA 3.45Å; L63-I79 HydrophobicContact CD1-CD1 3.98Å; L63-I79 HydrophobicContact CD1-CG1 3.76Å; L63-I79 HydrophobicContact CD2-CG1 3.74Å; L63-I79 HydrophobicContact CG-CG1 4.34Å
64R98.8Very high98.5Very high4 Ų428 Ų282%0.01515%0.149CC..Hα-helixtrans-61.4-39.3170.3-70.8170.6-177.4-79.7-5.2111.3D41 M42 D60 I66 S67 Q68 N73 P75 A118D41-R64 PolarHBondContact O-NH1 3.23Å; M42-R64 PolarHBondContact O-NH2 3.45Å; D60-R64 WeakPolarHBondContact O-CB 3.46Å; D60-R64 VanDerWaalsContact O-CG 3.27Å; D60-R64 WeakPolarHBondContact O-CG 3.36Å; D60-R64 PolarHBondContact O-N 3.37Å; D60-R64 IonicContact OD1-CZ 2.74Å; D60-R64 IonicContact OD1-NE 3.63Å; D60-R64 PolarHBondContact OD1-NE 2.96Å; D60-R64 IonicContact OD1-NH2 3.46Å; D60-R64 PolarHBondContact OD1-NH2 3.27Å; D60-R64 WeakPolarHBondContact OD2-CD 3.35Å; D60-R64 IonicContact OD2-CZ 2.89Å; D60-R64 IonicContact OD2-NE 3.86Å; D60-R64 PolarHBondContact OD2-NE 3.37Å; R64-I66 VanDerWaalsContact C-N 3.34Å; R64-I66 PolarHBondContact O-N 3.42Å; R64-S67 PolarHBondContact O-N 3.27Å; R64-S67 PolarHBondContact O-OG 3.39Å; R64-Q68 WeakPolarHBondContact O-CB 3.3Å; R64-Q68 WeakPolarHBondContact O-CG 3.38Å; R64-Q68 PolarHBondContact O-N 3.44Å; R64-N73 VanDerWaalsContact CD-OD1 3.26Å; R64-N73 WeakPolarHBondContact CD-OD1 3.46Å; R64-N73 WeakPolarHBondContact CG-OD1 3.49Å; R64-N73 PolarHBondContact NH1-O 2.96Å; R64-N73 PolarHBondContact NH1-OD1 3.37Å; R64-P75 HydrophobicContact CG-CB 4.39Å; R64-A118 WeakPolarHBondContact CD-O 3.3Å
65G98.8Very high98.6Very high0 Ų023.6 Ų23.60%012%0.122CC..Hα-helixtrans-58.9-43.7174.400000112.6W61 I62 L63 S67 Q68 G120 Y124W61-G65 PolarHBondContact O-N 3.01Å; I62-G65 CarbonylContact O-C 3.58Å; I62-G65 WeakPolarHBondContact O-CA 3.36Å; I62-G65 PolarHBondContact O-N 3.34Å; I62-G65 VanDerWaalsContact O-N 3.08Å; L63-G65 VanDerWaalsContact C-N 3.29Å; L63-G65 PolarHBondContact O-N 2.93Å; G65-S67 PolarHBondContact O-N 3.47Å; G65-Q68 PolarHBondContact O-N 3.29Å; G65-G120 WeakPolarHBondContact CA-O 3.3Å; G65-Y124 WeakPolarHBondContact O-CA 3.48Å; G65-Y124 WeakPolarHBondContact O-CB 3.47Å; G65-Y124 PolarHBondContact O-N 3.43Å
66I98.9Very high98.6Very high1 Ų121.2 Ų21.21%0.00511%0.107CC..Hα-helixtrans-63.1-43.3176.5-67.2166.9000110.9I62 L63 R64 Q68 I81 L82 T100 T127 Y234I62-I66 HydrophobicContact CG2-CD1 4.29Å; I62-I66 WeakPolarHBondContact O-CG1 3.36Å; I62-I66 PolarHBondContact O-N 3.19Å; L63-I66 PolarHBondContact O-N 3.04Å; R64-I66 VanDerWaalsContact C-N 3.34Å; R64-I66 PolarHBondContact O-N 3.42Å; I66-Q68 VanDerWaalsContact C-N 3.35Å; I66-Q68 PolarHBondContact O-N 3.36Å; I66-I81 HydrophobicContact CG2-CB 3.99Å; I66-I81 HydrophobicContact CG2-CG2 3.52Å; I66-L82 HydrophobicContact CD1-CD1 4.33Å; I66-T100 HydrophobicContact CG1-CG2 4.3Å; I66-T127 HydrophobicContact CG1-CG2 4.14Å; I66-Y234 PolarHBondContact O-OH 3.1Å
67S98.8Very high98.7Very high0 Ų017 Ų170%09%0.086CC..Hα-helixtrans-72.6-25.1-179.566.80000114L63 R64 G65 V69 V70 V72 N74L63-S67 PolarHBondContact O-N 3.47Å; L63-S67 VanDerWaalsContact O-N 3.12Å; R64-S67 PolarHBondContact O-N 3.27Å; R64-S67 PolarHBondContact O-OG 3.39Å; G65-S67 PolarHBondContact O-N 3.47Å; S67-V69 PolarHBondContact O-N 3.2Å; S67-V70 WeakPolarHBondContact O-CG2 3.35Å; S67-V70 PolarHBondContact O-N 3.03Å; S67-V72 CarbonylContact C-O 3.37Å; S67-V72 VanDerWaalsContact CB-O 3.31Å; S67-V72 WeakPolarHBondContact CB-O 3.43Å; S67-V72 PolarHBondContact O-N 3.03Å; S67-V72 PolarHBondContact OG-O 3.39Å; S67-N74 PolarHBondContact OG-N 2.92Å; S67-N74 PolarHBondContact OG-O 3.08Å
68Q98.8Very high98.7Very high19 Ų1915.1 Ų15.19%0.0898%0.076CC..G310 helixtrans-68.1-14.9-177.7-82.7-73.920.200114R64 G65 I66 V70 F71 V72 S119 L121 Y124R64-Q68 WeakPolarHBondContact O-CB 3.3Å; R64-Q68 WeakPolarHBondContact O-CG 3.38Å; R64-Q68 PolarHBondContact O-N 3.44Å; G65-Q68 PolarHBondContact O-N 3.29Å; I66-Q68 VanDerWaalsContact C-N 3.35Å; I66-Q68 PolarHBondContact O-N 3.36Å; Q68-V70 PolarHBondContact O-N 3.26Å; Q68-F71 WeakPolarHBondContact O-CA 3.43Å; Q68-F71 PolarHBondContact O-N 2.61Å; Q68-V72 VanDerWaalsContact CA-O 3.32Å; Q68-V72 WeakPolarHBondContact CA-O 3.37Å; Q68-V72 WeakPolarHBondContact CG-O 3.26Å; Q68-V72 PolarHBondContact N-O 3.21Å; Q68-S119 VanDerWaalsContact CG-O 3.28Å; Q68-S119 WeakPolarHBondContact CG-O 3.22Å; Q68-S119 PolarHBondContact NE2-O 2.96Å; Q68-L121 HydrophobicContact CG-CD2 4.43Å; Q68-Y124 HydrophobicContact CB-CD1 3.87Å; Q68-Y124 HydrophobicContact CB-CG 4.01Å
69V98.9Very high98.8Very high1 Ų117 Ų171%0.0069%0.088CC..G310 helixtrans-56-34.2171.4168.30000111.1S67 Y124 L128 I233 Y234S67-V69 PolarHBondContact O-N 3.2Å; V69-Y124 WeakPolarHBondContact CG2-O 3.47Å; V69-L128 HydrophobicContact CG1-CD1 4.07Å; V69-L128 HydrophobicContact CG1-CD2 3.73Å; V69-L128 HydrophobicContact CG1-CG 4.01Å; V69-L128 HydrophobicContact CG2-CD1 4.39Å; V69-L128 HydrophobicContact CG2-CD2 4.29Å; V69-L128 HydrophobicContact CG2-CG 3.92Å; V69-I233 HydrophobicContact CG1-CG2 3.68Å; V69-Y234 HydrophobicContact CB-CE1 3.69Å; V69-Y234 HydrophobicContact CB-CE2 4.26Å; V69-Y234 VanDerWaalsContact CB-CZ 3.49Å; V69-Y234 WeakPolarHBondContact CB-OH 3.45Å; V69-Y234 HydrophobicContact CG1-CD1 4.21Å; V69-Y234 HydrophobicContact CG1-CD2 4.32Å; V69-Y234 HydrophobicContact CG1-CE1 3.71Å; V69-Y234 HydrophobicContact CG1-CE2 3.83Å; V69-Y234 HydrophobicContact CG2-CD1 4.46Å; V69-Y234 HydrophobicContact CG2-CE1 3.63Å
70V98.8Very high98.8Very high2 Ų216 Ų161%0.0128%0.083CC..G310 helixtrans-104.325.1175.2-66.70000112.4S67 Q68 V72 I81 I233 Y234 I249 M256 L292S67-V70 WeakPolarHBondContact O-CG2 3.35Å; S67-V70 PolarHBondContact O-N 3.03Å; Q68-V70 PolarHBondContact O-N 3.26Å; V70-V72 HydrophobicContact CG2-CB 4.26Å; V70-V72 HydrophobicContact CG2-CG2 4.01Å; V70-V72 PolarHBondContact O-N 3.06Å; V70-I81 HydrophobicContact CG2-CD1 4.2Å; V70-I233 HydrophobicContact CG1-CD1 4.02Å; V70-I233 HydrophobicContact CG1-CG2 3.87Å; V70-Y234 HydrophobicContact CG1-CE2 4.04Å; V70-I249 HydrophobicContact CB-CD1 4.12Å; V70-I249 HydrophobicContact CB-CG1 4.26Å; V70-I249 HydrophobicContact CG1-CD1 4.21Å; V70-I249 HydrophobicContact CG2-CD1 4.2Å; V70-I249 HydrophobicContact CG2-CG1 3.84Å; V70-M256 WeakPolarHBondContact O-CE 3.43Å; V70-L292 HydrophobicContact CG1-CD2 4.49Å
71F98.8Very high98.8Very high13 Ų1315.5 Ų15.56%0.0578%0.08CC..THydrogen-bonded Turntrans63.214.9-178.5-38.2-70.5000115.4Q68 F176 M256 L292 I295 A296 M300 F301 F342Q68-F71 WeakPolarHBondContact O-CA 3.43Å; Q68-F71 PolarHBondContact O-N 2.61Å; F71-F176 AromaticContact CE1-CD1 3.82Å; F71-F176 HydrophobicContact CE1-CD1 3.82Å; F71-F176 HydrophobicContact CE1-CE1 4.07Å; F71-F176 HydrophobicContact CZ-CD1 4.42Å; F71-M256 HydrophobicContact CB-CE 3.93Å; F71-L292 HydrophobicContact CE2-CD2 3.93Å; F71-L292 HydrophobicContact CZ-CD2 4.12Å; F71-I295 HydrophobicContact CD2-CB 4.16Å; F71-I295 HydrophobicContact CD2-CG2 3.69Å; F71-I295 HydrophobicContact CE2-CB 4.22Å; F71-I295 HydrophobicContact CE2-CG2 4.26Å; F71-A296 HydrophobicContact CE2-CB 4.05Å; F71-A296 HydrophobicContact CZ-CB 4.14Å; F71-M300 HydrophobicContact CB-CE 3.99Å; F71-M300 HydrophobicContact CB-CG 4.21Å; F71-M300 HydrophobicContact CB-SD 4.45Å; F71-M300 WeakPolarHBondContact O-CE 3.43Å; F71-F301 AromaticContact CD1-CE2 3.91Å; F71-F301 HydrophobicContact CD1-CE2 3.91Å; F71-F301 HydrophobicContact CD1-CZ 4.21Å; F71-F301 HydrophobicContact CE1-CE2 4.19Å; F71-F301 HydrophobicContact CG-CE2 4.3Å; F71-F342 AromaticContact CE1-CZ 3.96Å; F71-F342 HydrophobicContact CE1-CZ 3.96Å; F71-F342 HydrophobicContact CZ-CE1 4.22Å; F71-F342 AromaticContact CZ-CE2 3.84Å; F71-F342 HydrophobicContact CZ-CE2 3.84Å; F71-F342 AromaticContact CZ-CZ 3.4Å; F71-F342 HydrophobicContact CZ-CZ 3.4Å
72V98.8Very high98.8Very high1 Ų116.2 Ų16.21%0.0069%0.085CC..  trans-91.2129.2179.8170.80000109.5S67 Q68 V70 N74 I249 M256S67-V72 CarbonylContact C-O 3.37Å; S67-V72 VanDerWaalsContact CB-O 3.31Å; S67-V72 WeakPolarHBondContact CB-O 3.43Å; S67-V72 PolarHBondContact O-N 3.03Å; S67-V72 PolarHBondContact OG-O 3.39Å; Q68-V72 VanDerWaalsContact CA-O 3.32Å; Q68-V72 WeakPolarHBondContact CA-O 3.37Å; Q68-V72 WeakPolarHBondContact CG-O 3.26Å; Q68-V72 PolarHBondContact N-O 3.21Å; V70-V72 HydrophobicContact CG2-CB 4.26Å; V70-V72 HydrophobicContact CG2-CG2 4.01Å; V70-V72 PolarHBondContact O-N 3.06Å; V72-N74 HydrophobicContact CG1-CB 3.52Å; V72-I249 HydrophobicContact CG2-CG1 4.5Å; V72-M256 HydrophobicContact CG2-CE 3.64Å; V72-M256 HydrophobicContact CG2-SD 4.26Å
73N98.6Very high98.8Very high32 Ų3219 Ų1917%0.17110%0.103CC..  trans-104.464174.4-175.511000110.7D41 R64 S119D41-N73 CarbonylContact C-O 3.58Å; D41-N73 WeakPolarHBondContact CA-O 3.46Å; D41-N73 HydrophobicContact CB-CB 4.08Å; D41-N73 VanDerWaalsContact O-O 3.07Å; R64-N73 VanDerWaalsContact CD-OD1 3.26Å; R64-N73 WeakPolarHBondContact CD-OD1 3.46Å; R64-N73 WeakPolarHBondContact CG-OD1 3.49Å; R64-N73 PolarHBondContact NH1-O 2.96Å; R64-N73 PolarHBondContact NH1-OD1 3.37Å; N73-S119 PolarHBondContact OD1-O 3.45Å
74N98.8Very high98.8Very high0 Ų017.9 Ų17.90%010%0.097CC..  trans-142.4116.9-171.9-175.7-46.9000110.9V38 G40 M42 S67 V72 V76 S77 G78V38-N74 PolarHBondContact O-ND2 2.82Å; G40-N74 PolarHBondContact O-ND2 3.29Å; M42-N74 PolarHBondContact SD-OD1 3.32Å; S67-N74 PolarHBondContact OG-N 2.92Å; S67-N74 PolarHBondContact OG-O 3.08Å; V72-N74 HydrophobicContact CG1-CB 3.52Å; N74-V76 VanDerWaalsContact C-N 3.31Å; N74-V76 PolarHBondContact O-N 2.99Å; N74-V76 WeakPolarHBondContact OD1-CA 3.4Å; N74-V76 WeakPolarHBondContact OD1-CB 3.4Å; N74-V76 PolarHBondContact OD1-N 3.27Å; N74-S77 WeakPolarHBondContact O-CB 3.2Å; N74-S77 PolarHBondContact O-N 3.44Å; N74-S77 PolarHBondContact OD1-N 3.17Å; N74-G78 PolarHBondContact O-N 3.46Å
75P98.6Very high98.8Very high6 Ų617.7 Ų17.74%0.03910%0.096CC..Hα-helixtrans-66.9-29.3-176.828.2-36.8000113.2M42 L45 D60 L63 R64 G78 I79M42-P75 HydrophobicContact SD-CG 3.91Å; L45-P75 HydrophobicContact CD2-CG 3.82Å; D60-P75 WeakPolarHBondContact OD1-CG 3.27Å; L63-P75 HydrophobicContact CB-CB 3.79Å; L63-P75 HydrophobicContact CD1-CB 4.17Å; R64-P75 HydrophobicContact CG-CB 4.39Å; P75-G78 PolarHBondContact O-N 3.42Å; P75-I79 WeakPolarHBondContact O-CG1 3.5Å; P75-I79 PolarHBondContact O-N 3.42Å
76V98.6Very high98.8Very high46 Ų4621.9 Ų21.928%0.27912%0.118SC..Hα-helixtrans-71.1-41.8176.6-176.70000110.3V38 M42 N74 G78 I79 L80 L251V38-V76 HydrophobicContact CG1-CG2 4.38Å; M42-V76 HydrophobicContact CE-CG2 3.93Å; M42-V76 HydrophobicContact SD-CB 4.34Å; M42-V76 HydrophobicContact SD-CG2 3.73Å; N74-V76 VanDerWaalsContact C-N 3.31Å; N74-V76 PolarHBondContact O-N 2.99Å; N74-V76 WeakPolarHBondContact OD1-CA 3.4Å; N74-V76 WeakPolarHBondContact OD1-CB 3.4Å; N74-V76 PolarHBondContact OD1-N 3.27Å; V76-G78 PolarHBondContact O-N 3.21Å; V76-I79 PolarHBondContact O-N 2.96Å; V76-L80 WeakPolarHBondContact O-CG 3.43Å; V76-L80 PolarHBondContact O-N 2.94Å; V76-L251 HydrophobicContact CB-CD2 3.97Å; V76-L251 HydrophobicContact CG1-CD2 3.51Å
77S98.8Very high98.8Very high0 Ų025 Ų250%014%0.137CC..Hα-helixtrans-58.7-39.8169.2-59.30000111.2N74 I79 L80 I81 A248N74-S77 WeakPolarHBondContact O-CB 3.2Å; N74-S77 PolarHBondContact O-N 3.44Å; N74-S77 PolarHBondContact OD1-N 3.17Å; S77-I79 PolarHBondContact O-N 3.26Å; S77-L80 PolarHBondContact O-N 2.91Å; S77-I81 WeakPolarHBondContact O-CB 3.48Å; S77-I81 WeakPolarHBondContact O-CD1 3.49Å; S77-I81 VanDerWaalsContact O-CG1 3.29Å; S77-I81 WeakPolarHBondContact O-CG1 3.12Å; S77-I81 PolarHBondContact O-N 3.46Å; S77-A248 WeakPolarHBondContact CB-O 3.37Å; S77-A248 PolarHBondContact OG-O 2.93Å
78G98.8Very high98.8Very high0 Ų026.6 Ų26.60%015%0.145CC..Hα-helixtrans-58.6-42.4173.600000113.6L63 N74 P75 V76 I81 L82L63-G78 WeakPolarHBondContact O-CA 3.45Å; N74-G78 PolarHBondContact O-N 3.46Å; P75-G78 PolarHBondContact O-N 3.42Å; V76-G78 PolarHBondContact O-N 3.21Å; G78-I81 PolarHBondContact O-N 3.34Å; G78-L82 WeakPolarHBondContact O-CB 3.36Å; G78-L82 PolarHBondContact O-N 3.02Å
79I98.8Very high98.8Very high82 Ų8226.6 Ų26.642%0.42115%0.145SC..Hα-helixtrans-62.7-47.1173.9-67.8167000110.8L63 P75 V76 S77 I81 L82 V83L63-I79 HydrophobicContact CD1-CD1 3.98Å; L63-I79 HydrophobicContact CD1-CG1 3.76Å; L63-I79 HydrophobicContact CD2-CG1 3.74Å; L63-I79 HydrophobicContact CG-CG1 4.34Å; P75-I79 WeakPolarHBondContact O-CG1 3.5Å; P75-I79 PolarHBondContact O-N 3.42Å; V76-I79 PolarHBondContact O-N 2.96Å; S77-I79 PolarHBondContact O-N 3.26Å; I79-I81 VanDerWaalsContact C-N 3.31Å; I79-I81 PolarHBondContact O-N 3.1Å; I79-L82 WeakPolarHBondContact O-CB 3.39Å; I79-L82 PolarHBondContact O-N 2.86Å; I79-L82 VanDerWaalsContact O-N 3.14Å; I79-V83 WeakPolarHBondContact O-CG2 3.44Å; I79-V83 PolarHBondContact O-N 2.9Å
80L98.8Very high98.8Very high61 Ų6129.5 Ų29.532%0.31916%0.164SC..Hα-helixtrans-61.5-40.6179.1-68.7175.5000111.7V76 S77 V83 G84 I244 A248 L251V76-L80 WeakPolarHBondContact O-CG 3.43Å; V76-L80 PolarHBondContact O-N 2.94Å; S77-L80 PolarHBondContact O-N 2.91Å; L80-V83 WeakPolarHBondContact O-CB 3.49Å; L80-V83 PolarHBondContact O-N 3.39Å; L80-G84 PolarHBondContact O-N 2.88Å; L80-I244 WeakPolarHBondContact O-CG2 3.29Å; L80-A248 HydrophobicContact CB-CB 3.71Å; L80-A248 HydrophobicContact CD1-CB 4.22Å; L80-L251 HydrophobicContact CD1-CD2 3.94Å
81I98.9Very high98.8Very high2 Ų229.4 Ų29.41%0.0116%0.164CC..Hα-helixtrans-63.9-42.6174-70.1158.1000110.6I66 V70 S77 G78 I79 V83 G84 L85 Y234 F245 A248I66-I81 HydrophobicContact CG2-CB 3.99Å; I66-I81 HydrophobicContact CG2-CG2 3.52Å; V70-I81 HydrophobicContact CG2-CD1 4.2Å; S77-I81 WeakPolarHBondContact O-CB 3.48Å; S77-I81 WeakPolarHBondContact O-CD1 3.49Å; S77-I81 VanDerWaalsContact O-CG1 3.29Å; S77-I81 WeakPolarHBondContact O-CG1 3.12Å; S77-I81 PolarHBondContact O-N 3.46Å; G78-I81 PolarHBondContact O-N 3.34Å; I79-I81 VanDerWaalsContact C-N 3.31Å; I79-I81 PolarHBondContact O-N 3.1Å; I81-V83 VanDerWaalsContact C-N 3.3Å; I81-V83 PolarHBondContact O-N 3.28Å; I81-G84 PolarHBondContact O-N 3.42Å; I81-G84 VanDerWaalsContact O-N 3.1Å; I81-L85 HydrophobicContact CG2-CD1 4.4Å; I81-L85 WeakPolarHBondContact O-CG 3.36Å; I81-L85 PolarHBondContact O-N 3.44Å; I81-Y234 HydrophobicContact CG2-CD1 4.47Å; I81-Y234 HydrophobicContact CG2-CE1 3.79Å; I81-Y234 HydrophobicContact CG2-CE2 4.05Å; I81-F245 HydrophobicContact CB-CD1 4.28Å; I81-F245 HydrophobicContact CB-CE1 4.24Å; I81-F245 HydrophobicContact CG1-CD1 4.01Å; I81-F245 HydrophobicContact CG1-CE1 4.46Å; I81-F245 HydrophobicContact CG2-CD1 4.25Å; I81-F245 HydrophobicContact CG2-CE1 3.86Å; I81-F245 HydrophobicContact CG2-CZ 4.36Å; I81-F245 WeakPolarHBondContact O-CE1 3.48Å; I81-A248 HydrophobicContact CD1-CB 4.15Å; I81-A248 HydrophobicContact CG1-CB 3.75Å
82L98.9Very high98.8Very high39 Ų3930.1 Ų30.120%0.20417%0.166CC..Hα-helixtrans-62.5-37.7175.7-169.862.3000112I66 G78 I79 L85 L86 A93 W97I66-L82 HydrophobicContact CD1-CD1 4.33Å; G78-L82 WeakPolarHBondContact O-CB 3.36Å; G78-L82 PolarHBondContact O-N 3.02Å; I79-L82 WeakPolarHBondContact O-CB 3.39Å; I79-L82 PolarHBondContact O-N 2.86Å; I79-L82 VanDerWaalsContact O-N 3.14Å; L82-L85 HydrophobicContact CD1-CD1 4.43Å; L82-L85 PolarHBondContact O-N 2.89Å; L82-L86 WeakPolarHBondContact O-CG 3.49Å; L82-L86 PolarHBondContact O-N 3.47Å; L82-A93 HydrophobicContact CD1-CB 4.32Å; L82-W97 HydrophobicContact CD1-CB 4.48Å
83V98.9Very high98.8Very high66 Ų6630.2 Ų30.240%0.417%0.167SC..Hα-helixtrans-62.3-43.8171.1171.90000111.1I79 L80 I81 L85 L86 V87I79-V83 WeakPolarHBondContact O-CG2 3.44Å; I79-V83 PolarHBondContact O-N 2.9Å; L80-V83 WeakPolarHBondContact O-CB 3.49Å; L80-V83 PolarHBondContact O-N 3.39Å; I81-V83 VanDerWaalsContact C-N 3.3Å; I81-V83 PolarHBondContact O-N 3.28Å; V83-L85 VanDerWaalsContact C-N 3.33Å; V83-L85 PolarHBondContact O-N 3.25Å; V83-L86 WeakPolarHBondContact O-CB 2.97Å; V83-L86 PolarHBondContact O-N 3.19Å; V83-V87 HydrophobicContact CG1-CG2 4.47Å; V83-V87 WeakPolarHBondContact O-CG2 3.31Å; V83-V87 PolarHBondContact O-N 2.96Å
84G98.8Very high98.8Very high0 Ų031.6 Ų31.60%017%0.174CC..Hα-helixtrans-61.3-39.8175.200000112.7L80 I81 V87 Q88 T241L80-G84 PolarHBondContact O-N 2.88Å; I81-G84 PolarHBondContact O-N 3.42Å; I81-G84 VanDerWaalsContact O-N 3.1Å; G84-V87 PolarHBondContact O-N 2.91Å; G84-Q88 PolarHBondContact O-N 3.4Å; G84-T241 WeakPolarHBondContact O-CG2 3.48Å; G84-T241 PolarHBondContact O-OG1 3.22Å
85L98.8Very high98.8Very high1 Ų131.6 Ų31.61%0.00517%0.174CC..Hα-helixtrans-63.8-40.2173-70.8172.1000111.7I81 L82 V83 V87 Q88 N89 A93 V131 Y234 F245I81-L85 HydrophobicContact CG2-CD1 4.4Å; I81-L85 WeakPolarHBondContact O-CG 3.36Å; I81-L85 PolarHBondContact O-N 3.44Å; L82-L85 HydrophobicContact CD1-CD1 4.43Å; L82-L85 PolarHBondContact O-N 2.89Å; V83-L85 VanDerWaalsContact C-N 3.33Å; V83-L85 PolarHBondContact O-N 3.25Å; L85-V87 VanDerWaalsContact C-N 3.34Å; L85-Q88 WeakPolarHBondContact O-CB 3.48Å; L85-Q88 PolarHBondContact O-N 3.02Å; L85-N89 CarbonylContact O-C 3.58Å; L85-N89 PolarHBondContact O-N 3.14Å; L85-N89 VanDerWaalsContact O-O 3.07Å; L85-A93 HydrophobicContact CB-CB 3.79Å; L85-V131 HydrophobicContact CD1-CG2 4.5Å; L85-V131 HydrophobicContact CD2-CG2 4.29Å; L85-Y234 HydrophobicContact CD2-CD1 4.41Å; L85-Y234 HydrophobicContact CD2-CG 4.44Å; L85-F245 HydrophobicContact CD2-CZ 4.1Å; L85-F245 HydrophobicContact CG-CZ 4.17Å
86L98.8Very high98.8Very high87 Ų8731.3 Ų31.346%0.45517%0.172SC..Hα-helixtrans-65.2-37.1174.8-72.4165.9000112.3L82 V83 Q88 P90 A93L82-L86 WeakPolarHBondContact O-CG 3.49Å; L82-L86 PolarHBondContact O-N 3.47Å; V83-L86 WeakPolarHBondContact O-CB 2.97Å; V83-L86 PolarHBondContact O-N 3.19Å; L86-Q88 VanDerWaalsContact C-N 3.32Å; L86-P90 HydrophobicContact CD2-CB 4.18Å; L86-A93 HydrophobicContact CD2-CB 3.74Å; L86-A93 HydrophobicContact CG-CB 3.92Å
87V98.8Very high98.8Very high68 Ų6834.4 Ų34.441%0.41218%0.179SC..Hα-helixtrans-66.7-34.3174.1169.30000111.5V83 G84 L85 W240 I244V83-V87 HydrophobicContact CG1-CG2 4.47Å; V83-V87 WeakPolarHBondContact O-CG2 3.31Å; V83-V87 PolarHBondContact O-N 2.96Å; G84-V87 PolarHBondContact O-N 2.91Å; L85-V87 VanDerWaalsContact C-N 3.34Å; V87-W240 HydrophobicContact CG1-CB 4.46Å; V87-I244 HydrophobicContact CG2-CD1 4.11Å
88Q98.8Very high98.8Very high33 Ų3336 Ų3615%0.15419%0.187CC..Hα-helixtrans-70.3-63.5173.717367.64300110.6G84 L85 L86 W92 C236 D237 T241G84-Q88 PolarHBondContact O-N 3.4Å; L85-Q88 WeakPolarHBondContact O-CB 3.48Å; L85-Q88 PolarHBondContact O-N 3.02Å; L86-Q88 VanDerWaalsContact C-N 3.32Å; Q88-W92 HydrophobicContact CG-CE3 3.51Å; Q88-W92 HydrophobicContact CG-CH2 4.4Å; Q88-W92 HydrophobicContact CG-CZ3 3.43Å; Q88-W92 VanDerWaalsContact CG-CZ3 3.43Å; Q88-W92 VanDerWaalsContact NE2-CZ3 3.31Å; Q88-C236 HydrophobicContact CB-CB 4.19Å; Q88-C236 HydrophobicContact CG-CB 3.84Å; Q88-D237 PolarHBondContact NE2-OD1 2.96Å; Q88-D237 PolarHBondContact OE1-OD1 3.29Å; Q88-T241 HydrophobicContact CB-CG2 4.18Å; Q88-T241 PolarHBondContact N-OG1 3.26Å
89N98.8Very high98.8Very high18 Ų1836 Ų3610%0.09619%0.187CC..  trans-163.9117.1-177.7-168.5-39.9000110.4L85 W91 W92 A93 D141L85-N89 CarbonylContact O-C 3.58Å; L85-N89 PolarHBondContact O-N 3.14Å; L85-N89 VanDerWaalsContact O-O 3.07Å; N89-W91 PolarHBondContact O-N 2.63Å; N89-W91 VanDerWaalsContact OD1-CB 3.25Å; N89-W91 WeakPolarHBondContact OD1-CB 3.31Å; N89-W91 PolarHBondContact OD1-N 2.97Å; N89-W92 HydrophobicContact CB-CB 4.15Å; N89-W92 HydrophobicContact CB-CD2 3.63Å; N89-W92 HydrophobicContact CB-CE3 4.09Å; N89-W92 HydrophobicContact CB-CG 3.68Å; N89-W92 PolarHBondContact ND2-NE1 3.36Å; N89-W92 PolarHBondContact O-N 3.18Å; N89-W92 VanDerWaalsContact O-N 3.07Å; N89-A93 PolarHBondContact O-N 3.26Å; N89-A93 VanDerWaalsContact O-N 3.07Å; N89-D141 VanDerWaalsContact ND2-CG 3.27Å; N89-D141 PolarHBondContact ND2-OD1 3.07Å; N89-D141 VanDerWaalsContact ND2-OD1 3.1Å; N89-D141 PolarHBondContact ND2-OD2 2.85Å
90P98.8Very high98.8Very high63 Ų6332 Ų3241%0.40917%0.167SC..Hα-helixtrans-59.4-29.3178.6-25.334.7000114.9L86 L94L86-P90 HydrophobicContact CD2-CB 4.18Å; P90-L94 WeakPolarHBondContact O-CB 3.36Å; P90-L94 PolarHBondContact O-N 2.89Å
91W98.8Very high98.8Very high0 Ų030.1 Ų30.10%016%0.157CC..Hα-helixtrans-65.1-42.8175.1175.6-123.7000111.4N89 L94 T95 D141 Y142 F143 W144 L146 L147N89-W91 PolarHBondContact O-N 2.63Å; N89-W91 VanDerWaalsContact OD1-CB 3.25Å; N89-W91 WeakPolarHBondContact OD1-CB 3.31Å; N89-W91 PolarHBondContact OD1-N 2.97Å; W91-L94 HydrophobicContact CE3-CD2 3.96Å; W91-L94 HydrophobicContact CZ3-CD2 3.84Å; W91-L94 WeakPolarHBondContact O-CB 3.4Å; W91-L94 PolarHBondContact O-N 3.46Å; W91-T95 HydrophobicContact CD2-CG2 4.15Å; W91-T95 HydrophobicContact CE3-CG2 4.41Å; W91-T95 HydrophobicContact CH2-CG2 4.11Å; W91-T95 HydrophobicContact CZ2-CG2 3.84Å; W91-T95 HydrophobicContact CZ3-CG2 4.39Å; W91-T95 PolarHBondContact O-N 3.12Å; W91-T95 PolarHBondContact O-OG1 2.82Å; W91-D141 HydrophobicContact CB-CB 4.26Å; W91-D141 HydrophobicContact CG-CB 4.29Å; W91-Y142 HydrophobicContact CB-CD1 4.5Å; W91-Y142 HydrophobicContact CB-CE1 4.26Å; W91-Y142 HydrophobicContact CB-CE2 4.49Å; W91-Y142 HydrophobicContact CD2-CD1 4.35Å; W91-Y142 AromaticContact CE3-CD1 3.74Å; W91-Y142 HydrophobicContact CE3-CD1 3.74Å; W91-Y142 HydrophobicContact CE3-CE1 4.25Å; W91-Y142 HydrophobicContact CE3-CG 4.36Å; W91-Y142 HydrophobicContact CZ3-CD1 4.38Å; W91-F143 WeakPolarHBondContact CZ2-O 3.48Å; W91-W144 HydrophobicContact CH2-CE3 4.2Å; W91-W144 HydrophobicContact CZ3-CD2 4.37Å; W91-W144 AromaticContact CZ3-CE3 3.88Å; W91-W144 HydrophobicContact CZ3-CE3 3.88Å; W91-W144 HydrophobicContact CZ3-CH2 4.26Å; W91-W144 AromaticContact CZ3-CZ3 3.83Å; W91-W144 HydrophobicContact CZ3-CZ3 3.83Å; W91-L146 HydrophobicContact CZ2-CB 4.18Å; W91-L146 HydrophobicContact CZ2-CD2 4.2Å; W91-L147 HydrophobicContact CH2-CD2 3.62Å; W91-L147 HydrophobicContact CH2-CG 4.07Å; W91-L147 HydrophobicContact CZ2-CD2 4.43Å; W91-L147 HydrophobicContact CZ3-CD2 4.07Å
92W98.8Very high98.8Very high28 Ų2831.1 Ų31.111%0.10616%0.164CC..Hα-helixtrans-70.4-37.5179.2-56.72.1000111.1Q88 N89 L94 T95 G96 V131 A134 V135 D141 G235Q88-W92 HydrophobicContact CG-CE3 3.51Å; Q88-W92 HydrophobicContact CG-CH2 4.4Å; Q88-W92 HydrophobicContact CG-CZ3 3.43Å; Q88-W92 VanDerWaalsContact CG-CZ3 3.43Å; Q88-W92 VanDerWaalsContact NE2-CZ3 3.31Å; N89-W92 HydrophobicContact CB-CB 4.15Å; N89-W92 HydrophobicContact CB-CD2 3.63Å; N89-W92 HydrophobicContact CB-CE3 4.09Å; N89-W92 HydrophobicContact CB-CG 3.68Å; N89-W92 PolarHBondContact ND2-NE1 3.36Å; N89-W92 PolarHBondContact O-N 3.18Å; N89-W92 VanDerWaalsContact O-N 3.07Å; W92-L94 VanDerWaalsContact C-N 3.31Å; W92-L94 PolarHBondContact O-N 3.17Å; W92-T95 PolarHBondContact O-N 3.41Å; W92-T95 PolarHBondContact O-OG1 2.89Å; W92-G96 PolarHBondContact O-N 3.18Å; W92-V131 HydrophobicContact CB-CG1 4.26Å; W92-A134 HydrophobicContact CG-CB 4.35Å; W92-V135 HydrophobicContact CD2-CG2 3.8Å; W92-V135 HydrophobicContact CE3-CG2 3.69Å; W92-V135 HydrophobicContact CH2-CG2 3.94Å; W92-V135 HydrophobicContact CZ2-CG2 4.04Å; W92-V135 HydrophobicContact CZ3-CG2 3.76Å; W92-D141 PolarHBondContact NE1-OD1 2.92Å; W92-G235 VanDerWaalsContact CZ3-O 3.27Å; W92-G235 WeakPolarHBondContact CZ3-O 3.18Å
93A98.9Very high98.8Very high2 Ų229.3 Ų29.32%0.01715%0.154CC..Hα-helixtrans-59.2-43.3172.100000111.6L82 L85 L86 N89 W97L82-A93 HydrophobicContact CD1-CB 4.32Å; L85-A93 HydrophobicContact CB-CB 3.79Å; L86-A93 HydrophobicContact CD2-CB 3.74Å; L86-A93 HydrophobicContact CG-CB 3.92Å; N89-A93 PolarHBondContact O-N 3.26Å; N89-A93 VanDerWaalsContact O-N 3.07Å; A93-W97 VanDerWaalsContact O-CB 3.22Å; A93-W97 WeakPolarHBondContact O-CB 3.46Å; A93-W97 PolarHBondContact O-N 2.84Å
94L98.9Very high98.8Very high62 Ų6226.2 Ų26.233%0.32514%0.136SC..Hα-helixtrans-63.9-50.1177.5175.963.9000112P90 W91 W92 W97 L98 W144P90-L94 WeakPolarHBondContact O-CB 3.36Å; P90-L94 PolarHBondContact O-N 2.89Å; W91-L94 HydrophobicContact CE3-CD2 3.96Å; W91-L94 HydrophobicContact CZ3-CD2 3.84Å; W91-L94 WeakPolarHBondContact O-CB 3.4Å; W91-L94 PolarHBondContact O-N 3.46Å; W92-L94 VanDerWaalsContact C-N 3.31Å; W92-L94 PolarHBondContact O-N 3.17Å; L94-W97 PolarHBondContact O-N 3.16Å; L94-L98 VanDerWaalsContact O-CB 3.28Å; L94-L98 WeakPolarHBondContact O-CB 3.47Å; L94-L98 PolarHBondContact O-N 2.71Å; L94-W144 HydrophobicContact CD2-CH2 4.06Å; L94-W144 HydrophobicContact CD2-CZ3 3.87Å
95T98.9Very high98.8Very high0 Ų030.1 Ų30.10%016%0.156CC..Hα-helixtrans-67.3-38.7-178.858.70000111.8W91 W92 L98 G99 G130 A134 L147W91-T95 HydrophobicContact CD2-CG2 4.15Å; W91-T95 HydrophobicContact CE3-CG2 4.41Å; W91-T95 HydrophobicContact CH2-CG2 4.11Å; W91-T95 HydrophobicContact CZ2-CG2 3.84Å; W91-T95 HydrophobicContact CZ3-CG2 4.39Å; W91-T95 PolarHBondContact O-N 3.12Å; W91-T95 PolarHBondContact O-OG1 2.82Å; W92-T95 PolarHBondContact O-N 3.41Å; W92-T95 PolarHBondContact O-OG1 2.89Å; T95-L98 PolarHBondContact O-N 3.44Å; T95-G99 PolarHBondContact O-N 3.38Å; T95-G130 VanDerWaalsContact CB-O 3.25Å; T95-G130 WeakPolarHBondContact CB-O 3.43Å; T95-G130 WeakPolarHBondContact O-CA 3.39Å; T95-G130 PolarHBondContact OG1-O 2.88Å; T95-A134 HydrophobicContact CG2-CB 4.34Å; T95-L147 HydrophobicContact CG2-CD2 3.95Å
96G98.9Very high98.8Very high0 Ų031.9 Ų31.90%017%0.165CC..Hα-helixtrans-59.8-52.5173.100000112.5W92 L98 G99 T100W92-G96 PolarHBondContact O-N 3.18Å; G96-L98 VanDerWaalsContact C-N 3.35Å; G96-L98 PolarHBondContact O-N 2.82Å; G96-G99 PolarHBondContact O-N 3.22Å; G96-T100 PolarHBondContact O-N 3.41Å; G96-T100 PolarHBondContact O-OG1 2.94Å
97W98.9Very high98.8Very high110 Ų11027.8 Ų27.842%0.41714%0.143SC..Hα-helixtrans-59.2-44.3176.7173.588.6000112.1L82 A93 L94 G99 T100 V101L82-W97 HydrophobicContact CD1-CB 4.48Å; A93-W97 VanDerWaalsContact O-CB 3.22Å; A93-W97 WeakPolarHBondContact O-CB 3.46Å; A93-W97 PolarHBondContact O-N 2.84Å; L94-W97 PolarHBondContact O-N 3.16Å; W97-G99 VanDerWaalsContact C-N 3.3Å; W97-G99 PolarHBondContact O-N 3.42Å; W97-T100 WeakPolarHBondContact O-CB 3.49Å; W97-T100 PolarHBondContact O-N 2.96Å; W97-V101 HydrophobicContact CD2-CG2 4.04Å; W97-V101 HydrophobicContact CE3-CG2 4.38Å; W97-V101 HydrophobicContact CH2-CG2 4.04Å; W97-V101 HydrophobicContact CZ2-CG2 3.67Å; W97-V101 HydrophobicContact CZ3-CG2 4.37Å; W97-V101 WeakPolarHBondContact O-CG2 3.42Å; W97-V101 PolarHBondContact O-N 2.93Å
98L98.9Very high98.8Very high33 Ų3326.1 Ų26.117%0.17313%0.132CC..Hα-helixtrans-59.7-43.6177177.963.9000110.9L94 T95 G96 T100 V101 V102 L147 V150L94-L98 VanDerWaalsContact O-CB 3.28Å; L94-L98 WeakPolarHBondContact O-CB 3.47Å; L94-L98 PolarHBondContact O-N 2.71Å; T95-L98 PolarHBondContact O-N 3.44Å; G96-L98 VanDerWaalsContact C-N 3.35Å; G96-L98 PolarHBondContact O-N 2.82Å; L98-T100 PolarHBondContact O-N 3.31Å; L98-V101 PolarHBondContact O-N 3.16Å; L98-V102 HydrophobicContact CD1-CG2 4.02Å; L98-V102 HydrophobicContact CG-CG2 4.33Å; L98-V102 VanDerWaalsContact O-CG2 3.3Å; L98-V102 WeakPolarHBondContact O-CG2 3.32Å; L98-V102 PolarHBondContact O-N 3.11Å; L98-L147 HydrophobicContact CD2-CB 4.13Å; L98-L147 HydrophobicContact CD2-CD1 4.41Å; L98-L147 HydrophobicContact CD2-CD2 3.76Å; L98-L147 HydrophobicContact CD2-CG 4.31Å; L98-V150 HydrophobicContact CD2-CG1 4.41Å
99G98.9Very high98.8Very high0 Ų031 Ų310%016%0.158CC..Hα-helixtrans-58.9-46.517600000112.3T95 G96 W97 V101 V102 S103 A126 S154T95-G99 PolarHBondContact O-N 3.38Å; G96-G99 PolarHBondContact O-N 3.22Å; W97-G99 VanDerWaalsContact C-N 3.3Å; W97-G99 PolarHBondContact O-N 3.42Å; G99-V101 VanDerWaalsContact C-N 3.34Å; G99-V101 PolarHBondContact O-N 3.05Å; G99-V102 PolarHBondContact O-N 3.42Å; G99-S103 VanDerWaalsContact O-CB 3.31Å; G99-S103 WeakPolarHBondContact O-CB 3.45Å; G99-S103 PolarHBondContact O-N 3.33Å; G99-A126 WeakPolarHBondContact O-CB 3.49Å; G99-S154 WeakPolarHBondContact CA-OG 3.48Å
100T98.9Very high98.8Very high0 Ų033.4 Ų33.40%017%0.171CC..Hα-helixtrans-57.6-45.9176-370000111.9I62 I66 G96 W97 L98 T104 T127I62-T100 HydrophobicContact CB-CG2 4.45Å; I62-T100 HydrophobicContact CD1-CG2 4.13Å; I62-T100 HydrophobicContact CG2-CG2 3.88Å; I66-T100 HydrophobicContact CG1-CG2 4.3Å; G96-T100 PolarHBondContact O-N 3.41Å; G96-T100 PolarHBondContact O-OG1 2.94Å; W97-T100 WeakPolarHBondContact O-CB 3.49Å; W97-T100 PolarHBondContact O-N 2.96Å; L98-T100 PolarHBondContact O-N 3.31Å; T100-T104 VanDerWaalsContact O-CB 3.32Å; T100-T104 WeakPolarHBondContact O-CB 2.96Å; T100-T104 PolarHBondContact O-N 2.99Å; T100-T104 PolarHBondContact O-OG1 2.94Å; T100-T127 PolarHBondContact OG1-OG1 3.34Å
