A0A096NJ60_PAPAN Loading...

Chemokine like factor

AlphaFold DB , UniProt , Accession A0A096NJ60, Species PAPAN (Papio anubis, Olive baboon), Gene CKLF, Length 152 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
1M39.5Very low39Very low247 Ų247159.5 Ų159.5100%1.21781%0.805SS**  0114.70-74171.7173.100107.9N3M1-N3 PolarHBondContact O-N 2.97Å
2A38.9Very low39.2Very low96 Ų96154.8 Ų154.879%0.79379%0.793SS**  trans-71.9124.3-172.200000111.1V4A2-V4 PolarHBondContact O-N 2.93Å
3N37.1Very low39.3Very low148 Ų148155.2 Ų155.279%0.79179%0.786SS**  trans-80.496.9174.5-167.6-11.1000108.7M1 Q5M1-N3 PolarHBondContact O-N 2.97Å; N3-Q5 PolarHBondContact O-N 3.49Å
4V40.6Very low39.5Very low124 Ų124151.7 Ų151.775%0.75278%0.781SS**  trans-80.995.6177.9-179.20000108.3A2A2-V4 PolarHBondContact O-N 2.93Å
5Q38.2Very low39.3Very low148 Ų148155.3 Ų155.369%0.69279%0.789SS**  trans-49.7129.7163-71.5-77.43.300109.5N3 K7N3-Q5 PolarHBondContact O-N 3.49Å; Q5-K7 PolarHBondContact O-N 2.99Å
6P39.5Very low39.3Very low108 Ų108148.8 Ų148.870%0.70176%0.762SS**  trans-68.2101.7169.227.9-28.7000106.8I8P6-I8 PolarHBondContact O-N 3.18Å
7K33.7Very low39.5Very low199 Ų199147.5 Ų147.587%0.86576%0.762SS**  trans-49.9109167.9-93.9-173.5175.9178.60107.1Q5 K9Q5-K7 PolarHBondContact O-N 2.99Å; K7-K9 PolarHBondContact O-N 3.09Å
8I44.6Very low39.6Very low156 Ų156146.8 Ų146.880%0.875%0.753SS**  trans-60.593.5168-65.8166.5000105.5P6 H10P6-I8 PolarHBondContact O-N 3.18Å; I8-H10 VanDerWaalsContact C-N 3.31Å; I8-H10 PolarHBondContact O-N 3.23Å
9K36.5Very low39.6Very low156 Ų156140.5 Ų140.568%0.67873%0.728SS**  trans-69.497.3176.1-168165.1-176.3172.50105K7 R11K7-K9 PolarHBondContact O-N 3.09Å; K9-R11 HydrophobicContact CG-CG 4.32Å; K9-R11 WeakPolarHBondContact O-CG 3.2Å; K9-R11 PolarHBondContact O-N 2.94Å
10H44Very low39.5Very low179 Ų179141 Ų14183%0.82973%0.726SS**  trans-52.992.2164.1-104.4-60.5000107I8 P12I8-H10 VanDerWaalsContact C-N 3.31Å; I8-H10 PolarHBondContact O-N 3.23Å; H10-P12 WeakPolarHBondContact O-CD 3.48Å
11R36.2Very low39.7Very low194 Ų194138.4 Ų138.473%0.73272%0.716SS**  trans-78.6116.1172.6-64.8-144.9-173.8-143.57.6105.3K9 F13K9-R11 HydrophobicContact CG-CG 4.32Å; K9-R11 WeakPolarHBondContact O-CG 3.2Å; K9-R11 PolarHBondContact O-N 2.94Å; R11-F13 PolarHBondContact O-N 3.24Å
12P42.1Very low39.8Very low102 Ų102131.8 Ų131.866%0.66268%0.681SS**  trans-56.5135.2176.122.4-29.8000107.6H10 C14H10-P12 WeakPolarHBondContact O-CD 3.48Å; P12-C14 PolarHBondContact O-N 2.94Å
13F40.5Very low40Very low161 Ų161133 Ų13371%0.70667%0.671SS**THydrogen-bonded Turntrans-66.128178.2-142.5-95.5000112R11R11-F13 PolarHBondContact O-N 3.24Å
14C41Very low40.2Very low106 Ų106131.4 Ų131.472%0.71666%0.662SS**THydrogen-bonded Turntrans-93.5-7.2179.2-75.40000113.1P12P12-C14 PolarHBondContact O-N 2.94Å
15F37.5Very low40.5Very low206 Ų206130.8 Ų130.890%0.90465%0.647SS**SBendtrans-126.937.1179.8-101.5-87.3000112.8
16S38.8Very low40.6Very low51 Ų51128.8 Ų128.836%0.35764%0.64SS.*SBendtrans-111.3142.4167.8-167.30000109.2K18 G19S16-K18 PolarHBondContact O-N 2.84Å; S16-G19 PolarHBondContact O-N 3.05Å
17V42.4Very low40.9Very low126 Ų126125.6 Ų125.676%0.76462%0.623SS**THydrogen-bonded Turntrans-46.9-21.5-176.8-1470000113.7G19 V21V17-G19 VanDerWaalsContact C-N 3.34Å; V17-G19 PolarHBondContact O-N 3.15Å; V17-V21 WeakPolarHBondContact O-CG2 3.24Å