101V98.9Very high98.8Very high20 Ų2035.1 Ų35.112%0.12118%0.184CC..Hα-helixtrans-61.7-52.9179.5170.30000110.9F58 I62 W97 L98 G99 S103 T104 L105F58-V101 HydrophobicContact CE1-CG1 4.23Å; F58-V101 HydrophobicContact CZ-CG1 4.22Å; I62-V101 HydrophobicContact CD1-CB 4.45Å; I62-V101 HydrophobicContact CD1-CG2 4.06Å; I62-V101 HydrophobicContact CG1-CG2 4.1Å; I62-V101 HydrophobicContact CG2-CG2 4.31Å; W97-V101 HydrophobicContact CD2-CG2 4.04Å; W97-V101 HydrophobicContact CE3-CG2 4.38Å; W97-V101 HydrophobicContact CH2-CG2 4.04Å; W97-V101 HydrophobicContact CZ2-CG2 3.67Å; W97-V101 HydrophobicContact CZ3-CG2 4.37Å; W97-V101 WeakPolarHBondContact O-CG2 3.42Å; W97-V101 PolarHBondContact O-N 2.93Å; L98-V101 PolarHBondContact O-N 3.16Å; G99-V101 VanDerWaalsContact C-N 3.34Å; G99-V101 PolarHBondContact O-N 3.05Å; V101-S103 VanDerWaalsContact C-N 3.31Å; V101-S103 PolarHBondContact O-N 3.39Å; V101-T104 PolarHBondContact O-N 3.24Å; V101-L105 HydrophobicContact CG1-CD1 3.96Å; V101-L105 HydrophobicContact CG1-CG 4.5Å; V101-L105 WeakPolarHBondContact O-CG 3.44Å; V101-L105 PolarHBondContact O-N 3.32Å
102V98.9Very high98.8Very high24 Ų2436.9 Ų36.915%0.14519%0.192CC..Hα-helixtrans-60.8-42.9-178.1171.80000111L98 G99 L105 M106 C151 M155L98-V102 HydrophobicContact CD1-CG2 4.02Å; L98-V102 HydrophobicContact CG-CG2 4.33Å; L98-V102 VanDerWaalsContact O-CG2 3.3Å; L98-V102 WeakPolarHBondContact O-CG2 3.32Å; L98-V102 PolarHBondContact O-N 3.11Å; G99-V102 PolarHBondContact O-N 3.42Å; V102-L105 PolarHBondContact O-N 3.12Å; V102-M106 WeakPolarHBondContact O-CB 3.3Å; V102-M106 PolarHBondContact O-N 3.26Å; V102-C151 HydrophobicContact CG2-CB 4.41Å; V102-M155 HydrophobicContact CG1-CG 3.54Å
103S98.9Very high98.7Very high0 Ų039.8 Ų39.80%021%0.21CC..Hα-helixtrans-68.3-39.3-179.5-152.70000112.8G99 V101 M106 A107 Y122 A126 S154 C157 P158G99-S103 VanDerWaalsContact O-CB 3.31Å; G99-S103 WeakPolarHBondContact O-CB 3.45Å; G99-S103 PolarHBondContact O-N 3.33Å; V101-S103 VanDerWaalsContact C-N 3.31Å; V101-S103 PolarHBondContact O-N 3.39Å; S103-M106 PolarHBondContact O-N 3.17Å; S103-A107 WeakPolarHBondContact O-CB 3.45Å; S103-A107 PolarHBondContact O-N 2.9Å; S103-Y122 PolarHBondContact OG-O 2.99Å; S103-A126 WeakPolarHBondContact OG-CB 3.32Å; S103-S154 WeakPolarHBondContact CB-O 3.27Å; S103-S154 PolarHBondContact OG-O 3.21Å; S103-C157 WeakPolarHBondContact OG-CB 3.49Å; S103-P158 VanDerWaalsContact O-CG 3.3Å; S103-P158 WeakPolarHBondContact O-CG 3.3Å; S103-P158 VanDerWaalsContact OG-CD 3.27Å; S103-P158 WeakPolarHBondContact OG-CD 3.26Å; S103-P158 WeakPolarHBondContact OG-CG 3.34Å
104T98.8Very high98.6Very high2 Ų246.4 Ų46.41%0.01224%0.235CC..Hα-helixtrans-66.1-42.9176.2-57.60000110.6F58 W61 I62 T100 V101 M106 A107 L108 I117F58-T104 HydrophobicContact CD2-CG2 4.19Å; F58-T104 HydrophobicContact CE2-CG2 3.58Å; F58-T104 HydrophobicContact CZ-CG2 4.26Å; W61-T104 HydrophobicContact CB-CG2 4.44Å; W61-T104 HydrophobicContact CE3-CG2 4.31Å; I62-T104 HydrophobicContact CD1-CG2 3.96Å; I62-T104 WeakPolarHBondContact CD1-OG1 3.43Å; T100-T104 VanDerWaalsContact O-CB 3.32Å; T100-T104 WeakPolarHBondContact O-CB 2.96Å; T100-T104 PolarHBondContact O-N 2.99Å; T100-T104 PolarHBondContact O-OG1 2.94Å; V101-T104 PolarHBondContact O-N 3.24Å; T104-M106 VanDerWaalsContact C-N 3.35Å; T104-M106 PolarHBondContact O-N 2.96Å; T104-A107 PolarHBondContact O-N 3Å; T104-L108 VanDerWaalsContact O-CG 3.26Å; T104-L108 WeakPolarHBondContact O-CG 3.48Å; T104-L108 PolarHBondContact O-N 3.41Å; T104-L108 VanDerWaalsContact O-N 3.09Å; T104-I117 HydrophobicContact CG2-CG2 4.01Å
105L98.8Very high98.5Very high82 Ų8247 Ų4743%0.42924%0.244SC..Hα-helixtrans-59.9-44.1172-70.7172.9000111.8F58 V101 V102 A107 L108 L109F58-L105 HydrophobicContact CE2-CD2 3.77Å; F58-L105 HydrophobicContact CE2-CG 4.13Å; F58-L105 HydrophobicContact CZ-CD2 3.76Å; F58-L105 HydrophobicContact CZ-CG 3.79Å; V101-L105 HydrophobicContact CG1-CD1 3.96Å; V101-L105 HydrophobicContact CG1-CG 4.5Å; V101-L105 WeakPolarHBondContact O-CG 3.44Å; V101-L105 PolarHBondContact O-N 3.32Å; V102-L105 PolarHBondContact O-N 3.12Å; L105-A107 PolarHBondContact O-N 3.35Å; L105-L108 HydrophobicContact CD2-CD1 4.42Å; L105-L108 WeakPolarHBondContact O-CB 3.36Å; L105-L108 PolarHBondContact O-N 2.83Å; L105-L109 WeakPolarHBondContact O-CG 3.19Å; L105-L109 PolarHBondContact O-N 3.37Å
106M98.8Very high98.5Very high38 Ų3849.2 Ų49.219%0.18726%0.256CS..Hα-helixtrans-65.5-38.1179-171.362178.700112.1V102 S103 T104 L108 L109 L110 M155 P158V102-M106 WeakPolarHBondContact O-CB 3.3Å; V102-M106 PolarHBondContact O-N 3.26Å; S103-M106 PolarHBondContact O-N 3.17Å; T104-M106 VanDerWaalsContact C-N 3.35Å; T104-M106 PolarHBondContact O-N 2.96Å; M106-L108 VanDerWaalsContact C-N 3.3Å; M106-L108 PolarHBondContact O-N 3.26Å; M106-L109 PolarHBondContact O-N 3Å; M106-L109 HydrophobicContact SD-CB 4.47Å; M106-L109 HydrophobicContact SD-CD1 4.31Å; M106-L110 HydrophobicContact CE-CD1 3.86Å; M106-L110 HydrophobicContact CE-CD2 3.96Å; M106-L110 HydrophobicContact CE-CG 3.84Å; M106-L110 HydrophobicContact CG-CD1 4.11Å; M106-L110 HydrophobicContact CG-CG 4.37Å; M106-L110 WeakPolarHBondContact O-CB 3.32Å; M106-L110 WeakPolarHBondContact O-CG 3.49Å; M106-L110 PolarHBondContact O-N 2.83Å; M106-L110 HydrophobicContact SD-CG 4.37Å; M106-M155 HydrophobicContact CB-CG 4.44Å; M106-M155 HydrophobicContact CG-CB 4.13Å; M106-M155 HydrophobicContact CG-CG 4.4Å; M106-M155 WeakPolarHBondContact CG-O 3.48Å; M106-M155 HydrophobicContact SD-CB 4.47Å; M106-M155 HydrophobicContact SD-CG 4.48Å; M106-P158 HydrophobicContact CB-CG 4.16Å; M106-P158 HydrophobicContact CG-CG 4.34Å
107A98.7Very high98.4Very high0 Ų049.3 Ų49.30%026%0.256CS..Hα-helixtrans-62.9-36.7173.600000112.2S103 T104 L105 S111 Q112 I117 Y122 P158S103-A107 WeakPolarHBondContact O-CB 3.45Å; S103-A107 PolarHBondContact O-N 2.9Å; T104-A107 PolarHBondContact O-N 3Å; L105-A107 PolarHBondContact O-N 3.35Å; A107-S111 PolarHBondContact O-N 3.08Å; A107-Q112 HydrophobicContact CB-CB 4.26Å; A107-Q112 HydrophobicContact CB-CG 4.21Å; A107-Q112 WeakPolarHBondContact O-CB 3.44Å; A107-Q112 WeakPolarHBondContact O-CG 3.34Å; A107-Q112 PolarHBondContact O-N 2.85Å; A107-I117 HydrophobicContact CB-CD1 3.92Å; A107-I117 HydrophobicContact CB-CG1 3.99Å; A107-Y122 HydrophobicContact CB-CD1 3.97Å; A107-Y122 HydrophobicContact CB-CD2 4.27Å; A107-Y122 HydrophobicContact CB-CG 3.71Å; A107-P158 HydrophobicContact CB-CB 4.11Å; A107-P158 HydrophobicContact CB-CG 4.12Å
108L98.5Very high98.4Very high34 Ų3445.7 Ų45.718%0.17825%0.25CC..Hα-helixtrans-66-44.7173.3-64.4165.5000111.6F58 W61 T104 L105 M106 S111 R114 I117F58-L108 HydrophobicContact CD2-CD1 4.15Å; F58-L108 HydrophobicContact CE2-CD1 3.94Å; W61-L108 HydrophobicContact CZ3-CD1 4.14Å; W61-L108 HydrophobicContact CZ3-CD2 3.85Å; T104-L108 VanDerWaalsContact O-CG 3.26Å; T104-L108 WeakPolarHBondContact O-CG 3.48Å; T104-L108 PolarHBondContact O-N 3.41Å; T104-L108 VanDerWaalsContact O-N 3.09Å; L105-L108 HydrophobicContact CD2-CD1 4.42Å; L105-L108 WeakPolarHBondContact O-CB 3.36Å; L105-L108 PolarHBondContact O-N 2.83Å; M106-L108 VanDerWaalsContact C-N 3.3Å; M106-L108 PolarHBondContact O-N 3.26Å; L108-S111 PolarHBondContact O-N 2.94Å; L108-S111 VanDerWaalsContact O-N 3.13Å; L108-R114 VanDerWaalsContact CD2-CZ 3.5Å; L108-I117 HydrophobicContact CD2-CD1 3.85Å; L108-I117 HydrophobicContact CD2-CG2 4.26Å; L108-I117 HydrophobicContact CG-CD1 4.24Å
109L98.6Very high98.3Very high136 Ų13645.1 Ų45.171%0.71225%0.248SC*.Hα-helixtrans-62.9-41177.5-71.7172.9000111.9L105 M106 S111L105-L109 WeakPolarHBondContact O-CG 3.19Å; L105-L109 PolarHBondContact O-N 3.37Å; M106-L109 PolarHBondContact O-N 3Å; M106-L109 HydrophobicContact SD-CB 4.47Å; M106-L109 HydrophobicContact SD-CD1 4.31Å; L109-S111 PolarHBondContact O-N 3.31Å
110L98.3Very high98.3Very high68 Ų6845.2 Ų45.236%0.35625%0.249SC..THydrogen-bonded Turntrans-78.28.7175.8-67.2178.6000113.6M106 Q112 P158 I159M106-L110 HydrophobicContact CE-CD1 3.86Å; M106-L110 HydrophobicContact CE-CD2 3.96Å; M106-L110 HydrophobicContact CE-CG 3.84Å; M106-L110 HydrophobicContact CG-CD1 4.11Å; M106-L110 HydrophobicContact CG-CG 4.37Å; M106-L110 WeakPolarHBondContact O-CB 3.32Å; M106-L110 WeakPolarHBondContact O-CG 3.49Å; M106-L110 PolarHBondContact O-N 2.83Å; M106-L110 HydrophobicContact SD-CG 4.37Å; L110-Q112 HydrophobicContact CB-CG 4.13Å; L110-Q112 PolarHBondContact O-N 3.35Å; L110-Q112 VanDerWaalsContact O-N 3.17Å; L110-Q112 PolarHBondContact O-NE2 3.28Å; L110-P158 HydrophobicContact CD1-CB 4.33Å; L110-I159 HydrophobicContact CD1-CG1 3.83Å
111S98.4Very high98.2Very high99 Ų9948 Ų4869%0.69226%0.264SS*.THydrogen-bonded Turntrans5239.1177.8-59.70000113.8A107 L108 L109A107-S111 PolarHBondContact O-N 3.08Å; L108-S111 PolarHBondContact O-N 2.94Å; L108-S111 VanDerWaalsContact O-N 3.13Å; L109-S111 PolarHBondContact O-N 3.31Å
112Q98.5Very high98.2Very high36 Ų3647.7 Ų47.717%0.16826%0.26CS..  trans-68.8162.2176.5-59.6-58.4-61.800111.6A107 L110 R114 I117 Y122 S162A107-Q112 HydrophobicContact CB-CB 4.26Å; A107-Q112 HydrophobicContact CB-CG 4.21Å; A107-Q112 WeakPolarHBondContact O-CB 3.44Å; A107-Q112 WeakPolarHBondContact O-CG 3.34Å; A107-Q112 PolarHBondContact O-N 2.85Å; L110-Q112 HydrophobicContact CB-CG 4.13Å; L110-Q112 PolarHBondContact O-N 3.35Å; L110-Q112 VanDerWaalsContact O-N 3.17Å; L110-Q112 PolarHBondContact O-NE2 3.28Å; Q112-R114 PolarHBondContact O-N 2.96Å; Q112-I117 HydrophobicContact CB-CD1 4.21Å; Q112-Y122 HydrophobicContact CB-CD2 4.26Å; Q112-Y122 HydrophobicContact CB-CE1 4.38Å; Q112-Y122 HydrophobicContact CB-CE2 3.68Å; Q112-Y122 HydrophobicContact CG-CE1 4.06Å; Q112-Y122 HydrophobicContact CG-CE2 4.26Å; Q112-Y122 PolarHBondContact OE1-OH 3.15Å; Q112-S162 PolarHBondContact OE1-OG 3.16Å
113D97.7Very high98.2Very high89 Ų8946.6 Ų46.648%0.47625%0.254SS..  trans-54.7121.6-178.4-173.6-30.2000111.6S115 L116 I117D113-S115 VanDerWaalsContact C-N 3.27Å; D113-S115 VanDerWaalsContact CG-OG 3.26Å; D113-S115 PolarHBondContact O-N 3.16Å; D113-S115 WeakPolarHBondContact OD1-CB 3.39Å; D113-S115 PolarHBondContact OD1-N 3.16Å; D113-S115 PolarHBondContact OD1-OG 3.17Å; D113-S115 PolarHBondContact OD2-OG 2.89Å; D113-L116 HydrophobicContact CB-CB 4.31Å; D113-L116 HydrophobicContact CB-CD1 3.95Å; D113-L116 HydrophobicContact CB-CG 3.94Å; D113-L116 PolarHBondContact O-N 3.36Å; D113-I117 WeakPolarHBondContact O-CG1 3.35Å; D113-I117 PolarHBondContact O-N 2.92Å
114R96.9Very high98.2Very high142 Ų14247.3 Ų47.354%0.53626%0.257SS..Hα-helixtrans-63.6-29.7-177.1-64-64.7175.1147.5-8.2113.1L108 Q112 A118L108-R114 VanDerWaalsContact CD2-CZ 3.5Å; Q112-R114 PolarHBondContact O-N 2.96Å; R114-A118 WeakPolarHBondContact O-CB 3.48Å; R114-A118 PolarHBondContact O-N 3Å
115S96.8Very high98.2Very high74 Ų7447.2 Ų47.252%0.51726%0.256SS..Hα-helixtrans-69.4-38.7176.569.30000111.9D113 S119D113-S115 VanDerWaalsContact C-N 3.27Å; D113-S115 VanDerWaalsContact CG-OG 3.26Å; D113-S115 PolarHBondContact O-N 3.16Å; D113-S115 WeakPolarHBondContact OD1-CB 3.39Å; D113-S115 PolarHBondContact OD1-N 3.16Å; D113-S115 PolarHBondContact OD1-OG 3.17Å; D113-S115 PolarHBondContact OD2-OG 2.89Å; S115-S119 WeakPolarHBondContact O-CB 3.4Å; S115-S119 PolarHBondContact O-N 2.81Å; S115-S119 VanDerWaalsContact O-N 3.11Å; S115-S119 PolarHBondContact O-OG 3.46Å
116L97.5Very high98.2Very high47 Ų4743.3 Ų43.325%0.24624%0.236CC..Hα-helixtrans-70.3-39.8175.6-58.8-177.7000111.1D113 S119 G120 L121 Y122D113-L116 HydrophobicContact CB-CB 4.31Å; D113-L116 HydrophobicContact CB-CD1 3.95Å; D113-L116 HydrophobicContact CB-CG 3.94Å; D113-L116 PolarHBondContact O-N 3.36Å; L116-S119 WeakPolarHBondContact CA-OG 3.49Å; L116-S119 PolarHBondContact O-OG 3.47Å; L116-G120 PolarHBondContact O-N 3.01Å; L116-L121 HydrophobicContact CB-CB 4.36Å; L116-L121 HydrophobicContact CB-CD1 4.47Å; L116-L121 HydrophobicContact CD2-CD1 3.6Å; L116-L121 WeakPolarHBondContact O-CB 3.46Å; L116-L121 PolarHBondContact O-N 3.39Å; L116-Y122 HydrophobicContact CB-CD2 3.96Å; L116-Y122 HydrophobicContact CB-CE2 3.75Å; L116-Y122 HydrophobicContact CD1-CE2 4.11Å
117I98.2Very high98.2Very high2 Ų241.5 Ų41.51%0.0123%0.227CC..Hα-helixtrans-62.2-49.7173.3-64.3173.3000110.3W61 T104 A107 L108 Q112 D113 S119 G120 Y122W61-I117 HydrophobicContact CD2-CG2 4.13Å; W61-I117 HydrophobicContact CE3-CG2 3.71Å; W61-I117 HydrophobicContact CZ3-CG2 4.2Å; T104-I117 HydrophobicContact CG2-CG2 4.01Å; A107-I117 HydrophobicContact CB-CD1 3.92Å; A107-I117 HydrophobicContact CB-CG1 3.99Å; L108-I117 HydrophobicContact CD2-CD1 3.85Å; L108-I117 HydrophobicContact CD2-CG2 4.26Å; L108-I117 HydrophobicContact CG-CD1 4.24Å; Q112-I117 HydrophobicContact CB-CD1 4.21Å; D113-I117 WeakPolarHBondContact O-CG1 3.35Å; D113-I117 PolarHBondContact O-N 2.92Å; I117-S119 PolarHBondContact O-N 3.21Å; I117-G120 PolarHBondContact O-N 3.36Å; I117-Y122 HydrophobicContact CG1-CD2 3.74Å; I117-Y122 HydrophobicContact CG1-CE2 4.49Å; I117-Y122 HydrophobicContact CG1-CG 4.37Å
118A97.8Very high98.2Very high34 Ų3441.6 Ų41.628%0.28123%0.227SC..Hα-helixtrans-66.3-24.2-175.300000113.9W61 R64 R114 G120W61-A118 VanDerWaalsContact CD1-CA 3.42Å; R64-A118 WeakPolarHBondContact CD-O 3.3Å; R114-A118 WeakPolarHBondContact O-CB 3.48Å; R114-A118 PolarHBondContact O-N 3Å; A118-G120 VanDerWaalsContact C-N 3.32Å
119S97.5Very high98.3Very high21 Ų2140 Ų4015%0.14722%0.219CC..THydrogen-bonded Turntrans-89.57173.153.60000113.6Q68 N73 S115 L116 I117 L121Q68-S119 VanDerWaalsContact CG-O 3.28Å; Q68-S119 WeakPolarHBondContact CG-O 3.22Å; Q68-S119 PolarHBondContact NE2-O 2.96Å; N73-S119 PolarHBondContact OD1-O 3.45Å; S115-S119 WeakPolarHBondContact O-CB 3.4Å; S115-S119 PolarHBondContact O-N 2.81Å; S115-S119 VanDerWaalsContact O-N 3.11Å; S115-S119 PolarHBondContact O-OG 3.46Å; L116-S119 WeakPolarHBondContact CA-OG 3.49Å; L116-S119 PolarHBondContact O-OG 3.47Å; I117-S119 PolarHBondContact O-N 3.21Å; S119-L121 VanDerWaalsContact C-N 3.31Å; S119-L121 PolarHBondContact O-N 2.66Å
120G98.3Very high98.3Very high1 Ų133.5 Ų33.51%0.0119%0.185CC..THydrogen-bonded Turntrans78.74.4176.900000115.3G65 L116 I117 A118 Y122 G123G65-G120 WeakPolarHBondContact CA-O 3.3Å; L116-G120 PolarHBondContact O-N 3.01Å; I117-G120 PolarHBondContact O-N 3.36Å; A118-G120 VanDerWaalsContact C-N 3.32Å; G120-Y122 PolarHBondContact O-N 3Å; G120-Y122 VanDerWaalsContact O-N 3.12Å; G120-G123 PolarHBondContact O-N 2.88Å
121L98.3Very high98.3Very high59 Ų5930.3 Ų30.331%0.30917%0.168SC..THydrogen-bonded Turntrans-68.8-12.9-173.8-66.2173.3000114Q68 L116 S119 Y124Q68-L121 HydrophobicContact CG-CD2 4.43Å; L116-L121 HydrophobicContact CB-CB 4.36Å; L116-L121 HydrophobicContact CB-CD1 4.47Å; L116-L121 HydrophobicContact CD2-CD1 3.6Å; L116-L121 WeakPolarHBondContact O-CB 3.46Å; L116-L121 PolarHBondContact O-N 3.39Å; S119-L121 VanDerWaalsContact C-N 3.31Å; S119-L121 PolarHBondContact O-N 2.66Å; L121-Y124 HydrophobicContact CB-CE1 4.46Å; L121-Y124 HydrophobicContact CD2-CE1 4.16Å; L121-Y124 WeakPolarHBondContact O-CD1 3.47Å; L121-Y124 WeakPolarHBondContact O-CE1 3.47Å
122Y98.7Very high98.3Very high13 Ų1326.2 Ų26.25%0.05114%0.138CC..THydrogen-bonded Turntrans-99.3-0.2171.7-82.3-72.9000114.2S103 A107 Q112 L116 I117 G120 P158S103-Y122 PolarHBondContact OG-O 2.99Å; A107-Y122 HydrophobicContact CB-CD1 3.97Å; A107-Y122 HydrophobicContact CB-CD2 4.27Å; A107-Y122 HydrophobicContact CB-CG 3.71Å; Q112-Y122 HydrophobicContact CB-CD2 4.26Å; Q112-Y122 HydrophobicContact CB-CE1 4.38Å; Q112-Y122 HydrophobicContact CB-CE2 3.68Å; Q112-Y122 HydrophobicContact CG-CE1 4.06Å; Q112-Y122 HydrophobicContact CG-CE2 4.26Å; Q112-Y122 PolarHBondContact OE1-OH 3.15Å; L116-Y122 HydrophobicContact CB-CD2 3.96Å; L116-Y122 HydrophobicContact CB-CE2 3.75Å; L116-Y122 HydrophobicContact CD1-CE2 4.11Å; I117-Y122 HydrophobicContact CG1-CD2 3.74Å; I117-Y122 HydrophobicContact CG1-CE2 4.49Å; I117-Y122 HydrophobicContact CG1-CG 4.37Å; G120-Y122 PolarHBondContact O-N 3Å; G120-Y122 VanDerWaalsContact O-N 3.12Å; Y122-P158 HydrophobicContact CD1-CB 3.69Å; Y122-P158 HydrophobicContact CD1-CG 4.26Å; Y122-P158 HydrophobicContact CE1-CB 3.95Å
123G98.5Very high98.3Very high1 Ų124.5 Ų24.51%0.0113%0.13CC..THydrogen-bonded Turntrans-104.7-34.7-177.400000115G120 N125 A126 T127G120-G123 PolarHBondContact O-N 2.88Å; G123-N125 PolarHBondContact O-N 2.92Å; G123-A126 PolarHBondContact O-N 3.08Å; G123-T127 PolarHBondContact O-N 2.84Å; G123-T127 PolarHBondContact O-OG1 3.47Å
124Y98.8Very high98.4Very high15 Ų1520.5 Ų20.56%0.05911%0.11CC..Hα-helixtrans-65.6-39.5-168.471.4-88.9000114.2G65 Q68 V69 L121 A126 T127 L128 F176 T177G65-Y124 WeakPolarHBondContact O-CA 3.48Å; G65-Y124 WeakPolarHBondContact O-CB 3.47Å; G65-Y124 PolarHBondContact O-N 3.43Å; Q68-Y124 HydrophobicContact CB-CD1 3.87Å; Q68-Y124 HydrophobicContact CB-CG 4.01Å; V69-Y124 WeakPolarHBondContact CG2-O 3.47Å; L121-Y124 HydrophobicContact CB-CE1 4.46Å; L121-Y124 HydrophobicContact CD2-CE1 4.16Å; L121-Y124 WeakPolarHBondContact O-CD1 3.47Å; L121-Y124 WeakPolarHBondContact O-CE1 3.47Å; Y124-A126 VanDerWaalsContact C-N 3.31Å; Y124-A126 PolarHBondContact O-N 2.93Å; Y124-T127 VanDerWaalsContact O-CB 3.28Å; Y124-T127 WeakPolarHBondContact O-CB 3.15Å; Y124-T127 PolarHBondContact O-N 3.44Å; Y124-T127 VanDerWaalsContact O-N 3.16Å; Y124-L128 PolarHBondContact O-N 3.24Å; Y124-F176 WeakPolarHBondContact CE2-O 3.34Å; Y124-F176 PolarHBondContact OH-O 3.11Å; Y124-T177 HydrophobicContact CD2-CG2 4.31Å; Y124-T177 HydrophobicContact CE2-CG2 4.08Å
125N98.9Very high98.5Very high0 Ų014.6 Ų14.60%09%0.09CC..Hα-helixtrans-59.8-43.5177.6-82.6-70.7000111.4G123 T127 L128 V129 C157 F176 T177 P179 F180G123-N125 PolarHBondContact O-N 2.92Å; N125-T127 VanDerWaalsContact C-N 3.32Å; N125-T127 PolarHBondContact O-N 2.66Å; N125-L128 PolarHBondContact O-N 3.39Å; N125-V129 WeakPolarHBondContact O-CG2 3.33Å; N125-V129 PolarHBondContact O-N 2.78Å; N125-C157 HydrophobicContact CB-CB 4.23Å; N125-F176 PolarHBondContact ND2-O 3.04Å; N125-T177 VanDerWaalsContact OD1-CA 3.28Å; N125-T177 WeakPolarHBondContact OD1-CA 3.06Å; N125-P179 HydrophobicContact CB-CB 4.03Å; N125-P179 WeakPolarHBondContact ND2-CG 3.31Å; N125-P179 WeakPolarHBondContact OD1-CD 3.13Å; N125-F180 HydrophobicContact CB-CB 4.12Å; N125-F180 VanDerWaalsContact OD1-CB 3.27Å; N125-F180 WeakPolarHBondContact OD1-CB 3.32Å; N125-F180 PolarHBondContact OD1-N 2.95Å
126A98.9Very high98.6Very high0 Ų013.1 Ų13.10%07%0.074CC..Hα-helixtrans-74.7-23.7178.900000113.5G99 S103 G123 Y124 L128 V129 G130 C157G99-A126 WeakPolarHBondContact O-CB 3.49Å; S103-A126 WeakPolarHBondContact OG-CB 3.32Å; G123-A126 PolarHBondContact O-N 3.08Å; Y124-A126 VanDerWaalsContact C-N 3.31Å; Y124-A126 PolarHBondContact O-N 2.93Å; A126-L128 VanDerWaalsContact C-N 3.34Å; A126-V129 PolarHBondContact O-N 3.14Å; A126-G130 PolarHBondContact O-N 3.18Å; A126-C157 HydrophobicContact CB-CB 4.19Å
127T98.9Very high98.6Very high0 Ų011.2 Ų11.20%06%0.064CC..Hα-helixtrans-59.1-49.3169.1-49.60000109.6I66 T100 G123 Y124 N125 G130 V131 Y234I66-T127 HydrophobicContact CG1-CG2 4.14Å; T100-T127 PolarHBondContact OG1-OG1 3.34Å; G123-T127 PolarHBondContact O-N 2.84Å; G123-T127 PolarHBondContact O-OG1 3.47Å; Y124-T127 VanDerWaalsContact O-CB 3.28Å; Y124-T127 WeakPolarHBondContact O-CB 3.15Å; Y124-T127 PolarHBondContact O-N 3.44Å; Y124-T127 VanDerWaalsContact O-N 3.16Å; N125-T127 VanDerWaalsContact C-N 3.32Å; N125-T127 PolarHBondContact O-N 2.66Å; T127-G130 PolarHBondContact O-N 2.78Å; T127-V131 WeakPolarHBondContact O-CG2 3.33Å; T127-V131 PolarHBondContact O-N 2.89Å; T127-Y234 HydrophobicContact CG2-CE1 4.37Å
128L98.9Very high98.6Very high3 Ų315.1 Ų15.12%0.0169%0.085CC..Hα-helixtrans-64.9-41.8175.7-68.1174.3000112.3V69 Y124 N125 A126 G130 V131 L132 T177 F180 I233 Y234V69-L128 HydrophobicContact CG1-CD1 4.07Å; V69-L128 HydrophobicContact CG1-CD2 3.73Å; V69-L128 HydrophobicContact CG1-CG 4.01Å; V69-L128 HydrophobicContact CG2-CD1 4.39Å; V69-L128 HydrophobicContact CG2-CD2 4.29Å; V69-L128 HydrophobicContact CG2-CG 3.92Å; Y124-L128 PolarHBondContact O-N 3.24Å; N125-L128 PolarHBondContact O-N 3.39Å; A126-L128 VanDerWaalsContact C-N 3.34Å; L128-G130 PolarHBondContact O-N 3.3Å; L128-V131 PolarHBondContact O-N 3.18Å; L128-L132 HydrophobicContact CB-CD2 4.34Å; L128-L132 HydrophobicContact CD2-CD2 4.07Å; L128-L132 WeakPolarHBondContact O-CB 3.28Å; L128-L132 VanDerWaalsContact O-CD2 3.23Å; L128-L132 WeakPolarHBondContact O-CD2 3.38Å; L128-L132 PolarHBondContact O-N 3.33Å; L128-T177 HydrophobicContact CD1-CG2 3.55Å; L128-F180 HydrophobicContact CB-CB 4.2Å; L128-F180 HydrophobicContact CB-CD1 4.13Å; L128-F180 HydrophobicContact CB-CD2 3.28Å; L128-F180 HydrophobicContact CB-CE1 4.37Å; L128-F180 HydrophobicContact CB-CE2 3.56Å; L128-F180 HydrophobicContact CB-CG 3.58Å; L128-F180 HydrophobicContact CB-CZ 4.11Å; L128-F180 HydrophobicContact CD1-CB 4.26Å; L128-F180 HydrophobicContact CD1-CD1 3.78Å; L128-F180 HydrophobicContact CD1-CD2 4.42Å; L128-F180 HydrophobicContact CD1-CE1 4.24Å; L128-F180 HydrophobicContact CD1-CG 3.87Å; L128-F180 HydrophobicContact CG-CD2 4.49Å; L128-F180 HydrophobicContact CG-CG 4.41Å; L128-I233 VanDerWaalsContact CD2-O 3.32Å; L128-I233 WeakPolarHBondContact CD2-O 3.25Å; L128-Y234 HydrophobicContact CD2-CD1 4.29Å
129V98.9Very high98.6Very high0 Ų018.5 Ų18.50%09%0.094CC..Hα-helixtrans-56.1-51.4175.6168.60000110.3N125 A126 V131 M133 M153 F180 A183N125-V129 WeakPolarHBondContact O-CG2 3.33Å; N125-V129 PolarHBondContact O-N 2.78Å; A126-V129 PolarHBondContact O-N 3.14Å; V129-V131 PolarHBondContact O-N 2.92Å; V129-M133 HydrophobicContact CG1-CG 4.22Å; V129-M133 HydrophobicContact CG1-SD 3.38Å; V129-M133 WeakPolarHBondContact CG1-SD 3.49Å; V129-M133 VanDerWaalsContact O-CB 3.24Å; V129-M133 WeakPolarHBondContact O-CB 3.45Å; V129-M133 WeakPolarHBondContact O-CG 3.48Å; V129-M133 PolarHBondContact O-N 3.49Å; V129-M153 HydrophobicContact CG1-CB 3.63Å; V129-F180 HydrophobicContact CB-CD2 4.49Å; V129-F180 HydrophobicContact CG2-CB 4.44Å; V129-F180 HydrophobicContact CG2-CD2 3.79Å; V129-A183 HydrophobicContact CG2-CB 3.98Å
130G98.9Very high98.5Very high0 Ų019.3 Ų19.30%011%0.105CC..Hα-helixtrans-61.2-45.2-179.200000113.4T95 A126 T127 L128 A134T95-G130 VanDerWaalsContact CB-O 3.25Å; T95-G130 WeakPolarHBondContact CB-O 3.43Å; T95-G130 WeakPolarHBondContact O-CA 3.39Å; T95-G130 PolarHBondContact OG1-O 2.88Å; A126-G130 PolarHBondContact O-N 3.18Å; T127-G130 PolarHBondContact O-N 2.78Å; L128-G130 PolarHBondContact O-N 3.3Å; G130-A134 PolarHBondContact O-N 3.31Å
131V98.9Very high98.5Very high0 Ų023.1 Ų23.10%013%0.125CC..Hα-helixtrans-65.8-52.7178.5175.80000110.8L85 W92 T127 L128 V129 M133 A134 V135 Y234L85-V131 HydrophobicContact CD1-CG2 4.5Å; L85-V131 HydrophobicContact CD2-CG2 4.29Å; W92-V131 HydrophobicContact CB-CG1 4.26Å; T127-V131 WeakPolarHBondContact O-CG2 3.33Å; T127-V131 PolarHBondContact O-N 2.89Å; L128-V131 PolarHBondContact O-N 3.18Å; V129-V131 PolarHBondContact O-N 2.92Å; V131-M133 PolarHBondContact O-N 2.83Å; V131-A134 WeakPolarHBondContact O-CA 3.13Å; V131-A134 WeakPolarHBondContact O-CB 3.19Å; V131-A134 PolarHBondContact O-N 3.26Å; V131-V135 HydrophobicContact CG1-CG2 4.2Å; V131-V135 WeakPolarHBondContact O-CG2 3.41Å; V131-V135 PolarHBondContact O-N 3.44Å; V131-Y234 WeakPolarHBondContact CG1-O 3.4Å
132L98.8Very high98.5Very high13 Ų1325.7 Ų25.77%0.06813%0.132CC..Hα-helixtrans-74.9-24.8-171.8-77.6-54000112.8L128 A134 V135 F136 F180 L184L128-L132 HydrophobicContact CB-CD2 4.34Å; L128-L132 HydrophobicContact CD2-CD2 4.07Å; L128-L132 WeakPolarHBondContact O-CB 3.28Å; L128-L132 VanDerWaalsContact O-CD2 3.23Å; L128-L132 WeakPolarHBondContact O-CD2 3.38Å; L128-L132 PolarHBondContact O-N 3.33Å; L132-A134 VanDerWaalsContact C-N 3.27Å; L132-A134 PolarHBondContact O-N 3.12Å; L132-V135 HydrophobicContact CD1-CB 4.04Å; L132-V135 HydrophobicContact CD1-CG1 4.25Å; L132-V135 HydrophobicContact CD1-CG2 4.14Å; L132-V135 PolarHBondContact O-N 2.7Å; L132-F136 HydrophobicContact CB-CD2 4.13Å; L132-F136 HydrophobicContact CB-CE2 4.16Å; L132-F136 HydrophobicContact CD1-CD2 4.44Å; L132-F136 HydrophobicContact CD1-CE2 3.88Å; L132-F136 HydrophobicContact CG-CE2 4.32Å; L132-F136 WeakPolarHBondContact O-CB 3.32Å; L132-F136 WeakPolarHBondContact O-CD2 3.2Å; L132-F136 PolarHBondContact O-N 2.86Å; L132-F180 HydrophobicContact CB-CE2 4.06Å; L132-F180 HydrophobicContact CB-CZ 4.27Å; L132-F180 HydrophobicContact CD2-CE2 4.28Å; L132-F180 HydrophobicContact CD2-CZ 4.21Å; L132-F180 HydrophobicContact CG-CE2 4.18Å; L132-F180 HydrophobicContact CG-CZ 3.98Å; L132-L184 HydrophobicContact CB-CD1 4.45Å; L132-L184 HydrophobicContact CB-CD2 3.69Å; L132-L184 HydrophobicContact CG-CD2 4.43Å
133M98.9Very high98.5Very high0 Ų027 Ų270%014%0.138CC..Hα-helixtrans-62.6-35.5167.1-74.3174.969.900111.9V129 V131 S137 P149 V150 M153 L184 Y187V129-M133 HydrophobicContact CG1-CG 4.22Å; V129-M133 HydrophobicContact CG1-SD 3.38Å; V129-M133 WeakPolarHBondContact CG1-SD 3.49Å; V129-M133 VanDerWaalsContact O-CB 3.24Å; V129-M133 WeakPolarHBondContact O-CB 3.45Å; V129-M133 WeakPolarHBondContact O-CG 3.48Å; V129-M133 PolarHBondContact O-N 3.49Å; V131-M133 PolarHBondContact O-N 2.83Å; M133-S137 WeakPolarHBondContact O-CB 3.47Å; M133-S137 PolarHBondContact O-N 3.27Å; M133-P149 HydrophobicContact CE-CB 3.67Å; M133-P149 HydrophobicContact CE-CG 4.04Å; M133-V150 HydrophobicContact CB-CG2 4.07Å; M133-V150 HydrophobicContact CE-CB 4.46Å; M133-V150 HydrophobicContact CE-CG2 3.89Å; M133-V150 HydrophobicContact SD-CG2 3.97Å; M133-M153 HydrophobicContact CE-CG 4.08Å; M133-M153 HydrophobicContact SD-CB 3.95Å; M133-M153 HydrophobicContact SD-CG 3.99Å; M133-L184 HydrophobicContact CG-CD1 3.72Å; M133-Y187 HydrophobicContact CB-CE1 4.42Å; M133-Y187 HydrophobicContact CE-CD1 3.89Å; M133-Y187 HydrophobicContact CE-CD2 3.88Å; M133-Y187 HydrophobicContact CE-CE1 3.65Å; M133-Y187 HydrophobicContact CE-CE2 3.65Å; M133-Y187 HydrophobicContact CE-CG 4Å; M133-Y187 HydrophobicContact CG-CD1 3.85Å; M133-Y187 HydrophobicContact CG-CE1 3.92Å; M133-Y187 HydrophobicContact SD-CD1 4.34Å
134A98.8Very high98.5Very high5 Ų534 Ų344%0.04116%0.164CC..Hα-helixtrans-71.1-45.5172.800000111.6W92 T95 G130 V131 L132 F136 S137 L146W92-A134 HydrophobicContact CG-CB 4.35Å; T95-A134 HydrophobicContact CG2-CB 4.34Å; G130-A134 PolarHBondContact O-N 3.31Å; V131-A134 WeakPolarHBondContact O-CA 3.13Å; V131-A134 WeakPolarHBondContact O-CB 3.19Å; V131-A134 PolarHBondContact O-N 3.26Å; L132-A134 VanDerWaalsContact C-N 3.27Å; L132-A134 PolarHBondContact O-N 3.12Å; A134-F136 VanDerWaalsContact C-N 3.32Å; A134-F136 PolarHBondContact O-N 3.26Å; A134-S137 PolarHBondContact O-N 3.46Å; A134-L146 HydrophobicContact CB-CD2 4.14Å
135V98.7Very high98.5Very high19 Ų1941.4 Ų41.412%0.11519%0.192CC..Hα-helixtrans-58.6-41.7178.7173.10000112.2W92 V131 L132 K201W92-V135 HydrophobicContact CD2-CG2 3.8Å; W92-V135 HydrophobicContact CE3-CG2 3.69Å; W92-V135 HydrophobicContact CH2-CG2 3.94Å; W92-V135 HydrophobicContact CZ2-CG2 4.04Å; W92-V135 HydrophobicContact CZ3-CG2 3.76Å; V131-V135 HydrophobicContact CG1-CG2 4.2Å; V131-V135 WeakPolarHBondContact O-CG2 3.41Å; V131-V135 PolarHBondContact O-N 3.44Å; L132-V135 HydrophobicContact CD1-CB 4.04Å; L132-V135 HydrophobicContact CD1-CG1 4.25Å; L132-V135 HydrophobicContact CD1-CG2 4.14Å; L132-V135 PolarHBondContact O-N 2.7Å; V135-K201 WeakPolarHBondContact O-CD 3.32Å; V135-K201 WeakPolarHBondContact O-CE 3.41Å; V135-K201 PolarHBondContact O-NZ 3.04Å
136F98.7Very high98.5Very high43 Ų4341.4 Ų41.419%0.18919%0.192CC..THydrogen-bonded Turntrans-91.13.1-178.4-67.4-61.5000114.2L132 A134 L184 L188 A200 K201 P336L132-F136 HydrophobicContact CB-CD2 4.13Å; L132-F136 HydrophobicContact CB-CE2 4.16Å; L132-F136 HydrophobicContact CD1-CD2 4.44Å; L132-F136 HydrophobicContact CD1-CE2 3.88Å; L132-F136 HydrophobicContact CG-CE2 4.32Å; L132-F136 WeakPolarHBondContact O-CB 3.32Å; L132-F136 WeakPolarHBondContact O-CD2 3.2Å; L132-F136 PolarHBondContact O-N 2.86Å; A134-F136 VanDerWaalsContact C-N 3.32Å; A134-F136 PolarHBondContact O-N 3.26Å; F136-L184 HydrophobicContact CD2-CD2 4.16Å; F136-L184 HydrophobicContact CE2-CD2 4.17Å; F136-L188 HydrophobicContact CB-CD1 4.29Å; F136-L188 HydrophobicContact CB-CD2 3.98Å; F136-L188 HydrophobicContact CD2-CD1 4.08Å; F136-L188 HydrophobicContact CG-CD1 4.24Å; F136-A200 CarbonylContact O-C 3.22Å; F136-A200 VanDerWaalsContact O-CA 3.25Å; F136-A200 WeakPolarHBondContact O-CA 3.45Å; F136-K201 PolarHBondContact O-N 3.49Å; F136-P336 HydrophobicContact CD1-CG 4.22Å; F136-P336 HydrophobicContact CD2-CG 4.1Å; F136-P336 HydrophobicContact CE1-CB 3.76Å; F136-P336 HydrophobicContact CE1-CG 3.82Å; F136-P336 HydrophobicContact CE2-CB 4.09Å; F136-P336 HydrophobicContact CE2-CG 3.69Å; F136-P336 HydrophobicContact CG-CG 4.36Å; F136-P336 HydrophobicContact CZ-CB 3.48Å; F136-P336 VanDerWaalsContact CZ-CB 3.48Å; F136-P336 HydrophobicContact CZ-CG 3.55Å
137S98.6Very high98.5Very high6 Ų643.3 Ų43.34%0.04220%0.202CC..BIsolated β-bridgetrans-74.9137.7173.1-171.90000111.2M133 A134 K139M133-S137 WeakPolarHBondContact O-CB 3.47Å; M133-S137 PolarHBondContact O-N 3.27Å; A134-S137 PolarHBondContact O-N 3.46Å; S137-K139 VanDerWaalsContact C-N 3.3Å; S137-K139 PolarHBondContact OG-N 3.43Å
138D98.3Very high98.5Very high85 Ų8548.2 Ų48.246%0.45523%0.227SC..THydrogen-bonded Turntrans-87.71.2174.3-160.451.4000112.8H193 P199D138-H193 IonicContact OD2-CE1 3.68Å; D138-P199 HydrophobicContact CB-CB 4.17Å; D138-P199 HydrophobicContact CB-CG 4.23Å; D138-P199 WeakPolarHBondContact CB-O 3.31Å; D138-P199 PolarHBondContact N-O 3.47Å
139K98Very high98.5Very high105 Ų10548.8 Ų48.846%0.45723%0.231SC..THydrogen-bonded Turntrans-89.9-7.4178.9-67.4-66-166.3-174.10113.9S137 F143 P199S137-K139 VanDerWaalsContact C-N 3.3Å; S137-K139 PolarHBondContact OG-N 3.43Å; K139-F143 HydrophobicContact CB-CB 3.79Å; K139-F143 HydrophobicContact CB-CD1 3.57Å; K139-F143 HydrophobicContact CB-CD2 4.11Å; K139-F143 HydrophobicContact CB-CE1 4.16Å; K139-F143 HydrophobicContact CB-CG 3.56Å; K139-F143 HydrophobicContact CG-CD1 3.75Å; K139-F143 HydrophobicContact CG-CD2 4.29Å; K139-F143 HydrophobicContact CG-CE1 3.79Å; K139-F143 HydrophobicContact CG-CE2 4.31Å; K139-F143 HydrophobicContact CG-CG 4.02Å; K139-F143 HydrophobicContact CG-CZ 4.07Å; K139-P199 HydrophobicContact CD-CG 4.03Å; K139-P199 HydrophobicContact CG-CG 3.97Å
140G95.3Very high98.5Very high37 Ų3748.8 Ų48.838%0.38123%0.231SC..  trans73.3-166.4-178.200000114.1
141D97.9Very high98.5Very high82 Ų8250.6 Ų50.644%0.43924%0.243SC..THydrogen-bonded Turntrans-71.9151.2-174.2-69.1-21.6000113.1N89 W91 W92 F143N89-D141 VanDerWaalsContact ND2-CG 3.27Å; N89-D141 PolarHBondContact ND2-OD1 3.07Å; N89-D141 VanDerWaalsContact ND2-OD1 3.1Å; N89-D141 PolarHBondContact ND2-OD2 2.85Å; W91-D141 HydrophobicContact CB-CB 4.26Å; W91-D141 HydrophobicContact CG-CB 4.29Å; W92-D141 PolarHBondContact NE1-OD1 2.92Å; D141-F143 PolarHBondContact O-N 3.39Å; D141-F143 VanDerWaalsContact O-N 3.16Å
142Y98.5Very high98.5Very high113 Ų11352.6 Ų52.644%0.44326%0.26SS..THydrogen-bonded Turntrans57.725.6177.2-53.7-78.4000114.8W91 W144W91-Y142 HydrophobicContact CB-CD1 4.5Å; W91-Y142 HydrophobicContact CB-CE1 4.26Å; W91-Y142 HydrophobicContact CB-CE2 4.49Å; W91-Y142 HydrophobicContact CD2-CD1 4.35Å; W91-Y142 AromaticContact CE3-CD1 3.74Å; W91-Y142 HydrophobicContact CE3-CD1 3.74Å; W91-Y142 HydrophobicContact CE3-CE1 4.25Å; W91-Y142 HydrophobicContact CE3-CG 4.36Å; W91-Y142 HydrophobicContact CZ3-CD1 4.38Å; Y142-W144 VanDerWaalsContact C-N 3.25Å; Y142-W144 HydrophobicContact CD1-CZ2 4.06Å; Y142-W144 PolarHBondContact O-N 3.41Å; Y142-W144 PolarHBondContact O-NE1 2.96Å
143F98.6Very high98.5Very high40 Ų4053 Ų5318%0.17526%0.262CS..  trans-70.484163.8178.4-127.7000109.8W91 K139 D141 W145 L146 F197 F198W91-F143 WeakPolarHBondContact CZ2-O 3.48Å; K139-F143 HydrophobicContact CB-CB 3.79Å; K139-F143 HydrophobicContact CB-CD1 3.57Å; K139-F143 HydrophobicContact CB-CD2 4.11Å; K139-F143 HydrophobicContact CB-CE1 4.16Å; K139-F143 HydrophobicContact CB-CG 3.56Å; K139-F143 HydrophobicContact CG-CD1 3.75Å; K139-F143 HydrophobicContact CG-CD2 4.29Å; K139-F143 HydrophobicContact CG-CE1 3.79Å; K139-F143 HydrophobicContact CG-CE2 4.31Å; K139-F143 HydrophobicContact CG-CG 4.02Å; K139-F143 HydrophobicContact CG-CZ 4.07Å; D141-F143 PolarHBondContact O-N 3.39Å; D141-F143 VanDerWaalsContact O-N 3.16Å; F143-W145 HydrophobicContact CD2-CB 4.36Å; F143-W145 HydrophobicContact CE1-CB 4.06Å; F143-W145 HydrophobicContact CE2-CB 3.73Å; F143-W145 AromaticContact CE2-CD1 3.71Å; F143-W145 HydrophobicContact CE2-CG 4.1Å; F143-W145 HydrophobicContact CZ-CB 3.55Å; F143-W145 HydrophobicContact CZ-CG 4.27Å; F143-W145 PolarHBondContact O-N 2.82Å; F143-W145 VanDerWaalsContact O-N 3.07Å; F143-L146 HydrophobicContact CD1-CB 3.86Å; F143-L146 HydrophobicContact CE1-CB 4.46Å; F143-L146 WeakPolarHBondContact O-CB 3.14Å; F143-L146 PolarHBondContact O-N 3.37Å; F143-F197 VanDerWaalsContact CZ-O 3.25Å; F143-F197 WeakPolarHBondContact CZ-O 3.43Å; F143-F198 AromaticContact CE1-CD1 3.79Å; F143-F198 HydrophobicContact CE1-CD1 3.79Å; F143-F198 HydrophobicContact CE1-CE1 4.12Å; F143-F198 HydrophobicContact CZ-CD1 4.31Å; F143-F198 HydrophobicContact CZ-CE1 4.37Å
144W98.7Very high98.5Very high148 Ų14853 Ų5356%0.56126%0.262SS*.G310 helixtrans-55.7-29-171.6-68.3105.7000115.1W91 L94 Y142 L146 L147W91-W144 HydrophobicContact CH2-CE3 4.2Å; W91-W144 HydrophobicContact CZ3-CD2 4.37Å; W91-W144 AromaticContact CZ3-CE3 3.88Å; W91-W144 HydrophobicContact CZ3-CE3 3.88Å; W91-W144 HydrophobicContact CZ3-CH2 4.26Å; W91-W144 AromaticContact CZ3-CZ3 3.83Å; W91-W144 HydrophobicContact CZ3-CZ3 3.83Å; L94-W144 HydrophobicContact CD2-CH2 4.06Å; L94-W144 HydrophobicContact CD2-CZ3 3.87Å; Y142-W144 VanDerWaalsContact C-N 3.25Å; Y142-W144 HydrophobicContact CD1-CZ2 4.06Å; Y142-W144 PolarHBondContact O-N 3.41Å; Y142-W144 PolarHBondContact O-NE1 2.96Å; W144-L146 PolarHBondContact O-N 3.22Å; W144-L147 HydrophobicContact CE3-CD1 3.68Å; W144-L147 HydrophobicContact CE3-CG 4.35Å; W144-L147 HydrophobicContact CZ3-CD1 4.01Å; W144-L147 WeakPolarHBondContact O-CB 3.27Å; W144-L147 WeakPolarHBondContact O-CG 3.49Å; W144-L147 PolarHBondContact O-N 3.22Å; W144-L147 VanDerWaalsContact O-N 3.11Å
145W98.6Very high98.5Very high171 Ų17156.7 Ų56.765%0.64828%0.279SS*.G310 helixtrans-60.7-26.5175-70.7108000112.7F143 L147 L148 P149 F198F143-W145 HydrophobicContact CD2-CB 4.36Å; F143-W145 HydrophobicContact CE1-CB 4.06Å; F143-W145 HydrophobicContact CE2-CB 3.73Å; F143-W145 AromaticContact CE2-CD1 3.71Å; F143-W145 HydrophobicContact CE2-CG 4.1Å; F143-W145 HydrophobicContact CZ-CB 3.55Å; F143-W145 HydrophobicContact CZ-CG 4.27Å; F143-W145 PolarHBondContact O-N 2.82Å; F143-W145 VanDerWaalsContact O-N 3.07Å; W145-L147 PolarHBondContact O-N 3.23Å; W145-L147 VanDerWaalsContact O-N 3.16Å; W145-L148 HydrophobicContact CE3-CD1 3.65Å; W145-L148 HydrophobicContact CZ3-CD1 3.88Å; W145-L148 WeakPolarHBondContact O-CB 3.37Å; W145-L148 PolarHBondContact O-N 2.93Å; W145-L148 VanDerWaalsContact O-N 3.08Å; W145-P149 VanDerWaalsContact O-CD 3.23Å; W145-P149 WeakPolarHBondContact O-CD 3.41Å; W145-F198 HydrophobicContact CB-CE1 4.02Å; W145-F198 WeakPolarHBondContact O-CE1 3.13Å
146L98.8Very high98.5Very high0 Ų057.4 Ų57.40%028%0.284CS..G310 helixtrans-59.7-23.3176.5-165.167.3000112.9W91 A134 F143 W144 L148 P149 V150W91-L146 HydrophobicContact CZ2-CB 4.18Å; W91-L146 HydrophobicContact CZ2-CD2 4.2Å; A134-L146 HydrophobicContact CB-CD2 4.14Å; F143-L146 HydrophobicContact CD1-CB 3.86Å; F143-L146 HydrophobicContact CE1-CB 4.46Å; F143-L146 WeakPolarHBondContact O-CB 3.14Å; F143-L146 PolarHBondContact O-N 3.37Å; W144-L146 PolarHBondContact O-N 3.22Å; L146-L148 PolarHBondContact O-N 3.2Å; L146-P149 HydrophobicContact CD1-CG 4.21Å; L146-P149 WeakPolarHBondContact O-CD 3.24Å; L146-P149 VanDerWaalsContact O-CG 3.29Å; L146-P149 WeakPolarHBondContact O-CG 3.4Å; L146-V150 HydrophobicContact CG-CG2 4.23Å; L146-V150 WeakPolarHBondContact O-CB 3.21Å; L146-V150 VanDerWaalsContact O-CG2 3.23Å; L146-V150 WeakPolarHBondContact O-CG2 3.46Å; L146-V150 PolarHBondContact O-N 3.18Å
147L98.8Very high98.5Very high39 Ų3955.4 Ų55.420%0.20428%0.275CS..Hα-helixtrans-61.1-30.3176-59.3-170.4000112.1W91 T95 L98 W144 W145 C151W91-L147 HydrophobicContact CH2-CD2 3.62Å; W91-L147 HydrophobicContact CH2-CG 4.07Å; W91-L147 HydrophobicContact CZ2-CD2 4.43Å; W91-L147 HydrophobicContact CZ3-CD2 4.07Å; T95-L147 HydrophobicContact CG2-CD2 3.95Å; L98-L147 HydrophobicContact CD2-CB 4.13Å; L98-L147 HydrophobicContact CD2-CD1 4.41Å; L98-L147 HydrophobicContact CD2-CD2 3.76Å; L98-L147 HydrophobicContact CD2-CG 4.31Å; W144-L147 HydrophobicContact CE3-CD1 3.68Å; W144-L147 HydrophobicContact CE3-CG 4.35Å; W144-L147 HydrophobicContact CZ3-CD1 4.01Å; W144-L147 WeakPolarHBondContact O-CB 3.27Å; W144-L147 WeakPolarHBondContact O-CG 3.49Å; W144-L147 PolarHBondContact O-N 3.22Å; W144-L147 VanDerWaalsContact O-N 3.11Å; W145-L147 PolarHBondContact O-N 3.23Å; W145-L147 VanDerWaalsContact O-N 3.16Å; L147-C151 WeakPolarHBondContact O-CB 3.26Å; L147-C151 PolarHBondContact O-N 3.17Å; L147-C151 PolarHBondContact O-SG 3.21Å
148L98.8Very high98.5Very high104 Ų10455.1 Ų55.155%0.54527%0.273SS..Hα-helixtrans-63.8-58.2178-62.9-178.9000112.5W145 L146 V150 C151 A152W145-L148 HydrophobicContact CE3-CD1 3.65Å; W145-L148 HydrophobicContact CZ3-CD1 3.88Å; W145-L148 WeakPolarHBondContact O-CB 3.37Å; W145-L148 PolarHBondContact O-N 2.93Å; W145-L148 VanDerWaalsContact O-N 3.08Å; L146-L148 PolarHBondContact O-N 3.2Å; L148-V150 VanDerWaalsContact C-N 3.29Å; L148-V150 PolarHBondContact O-N 3.13Å; L148-C151 PolarHBondContact O-N 3.07Å; L148-A152 PolarHBondContact O-N 3.33Å
149P98.8Very high98.5Very high15 Ų1555.5 Ų55.510%0.09727%0.274CS..Hα-helixtrans-66.3-30.6176.228.8-37000112.1M133 W145 L146 C151 A152 M153 Y187 F198M133-P149 HydrophobicContact CE-CB 3.67Å; M133-P149 HydrophobicContact CE-CG 4.04Å; W145-P149 VanDerWaalsContact O-CD 3.23Å; W145-P149 WeakPolarHBondContact O-CD 3.41Å; L146-P149 HydrophobicContact CD1-CG 4.21Å; L146-P149 WeakPolarHBondContact O-CD 3.24Å; L146-P149 VanDerWaalsContact O-CG 3.29Å; L146-P149 WeakPolarHBondContact O-CG 3.4Å; P149-C151 PolarHBondContact O-N 3.38Å; P149-A152 PolarHBondContact O-N 3.44Å; P149-M153 WeakPolarHBondContact O-CB 3.35Å; P149-M153 WeakPolarHBondContact O-CG 3.29Å; P149-M153 PolarHBondContact O-N 3.02Å; P149-Y187 HydrophobicContact CB-CD2 4.29Å; P149-Y187 HydrophobicContact CB-CE2 3.58Å; P149-Y187 HydrophobicContact CG-CE2 4.19Å; P149-F198 HydrophobicContact CG-CD1 3.87Å; P149-F198 HydrophobicContact CG-CE1 3.82Å; P149-F198 HydrophobicContact CG-CG 4.43Å; P149-F198 HydrophobicContact CG-CZ 4.32Å
150V98.9Very high98.5Very high0 Ų053 Ų530%026%0.263CS..Hα-helixtrans-58.4-48.3173.31660000110.8L98 M133 L146 L148 S154L98-V150 HydrophobicContact CD2-CG1 4.41Å; M133-V150 HydrophobicContact CB-CG2 4.07Å; M133-V150 HydrophobicContact CE-CB 4.46Å; M133-V150 HydrophobicContact CE-CG2 3.89Å; M133-V150 HydrophobicContact SD-CG2 3.97Å; L146-V150 HydrophobicContact CG-CG2 4.23Å; L146-V150 WeakPolarHBondContact O-CB 3.21Å; L146-V150 VanDerWaalsContact O-CG2 3.23Å; L146-V150 WeakPolarHBondContact O-CG2 3.46Å; L146-V150 PolarHBondContact O-N 3.18Å; L148-V150 VanDerWaalsContact C-N 3.29Å; L148-V150 PolarHBondContact O-N 3.13Å; V150-S154 WeakPolarHBondContact O-CB 3.49Å; V150-S154 PolarHBondContact O-N 2.88Å; V150-S154 PolarHBondContact O-OG 3.03Å
151C98.9Very high98.7Very high37 Ų3751.5 Ų51.525%0.2525%0.247CC..Hα-helixtrans-60.2-47.7174.1-71.70000111.4V102 L147 L148 P149 M153 S154 M155V102-C151 HydrophobicContact CG2-CB 4.41Å; L147-C151 WeakPolarHBondContact O-CB 3.26Å; L147-C151 PolarHBondContact O-N 3.17Å; L147-C151 PolarHBondContact O-SG 3.21Å; L148-C151 PolarHBondContact O-N 3.07Å; P149-C151 PolarHBondContact O-N 3.38Å; C151-M153 PolarHBondContact O-N 3.44Å; C151-S154 PolarHBondContact O-N 2.94Å; C151-M155 WeakPolarHBondContact O-CG 3.38Å; C151-M155 PolarHBondContact O-N 3.17Å
152A98.8Very high98.7Very high43 Ų4349.7 Ų49.736%0.35524%0.241SC..Hα-helixtrans-56.7-51.4-179.300000112.3L148 P149 M155L148-A152 PolarHBondContact O-N 3.33Å; P149-A152 PolarHBondContact O-N 3.44Å; A152-M155 PolarHBondContact O-N 2.72Å
153M98.8Very high98.7Very high21 Ų2147 Ų4710%0.10324%0.242CC..Hα-helixtrans-69-36.2-179.4-62.1-48.2-56.300111.8V129 M133 P149 C151 M155 T156 C157 A183 Y187V129-M153 HydrophobicContact CG1-CB 3.63Å; M133-M153 HydrophobicContact CE-CG 4.08Å; M133-M153 HydrophobicContact SD-CB 3.95Å; M133-M153 HydrophobicContact SD-CG 3.99Å; P149-M153 WeakPolarHBondContact O-CB 3.35Å; P149-M153 WeakPolarHBondContact O-CG 3.29Å; P149-M153 PolarHBondContact O-N 3.02Å; C151-M153 PolarHBondContact O-N 3.44Å; M153-M155 VanDerWaalsContact C-N 3.29Å; M153-M155 PolarHBondContact O-N 3.33Å; M153-T156 WeakPolarHBondContact O-CB 3.36Å; M153-T156 PolarHBondContact O-N 3.13Å; M153-T156 PolarHBondContact O-OG1 3.11Å; M153-C157 PolarHBondContact O-N 2.88Å; M153-A183 HydrophobicContact CE-CB 3.83Å; M153-A183 WeakPolarHBondContact CE-O 3.41Å; M153-Y187 HydrophobicContact CG-CD2 4.07Å; M153-Y187 HydrophobicContact CG-CG 4.18Å; M153-Y187 HydrophobicContact SD-CD2 4.42Å
154S98.9Very high98.7Very high0 Ų046.1 Ų46.10%024%0.239CC..Hα-helixtrans-63.7-32.5176.3-61.10000113.2G99 S103 V150 C151 T156 C157 P158G99-S154 WeakPolarHBondContact CA-OG 3.48Å; S103-S154 WeakPolarHBondContact CB-O 3.27Å; S103-S154 PolarHBondContact OG-O 3.21Å; V150-S154 WeakPolarHBondContact O-CB 3.49Å; V150-S154 PolarHBondContact O-N 2.88Å; V150-S154 PolarHBondContact O-OG 3.03Å; C151-S154 PolarHBondContact O-N 2.94Å; S154-T156 PolarHBondContact O-N 3.49Å; S154-C157 PolarHBondContact O-N 3.41Å; S154-P158 WeakPolarHBondContact O-CD 3.38Å
155M98.8Very high98.6Very high82 Ų8241.9 Ų41.940%0.40423%0.227SC..Hα-helixtrans-67.1-23.8172.2-69.4-174.8-68.300112.7V102 M106 C151 A152 M153 P158V102-M155 HydrophobicContact CG1-CG 3.54Å; M106-M155 HydrophobicContact CB-CG 4.44Å; M106-M155 HydrophobicContact CG-CB 4.13Å; M106-M155 HydrophobicContact CG-CG 4.4Å; M106-M155 WeakPolarHBondContact CG-O 3.48Å; M106-M155 HydrophobicContact SD-CB 4.47Å; M106-M155 HydrophobicContact SD-CG 4.48Å; C151-M155 WeakPolarHBondContact O-CG 3.38Å; C151-M155 PolarHBondContact O-N 3.17Å; A152-M155 PolarHBondContact O-N 2.72Å; M153-M155 VanDerWaalsContact C-N 3.29Å; M153-M155 PolarHBondContact O-N 3.33Å; M155-P158 WeakPolarHBondContact O-CD 3.48Å
156T98.8Very high98.6Very high35 Ų3537.3 Ų37.322%0.21522%0.221CC..Hα-helixtrans-79.2-24.4176.474.70000112.9M153 S154 I159 F160M153-T156 WeakPolarHBondContact O-CB 3.36Å; M153-T156 PolarHBondContact O-N 3.13Å; M153-T156 PolarHBondContact O-OG1 3.11Å; S154-T156 PolarHBondContact O-N 3.49Å; T156-I159 WeakPolarHBondContact O-CA 3.36Å; T156-I159 WeakPolarHBondContact O-CB 3.38Å; T156-I159 PolarHBondContact O-N 3.39Å; T156-F160 WeakPolarHBondContact O-CD2 3.49Å; T156-F160 PolarHBondContact O-N 2.73Å; T156-F160 WeakPolarHBondContact OG1-CE2 3.41Å
157C98.8Very high98.5Very high1 Ų143 Ų431%0.00725%0.249CC..Hα-helixtrans-58.5-41.3-175-64.30000114.1S103 N125 A126 M153 S154 I159 F160 S161S103-C157 WeakPolarHBondContact OG-CB 3.49Å; N125-C157 HydrophobicContact CB-CB 4.23Å; A126-C157 HydrophobicContact CB-CB 4.19Å; M153-C157 PolarHBondContact O-N 2.88Å; S154-C157 PolarHBondContact O-N 3.41Å; C157-I159 VanDerWaalsContact C-N 3.3Å; C157-I159 PolarHBondContact O-N 3.33Å; C157-F160 PolarHBondContact O-N 3.12Å; C157-S161 VanDerWaalsContact O-CB 3.25Å; C157-S161 WeakPolarHBondContact O-CB 3.4Å; C157-S161 PolarHBondContact O-N 3.48Å; C157-S161 PolarHBondContact O-OG 2.84Å
158P98.8Very high98.5Very high0 Ų042.5 Ų42.50%025%0.247CC..Hα-helixtrans-67.5-31.2175.3-23.137.3000112.8S103 M106 A107 L110 Y122 S154 M155 S161 S162S103-P158 VanDerWaalsContact O-CG 3.3Å; S103-P158 WeakPolarHBondContact O-CG 3.3Å; S103-P158 VanDerWaalsContact OG-CD 3.27Å; S103-P158 WeakPolarHBondContact OG-CD 3.26Å; S103-P158 WeakPolarHBondContact OG-CG 3.34Å; M106-P158 HydrophobicContact CB-CG 4.16Å; M106-P158 HydrophobicContact CG-CG 4.34Å; A107-P158 HydrophobicContact CB-CB 4.11Å; A107-P158 HydrophobicContact CB-CG 4.12Å; L110-P158 HydrophobicContact CD1-CB 4.33Å; Y122-P158 HydrophobicContact CD1-CB 3.69Å; Y122-P158 HydrophobicContact CD1-CG 4.26Å; Y122-P158 HydrophobicContact CE1-CB 3.95Å; S154-P158 WeakPolarHBondContact O-CD 3.38Å; M155-P158 WeakPolarHBondContact O-CD 3.48Å; P158-S161 PolarHBondContact O-N 3.48Å; P158-S162 VanDerWaalsContact O-CB 3.27Å; P158-S162 WeakPolarHBondContact O-CB 3.37Å; P158-S162 PolarHBondContact O-N 2.82Å
159I98.8Very high98.4Very high92 Ų9240.2 Ų40.247%0.47224%0.239SC..Hα-helixtrans-65.3-52.9176.1-56.4174.1000109.5L110 T156 C157 S161 S162 A163L110-I159 HydrophobicContact CD1-CG1 3.83Å; T156-I159 WeakPolarHBondContact O-CA 3.36Å; T156-I159 WeakPolarHBondContact O-CB 3.38Å; T156-I159 PolarHBondContact O-N 3.39Å; C157-I159 VanDerWaalsContact C-N 3.3Å; C157-I159 PolarHBondContact O-N 3.33Å; I159-S161 VanDerWaalsContact C-N 3.34Å; I159-S161 PolarHBondContact O-N 3.37Å; I159-S162 PolarHBondContact O-N 2.98Å; I159-A163 WeakPolarHBondContact O-CB 3.4Å; I159-A163 PolarHBondContact O-N 2.95Å
160F98.7Very high98.3Very high52 Ų5247.1 Ų47.123%0.22827%0.268CS..Hα-helixtrans-58.7-45.2175-76.5-60.1000111.8T156 C157 S162 A163 L164 P179 M182 A183 M186T156-F160 WeakPolarHBondContact O-CD2 3.49Å; T156-F160 PolarHBondContact O-N 2.73Å; T156-F160 WeakPolarHBondContact OG1-CE2 3.41Å; C157-F160 PolarHBondContact O-N 3.12Å; F160-S162 PolarHBondContact O-N 3.37Å; F160-A163 PolarHBondContact O-N 3.47Å; F160-L164 VanDerWaalsContact O-CB 3.29Å; F160-L164 WeakPolarHBondContact O-CB 3.46Å; F160-L164 WeakPolarHBondContact O-CD1 3.22Å; F160-L164 VanDerWaalsContact O-CG 3.3Å; F160-L164 WeakPolarHBondContact O-CG 3.48Å; F160-L164 PolarHBondContact O-N 3.34Å; F160-P179 HydrophobicContact CB-CB 3.7Å; F160-P179 HydrophobicContact CB-CG 4.4Å; F160-M182 HydrophobicContact CD1-CB 4.24Å; F160-M182 HydrophobicContact CD1-SD 3.98Å; F160-M182 HydrophobicContact CE1-CB 4.1Å; F160-M182 HydrophobicContact CE1-SD 4.26Å; F160-M182 HydrophobicContact CZ-CB 4.27Å; F160-A183 HydrophobicContact CD2-CB 4.29Å; F160-A183 HydrophobicContact CE2-CB 4.07Å; F160-M186 HydrophobicContact CZ-SD 4.47Å
161S98.4Very high98.2Very high6 Ų655.3 Ų55.34%0.04230%0.299CS..Hα-helixtrans-60.2-47179.7-58.70000111.5C157 P158 I159 N165 P179C157-S161 VanDerWaalsContact O-CB 3.25Å; C157-S161 WeakPolarHBondContact O-CB 3.4Å; C157-S161 PolarHBondContact O-N 3.48Å; C157-S161 PolarHBondContact O-OG 2.84Å; P158-S161 PolarHBondContact O-N 3.48Å; I159-S161 VanDerWaalsContact C-N 3.34Å; I159-S161 PolarHBondContact O-N 3.37Å; S161-N165 WeakPolarHBondContact O-CB 3.47Å; S161-N165 PolarHBondContact O-N 2.98Å; S161-P179 VanDerWaalsContact OG-CG 3.32Å; S161-P179 WeakPolarHBondContact OG-CG 3.34Å
162S98.4Very high98.2Very high44 Ų4456.1 Ų56.131%0.30830%0.301SS..Hα-helixtrans-63.8-46.2178.2178.60000111.9Q112 P158 I159 F160 N165 S166Q112-S162 PolarHBondContact OE1-OG 3.16Å; P158-S162 VanDerWaalsContact O-CB 3.27Å; P158-S162 WeakPolarHBondContact O-CB 3.37Å; P158-S162 PolarHBondContact O-N 2.82Å; I159-S162 PolarHBondContact O-N 2.98Å; F160-S162 PolarHBondContact O-N 3.37Å; S162-N165 PolarHBondContact O-N 2.74Å; S162-S166 WeakPolarHBondContact O-CB 3.32Å; S162-S166 PolarHBondContact O-N 3.36Å
163A98.5Very high98.2Very high56 Ų5654.2 Ų54.246%0.46329%0.285SS..Hα-helixtrans-62.2-48.4179.700000111.7I159 F160 N165 S166 M167I159-A163 WeakPolarHBondContact O-CB 3.4Å; I159-A163 PolarHBondContact O-N 2.95Å; F160-A163 PolarHBondContact O-N 3.47Å; A163-N165 PolarHBondContact O-N 2.97Å; A163-S166 WeakPolarHBondContact O-CB 3.44Å; A163-S166 PolarHBondContact O-N 3.27Å; A163-M167 PolarHBondContact O-N 3.49Å
164L98.4Very high98.2Very high23 Ų2354.1 Ų54.112%0.1229%0.285CS..Hα-helixtrans-64.2-40.8177.3-72.7165.8000111.6F160 S166 M167 L168 V175 L178 P179 M182F160-L164 VanDerWaalsContact O-CB 3.29Å; F160-L164 WeakPolarHBondContact O-CB 3.46Å; F160-L164 WeakPolarHBondContact O-CD1 3.22Å; F160-L164 VanDerWaalsContact O-CG 3.3Å; F160-L164 WeakPolarHBondContact O-CG 3.48Å; F160-L164 PolarHBondContact O-N 3.34Å; L164-S166 VanDerWaalsContact C-N 3.33Å; L164-S166 PolarHBondContact O-N 3.35Å; L164-M167 PolarHBondContact O-N 2.88Å; L164-M167 VanDerWaalsContact O-N 3.15Å; L164-L168 WeakPolarHBondContact O-CB 3.45Å; L164-L168 PolarHBondContact O-N 2.88Å; L164-V175 HydrophobicContact CB-CB 4.18Å; L164-V175 HydrophobicContact CB-CG1 3.69Å; L164-L178 HydrophobicContact CD1-CB 3.64Å; L164-L178 HydrophobicContact CD2-CD1 4.34Å; L164-P179 HydrophobicContact CD1-CG 3.86Å; L164-M182 HydrophobicContact CD1-SD 3.99Å; L164-M182 HydrophobicContact CD2-CE 4.15Å; L164-M182 HydrophobicContact CD2-SD 4.41Å
165N97.3Very high98.1Very high58 Ų5854.9 Ų54.931%0.3129%0.29SS..Hα-helixtrans-64.7-38.1178.1-169.453.8000111.2S161 S162 A163 M167 S169 V175S161-N165 WeakPolarHBondContact O-CB 3.47Å; S161-N165 PolarHBondContact O-N 2.98Å; S162-N165 PolarHBondContact O-N 2.74Å; A163-N165 PolarHBondContact O-N 2.97Å; N165-M167 PolarHBondContact O-N 3.25Å; N165-S169 WeakPolarHBondContact O-CB 3.49Å; N165-S169 PolarHBondContact O-N 3.21Å; N165-S169 PolarHBondContact O-OG 3.23Å; N165-V175 HydrophobicContact CB-CG1 3.8Å; N165-V175 VanDerWaalsContact N-CG1 3.34Å
166S97.5Very high98.1Very high75 Ų7551.1 Ų51.152%0.52427%0.271SS..Hα-helixtrans-59.4-31.3175.1-173.60000112.8S162 A163 L164 K170S162-S166 WeakPolarHBondContact O-CB 3.32Å; S162-S166 PolarHBondContact O-N 3.36Å; A163-S166 WeakPolarHBondContact O-CB 3.44Å; A163-S166 PolarHBondContact O-N 3.27Å; L164-S166 VanDerWaalsContact C-N 3.33Å; L164-S166 PolarHBondContact O-N 3.35Å; S166-K170 WeakPolarHBondContact O-CE 3.35Å
167M97.7Very high98.1Very high120 Ų12049.5 Ų49.559%0.59126%0.261SS*.Hα-helixtrans-84.4-58.2176-62.7-176.670.600111.6A163 L164 N165 S169 K170 W171A163-M167 PolarHBondContact O-N 3.49Å; L164-M167 PolarHBondContact O-N 2.88Å; L164-M167 VanDerWaalsContact O-N 3.15Å; N165-M167 PolarHBondContact O-N 3.25Å; M167-S169 PolarHBondContact O-N 3.44Å; M167-K170 WeakPolarHBondContact O-CB 3.28Å; M167-K170 PolarHBondContact O-N 2.84Å; M167-W171 WeakPolarHBondContact O-CZ3 3.1Å
168L97.9Very high98.1Very high29 Ų2950 Ų5015%0.15226%0.264CS..Hα-helixtrans-71-30.3-169.8-69.3173.8000113.6L164 K170 W171 D172 L173 V175 L178L164-L168 WeakPolarHBondContact O-CB 3.45Å; L164-L168 PolarHBondContact O-N 2.88Å; L168-K170 PolarHBondContact O-N 3.41Å; L168-W171 CarbonylContact O-C 2.99Å; L168-W171 PolarHBondContact O-N 2.97Å; L168-D172 PolarHBondContact O-N 3.45Å; L168-L173 CarbonylContact C-O 3.57Å; L168-L173 HydrophobicContact CB-CB 4.05Å; L168-L173 WeakPolarHBondContact CB-O 3.39Å; L168-L173 HydrophobicContact CD2-CB 4.31Å; L168-L173 HydrophobicContact CD2-CD1 4.22Å; L168-L173 PolarHBondContact O-N 3.41Å; L168-V175 HydrophobicContact CD1-CG1 4.33Å; L168-L178 HydrophobicContact CD1-CD1 4.05Å
169S96.6Very high98.1Very high55 Ų5550 Ų5039%0.38526%0.264SS..G310 helixtrans-64.1-21.3176.864.20000113.1N165 M167 W171 D172N165-S169 WeakPolarHBondContact O-CB 3.49Å; N165-S169 PolarHBondContact O-N 3.21Å; N165-S169 PolarHBondContact O-OG 3.23Å; M167-S169 PolarHBondContact O-N 3.44Å; S169-W171 PolarHBondContact O-N 2.98Å; S169-D172 WeakPolarHBondContact O-CA 3.48Å; S169-D172 PolarHBondContact O-N 3.23Å
170K96.9Very high98.1Very high161 Ų16145.7 Ų45.770%0.724%0.242SC*.G310 helixtrans-63.4-25.6172.9-61.2-178.9-179.2179.30112.9S166 M167 L168S166-K170 WeakPolarHBondContact O-CE 3.35Å; M167-K170 WeakPolarHBondContact O-CB 3.28Å; M167-K170 PolarHBondContact O-N 2.84Å; L168-K170 PolarHBondContact O-N 3.41Å
171W97.5Very high98.2Very high172 Ų17243.3 Ų43.365%0.65223%0.231SC*.G310 helixtrans-105.612172.5-65.6-89000112.1M167 L168 S169 L173M167-W171 WeakPolarHBondContact O-CZ3 3.1Å; L168-W171 CarbonylContact O-C 2.99Å; L168-W171 PolarHBondContact O-N 2.97Å; S169-W171 PolarHBondContact O-N 2.98Å; W171-L173 HydrophobicContact CB-CD1 3.89Å; W171-L173 HydrophobicContact CB-CG 4.04Å; W171-L173 PolarHBondContact O-N 2.87Å
172D97.9Very high98.2Very high53 Ų5346 Ų4628%0.28324%0.244SC..THydrogen-bonded Turntrans5540-176-174.359.6000111.4L168 S169 K361 P363 L364L168-D172 PolarHBondContact O-N 3.45Å; S169-D172 WeakPolarHBondContact O-CA 3.48Å; S169-D172 PolarHBondContact O-N 3.23Å; D172-K361 WeakPolarHBondContact O-CE 3.25Å; D172-K361 PolarHBondContact O-NZ 3.1Å; D172-K361 IonicContact OD2-NZ 3.81Å; D172-K361 PolarHBondContact OD2-NZ 3.31Å; D172-P363 WeakPolarHBondContact OD2-CA 3.35Å; D172-L364 VanDerWaalsContact C-CD1 3.42Å; D172-L364 WeakPolarHBondContact O-CD1 3.45Å; D172-L364 WeakPolarHBondContact O-CG 3.13Å; D172-L364 VanDerWaalsContact OD1-CB 3.32Å; D172-L364 WeakPolarHBondContact OD1-CB 3.27Å; D172-L364 WeakPolarHBondContact OD1-CG 3.37Å; D172-L364 PolarHBondContact OD1-N 3.28Å; D172-L364 VanDerWaalsContact OD1-N 3.07Å; D172-L364 PolarHBondContact OD2-N 3.3Å
173L98.4Very high98.2Very high4 Ų443.9 Ų43.92%0.02123%0.229CC..  trans-105.4140.7178.8-66.7170.6000111.4L168 W171 L347 L350 I351L168-L173 CarbonylContact C-O 3.57Å; L168-L173 HydrophobicContact CB-CB 4.05Å; L168-L173 WeakPolarHBondContact CB-O 3.39Å; L168-L173 HydrophobicContact CD2-CB 4.31Å; L168-L173 HydrophobicContact CD2-CD1 4.22Å; L168-L173 PolarHBondContact O-N 3.41Å; W171-L173 HydrophobicContact CB-CD1 3.89Å; W171-L173 HydrophobicContact CB-CG 4.04Å; W171-L173 PolarHBondContact O-N 2.87Å; L173-L347 HydrophobicContact CB-CD2 4.02Å; L173-L347 HydrophobicContact CD1-CD2 4.23Å; L173-L347 HydrophobicContact CD2-CD2 4.31Å; L173-L347 HydrophobicContact CG-CD2 4.42Å; L173-L350 HydrophobicContact CD2-CB 3.63Å; L173-L350 HydrophobicContact CD2-CD1 4.33Å; L173-I351 HydrophobicContact CD1-CD1 3.81Å; L173-I351 HydrophobicContact CD1-CG1 3.54Å; L173-I351 HydrophobicContact CD2-CG1 4.29Å
174P98.2Very high98.2Very high18 Ų1841.3 Ų41.312%0.11721%0.208CC..  trans-76.7157.7176.234.7-35.3000110.7F176 F301 L350 L364P174-F176 VanDerWaalsContact C-N 3.32Å; P174-F176 HydrophobicContact CB-CD1 4.24Å; P174-F176 HydrophobicContact CB-CE1 4.22Å; P174-F176 HydrophobicContact CG-CD1 3.82Å; P174-F176 HydrophobicContact CG-CD2 4.2Å; P174-F176 HydrophobicContact CG-CE1 3.41Å; P174-F176 VanDerWaalsContact CG-CE1 3.41Å; P174-F176 HydrophobicContact CG-CE2 3.81Å; P174-F176 HydrophobicContact CG-CG 4.21Å; P174-F176 HydrophobicContact CG-CZ 3.4Å; P174-F301 HydrophobicContact CB-CE1 3.88Å; P174-F301 HydrophobicContact CB-CZ 4.23Å; P174-F301 HydrophobicContact CG-CD1 4.03Å; P174-F301 HydrophobicContact CG-CE1 3.76Å; P174-F301 HydrophobicContact CG-CZ 4.13Å; P174-L350 HydrophobicContact CG-CD1 4.35Å; P174-L364 HydrophobicContact CB-CD2 4.26Å; P174-L364 HydrophobicContact CG-CD2 4.46Å
175V98.4Very high98.2Very high16 Ų1641 Ų4110%0.09721%0.208CC..  trans-78-17.3177.1-57.80000113.7L164 N165 L168 L178 P179L164-V175 HydrophobicContact CB-CB 4.18Å; L164-V175 HydrophobicContact CB-CG1 3.69Å; N165-V175 HydrophobicContact CB-CG1 3.8Å; N165-V175 VanDerWaalsContact N-CG1 3.34Å; L168-V175 HydrophobicContact CD1-CG1 4.33Å; V175-L178 VanDerWaalsContact O-CB 3.27Å; V175-L178 WeakPolarHBondContact O-CB 3.32Å; V175-L178 WeakPolarHBondContact O-CG 3.42Å; V175-L178 PolarHBondContact O-N 3.02Å; V175-P179 HydrophobicContact CB-CG 4.5Å; V175-P179 HydrophobicContact CG2-CG 4.25Å