18K42.1Very low41.6Very low136 Ų136122 Ų12259%0.59161%0.613SS**Hα-helixtrans-66.3-22170.9-72.9175.8173.9172.30115.5S16S16-K18 PolarHBondContact O-N 2.84Å
19G39.3Very low41.6Very low27 Ų27117.7 Ų117.728%0.27859%0.593SS.*Hα-helixtrans-78.5-30.7-179.800000113.6S16 V17 K22 M23S16-G19 PolarHBondContact O-N 3.05Å; V17-G19 VanDerWaalsContact C-N 3.34Å; V17-G19 PolarHBondContact O-N 3.15Å; G19-K22 WeakPolarHBondContact O-CB 2.94Å; G19-K22 PolarHBondContact O-N 3.19Å; G19-M23 PolarHBondContact O-N 2.92Å
20H37.2Very low42.2Very low149 Ų149114.3 Ų114.369%0.6959%0.586SS**Hα-helixtrans-68.4-37.2177-80.862.7000111.7K22 M23 L24H20-K22 PolarHBondContact O-N 2.83Å; H20-M23 PolarHBondContact O-N 2.88Å; H20-L24 VanDerWaalsContact O-CB 3.29Å; H20-L24 WeakPolarHBondContact O-CB 3.44Å; H20-L24 PolarHBondContact O-N 2.75Å
21V44.3Very low42.4Very low87 Ų87109.9 Ų109.953%0.52757%0.572SS.*Hα-helixtrans-64.2-31.2173.8-145.30000111.7V17 R25V17-V21 WeakPolarHBondContact O-CG2 3.24Å; V21-R25 WeakPolarHBondContact O-CB 3.48Å; V21-R25 PolarHBondContact O-N 2.72Å; V21-R25 VanDerWaalsContact O-N 3.15Å
22K41.1Very low42.9Very low108 Ų108102.9 Ų102.947%0.4755%0.552SS.*Hα-helixtrans-76.9-34.7178.1-145.1177.4-171-169.20112.4G19 H20 L26G19-K22 WeakPolarHBondContact O-CB 2.94Å; G19-K22 PolarHBondContact O-N 3.19Å; H20-K22 PolarHBondContact O-N 2.83Å; K22-L26 PolarHBondContact O-N 3.07Å
23M42.3Very low43.1Very low121 Ų121101.8 Ų101.860%0.59654%0.539SS*.Hα-helixtrans-76.4-35.4173.5-116.8-12770.800112.6G19 H20 R25 L26 A27G19-M23 PolarHBondContact O-N 2.92Å; H20-M23 PolarHBondContact O-N 2.88Å; M23-R25 VanDerWaalsContact C-N 3.33Å; M23-L26 WeakPolarHBondContact O-CB 3.34Å; M23-L26 PolarHBondContact O-N 2.88Å; M23-A27 WeakPolarHBondContact O-CB 3.35Å; M23-A27 PolarHBondContact O-N 2.74Å
24L43Very low43.2Very low115 Ų11597.8 Ų97.860%0.60253%0.528SS*.Hα-helixtrans-64.7-39.9174.3-173.666.5000111.1H20 A27 L28H20-L24 VanDerWaalsContact O-CB 3.29Å; H20-L24 WeakPolarHBondContact O-CB 3.44Å; H20-L24 PolarHBondContact O-N 2.75Å; L24-A27 PolarHBondContact O-N 2.89Å; L24-L28 WeakPolarHBondContact O-CB 3.26Å; L24-L28 PolarHBondContact O-N 2.82Å
25R45.1Very low43.4Very low112 Ų11298.3 Ų98.342%0.42352%0.523SS..Hα-helixtrans-62.8-45.3172.4-171.1177-68.8172.5-7.1111.7V21 M23 A27 L28 T29 D80V21-R25 WeakPolarHBondContact O-CB 3.48Å; V21-R25 PolarHBondContact O-N 2.72Å; V21-R25 VanDerWaalsContact O-N 3.15Å; M23-R25 VanDerWaalsContact C-N 3.33Å; R25-A27 PolarHBondContact O-N 3Å; R25-L28 PolarHBondContact O-N 3.13Å; R25-T29 PolarHBondContact O-N 3.15Å; R25-T29 PolarHBondContact O-OG1 3.32Å; R25-D80 IonicContact CZ-OD1 3.14Å; R25-D80 IonicContact CZ-OD2 3.26Å; R25-D80 VanDerWaalsContact CZ-OD2 3.26Å; R25-D80 IonicContact NH1-OD1 2.65Å; R25-D80 PolarHBondContact NH1-OD1 3Å; R25-D80 IonicContact NH1-OD2 2.89Å; R25-D80 PolarHBondContact NH1-OD2 3.37Å; R25-D80 IonicContact NH2-OD1 3.24Å; R25-D80 PolarHBondContact NH2-OD1 2.94Å; R25-D80 IonicContact NH2-OD2 2.75Å; R25-D80 PolarHBondContact NH2-OD2 3.24Å
26L41.8Very low43.7Very low105 Ų10592.2 Ų92.255%0.5550%0.496SS..Hα-helixtrans-58.9-44.8175.2-172.474.5000112K22 M23 T29 V30K22-L26 PolarHBondContact O-N 3.07Å; M23-L26 WeakPolarHBondContact O-CB 3.34Å; M23-L26 PolarHBondContact O-N 2.88Å; L26-T29 PolarHBondContact O-N 3.15Å; L26-V30 VanDerWaalsContact O-CG2 3.25Å; L26-V30 WeakPolarHBondContact O-CG2 3.37Å; L26-V30 PolarHBondContact O-N 3.48Å
27A46.3Very low44Very low42 Ų4296.1 Ų96.135%0.34751%0.512SS..Hα-helixtrans-65-40.2177.800000112M23 L24 R25 T29 V30 T31M23-A27 WeakPolarHBondContact O-CB 3.35Å; M23-A27 PolarHBondContact O-N 2.74Å; L24-A27 PolarHBondContact O-N 2.89Å; R25-A27 PolarHBondContact O-N 3Å; A27-T29 PolarHBondContact O-N 2.89Å; A27-V30 PolarHBondContact O-N 3.02Å; A27-T31 WeakPolarHBondContact O-CB 3.4Å; A27-T31 PolarHBondContact O-N 2.94Å; A27-T31 PolarHBondContact O-OG1 2.83Å
28L48.1Very low44Very low124 Ų12496 Ų9665%0.64951%0.506SS*.Hα-helixtrans-64.4-39.7176.9-13181.6000112.1L24 R25 S32L24-L28 WeakPolarHBondContact O-CB 3.26Å; L24-L28 PolarHBondContact O-N 2.82Å; R25-L28 PolarHBondContact O-N 3.13Å; L28-S32 PolarHBondContact O-N 3.25Å; L28-S32 VanDerWaalsContact O-N 3.1Å
29T44.2Very low44.1Very low64 Ų6493 Ų9339%0.39351%0.507SS..Hα-helixtrans-70.6-36.1178.6-39.40000112.2R25 L26 A27 M33R25-T29 PolarHBondContact O-N 3.15Å; R25-T29 PolarHBondContact O-OG1 3.32Å; L26-T29 PolarHBondContact O-N 3.15Å; A27-T29 PolarHBondContact O-N 2.89Å; T29-M33 PolarHBondContact O-N 3.44Å
30V49.4Very low44.9Very low85 Ų85100.8 Ų100.852%0.51554%0.536SS..Hα-helixtrans-69.5-40.4175.1171.80000111.3L26 A27 S32 M33 T34L26-V30 VanDerWaalsContact O-CG2 3.25Å; L26-V30 WeakPolarHBondContact O-CG2 3.37Å; L26-V30 PolarHBondContact O-N 3.48Å; A27-V30 PolarHBondContact O-N 3.02Å; V30-S32 VanDerWaalsContact C-N 3.33Å; V30-S32 PolarHBondContact O-N 3.41Å; V30-M33 WeakPolarHBondContact O-CB 3.29Å; V30-M33 PolarHBondContact O-N 2.96Å; V30-T34 PolarHBondContact O-N 3.14Å; V30-T34 VanDerWaalsContact O-N 3.12Å; V30-T34 PolarHBondContact O-OG1 2.87Å; V30-T34 VanDerWaalsContact O-OG1 3.08Å
31T47.8Very low45.2Very low87 Ų8797.5 Ų97.553%0.53454%0.535SS..Hα-helixtrans-65-35.7176-56.80000112.1A27 L35A27-T31 WeakPolarHBondContact O-CB 3.4Å; A27-T31 PolarHBondContact O-N 2.94Å; A27-T31 PolarHBondContact O-OG1 2.83Å; T31-L35 HydrophobicContact CG2-CD1 4.44Å; T31-L35 WeakPolarHBondContact O-CD1 3.46Å; T31-L35 WeakPolarHBondContact O-CG 3.48Å; T31-L35 PolarHBondContact O-N 3.16Å
32S47.4Very low45.4Very low47 Ų4797.2 Ų97.233%0.32954%0.535SS..Hα-helixtrans-70.3-36.5173.9-164.70000113L28 V30 L35 F36L28-S32 PolarHBondContact O-N 3.25Å; L28-S32 VanDerWaalsContact O-N 3.1Å; V30-S32 VanDerWaalsContact C-N 3.33Å; V30-S32 PolarHBondContact O-N 3.41Å; S32-L35 PolarHBondContact O-N 3.26Å; S32-F36 PolarHBondContact O-N 3.39Å
33M44.8Very low45.9Very low79 Ų7999.8 Ų99.839%0.38955%0.548SS..Hα-helixtrans-61.9-40.5174-98.7-104.4140.200112.5T29 V30 F36 I37 V53T29-M33 PolarHBondContact O-N 3.44Å; V30-M33 WeakPolarHBondContact O-CB 3.29Å; V30-M33 PolarHBondContact O-N 2.96Å; M33-F36 PolarHBondContact O-N 3.4Å; M33-I37 WeakPolarHBondContact O-CD1 3.39Å; M33-I37 WeakPolarHBondContact O-CG1 3.49Å; M33-I37 PolarHBondContact O-N 3.39Å; M33-V53 HydrophobicContact CE-CG2 4.09Å