176F98.8Very high98.3Very high3 Ų344 Ų441%0.01322%0.221CC..THydrogen-bonded Turntrans47.3-146.9-173.7-65.6-46.6000112.4F71 Y124 N125 P174 L178 P179 A296 F301 F342 T346 L347 L350F71-F176 AromaticContact CE1-CD1 3.82Å; F71-F176 HydrophobicContact CE1-CD1 3.82Å; F71-F176 HydrophobicContact CE1-CE1 4.07Å; F71-F176 HydrophobicContact CZ-CD1 4.42Å; Y124-F176 WeakPolarHBondContact CE2-O 3.34Å; Y124-F176 PolarHBondContact OH-O 3.11Å; N125-F176 PolarHBondContact ND2-O 3.04Å; P174-F176 VanDerWaalsContact C-N 3.32Å; P174-F176 HydrophobicContact CB-CD1 4.24Å; P174-F176 HydrophobicContact CB-CE1 4.22Å; P174-F176 HydrophobicContact CG-CD1 3.82Å; P174-F176 HydrophobicContact CG-CD2 4.2Å; P174-F176 HydrophobicContact CG-CE1 3.41Å; P174-F176 VanDerWaalsContact CG-CE1 3.41Å; P174-F176 HydrophobicContact CG-CE2 3.81Å; P174-F176 HydrophobicContact CG-CG 4.21Å; P174-F176 HydrophobicContact CG-CZ 3.4Å; F176-L178 PolarHBondContact O-N 2.84Å; F176-P179 WeakPolarHBondContact O-CD 3.35Å; F176-A296 HydrophobicContact CE1-CB 4.41Å; F176-F301 HydrophobicContact CD1-CE2 4.46Å; F176-F301 AromaticContact CE1-CD2 3.91Å; F176-F301 HydrophobicContact CE1-CD2 3.91Å; F176-F301 AromaticContact CE1-CE2 3.52Å; F176-F301 HydrophobicContact CE1-CE2 3.52Å; F176-F301 AromaticContact CE1-CZ 3.88Å; F176-F301 HydrophobicContact CE1-CZ 3.88Å; F176-F301 HydrophobicContact CZ-CD2 4.25Å; F176-F301 HydrophobicContact CZ-CE2 4.3Å; F176-F342 HydrophobicContact CB-CE1 3.81Å; F176-F342 HydrophobicContact CB-CZ 3.92Å; F176-F342 HydrophobicContact CD1-CE1 4.32Å; F176-F342 HydrophobicContact CD1-CE2 4.49Å; F176-F342 AromaticContact CD1-CZ 3.59Å; F176-F342 HydrophobicContact CD1-CZ 3.59Å; F176-F342 HydrophobicContact CD2-CZ 4.2Å; F176-F342 HydrophobicContact CE1-CZ 4.03Å; F176-F342 HydrophobicContact CG-CE1 4.1Å; F176-F342 AromaticContact CG-CZ 3.67Å; F176-F342 HydrophobicContact CG-CZ 3.67Å; F176-T346 HydrophobicContact CE1-CG2 4.37Å; F176-T346 HydrophobicContact CE2-CG2 3.62Å; F176-T346 HydrophobicContact CZ-CG2 3.4Å; F176-L347 HydrophobicContact CD2-CD1 4.49Å; F176-L347 HydrophobicContact CD2-CD2 4Å; F176-L347 HydrophobicContact CD2-CG 3.86Å; F176-L347 HydrophobicContact CE2-CD2 3.86Å; F176-L347 HydrophobicContact CE2-CG 3.89Å; F176-L350 HydrophobicContact CE2-CD1 4.09Å; F176-L350 HydrophobicContact CZ-CD1 3.71Å
177T98.8Very high98.4Very high1 Ų141.1 Ų41.11%0.00620%0.199CC..THydrogen-bonded Turntrans-88.119.117857.20000112.5Y124 N125 L128 P179 F180 N181 T339 F342 C343Y124-T177 HydrophobicContact CD2-CG2 4.31Å; Y124-T177 HydrophobicContact CE2-CG2 4.08Å; N125-T177 VanDerWaalsContact OD1-CA 3.28Å; N125-T177 WeakPolarHBondContact OD1-CA 3.06Å; L128-T177 HydrophobicContact CD1-CG2 3.55Å; T177-P179 VanDerWaalsContact C-CD 3.48Å; T177-F180 WeakPolarHBondContact O-CB 3.15Å; T177-F180 PolarHBondContact O-N 3.4Å; T177-N181 PolarHBondContact O-N 3.29Å; T177-N181 PolarHBondContact O-ND2 3.35Å; T177-N181 PolarHBondContact OG1-ND2 3.46Å; T177-T339 PolarHBondContact OG1-OG1 3.04Å; T177-F342 HydrophobicContact CG2-CE1 4.42Å; T177-C343 PolarHBondContact OG1-SG 3.34Å
178L98.9Very high98.4Very high12 Ų1235.9 Ų35.96%0.06317%0.173CC..Hα-helixtrans-56.1-42.8174.3-70.2173.8000112.6L164 L168 V175 F176 F180 N181 M182 W340 C343 L347L164-L178 HydrophobicContact CD1-CB 3.64Å; L164-L178 HydrophobicContact CD2-CD1 4.34Å; L168-L178 HydrophobicContact CD1-CD1 4.05Å; V175-L178 VanDerWaalsContact O-CB 3.27Å; V175-L178 WeakPolarHBondContact O-CB 3.32Å; V175-L178 WeakPolarHBondContact O-CG 3.42Å; V175-L178 PolarHBondContact O-N 3.02Å; F176-L178 PolarHBondContact O-N 2.84Å; L178-F180 VanDerWaalsContact C-N 3.33Å; L178-F180 PolarHBondContact O-N 2.7Å; L178-N181 PolarHBondContact O-N 3.09Å; L178-M182 WeakPolarHBondContact O-CB 3.37Å; L178-M182 VanDerWaalsContact O-CG 3.32Å; L178-M182 WeakPolarHBondContact O-CG 3.38Å; L178-M182 PolarHBondContact O-N 3.42Å; L178-W340 HydrophobicContact CD2-CE3 3.87Å; L178-W340 HydrophobicContact CD2-CH2 4.31Å; L178-W340 HydrophobicContact CD2-CZ3 3.47Å; L178-W340 VanDerWaalsContact CD2-CZ3 3.47Å; L178-C343 HydrophobicContact CD2-CB 3.59Å; L178-C343 HydrophobicContact CG-CB 3.93Å; L178-L347 HydrophobicContact CD1-CD1 3.83Å
179P98.9Very high98.4Very high0 Ų038.1 Ų38.10%019%0.191CC..Hα-helixtrans-58.6-42.7175.8-22.932.5000113.1N125 F160 S161 L164 V175 F176 T177 A183N125-P179 HydrophobicContact CB-CB 4.03Å; N125-P179 WeakPolarHBondContact ND2-CG 3.31Å; N125-P179 WeakPolarHBondContact OD1-CD 3.13Å; F160-P179 HydrophobicContact CB-CB 3.7Å; F160-P179 HydrophobicContact CB-CG 4.4Å; S161-P179 VanDerWaalsContact OG-CG 3.32Å; S161-P179 WeakPolarHBondContact OG-CG 3.34Å; L164-P179 HydrophobicContact CD1-CG 3.86Å; V175-P179 HydrophobicContact CB-CG 4.5Å; V175-P179 HydrophobicContact CG2-CG 4.25Å; F176-P179 WeakPolarHBondContact O-CD 3.35Å; T177-P179 VanDerWaalsContact C-CD 3.48Å; P179-A183 VanDerWaalsContact O-CB 3.29Å; P179-A183 WeakPolarHBondContact O-CB 3.42Å; P179-A183 PolarHBondContact O-N 3.39Å
180F98.9Very high98.5Very high2 Ų239.2 Ų39.21%0.00920%0.204CC..Hα-helixtrans-60.5-52.2174152.2-106.8000111.6N125 L128 V129 L132 T177 L178 M182 A183 L184 C338 T339N125-F180 HydrophobicContact CB-CB 4.12Å; N125-F180 VanDerWaalsContact OD1-CB 3.27Å; N125-F180 WeakPolarHBondContact OD1-CB 3.32Å; N125-F180 PolarHBondContact OD1-N 2.95Å; L128-F180 HydrophobicContact CB-CB 4.2Å; L128-F180 HydrophobicContact CB-CD1 4.13Å; L128-F180 HydrophobicContact CB-CD2 3.28Å; L128-F180 HydrophobicContact CB-CE1 4.37Å; L128-F180 HydrophobicContact CB-CE2 3.56Å; L128-F180 HydrophobicContact CB-CG 3.58Å; L128-F180 HydrophobicContact CB-CZ 4.11Å; L128-F180 HydrophobicContact CD1-CB 4.26Å; L128-F180 HydrophobicContact CD1-CD1 3.78Å; L128-F180 HydrophobicContact CD1-CD2 4.42Å; L128-F180 HydrophobicContact CD1-CE1 4.24Å; L128-F180 HydrophobicContact CD1-CG 3.87Å; L128-F180 HydrophobicContact CG-CD2 4.49Å; L128-F180 HydrophobicContact CG-CG 4.41Å; V129-F180 HydrophobicContact CB-CD2 4.49Å; V129-F180 HydrophobicContact CG2-CB 4.44Å; V129-F180 HydrophobicContact CG2-CD2 3.79Å; L132-F180 HydrophobicContact CB-CE2 4.06Å; L132-F180 HydrophobicContact CB-CZ 4.27Å; L132-F180 HydrophobicContact CD2-CE2 4.28Å; L132-F180 HydrophobicContact CD2-CZ 4.21Å; L132-F180 HydrophobicContact CG-CE2 4.18Å; L132-F180 HydrophobicContact CG-CZ 3.98Å; T177-F180 WeakPolarHBondContact O-CB 3.15Å; T177-F180 PolarHBondContact O-N 3.4Å; L178-F180 VanDerWaalsContact C-N 3.33Å; L178-F180 PolarHBondContact O-N 2.7Å; F180-M182 VanDerWaalsContact C-N 3.35Å; F180-M182 PolarHBondContact O-N 2.98Å; F180-A183 PolarHBondContact O-N 3Å; F180-L184 HydrophobicContact CD2-CB 4.35Å; F180-L184 HydrophobicContact CE2-CB 3.98Å; F180-L184 HydrophobicContact CE2-CD2 3.59Å; F180-L184 HydrophobicContact CE2-CG 4.34Å; F180-L184 HydrophobicContact CZ-CD2 3.64Å; F180-L184 WeakPolarHBondContact O-CB 3.44Å; F180-L184 PolarHBondContact O-N 2.93Å; F180-C338 HydrophobicContact CE1-CB 3.91Å; F180-C338 HydrophobicContact CZ-CB 4.03Å; F180-T339 WeakPolarHBondContact CE1-OG1 3.48Å
181N98.9Very high98.6Very high1 Ų132.7 Ų32.71%0.00518%0.178CC..Hα-helixtrans-64.4-40.8-175.3-75.9-66.6000111.4T177 L178 S185 C338 T339 W340T177-N181 PolarHBondContact O-N 3.29Å; T177-N181 PolarHBondContact O-ND2 3.35Å; T177-N181 PolarHBondContact OG1-ND2 3.46Å; L178-N181 PolarHBondContact O-N 3.09Å; N181-S185 VanDerWaalsContact O-CB 3.25Å; N181-S185 WeakPolarHBondContact O-CB 3.14Å; N181-S185 PolarHBondContact O-N 3.3Å; N181-S185 PolarHBondContact O-OG 3Å; N181-C338 WeakPolarHBondContact OD1-CB 3.45Å; N181-T339 VanDerWaalsContact ND2-C 3.29Å; N181-T339 PolarHBondContact ND2-OG1 2.96Å; N181-T339 PolarHBondContact OD1-N 3.32Å; N181-T339 PolarHBondContact OD1-OG1 3.13Å; N181-W340 HydrophobicContact CB-CD2 3.74Å; N181-W340 VanDerWaalsContact CB-CE2 3.49Å; N181-W340 HydrophobicContact CB-CE3 4.42Å; N181-W340 HydrophobicContact CB-CG 3.94Å; N181-W340 HydrophobicContact CB-CZ2 3.95Å; N181-W340 PolarHBondContact ND2-N 3.06Å; N181-W340 PolarHBondContact OD1-N 2.94Å; N181-W340 VanDerWaalsContact OD1-N 3.12Å
182M98.9Very high98.6Very high62 Ų6225.6 Ų25.631%0.30516%0.158SC..Hα-helixtrans-61.7-48.2173.6-73.3-179.4164.900112F160 L164 L178 F180 M186 W340F160-M182 HydrophobicContact CD1-CB 4.24Å; F160-M182 HydrophobicContact CD1-SD 3.98Å; F160-M182 HydrophobicContact CE1-CB 4.1Å; F160-M182 HydrophobicContact CE1-SD 4.26Å; F160-M182 HydrophobicContact CZ-CB 4.27Å; L164-M182 HydrophobicContact CD1-SD 3.99Å; L164-M182 HydrophobicContact CD2-CE 4.15Å; L164-M182 HydrophobicContact CD2-SD 4.41Å; L178-M182 WeakPolarHBondContact O-CB 3.37Å; L178-M182 VanDerWaalsContact O-CG 3.32Å; L178-M182 WeakPolarHBondContact O-CG 3.38Å; L178-M182 PolarHBondContact O-N 3.42Å; F180-M182 VanDerWaalsContact C-N 3.35Å; F180-M182 PolarHBondContact O-N 2.98Å; M182-M186 WeakPolarHBondContact O-CB 3.3Å; M182-M186 PolarHBondContact O-N 2.76Å; M182-W340 HydrophobicContact CE-CH2 4.07Å; M182-W340 HydrophobicContact CG-CH2 3.59Å; M182-W340 HydrophobicContact CG-CZ2 3.84Å
183A98.9Very high98.6Very high0 Ų025.7 Ų25.70%016%0.157CC..Hα-helixtrans-63.3-48.1179.500000111.6V129 M153 F160 P179 F180 M186 Y187V129-A183 HydrophobicContact CG2-CB 3.98Å; M153-A183 HydrophobicContact CE-CB 3.83Å; M153-A183 WeakPolarHBondContact CE-O 3.41Å; F160-A183 HydrophobicContact CD2-CB 4.29Å; F160-A183 HydrophobicContact CE2-CB 4.07Å; P179-A183 VanDerWaalsContact O-CB 3.29Å; P179-A183 WeakPolarHBondContact O-CB 3.42Å; P179-A183 PolarHBondContact O-N 3.39Å; F180-A183 PolarHBondContact O-N 3Å; A183-M186 PolarHBondContact O-N 3Å; A183-Y187 WeakPolarHBondContact O-CB 3.3Å; A183-Y187 PolarHBondContact O-N 3.49Å
184L98.9Very high98.6Very high2 Ų235 Ų351%0.0119%0.193CC..Hα-helixtrans-67.9-44.6-177.9-17468.6000112L132 M133 F136 F180 M186 Y187 L188 C338L132-L184 HydrophobicContact CB-CD1 4.45Å; L132-L184 HydrophobicContact CB-CD2 3.69Å; L132-L184 HydrophobicContact CG-CD2 4.43Å; M133-L184 HydrophobicContact CG-CD1 3.72Å; F136-L184 HydrophobicContact CD2-CD2 4.16Å; F136-L184 HydrophobicContact CE2-CD2 4.17Å; F180-L184 HydrophobicContact CD2-CB 4.35Å; F180-L184 HydrophobicContact CE2-CB 3.98Å; F180-L184 HydrophobicContact CE2-CD2 3.59Å; F180-L184 HydrophobicContact CE2-CG 4.34Å; F180-L184 HydrophobicContact CZ-CD2 3.64Å; F180-L184 WeakPolarHBondContact O-CB 3.44Å; F180-L184 PolarHBondContact O-N 2.93Å; L184-M186 VanDerWaalsContact C-N 3.32Å; L184-M186 PolarHBondContact O-N 3.42Å; L184-Y187 HydrophobicContact CD1-CD1 4.41Å; L184-Y187 PolarHBondContact O-N 3.35Å; L184-L188 HydrophobicContact CD1-CD1 4.07Å; L184-L188 HydrophobicContact CD1-CG 4.04Å; L184-L188 HydrophobicContact CD2-CD1 4.3Å; L184-L188 HydrophobicContact CG-CD1 3.84Å; L184-L188 HydrophobicContact CG-CG 4.17Å; L184-L188 WeakPolarHBondContact O-CB 3.37Å; L184-L188 WeakPolarHBondContact O-CG 3.4Å; L184-L188 PolarHBondContact O-N 3.43Å; L184-C338 VanDerWaalsContact CD2-SG 3.56Å
185S98.8Very high98.6Very high18 Ų1836.1 Ų36.113%0.12620%0.198CC..Hα-helixtrans-59.6-44.6175.1-65.30000111N181 Y187 L188 S189 W340N181-S185 VanDerWaalsContact O-CB 3.25Å; N181-S185 WeakPolarHBondContact O-CB 3.14Å; N181-S185 PolarHBondContact O-N 3.3Å; N181-S185 PolarHBondContact O-OG 3Å; S185-Y187 PolarHBondContact O-N 3.09Å; S185-L188 PolarHBondContact O-N 3.19Å; S185-S189 WeakPolarHBondContact O-CB 3.28Å; S185-S189 PolarHBondContact O-N 3.28Å; S185-S189 PolarHBondContact O-OG 3.41Å; S185-W340 PolarHBondContact OG-NE1 2.94Å; S185-W340 VanDerWaalsContact OG-NE1 3.09Å
186M98.8Very high98.6Very high119 Ų11940.4 Ų40.459%0.58623%0.227SC*.Hα-helixtrans-59.1-46.1175.4179.8-178176.400112.2F160 M182 A183 L184 A190F160-M186 HydrophobicContact CZ-SD 4.47Å; M182-M186 WeakPolarHBondContact O-CB 3.3Å; M182-M186 PolarHBondContact O-N 2.76Å; A183-M186 PolarHBondContact O-N 3Å; L184-M186 VanDerWaalsContact C-N 3.32Å; L184-M186 PolarHBondContact O-N 3.42Å; M186-A190 VanDerWaalsContact O-CB 3.25Å; M186-A190 WeakPolarHBondContact O-CB 3.41Å; M186-A190 PolarHBondContact O-N 3.2Å
187Y98.8Very high98.5Very high16 Ų1647.4 Ų47.46%0.06326%0.257CS..Hα-helixtrans-62.8-51.2178.8169.6-104.7000112.1M133 P149 M153 A183 L184 S185 S189 A190 T191M133-Y187 HydrophobicContact CB-CE1 4.42Å; M133-Y187 HydrophobicContact CE-CD1 3.89Å; M133-Y187 HydrophobicContact CE-CD2 3.88Å; M133-Y187 HydrophobicContact CE-CE1 3.65Å; M133-Y187 HydrophobicContact CE-CE2 3.65Å; M133-Y187 HydrophobicContact CE-CG 4Å; M133-Y187 HydrophobicContact CG-CD1 3.85Å; M133-Y187 HydrophobicContact CG-CE1 3.92Å; M133-Y187 HydrophobicContact SD-CD1 4.34Å; P149-Y187 HydrophobicContact CB-CD2 4.29Å; P149-Y187 HydrophobicContact CB-CE2 3.58Å; P149-Y187 HydrophobicContact CG-CE2 4.19Å; M153-Y187 HydrophobicContact CG-CD2 4.07Å; M153-Y187 HydrophobicContact CG-CG 4.18Å; M153-Y187 HydrophobicContact SD-CD2 4.42Å; A183-Y187 WeakPolarHBondContact O-CB 3.3Å; A183-Y187 PolarHBondContact O-N 3.49Å; L184-Y187 HydrophobicContact CD1-CD1 4.41Å; L184-Y187 PolarHBondContact O-N 3.35Å; S185-Y187 PolarHBondContact O-N 3.09Å; Y187-S189 VanDerWaalsContact C-N 3.33Å; Y187-S189 PolarHBondContact O-N 2.88Å; Y187-A190 PolarHBondContact O-N 3Å; Y187-A190 VanDerWaalsContact O-N 3.14Å; Y187-T191 HydrophobicContact CD2-CG2 4.15Å; Y187-T191 HydrophobicContact CE2-CG2 3.62Å; Y187-T191 PolarHBondContact O-N 3Å; Y187-T191 PolarHBondContact O-OG1 3.48Å
188L98.7Very high98.5Very high9 Ų949.5 Ų49.55%0.04727%0.266CS..Hα-helixtrans-66.5-33.3-177.3-67179.1000112.2F136 L184 S185 G192 A200 L335 P336F136-L188 HydrophobicContact CB-CD1 4.29Å; F136-L188 HydrophobicContact CB-CD2 3.98Å; F136-L188 HydrophobicContact CD2-CD1 4.08Å; F136-L188 HydrophobicContact CG-CD1 4.24Å; L184-L188 HydrophobicContact CD1-CD1 4.07Å; L184-L188 HydrophobicContact CD1-CG 4.04Å; L184-L188 HydrophobicContact CD2-CD1 4.3Å; L184-L188 HydrophobicContact CG-CD1 3.84Å; L184-L188 HydrophobicContact CG-CG 4.17Å; L184-L188 WeakPolarHBondContact O-CB 3.37Å; L184-L188 WeakPolarHBondContact O-CG 3.4Å; L184-L188 PolarHBondContact O-N 3.43Å; S185-L188 PolarHBondContact O-N 3.19Å; L188-G192 VanDerWaalsContact O-CA 3.26Å; L188-G192 WeakPolarHBondContact O-CA 3.48Å; L188-G192 PolarHBondContact O-N 2.89Å; L188-A200 HydrophobicContact CD2-CB 3.86Å; L188-L335 HydrophobicContact CB-CD2 3.67Å; L188-P336 HydrophobicContact CD1-CG 3.6Å
189S98.4Very high98.5Very high76 Ų7649.5 Ų49.553%0.53127%0.267SS..Hα-helixtrans-69.4-38.1171.3-63.50000112.5S185 Y187 L335S185-S189 WeakPolarHBondContact O-CB 3.28Å; S185-S189 PolarHBondContact O-N 3.28Å; S185-S189 PolarHBondContact O-OG 3.41Å; Y187-S189 VanDerWaalsContact C-N 3.33Å; Y187-S189 PolarHBondContact O-N 2.88Å; S189-L335 WeakPolarHBondContact OG-CD1 3.3Å
190A98.5Very high98.5Very high79 Ų7950 Ų5065%0.65327%0.271SS*.Hα-helixtrans-71.4-33.3-178.600000112.6M186 Y187M186-A190 VanDerWaalsContact O-CB 3.25Å; M186-A190 WeakPolarHBondContact O-CB 3.41Å; M186-A190 PolarHBondContact O-N 3.2Å; Y187-A190 PolarHBondContact O-N 3Å; Y187-A190 VanDerWaalsContact O-N 3.14Å
191T98.2Very high98.4Very high23 Ų2354.6 Ų54.614%0.14129%0.291CS..Hα-helixtrans-88.3-58.1174.458.40000111.3Y187 N195 F198Y187-T191 HydrophobicContact CD2-CG2 4.15Å; Y187-T191 HydrophobicContact CE2-CG2 3.62Å; Y187-T191 PolarHBondContact O-N 3Å; Y187-T191 PolarHBondContact O-OG1 3.48Å; T191-N195 VanDerWaalsContact O-CB 3.32Å; T191-N195 WeakPolarHBondContact O-CB 3.1Å; T191-F198 VanDerWaalsContact CB-O 3.27Å; T191-F198 WeakPolarHBondContact CB-O 3.42Å; T191-F198 HydrophobicContact CG2-CB 3.91Å
192G97.8Very high98.4Very high24 Ų2458.8 Ų58.825%0.24731%0.313CS..  trans63.9-177-171.300000112.9L188 Y194 A200L188-G192 VanDerWaalsContact O-CA 3.26Å; L188-G192 WeakPolarHBondContact O-CA 3.48Å; L188-G192 PolarHBondContact O-N 2.89Å; G192-Y194 VanDerWaalsContact C-N 3.32Å; G192-Y194 PolarHBondContact O-N 3.27Å; G192-A200 PolarHBondContact O-N 3.42Å
193H98.1Very high98.3Very high55 Ų5557.8 Ų57.826%0.25531%0.31SS..THydrogen-bonded Turntrans-67.2-32.7179.5-177.358.5000113.1D138 N195 P199 A200 L202D138-H193 IonicContact OD2-CE1 3.68Å; H193-N195 PolarHBondContact O-N 3.47Å; H193-P199 WeakPolarHBondContact O-CB 3.44Å; H193-A200 WeakPolarHBondContact CA-O 3.46Å; H193-A200 PolarHBondContact ND1-O 3.23Å; H193-L202 HydrophobicContact CB-CB 4.5Å; H193-L202 HydrophobicContact CB-CD1 4.02Å
194Y97.6Very high98.1Very high198 Ų19863.4 Ų63.478%0.77634%0.339SS*.THydrogen-bonded Turntrans-92.39.6-171.6-55.1-69.3000114.4G192 P196G192-Y194 VanDerWaalsContact C-N 3.32Å; G192-Y194 PolarHBondContact O-N 3.27Å; Y194-P196 WeakPolarHBondContact O-CD 3.11Å
195N98.6Very high98Very high42 Ų4264.9 Ų64.923%0.22535%0.348CS..  trans-64.1130.2176.8-163.3-92.9000111T191 H193 F197 F198 P199T191-N195 VanDerWaalsContact O-CB 3.32Å; T191-N195 WeakPolarHBondContact O-CB 3.1Å; H193-N195 PolarHBondContact O-N 3.47Å; N195-F197 VanDerWaalsContact C-N 3.29Å; N195-F197 PolarHBondContact O-N 3.47Å; N195-F197 PolarHBondContact OD1-N 2.94Å; N195-F198 PolarHBondContact OD1-N 3.39Å; N195-P199 WeakPolarHBondContact O-CD 3.35Å
196P97.9Very high97.8Very high107 Ų10769.4 Ų69.470%0.69537%0.37SS*.SBendtrans-63.4-32179.2-25.335000114.3Y194Y194-P196 WeakPolarHBondContact O-CD 3.11Å
197F97.9Very high97.5Very high150 Ų15069.8 Ų69.866%0.65838%0.379SS*.SBendtrans-98.2-48.6-175.3-65-62.1000112.6F143 N195 P199F143-F197 VanDerWaalsContact CZ-O 3.25Å; F143-F197 WeakPolarHBondContact CZ-O 3.43Å; N195-F197 VanDerWaalsContact C-N 3.29Å; N195-F197 PolarHBondContact O-N 3.47Å; N195-F197 PolarHBondContact OD1-N 2.94Å; F197-P199 WeakPolarHBondContact O-CD 3.28Å
198F98.5Very high97.3Very high44 Ų4474.1 Ų74.119%0.19341%0.407CS..SBendtrans-124.758.9-170.1-53.5-74.8000111.9F143 W145 P149 T191 N195 A200F143-F198 AromaticContact CE1-CD1 3.79Å; F143-F198 HydrophobicContact CE1-CD1 3.79Å; F143-F198 HydrophobicContact CE1-CE1 4.12Å; F143-F198 HydrophobicContact CZ-CD1 4.31Å; F143-F198 HydrophobicContact CZ-CE1 4.37Å; W145-F198 HydrophobicContact CB-CE1 4.02Å; W145-F198 WeakPolarHBondContact O-CE1 3.13Å; P149-F198 HydrophobicContact CG-CD1 3.87Å; P149-F198 HydrophobicContact CG-CE1 3.82Å; P149-F198 HydrophobicContact CG-CG 4.43Å; P149-F198 HydrophobicContact CG-CZ 4.32Å; T191-F198 VanDerWaalsContact CB-O 3.27Å; T191-F198 WeakPolarHBondContact CB-O 3.42Å; T191-F198 HydrophobicContact CG2-CB 3.91Å; N195-F198 PolarHBondContact OD1-N 3.39Å; F198-A200 PolarHBondContact O-N 3.45Å
199P98.5Very high97.1Very high13 Ų1378.2 Ų78.28%0.08444%0.443CS..PPolyproline II helixtrans-64.3133.8-179.628.8-34.8000110.6D138 K139 H193 N195 F197D138-P199 HydrophobicContact CB-CB 4.17Å; D138-P199 HydrophobicContact CB-CG 4.23Å; D138-P199 WeakPolarHBondContact CB-O 3.31Å; D138-P199 PolarHBondContact N-O 3.47Å; K139-P199 HydrophobicContact CD-CG 4.03Å; K139-P199 HydrophobicContact CG-CG 3.97Å; H193-P199 WeakPolarHBondContact O-CB 3.44Å; N195-P199 WeakPolarHBondContact O-CD 3.35Å; F197-P199 WeakPolarHBondContact O-CD 3.28Å
200A98.5Very high96.8Very high9 Ų977.7 Ų77.77%0.07444%0.437CS..BIsolated β-bridgetrans-87.3157.317100000111.2F136 L188 G192 H193 F198 L202F136-A200 CarbonylContact O-C 3.22Å; F136-A200 VanDerWaalsContact O-CA 3.25Å; F136-A200 WeakPolarHBondContact O-CA 3.45Å; L188-A200 HydrophobicContact CD2-CB 3.86Å; G192-A200 PolarHBondContact O-N 3.42Å; H193-A200 WeakPolarHBondContact CA-O 3.46Å; H193-A200 PolarHBondContact ND1-O 3.23Å; F198-A200 PolarHBondContact O-N 3.45Å; A200-L202 PolarHBondContact O-N 3.2Å
201K98Very high96.5Very high99 Ų9981.9 Ų81.943%0.4345%0.449SS..PPolyproline II helixtrans-58.8137.2170.7-73.2-179.4177.7168.10109.8V135 F136 V203V135-K201 WeakPolarHBondContact O-CD 3.32Å; V135-K201 WeakPolarHBondContact O-CE 3.41Å; V135-K201 PolarHBondContact O-NZ 3.04Å; F136-K201 PolarHBondContact O-N 3.49Å; K201-V203 PolarHBondContact O-N 2.95Å
202L97.2Very high96.4Very high89 Ų8982.4 Ų82.447%0.46645%0.45SS..PPolyproline II helixtrans-70.3120.8178.6-175.262.5000110.1H193 A200 I204H193-L202 HydrophobicContact CB-CB 4.5Å; H193-L202 HydrophobicContact CB-CD1 4.02Å; A200-L202 PolarHBondContact O-N 3.2Å; L202-I204 HydrophobicContact CD2-CD1 3.79Å; L202-I204 HydrophobicContact CD2-CG1 3.95Å; L202-I204 HydrophobicContact CG-CD1 4.14Å; L202-I204 HydrophobicContact CG-CG1 3.76Å
203V96.9Very high96.2Very high41 Ų4183.6 Ų83.625%0.24846%0.455CS..PPolyproline II helixtrans-100.3127.4170.8-178.30000107.5K201 A331K201-V203 PolarHBondContact O-N 2.95Å; V203-A331 HydrophobicContact CG1-CB 3.88Å
204I96Very high96.1Very high119 Ų11987.7 Ų87.761%0.6147%0.469SS*.  trans-121.4133.3-175.4-52.9177.8000108.4L202L202-I204 HydrophobicContact CD2-CD1 3.79Å; L202-I204 HydrophobicContact CD2-CG1 3.95Å; L202-I204 HydrophobicContact CG-CD1 4.14Å; L202-I204 HydrophobicContact CG-CG1 3.76Å
205P96.2Very high96.1Very high32 Ų3283.1 Ų83.121%0.20847%0.466CS..  trans-67.5150174.228.4-34.1000111.2T207 A331 E332P205-T207 PolarHBondContact O-N 2.9Å; P205-A331 HydrophobicContact CB-CB 4.29Å; P205-E332 VanDerWaalsContact CB-OE1 3.32Å; P205-E332 WeakPolarHBondContact CB-OE1 3.11Å
206I93.8Very high95.9Very high114 Ų11486.2 Ų86.259%0.58548%0.482SS*.  trans-74.5116.6177.6-58175.1000108.6T208I206-T208 VanDerWaalsContact CG2-O 3.28Å; I206-T208 WeakPolarHBondContact CG2-O 3.46Å
207T93.9Very high95.9Very high126 Ų12684 Ų8477%0.77346%0.464SS*.  trans-105.8-12.2-178.452.10000113.7P205P205-T207 PolarHBondContact O-N 2.9Å
208T94.2Very high95.9Very high107 Ų10778.8 Ų78.866%0.65645%0.446SS*.SBendtrans-132.5142.7-17956.40000110.6I206I206-T208 VanDerWaalsContact CG2-O 3.28Å; I206-T208 WeakPolarHBondContact CG2-O 3.46Å
209A93.9Very high95.9Very high95 Ų9580.5 Ų80.579%0.78547%0.468SS*.  trans-61131174.900000110.6
210P92.4Very high95.9Very high65 Ų6584.7 Ų84.742%0.42249%0.49SS..  trans-68.4139.9177.828.6-34.2000110.5I212 P277P210-I212 HydrophobicContact CB-CD1 4.41Å; P210-I212 HydrophobicContact CB-CG1 4.27Å; P210-I212 HydrophobicContact CG-CD1 3.99Å; P210-I212 HydrophobicContact CG-CG1 4.37Å; P210-I212 PolarHBondContact O-N 3.05Å; P210-P277 HydrophobicContact CB-CG 3.81Å; P210-P277 HydrophobicContact CG-CG 3.94Å
211N93.2Very high95.9Very high168 Ų16887 Ų8790%0.89850%0.499SS*.  trans-83.6111.8173.2-172.717.3000109.5
212I94.4Very high95.9Very high33 Ų3383.9 Ų83.917%0.16949%0.487CS..  trans-115.5118.8-173.1-61.4168.6000110P210 S275 F278P210-I212 HydrophobicContact CB-CD1 4.41Å; P210-I212 HydrophobicContact CB-CG1 4.27Å; P210-I212 HydrophobicContact CG-CD1 3.99Å; P210-I212 HydrophobicContact CG-CG1 4.37Å; P210-I212 PolarHBondContact O-N 3.05Å; I212-S275 WeakPolarHBondContact CD1-O 3.35Å; I212-S275 VanDerWaalsContact CD1-OG 3.29Å; I212-S275 WeakPolarHBondContact CD1-OG 3.23Å; I212-F278 HydrophobicContact CG2-CE1 4.01Å; I212-F278 HydrophobicContact CG2-CE2 4.08Å; I212-F278 HydrophobicContact CG2-CZ 3.65Å
213S94.9Very high95.9Very high50 Ų5085.1 Ų85.135%0.3549%0.493SS..  trans-98.599.6174.7173.80000109.4S215 D216 F278S213-S215 PolarHBondContact O-N 3.26Å; S213-S215 VanDerWaalsContact O-N 3.14Å; S213-S215 PolarHBondContact OG-OG 2.93Å; S213-D216 WeakPolarHBondContact CB-OD2 3.34Å; S213-D216 WeakPolarHBondContact O-CB 3.35Å; S213-D216 PolarHBondContact O-N 3.4Å; S213-D216 VanDerWaalsContact OG-CG 3.32Å; S213-D216 PolarHBondContact OG-OD2 2.96Å; S213-F278 WeakPolarHBondContact O-CE2 3.49Å
214W95.9Very high96Very high141 Ų14187.1 Ų87.153%0.53450%0.498SS..G310 helixtrans-63.6-18.4-176.4-71.887.5000114.1D216 L217 L272 F278W214-D216 PolarHBondContact O-N 2.72Å; W214-L217 WeakPolarHBondContact O-CB 3.39Å; W214-L217 PolarHBondContact O-N 3.16Å; W214-L272 HydrophobicContact CZ3-CD2 4.5Å; W214-F278 HydrophobicContact CD2-CZ 4.28Å; W214-F278 HydrophobicContact CE3-CE1 4.42Å; W214-F278 HydrophobicContact CE3-CZ 4.07Å; W214-F278 HydrophobicContact CZ3-CE1 4.42Å
215S96.3Very high96.1Very high102 Ų10281.4 Ų81.471%0.71347%0.469SS*.G310 helixtrans-67-21.5172.152.90000113.2S213 L217S213-S215 PolarHBondContact O-N 3.26Å; S213-S215 VanDerWaalsContact O-N 3.14Å; S213-S215 PolarHBondContact OG-OG 2.93Å; S215-L217 VanDerWaalsContact C-N 3.29Å
216D95.9Very high96.3Very high107 Ų10781.4 Ų81.457%0.57247%0.467SS*.G310 helixtrans-90.82.6-176.3-53.8-22000112S213 W214 S218S213-D216 WeakPolarHBondContact CB-OD2 3.34Å; S213-D216 WeakPolarHBondContact O-CB 3.35Å; S213-D216 PolarHBondContact O-N 3.4Å; S213-D216 VanDerWaalsContact OG-CG 3.32Å; S213-D216 PolarHBondContact OG-OD2 2.96Å; W214-D216 PolarHBondContact O-N 2.72Å; D216-S218 PolarHBondContact O-N 3.12Å
217L97.1Very high96.5Very high59 Ų5977.3 Ų77.331%0.30945%0.448SS..  trans-65.3121176.2-173.768.5000110.2W214 S215 L222 L272 F278W214-L217 WeakPolarHBondContact O-CB 3.39Å; W214-L217 PolarHBondContact O-N 3.16Å; S215-L217 VanDerWaalsContact C-N 3.29Å; L217-L222 HydrophobicContact CD1-CD1 3.99Å; L217-L222 HydrophobicContact CD1-CD2 4.2Å; L217-L222 HydrophobicContact CD1-CG 4.24Å; L217-L222 HydrophobicContact CD2-CD1 4.24Å; L217-L222 HydrophobicContact CG-CD1 4.08Å; L217-L272 HydrophobicContact CD1-CD2 3.88Å; L217-L272 HydrophobicContact CD2-CD2 4.49Å; L217-F278 HydrophobicContact CB-CE2 3.91Å; L217-F278 HydrophobicContact CB-CZ 3.97Å; L217-F278 HydrophobicContact CD1-CD1 3.82Å; L217-F278 HydrophobicContact CD1-CD2 4.24Å; L217-F278 HydrophobicContact CD1-CE1 3.66Å; L217-F278 HydrophobicContact CD1-CE2 4.07Å; L217-F278 HydrophobicContact CD1-CG 4.13Å; L217-F278 HydrophobicContact CD1-CZ 3.79Å; L217-F278 HydrophobicContact CG-CZ 4.4Å
218S98.2Very high96.7Very high42 Ų4271.6 Ų71.629%0.29441%0.413SS..  trans-107.3116.6-176.1174.30000110.9D216 L220 E221 L222 Y282D216-S218 PolarHBondContact O-N 3.12Å; S218-L220 PolarHBondContact O-N 3.07Å; S218-E221 PolarHBondContact O-N 3.19Å; S218-E221 PolarHBondContact OG-N 3.16Å; S218-L222 WeakPolarHBondContact O-CG 3.47Å; S218-L222 PolarHBondContact O-N 2.81Å; S218-Y282 PolarHBondContact N-OH 2.89Å
219A98Very high97Very high79 Ų7966.5 Ų66.565%0.65338%0.382SS*.Hα-helixtrans-60.1-33.5175.700000112.7L223A219-L223 WeakPolarHBondContact O-CB 3.44Å; A219-L223 PolarHBondContact O-N 3.49Å
220L98.3Very high97.2Very high102 Ų10262 Ų6253%0.53434%0.344SS..Hα-helixtrans-68.7-41.6177.5179.961.8000111.5S218 L223 K224S218-L220 PolarHBondContact O-N 3.07Å; L220-L223 PolarHBondContact O-N 3.07Å; L220-K224 WeakPolarHBondContact O-CG 3.33Å; L220-K224 PolarHBondContact O-N 3.08Å
221E98.4Very high97.5Very high58 Ų5858.9 Ų58.927%0.27132%0.324SS..Hα-helixtrans-69.1-37.3176.8-64.2-54.3134.700111.2S218 L223 K224 S225 Y282S218-E221 PolarHBondContact O-N 3.19Å; S218-E221 PolarHBondContact OG-N 3.16Å; E221-L223 VanDerWaalsContact C-N 3.32Å; E221-L223 PolarHBondContact O-N 2.72Å; E221-K224 PolarHBondContact O-N 3.42Å; E221-K224 IonicContact OE1-NZ 2.86Å; E221-K224 PolarHBondContact OE1-NZ 2.99Å; E221-K224 IonicContact OE2-NZ 2.94Å; E221-S225 PolarHBondContact O-N 3.06Å; E221-S225 PolarHBondContact O-OG 3.39Å; E221-Y282 HydrophobicContact CB-CD1 3.67Å; E221-Y282 HydrophobicContact CB-CD2 3.83Å; E221-Y282 HydrophobicContact CB-CE1 3.59Å; E221-Y282 HydrophobicContact CB-CE2 3.76Å; E221-Y282 HydrophobicContact CB-CG 3.8Å; E221-Y282 HydrophobicContact CG-CD2 4.27Å; E221-Y282 HydrophobicContact CG-CE2 4.17Å
222L98.4Very high97.8Very high33 Ų3351.8 Ų51.817%0.17329%0.286CS..Hα-helixtrans-59.4-41.4170.1-69175.2000112.1L217 S218 S225 I268 L272 I281 Y282L217-L222 HydrophobicContact CD1-CD1 3.99Å; L217-L222 HydrophobicContact CD1-CD2 4.2Å; L217-L222 HydrophobicContact CD1-CG 4.24Å; L217-L222 HydrophobicContact CD2-CD1 4.24Å; L217-L222 HydrophobicContact CG-CD1 4.08Å; S218-L222 WeakPolarHBondContact O-CG 3.47Å; S218-L222 PolarHBondContact O-N 2.81Å; L222-S225 VanDerWaalsContact O-CB 3.27Å; L222-S225 WeakPolarHBondContact O-CB 3.46Å; L222-S225 PolarHBondContact O-N 3.29Å; L222-I268 HydrophobicContact CD2-CG2 3.67Å; L222-L272 HydrophobicContact CD1-CD1 4.38Å; L222-L272 HydrophobicContact CD2-CD1 4.18Å; L222-L272 HydrophobicContact CD2-CD2 4.49Å; L222-I281 HydrophobicContact CD2-CG2 4.08Å; L222-Y282 HydrophobicContact CD2-CD1 4.46Å; L222-Y282 HydrophobicContact CD2-CE1 3.87Å; L222-Y282 HydrophobicContact CG-CE1 4.1Å
223L98.4Very high98Very high115 Ų11550.4 Ų50.460%0.60228%0.278SS*.Hα-helixtrans-65.8-41.3176.8-172.964.5000111.7A219 L220 E221 S225 I226 P227A219-L223 WeakPolarHBondContact O-CB 3.44Å; A219-L223 PolarHBondContact O-N 3.49Å; L220-L223 PolarHBondContact O-N 3.07Å; E221-L223 VanDerWaalsContact C-N 3.32Å; E221-L223 PolarHBondContact O-N 2.72Å; L223-S225 VanDerWaalsContact C-N 3.26Å; L223-S225 PolarHBondContact O-N 2.88Å; L223-I226 HydrophobicContact CD1-CD1 4.11Å; L223-I226 PolarHBondContact O-N 3.04Å; L223-P227 WeakPolarHBondContact O-CD 3.28Å
224K98.4Very high98.2Very high82 Ų8248 Ų4836%0.35726%0.262SS..Hα-helixtrans-64.8-29.9173.2-70.7174.1-173.8168.60112.5L220 E221 I226 P227 V228L220-K224 WeakPolarHBondContact O-CG 3.33Å; L220-K224 PolarHBondContact O-N 3.08Å; E221-K224 PolarHBondContact O-N 3.42Å; E221-K224 IonicContact OE1-NZ 2.86Å; E221-K224 PolarHBondContact OE1-NZ 2.99Å; E221-K224 IonicContact OE2-NZ 2.94Å; K224-I226 PolarHBondContact O-N 3.26Å; K224-P227 WeakPolarHBondContact O-CD 3.3Å; K224-P227 VanDerWaalsContact O-CG 3.24Å; K224-P227 WeakPolarHBondContact O-CG 3.4Å; K224-V228 WeakPolarHBondContact O-CG2 3.4Å; K224-V228 PolarHBondContact O-N 2.7Å
225S98.6Very high98.3Very high0 Ų041.6 Ų41.60%024%0.239CC..Hα-helixtrans-62-24.2179.1-53.30000112.4E221 L222 L223 G229 I268 I281 Y282E221-S225 PolarHBondContact O-N 3.06Å; E221-S225 PolarHBondContact O-OG 3.39Å; L222-S225 VanDerWaalsContact O-CB 3.27Å; L222-S225 WeakPolarHBondContact O-CB 3.46Å; L222-S225 PolarHBondContact O-N 3.29Å; L223-S225 VanDerWaalsContact C-N 3.26Å; L223-S225 PolarHBondContact O-N 2.88Å; S225-G229 PolarHBondContact O-N 3.41Å; S225-I268 VanDerWaalsContact CB-CD1 3.5Å; S225-I281 PolarHBondContact OG-O 3.18Å; S225-Y282 VanDerWaalsContact OG-CA 3.32Å; S225-Y282 WeakPolarHBondContact OG-CA 3.2Å
226I98.9Very high98.4Very high32 Ų3236.7 Ų36.716%0.16421%0.205CC..Hα-helixtrans-63.4-60.7179-58.6174.8000111.2L223 K224 V228 G229 V230 A261 S264 L265 I268L223-I226 HydrophobicContact CD1-CD1 4.11Å; L223-I226 PolarHBondContact O-N 3.04Å; K224-I226 PolarHBondContact O-N 3.26Å; I226-V228 VanDerWaalsContact C-N 3.33Å; I226-V228 PolarHBondContact O-N 3.26Å; I226-G229 PolarHBondContact O-N 3.06Å; I226-V230 PolarHBondContact O-N 3.22Å; I226-A261 HydrophobicContact CG2-CB 4.32Å; I226-S264 WeakPolarHBondContact O-CB 3.27Å; I226-S264 PolarHBondContact O-OG 3.43Å; I226-L265 HydrophobicContact CD1-CD1 4.09Å; I226-L265 HydrophobicContact CG1-CD1 4.4Å; I226-I268 HydrophobicContact CG1-CD1 3.72Å
227P98.8Very high98.5Very high27 Ų2734.3 Ų34.318%0.17519%0.192CC..Hα-helixtrans-64.4-35.8175.424.5-33.9000112.1L223 K224 G229 V230 G231 G242 L246L223-P227 WeakPolarHBondContact O-CD 3.28Å; K224-P227 WeakPolarHBondContact O-CD 3.3Å; K224-P227 VanDerWaalsContact O-CG 3.24Å; K224-P227 WeakPolarHBondContact O-CG 3.4Å; P227-G229 VanDerWaalsContact C-N 3.33Å; P227-G229 PolarHBondContact O-N 2.84Å; P227-V230 CarbonylContact O-C 3.47Å; P227-V230 WeakPolarHBondContact O-CA 3.3Å; P227-V230 WeakPolarHBondContact O-CB 3.38Å; P227-V230 PolarHBondContact O-N 2.9Å; P227-G231 PolarHBondContact O-N 3.19Å; P227-G242 WeakPolarHBondContact O-CA 3.43Å; P227-L246 HydrophobicContact CB-CD1 4.31Å
228V98.9Very high98.6Very high7 Ų733.5 Ų33.54%0.04219%0.188CC..Hα-helixtrans-61.2-41.7177.11780000111.3K224 I226 V230 G231 Q232 D237 P239 F283K224-V228 WeakPolarHBondContact O-CG2 3.4Å; K224-V228 PolarHBondContact O-N 2.7Å; I226-V228 VanDerWaalsContact C-N 3.33Å; I226-V228 PolarHBondContact O-N 3.26Å; V228-V230 PolarHBondContact O-N 2.82Å; V228-G231 CarbonylContact O-C 3.03Å; V228-G231 WeakPolarHBondContact O-CA 3.43Å; V228-G231 PolarHBondContact O-N 3.33Å; V228-Q232 HydrophobicContact CG1-CG 4.48Å; V228-Q232 WeakPolarHBondContact O-CG 3.43Å; V228-Q232 PolarHBondContact O-N 3.07Å; V228-D237 WeakPolarHBondContact CG1-O 3.46Å; V228-P239 HydrophobicContact CG2-CB 3.76Å; V228-P239 HydrophobicContact CG2-CG 4.49Å; V228-F283 WeakPolarHBondContact CG1-O 3.36Å
229G98.9Very high98.6Very high0 Ų033.8 Ų33.80%019%0.189CC..Hα-helixtrans-60.2-32.6173.300000113.2S225 I226 P227 F288S225-G229 PolarHBondContact O-N 3.41Å; I226-G229 PolarHBondContact O-N 3.06Å; P227-G229 VanDerWaalsContact C-N 3.33Å; P227-G229 PolarHBondContact O-N 2.84Å; G229-F288 WeakPolarHBondContact O-CA 3.49Å; G229-F288 WeakPolarHBondContact O-CB 3.44Å; G229-F288 PolarHBondContact O-N 3.39Å
230V98.9Very high98.7Very high0 Ų039.5 Ų39.50%019%0.194CC..Hα-helixtrans-74.7-37.1172-179.10000111.3I226 P227 V228 Q232 I233 F245 L246 I249 A260I226-V230 PolarHBondContact O-N 3.22Å; P227-V230 CarbonylContact O-C 3.47Å; P227-V230 WeakPolarHBondContact O-CA 3.3Å; P227-V230 WeakPolarHBondContact O-CB 3.38Å; P227-V230 PolarHBondContact O-N 2.9Å; V228-V230 PolarHBondContact O-N 2.82Å; V230-Q232 VanDerWaalsContact C-N 3.3Å; V230-Q232 PolarHBondContact O-N 3.41Å; V230-I233 HydrophobicContact CG1-CD1 4.18Å; V230-I233 VanDerWaalsContact O-CB 3.28Å; V230-I233 WeakPolarHBondContact O-CB 3.25Å; V230-I233 VanDerWaalsContact O-CG1 3.3Å; V230-I233 WeakPolarHBondContact O-CG1 3.47Å; V230-I233 PolarHBondContact O-N 2.9Å; V230-F245 HydrophobicContact CG1-CB 4.19Å; V230-L246 HydrophobicContact CB-CG 4.34Å; V230-L246 HydrophobicContact CG1-CD2 4.25Å; V230-L246 HydrophobicContact CG1-CG 4.1Å; V230-L246 HydrophobicContact CG2-CD1 4.43Å; V230-L246 HydrophobicContact CG2-CD2 4.01Å; V230-L246 HydrophobicContact CG2-CG 4.18Å; V230-I249 HydrophobicContact CG1-CD1 4.46Å; V230-A260 HydrophobicContact CG2-CB 4.5Å
231G98.8Very high98.7Very high0 Ų034.6 Ų34.60%017%0.168CC..Hα-helixtrans-57.4-42172.800000112.7P227 V228 I233 Y234 C236P227-G231 PolarHBondContact O-N 3.19Å; V228-G231 CarbonylContact O-C 3.03Å; V228-G231 WeakPolarHBondContact O-CA 3.43Å; V228-G231 PolarHBondContact O-N 3.33Å; G231-I233 PolarHBondContact O-N 2.95Å; G231-Y234 PolarHBondContact O-N 2.98Å; G231-C236 CarbonylContact C-O 3.03Å; G231-C236 WeakPolarHBondContact CA-O 3.21Å; G231-C236 WeakPolarHBondContact O-CB 3.19Å; G231-C236 PolarHBondContact O-N 3.05Å; G231-C236 VanDerWaalsContact O-N 3.08Å
232Q98.9Very high98.7Very high18 Ų1831.9 Ų31.98%0.08416%0.155CC..G310 helixtrans-65.2-10.3-179.6-74.1-67.5500114V228 V230 Y234 G235 C236 F283 F288V228-Q232 HydrophobicContact CG1-CG 4.48Å; V228-Q232 WeakPolarHBondContact O-CG 3.43Å; V228-Q232 PolarHBondContact O-N 3.07Å; V230-Q232 VanDerWaalsContact C-N 3.3Å; V230-Q232 PolarHBondContact O-N 3.41Å; Q232-Y234 PolarHBondContact O-N 3.43Å; Q232-G235 PolarHBondContact O-N 2.96Å; Q232-G235 VanDerWaalsContact OE1-C 3.3Å; Q232-G235 VanDerWaalsContact OE1-CA 3.28Å; Q232-C236 PolarHBondContact N-O 2.65Å; Q232-F283 VanDerWaalsContact CG-O 3.27Å; Q232-F283 WeakPolarHBondContact CG-O 3.35Å; Q232-F283 PolarHBondContact NE2-O 3.42Å; Q232-F288 HydrophobicContact CB-CB 3.71Å; Q232-F288 HydrophobicContact CB-CD1 3.78Å; Q232-F288 HydrophobicContact CB-CG 3.94Å
233I98.9Very high98.7Very high4 Ų432 Ų322%0.02116%0.164CC..G310 helixtrans-56.3-35.7167.4-65.5175.9000110.8V69 V70 L128 V230 G231 F288 L292V69-I233 HydrophobicContact CG1-CG2 3.68Å; V70-I233 HydrophobicContact CG1-CD1 4.02Å; V70-I233 HydrophobicContact CG1-CG2 3.87Å; L128-I233 VanDerWaalsContact CD2-O 3.32Å; L128-I233 WeakPolarHBondContact CD2-O 3.25Å; V230-I233 HydrophobicContact CG1-CD1 4.18Å; V230-I233 VanDerWaalsContact O-CB 3.28Å; V230-I233 WeakPolarHBondContact O-CB 3.25Å; V230-I233 VanDerWaalsContact O-CG1 3.3Å; V230-I233 WeakPolarHBondContact O-CG1 3.47Å; V230-I233 PolarHBondContact O-N 2.9Å; G231-I233 PolarHBondContact O-N 2.95Å; I233-F288 HydrophobicContact CG1-CB 3.94Å; I233-L292 HydrophobicContact CD1-CD2 4.02Å; I233-L292 HydrophobicContact CD1-CG 4Å; I233-L292 HydrophobicContact CG1-CD1 4.45Å; I233-L292 HydrophobicContact CG1-CD2 4.39Å; I233-L292 HydrophobicContact CG1-CG 4.04Å; I233-L292 HydrophobicContact CG2-CD1 4.17Å; I233-L292 HydrophobicContact CG2-CD2 3.9Å; I233-L292 HydrophobicContact CG2-CG 4.18Å
234Y98.8Very high98.7Very high1 Ų128.8 Ų28.80%0.00415%0.147CC..G310 helixtrans-104.917.9172.9-63.2-102.7000112.1I66 V69 V70 I81 L85 T127 L128 V131 G231 Q232 C236 F245I66-Y234 PolarHBondContact O-OH 3.1Å; V69-Y234 HydrophobicContact CB-CE1 3.69Å; V69-Y234 HydrophobicContact CB-CE2 4.26Å; V69-Y234 VanDerWaalsContact CB-CZ 3.49Å; V69-Y234 WeakPolarHBondContact CB-OH 3.45Å; V69-Y234 HydrophobicContact CG1-CD1 4.21Å; V69-Y234 HydrophobicContact CG1-CD2 4.32Å; V69-Y234 HydrophobicContact CG1-CE1 3.71Å; V69-Y234 HydrophobicContact CG1-CE2 3.83Å; V69-Y234 HydrophobicContact CG2-CD1 4.46Å; V69-Y234 HydrophobicContact CG2-CE1 3.63Å; V70-Y234 HydrophobicContact CG1-CE2 4.04Å; I81-Y234 HydrophobicContact CG2-CD1 4.47Å; I81-Y234 HydrophobicContact CG2-CE1 3.79Å; I81-Y234 HydrophobicContact CG2-CE2 4.05Å; L85-Y234 HydrophobicContact CD2-CD1 4.41Å; L85-Y234 HydrophobicContact CD2-CG 4.44Å; T127-Y234 HydrophobicContact CG2-CE1 4.37Å; L128-Y234 HydrophobicContact CD2-CD1 4.29Å; V131-Y234 WeakPolarHBondContact CG1-O 3.4Å; G231-Y234 PolarHBondContact O-N 2.98Å; Q232-Y234 PolarHBondContact O-N 3.43Å; Y234-C236 VanDerWaalsContact C-N 3.32Å; Y234-C236 PolarHBondContact O-N 2.97Å; Y234-F245 AromaticContact CD2-CD2 3.81Å; Y234-F245 HydrophobicContact CD2-CD2 3.81Å; Y234-F245 AromaticContact CD2-CE2 3.43Å; Y234-F245 HydrophobicContact CD2-CE2 3.43Å; Y234-F245 VanDerWaalsContact CD2-CE2 3.43Å; Y234-F245 AromaticContact CD2-CZ 3.99Å; Y234-F245 HydrophobicContact CD2-CZ 3.99Å; Y234-F245 HydrophobicContact CE2-CD2 4.23Å; Y234-F245 HydrophobicContact CE2-CE2 4.17Å; Y234-F245 AromaticContact CG-CE2 3.95Å; Y234-F245 HydrophobicContact CG-CE2 3.95Å; Y234-F245 HydrophobicContact CG-CZ 4.23Å
235G98.5Very high98.8Very high5 Ų525 Ų255%0.05213%0.131CC..THydrogen-bonded Turntrans69.323.9-176.800000114.8W92 Q232W92-G235 VanDerWaalsContact CZ3-O 3.27Å; W92-G235 WeakPolarHBondContact CZ3-O 3.18Å; Q232-G235 PolarHBondContact O-N 2.96Å; Q232-G235 VanDerWaalsContact OE1-C 3.3Å; Q232-G235 VanDerWaalsContact OE1-CA 3.28Å
236C98.8Very high98.8Very high0 Ų026.2 Ų26.20%014%0.138CC..  trans-101125.1-178.4-56.60000111.4Q88 G231 Q232 Y234 T241 F245Q88-C236 HydrophobicContact CB-CB 4.19Å; Q88-C236 HydrophobicContact CG-CB 3.84Å; G231-C236 CarbonylContact C-O 3.03Å; G231-C236 WeakPolarHBondContact CA-O 3.21Å; G231-C236 WeakPolarHBondContact O-CB 3.19Å; G231-C236 PolarHBondContact O-N 3.05Å; G231-C236 VanDerWaalsContact O-N 3.08Å; Q232-C236 PolarHBondContact N-O 2.65Å; Y234-C236 VanDerWaalsContact C-N 3.32Å; Y234-C236 PolarHBondContact O-N 2.97Å; C236-T241 HydrophobicContact CB-CG2 3.64Å; C236-F245 HydrophobicContact CB-CE2 4.39Å
237D98.3Very high98.8Very high56 Ų5626.3 Ų26.330%0.29915%0.146SC..  trans-96.6-9.618062.8-48.7000113.9Q88 V228 P239 F283Q88-D237 PolarHBondContact NE2-OD1 2.96Å; Q88-D237 PolarHBondContact OE1-OD1 3.29Å; V228-D237 WeakPolarHBondContact CG1-O 3.46Å; D237-P239 WeakPolarHBondContact O-CD 3.44Å; D237-F283 HydrophobicContact CB-CD1 4.43Å; D237-F283 HydrophobicContact CB-CD2 3.89Å; D237-F283 HydrophobicContact CB-CE1 3.94Å; D237-F283 HydrophobicContact CB-CE2 3.34Å; D237-F283 HydrophobicContact CB-CG 4.4Å; D237-F283 HydrophobicContact CB-CZ 3.37Å; D237-F283 WeakPolarHBondContact OD2-CE2 3.31Å
238N98.6Very high98.8Very high42 Ų4225 Ų2523%0.22514%0.138CC..  trans-71.4121.7177.7-174-25000111.3W240 T241 G242N238-W240 PolarHBondContact O-N 3.43Å; N238-W240 WeakPolarHBondContact OD1-CB 3.27Å; N238-W240 VanDerWaalsContact OD1-CD1 3.24Å; N238-W240 PolarHBondContact OD1-N 3.11Å; N238-T241 WeakPolarHBondContact O-CB 3.38Å; N238-T241 PolarHBondContact O-N 3.25Å; N238-T241 VanDerWaalsContact O-N 3.11Å; N238-G242 PolarHBondContact O-N 3.5Å; N238-G242 VanDerWaalsContact O-N 3.13Å
239P98.5Very high98.8Very high48 Ų4824.7 Ų24.731%0.31214%0.136SC..Hα-helixtrans-61.4-30.1-179.323.8-34.2000113.2V228 D237 G242 G243V228-P239 HydrophobicContact CG2-CB 3.76Å; V228-P239 HydrophobicContact CG2-CG 4.49Å; D237-P239 WeakPolarHBondContact O-CD 3.44Å; P239-G242 PolarHBondContact O-N 3.05Å; P239-G243 PolarHBondContact O-N 3.04Å
240W98.8Very high98.7Very high199 Ų19929 Ų2975%0.75416%0.158SC*.Hα-helixtrans-68.3-41.2176.7-59.7106.7000111.5V87 N238 G242 G243 I244V87-W240 HydrophobicContact CG1-CB 4.46Å; N238-W240 PolarHBondContact O-N 3.43Å; N238-W240 WeakPolarHBondContact OD1-CB 3.27Å; N238-W240 VanDerWaalsContact OD1-CD1 3.24Å; N238-W240 PolarHBondContact OD1-N 3.11Å; W240-G242 VanDerWaalsContact C-N 3.35Å; W240-G243 PolarHBondContact O-N 2.94Å; W240-I244 VanDerWaalsContact O-CG1 3.31Å; W240-I244 WeakPolarHBondContact O-CG1 3.25Å; W240-I244 PolarHBondContact O-N 3.22Å
241T98.8Very high98.7Very high0 Ų030.7 Ų30.70%017%0.167CC..Hα-helixtrans-59.9-46.3173.7-65.90000110.9G84 Q88 C236 N238 G243 I244 F245G84-T241 WeakPolarHBondContact O-CG2 3.48Å; G84-T241 PolarHBondContact O-OG1 3.22Å; Q88-T241 HydrophobicContact CB-CG2 4.18Å; Q88-T241 PolarHBondContact N-OG1 3.26Å; C236-T241 HydrophobicContact CB-CG2 3.64Å; N238-T241 WeakPolarHBondContact O-CB 3.38Å; N238-T241 PolarHBondContact O-N 3.25Å; N238-T241 VanDerWaalsContact O-N 3.11Å; T241-G243 VanDerWaalsContact C-N 3.33Å; T241-G243 PolarHBondContact O-N 3.47Å; T241-I244 PolarHBondContact O-N 2.89Å; T241-F245 HydrophobicContact CG2-CD1 4.32Å; T241-F245 HydrophobicContact CG2-CD2 4.27Å; T241-F245 HydrophobicContact CG2-CE1 3.67Å; T241-F245 HydrophobicContact CG2-CE2 3.61Å; T241-F245 HydrophobicContact CG2-CZ 3.27Å; T241-F245 WeakPolarHBondContact O-CD1 3.46Å; T241-F245 WeakPolarHBondContact O-CG 3.48Å; T241-F245 PolarHBondContact O-N 3.26Å
242G98.8Very high98.7Very high0 Ų031 Ų310%017%0.169CC..Hα-helixtrans-58.7-41.2173.800000113.9P227 N238 P239 W240 F245 L246P227-G242 WeakPolarHBondContact O-CA 3.43Å; N238-G242 PolarHBondContact O-N 3.5Å; N238-G242 VanDerWaalsContact O-N 3.13Å; P239-G242 PolarHBondContact O-N 3.05Å; W240-G242 VanDerWaalsContact C-N 3.35Å; G242-F245 PolarHBondContact O-N 3.43Å; G242-L246 PolarHBondContact O-N 3.48Å
243G98.8Very high98.7Very high35 Ų3530.1 Ų30.136%0.36117%0.165SC..Hα-helixtrans-63.7-40.7173.600000113.2P239 W240 T241 L246 G247P239-G243 PolarHBondContact O-N 3.04Å; W240-G243 PolarHBondContact O-N 2.94Å; T241-G243 VanDerWaalsContact C-N 3.33Å; T241-G243 PolarHBondContact O-N 3.47Å; G243-L246 PolarHBondContact O-N 3.47Å; G243-G247 PolarHBondContact O-N 3.01Å
244I98.9Very high98.7Very high48 Ų4833.5 Ų33.525%0.24619%0.187CC..Hα-helixtrans-63.6-41.8174.6-69164.3000110.5L80 V87 W240 T241 G247 A248L80-I244 WeakPolarHBondContact O-CG2 3.29Å; V87-I244 HydrophobicContact CG2-CD1 4.11Å; W240-I244 VanDerWaalsContact O-CG1 3.31Å; W240-I244 WeakPolarHBondContact O-CG1 3.25Å; W240-I244 PolarHBondContact O-N 3.22Å; T241-I244 PolarHBondContact O-N 2.89Å; I244-G247 CarbonylContact O-C 3.34Å; I244-G247 WeakPolarHBondContact O-CA 3.27Å; I244-G247 PolarHBondContact O-N 3.32Å; I244-G247 VanDerWaalsContact O-N 3.16Å; I244-A248 PolarHBondContact O-N 3.2Å
245F98.9Very high98.7Very high2 Ų235.6 Ų35.61%0.00920%0.198CC..Hα-helixtrans-63.7-42.6176.5-65-7.8000111.9I81 L85 V230 Y234 C236 T241 G242 G247 A248 I249I81-F245 HydrophobicContact CB-CD1 4.28Å; I81-F245 HydrophobicContact CB-CE1 4.24Å; I81-F245 HydrophobicContact CG1-CD1 4.01Å; I81-F245 HydrophobicContact CG1-CE1 4.46Å; I81-F245 HydrophobicContact CG2-CD1 4.25Å; I81-F245 HydrophobicContact CG2-CE1 3.86Å; I81-F245 HydrophobicContact CG2-CZ 4.36Å; I81-F245 WeakPolarHBondContact O-CE1 3.48Å; L85-F245 HydrophobicContact CD2-CZ 4.1Å; L85-F245 HydrophobicContact CG-CZ 4.17Å; V230-F245 HydrophobicContact CG1-CB 4.19Å; Y234-F245 AromaticContact CD2-CD2 3.81Å; Y234-F245 HydrophobicContact CD2-CD2 3.81Å; Y234-F245 AromaticContact CD2-CE2 3.43Å; Y234-F245 HydrophobicContact CD2-CE2 3.43Å; Y234-F245 VanDerWaalsContact CD2-CE2 3.43Å; Y234-F245 AromaticContact CD2-CZ 3.99Å; Y234-F245 HydrophobicContact CD2-CZ 3.99Å; Y234-F245 HydrophobicContact CE2-CD2 4.23Å; Y234-F245 HydrophobicContact CE2-CE2 4.17Å; Y234-F245 AromaticContact CG-CE2 3.95Å; Y234-F245 HydrophobicContact CG-CE2 3.95Å; Y234-F245 HydrophobicContact CG-CZ 4.23Å; C236-F245 HydrophobicContact CB-CE2 4.39Å; T241-F245 HydrophobicContact CG2-CD1 4.32Å; T241-F245 HydrophobicContact CG2-CD2 4.27Å; T241-F245 HydrophobicContact CG2-CE1 3.67Å; T241-F245 HydrophobicContact CG2-CE2 3.61Å; T241-F245 HydrophobicContact CG2-CZ 3.27Å; T241-F245 WeakPolarHBondContact O-CD1 3.46Å; T241-F245 WeakPolarHBondContact O-CG 3.48Å; T241-F245 PolarHBondContact O-N 3.26Å; G242-F245 PolarHBondContact O-N 3.43Å; F245-G247 VanDerWaalsContact C-N 3.3Å; F245-G247 PolarHBondContact O-N 3.36Å; F245-A248 WeakPolarHBondContact O-CB 3.08Å; F245-A248 PolarHBondContact O-N 3.47Å; F245-A248 VanDerWaalsContact O-N 3.17Å; F245-I249 VanDerWaalsContact O-CG1 3.31Å; F245-I249 WeakPolarHBondContact O-CG1 3.36Å; F245-I249 PolarHBondContact O-N 2.83Å
246L98.9Very high98.7Very high27 Ų2735.4 Ų35.414%0.14120%0.196CC..Hα-helixtrans-58-43.5171-78.7170.4000111.5P227 V230 G242 G243 A248 I249 L250 C257 A260 A261P227-L246 HydrophobicContact CB-CD1 4.31Å; V230-L246 HydrophobicContact CB-CG 4.34Å; V230-L246 HydrophobicContact CG1-CD2 4.25Å; V230-L246 HydrophobicContact CG1-CG 4.1Å; V230-L246 HydrophobicContact CG2-CD1 4.43Å; V230-L246 HydrophobicContact CG2-CD2 4.01Å; V230-L246 HydrophobicContact CG2-CG 4.18Å; G242-L246 PolarHBondContact O-N 3.48Å; G243-L246 PolarHBondContact O-N 3.47Å; L246-A248 VanDerWaalsContact C-N 3.34Å; L246-A248 PolarHBondContact O-N 3.18Å; L246-I249 PolarHBondContact O-N 3.35Å; L246-L250 VanDerWaalsContact O-CB 3.25Å; L246-L250 WeakPolarHBondContact O-CB 3.23Å; L246-L250 PolarHBondContact O-N 2.95Å; L246-C257 PolarHBondContact O-SG 3.27Å; L246-A260 HydrophobicContact CD2-CB 3.93Å; L246-A261 HydrophobicContact CD2-CB 4.39Å
247G98.8Very high98.7Very high33 Ų3336.2 Ų36.234%0.3420%0.202SC..Hα-helixtrans-60.6-40.3174.100000113.4G243 I244 F245 L250 L251G243-G247 PolarHBondContact O-N 3.01Å; I244-G247 CarbonylContact O-C 3.34Å; I244-G247 WeakPolarHBondContact O-CA 3.27Å; I244-G247 PolarHBondContact O-N 3.32Å; I244-G247 VanDerWaalsContact O-N 3.16Å; F245-G247 VanDerWaalsContact C-N 3.3Å; F245-G247 PolarHBondContact O-N 3.36Å; G247-L250 PolarHBondContact O-N 2.91Å; G247-L251 PolarHBondContact O-N 3Å
248A98.8Very high98.7Very high0 Ų037.9 Ų37.90%021%0.21CC..Hα-helixtrans-65.2-40.6176.200000112.3S77 L80 I81 I244 F245 L246S77-A248 WeakPolarHBondContact CB-O 3.37Å; S77-A248 PolarHBondContact OG-O 2.93Å; L80-A248 HydrophobicContact CB-CB 3.71Å; L80-A248 HydrophobicContact CD1-CB 4.22Å; I81-A248 HydrophobicContact CD1-CB 4.15Å; I81-A248 HydrophobicContact CG1-CB 3.75Å; I244-A248 PolarHBondContact O-N 3.2Å; F245-A248 WeakPolarHBondContact O-CB 3.08Å; F245-A248 PolarHBondContact O-N 3.47Å; F245-A248 VanDerWaalsContact O-N 3.17Å; L246-A248 VanDerWaalsContact C-N 3.34Å; L246-A248 PolarHBondContact O-N 3.18Å
249I98.8Very high98.7Very high1 Ų136 Ų361%0.00520%0.2CC..Hα-helixtrans-68.2-44.7174.8-61.6164.7000110V70 V72 V230 F245 L246 L251 S252 S253 M256 C257 A260V70-I249 HydrophobicContact CB-CD1 4.12Å; V70-I249 HydrophobicContact CB-CG1 4.26Å; V70-I249 HydrophobicContact CG1-CD1 4.21Å; V70-I249 HydrophobicContact CG2-CD1 4.2Å; V70-I249 HydrophobicContact CG2-CG1 3.84Å; V72-I249 HydrophobicContact CG2-CG1 4.5Å; V230-I249 HydrophobicContact CG1-CD1 4.46Å; F245-I249 VanDerWaalsContact O-CG1 3.31Å; F245-I249 WeakPolarHBondContact O-CG1 3.36Å; F245-I249 PolarHBondContact O-N 2.83Å; L246-I249 PolarHBondContact O-N 3.35Å; I249-L251 VanDerWaalsContact C-N 3.29Å; I249-L251 PolarHBondContact O-N 2.86Å; I249-S252 PolarHBondContact O-N 3.23Å; I249-S253 PolarHBondContact O-N 3.29Å; I249-M256 HydrophobicContact CG2-CB 3.5Å; I249-M256 VanDerWaalsContact CG2-CB 3.5Å; I249-C257 HydrophobicContact CB-CB 4.37Å; I249-C257 HydrophobicContact CG2-CB 4Å; I249-C257 VanDerWaalsContact CG2-N 3.33Å; I249-A260 HydrophobicContact CD1-CB 4.16Å
250L98.8Very high98.8Very high90 Ų9033.8 Ų33.847%0.47119%0.185SC..Hα-helixtrans-57.5-41.1178.9177.560000112.3L246 G247 S252 P254 C257L246-L250 VanDerWaalsContact O-CB 3.25Å; L246-L250 WeakPolarHBondContact O-CB 3.23Å; L246-L250 PolarHBondContact O-N 2.95Å; G247-L250 PolarHBondContact O-N 2.91Å; L250-S252 VanDerWaalsContact C-N 3.25Å; L250-S252 PolarHBondContact O-N 3.26Å; L250-P254 HydrophobicContact CD1-CB 3.94Å; L250-P254 HydrophobicContact CD1-CG 4.09Å; L250-C257 HydrophobicContact CB-CB 3.92Å; L250-C257 HydrophobicContact CD1-CB 4.26Å
251L98.3Very high98.8Very high36 Ų3625.7 Ų25.719%0.18816%0.161CC..Hα-helixtrans-56.6-41.7175.9179.166.1000111.7L35 V38 T39 V76 L80 G247 I249L35-L251 HydrophobicContact CD1-CD1 4.37Å; V38-L251 HydrophobicContact CG2-CD1 3.83Å; T39-L251 WeakPolarHBondContact CA-O 3.34Å; T39-L251 WeakPolarHBondContact CG2-O 3.45Å; V76-L251 HydrophobicContact CB-CD2 3.97Å; V76-L251 HydrophobicContact CG1-CD2 3.51Å; L80-L251 HydrophobicContact CD1-CD2 3.94Å; G247-L251 PolarHBondContact O-N 3Å; I249-L251 VanDerWaalsContact C-N 3.29Å; I249-L251 PolarHBondContact O-N 2.86Å
252S98.4Very high98.8Very high6 Ų627.7 Ų27.74%0.04217%0.171CC..Hα-helixtrans-77.3-53.9178.6178.80000111.8G40 I249 L250G40-S252 WeakPolarHBondContact CA-O 3.43Å; G40-S252 PolarHBondContact N-O 3.23Å; G40-S252 PolarHBondContact O-OG 3.2Å; I249-S252 PolarHBondContact O-N 3.23Å; L250-S252 VanDerWaalsContact C-N 3.25Å; L250-S252 PolarHBondContact O-N 3.26Å
253S98.7Very high98.8Very high0 Ų027.7 Ų27.70%017%0.171CC..  trans-150.4114.9-176.5169.90000111.1I249 L255 M256 C257 E371I249-S253 PolarHBondContact O-N 3.29Å; S253-L255 PolarHBondContact O-N 3.5Å; S253-L255 PolarHBondContact OG-N 2.96Å; S253-M256 PolarHBondContact O-N 2.89Å; S253-M256 WeakPolarHBondContact OG-CG 3.28Å; S253-M256 PolarHBondContact OG-N 3.48Å; S253-M256 VanDerWaalsContact OG-N 3.16Å; S253-C257 PolarHBondContact O-N 3.24Å; S253-C257 VanDerWaalsContact O-N 3.11Å; S253-E371 WeakPolarHBondContact CB-OE2 3.25Å; S253-E371 VanDerWaalsContact OG-CD 3.24Å; S253-E371 PolarHBondContact OG-OE1 3.27Å; S253-E371 VanDerWaalsContact OG-OE1 3.05Å; S253-E371 PolarHBondContact OG-OE2 2.91Å
254P98.7Very high98.8Very high74 Ų7426 Ų2648%0.48115%0.154SC..Hα-helixtrans-56.8-35.5170.8-26.434.4000113.7L250 C257 L258 E371L250-P254 HydrophobicContact CD1-CB 3.94Å; L250-P254 HydrophobicContact CD1-CG 4.09Å; P254-C257 PolarHBondContact O-N 2.87Å; P254-L258 WeakPolarHBondContact O-CB 3.44Å; P254-L258 PolarHBondContact O-N 2.85Å; P254-E371 WeakPolarHBondContact CD-OE1 3.27Å
255L98.8Very high98.8Very high45 Ų4528 Ų2824%0.23616%0.164CC..Hα-helixtrans-67.9-38.1178.3-70.3177000112.6S253 H259 L304 P370 E371S253-L255 PolarHBondContact O-N 3.5Å; S253-L255 PolarHBondContact OG-N 2.96Å; L255-H259 PolarHBondContact O-N 2.77Å; L255-H259 VanDerWaalsContact O-N 3.17Å; L255-H259 PolarHBondContact O-ND1 2.91Å; L255-L304 HydrophobicContact CD1-CD2 3.76Å; L255-L304 HydrophobicContact CD2-CD2 3.92Å; L255-L304 HydrophobicContact CG-CD2 4.35Å; L255-P370 HydrophobicContact CB-CB 3.82Å; L255-P370 HydrophobicContact CB-CG 4.27Å; L255-P370 HydrophobicContact CD1-CB 3.86Å; L255-E371 WeakPolarHBondContact CB-OE1 3.37Å; L255-E371 HydrophobicContact CD1-CG 3.85Å; L255-E371 HydrophobicContact CG-CG 4.37Å; L255-E371 WeakPolarHBondContact CG-OE1 3.39Å; L255-E371 PolarHBondContact N-OE1 3.25Å
256M98.9Very high98.8Very high1 Ų129.4 Ų29.41%0.00517%0.172CC..Hα-helixtrans-64.8-43.9173.2-66.8175.769.900110.9V70 F71 V72 I249 S253 L258 H259 A260 I295 M300 P370V70-M256 WeakPolarHBondContact O-CE 3.43Å; F71-M256 HydrophobicContact CB-CE 3.93Å; V72-M256 HydrophobicContact CG2-CE 3.64Å; V72-M256 HydrophobicContact CG2-SD 4.26Å; I249-M256 HydrophobicContact CG2-CB 3.5Å; I249-M256 VanDerWaalsContact CG2-CB 3.5Å; S253-M256 PolarHBondContact O-N 2.89Å; S253-M256 WeakPolarHBondContact OG-CG 3.28Å; S253-M256 PolarHBondContact OG-N 3.48Å; S253-M256 VanDerWaalsContact OG-N 3.16Å; M256-L258 VanDerWaalsContact C-N 3.32Å; M256-L258 PolarHBondContact O-N 3.16Å; M256-H259 PolarHBondContact O-N 2.95Å; M256-A260 WeakPolarHBondContact O-CB 3.44Å; M256-A260 PolarHBondContact O-N 2.97Å; M256-I295 HydrophobicContact CB-CG2 4.07Å; M256-I295 HydrophobicContact CE-CG2 3.65Å; M256-I295 HydrophobicContact CG-CG2 4.1Å; M256-M300 HydrophobicContact CE-SD 4.45Å; M256-M300 HydrophobicContact SD-SD 4.39Å; M256-P370 VanDerWaalsContact CG-CD 3.46Å; M256-P370 HydrophobicContact CG-CG 3.53Å; M256-P370 HydrophobicContact SD-CG 4.43Å
257C98.9Very high98.8Very high18 Ų1828.1 Ų28.112%0.12217%0.165CC..Hα-helixtrans-61.6-41.7179-178.50000111.8L246 I249 L250 S253 P254 A260 A261L246-C257 PolarHBondContact O-SG 3.27Å; I249-C257 HydrophobicContact CB-CB 4.37Å; I249-C257 HydrophobicContact CG2-CB 4Å; I249-C257 VanDerWaalsContact CG2-N 3.33Å; L250-C257 HydrophobicContact CB-CB 3.92Å; L250-C257 HydrophobicContact CD1-CB 4.26Å; S253-C257 PolarHBondContact O-N 3.24Å; S253-C257 VanDerWaalsContact O-N 3.11Å; P254-C257 PolarHBondContact O-N 2.87Å; C257-A260 WeakPolarHBondContact O-CB 3.5Å; C257-A260 PolarHBondContact O-N 3.02Å; C257-A261 PolarHBondContact O-N 3.17Å; C257-A261 VanDerWaalsContact O-N 3.12Å
258L98.9Very high98.8Very high91 Ų9127 Ų2748%0.47615%0.151SC..Hα-helixtrans-59.6-48.9176177.963.5000111.2P254 M256 A260 A261 I262P254-L258 WeakPolarHBondContact O-CB 3.44Å; P254-L258 PolarHBondContact O-N 2.85Å; M256-L258 VanDerWaalsContact C-N 3.32Å; M256-L258 PolarHBondContact O-N 3.16Å; L258-A260 VanDerWaalsContact C-N 3.33Å; L258-A260 PolarHBondContact O-N 3.35Å; L258-A261 PolarHBondContact O-N 2.87Å; L258-I262 HydrophobicContact CD1-CD1 3.84Å; L258-I262 HydrophobicContact CD1-CG1 4.28Å; L258-I262 HydrophobicContact CD2-CD1 4.47Å; L258-I262 HydrophobicContact CG-CD1 3.78Å; L258-I262 VanDerWaalsContact O-CG1 3.3Å; L258-I262 WeakPolarHBondContact O-CG1 3.42Å; L258-I262 PolarHBondContact O-N 3.2Å
259H98.9Very high98.8Very high3 Ų329.2 Ų29.21%0.01417%0.17CC..Hα-helixtrans-69-31.4179.3-72.289.1000112.7L255 M256 I262 G263 C294 G298 H309L255-H259 PolarHBondContact O-N 2.77Å; L255-H259 VanDerWaalsContact O-N 3.17Å; L255-H259 PolarHBondContact O-ND1 2.91Å; M256-H259 PolarHBondContact O-N 2.95Å; H259-I262 PolarHBondContact O-N 2.67Å; H259-G263 PolarHBondContact O-N 3.38Å; H259-C294 HydrophobicContact CB-CB 4.41Å; H259-C294 WeakPolarHBondContact O-CB 3.32Å; H259-G298 PolarHBondContact CE1-O 3.34Å; H259-G298 VanDerWaalsContact CE1-O 3.26Å; H259-G298 PolarHBondContact ND1-O 2.99Å; H259-H309 AromaticContact CD2-ND1 3.85Å; H259-H309 AromaticContact CE1-ND1 3.91Å; H259-H309 AromaticContact NE2-CE1 3.72Å; H259-H309 AromaticContact NE2-ND1 3Å; H259-H309 PolarHBondContact NE2-ND1 3.16Å
260A98.9Very high98.8Very high0 Ų029.2 Ų29.20%017%0.17CC..Hα-helixtrans-58.9-48.3172.500000111.3V230 L246 I249 M256 C257 L258 S264 S291 I295V230-A260 HydrophobicContact CG2-CB 4.5Å; L246-A260 HydrophobicContact CD2-CB 3.93Å; I249-A260 HydrophobicContact CD1-CB 4.16Å; M256-A260 WeakPolarHBondContact O-CB 3.44Å; M256-A260 PolarHBondContact O-N 2.97Å; C257-A260 WeakPolarHBondContact O-CB 3.5Å; C257-A260 PolarHBondContact O-N 3.02Å; L258-A260 VanDerWaalsContact C-N 3.33Å; L258-A260 PolarHBondContact O-N 3.35Å; A260-S264 PolarHBondContact O-N 3.42Å; A260-S264 VanDerWaalsContact O-N 3.12Å; A260-S291 VanDerWaalsContact CA-OG 3.27Å; A260-S291 WeakPolarHBondContact CA-OG 3.45Å; A260-S291 WeakPolarHBondContact O-CB 3.12Å; A260-S291 PolarHBondContact O-OG 2.65Å; A260-I295 HydrophobicContact CB-CD1 3.6Å; A260-I295 HydrophobicContact CB-CG1 3.75Å
261A98.9Very high98.8Very high30 Ų3024.9 Ų24.925%0.24815%0.148CC..Hα-helixtrans-67.8-43.6178.700000112.3I226 L246 C257 L258 S264 L265I226-A261 HydrophobicContact CG2-CB 4.32Å; L246-A261 HydrophobicContact CD2-CB 4.39Å; C257-A261 PolarHBondContact O-N 3.17Å; C257-A261 VanDerWaalsContact O-N 3.12Å; L258-A261 PolarHBondContact O-N 2.87Å; A261-S264 PolarHBondContact O-N 3.38Å; A261-L265 WeakPolarHBondContact O-CB 3.48Å; A261-L265 PolarHBondContact O-N 2.86Å
262I98.9Very high98.8Very high41 Ų4125.1 Ų25.121%0.2115%0.149CC..Hα-helixtrans-62.5-45.3177.1-69.6171.8000111.1L258 H259 S264 L265 L266 L313L258-I262 HydrophobicContact CD1-CD1 3.84Å; L258-I262 HydrophobicContact CD1-CG1 4.28Å; L258-I262 HydrophobicContact CD2-CD1 4.47Å; L258-I262 HydrophobicContact CG-CD1 3.78Å; L258-I262 VanDerWaalsContact O-CG1 3.3Å; L258-I262 WeakPolarHBondContact O-CG1 3.42Å; L258-I262 PolarHBondContact O-N 3.2Å; H259-I262 PolarHBondContact O-N 2.67Å; I262-S264 VanDerWaalsContact C-N 3.34Å; I262-S264 PolarHBondContact O-N 3.48Å; I262-L265 WeakPolarHBondContact O-CB 3.36Å; I262-L265 PolarHBondContact O-N 2.67Å; I262-L266 HydrophobicContact CG2-CD1 4.04Å; I262-L266 HydrophobicContact CG2-CG 4.32Å; I262-L266 WeakPolarHBondContact O-CG 3.09Å; I262-L266 PolarHBondContact O-N 3.49Å; I262-L313 HydrophobicContact CG2-CD2 3.41Å; I262-L313 VanDerWaalsContact CG2-CD2 3.41Å
263G98.9Very high98.8Very high0 Ų028.2 Ų28.20%017%0.17CC..Hα-helixtrans-61.6-43.5178.800000111.7H259 L265 L266 G267 S290H259-G263 PolarHBondContact O-N 3.38Å; G263-L265 VanDerWaalsContact C-N 3.35Å; G263-L265 PolarHBondContact O-N 2.86Å; G263-L266 PolarHBondContact O-N 3.47Å; G263-G267 PolarHBondContact O-N 3.44Å; G263-S290 WeakPolarHBondContact O-CB 3.49Å; G263-S290 PolarHBondContact O-OG 3.05Å; G263-S290 VanDerWaalsContact O-OG 3.05Å
264S98.9Very high98.8Very high0 Ų032.6 Ų32.60%019%0.193CC..Hα-helixtrans-59.7-43.8174.7-172.30000112I226 A260 A261 I262 L266 G267 I268I226-S264 WeakPolarHBondContact O-CB 3.27Å; I226-S264 PolarHBondContact O-OG 3.43Å; A260-S264 PolarHBondContact O-N 3.42Å; A260-S264 VanDerWaalsContact O-N 3.12Å; A261-S264 PolarHBondContact O-N 3.38Å; I262-S264 VanDerWaalsContact C-N 3.34Å; I262-S264 PolarHBondContact O-N 3.48Å; S264-L266 PolarHBondContact O-N 3.5Å; S264-G267 PolarHBondContact O-N 3.45Å; S264-I268 PolarHBondContact O-N 3.42Å; S264-I268 VanDerWaalsContact O-N 3.11Å