34T43.8Very low46.6Very low76 Ų7698 Ų9847%0.46655%0.545SS..Hα-helixtrans-71.3-33.6179.3-50.20000112.7V30 F36 I38V30-T34 PolarHBondContact O-N 3.14Å; V30-T34 VanDerWaalsContact O-N 3.12Å; V30-T34 PolarHBondContact O-OG1 2.87Å; V30-T34 VanDerWaalsContact O-OG1 3.08Å; T34-F36 VanDerWaalsContact C-N 3.34Å; T34-I38 WeakPolarHBondContact O-CD1 3.32Å; T34-I38 WeakPolarHBondContact O-CG1 3.48Å
35L44.1Very low47Very low117 Ų11796.7 Ų96.761%0.61353%0.533SS*.Hα-helixtrans-70.1-29.8177-74.1165.2000112.7T31 S32T31-L35 HydrophobicContact CG2-CD1 4.44Å; T31-L35 WeakPolarHBondContact O-CD1 3.46Å; T31-L35 WeakPolarHBondContact O-CG 3.48Å; T31-L35 PolarHBondContact O-N 3.16Å; S32-L35 PolarHBondContact O-N 3.26Å
36F43.6Very low47.4Very low78 Ų7896.9 Ų96.934%0.34254%0.541SS..Hα-helixtrans-77-28.8177.5-110.6-82.7000114.1S32 M33 T34 I38 T49 E52S32-F36 PolarHBondContact O-N 3.39Å; M33-F36 PolarHBondContact O-N 3.4Å; T34-F36 VanDerWaalsContact C-N 3.34Å; F36-I38 VanDerWaalsContact C-N 3.27Å; F36-I38 PolarHBondContact O-N 2.97Å; F36-T49 HydrophobicContact CD1-CG2 3.49Å; F36-T49 VanDerWaalsContact CD1-CG2 3.49Å; F36-T49 HydrophobicContact CE1-CG2 3.51Å; F36-E52 WeakPolarHBondContact CZ-OE2 3.32Å
37I44.8Very low48.1Very low134 Ų13497 Ų9769%0.68755%0.546SS*.Hα-helixtrans-71.2-22.2178.3-69.2165.1000112M33M33-I37 WeakPolarHBondContact O-CD1 3.39Å; M33-I37 WeakPolarHBondContact O-CG1 3.49Å; M33-I37 PolarHBondContact O-N 3.39Å
38I43.9Very low48.7Very low123 Ų12397.1 Ų97.163%0.63154%0.541SS*.THydrogen-bonded Turntrans-88.4-12.5-174.4-64.2170.9000112.7T34 F36 E40T34-I38 WeakPolarHBondContact O-CD1 3.32Å; T34-I38 WeakPolarHBondContact O-CG1 3.48Å; F36-I38 VanDerWaalsContact C-N 3.27Å; F36-I38 PolarHBondContact O-N 2.97Å; I38-E40 PolarHBondContact O-N 3.22Å
39A44.1Very low49Very low74 Ų7493.2 Ų93.261%0.61252%0.522SS*.  trans-96.634.6-164.500000116.2
40E56.7Low49.8Very low189 Ų18991.7 Ų91.788%0.88352%0.519SS*.  trans-28.6127.4-179.5-82.1172.8100.900117.9I38I38-E40 PolarHBondContact O-N 3.22Å
41A41.8Very low49.9Very low81 Ų8193.6 Ų93.667%0.66952%0.52SS*.  trans100.2160.9161.800000119.6
42P49.9Very low50.3Low81 Ų8190.4 Ų90.453%0.52650%0.5SS..  cis-112-169.4-35.321.90.7000114.1P44 Y45P42-P44 WeakPolarHBondContact O-CD 3.3Å; P42-P44 VanDerWaalsContact O-N 3.16Å; P42-Y45 VanDerWaalsContact CD-CD2 3.47Å; P42-Y45 WeakPolarHBondContact O-CB 3.31Å; P42-Y45 VanDerWaalsContact O-CD2 3.27Å; P42-Y45 WeakPolarHBondContact O-CD2 3.38Å; P42-Y45 PolarHBondContact O-N 3.47Å
43E51.3Low50.4Low162 Ų16291 Ų9176%0.75750%0.501SS*.Hα-helixtrans-44.6-41.2-156.2-54.4-146156.500122.2Y45 I46E43-Y45 VanDerWaalsContact C-N 3.28Å; E43-Y45 PolarHBondContact O-N 3.26Å; E43-I46 WeakPolarHBondContact O-CB 3.3Å; E43-I46 PolarHBondContact O-N 2.94Å
44P56.5Low50.8Low83 Ų8391.3 Ų91.354%0.53951%0.508SS..Hα-helixtrans-70.6-25.5177.324.5-31.3000112.9P42 I46 V47 I48P42-P44 WeakPolarHBondContact O-CD 3.3Å; P42-P44 VanDerWaalsContact O-N 3.16Å; P44-I46 VanDerWaalsContact C-N 3.27Å; P44-I46 PolarHBondContact O-N 3.46Å; P44-V47 PolarHBondContact O-N 3.04Å; P44-I48 WeakPolarHBondContact O-CD1 3.33Å; P44-I48 PolarHBondContact O-N 3.26Å
45Y52.2Low51.5Low88 Ų8889.1 Ų89.135%0.34549%0.494SS..Hα-helixtrans-68.4-31.1176.1-64-95.9000110.9P42 E43 V47 I48 T49P42-Y45 VanDerWaalsContact CD-CD2 3.47Å; P42-Y45 WeakPolarHBondContact O-CB 3.31Å; P42-Y45 VanDerWaalsContact O-CD2 3.27Å; P42-Y45 WeakPolarHBondContact O-CD2 3.38Å; P42-Y45 PolarHBondContact O-N 3.47Å; E43-Y45 VanDerWaalsContact C-N 3.28Å; E43-Y45 PolarHBondContact O-N 3.26Å; Y45-V47 VanDerWaalsContact C-N 3.33Å; Y45-V47 PolarHBondContact O-N 3.48Å; Y45-I48 PolarHBondContact O-N 2.82Å; Y45-T49 WeakPolarHBondContact O-CB 3.38Å; Y45-T49 PolarHBondContact O-N 2.78Å; Y45-T49 PolarHBondContact O-OG1 2.84Å