265L98.9Very high98.8Very high89 Ų8931.4 Ų31.447%0.46619%0.187SC..Hα-helixtrans-62.2-41.2174.7179.663.1000113.2I226 A261 I262 G263 G267 I268 A269I226-L265 HydrophobicContact CD1-CD1 4.09Å; I226-L265 HydrophobicContact CG1-CD1 4.4Å; A261-L265 WeakPolarHBondContact O-CB 3.48Å; A261-L265 PolarHBondContact O-N 2.86Å; I262-L265 WeakPolarHBondContact O-CB 3.36Å; I262-L265 PolarHBondContact O-N 2.67Å; G263-L265 VanDerWaalsContact C-N 3.35Å; G263-L265 PolarHBondContact O-N 2.86Å; L265-G267 VanDerWaalsContact C-N 3.29Å; L265-G267 PolarHBondContact O-N 3.1Å; L265-I268 WeakPolarHBondContact O-CB 3.24Å; L265-I268 PolarHBondContact O-N 2.86Å; L265-A269 PolarHBondContact O-N 3.42Å
266L98.9Very high98.7Very high32 Ų3229.6 Ų29.617%0.16818%0.178CC..Hα-helixtrans-66.8-32.9176.1-71.4176.2000111.9I262 G263 S264 A269 A270 L313 A316 L317I262-L266 HydrophobicContact CG2-CD1 4.04Å; I262-L266 HydrophobicContact CG2-CG 4.32Å; I262-L266 WeakPolarHBondContact O-CG 3.09Å; I262-L266 PolarHBondContact O-N 3.49Å; G263-L266 PolarHBondContact O-N 3.47Å; S264-L266 PolarHBondContact O-N 3.5Å; L266-A269 PolarHBondContact O-N 3.07Å; L266-A270 WeakPolarHBondContact O-CB 3.27Å; L266-A270 PolarHBondContact O-N 2.81Å; L266-L313 HydrophobicContact CD1-CB 3.91Å; L266-L313 HydrophobicContact CD1-CD2 3.83Å; L266-L313 HydrophobicContact CD1-CG 4.43Å; L266-A316 HydrophobicContact CB-CB 4.43Å; L266-A316 HydrophobicContact CD1-CB 3.87Å; L266-L317 HydrophobicContact CB-CD2 4Å; L266-L317 HydrophobicContact CB-CG 4.19Å; L266-L317 HydrophobicContact CD1-CG 4.38Å; L266-L317 HydrophobicContact CD2-CD1 4.32Å; L266-L317 HydrophobicContact CD2-CD2 4.11Å; L266-L317 HydrophobicContact CD2-CG 4.11Å; L266-L317 HydrophobicContact CG-CG 4.47Å; L266-L317 WeakPolarHBondContact O-CD2 3.44Å
267G98.9Very high98.7Very high0 Ų031.2 Ų31.20%019%0.189CC..Hα-helixtrans-57.9-49.116900000112.6G263 S264 L265 A269 A270 G271 W286 S290G263-G267 PolarHBondContact O-N 3.44Å; S264-G267 PolarHBondContact O-N 3.45Å; L265-G267 VanDerWaalsContact C-N 3.29Å; L265-G267 PolarHBondContact O-N 3.1Å; G267-A269 VanDerWaalsContact C-N 3.33Å; G267-A269 PolarHBondContact O-N 3.35Å; G267-A270 PolarHBondContact O-N 2.98Å; G267-G271 PolarHBondContact O-N 3.04Å; G267-W286 WeakPolarHBondContact CA-O 3.5Å; G267-W286 WeakPolarHBondContact O-CB 3.22Å; G267-S290 WeakPolarHBondContact CA-OG 3.27Å
268I98.9Very high98.6Very high9 Ų931.6 Ų31.65%0.04619%0.188CC..Hα-helixtrans-56.6-48.1174.8-64.9164.5000110.8L222 S225 I226 S264 L265 A270 G271 L272 I281L222-I268 HydrophobicContact CD2-CG2 3.67Å; S225-I268 VanDerWaalsContact CB-CD1 3.5Å; I226-I268 HydrophobicContact CG1-CD1 3.72Å; S264-I268 PolarHBondContact O-N 3.42Å; S264-I268 VanDerWaalsContact O-N 3.11Å; L265-I268 WeakPolarHBondContact O-CB 3.24Å; L265-I268 PolarHBondContact O-N 2.86Å; I268-A270 VanDerWaalsContact C-N 3.33Å; I268-A270 PolarHBondContact O-N 3.48Å; I268-G271 PolarHBondContact O-N 2.99Å; I268-L272 HydrophobicContact CG2-CD1 4.15Å; I268-L272 WeakPolarHBondContact O-CG 3.2Å; I268-L272 PolarHBondContact O-N 3.49Å; I268-I281 HydrophobicContact CB-CG2 4.26Å; I268-I281 HydrophobicContact CG1-CG2 4.1Å; I268-I281 HydrophobicContact CG2-CG2 3.84Å
269A98.8Very high98.6Very high48 Ų4834.7 Ų34.740%0.39720%0.201SC..Hα-helixtrans-60.7-41.6179.100000112.2L265 L266 G267 L272 S273L265-A269 PolarHBondContact O-N 3.42Å; L266-A269 PolarHBondContact O-N 3.07Å; G267-A269 VanDerWaalsContact C-N 3.33Å; G267-A269 PolarHBondContact O-N 3.35Å; A269-L272 PolarHBondContact O-N 2.93Å; A269-S273 WeakPolarHBondContact O-CB 3.29Å; A269-S273 PolarHBondContact O-N 3.47Å
270A98.8Very high98.5Very high0 Ų037.3 Ų37.30%022%0.215CC..Hα-helixtrans-62.7-43.1174.300000111.8L266 G267 I268 L272 S273 L274 W286 L317 A320 Y321L266-A270 WeakPolarHBondContact O-CB 3.27Å; L266-A270 PolarHBondContact O-N 2.81Å; G267-A270 PolarHBondContact O-N 2.98Å; I268-A270 VanDerWaalsContact C-N 3.33Å; I268-A270 PolarHBondContact O-N 3.48Å; A270-L272 PolarHBondContact O-N 3.49Å; A270-S273 PolarHBondContact O-N 3.45Å; A270-S273 PolarHBondContact O-OG 2.87Å; A270-L274 PolarHBondContact O-N 3.43Å; A270-L274 VanDerWaalsContact O-N 3.16Å; A270-W286 HydrophobicContact CB-CE3 4.23Å; A270-W286 HydrophobicContact CB-CZ3 4.25Å; A270-L317 HydrophobicContact CB-CD2 4.23Å; A270-A320 HydrophobicContact CB-CB 3.59Å; A270-Y321 HydrophobicContact CB-CD1 4.34Å; A270-Y321 HydrophobicContact CB-CE1 3.93Å
271G98.6Very high98.5Very high0 Ų037.4 Ų37.40%022%0.215CC..Hα-helixtrans-59.3-45.8175.900000112.9G267 I268 S273 L274 S275 A276 W286G267-G271 PolarHBondContact O-N 3.04Å; I268-G271 PolarHBondContact O-N 2.99Å; G271-S273 VanDerWaalsContact C-N 3.35Å; G271-S273 PolarHBondContact O-N 3.31Å; G271-L274 PolarHBondContact O-N 3.23Å; G271-S275 PolarHBondContact O-N 2.95Å; G271-A276 VanDerWaalsContact O-CB 3.27Å; G271-A276 WeakPolarHBondContact O-CB 3.26Å; G271-A276 PolarHBondContact O-N 3.26Å; G271-W286 VanDerWaalsContact CA-CZ3 3.46Å
272L98.6Very high98.5Very high40 Ų4038.1 Ų38.121%0.20921%0.212CC..Hα-helixtrans-64.1-39.7175.6-67.4173.4000111.8W214 L217 L222 I268 A269 A270 L274 S275 F278 I281W214-L272 HydrophobicContact CZ3-CD2 4.5Å; L217-L272 HydrophobicContact CD1-CD2 3.88Å; L217-L272 HydrophobicContact CD2-CD2 4.49Å; L222-L272 HydrophobicContact CD1-CD1 4.38Å; L222-L272 HydrophobicContact CD2-CD1 4.18Å; L222-L272 HydrophobicContact CD2-CD2 4.49Å; I268-L272 HydrophobicContact CG2-CD1 4.15Å; I268-L272 WeakPolarHBondContact O-CG 3.2Å; I268-L272 PolarHBondContact O-N 3.49Å; A269-L272 PolarHBondContact O-N 2.93Å; A270-L272 PolarHBondContact O-N 3.49Å; L272-L274 PolarHBondContact O-N 2.97Å; L272-S275 PolarHBondContact O-N 3.38Å; L272-F278 HydrophobicContact CD2-CD1 4.33Å; L272-F278 HydrophobicContact CD2-CE1 4.09Å; L272-I281 HydrophobicContact CD2-CD1 3.7Å; L272-I281 HydrophobicContact CG-CD1 4Å
273S98.7Very high98.5Very high72 Ų7240.7 Ų40.750%0.50322%0.222SC..Hα-helixtrans-64-28.4179.576.30000113.8A269 A270 G271 Y321A269-S273 WeakPolarHBondContact O-CB 3.29Å; A269-S273 PolarHBondContact O-N 3.47Å; A270-S273 PolarHBondContact O-N 3.45Å; A270-S273 PolarHBondContact O-OG 2.87Å; G271-S273 VanDerWaalsContact C-N 3.35Å; G271-S273 PolarHBondContact O-N 3.31Å; S273-Y321 PolarHBondContact OG-OH 2.6Å
274L98.3Very high98.5Very high92 Ų9240.8 Ų40.848%0.48222%0.223SC..THydrogen-bonded Turntrans-94.910.2174.5-70.4-178000113.4A270 G271 L272 A276 W286 Y321 V324A270-L274 PolarHBondContact O-N 3.43Å; A270-L274 VanDerWaalsContact O-N 3.16Å; G271-L274 PolarHBondContact O-N 3.23Å; L272-L274 PolarHBondContact O-N 2.97Å; L274-A276 PolarHBondContact O-N 3.26Å; L274-W286 HydrophobicContact CB-CH2 4.07Å; L274-W286 HydrophobicContact CD1-CH2 3.74Å; L274-W286 HydrophobicContact CD1-CZ3 4.13Å; L274-W286 HydrophobicContact CG-CH2 4.43Å; L274-Y321 HydrophobicContact CD1-CD1 3.54Å; L274-Y321 HydrophobicContact CD1-CE1 3.82Å; L274-Y321 HydrophobicContact CD2-CE1 4.43Å; L274-Y321 HydrophobicContact CG-CD1 4.12Å; L274-Y321 HydrophobicContact CG-CE1 3.85Å; L274-V324 HydrophobicContact CD1-CG1 3.83Å
275S97.8Very high98.5Very high48 Ų4844.3 Ų44.334%0.33624%0.241SC..THydrogen-bonded Turntrans51.746.1-177.2-170.40000111.5I212 G271 L272I212-S275 WeakPolarHBondContact CD1-O 3.35Å; I212-S275 VanDerWaalsContact CD1-OG 3.29Å; I212-S275 WeakPolarHBondContact CD1-OG 3.23Å; G271-S275 PolarHBondContact O-N 2.95Å; L272-S275 PolarHBondContact O-N 3.38Å
276A97.8Very high98.4Very high7 Ų741.2 Ų41.26%0.05822%0.223CC..  trans-68.2148.4176.500000110.8G271 L274 F278 I281 W286G271-A276 VanDerWaalsContact O-CB 3.27Å; G271-A276 WeakPolarHBondContact O-CB 3.26Å; G271-A276 PolarHBondContact O-N 3.26Å; L274-A276 PolarHBondContact O-N 3.26Å; A276-F278 PolarHBondContact O-N 3.14Å; A276-I281 HydrophobicContact CB-CD1 4.22Å; A276-I281 HydrophobicContact CB-CG1 4.26Å; A276-W286 HydrophobicContact CB-CH2 4.28Å; A276-W286 HydrophobicContact CB-CZ2 3.35Å
277P97.8Very high98.4Very high36 Ų3639.8 Ų39.823%0.23422%0.216CC..  trans-52.6130.1171.9-25.233.7000111P210 E279 N280 I281P210-P277 HydrophobicContact CB-CG 3.81Å; P210-P277 HydrophobicContact CG-CG 3.94Å; P277-E279 PolarHBondContact O-N 2.98Å; P277-N280 PolarHBondContact O-N 3.28Å; P277-I281 PolarHBondContact O-N 3.01Å
278F98.2Very high98.4Very high25 Ų2541 Ų4111%0.1122%0.222CC..Hα-helixtrans-60-33-174.1-60.5-27.5000112.7I212 S213 W214 L217 L272 A276 N280 I281 Y282I212-F278 HydrophobicContact CG2-CE1 4.01Å; I212-F278 HydrophobicContact CG2-CE2 4.08Å; I212-F278 HydrophobicContact CG2-CZ 3.65Å; S213-F278 WeakPolarHBondContact O-CE2 3.49Å; W214-F278 HydrophobicContact CD2-CZ 4.28Å; W214-F278 HydrophobicContact CE3-CE1 4.42Å; W214-F278 HydrophobicContact CE3-CZ 4.07Å; W214-F278 HydrophobicContact CZ3-CE1 4.42Å; L217-F278 HydrophobicContact CB-CE2 3.91Å; L217-F278 HydrophobicContact CB-CZ 3.97Å; L217-F278 HydrophobicContact CD1-CD1 3.82Å; L217-F278 HydrophobicContact CD1-CD2 4.24Å; L217-F278 HydrophobicContact CD1-CE1 3.66Å; L217-F278 HydrophobicContact CD1-CE2 4.07Å; L217-F278 HydrophobicContact CD1-CG 4.13Å; L217-F278 HydrophobicContact CD1-CZ 3.79Å; L217-F278 HydrophobicContact CG-CZ 4.4Å; L272-F278 HydrophobicContact CD2-CD1 4.33Å; L272-F278 HydrophobicContact CD2-CE1 4.09Å; A276-F278 PolarHBondContact O-N 3.14Å; F278-N280 VanDerWaalsContact C-N 3.3Å; F278-N280 PolarHBondContact O-N 3.28Å; F278-I281 HydrophobicContact CD1-CD1 4.45Å; F278-I281 WeakPolarHBondContact O-CA 3.21Å; F278-I281 WeakPolarHBondContact O-CB 3.32Å; F278-I281 PolarHBondContact O-N 2.8Å; F278-Y282 HydrophobicContact CB-CD2 4.29Å; F278-Y282 HydrophobicContact CB-CE1 4.27Å; F278-Y282 HydrophobicContact CB-CE2 3.75Å; F278-Y282 WeakPolarHBondContact O-CB 3.37Å; F278-Y282 WeakPolarHBondContact O-CD1 3.12Å; F278-Y282 WeakPolarHBondContact O-CD2 3.41Å; F278-Y282 PolarHBondContact O-N 3.29Å
279E97.7Very high98.4Very high157 Ų15741 Ų4173%0.73422%0.221SC*.Hα-helixtrans-56.2-42.6175.5-64.3178-173.800112.3P277 I281 Y282 F283P277-E279 PolarHBondContact O-N 2.98Å; E279-I281 VanDerWaalsContact C-N 3.29Å; E279-I281 PolarHBondContact O-N 3.33Å; E279-Y282 PolarHBondContact O-N 2.94Å; E279-F283 WeakPolarHBondContact O-CB 3.12Å; E279-F283 PolarHBondContact O-N 3.48Å
280N98.1Very high98.4Very high58 Ų5838.7 Ų38.731%0.3120%0.203SC..Hα-helixtrans-67-32.7178.1-67.4-21.9000112P277 F278 L285P277-N280 PolarHBondContact O-N 3.28Å; F278-N280 VanDerWaalsContact C-N 3.3Å; F278-N280 PolarHBondContact O-N 3.28Å; N280-L285 HydrophobicContact CB-CD1 4.29Å; N280-L285 WeakPolarHBondContact O-CB 3.24Å; N280-L285 PolarHBondContact O-N 3.25Å
281I98.6Very high98.4Very high1 Ų138.7 Ų38.71%0.00520%0.203CC..Hα-helixtrans-71.3-48.3175.3-58.3177.9000109.6L222 S225 I268 L272 A276 P277 F278 E279 F283 G284 W286L222-I281 HydrophobicContact CD2-CG2 4.08Å; S225-I281 PolarHBondContact OG-O 3.18Å; I268-I281 HydrophobicContact CB-CG2 4.26Å; I268-I281 HydrophobicContact CG1-CG2 4.1Å; I268-I281 HydrophobicContact CG2-CG2 3.84Å; L272-I281 HydrophobicContact CD2-CD1 3.7Å; L272-I281 HydrophobicContact CG-CD1 4Å; A276-I281 HydrophobicContact CB-CD1 4.22Å; A276-I281 HydrophobicContact CB-CG1 4.26Å; P277-I281 PolarHBondContact O-N 3.01Å; F278-I281 HydrophobicContact CD1-CD1 4.45Å; F278-I281 WeakPolarHBondContact O-CA 3.21Å; F278-I281 WeakPolarHBondContact O-CB 3.32Å; F278-I281 PolarHBondContact O-N 2.8Å; E279-I281 VanDerWaalsContact C-N 3.29Å; E279-I281 PolarHBondContact O-N 3.33Å; I281-F283 VanDerWaalsContact C-N 3.29Å; I281-F283 PolarHBondContact O-N 2.96Å; I281-G284 WeakPolarHBondContact O-CA 3.16Å; I281-G284 PolarHBondContact O-N 3.45Å; I281-W286 HydrophobicContact CG1-CG 4.47Å
282Y98.8Very high98.4Very high46 Ų4638.8 Ų38.818%0.1820%0.203CC..Hα-helixtrans-63.7-34.2-179.9-60.2-16000112.6S218 E221 L222 S225 F278 E279 G284S218-Y282 PolarHBondContact N-OH 2.89Å; E221-Y282 HydrophobicContact CB-CD1 3.67Å; E221-Y282 HydrophobicContact CB-CD2 3.83Å; E221-Y282 HydrophobicContact CB-CE1 3.59Å; E221-Y282 HydrophobicContact CB-CE2 3.76Å; E221-Y282 HydrophobicContact CB-CG 3.8Å; E221-Y282 HydrophobicContact CG-CD2 4.27Å; E221-Y282 HydrophobicContact CG-CE2 4.17Å; L222-Y282 HydrophobicContact CD2-CD1 4.46Å; L222-Y282 HydrophobicContact CD2-CE1 3.87Å; L222-Y282 HydrophobicContact CG-CE1 4.1Å; S225-Y282 VanDerWaalsContact OG-CA 3.32Å; S225-Y282 WeakPolarHBondContact OG-CA 3.2Å; F278-Y282 HydrophobicContact CB-CD2 4.29Å; F278-Y282 HydrophobicContact CB-CE1 4.27Å; F278-Y282 HydrophobicContact CB-CE2 3.75Å; F278-Y282 WeakPolarHBondContact O-CB 3.37Å; F278-Y282 WeakPolarHBondContact O-CD1 3.12Å; F278-Y282 WeakPolarHBondContact O-CD2 3.41Å; F278-Y282 PolarHBondContact O-N 3.29Å; E279-Y282 PolarHBondContact O-N 2.94Å; Y282-G284 PolarHBondContact O-N 3.45Å
283F98.4Very high98.5Very high95 Ų9536.9 Ų36.942%0.41719%0.193SC..THydrogen-bonded Turntrans-76.32.5172.8-151.5-107.5000113.3V228 Q232 D237 E279 I281 L285V228-F283 WeakPolarHBondContact CG1-O 3.36Å; Q232-F283 VanDerWaalsContact CG-O 3.27Å; Q232-F283 WeakPolarHBondContact CG-O 3.35Å; Q232-F283 PolarHBondContact NE2-O 3.42Å; D237-F283 HydrophobicContact CB-CD1 4.43Å; D237-F283 HydrophobicContact CB-CD2 3.89Å; D237-F283 HydrophobicContact CB-CE1 3.94Å; D237-F283 HydrophobicContact CB-CE2 3.34Å; D237-F283 HydrophobicContact CB-CG 4.4Å; D237-F283 HydrophobicContact CB-CZ 3.37Å; D237-F283 WeakPolarHBondContact OD2-CE2 3.31Å; E279-F283 WeakPolarHBondContact O-CB 3.12Å; E279-F283 PolarHBondContact O-N 3.48Å; I281-F283 VanDerWaalsContact C-N 3.29Å; I281-F283 PolarHBondContact O-N 2.96Å; F283-L285 VanDerWaalsContact C-N 3.29Å; F283-L285 HydrophobicContact CB-CG 4.35Å; F283-L285 HydrophobicContact CD1-CD1 4.38Å; F283-L285 HydrophobicContact CD1-CD2 3.93Å; F283-L285 HydrophobicContact CD1-CG 4.03Å; F283-L285 PolarHBondContact O-N 3.11Å
284G98.5Very high98.5Very high2 Ų233.5 Ų33.52%0.02117%0.169CC..THydrogen-bonded Turntrans758.917400000115.4I281 Y282 W286 G287I281-G284 WeakPolarHBondContact O-CA 3.16Å; I281-G284 PolarHBondContact O-N 3.45Å; Y282-G284 PolarHBondContact O-N 3.45Å; G284-W286 PolarHBondContact O-N 3.48Å; G284-W286 VanDerWaalsContact O-N 3.11Å; G284-G287 PolarHBondContact O-N 3.02Å
285L98.5Very high98.5Very high74 Ų7429.1 Ų29.139%0.38715%0.146SC..THydrogen-bonded Turntrans-64.9-19.3-174.2-61-179000113.5N280 F283 F288N280-L285 HydrophobicContact CB-CD1 4.29Å; N280-L285 WeakPolarHBondContact O-CB 3.24Å; N280-L285 PolarHBondContact O-N 3.25Å; F283-L285 VanDerWaalsContact C-N 3.29Å; F283-L285 HydrophobicContact CB-CG 4.35Å; F283-L285 HydrophobicContact CD1-CD1 4.38Å; F283-L285 HydrophobicContact CD1-CD2 3.93Å; F283-L285 HydrophobicContact CD1-CG 4.03Å; F283-L285 PolarHBondContact O-N 3.11Å; L285-F288 WeakPolarHBondContact O-CE1 3.2Å
286W98.8Very high98.6Very high24 Ų2426.8 Ų26.89%0.09113%0.13CC..THydrogen-bonded Turntrans-89.3-15175-74.378.7000113.9G267 A270 G271 L274 A276 I281 G284 S290 A320 V324G267-W286 WeakPolarHBondContact CA-O 3.5Å; G267-W286 WeakPolarHBondContact O-CB 3.22Å; A270-W286 HydrophobicContact CB-CE3 4.23Å; A270-W286 HydrophobicContact CB-CZ3 4.25Å; G271-W286 VanDerWaalsContact CA-CZ3 3.46Å; L274-W286 HydrophobicContact CB-CH2 4.07Å; L274-W286 HydrophobicContact CD1-CH2 3.74Å; L274-W286 HydrophobicContact CD1-CZ3 4.13Å; L274-W286 HydrophobicContact CG-CH2 4.43Å; A276-W286 HydrophobicContact CB-CH2 4.28Å; A276-W286 HydrophobicContact CB-CZ2 3.35Å; I281-W286 HydrophobicContact CG1-CG 4.47Å; G284-W286 PolarHBondContact O-N 3.48Å; G284-W286 VanDerWaalsContact O-N 3.11Å; W286-S290 PolarHBondContact O-OG 2.91Å; W286-S290 VanDerWaalsContact O-OG 3.04Å; W286-A320 HydrophobicContact CE3-CB 4.49Å; W286-V324 HydrophobicContact CH2-CB 3.55Å; W286-V324 HydrophobicContact CH2-CG1 3.53Å; W286-V324 HydrophobicContact CH2-CG2 3.83Å; W286-V324 HydrophobicContact CZ2-CB 3.83Å; W286-V324 HydrophobicContact CZ2-CG1 4.3Å; W286-V324 HydrophobicContact CZ2-CG2 3.76Å; W286-V324 HydrophobicContact CZ3-CB 4.09Å; W286-V324 HydrophobicContact CZ3-CG1 3.91Å
287G98.3Very high98.6Very high2 Ų226.5 Ų26.52%0.02113%0.127CC..THydrogen-bonded Turntrans-97.3-28.5-167.200000115.5G284 S290 S291G284-G287 PolarHBondContact O-N 3.02Å; G287-S290 PolarHBondContact O-OG 2.83Å; G287-S291 WeakPolarHBondContact O-CB 3.49Å; G287-S291 PolarHBondContact O-N 2.96Å
288F98.8Very high98.6Very high26 Ų2624.8 Ų24.811%0.11412%0.116CC..Hα-helixtrans-74-44.1-168.566.1-84.2000114.1G229 Q232 I233 L285 S291 L292 C338 T339G229-F288 WeakPolarHBondContact O-CA 3.49Å; G229-F288 WeakPolarHBondContact O-CB 3.44Å; G229-F288 PolarHBondContact O-N 3.39Å; Q232-F288 HydrophobicContact CB-CB 3.71Å; Q232-F288 HydrophobicContact CB-CD1 3.78Å; Q232-F288 HydrophobicContact CB-CG 3.94Å; I233-F288 HydrophobicContact CG1-CB 3.94Å; L285-F288 WeakPolarHBondContact O-CE1 3.2Å; F288-S291 PolarHBondContact O-N 3.11Å; F288-L292 PolarHBondContact O-N 3.47Å; F288-C338 VanDerWaalsContact CE2-O 3.24Å; F288-C338 WeakPolarHBondContact CE2-O 3.47Å; F288-T339 HydrophobicContact CD2-CG2 3.91Å; F288-T339 HydrophobicContact CE2-CG2 3.88Å
289N98.9Very high98.6Very high8 Ų823.6 Ų23.64%0.04311%0.111CC..Hα-helixtrans-63.4-46.2177.5-88.1-70.2000111.6L292 A293 T319 C338 T339 P341 F342N289-L292 PolarHBondContact O-N 2.92Å; N289-A293 PolarHBondContact O-N 3.29Å; N289-T319 HydrophobicContact CB-CG2 3.79Å; N289-T319 WeakPolarHBondContact O-CG2 3.44Å; N289-C338 PolarHBondContact ND2-O 3.39Å; N289-C338 PolarHBondContact OD1-O 3.32Å; N289-T339 VanDerWaalsContact OD1-CA 3.29Å; N289-T339 WeakPolarHBondContact OD1-CA 3.49Å; N289-P341 HydrophobicContact CB-CB 4.41Å; N289-F342 HydrophobicContact CB-CB 4.29Å; N289-F342 WeakPolarHBondContact OD1-CB 3.24Å; N289-F342 PolarHBondContact OD1-N 3.39Å
290S98.9Very high98.7Very high0 Ų016.5 Ų16.50%08%0.078CC..Hα-helixtrans-66.7-3617847.50000112.2G263 G267 W286 G287 C294 A316G263-S290 WeakPolarHBondContact O-CB 3.49Å; G263-S290 PolarHBondContact O-OG 3.05Å; G263-S290 VanDerWaalsContact O-OG 3.05Å; G267-S290 WeakPolarHBondContact CA-OG 3.27Å; W286-S290 PolarHBondContact O-OG 2.91Å; W286-S290 VanDerWaalsContact O-OG 3.04Å; G287-S290 PolarHBondContact O-OG 2.83Å; S290-C294 VanDerWaalsContact O-CB 3.28Å; S290-C294 WeakPolarHBondContact O-CB 3.43Å; S290-C294 PolarHBondContact O-N 3.33Å; S290-A316 VanDerWaalsContact CB-O 3.23Å; S290-A316 WeakPolarHBondContact CB-O 3.49Å
291S98.9Very high98.7Very high0 Ų014.7 Ų14.70%07%0.067CC..Hα-helixtrans-59.1-52.9170.9-170.10000112A260 G287 F288 A293 C294 I295A260-S291 VanDerWaalsContact CA-OG 3.27Å; A260-S291 WeakPolarHBondContact CA-OG 3.45Å; A260-S291 WeakPolarHBondContact O-CB 3.12Å; A260-S291 PolarHBondContact O-OG 2.65Å; G287-S291 WeakPolarHBondContact O-CB 3.49Å; G287-S291 PolarHBondContact O-N 2.96Å; F288-S291 PolarHBondContact O-N 3.11Å; S291-A293 PolarHBondContact O-N 2.74Å; S291-C294 PolarHBondContact O-N 2.94Å; S291-I295 VanDerWaalsContact O-CG1 3.29Å; S291-I295 WeakPolarHBondContact O-CG1 3.43Å; S291-I295 PolarHBondContact O-N 2.94Å
292L98.9Very high98.7Very high2 Ų215 Ų151%0.017%0.069CC..Hα-helixtrans-58.3-45.9177.5-75.3170.8000112.6V70 F71 I233 F288 N289 C294 I295 A296 T339 F342V70-L292 HydrophobicContact CG1-CD2 4.49Å; F71-L292 HydrophobicContact CE2-CD2 3.93Å; F71-L292 HydrophobicContact CZ-CD2 4.12Å; I233-L292 HydrophobicContact CD1-CD2 4.02Å; I233-L292 HydrophobicContact CD1-CG 4Å; I233-L292 HydrophobicContact CG1-CD1 4.45Å; I233-L292 HydrophobicContact CG1-CD2 4.39Å; I233-L292 HydrophobicContact CG1-CG 4.04Å; I233-L292 HydrophobicContact CG2-CD1 4.17Å; I233-L292 HydrophobicContact CG2-CD2 3.9Å; I233-L292 HydrophobicContact CG2-CG 4.18Å; F288-L292 PolarHBondContact O-N 3.47Å; N289-L292 PolarHBondContact O-N 2.92Å; L292-C294 VanDerWaalsContact C-N 3.32Å; L292-C294 PolarHBondContact O-N 3.03Å; L292-I295 PolarHBondContact O-N 3.2Å; L292-A296 WeakPolarHBondContact O-CB 3.46Å; L292-A296 PolarHBondContact O-N 3.23Å; L292-T339 HydrophobicContact CD1-CG2 3.76Å; L292-F342 HydrophobicContact CB-CB 4.31Å; L292-F342 HydrophobicContact CB-CD1 4.18Å; L292-F342 HydrophobicContact CB-CD2 3.49Å; L292-F342 VanDerWaalsContact CB-CD2 3.49Å; L292-F342 HydrophobicContact CB-CE1 4.48Å; L292-F342 HydrophobicContact CB-CE2 3.88Å; L292-F342 HydrophobicContact CB-CG 3.69Å; L292-F342 HydrophobicContact CB-CZ 4.38Å; L292-F342 HydrophobicContact CD1-CB 4.46Å; L292-F342 HydrophobicContact CD1-CD1 3.87Å; L292-F342 HydrophobicContact CD1-CE1 4.35Å; L292-F342 HydrophobicContact CD1-CG 4.04Å
293A98.9Very high98.7Very high0 Ų012.9 Ų12.90%06%0.061CC..Hα-helixtrans-61.7-41177.900000111.8N289 S291 A296 M297 T319 F342N289-A293 PolarHBondContact O-N 3.29Å; S291-A293 PolarHBondContact O-N 2.74Å; A293-A296 PolarHBondContact O-N 3.27Å; A293-M297 WeakPolarHBondContact O-CB 3.33Å; A293-M297 WeakPolarHBondContact O-CG 3.08Å; A293-M297 PolarHBondContact O-N 3.27Å; A293-T319 HydrophobicContact CB-CG2 3.95Å; A293-T319 VanDerWaalsContact CB-OG1 3.31Å; A293-T319 WeakPolarHBondContact CB-OG1 3.11Å; A293-F342 HydrophobicContact CB-CD2 4.16Å
294C98.9Very high98.7Very high0 Ų09.3 Ų9.30%05%0.046CC..Hα-helixtrans-66.8-40.8178.9-152.30000111.8H259 S290 S291 L292 G298 A316H259-C294 HydrophobicContact CB-CB 4.41Å; H259-C294 WeakPolarHBondContact O-CB 3.32Å; S290-C294 VanDerWaalsContact O-CB 3.28Å; S290-C294 WeakPolarHBondContact O-CB 3.43Å; S290-C294 PolarHBondContact O-N 3.33Å; S291-C294 PolarHBondContact O-N 2.94Å; L292-C294 VanDerWaalsContact C-N 3.32Å; L292-C294 PolarHBondContact O-N 3.03Å; C294-G298 VanDerWaalsContact O-CA 3.26Å; C294-G298 WeakPolarHBondContact O-CA 3.46Å; C294-G298 PolarHBondContact O-N 3.39Å; C294-A316 HydrophobicContact CB-CB 3.88Å
295I98.9Very high98.7Very high0 Ų09.8 Ų9.80%05%0.049CC..Hα-helixtrans-62.2-47.2174-59161000110.1F71 M256 A260 S291 L292 M297 G298 M300F71-I295 HydrophobicContact CD2-CB 4.16Å; F71-I295 HydrophobicContact CD2-CG2 3.69Å; F71-I295 HydrophobicContact CE2-CB 4.22Å; F71-I295 HydrophobicContact CE2-CG2 4.26Å; M256-I295 HydrophobicContact CB-CG2 4.07Å; M256-I295 HydrophobicContact CE-CG2 3.65Å; M256-I295 HydrophobicContact CG-CG2 4.1Å; A260-I295 HydrophobicContact CB-CD1 3.6Å; A260-I295 HydrophobicContact CB-CG1 3.75Å; S291-I295 VanDerWaalsContact O-CG1 3.29Å; S291-I295 WeakPolarHBondContact O-CG1 3.43Å; S291-I295 PolarHBondContact O-N 2.94Å; L292-I295 PolarHBondContact O-N 3.2Å; I295-M297 PolarHBondContact O-N 3.38Å; I295-G298 PolarHBondContact O-N 2.81Å; I295-M300 WeakPolarHBondContact O-CB 3.46Å
296A98.9Very high98.7Very high0 Ų014.8 Ų14.80%06%0.063CC..Iπ-helixtrans-61.8-45.6-177.300000112.5F71 F176 L292 A293 M300 F301 F342 T346F71-A296 HydrophobicContact CE2-CB 4.05Å; F71-A296 HydrophobicContact CZ-CB 4.14Å; F176-A296 HydrophobicContact CE1-CB 4.41Å; L292-A296 WeakPolarHBondContact O-CB 3.46Å; L292-A296 PolarHBondContact O-N 3.23Å; A293-A296 PolarHBondContact O-N 3.27Å; A296-M300 WeakPolarHBondContact O-CB 3.11Å; A296-F301 HydrophobicContact CB-CD2 3.85Å; A296-F301 HydrophobicContact CB-CE2 4.21Å; A296-F301 PolarHBondContact O-N 3.05Å; A296-F342 HydrophobicContact CB-CE2 4.22Å; A296-T346 HydrophobicContact CB-CG2 3.74Å
297M98.8Very high98.7Very high0 Ų014.7 Ų14.70%06%0.063CC..Iπ-helixtrans-82.4-27.3-179.1-65-59.3-67.100113A293 I295 G299 M302 L311 A312 C315 T346 F349 L350A293-M297 WeakPolarHBondContact O-CB 3.33Å; A293-M297 WeakPolarHBondContact O-CG 3.08Å; A293-M297 PolarHBondContact O-N 3.27Å; I295-M297 PolarHBondContact O-N 3.38Å; M297-G299 PolarHBondContact O-N 3.06Å; M297-M302 HydrophobicContact CE-CG 3.61Å; M297-M302 HydrophobicContact CE-SD 4.43Å; M297-M302 HydrophobicContact SD-CG 4.11Å; M297-L311 HydrophobicContact CE-CD2 3.82Å; M297-L311 HydrophobicContact CE-CG 4.12Å; M297-A312 HydrophobicContact CB-CB 3.6Å; M297-C315 HydrophobicContact CG-CB 3.95Å; M297-T346 HydrophobicContact CG-CG2 4.22Å; M297-T346 HydrophobicContact SD-CG2 4.02Å; M297-F349 HydrophobicContact CE-CB 3.78Å; M297-F349 HydrophobicContact CE-CD1 4.41Å; M297-F349 HydrophobicContact SD-CB 4.13Å; M297-L350 HydrophobicContact CE-CD2 4.43Å; M297-L350 HydrophobicContact SD-CD2 3.79Å; M297-L350 HydrophobicContact SD-CG 4.02Å
298G98.5Very high98.7Very high0 Ų014.7 Ų14.70%06%0.062CC..Iπ-helixtrans-79.943.4-173.500000115.3H259 C294 I295H259-G298 PolarHBondContact CE1-O 3.34Å; H259-G298 VanDerWaalsContact CE1-O 3.26Å; H259-G298 PolarHBondContact ND1-O 2.99Å; C294-G298 VanDerWaalsContact O-CA 3.26Å; C294-G298 WeakPolarHBondContact O-CA 3.46Å; C294-G298 PolarHBondContact O-N 3.39Å; I295-G298 PolarHBondContact O-N 2.81Å
299G98.3Very high98.7Very high0 Ų016.1 Ų16.10%07%0.069CC..Iπ-helixtrans113.9-13.3178.200000115.5M297 M302 P370 N373M297-G299 PolarHBondContact O-N 3.06Å; G299-M302 CarbonylContact C-O 3.53Å; G299-M302 WeakPolarHBondContact CA-O 3.46Å; G299-M302 PolarHBondContact N-O 3.2Å; G299-P370 WeakPolarHBondContact O-CA 3.2Å; G299-N373 PolarHBondContact O-ND2 3.02Å
300M98.6Very high98.7Very high9 Ų920.4 Ų20.44%0.0449%0.092CC..Iπ-helixtrans-80.9-64.3-177-168.965.4-173.800111.9F71 M256 I295 A296 V367 T368 N373F71-M300 HydrophobicContact CB-CE 3.99Å; F71-M300 HydrophobicContact CB-CG 4.21Å; F71-M300 HydrophobicContact CB-SD 4.45Å; F71-M300 WeakPolarHBondContact O-CE 3.43Å; M256-M300 HydrophobicContact CE-SD 4.45Å; M256-M300 HydrophobicContact SD-SD 4.39Å; I295-M300 WeakPolarHBondContact O-CB 3.46Å; A296-M300 WeakPolarHBondContact O-CB 3.11Å; M300-V367 HydrophobicContact CE-CG1 3.59Å; M300-V367 HydrophobicContact CG-CG1 4.42Å; M300-V367 HydrophobicContact SD-CG1 4.29Å; M300-T368 WeakPolarHBondContact CE-O 3.35Å; M300-N373 PolarHBondContact O-ND2 2.94Å
301F98.7Very high98.7Very high19 Ų1921.7 Ų21.78%0.08310%0.099CC..SBendtrans-98.8-12.3179.5-62.7-79.3000113.3F71 P174 F176 A296 L350 M362 L364 V367F71-F301 AromaticContact CD1-CE2 3.91Å; F71-F301 HydrophobicContact CD1-CE2 3.91Å; F71-F301 HydrophobicContact CD1-CZ 4.21Å; F71-F301 HydrophobicContact CE1-CE2 4.19Å; F71-F301 HydrophobicContact CG-CE2 4.3Å; P174-F301 HydrophobicContact CB-CE1 3.88Å; P174-F301 HydrophobicContact CB-CZ 4.23Å; P174-F301 HydrophobicContact CG-CD1 4.03Å; P174-F301 HydrophobicContact CG-CE1 3.76Å; P174-F301 HydrophobicContact CG-CZ 4.13Å; F176-F301 HydrophobicContact CD1-CE2 4.46Å; F176-F301 AromaticContact CE1-CD2 3.91Å; F176-F301 HydrophobicContact CE1-CD2 3.91Å; F176-F301 AromaticContact CE1-CE2 3.52Å; F176-F301 HydrophobicContact CE1-CE2 3.52Å; F176-F301 AromaticContact CE1-CZ 3.88Å; F176-F301 HydrophobicContact CE1-CZ 3.88Å; F176-F301 HydrophobicContact CZ-CD2 4.25Å; F176-F301 HydrophobicContact CZ-CE2 4.3Å; A296-F301 HydrophobicContact CB-CD2 3.85Å; A296-F301 HydrophobicContact CB-CE2 4.21Å; A296-F301 PolarHBondContact O-N 3.05Å; F301-L350 HydrophobicContact CB-CD1 4.02Å; F301-L350 HydrophobicContact CB-CD2 3.81Å; F301-L350 HydrophobicContact CG-CD1 4.39Å; F301-M362 PolarHBondContact O-N 3.49Å; F301-L364 HydrophobicContact CD1-CD2 3.81Å; F301-L364 HydrophobicContact CE1-CD2 3.88Å; F301-V367 HydrophobicContact CD1-CG1 4.35Å; F301-V367 HydrophobicContact CD1-CG2 4.23Å; F301-V367 HydrophobicContact CE1-CG1 4.15Å
302M98.7Very high98.7Very high8 Ų821.7 Ų21.74%0.03910%0.099CC..BIsolated β-bridgetrans-117.5139.7166.8-59-66-74.200108.3M297 G299 L304 T308 L311 L350 I359 Y360 K361M297-M302 HydrophobicContact CE-CG 3.61Å; M297-M302 HydrophobicContact CE-SD 4.43Å; M297-M302 HydrophobicContact SD-CG 4.11Å; G299-M302 CarbonylContact C-O 3.53Å; G299-M302 WeakPolarHBondContact CA-O 3.46Å; G299-M302 PolarHBondContact N-O 3.2Å; M302-L304 PolarHBondContact O-N 3.24Å; M302-T308 HydrophobicContact CB-CG2 4.11Å; M302-T308 HydrophobicContact CE-CG2 4.22Å; M302-L311 HydrophobicContact CE-CD2 4.36Å; M302-L350 HydrophobicContact CG-CD2 3.97Å; M302-L350 HydrophobicContact SD-CD2 3.74Å; M302-I359 HydrophobicContact CE-CG2 3.4Å; M302-I359 VanDerWaalsContact CE-CG2 3.4Å; M302-Y360 CarbonylContact C-O 3.57Å; M302-Y360 WeakPolarHBondContact CA-O 3.16Å; M302-K361 HydrophobicContact CE-CB 4.5Å; M302-K361 VanDerWaalsContact SD-CA 3.51Å; M302-K361 HydrophobicContact SD-CB 3.76Å; M302-K361 HydrophobicContact SD-CG 4.31Å
303A98.5Very high98.7Very high1 Ų123.6 Ų23.61%0.00811%0.109CC..  trans-64128.7174.500000110T305 T308 Y360 M362 Y377A303-T305 PolarHBondContact O-N 3.43Å; A303-T308 WeakPolarHBondContact O-CG2 3.46Å; A303-T308 PolarHBondContact O-OG1 3.48Å; A303-Y360 HydrophobicContact CB-CD1 4.01Å; A303-Y360 PolarHBondContact N-O 2.92Å; A303-M362 HydrophobicContact CB-SD 3.94Å; A303-Y377 VanDerWaalsContact CB-CB 3.42Å; A303-Y377 HydrophobicContact CB-CD1 4Å; A303-Y377 HydrophobicContact CB-CD2 3.91Å; A303-Y377 HydrophobicContact CB-CG 3.49Å; A303-Y377 VanDerWaalsContact CB-CG 3.49Å
304L98.7Very high98.7Very high20 Ų2025.3 Ų25.311%0.10513%0.126CC..  trans-66.6122.2-176.8-174.263.3000110L255 M302 T308 H309 R374L255-L304 HydrophobicContact CD1-CD2 3.76Å; L255-L304 HydrophobicContact CD2-CD2 3.92Å; L255-L304 HydrophobicContact CG-CD2 4.35Å; M302-L304 PolarHBondContact O-N 3.24Å; L304-T308 WeakPolarHBondContact CA-OG1 3.29Å; L304-H309 HydrophobicContact CD1-CB 4.11Å; L304-R374 PolarHBondContact O-NH1 3.48Å
305T98.6Very high98.7Very high12 Ų1225.3 Ų25.37%0.07413%0.126CC..  trans-139.3173.5169.464.60000107.2A303 Q307 T308 H309 N358 Y377A303-T305 PolarHBondContact O-N 3.43Å; T305-Q307 PolarHBondContact O-N 3.02Å; T305-Q307 PolarHBondContact OG1-N 3.35Å; T305-Q307 PolarHBondContact OG1-OE1 2.82Å; T305-T308 PolarHBondContact N-OG1 3.15Å; T305-T308 PolarHBondContact O-N 3.46Å; T305-T308 PolarHBondContact O-OG1 3.15Å; T305-T308 PolarHBondContact OG1-N 3.39Å; T305-T308 VanDerWaalsContact OG1-N 3.16Å; T305-T308 PolarHBondContact OG1-OG1 2.95Å; T305-H309 VanDerWaalsContact O-CB 3.3Å; T305-H309 WeakPolarHBondContact O-CB 3.23Å; T305-H309 PolarHBondContact O-N 3.31Å; T305-N358 WeakPolarHBondContact CG2-O 3.43Å; T305-N358 PolarHBondContact OG1-O 3.04Å; T305-Y377 HydrophobicContact CG2-CD1 4.4Å; T305-Y377 HydrophobicContact CG2-CE1 3.74Å
306W98.6Very high98.7Very high180 Ų18025.3 Ų25.368%0.68213%0.126SC*.Hα-helixtrans-66.1-31.4175.668.7-99.5000111.2L310W306-L310 HydrophobicContact CE3-CD1 3.8Å; W306-L310 HydrophobicContact CZ3-CD1 3.82Å; W306-L310 WeakPolarHBondContact O-CG 3.45Å; W306-L310 PolarHBondContact O-N 3.21Å; W306-L310 VanDerWaalsContact O-N 3.09Å
307Q98.7Very high98.7Very high22 Ų2227.9 Ų27.910%0.10314%0.139CC..Hα-helixtrans-67.3-47.5176.2-61.388.2-20.700111.8T305 H309 L310 L311 N358 I359T305-Q307 PolarHBondContact O-N 3.02Å; T305-Q307 PolarHBondContact OG1-N 3.35Å; T305-Q307 PolarHBondContact OG1-OE1 2.82Å; Q307-H309 VanDerWaalsContact C-N 3.32Å; Q307-L310 PolarHBondContact O-N 3.42Å; Q307-L311 PolarHBondContact O-N 2.89Å; Q307-N358 HydrophobicContact CG-CB 4.1Å; Q307-N358 VanDerWaalsContact NE2-CG 3.33Å; Q307-N358 PolarHBondContact NE2-ND2 3.49Å; Q307-I359 HydrophobicContact CB-CD1 4.41Å; Q307-I359 HydrophobicContact CB-CG1 3.85Å
308T98.6Very high98.7Very high1 Ų131.9 Ų31.91%0.00616%0.157CC..Hα-helixtrans-73.3-26.1178.854.80000112.2M302 A303 L304 T305 L311 A312 I359M302-T308 HydrophobicContact CB-CG2 4.11Å; M302-T308 HydrophobicContact CE-CG2 4.22Å; A303-T308 WeakPolarHBondContact O-CG2 3.46Å; A303-T308 PolarHBondContact O-OG1 3.48Å; L304-T308 WeakPolarHBondContact CA-OG1 3.29Å; T305-T308 PolarHBondContact N-OG1 3.15Å; T305-T308 PolarHBondContact O-N 3.46Å; T305-T308 PolarHBondContact O-OG1 3.15Å; T305-T308 PolarHBondContact OG1-N 3.39Å; T305-T308 VanDerWaalsContact OG1-N 3.16Å; T305-T308 PolarHBondContact OG1-OG1 2.95Å; T308-L311 PolarHBondContact O-N 2.68Å; T308-A312 WeakPolarHBondContact O-CB 3.36Å; T308-A312 PolarHBondContact O-N 2.98Å; T308-I359 HydrophobicContact CG2-CB 4.32Å; T308-I359 HydrophobicContact CG2-CG1 4.36Å; T308-I359 HydrophobicContact CG2-CG2 4.21Å
309H98.8Very high98.7Very high56 Ų5631.9 Ų31.926%0.25916%0.157SC..Hα-helixtrans-61-51.7167.6179.664000111.1H259 L304 T305 Q307 L311 A312 L313H259-H309 AromaticContact CD2-ND1 3.85Å; H259-H309 AromaticContact CE1-ND1 3.91Å; H259-H309 AromaticContact NE2-CE1 3.72Å; H259-H309 AromaticContact NE2-ND1 3Å; H259-H309 PolarHBondContact NE2-ND1 3.16Å; L304-H309 HydrophobicContact CD1-CB 4.11Å; T305-H309 VanDerWaalsContact O-CB 3.3Å; T305-H309 WeakPolarHBondContact O-CB 3.23Å; T305-H309 PolarHBondContact O-N 3.31Å; Q307-H309 VanDerWaalsContact C-N 3.32Å; H309-L311 VanDerWaalsContact C-N 3.28Å; H309-L311 PolarHBondContact O-N 3.44Å; H309-A312 WeakPolarHBondContact O-CA 3.23Å; H309-A312 WeakPolarHBondContact O-CB 3.46Å; H309-A312 PolarHBondContact O-N 2.96Å; H309-L313 WeakPolarHBondContact O-CG 3.47Å; H309-L313 PolarHBondContact O-N 3.17Å
310L98.8Very high98.8Very high98 Ų9832 Ų3251%0.51316%0.158SC..Hα-helixtrans-59.3-39.4175.1-67.5177.6000112.3W306 Q307 A312 L313 G314W306-L310 HydrophobicContact CE3-CD1 3.8Å; W306-L310 HydrophobicContact CZ3-CD1 3.82Å; W306-L310 WeakPolarHBondContact O-CG 3.45Å; W306-L310 PolarHBondContact O-N 3.21Å; W306-L310 VanDerWaalsContact O-N 3.09Å; Q307-L310 PolarHBondContact O-N 3.42Å; L310-A312 VanDerWaalsContact C-N 3.31Å; L310-A312 PolarHBondContact O-N 3.44Å; L310-L313 HydrophobicContact CD2-CD1 4.26Å; L310-L313 PolarHBondContact O-N 3.38Å; L310-G314 PolarHBondContact O-N 2.99Å
311L98.7Very high98.8Very high28 Ų2836.1 Ų36.115%0.14717%0.174CC..Hα-helixtrans-61.9-39.1174.2-17464.8000111.8M297 M302 Q307 T308 H309 G314 C315 F349 M352 I359M297-L311 HydrophobicContact CE-CD2 3.82Å; M297-L311 HydrophobicContact CE-CG 4.12Å; M302-L311 HydrophobicContact CE-CD2 4.36Å; Q307-L311 PolarHBondContact O-N 2.89Å; T308-L311 PolarHBondContact O-N 2.68Å; H309-L311 VanDerWaalsContact C-N 3.28Å; H309-L311 PolarHBondContact O-N 3.44Å; L311-G314 PolarHBondContact O-N 2.96Å; L311-C315 WeakPolarHBondContact O-CB 3.32Å; L311-C315 PolarHBondContact O-N 3.14Å; L311-F349 HydrophobicContact CD1-CD1 3.78Å; L311-F349 HydrophobicContact CD1-CE1 3.9Å; L311-F349 HydrophobicContact CG-CD1 4.15Å; L311-M352 HydrophobicContact CD1-CE 3.99Å; L311-M352 HydrophobicContact CD2-CE 3.88Å; L311-I359 HydrophobicContact CD2-CG2 4.02Å
312A98.9Very high98.8Very high0 Ų037.6 Ų37.60%018%0.182CC..Hα-helixtrans-65.9-37.2175.900000112.1M297 T308 H309 L310 C315 A316M297-A312 HydrophobicContact CB-CB 3.6Å; T308-A312 WeakPolarHBondContact O-CB 3.36Å; T308-A312 PolarHBondContact O-N 2.98Å; H309-A312 WeakPolarHBondContact O-CA 3.23Å; H309-A312 WeakPolarHBondContact O-CB 3.46Å; H309-A312 PolarHBondContact O-N 2.96Å; L310-A312 VanDerWaalsContact C-N 3.31Å; L310-A312 PolarHBondContact O-N 3.44Å; A312-C315 PolarHBondContact O-N 2.98Å; A312-A316 WeakPolarHBondContact O-CB 3.47Å; A312-A316 PolarHBondContact O-N 2.89Å
313L98.9Very high98.8Very high42 Ų4237.7 Ų37.722%0.2219%0.186CC..Hα-helixtrans-63.8-45.9172.8-53.6-175.1000111.1I262 L266 H309 L310 C315 A316 L317I262-L313 HydrophobicContact CG2-CD2 3.41Å; I262-L313 VanDerWaalsContact CG2-CD2 3.41Å; L266-L313 HydrophobicContact CD1-CB 3.91Å; L266-L313 HydrophobicContact CD1-CD2 3.83Å; L266-L313 HydrophobicContact CD1-CG 4.43Å; H309-L313 WeakPolarHBondContact O-CG 3.47Å; H309-L313 PolarHBondContact O-N 3.17Å; L310-L313 HydrophobicContact CD2-CD1 4.26Å; L310-L313 PolarHBondContact O-N 3.38Å; L313-C315 VanDerWaalsContact C-N 3.34Å; L313-C315 PolarHBondContact O-N 3.07Å; L313-A316 PolarHBondContact O-N 3.25Å; L313-L317 PolarHBondContact O-N 3.16Å
314G98.8Very high98.8Very high35 Ų3539.4 Ų39.436%0.36120%0.196SC..Hα-helixtrans-61.1-42.2175.600000112.5L310 L311 F318L310-G314 PolarHBondContact O-N 2.99Å; L311-G314 PolarHBondContact O-N 2.96Å; G314-F318 WeakPolarHBondContact O-CB 3.44Å; G314-F318 PolarHBondContact O-N 3.21Å
315C98.9Very high98.8Very high0 Ų040.2 Ų40.20%021%0.209CC..Hα-helixtrans-63.8-44.1175.7-169.50000111.7M297 L311 A312 L313 F318 T319 F349M297-C315 HydrophobicContact CG-CB 3.95Å; L311-C315 WeakPolarHBondContact O-CB 3.32Å; L311-C315 PolarHBondContact O-N 3.14Å; A312-C315 PolarHBondContact O-N 2.98Å; L313-C315 VanDerWaalsContact C-N 3.34Å; L313-C315 PolarHBondContact O-N 3.07Å; C315-F318 PolarHBondContact O-N 3.31Å; C315-T319 WeakPolarHBondContact O-CB 3.48Å; C315-T319 PolarHBondContact O-N 2.95Å; C315-T319 PolarHBondContact O-OG1 3.48Å; C315-F349 VanDerWaalsContact CA-CE1 3.49Å; C315-F349 HydrophobicContact CB-CD1 3.52Å; C315-F349 HydrophobicContact CB-CD2 4.4Å; C315-F349 HydrophobicContact CB-CE1 3.56Å; C315-F349 HydrophobicContact CB-CE2 4.42Å; C315-F349 HydrophobicContact CB-CG 3.96Å; C315-F349 HydrophobicContact CB-CZ 4.03Å; C315-F349 VanDerWaalsContact SG-CG 3.59Å
316A98.9Very high98.8Very high0 Ų041 Ų410%021%0.212CC..Hα-helixtrans-62-45.1178.400000112.2L266 S290 C294 A312 L313 T319 A320L266-A316 HydrophobicContact CB-CB 4.43Å; L266-A316 HydrophobicContact CD1-CB 3.87Å; S290-A316 VanDerWaalsContact CB-O 3.23Å; S290-A316 WeakPolarHBondContact CB-O 3.49Å; C294-A316 HydrophobicContact CB-CB 3.88Å; A312-A316 WeakPolarHBondContact O-CB 3.47Å; A312-A316 PolarHBondContact O-N 2.89Å; L313-A316 PolarHBondContact O-N 3.25Å; A316-T319 PolarHBondContact O-N 3.08Å; A316-A320 PolarHBondContact O-N 3.43Å
317L98.8Very high98.8Very high54 Ų5434.3 Ų34.328%0.28320%0.196SC..Hα-helixtrans-62.8-48.8174.7-78171.7000111.9L266 A270 L313 T319 A320 Y321L266-L317 HydrophobicContact CB-CD2 4Å; L266-L317 HydrophobicContact CB-CG 4.19Å; L266-L317 HydrophobicContact CD1-CG 4.38Å; L266-L317 HydrophobicContact CD2-CD1 4.32Å; L266-L317 HydrophobicContact CD2-CD2 4.11Å; L266-L317 HydrophobicContact CD2-CG 4.11Å; L266-L317 HydrophobicContact CG-CG 4.47Å; L266-L317 WeakPolarHBondContact O-CD2 3.44Å; A270-L317 HydrophobicContact CB-CD2 4.23Å; L313-L317 PolarHBondContact O-N 3.16Å; L317-T319 PolarHBondContact O-N 3.11Å; L317-A320 PolarHBondContact O-N 2.99Å; L317-A320 VanDerWaalsContact O-N 3.15Å; L317-Y321 HydrophobicContact CB-CE2 4.49Å; L317-Y321 WeakPolarHBondContact O-CD2 3.38Å; L317-Y321 PolarHBondContact O-N 3.04Å; L317-Y321 VanDerWaalsContact O-N 3.15Å
318F98.9Very high98.7Very high84 Ų8437 Ų3737%0.36821%0.211SC..Hα-helixtrans-55.8-42.9175.8177.5-88.1000111.3G314 C315 A320 Y321 L322 A345 L348 F349G314-F318 WeakPolarHBondContact O-CB 3.44Å; G314-F318 PolarHBondContact O-N 3.21Å; C315-F318 PolarHBondContact O-N 3.31Å; F318-A320 VanDerWaalsContact C-N 3.35Å; F318-A320 PolarHBondContact O-N 3.34Å; F318-Y321 PolarHBondContact O-N 3.04Å; F318-L322 HydrophobicContact CE1-CB 4.42Å; F318-L322 HydrophobicContact CE1-CD2 4.11Å; F318-L322 WeakPolarHBondContact O-CB 3.41Å; F318-L322 PolarHBondContact O-N 3.22Å; F318-A345 HydrophobicContact CD1-CB 3.68Å; F318-A345 HydrophobicContact CE1-CB 3.83Å; F318-L348 HydrophobicContact CE1-CD2 4.2Å; F318-L348 HydrophobicContact CZ-CD2 4Å; F318-F349 HydrophobicContact CB-CE2 4.09Å; F318-F349 HydrophobicContact CB-CZ 4.02Å; F318-F349 AromaticContact CD1-CE2 3.78Å; F318-F349 HydrophobicContact CD1-CE2 3.78Å; F318-F349 HydrophobicContact CD2-CE2 4.5Å; F318-F349 HydrophobicContact CE1-CE2 4.36Å; F318-F349 AromaticContact CG-CE2 3.86Å; F318-F349 HydrophobicContact CG-CE2 3.86Å; F318-F349 HydrophobicContact CG-CZ 4.23Å
319T98.9Very high98.7Very high0 Ų043.4 Ų43.40%024%0.239CC..Hα-helixtrans-64.4-37.6179.5-59.50000112N289 A293 C315 A316 L317 G323 F342 A345N289-T319 HydrophobicContact CB-CG2 3.79Å; N289-T319 WeakPolarHBondContact O-CG2 3.44Å; A293-T319 HydrophobicContact CB-CG2 3.95Å; A293-T319 VanDerWaalsContact CB-OG1 3.31Å; A293-T319 WeakPolarHBondContact CB-OG1 3.11Å; C315-T319 WeakPolarHBondContact O-CB 3.48Å; C315-T319 PolarHBondContact O-N 2.95Å; C315-T319 PolarHBondContact O-OG1 3.48Å; A316-T319 PolarHBondContact O-N 3.08Å; L317-T319 PolarHBondContact O-N 3.11Å; T319-G323 PolarHBondContact O-N 2.97Å; T319-F342 HydrophobicContact CG2-CB 4.33Å; T319-A345 HydrophobicContact CG2-CB 4.23Å; T319-A345 WeakPolarHBondContact OG1-CB 3.17Å
320A98.9Very high98.7Very high3 Ų341.5 Ų41.53%0.02523%0.23CC..Hα-helixtrans-65.1-43.7175.400000112A270 W286 A316 L317 F318 G323 V324A270-A320 HydrophobicContact CB-CB 3.59Å; W286-A320 HydrophobicContact CE3-CB 4.49Å; A316-A320 PolarHBondContact O-N 3.43Å; L317-A320 PolarHBondContact O-N 2.99Å; L317-A320 VanDerWaalsContact O-N 3.15Å; F318-A320 VanDerWaalsContact C-N 3.35Å; F318-A320 PolarHBondContact O-N 3.34Å; A320-G323 WeakPolarHBondContact O-CA 3.4Å; A320-G323 PolarHBondContact O-N 2.85Å; A320-G323 VanDerWaalsContact O-N 3.11Å; A320-V324 PolarHBondContact O-N 3.01Å; A320-V324 VanDerWaalsContact O-N 3.16Å
321Y98.9Very high98.7Very high96 Ų9637.3 Ų37.338%0.37621%0.21SC..Hα-helixtrans-65.4-42.9175.6-66.1-55.7000112.7A270 S273 L274 L317 F318 G323 V324 G325A270-Y321 HydrophobicContact CB-CD1 4.34Å; A270-Y321 HydrophobicContact CB-CE1 3.93Å; S273-Y321 PolarHBondContact OG-OH 2.6Å; L274-Y321 HydrophobicContact CD1-CD1 3.54Å; L274-Y321 HydrophobicContact CD1-CE1 3.82Å; L274-Y321 HydrophobicContact CD2-CE1 4.43Å; L274-Y321 HydrophobicContact CG-CD1 4.12Å; L274-Y321 HydrophobicContact CG-CE1 3.85Å; L317-Y321 HydrophobicContact CB-CE2 4.49Å; L317-Y321 WeakPolarHBondContact O-CD2 3.38Å; L317-Y321 PolarHBondContact O-N 3.04Å; L317-Y321 VanDerWaalsContact O-N 3.15Å; F318-Y321 PolarHBondContact O-N 3.04Å; Y321-G323 PolarHBondContact O-N 3.44Å; Y321-V324 WeakPolarHBondContact O-CG1 3.43Å; Y321-V324 PolarHBondContact O-N 3.45Å; Y321-G325 PolarHBondContact O-N 3.36Å; Y321-G325 VanDerWaalsContact O-N 3.1Å
322L98.9Very high98.6Very high49 Ų4942.5 Ų42.526%0.25723%0.233SC..Hα-helixtrans-61.3-34.8171.6-176.361.4000110.7F318 G325 M326 P341 L344 A345F318-L322 HydrophobicContact CE1-CB 4.42Å; F318-L322 HydrophobicContact CE1-CD2 4.11Å; F318-L322 WeakPolarHBondContact O-CB 3.41Å; F318-L322 PolarHBondContact O-N 3.22Å; L322-G325 PolarHBondContact O-N 3.3Å; L322-M326 HydrophobicContact CD1-CG 3.94Å; L322-M326 HydrophobicContact CD1-SD 4.29Å; L322-M326 HydrophobicContact CG-CG 4.16Å; L322-M326 HydrophobicContact CG-SD 4.17Å; L322-M326 WeakPolarHBondContact O-CB 3.32Å; L322-M326 WeakPolarHBondContact O-CG 3.47Å; L322-M326 PolarHBondContact O-N 3.46Å; L322-P341 HydrophobicContact CB-CB 4.43Å; L322-P341 HydrophobicContact CD2-CB 4.46Å; L322-P341 HydrophobicContact CG-CB 4.17Å; L322-L344 HydrophobicContact CD2-CB 4.2Å; L322-A345 HydrophobicContact CD2-CB 4.04Å
323G98.6Very high98.5Very high11 Ų1148.1 Ų48.111%0.11326%0.263CS..Hα-helixtrans-52.7-58.6175.900000113.2T319 A320 Y321 G325 M326 A327T319-G323 PolarHBondContact O-N 2.97Å; A320-G323 WeakPolarHBondContact O-CA 3.4Å; A320-G323 PolarHBondContact O-N 2.85Å; A320-G323 VanDerWaalsContact O-N 3.11Å; Y321-G323 PolarHBondContact O-N 3.44Å; G323-G325 VanDerWaalsContact C-N 3.34Å; G323-G325 PolarHBondContact O-N 2.64Å; G323-M326 PolarHBondContact O-N 2.99Å; G323-A327 WeakPolarHBondContact O-CB 3.46Å; G323-A327 PolarHBondContact O-N 2.97Å
324V98.4Very high98.4Very high36 Ų3647.8 Ų47.822%0.21827%0.27CS..Hα-helixtrans-66.2-36.8177.964.70000112.1L274 W286 A320 Y321 M326 A327 N328L274-V324 HydrophobicContact CD1-CG1 3.83Å; W286-V324 HydrophobicContact CH2-CB 3.55Å; W286-V324 HydrophobicContact CH2-CG1 3.53Å; W286-V324 HydrophobicContact CH2-CG2 3.83Å; W286-V324 HydrophobicContact CZ2-CB 3.83Å; W286-V324 HydrophobicContact CZ2-CG1 4.3Å; W286-V324 HydrophobicContact CZ2-CG2 3.76Å; W286-V324 HydrophobicContact CZ3-CB 4.09Å; W286-V324 HydrophobicContact CZ3-CG1 3.91Å; A320-V324 PolarHBondContact O-N 3.01Å; A320-V324 VanDerWaalsContact O-N 3.16Å; Y321-V324 WeakPolarHBondContact O-CG1 3.43Å; Y321-V324 PolarHBondContact O-N 3.45Å; V324-M326 PolarHBondContact O-N 3.38Å; V324-A327 PolarHBondContact O-N 3.23Å; V324-N328 VanDerWaalsContact O-CG 3.29Å; V324-N328 PolarHBondContact O-N 3.36Å; V324-N328 PolarHBondContact O-ND2 2.92Å
325G98.6Very high98.4Very high38 Ų3847 Ų4739%0.39226%0.257SS..Hα-helixtrans-60.6-46.8177.400000112.4Y321 L322 G323 F329Y321-G325 PolarHBondContact O-N 3.36Å; Y321-G325 VanDerWaalsContact O-N 3.1Å; L322-G325 PolarHBondContact O-N 3.3Å; G323-G325 VanDerWaalsContact C-N 3.34Å; G323-G325 PolarHBondContact O-N 2.64Å; G325-F329 WeakPolarHBondContact O-CB 3.16Å; G325-F329 PolarHBondContact O-N 2.98Å
326M98.7Very high98.4Very high27 Ų2748 Ų4813%0.13326%0.264CS..Hα-helixtrans-71.3-35.9176.4-67.2-166.374.700112.6L322 G323 V324 N328 F329 M330 A337 W340 P341 L344L322-M326 HydrophobicContact CD1-CG 3.94Å; L322-M326 HydrophobicContact CD1-SD 4.29Å; L322-M326 HydrophobicContact CG-CG 4.16Å; L322-M326 HydrophobicContact CG-SD 4.17Å; L322-M326 WeakPolarHBondContact O-CB 3.32Å; L322-M326 WeakPolarHBondContact O-CG 3.47Å; L322-M326 PolarHBondContact O-N 3.46Å; G323-M326 PolarHBondContact O-N 2.99Å; V324-M326 PolarHBondContact O-N 3.38Å; M326-N328 VanDerWaalsContact C-N 3.32Å; M326-N328 PolarHBondContact O-N 3.36Å; M326-F329 PolarHBondContact O-N 3.34Å; M326-M330 HydrophobicContact CE-SD 4.24Å; M326-M330 VanDerWaalsContact O-CB 3.32Å; M326-M330 WeakPolarHBondContact O-CB 3.4Å; M326-M330 VanDerWaalsContact O-CG 3.31Å; M326-M330 WeakPolarHBondContact O-CG 3.29Å; M326-M330 PolarHBondContact O-N 3.22Å; M326-A337 HydrophobicContact CB-CB 3.91Å; M326-W340 HydrophobicContact CE-CB 3.53Å; M326-W340 HydrophobicContact CE-CG 4.16Å; M326-W340 HydrophobicContact SD-CB 3.94Å; M326-P341 HydrophobicContact CB-CG 4.11Å; M326-P341 HydrophobicContact CG-CG 4.36Å; M326-P341 HydrophobicContact SD-CB 4.31Å; M326-P341 HydrophobicContact SD-CG 3.93Å; M326-L344 HydrophobicContact CE-CD1 3.9Å; M326-L344 HydrophobicContact SD-CD1 3.85Å
327A98.4Very high98.3Very high41 Ų4148.3 Ų48.334%0.33927%0.267SS..Hα-helixtrans-60.2-44.5175.800000111.1G323 V324 A331 A337G323-A327 WeakPolarHBondContact O-CB 3.46Å; G323-A327 PolarHBondContact O-N 2.97Å; V324-A327 PolarHBondContact O-N 3.23Å; A327-A331 VanDerWaalsContact O-CB 3.24Å; A327-A331 WeakPolarHBondContact O-CB 3.1Å; A327-A331 PolarHBondContact O-N 2.84Å; A327-A337 HydrophobicContact CB-CB 4.25Å
328N98.1Very high98.3Very high77 Ų7746.5 Ų46.541%0.41226%0.258SS..Hα-helixtrans-64.8-47.7175.1-67.9-14.8000111.6V324 M326 M330 A331V324-N328 VanDerWaalsContact O-CG 3.29Å; V324-N328 PolarHBondContact O-N 3.36Å; V324-N328 PolarHBondContact O-ND2 2.92Å; M326-N328 VanDerWaalsContact C-N 3.32Å; M326-N328 PolarHBondContact O-N 3.36Å; N328-M330 PolarHBondContact O-N 3.46Å; N328-A331 PolarHBondContact O-N 3.44Å
329F98.4Very high98.3Very high137 Ų13742.7 Ų42.760%0.60124%0.242SC*.Hα-helixtrans-58.8-46.9179.2171.5-105.6000112.5G325 M326 E332G325-F329 WeakPolarHBondContact O-CB 3.16Å; G325-F329 PolarHBondContact O-N 2.98Å; M326-F329 PolarHBondContact O-N 3.34Å; F329-E332 WeakPolarHBondContact O-CB 3.24Å; F329-E332 PolarHBondContact O-N 3.27Å
330M98.5Very high98.3Very high15 Ų1544.8 Ų44.87%0.07425%0.25CC..Hα-helixtrans-76.9-23.1-176.7-66.9-175.364.500112.9M326 N328 E332 D333 G334 L335 P336 A337M326-M330 HydrophobicContact CE-SD 4.24Å; M326-M330 VanDerWaalsContact O-CB 3.32Å; M326-M330 WeakPolarHBondContact O-CB 3.4Å; M326-M330 VanDerWaalsContact O-CG 3.31Å; M326-M330 WeakPolarHBondContact O-CG 3.29Å; M326-M330 PolarHBondContact O-N 3.22Å; N328-M330 PolarHBondContact O-N 3.46Å; M330-E332 PolarHBondContact O-N 2.93Å; M330-D333 CarbonylContact O-C 3.57Å; M330-D333 PolarHBondContact O-N 3.04Å; M330-D333 VanDerWaalsContact O-N 3.13Å; M330-G334 PolarHBondContact O-N 2.9Å; M330-L335 CarbonylContact C-O 3.6Å; M330-L335 HydrophobicContact CB-CB 4.15Å; M330-L335 WeakPolarHBondContact CB-O 3.48Å; M330-L335 HydrophobicContact CE-CB 3.9Å; M330-L335 HydrophobicContact CE-CD1 4.13Å; M330-L335 PolarHBondContact O-N 3.31Å; M330-P336 WeakPolarHBondContact CE-O 3.29Å; M330-A337 VanDerWaalsContact SD-CA 3.59Å; M330-A337 HydrophobicContact SD-CB 4.03Å
331A97.9Very high98.3Very high10 Ų1044.6 Ų44.68%0.08325%0.249CC..Hα-helixtrans-64.4-27.6173.700000112.6V203 P205 A327 N328 D333 G334 L335V203-A331 HydrophobicContact CG1-CB 3.88Å; P205-A331 HydrophobicContact CB-CB 4.29Å; A327-A331 VanDerWaalsContact O-CB 3.24Å; A327-A331 WeakPolarHBondContact O-CB 3.1Å; A327-A331 PolarHBondContact O-N 2.84Å; N328-A331 PolarHBondContact O-N 3.44Å; A331-D333 PolarHBondContact O-N 3.4Å; A331-G334 PolarHBondContact O-N 3.45Å; A331-L335 PolarHBondContact N-O 2.94Å
332E97.6Very high98.3Very high138 Ų13840 Ų4065%0.64523%0.231SC*.THydrogen-bonded Turntrans-59.7-31.5173-61.7-61.4150.700112.2P205 F329 M330P205-E332 VanDerWaalsContact CB-OE1 3.32Å; P205-E332 WeakPolarHBondContact CB-OE1 3.11Å; F329-E332 WeakPolarHBondContact O-CB 3.24Å; F329-E332 PolarHBondContact O-N 3.27Å; M330-E332 PolarHBondContact O-N 2.93Å
333D96.3Very high98.3Very high117 Ų11737.7 Ų37.763%0.62622%0.218SC*.THydrogen-bonded Turntrans-98.510.3176.1-64-57000112.8M330 A331 L335M330-D333 CarbonylContact O-C 3.57Å; M330-D333 PolarHBondContact O-N 3.04Å; M330-D333 VanDerWaalsContact O-N 3.13Å; A331-D333 PolarHBondContact O-N 3.4Å; D333-L335 VanDerWaalsContact C-N 3.34Å; D333-L335 PolarHBondContact O-N 3.23Å
334G97.3Very high98.3Very high35 Ų3540.8 Ų40.836%0.36123%0.232SC..THydrogen-bonded Turntrans70.524.818000000114.6M330 A331M330-G334 PolarHBondContact O-N 2.9Å; A331-G334 PolarHBondContact O-N 3.45Å
335L98.4Very high98.3Very high18 Ų1839.1 Ų39.19%0.09422%0.222CC..  trans-114.3145.7-176.7-66174.8000113.2L188 S189 M330 A331 D333L188-L335 HydrophobicContact CB-CD2 3.67Å; S189-L335 WeakPolarHBondContact OG-CD1 3.3Å; M330-L335 CarbonylContact C-O 3.6Å; M330-L335 HydrophobicContact CB-CB 4.15Å; M330-L335 WeakPolarHBondContact CB-O 3.48Å; M330-L335 HydrophobicContact CE-CB 3.9Å; M330-L335 HydrophobicContact CE-CD1 4.13Å; M330-L335 PolarHBondContact O-N 3.31Å; A331-L335 PolarHBondContact N-O 2.94Å; D333-L335 VanDerWaalsContact C-N 3.34Å; D333-L335 PolarHBondContact O-N 3.23Å
336P98.2Very high98.3Very high21 Ų2137.3 Ų37.314%0.13620%0.203CC..  trans-79.6143.516732.7-33.6000111.5F136 L188 M330 C338F136-P336 HydrophobicContact CD1-CG 4.22Å; F136-P336 HydrophobicContact CD2-CG 4.1Å; F136-P336 HydrophobicContact CE1-CB 3.76Å; F136-P336 HydrophobicContact CE1-CG 3.82Å; F136-P336 HydrophobicContact CE2-CB 4.09Å; F136-P336 HydrophobicContact CE2-CG 3.69Å; F136-P336 HydrophobicContact CG-CG 4.36Å; F136-P336 HydrophobicContact CZ-CB 3.48Å; F136-P336 VanDerWaalsContact CZ-CB 3.48Å; F136-P336 HydrophobicContact CZ-CG 3.55Å; L188-P336 HydrophobicContact CD1-CG 3.6Å; M330-P336 WeakPolarHBondContact CE-O 3.29Å; P336-C338 VanDerWaalsContact C-N 3.31Å; P336-C338 PolarHBondContact O-N 3.5Å
337A98.2Very high98.4Very high8 Ų836.8 Ų36.87%0.06620%0.201CC..  trans-71.8-23.3176.400000114.4M326 A327 M330 T339 W340 P341M326-A337 HydrophobicContact CB-CB 3.91Å; A327-A337 HydrophobicContact CB-CB 4.25Å; M330-A337 VanDerWaalsContact SD-CA 3.59Å; M330-A337 HydrophobicContact SD-CB 4.03Å; A337-T339 PolarHBondContact O-N 2.82Å; A337-W340 WeakPolarHBondContact O-CB 3.41Å; A337-W340 PolarHBondContact O-N 3.37Å; A337-P341 HydrophobicContact CB-CG 4.36Å
338C98.5Very high98.4Very high15 Ų1539.6 Ų39.610%0.10121%0.21CC..THydrogen-bonded Turntrans46.8-126.4-178.1-58.90000111.3F180 N181 L184 F288 N289 P336F180-C338 HydrophobicContact CE1-CB 3.91Å; F180-C338 HydrophobicContact CZ-CB 4.03Å; N181-C338 WeakPolarHBondContact OD1-CB 3.45Å; L184-C338 VanDerWaalsContact CD2-SG 3.56Å; F288-C338 VanDerWaalsContact CE2-O 3.24Å; F288-C338 WeakPolarHBondContact CE2-O 3.47Å; N289-C338 PolarHBondContact ND2-O 3.39Å; N289-C338 PolarHBondContact OD1-O 3.32Å; P336-C338 VanDerWaalsContact C-N 3.31Å; P336-C338 PolarHBondContact O-N 3.5Å
339T98.7Very high98.4Very high5 Ų537.6 Ų37.63%0.03120%0.197CC..THydrogen-bonded Turntrans-105.916.9-178.257.30000114.1T177 F180 N181 F288 N289 L292 A337 P341 F342 C343T177-T339 PolarHBondContact OG1-OG1 3.04Å; F180-T339 WeakPolarHBondContact CE1-OG1 3.48Å; N181-T339 VanDerWaalsContact ND2-C 3.29Å; N181-T339 PolarHBondContact ND2-OG1 2.96Å; N181-T339 PolarHBondContact OD1-N 3.32Å; N181-T339 PolarHBondContact OD1-OG1 3.13Å; F288-T339 HydrophobicContact CD2-CG2 3.91Å; F288-T339 HydrophobicContact CE2-CG2 3.88Å; N289-T339 VanDerWaalsContact OD1-CA 3.29Å; N289-T339 WeakPolarHBondContact OD1-CA 3.49Å; L292-T339 HydrophobicContact CD1-CG2 3.76Å; A337-T339 PolarHBondContact O-N 2.82Å; T339-P341 VanDerWaalsContact C-N 3.29Å; T339-F342 PolarHBondContact O-N 3.15Å; T339-C343 PolarHBondContact O-N 3.46Å; T339-C343 VanDerWaalsContact O-N 3.11Å; T339-C343 PolarHBondContact O-SG 3.17Å
340W98.9Very high98.4Very high43 Ų4331.4 Ų31.416%0.16317%0.171CC..Hα-helixtrans-50.7-45.1166.2-79.9113000112.7L178 N181 M182 S185 M326 A337 F342 C343 L344L178-W340 HydrophobicContact CD2-CE3 3.87Å; L178-W340 HydrophobicContact CD2-CH2 4.31Å; L178-W340 HydrophobicContact CD2-CZ3 3.47Å; L178-W340 VanDerWaalsContact CD2-CZ3 3.47Å; N181-W340 HydrophobicContact CB-CD2 3.74Å; N181-W340 VanDerWaalsContact CB-CE2 3.49Å; N181-W340 HydrophobicContact CB-CE3 4.42Å; N181-W340 HydrophobicContact CB-CG 3.94Å; N181-W340 HydrophobicContact CB-CZ2 3.95Å; N181-W340 PolarHBondContact ND2-N 3.06Å; N181-W340 PolarHBondContact OD1-N 2.94Å; N181-W340 VanDerWaalsContact OD1-N 3.12Å; M182-W340 HydrophobicContact CE-CH2 4.07Å; M182-W340 HydrophobicContact CG-CH2 3.59Å; M182-W340 HydrophobicContact CG-CZ2 3.84Å; S185-W340 PolarHBondContact OG-NE1 2.94Å; S185-W340 VanDerWaalsContact OG-NE1 3.09Å; M326-W340 HydrophobicContact CE-CB 3.53Å; M326-W340 HydrophobicContact CE-CG 4.16Å; M326-W340 HydrophobicContact SD-CB 3.94Å; A337-W340 WeakPolarHBondContact O-CB 3.41Å; A337-W340 PolarHBondContact O-N 3.37Å; W340-F342 PolarHBondContact O-N 2.78Å; W340-C343 PolarHBondContact O-N 2.92Å; W340-L344 HydrophobicContact CE3-CD1 4.5Å; W340-L344 HydrophobicContact CE3-CG 4.45Å; W340-L344 WeakPolarHBondContact O-CG 3.34Å; W340-L344 PolarHBondContact O-N 3.12Å
341P98.9Very high98.4Very high0 Ų035.7 Ų35.70%019%0.192CC..Hα-helixtrans-58.9-47.3179.7-22.732.8000112.6N289 L322 M326 A337 T339 C343 A345N289-P341 HydrophobicContact CB-CB 4.41Å; L322-P341 HydrophobicContact CB-CB 4.43Å; L322-P341 HydrophobicContact CD2-CB 4.46Å; L322-P341 HydrophobicContact CG-CB 4.17Å; M326-P341 HydrophobicContact CB-CG 4.11Å; M326-P341 HydrophobicContact CG-CG 4.36Å; M326-P341 HydrophobicContact SD-CB 4.31Å; M326-P341 HydrophobicContact SD-CG 3.93Å; A337-P341 HydrophobicContact CB-CG 4.36Å; T339-P341 VanDerWaalsContact C-N 3.29Å; P341-C343 PolarHBondContact O-N 3.27Å; P341-A345 WeakPolarHBondContact O-CB 3.37Å; P341-A345 PolarHBondContact O-N 3.42Å
342F98.9Very high98.4Very high0 Ų039.4 Ų39.40%021%0.209CC..Hα-helixtrans-55.9-50.8175.3150.1-109.1000111.8F71 F176 T177 N289 L292 A293 A296 T319 T339 W340 T346F71-F342 AromaticContact CE1-CZ 3.96Å; F71-F342 HydrophobicContact CE1-CZ 3.96Å; F71-F342 HydrophobicContact CZ-CE1 4.22Å; F71-F342 AromaticContact CZ-CE2 3.84Å; F71-F342 HydrophobicContact CZ-CE2 3.84Å; F71-F342 AromaticContact CZ-CZ 3.4Å; F71-F342 HydrophobicContact CZ-CZ 3.4Å; F176-F342 HydrophobicContact CB-CE1 3.81Å; F176-F342 HydrophobicContact CB-CZ 3.92Å; F176-F342 HydrophobicContact CD1-CE1 4.32Å; F176-F342 HydrophobicContact CD1-CE2 4.49Å; F176-F342 AromaticContact CD1-CZ 3.59Å; F176-F342 HydrophobicContact CD1-CZ 3.59Å; F176-F342 HydrophobicContact CD2-CZ 4.2Å; F176-F342 HydrophobicContact CE1-CZ 4.03Å; F176-F342 HydrophobicContact CG-CE1 4.1Å; F176-F342 AromaticContact CG-CZ 3.67Å; F176-F342 HydrophobicContact CG-CZ 3.67Å; T177-F342 HydrophobicContact CG2-CE1 4.42Å; N289-F342 HydrophobicContact CB-CB 4.29Å; N289-F342 WeakPolarHBondContact OD1-CB 3.24Å; N289-F342 PolarHBondContact OD1-N 3.39Å; L292-F342 HydrophobicContact CB-CB 4.31Å; L292-F342 HydrophobicContact CB-CD1 4.18Å; L292-F342 HydrophobicContact CB-CD2 3.49Å; L292-F342 VanDerWaalsContact CB-CD2 3.49Å; L292-F342 HydrophobicContact CB-CE1 4.48Å; L292-F342 HydrophobicContact CB-CE2 3.88Å; L292-F342 HydrophobicContact CB-CG 3.69Å; L292-F342 HydrophobicContact CB-CZ 4.38Å; L292-F342 HydrophobicContact CD1-CB 4.46Å; L292-F342 HydrophobicContact CD1-CD1 3.87Å; L292-F342 HydrophobicContact CD1-CE1 4.35Å; L292-F342 HydrophobicContact CD1-CG 4.04Å; A293-F342 HydrophobicContact CB-CD2 4.16Å; A296-F342 HydrophobicContact CB-CE2 4.22Å; T319-F342 HydrophobicContact CG2-CB 4.33Å; T339-F342 PolarHBondContact O-N 3.15Å; W340-F342 PolarHBondContact O-N 2.78Å; F342-T346 VanDerWaalsContact CD2-OG1 3.26Å; F342-T346 WeakPolarHBondContact CD2-OG1 3.45Å; F342-T346 HydrophobicContact CE2-CG2 4.3Å; F342-T346 VanDerWaalsContact CE2-OG1 3.3Å; F342-T346 WeakPolarHBondContact CE2-OG1 3.35Å; F342-T346 VanDerWaalsContact O-CB 3.24Å; F342-T346 WeakPolarHBondContact O-CB 3.2Å; F342-T346 PolarHBondContact O-N 2.89Å; F342-T346 PolarHBondContact O-OG1 2.81Å
343C98.9Very high98.4Very high0 Ų039.1 Ų39.10%022%0.217CC..Hα-helixtrans-60-51.3-177.4-72.10000111.6T177 L178 T339 W340 P341 L347T177-C343 PolarHBondContact OG1-SG 3.34Å; L178-C343 HydrophobicContact CD2-CB 3.59Å; L178-C343 HydrophobicContact CG-CB 3.93Å; T339-C343 PolarHBondContact O-N 3.46Å; T339-C343 VanDerWaalsContact O-N 3.11Å; T339-C343 PolarHBondContact O-SG 3.17Å; W340-C343 PolarHBondContact O-N 2.92Å; P341-C343 PolarHBondContact O-N 3.27Å; C343-L347 WeakPolarHBondContact O-CB 3.35Å; C343-L347 WeakPolarHBondContact O-CD1 3.32Å; C343-L347 WeakPolarHBondContact O-CG 3.21Å; C343-L347 PolarHBondContact O-N 2.94Å