46I53.4Low52.1Low116 Ų11685.9 Ų85.960%0.59548%0.477SS*.Hα-helixtrans-63.2-39.8179.2-60.9175.9000111.2E43 P44 G50E43-I46 WeakPolarHBondContact O-CB 3.3Å; E43-I46 PolarHBondContact O-N 2.94Å; P44-I46 VanDerWaalsContact C-N 3.27Å; P44-I46 PolarHBondContact O-N 3.46Å; I46-G50 WeakPolarHBondContact O-CA 3.36Å; I46-G50 PolarHBondContact O-N 2.75Å
47V55.2Low52.6Low106 Ų10686.8 Ų86.864%0.64249%0.485SS*.Hα-helixtrans-72.9-42.5-178.2-178.60000111.3P44 Y45 G50 F51P44-V47 PolarHBondContact O-N 3.04Å; Y45-V47 VanDerWaalsContact C-N 3.33Å; Y45-V47 PolarHBondContact O-N 3.48Å; V47-G50 PolarHBondContact O-N 3.28Å; V47-F51 WeakPolarHBondContact O-CB 3.39Å; V47-F51 PolarHBondContact O-N 2.81Å
48I59.8Low52.9Low46 Ų4686.4 Ų86.424%0.23648%0.478CS..Hα-helixtrans-66.5-45.3178.3-70.1154.1000110.5P44 Y45 F51 E52 L97P44-I48 WeakPolarHBondContact O-CD1 3.33Å; P44-I48 PolarHBondContact O-N 3.26Å; Y45-I48 PolarHBondContact O-N 2.82Å; I48-F51 PolarHBondContact O-N 3.28Å; I48-E52 WeakPolarHBondContact O-CB 3.4Å; I48-E52 PolarHBondContact O-N 3.25Å; I48-L97 HydrophobicContact CD1-CD1 3.27Å; I48-L97 HydrophobicContact CG1-CD1 4.39Å
49T55Low53.3Low41 Ų4182.6 Ų82.625%0.25246%0.457SS..Hα-helixtrans-67.1-38177-450000111.2F36 Y45 E52 V53F36-T49 HydrophobicContact CD1-CG2 3.49Å; F36-T49 VanDerWaalsContact CD1-CG2 3.49Å; F36-T49 HydrophobicContact CE1-CG2 3.51Å; Y45-T49 WeakPolarHBondContact O-CB 3.38Å; Y45-T49 PolarHBondContact O-N 2.78Å; Y45-T49 PolarHBondContact O-OG1 2.84Å; T49-E52 PolarHBondContact O-N 3.25Å; T49-V53 VanDerWaalsContact O-CG2 3.26Å; T49-V53 WeakPolarHBondContact O-CG2 3.42Å; T49-V53 PolarHBondContact O-N 3.07Å
50G59.2Low53.6Low33 Ų3383.1 Ų83.134%0.3445%0.449SS..Hα-helixtrans-65.6-38.3175.800000113.1I46 V47 T54I46-G50 WeakPolarHBondContact O-CA 3.36Å; I46-G50 PolarHBondContact O-N 2.75Å; V47-G50 PolarHBondContact O-N 3.28Å; G50-T54 WeakPolarHBondContact O-CB 3.35Å; G50-T54 PolarHBondContact O-N 3.27Å; G50-T54 PolarHBondContact O-OG1 2.92Å
51F52.9Low53.3Low124 Ų12478.2 Ų78.254%0.54443%0.428SS..Hα-helixtrans-68.5-40.6174.3-173-116.3000111.5V47 I48 T54 V55 F90V47-F51 WeakPolarHBondContact O-CB 3.39Å; V47-F51 PolarHBondContact O-N 2.81Å; I48-F51 PolarHBondContact O-N 3.28Å; F51-T54 PolarHBondContact O-N 3.41Å; F51-V55 HydrophobicContact CE1-CG2 4.41Å; F51-V55 HydrophobicContact CE2-CG2 4.47Å; F51-V55 HydrophobicContact CZ-CG2 4.28Å; F51-V55 WeakPolarHBondContact O-CG2 3.32Å; F51-V55 PolarHBondContact O-N 3.35Å; F51-F90 AromaticContact CD1-CE1 3.55Å; F51-F90 HydrophobicContact CD1-CE1 3.55Å; F51-F90 AromaticContact CD1-CZ 3.4Å; F51-F90 HydrophobicContact CD1-CZ 3.4Å; F51-F90 HydrophobicContact CE1-CE1 4.01Å; F51-F90 AromaticContact CE1-CZ 3.51Å; F51-F90 HydrophobicContact CE1-CZ 3.51Å; F51-F90 HydrophobicContact CG-CZ 4.44Å