344L98.9Very high98.5Very high76 Ų7636.9 Ų36.940%0.39821%0.208SC..Hα-helixtrans-68.1-44.6-175.4-63.7178.6000111.7L322 M326 W340 L348L322-L344 HydrophobicContact CD2-CB 4.2Å; M326-L344 HydrophobicContact CE-CD1 3.9Å; M326-L344 HydrophobicContact SD-CD1 3.85Å; W340-L344 HydrophobicContact CE3-CD1 4.5Å; W340-L344 HydrophobicContact CE3-CG 4.45Å; W340-L344 WeakPolarHBondContact O-CG 3.34Å; W340-L344 PolarHBondContact O-N 3.12Å; L344-L348 WeakPolarHBondContact O-CB 3.45Å; L344-L348 PolarHBondContact O-N 3.24Å
345A98.9Very high98.4Very high0 Ų045.6 Ų45.60%024%0.236CC..Hα-helixtrans-62.8-48.3177.200000111.8F318 T319 L322 P341 L347 L348 F349F318-A345 HydrophobicContact CD1-CB 3.68Å; F318-A345 HydrophobicContact CE1-CB 3.83Å; T319-A345 HydrophobicContact CG2-CB 4.23Å; T319-A345 WeakPolarHBondContact OG1-CB 3.17Å; L322-A345 HydrophobicContact CD2-CB 4.04Å; P341-A345 WeakPolarHBondContact O-CB 3.37Å; P341-A345 PolarHBondContact O-N 3.42Å; A345-L347 PolarHBondContact O-N 3.34Å; A345-L348 WeakPolarHBondContact O-CB 3.4Å; A345-L348 PolarHBondContact O-N 2.87Å; A345-F349 WeakPolarHBondContact O-CD2 3.36Å; A345-F349 PolarHBondContact O-N 3.44Å
346T98.9Very high98.4Very high0 Ų047.7 Ų47.70%025%0.247CC..Hα-helixtrans-67.6-40-176.3-50.60000111.2F176 A296 M297 F342 F349 L350F176-T346 HydrophobicContact CE1-CG2 4.37Å; F176-T346 HydrophobicContact CE2-CG2 3.62Å; F176-T346 HydrophobicContact CZ-CG2 3.4Å; A296-T346 HydrophobicContact CB-CG2 3.74Å; M297-T346 HydrophobicContact CG-CG2 4.22Å; M297-T346 HydrophobicContact SD-CG2 4.02Å; F342-T346 VanDerWaalsContact CD2-OG1 3.26Å; F342-T346 WeakPolarHBondContact CD2-OG1 3.45Å; F342-T346 HydrophobicContact CE2-CG2 4.3Å; F342-T346 VanDerWaalsContact CE2-OG1 3.3Å; F342-T346 WeakPolarHBondContact CE2-OG1 3.35Å; F342-T346 VanDerWaalsContact O-CB 3.24Å; F342-T346 WeakPolarHBondContact O-CB 3.2Å; F342-T346 PolarHBondContact O-N 2.89Å; F342-T346 PolarHBondContact O-OG1 2.81Å; T346-F349 PolarHBondContact O-N 3.43Å; T346-L350 HydrophobicContact CG2-CD1 4.29Å; T346-L350 HydrophobicContact CG2-CG 4.46Å; T346-L350 WeakPolarHBondContact O-CB 3.34Å; T346-L350 WeakPolarHBondContact O-CG 2.85Å; T346-L350 PolarHBondContact O-N 3.01Å
347L98.9Very high98.2Very high17 Ų1750.7 Ų50.79%0.08927%0.269CS..Hα-helixtrans-61.6-43.8173.9-73.8170.7000111.8L173 F176 L178 C343 A345 F349 L350 I351L173-L347 HydrophobicContact CB-CD2 4.02Å; L173-L347 HydrophobicContact CD1-CD2 4.23Å; L173-L347 HydrophobicContact CD2-CD2 4.31Å; L173-L347 HydrophobicContact CG-CD2 4.42Å; F176-L347 HydrophobicContact CD2-CD1 4.49Å; F176-L347 HydrophobicContact CD2-CD2 4Å; F176-L347 HydrophobicContact CD2-CG 3.86Å; F176-L347 HydrophobicContact CE2-CD2 3.86Å; F176-L347 HydrophobicContact CE2-CG 3.89Å; L178-L347 HydrophobicContact CD1-CD1 3.83Å; C343-L347 WeakPolarHBondContact O-CB 3.35Å; C343-L347 WeakPolarHBondContact O-CD1 3.32Å; C343-L347 WeakPolarHBondContact O-CG 3.21Å; C343-L347 PolarHBondContact O-N 2.94Å; A345-L347 PolarHBondContact O-N 3.34Å; L347-F349 VanDerWaalsContact C-N 3.3Å; L347-F349 PolarHBondContact O-N 3.47Å; L347-L350 PolarHBondContact O-N 3.5Å; L347-I351 WeakPolarHBondContact O-CB 3.37Å; L347-I351 WeakPolarHBondContact O-CD1 3.34Å; L347-I351 VanDerWaalsContact O-CG1 3.24Å; L347-I351 WeakPolarHBondContact O-CG1 3.48Å; L347-I351 PolarHBondContact O-N 3.36Å
348L98.8Very high98.2Very high100 Ų10052.3 Ų52.352%0.52428%0.276SS..Hα-helixtrans-56.4-45.9175.8177.564.8000111.3F318 L344 A345 I351 M352F318-L348 HydrophobicContact CE1-CD2 4.2Å; F318-L348 HydrophobicContact CZ-CD2 4Å; L344-L348 WeakPolarHBondContact O-CB 3.45Å; L344-L348 PolarHBondContact O-N 3.24Å; A345-L348 WeakPolarHBondContact O-CB 3.4Å; A345-L348 PolarHBondContact O-N 2.87Å; L348-I351 PolarHBondContact O-N 3.11Å; L348-M352 PolarHBondContact O-N 2.92Å
349F98.7Very high98.1Very high34 Ų3453.3 Ų53.315%0.14928%0.28CS..Hα-helixtrans-69.8-31.8179.2-84.4-114.7000113.2M297 L311 C315 F318 A345 T346 L347 M352M297-F349 HydrophobicContact CE-CB 3.78Å; M297-F349 HydrophobicContact CE-CD1 4.41Å; M297-F349 HydrophobicContact SD-CB 4.13Å; L311-F349 HydrophobicContact CD1-CD1 3.78Å; L311-F349 HydrophobicContact CD1-CE1 3.9Å; L311-F349 HydrophobicContact CG-CD1 4.15Å; C315-F349 VanDerWaalsContact CA-CE1 3.49Å; C315-F349 HydrophobicContact CB-CD1 3.52Å; C315-F349 HydrophobicContact CB-CD2 4.4Å; C315-F349 HydrophobicContact CB-CE1 3.56Å; C315-F349 HydrophobicContact CB-CE2 4.42Å; C315-F349 HydrophobicContact CB-CG 3.96Å; C315-F349 HydrophobicContact CB-CZ 4.03Å; C315-F349 VanDerWaalsContact SG-CG 3.59Å; F318-F349 HydrophobicContact CB-CE2 4.09Å; F318-F349 HydrophobicContact CB-CZ 4.02Å; F318-F349 AromaticContact CD1-CE2 3.78Å; F318-F349 HydrophobicContact CD1-CE2 3.78Å; F318-F349 HydrophobicContact CD2-CE2 4.5Å; F318-F349 HydrophobicContact CE1-CE2 4.36Å; F318-F349 AromaticContact CG-CE2 3.86Å; F318-F349 HydrophobicContact CG-CE2 3.86Å; F318-F349 HydrophobicContact CG-CZ 4.23Å; A345-F349 WeakPolarHBondContact O-CD2 3.36Å; A345-F349 PolarHBondContact O-N 3.44Å; T346-F349 PolarHBondContact O-N 3.43Å; L347-F349 VanDerWaalsContact C-N 3.3Å; L347-F349 PolarHBondContact O-N 3.47Å; F349-M352 WeakPolarHBondContact O-CB 3.29Å
350L98.6Very high98.1Very high8 Ų856 Ų564%0.04229%0.29CS..Hα-helixtrans-76.2-25.2175.3-72.3178.3000113.5L173 P174 F176 M297 F301 M302 T346 L347L173-L350 HydrophobicContact CD2-CB 3.63Å; L173-L350 HydrophobicContact CD2-CD1 4.33Å; P174-L350 HydrophobicContact CG-CD1 4.35Å; F176-L350 HydrophobicContact CE2-CD1 4.09Å; F176-L350 HydrophobicContact CZ-CD1 3.71Å; M297-L350 HydrophobicContact CE-CD2 4.43Å; M297-L350 HydrophobicContact SD-CD2 3.79Å; M297-L350 HydrophobicContact SD-CG 4.02Å; F301-L350 HydrophobicContact CB-CD1 4.02Å; F301-L350 HydrophobicContact CB-CD2 3.81Å; F301-L350 HydrophobicContact CG-CD1 4.39Å; M302-L350 HydrophobicContact CG-CD2 3.97Å; M302-L350 HydrophobicContact SD-CD2 3.74Å; T346-L350 HydrophobicContact CG2-CD1 4.29Å; T346-L350 HydrophobicContact CG2-CG 4.46Å; T346-L350 WeakPolarHBondContact O-CB 3.34Å; T346-L350 WeakPolarHBondContact O-CG 2.85Å; T346-L350 PolarHBondContact O-N 3.01Å; L347-L350 PolarHBondContact O-N 3.5Å
351I98.4Very high98.1Very high104 Ų10456.6 Ų56.653%0.53329%0.294SS..Hα-helixtrans-77.8-27.7175.1-70.6163.7000111.3L173 L347 L348 T353L173-I351 HydrophobicContact CD1-CD1 3.81Å; L173-I351 HydrophobicContact CD1-CG1 3.54Å; L173-I351 HydrophobicContact CD2-CG1 4.29Å; L347-I351 WeakPolarHBondContact O-CB 3.37Å; L347-I351 WeakPolarHBondContact O-CD1 3.34Å; L347-I351 VanDerWaalsContact O-CG1 3.24Å; L347-I351 WeakPolarHBondContact O-CG1 3.48Å; L347-I351 PolarHBondContact O-N 3.36Å; L348-I351 PolarHBondContact O-N 3.11Å; I351-T353 PolarHBondContact O-N 2.81Å
352M98.1Very high98.1Very high89 Ų8956.7 Ų56.744%0.43829%0.294SS..  trans-55.5127.2178-177.5-164.966.400111.1L311 L348 F349L311-M352 HydrophobicContact CD1-CE 3.99Å; L311-M352 HydrophobicContact CD2-CE 3.88Å; L348-M352 PolarHBondContact O-N 2.92Å; F349-M352 WeakPolarHBondContact O-CB 3.29Å
353T97.4Very high98Very high132 Ų13258.4 Ų58.481%0.8131%0.305SS*.  trans-100.7153.4173.663.40000110.9I351I351-T353 PolarHBondContact O-N 2.81Å
354T97.2Very high97.9Very high70 Ų7060.5 Ų60.543%0.42932%0.316SS..  trans-151.2151178.3177.60000110.7N356 I359T354-N356 VanDerWaalsContact C-N 3.26Å; T354-N356 HydrophobicContact CG2-CB 4.5Å; T354-N356 PolarHBondContact OG1-N 2.86Å; T354-I359 HydrophobicContact CG2-CB 3.61Å; T354-I359 HydrophobicContact CG2-CD1 4.13Å; T354-I359 HydrophobicContact CG2-CG1 4.43Å; T354-I359 HydrophobicContact CG2-CG2 3.62Å
355K97.1Very high97.8Very high218 Ų21861.9 Ų61.995%0.94833%0.332SS*.SBendtrans-81.4-4.6173.9-65.1-175.2178.6-179.50112.8S357K355-S357 PolarHBondContact O-N 2.96Å
356N97.1Very high97.8Very high61 Ų6167 Ų6733%0.32636%0.355SS..  trans-79.4108.1178.1-170.9-20.8000110.7T354 N358 I359T354-N356 VanDerWaalsContact C-N 3.26Å; T354-N356 HydrophobicContact CG2-CB 4.5Å; T354-N356 PolarHBondContact OG1-N 2.86Å; N356-N358 PolarHBondContact O-N 3.29Å; N356-N358 WeakPolarHBondContact OD1-CB 3.27Å; N356-N358 PolarHBondContact OD1-N 3.02Å; N356-N358 PolarHBondContact OD1-ND2 3.16Å; N356-I359 HydrophobicContact CB-CD1 4.24Å; N356-I359 HydrophobicContact CB-CG1 4.39Å; N356-I359 PolarHBondContact O-N 2.88Å
357S95.1Very high97.7Very high85 Ų8568.4 Ų68.459%0.59436%0.363SS*.THydrogen-bonded Turntrans-63.3-9-179.262.80000115.2K355 Y377K355-S357 PolarHBondContact O-N 2.96Å; S357-Y377 PolarHBondContact O-OH 3.5Å
358N96.9Very high97.7Very high41 Ų4169.3 Ų69.322%0.21937%0.369CS..THydrogen-bonded Turntrans-88.1-11174.4-54.2-70000113.7T305 Q307 N356 Y377 K381T305-N358 WeakPolarHBondContact CG2-O 3.43Å; T305-N358 PolarHBondContact OG1-O 3.04Å; Q307-N358 HydrophobicContact CG-CB 4.1Å; Q307-N358 VanDerWaalsContact NE2-CG 3.33Å; Q307-N358 PolarHBondContact NE2-ND2 3.49Å; N356-N358 PolarHBondContact O-N 3.29Å; N356-N358 WeakPolarHBondContact OD1-CB 3.27Å; N356-N358 PolarHBondContact OD1-N 3.02Å; N356-N358 PolarHBondContact OD1-ND2 3.16Å; N358-Y377 WeakPolarHBondContact CA-OH 3.32Å; N358-K381 PolarHBondContact OD1-NZ 3.14Å
359I98.1Very high97.7Very high36 Ų3667 Ų6719%0.18535%0.354CS..SBendtrans-101.693.9172.8-60.6175.4000106.6M302 Q307 T308 L311 T354 N356M302-I359 HydrophobicContact CE-CG2 3.4Å; M302-I359 VanDerWaalsContact CE-CG2 3.4Å; Q307-I359 HydrophobicContact CB-CD1 4.41Å; Q307-I359 HydrophobicContact CB-CG1 3.85Å; T308-I359 HydrophobicContact CG2-CB 4.32Å; T308-I359 HydrophobicContact CG2-CG1 4.36Å; T308-I359 HydrophobicContact CG2-CG2 4.21Å; L311-I359 HydrophobicContact CD2-CG2 4.02Å; T354-I359 HydrophobicContact CG2-CB 3.61Å; T354-I359 HydrophobicContact CG2-CD1 4.13Å; T354-I359 HydrophobicContact CG2-CG1 4.43Å; T354-I359 HydrophobicContact CG2-CG2 3.62Å; N356-I359 HydrophobicContact CB-CD1 4.24Å; N356-I359 HydrophobicContact CB-CG1 4.39Å; N356-I359 PolarHBondContact O-N 2.88Å
360Y98.1Very high97.7Very high62 Ų6265.4 Ų65.424%0.24335%0.347CS..  trans-119.3118.3-170.4-179.5-91.7000110.8M302 A303 M362 F376 Y377M302-Y360 CarbonylContact C-O 3.57Å; M302-Y360 WeakPolarHBondContact CA-O 3.16Å; A303-Y360 HydrophobicContact CB-CD1 4.01Å; A303-Y360 PolarHBondContact N-O 2.92Å; Y360-M362 HydrophobicContact CD1-SD 4.23Å; Y360-M362 HydrophobicContact CE1-SD 4.08Å; Y360-F376 HydrophobicContact CE1-CE1 4.47Å; Y360-Y377 VanDerWaalsContact CB-CE2 3.5Å; Y360-Y377 AromaticContact CD1-CD2 3.6Å; Y360-Y377 HydrophobicContact CD1-CD2 3.6Å; Y360-Y377 HydrophobicContact CD1-CE2 4.28Å; Y360-Y377 HydrophobicContact CD1-CG 4.44Å; Y360-Y377 HydrophobicContact CD2-CD2 4.16Å; Y360-Y377 HydrophobicContact CD2-CE2 4.18Å; Y360-Y377 HydrophobicContact CE1-CD2 4.26Å; Y360-Y377 AromaticContact CG-CD2 3.54Å; Y360-Y377 HydrophobicContact CG-CD2 3.54Å; Y360-Y377 AromaticContact CG-CE2 3.74Å; Y360-Y377 HydrophobicContact CG-CE2 3.74Å
361K98.5Very high97.7Very high56 Ų5667.5 Ų67.524%0.24336%0.356CS..BIsolated β-bridgetrans-75.5129.3171.8177.4172.1173.8-79.20110D172 M302D172-K361 WeakPolarHBondContact O-CE 3.25Å; D172-K361 PolarHBondContact O-NZ 3.1Å; D172-K361 IonicContact OD2-NZ 3.81Å; D172-K361 PolarHBondContact OD2-NZ 3.31Å; M302-K361 HydrophobicContact CE-CB 4.5Å; M302-K361 VanDerWaalsContact SD-CA 3.51Å; M302-K361 HydrophobicContact SD-CB 3.76Å; M302-K361 HydrophobicContact SD-CG 4.31Å
362M98.4Very high97.7Very high2 Ų265.5 Ų65.51%0.0135%0.345CS..PPolyproline II helixtrans-72.4133.6177-68.8-64.9-63.900110.1F301 A303 Y360 L364 K366 V367 N373 F376F301-M362 PolarHBondContact O-N 3.49Å; A303-M362 HydrophobicContact CB-SD 3.94Å; Y360-M362 HydrophobicContact CD1-SD 4.23Å; Y360-M362 HydrophobicContact CE1-SD 4.08Å; M362-L364 PolarHBondContact O-N 2.91Å; M362-K366 HydrophobicContact CE-CB 4.43Å; M362-V367 HydrophobicContact CB-CG2 3.59Å; M362-N373 HydrophobicContact CE-CB 3.68Å; M362-N373 HydrophobicContact CG-CB 4.44Å; M362-N373 HydrophobicContact SD-CB 4.11Å; M362-F376 HydrophobicContact CE-CB 4.33Å; M362-F376 HydrophobicContact CE-CD1 3.59Å; M362-F376 HydrophobicContact CE-CE1 4.3Å; M362-F376 HydrophobicContact CE-CG 4.22Å; M362-F376 HydrophobicContact SD-CD1 4.18Å
363P97.9Very high97.7Very high36 Ų3661.3 Ų61.323%0.23432%0.324CS..PPolyproline II helixtrans-61131165.8-19.831.8000109.7D172 S365 K366 V367 F376D172-P363 WeakPolarHBondContact OD2-CA 3.35Å; P363-S365 PolarHBondContact O-N 3.3Å; P363-S365 VanDerWaalsContact O-N 3.17Å; P363-K366 HydrophobicContact CB-CG 4.32Å; P363-K366 WeakPolarHBondContact O-CA 3.25Å; P363-K366 PolarHBondContact O-N 3.35Å; P363-V367 PolarHBondContact O-N 3.3Å; P363-F376 HydrophobicContact CG-CE1 4.42Å
364L96.8Very high97.8Very high44 Ų4459.9 Ų59.923%0.2330%0.304CS..G310 helixtrans-58.7-36.2-173.9-70.2-179.9000113.2D172 P174 F301 M362 K366 V367D172-L364 VanDerWaalsContact C-CD1 3.42Å; D172-L364 WeakPolarHBondContact O-CD1 3.45Å; D172-L364 WeakPolarHBondContact O-CG 3.13Å; D172-L364 VanDerWaalsContact OD1-CB 3.32Å; D172-L364 WeakPolarHBondContact OD1-CB 3.27Å; D172-L364 WeakPolarHBondContact OD1-CG 3.37Å; D172-L364 PolarHBondContact OD1-N 3.28Å; D172-L364 VanDerWaalsContact OD1-N 3.07Å; D172-L364 PolarHBondContact OD2-N 3.3Å; P174-L364 HydrophobicContact CB-CD2 4.26Å; P174-L364 HydrophobicContact CG-CD2 4.46Å; F301-L364 HydrophobicContact CD1-CD2 3.81Å; F301-L364 HydrophobicContact CE1-CD2 3.88Å; M362-L364 PolarHBondContact O-N 2.91Å; L364-K366 PolarHBondContact O-N 3.01Å; L364-V367 HydrophobicContact CD2-CG2 4.39Å; L364-V367 PolarHBondContact O-N 3.49Å; L364-V367 VanDerWaalsContact O-N 3.13Å
365S96.5Very high97.8Very high104 Ų10461.1 Ų61.173%0.72731%0.307SS*.G310 helixtrans-62.2-10.1175.962.90000114.7P363P363-S365 PolarHBondContact O-N 3.3Å; P363-S365 VanDerWaalsContact O-N 3.17Å
366K97.6Very high97.9Very high109 Ų10953.6 Ų53.647%0.47427%0.274SS..G310 helixtrans-115.7-5.8179.4-58.3-61178.7-168.70113.3M362 P363 L364 T368 F376M362-K366 HydrophobicContact CE-CB 4.43Å; P363-K366 HydrophobicContact CB-CG 4.32Å; P363-K366 WeakPolarHBondContact O-CA 3.25Å; P363-K366 PolarHBondContact O-N 3.35Å; L364-K366 PolarHBondContact O-N 3.01Å; K366-T368 PolarHBondContact O-N 3.43Å; K366-F376 HydrophobicContact CB-CD2 4.49Å; K366-F376 HydrophobicContact CB-CE1 4.32Å; K366-F376 HydrophobicContact CB-CE2 4.27Å; K366-F376 HydrophobicContact CB-CZ 4.19Å; K366-F376 HydrophobicContact CD-CE2 3.98Å; K366-F376 HydrophobicContact CD-CZ 4.41Å; K366-F376 HydrophobicContact CG-CD2 4.45Å; K366-F376 HydrophobicContact CG-CE1 4.35Å; K366-F376 HydrophobicContact CG-CE2 3.81Å; K366-F376 HydrophobicContact CG-CZ 3.76Å
367V98.3Very high97.9Very high29 Ų2951 Ų5118%0.17626%0.26CS..  trans-68.6126178.9170.60000109.6M300 F301 M362 P363 L364M300-V367 HydrophobicContact CE-CG1 3.59Å; M300-V367 HydrophobicContact CG-CG1 4.42Å; M300-V367 HydrophobicContact SD-CG1 4.29Å; F301-V367 HydrophobicContact CD1-CG1 4.35Å; F301-V367 HydrophobicContact CD1-CG2 4.23Å; F301-V367 HydrophobicContact CE1-CG1 4.15Å; M362-V367 HydrophobicContact CB-CG2 3.59Å; P363-V367 PolarHBondContact O-N 3.3Å; L364-V367 HydrophobicContact CD2-CG2 4.39Å; L364-V367 PolarHBondContact O-N 3.49Å; L364-V367 VanDerWaalsContact O-N 3.13Å
368T98.2Very high98Very high35 Ų3550.5 Ų50.522%0.21525%0.25CS..  trans-132.3-82175.448.30000110.4M300 K366 N373M300-T368 WeakPolarHBondContact CE-O 3.35Å; K366-T368 PolarHBondContact O-N 3.43Å; T368-N373 PolarHBondContact N-OD1 2.85Å; T368-N373 PolarHBondContact OG1-OD1 3.49Å; T368-N373 VanDerWaalsContact OG1-OD1 3.12Å
369Y98.6Very high98Very high52 Ų5253.3 Ų53.320%0.20426%0.262CS..  trans-150.6158.2173.257.6-84000109.8E371 E372 N373Y369-E371 VanDerWaalsContact C-N 3.33Å; Y369-E371 HydrophobicContact CD2-CB 4.01Å; Y369-E371 WeakPolarHBondContact CD2-OE2 3.41Å; Y369-E371 HydrophobicContact CE2-CB 3.84Å; Y369-E371 PolarHBondContact O-N 2.88Å; Y369-E371 VanDerWaalsContact O-N 3.13Å; Y369-E372 HydrophobicContact CD1-CB 4.39Å; Y369-E372 HydrophobicContact CD2-CB 4.46Å; Y369-E372 HydrophobicContact CE1-CB 3.92Å; Y369-E372 WeakPolarHBondContact CE1-OE2 3.43Å; Y369-E372 HydrophobicContact CE2-CB 4.04Å; Y369-E372 PolarHBondContact O-N 3.45Å; Y369-E372 VanDerWaalsContact O-N 3.09Å; Y369-E372 PolarHBondContact OH-OE2 3.47Å; Y369-N373 WeakPolarHBondContact O-CB 3.44Å; Y369-N373 PolarHBondContact O-N 2.92Å; Y369-N373 PolarHBondContact O-ND2 2.95Å; Y369-N373 PolarHBondContact O-OD1 2.79Å
370P98.8Very high97.7Very high0 Ų052.7 Ų52.70%026%0.262CS..Hα-helixtrans-52.4-40.1-165.9-33.238.4000116.7L255 M256 G299 R374L255-P370 HydrophobicContact CB-CB 3.82Å; L255-P370 HydrophobicContact CB-CG 4.27Å; L255-P370 HydrophobicContact CD1-CB 3.86Å; M256-P370 VanDerWaalsContact CG-CD 3.46Å; M256-P370 HydrophobicContact CG-CG 3.53Å; M256-P370 HydrophobicContact SD-CG 4.43Å; G299-P370 WeakPolarHBondContact O-CA 3.2Å; P370-R374 VanDerWaalsContact O-CB 3.3Å; P370-R374 WeakPolarHBondContact O-CB 3.38Å; P370-R374 PolarHBondContact O-N 3.49Å
371E98.6Very high97.4Very high52 Ų5252.8 Ų52.824%0.24326%0.264CS..Hα-helixtrans-63-46.8179.8-67.279.7175.900111.4S253 P254 L255 Y369 I375S253-E371 WeakPolarHBondContact CB-OE2 3.25Å; S253-E371 VanDerWaalsContact OG-CD 3.24Å; S253-E371 PolarHBondContact OG-OE1 3.27Å; S253-E371 VanDerWaalsContact OG-OE1 3.05Å; S253-E371 PolarHBondContact OG-OE2 2.91Å; P254-E371 WeakPolarHBondContact CD-OE1 3.27Å; L255-E371 WeakPolarHBondContact CB-OE1 3.37Å; L255-E371 HydrophobicContact CD1-CG 3.85Å; L255-E371 HydrophobicContact CG-CG 4.37Å; L255-E371 WeakPolarHBondContact CG-OE1 3.39Å; L255-E371 PolarHBondContact N-OE1 3.25Å; Y369-E371 VanDerWaalsContact C-N 3.33Å; Y369-E371 HydrophobicContact CD2-CB 4.01Å; Y369-E371 WeakPolarHBondContact CD2-OE2 3.41Å; Y369-E371 HydrophobicContact CE2-CB 3.84Å; Y369-E371 PolarHBondContact O-N 2.88Å; Y369-E371 VanDerWaalsContact O-N 3.13Å; E371-I375 WeakPolarHBondContact O-CG1 3.32Å; E371-I375 PolarHBondContact O-N 3.45Å
372E98.2Very high97.1Very high63 Ų6356.7 Ų56.729%0.29428%0.281SS..Hα-helixtrans-74.6-38178.6-169.6169.8175.300111.7K43 Y369 R374 I375 F376K43-E372 IonicContact NZ-OE1 3.79Å; K43-E372 PolarHBondContact NZ-OE1 2.95Å; K43-E372 IonicContact NZ-OE2 2.74Å; K43-E372 PolarHBondContact NZ-OE2 3.33Å; Y369-E372 HydrophobicContact CD1-CB 4.39Å; Y369-E372 HydrophobicContact CD2-CB 4.46Å; Y369-E372 HydrophobicContact CE1-CB 3.92Å; Y369-E372 WeakPolarHBondContact CE1-OE2 3.43Å; Y369-E372 HydrophobicContact CE2-CB 4.04Å; Y369-E372 PolarHBondContact O-N 3.45Å; Y369-E372 VanDerWaalsContact O-N 3.09Å; Y369-E372 PolarHBondContact OH-OE2 3.47Å; E372-R374 VanDerWaalsContact C-N 3.3Å; E372-R374 PolarHBondContact O-N 3.4Å; E372-I375 WeakPolarHBondContact O-CB 3.31Å; E372-I375 PolarHBondContact O-N 3Å; E372-I375 VanDerWaalsContact O-N 3.13Å; E372-F376 PolarHBondContact O-N 3.02Å
373N98.6Very high96.6Very high0 Ų065.2 Ų65.20%031%0.313CS..Hα-helixtrans-58.9-41.4174.6-66.2-16.4000111.8G299 M300 M362 T368 Y369 I375 F376 Y377G299-N373 PolarHBondContact O-ND2 3.02Å; M300-N373 PolarHBondContact O-ND2 2.94Å; M362-N373 HydrophobicContact CE-CB 3.68Å; M362-N373 HydrophobicContact CG-CB 4.44Å; M362-N373 HydrophobicContact SD-CB 4.11Å; T368-N373 PolarHBondContact N-OD1 2.85Å; T368-N373 PolarHBondContact OG1-OD1 3.49Å; T368-N373 VanDerWaalsContact OG1-OD1 3.12Å; Y369-N373 WeakPolarHBondContact O-CB 3.44Å; Y369-N373 PolarHBondContact O-N 2.92Å; Y369-N373 PolarHBondContact O-ND2 2.95Å; Y369-N373 PolarHBondContact O-OD1 2.79Å; N373-I375 VanDerWaalsContact C-N 3.35Å; N373-F376 WeakPolarHBondContact O-CB 3.24Å; N373-F376 PolarHBondContact O-N 3.35Å; N373-Y377 PolarHBondContact O-N 3.09Å
374R98.4Very high95.9Very high102 Ų10269.9 Ų69.939%0.38533%0.333SS..Hα-helixtrans-65.1-38.3176.7-178.1174.8168.689.7-3.3111.8L304 P370 E372 Y377 L378L304-R374 PolarHBondContact O-NH1 3.48Å; P370-R374 VanDerWaalsContact O-CB 3.3Å; P370-R374 WeakPolarHBondContact O-CB 3.38Å; P370-R374 PolarHBondContact O-N 3.49Å; E372-R374 VanDerWaalsContact C-N 3.3Å; E372-R374 PolarHBondContact O-N 3.4Å; R374-Y377 PolarHBondContact O-N 2.98Å; R374-L378 HydrophobicContact CG-CD1 4.22Å; R374-L378 VanDerWaalsContact O-CG 3.3Å; R374-L378 WeakPolarHBondContact O-CG 3.38Å; R374-L378 PolarHBondContact O-N 3.47Å
375I98.3Very high95.2Very high97 Ų9773.2 Ų73.250%0.49736%0.355SS..Hα-helixtrans-62.5-47175.4-66.7167.9000110.1E371 E372 N373 Y377 L378 Q379E371-I375 WeakPolarHBondContact O-CG1 3.32Å; E371-I375 PolarHBondContact O-N 3.45Å; E372-I375 WeakPolarHBondContact O-CB 3.31Å; E372-I375 PolarHBondContact O-N 3Å; E372-I375 VanDerWaalsContact O-N 3.13Å; N373-I375 VanDerWaalsContact C-N 3.35Å; I375-Y377 PolarHBondContact O-N 3.33Å; I375-L378 PolarHBondContact O-N 3.3Å; I375-Q379 WeakPolarHBondContact O-CG 3.43Å; I375-Q379 PolarHBondContact O-N 2.84Å
376F98.1Very high94.2Very high60 Ų6075.3 Ų75.326%0.26335%0.354SS..Hα-helixtrans-55.7-48.7176.1173.9-93000111.8Y360 M362 P363 K366 E372 N373 L378 Q379 A380Y360-F376 HydrophobicContact CE1-CE1 4.47Å; M362-F376 HydrophobicContact CE-CB 4.33Å; M362-F376 HydrophobicContact CE-CD1 3.59Å; M362-F376 HydrophobicContact CE-CE1 4.3Å; M362-F376 HydrophobicContact CE-CG 4.22Å; M362-F376 HydrophobicContact SD-CD1 4.18Å; P363-F376 HydrophobicContact CG-CE1 4.42Å; K366-F376 HydrophobicContact CB-CD2 4.49Å; K366-F376 HydrophobicContact CB-CE1 4.32Å; K366-F376 HydrophobicContact CB-CE2 4.27Å; K366-F376 HydrophobicContact CB-CZ 4.19Å; K366-F376 HydrophobicContact CD-CE2 3.98Å; K366-F376 HydrophobicContact CD-CZ 4.41Å; K366-F376 HydrophobicContact CG-CD2 4.45Å; K366-F376 HydrophobicContact CG-CE1 4.35Å; K366-F376 HydrophobicContact CG-CE2 3.81Å; K366-F376 HydrophobicContact CG-CZ 3.76Å; E372-F376 PolarHBondContact O-N 3.02Å; N373-F376 WeakPolarHBondContact O-CB 3.24Å; N373-F376 PolarHBondContact O-N 3.35Å; F376-L378 PolarHBondContact O-N 2.99Å; F376-Q379 PolarHBondContact O-N 3.49Å; F376-A380 WeakPolarHBondContact O-CB 3.43Å; F376-A380 PolarHBondContact O-N 3.03Å
377Y97.7Very high92.5Very high7 Ų774.6 Ų74.63%0.02736%0.362CS..Hα-helixtrans-59-46.2177.5166.7-108.4000112.8A303 T305 S357 N358 Y360 N373 R374 I375 Q379 A380 K381A303-Y377 VanDerWaalsContact CB-CB 3.42Å; A303-Y377 HydrophobicContact CB-CD1 4Å; A303-Y377 HydrophobicContact CB-CD2 3.91Å; A303-Y377 HydrophobicContact CB-CG 3.49Å; A303-Y377 VanDerWaalsContact CB-CG 3.49Å; T305-Y377 HydrophobicContact CG2-CD1 4.4Å; T305-Y377 HydrophobicContact CG2-CE1 3.74Å; S357-Y377 PolarHBondContact O-OH 3.5Å; N358-Y377 WeakPolarHBondContact CA-OH 3.32Å; Y360-Y377 VanDerWaalsContact CB-CE2 3.5Å; Y360-Y377 AromaticContact CD1-CD2 3.6Å; Y360-Y377 HydrophobicContact CD1-CD2 3.6Å; Y360-Y377 HydrophobicContact CD1-CE2 4.28Å; Y360-Y377 HydrophobicContact CD1-CG 4.44Å; Y360-Y377 HydrophobicContact CD2-CD2 4.16Å; Y360-Y377 HydrophobicContact CD2-CE2 4.18Å; Y360-Y377 HydrophobicContact CE1-CD2 4.26Å; Y360-Y377 AromaticContact CG-CD2 3.54Å; Y360-Y377 HydrophobicContact CG-CD2 3.54Å; Y360-Y377 AromaticContact CG-CE2 3.74Å; Y360-Y377 HydrophobicContact CG-CE2 3.74Å; N373-Y377 PolarHBondContact O-N 3.09Å; R374-Y377 PolarHBondContact O-N 2.98Å; I375-Y377 PolarHBondContact O-N 3.33Å; Y377-Q379 VanDerWaalsContact C-N 3.3Å; Y377-Q379 PolarHBondContact O-N 2.84Å; Y377-A380 PolarHBondContact O-N 2.78Å; Y377-K381 HydrophobicContact CE1-CD 4.18Å; Y377-K381 HydrophobicContact CE2-CD 4.46Å; Y377-K381 VanDerWaalsContact O-CB 3.32Å; Y377-K381 WeakPolarHBondContact O-CB 3.42Å; Y377-K381 PolarHBondContact O-N 2.97Å; Y377-K381 WeakPolarHBondContact OH-CD 3.25Å; Y377-K381 WeakPolarHBondContact OH-CE 3.16Å; Y377-K381 PolarHBondContact OH-NZ 3.02Å
378L97.7Very high90.6Very high74 Ų7478.2 Ų78.239%0.38739%0.387SS..Hα-helixtrans-63.7-36.9-179.9-70.5173000112R374 I375 F376 K382R374-L378 HydrophobicContact CG-CD1 4.22Å; R374-L378 VanDerWaalsContact O-CG 3.3Å; R374-L378 WeakPolarHBondContact O-CG 3.38Å; R374-L378 PolarHBondContact O-N 3.47Å; I375-L378 PolarHBondContact O-N 3.3Å; F376-L378 PolarHBondContact O-N 2.99Å; L378-K382 WeakPolarHBondContact O-CG 3.26Å; L378-K382 PolarHBondContact O-N 3.43Å; L378-K382 VanDerWaalsContact O-N 3.1Å
379Q96.2Very high88Confident99 Ų9988.2 Ų88.246%0.46344%0.437SS..Hα-helixtrans-67.7-45.2174.6-69.4174-3.200111.7I375 F376 Y377 K381 K382 R383I375-Q379 WeakPolarHBondContact O-CG 3.43Å; I375-Q379 PolarHBondContact O-N 2.84Å; F376-Q379 PolarHBondContact O-N 3.49Å; Y377-Q379 VanDerWaalsContact C-N 3.3Å; Y377-Q379 PolarHBondContact O-N 2.84Å; Q379-K381 VanDerWaalsContact C-N 3.33Å; Q379-K381 PolarHBondContact O-N 3.46Å; Q379-K382 PolarHBondContact O-N 3.47Å; Q379-R383 WeakPolarHBondContact O-CG 3.32Å; Q379-R383 PolarHBondContact O-N 3.46Å
380A92.9Very high87.5Confident23 Ų2390.1 Ų90.119%0.1945%0.449CS..Hα-helixtrans-61.1-43176.400000111.4F376 Y377 K382 R383 M384F376-A380 WeakPolarHBondContact O-CB 3.43Å; F376-A380 PolarHBondContact O-N 3.03Å; Y377-A380 PolarHBondContact O-N 2.78Å; A380-K382 PolarHBondContact O-N 2.91Å; A380-R383 PolarHBondContact O-N 3.01Å; A380-M384 WeakPolarHBondContact O-CG 3.28Å; A380-M384 PolarHBondContact O-N 3.17Å; A380-M384 VanDerWaalsContact O-N 3.08Å
381K91.9Very high86.9Confident64 Ų6494.8 Ų94.828%0.27847%0.473SS..Hα-helixtrans-63.1-41.1178.2-166.7179.1-164.4167.70112.7N358 Y377 Q379 M384 V385N358-K381 PolarHBondContact OD1-NZ 3.14Å; Y377-K381 HydrophobicContact CE1-CD 4.18Å; Y377-K381 HydrophobicContact CE2-CD 4.46Å; Y377-K381 VanDerWaalsContact O-CB 3.32Å; Y377-K381 WeakPolarHBondContact O-CB 3.42Å; Y377-K381 PolarHBondContact O-N 2.97Å; Y377-K381 WeakPolarHBondContact OH-CD 3.25Å; Y377-K381 WeakPolarHBondContact OH-CE 3.16Å; Y377-K381 PolarHBondContact OH-NZ 3.02Å; Q379-K381 VanDerWaalsContact C-N 3.33Å; Q379-K381 PolarHBondContact O-N 3.46Å; K381-M384 PolarHBondContact O-N 3.37Å; K381-V385 WeakPolarHBondContact O-CG2 3.48Å; K381-V385 PolarHBondContact O-N 3.38Å
382K90.6Very high86.2Confident139 Ų13997.2 Ų97.260%0.60449%0.485SS*.Hα-helixtrans-59.6-45.6174.5-76.4178.8179-1710111.6L378 Q379 A380 M384 V385 E386L378-K382 WeakPolarHBondContact O-CG 3.26Å; L378-K382 PolarHBondContact O-N 3.43Å; L378-K382 VanDerWaalsContact O-N 3.1Å; Q379-K382 PolarHBondContact O-N 3.47Å; A380-K382 PolarHBondContact O-N 2.91Å; K382-M384 VanDerWaalsContact C-N 3.3Å; K382-M384 PolarHBondContact O-N 3.03Å; K382-V385 PolarHBondContact O-N 3.3Å; K382-E386 PolarHBondContact O-N 3.42Å
383R88.6Confident85.5Confident180 Ų18099.2 Ų99.268%0.67950%0.497SS*.Hα-helixtrans-60.6-37.4176.9-66.5178-172.1-174.42.4112.8Q379 A380 V385 E386 S387Q379-R383 WeakPolarHBondContact O-CG 3.32Å; Q379-R383 PolarHBondContact O-N 3.46Å; A380-R383 PolarHBondContact O-N 3.01Å; R383-V385 VanDerWaalsContact C-N 3.29Å; R383-V385 PolarHBondContact O-N 3.29Å; R383-E386 PolarHBondContact O-N 3.3Å; R383-S387 PolarHBondContact O-N 3.13Å
384M83.4Confident84.7Confident134 Ų134105.4 Ų105.466%0.6653%0.528SS*.Hα-helixtrans-66.6-29.2175.7-66.5178.3104.400113.1A380 K381 K382A380-M384 WeakPolarHBondContact O-CG 3.28Å; A380-M384 PolarHBondContact O-N 3.17Å; A380-M384 VanDerWaalsContact O-N 3.08Å; K381-M384 PolarHBondContact O-N 3.37Å; K382-M384 VanDerWaalsContact C-N 3.3Å; K382-M384 PolarHBondContact O-N 3.03Å
385V81.8Confident83.8Confident114 Ų114105.6 Ų105.669%0.69154%0.537SS*.Hα-helixtrans-79.4-33.9176.5176.10000111.5K381 K382 R383K381-V385 WeakPolarHBondContact O-CG2 3.48Å; K381-V385 PolarHBondContact O-N 3.38Å; K382-V385 PolarHBondContact O-N 3.3Å; R383-V385 VanDerWaalsContact C-N 3.29Å; R383-V385 PolarHBondContact O-N 3.29Å
386E76.7Confident82.8Confident149 Ų149106.2 Ų106.270%0.69654%0.54SS*.Hα-helixtrans-80.9-19.8179.7-70.4170.7-173.100113.5K382 R383K382-E386 PolarHBondContact O-N 3.42Å; R383-E386 PolarHBondContact O-N 3.3Å
387S61.3Low81.6Confident93 Ų93109.8 Ų109.865%0.6556%0.561SS**SBendtrans-133.370.6173.9-65.20000110.7R383 L389R383-S387 PolarHBondContact O-N 3.13Å; S387-L389 PolarHBondContact O-N 3.46Å; S387-L389 VanDerWaalsContact O-N 3.16Å
388P58.1Low80.3Confident106 Ų106118.3 Ų118.369%0.68861%0.606SS**  trans-66.2114.1169.527.5-28.5000107.5
389L43.9Very low78.7Confident245 Ų245122.4 Ų122.4100%1.28363%0.626SS**  trans-58.50169.5-87.4161000111.2S387S387-L389 PolarHBondContact O-N 3.46Å; S387-L389 VanDerWaalsContact O-N 3.16Å

Retrieved 389 of 389 residues in 489.9 ms (Link to these results)