52E54.9Low53.8Low20 Ų2076.6 Ų76.69%0.09341%0.408CS..Hα-helixtrans-61.5-45.3174.3-175169.1-154.900112F36 I48 T49 T54 V55 I56 F90F36-E52 WeakPolarHBondContact CZ-OE2 3.32Å; I48-E52 WeakPolarHBondContact O-CB 3.4Å; I48-E52 PolarHBondContact O-N 3.25Å; T49-E52 PolarHBondContact O-N 3.25Å; E52-T54 VanDerWaalsContact C-N 3.34Å; E52-T54 PolarHBondContact O-N 2.81Å; E52-V55 PolarHBondContact O-N 3.5Å; E52-I56 HydrophobicContact CG-CD1 4.03Å; E52-I56 VanDerWaalsContact O-CG1 3.28Å; E52-I56 WeakPolarHBondContact O-CG1 3.25Å; E52-I56 PolarHBondContact O-N 3.49Å; E52-F90 HydrophobicContact CB-CD1 4.31Å; E52-F90 HydrophobicContact CB-CE1 4.21Å; E52-F90 HydrophobicContact CG-CG 4.49Å
53V51.4Low53.6Low61 Ų6179.5 Ų79.537%0.3741%0.41SS..Hα-helixtrans-63-38.7174.9172.70000111.7M33 T49 V55 I56 L57M33-V53 HydrophobicContact CE-CG2 4.09Å; T49-V53 VanDerWaalsContact O-CG2 3.26Å; T49-V53 WeakPolarHBondContact O-CG2 3.42Å; T49-V53 PolarHBondContact O-N 3.07Å; V53-V55 VanDerWaalsContact C-N 3.35Å; V53-V55 PolarHBondContact O-N 3.29Å; V53-I56 PolarHBondContact O-N 3.23Å; V53-L57 WeakPolarHBondContact O-CB 3.48Å; V53-L57 PolarHBondContact O-N 3.43Å
54T53.3Low53.1Low85 Ų8577.7 Ų77.752%0.52140%0.404SS..Hα-helixtrans-64.1-40.6177.8-59.60000111.6G50 F51 E52 L57 F58G50-T54 WeakPolarHBondContact O-CB 3.35Å; G50-T54 PolarHBondContact O-N 3.27Å; G50-T54 PolarHBondContact O-OG1 2.92Å; F51-T54 PolarHBondContact O-N 3.41Å; E52-T54 VanDerWaalsContact C-N 3.34Å; E52-T54 PolarHBondContact O-N 2.81Å; T54-L57 PolarHBondContact O-N 3.46Å; T54-F58 WeakPolarHBondContact O-CB 3.16Å; T54-F58 PolarHBondContact O-N 2.86Å
55V58.1Low52.8Low29 Ų2978.6 Ų78.618%0.17640%0.403CS..Hα-helixtrans-68.9-43177.4173.80000111.3F51 E52 V53 F58 F59 V86 F90F51-V55 HydrophobicContact CE1-CG2 4.41Å; F51-V55 HydrophobicContact CE2-CG2 4.47Å; F51-V55 HydrophobicContact CZ-CG2 4.28Å; F51-V55 WeakPolarHBondContact O-CG2 3.32Å; F51-V55 PolarHBondContact O-N 3.35Å; E52-V55 PolarHBondContact O-N 3.5Å; V53-V55 VanDerWaalsContact C-N 3.35Å; V53-V55 PolarHBondContact O-N 3.29Å; V55-F58 PolarHBondContact O-N 2.84Å; V55-F59 HydrophobicContact CG1-CD2 4.27Å; V55-F59 HydrophobicContact CG1-CE2 4.5Å; V55-F59 WeakPolarHBondContact O-CD2 3.4Å; V55-F59 PolarHBondContact O-N 3.44Å; V55-V86 HydrophobicContact CG1-CG1 3.67Å; V55-F90 HydrophobicContact CB-CE2 4.39Å; V55-F90 HydrophobicContact CG1-CE2 4.37Å; V55-F90 HydrophobicContact CG2-CE2 4.26Å; V55-F90 HydrophobicContact CG2-CZ 4.19Å
56I56.8Low52.6Low50 Ų5081.4 Ų81.426%0.25641%0.414SS..Hα-helixtrans-61.5-44.4174.1-67.4165.9000110.5E52 V53 F59 I60E52-I56 HydrophobicContact CG-CD1 4.03Å; E52-I56 VanDerWaalsContact O-CG1 3.28Å; E52-I56 WeakPolarHBondContact O-CG1 3.25Å; E52-I56 PolarHBondContact O-N 3.49Å; V53-I56 PolarHBondContact O-N 3.23Å; I56-F59 PolarHBondContact O-N 2.95Å; I56-I60 HydrophobicContact CG2-CD1 3.72Å; I56-I60 HydrophobicContact CG2-CG1 4.43Å; I56-I60 VanDerWaalsContact O-CG1 3.27Å; I56-I60 WeakPolarHBondContact O-CG1 3.27Å; I56-I60 PolarHBondContact O-N 3.11Å
57L53.5Low52.4Low97 Ų9777.8 Ų77.851%0.50840%0.395SS..Hα-helixtrans-64.2-41.1178.1-172.7146.6000111.6V53 T54 F59 I60 L61V53-L57 WeakPolarHBondContact O-CB 3.48Å; V53-L57 PolarHBondContact O-N 3.43Å; T54-L57 PolarHBondContact O-N 3.46Å; L57-F59 VanDerWaalsContact C-N 3.34Å; L57-F59 PolarHBondContact O-N 3.02Å; L57-I60 CarbonylContact O-C 3.59Å; L57-I60 PolarHBondContact O-N 3.02Å; L57-L61 HydrophobicContact CD2-CD1 3.87Å; L57-L61 WeakPolarHBondContact O-CB 3.49Å; L57-L61 PolarHBondContact O-N 2.89Å
58F51.7Low51.8Low126 Ų12677 Ų7755%0.55339%0.387SS*.Hα-helixtrans-59.7-44.2174.2-176.3-104000111.6T54 V55 L61 L62T54-F58 WeakPolarHBondContact O-CB 3.16Å; T54-F58 PolarHBondContact O-N 2.86Å; V55-F58 PolarHBondContact O-N 2.84Å; F58-L61 PolarHBondContact O-N 3.24Å; F58-L62 HydrophobicContact CD1-CD1 3.87Å; F58-L62 HydrophobicContact CD1-CG 4.45Å; F58-L62 HydrophobicContact CE1-CD1 3.59Å; F58-L62 HydrophobicContact CE1-CG 4.26Å; F58-L62 HydrophobicContact CZ-CD1 4.21Å; F58-L62 HydrophobicContact CZ-CD2 4.47Å; F58-L62 HydrophobicContact CZ-CG 4.49Å; F58-L62 VanDerWaalsContact O-CG 3.3Å; F58-L62 WeakPolarHBondContact O-CG 3.48Å; F58-L62 PolarHBondContact O-N 3.41Å
59F51.3Low51.1Low42 Ų4282.1 Ų82.118%0.18440%0.404CS..Hα-helixtrans-63.9-40.2174.3-96.8-82.7000113.1V55 I56 L57 L61 L62 Y63 L79 N83V55-F59 HydrophobicContact CG1-CD2 4.27Å; V55-F59 HydrophobicContact CG1-CE2 4.5Å; V55-F59 WeakPolarHBondContact O-CD2 3.4Å; V55-F59 PolarHBondContact O-N 3.44Å; I56-F59 PolarHBondContact O-N 2.95Å; L57-F59 VanDerWaalsContact C-N 3.34Å; L57-F59 PolarHBondContact O-N 3.02Å; F59-L61 VanDerWaalsContact C-N 3.34Å; F59-L62 PolarHBondContact O-N 3.04Å; F59-Y63 WeakPolarHBondContact O-CB 3.19Å; F59-Y63 PolarHBondContact O-N 3.3Å; F59-L79 HydrophobicContact CE1-CD1 4.39Å; F59-L79 HydrophobicContact CE1-CD2 4.29Å; F59-L79 HydrophobicContact CE1-CG 4.01Å; F59-N83 HydrophobicContact CD1-CB 4.44Å; F59-N83 HydrophobicContact CE1-CB 3.71Å; F59-N83 HydrophobicContact CE2-CB 4.34Å; F59-N83 HydrophobicContact CZ-CB 3.65Å
60I50.8Low50.6Low85 Ų8586.6 Ų86.644%0.43643%0.425SS..Hα-helixtrans-65.5-37.6174.1-69167.2000110.8I56 L57 Y63 I64I56-I60 HydrophobicContact CG2-CD1 3.72Å; I56-I60 HydrophobicContact CG2-CG1 4.43Å; I56-I60 VanDerWaalsContact O-CG1 3.27Å; I56-I60 WeakPolarHBondContact O-CG1 3.27Å; I56-I60 PolarHBondContact O-N 3.11Å; L57-I60 CarbonylContact O-C 3.59Å; L57-I60 PolarHBondContact O-N 3.02Å; I60-Y63 WeakPolarHBondContact O-CB 3.27Å; I60-Y63 PolarHBondContact O-N 3.49Å; I60-I64 HydrophobicContact CG2-CD1 3.74Å; I60-I64 HydrophobicContact CG2-CG1 4.27Å; I60-I64 WeakPolarHBondContact O-CG1 3.34Å; I60-I64 PolarHBondContact O-N 2.75Å
61L50.7Low50.1Low86 Ų8689.2 Ų89.245%0.4543%0.43SS..Hα-helixtrans-66.8-45.2177-134.8108.6000111.1L57 F58 F59 Y63 I64 L65L57-L61 HydrophobicContact CD2-CD1 3.87Å; L57-L61 WeakPolarHBondContact O-CB 3.49Å; L57-L61 PolarHBondContact O-N 2.89Å; F58-L61 PolarHBondContact O-N 3.24Å; F59-L61 VanDerWaalsContact C-N 3.34Å; L61-Y63 PolarHBondContact O-N 2.65Å; L61-I64 PolarHBondContact O-N 2.75Å; L61-L65 HydrophobicContact CD2-CD1 3.66Å; L61-L65 HydrophobicContact CG-CD1 3.85Å; L61-L65 VanDerWaalsContact O-CB 3.3Å; L61-L65 WeakPolarHBondContact O-CB 3.34Å; L61-L65 WeakPolarHBondContact O-CD1 3.43Å; L61-L65 PolarHBondContact O-N 2.98Å
62L52.1Low49.8Very low47 Ų4792.4 Ų92.425%0.24644%0.443CS..Hα-helixtrans-57.9-34.6173.3-69173.5000111.9F58 F59 L67F58-L62 HydrophobicContact CD1-CD1 3.87Å; F58-L62 HydrophobicContact CD1-CG 4.45Å; F58-L62 HydrophobicContact CE1-CD1 3.59Å; F58-L62 HydrophobicContact CE1-CG 4.26Å; F58-L62 HydrophobicContact CZ-CD1 4.21Å; F58-L62 HydrophobicContact CZ-CD2 4.47Å; F58-L62 HydrophobicContact CZ-CG 4.49Å; F58-L62 VanDerWaalsContact O-CG 3.3Å; F58-L62 WeakPolarHBondContact O-CG 3.48Å; F58-L62 PolarHBondContact O-N 3.41Å; F59-L62 PolarHBondContact O-N 3.04Å; L62-L67 HydrophobicContact CD2-CD2 3.52Å; L62-L67 WeakPolarHBondContact O-CB 3.39Å
63Y46.1Very low49.2Very low143 Ų143103.3 Ų103.356%0.56148%0.484SS*.Hα-helixtrans-72.8-46176.2-178.8-100.6000112.9F59 I60 L61F59-Y63 WeakPolarHBondContact O-CB 3.19Å; F59-Y63 PolarHBondContact O-N 3.3Å; I60-Y63 WeakPolarHBondContact O-CB 3.27Å; I60-Y63 PolarHBondContact O-N 3.49Å; L61-Y63 PolarHBondContact O-N 2.65Å
64I40.8Very low49Very low123 Ų123104.1 Ų104.163%0.63149%0.486SS*.Hα-helixtrans-73.6-37.8-179-68.7178.2000112.1I60 L61 R66I60-I64 HydrophobicContact CG2-CD1 3.74Å; I60-I64 HydrophobicContact CG2-CG1 4.27Å; I60-I64 WeakPolarHBondContact O-CG1 3.34Å; I60-I64 PolarHBondContact O-N 2.75Å; L61-I64 PolarHBondContact O-N 2.75Å; I64-R66 PolarHBondContact O-N 2.88Å
65L49.4Very low49Very low102 Ų102107 Ų10753%0.53449%0.491SS..THydrogen-bonded Turntrans-64.31.2177.7-101.380.5000113.6L61 L67L61-L65 HydrophobicContact CD2-CD1 3.66Å; L61-L65 HydrophobicContact CG-CD1 3.85Å; L61-L65 VanDerWaalsContact O-CB 3.3Å; L61-L65 WeakPolarHBondContact O-CB 3.34Å; L61-L65 WeakPolarHBondContact O-CD1 3.43Å; L61-L65 PolarHBondContact O-N 2.98Å; L65-L67 PolarHBondContact O-N 3.46Å; L65-L67 VanDerWaalsContact O-N 3.15Å
66R48.5Very low48.6Very low148 Ų148110.8 Ų110.856%0.55850%0.502SS*.THydrogen-bonded Turntrans55.334-178.6-122.8-167.3-174.1-176.46.8111.1I64 D68 R69I64-R66 PolarHBondContact O-N 2.88Å; R66-D68 PolarHBondContact O-N 2.98Å; R66-R69 WeakPolarHBondContact O-CB 3.4Å; R66-R69 PolarHBondContact O-N 3.36Å
67L48.3Very low48.2Very low40 Ų40110.4 Ų110.421%0.20950%0.503CS..Hα-helixtrans-61.5-18.7177.7-141.576.6000111.5L62 L65 R69 L70 M71L62-L67 HydrophobicContact CD2-CD2 3.52Å; L62-L67 WeakPolarHBondContact O-CB 3.39Å; L65-L67 PolarHBondContact O-N 3.46Å; L65-L67 VanDerWaalsContact O-N 3.15Å; L67-R69 PolarHBondContact O-N 3.26Å; L67-L70 HydrophobicContact CD1-CB 4.11Å; L67-L70 HydrophobicContact CD1-CD1 3.86Å; L67-L70 HydrophobicContact CG-CB 4.33Å; L67-L70 PolarHBondContact O-N 3.44Å; L67-M71 HydrophobicContact CD2-CE 4Å; L67-M71 HydrophobicContact CD2-CG 4.32Å; L67-M71 HydrophobicContact CD2-SD 4.11Å; L67-M71 HydrophobicContact CG-CG 4.26Å; L67-M71 PolarHBondContact O-N 2.82Å
68D44Very low48.1Very low88 Ų88110.2 Ų110.247%0.47150%0.502SS..Hα-helixtrans-44-37.5161.3-177.6-100.2000114.4R66 W76R66-D68 PolarHBondContact O-N 2.98Å; D68-W76 VanDerWaalsContact CA-CZ2 3.45Å; D68-W76 HydrophobicContact CB-CH2 3.87Å; D68-W76 HydrophobicContact CB-CZ2 3.37Å; D68-W76 VanDerWaalsContact OD2-CE2 3.27Å; D68-W76 VanDerWaalsContact OD2-CH2 3.31Å; D68-W76 WeakPolarHBondContact OD2-CH2 3.2Å; D68-W76 WeakPolarHBondContact OD2-CZ2 3.23Å
69R45.3Very low48.1Very low155 Ų155106.6 Ų106.659%0.58549%0.489SS*.Hα-helixtrans-91.6-24.5-179.5-158.5178.8-82.4-148.7-6.4112.7R66 L67R66-R69 WeakPolarHBondContact O-CB 3.4Å; R66-R69 PolarHBondContact O-N 3.36Å; L67-R69 PolarHBondContact O-N 3.26Å
70L43.8Very low48.4Very low135 Ų135107.1 Ų107.171%0.70749%0.493SS*.Hα-helixtrans-84.6-37.9-179.2-90.1156.5000112.6L67L67-L70 HydrophobicContact CD1-CB 4.11Å; L67-L70 HydrophobicContact CD1-CD1 3.86Å; L67-L70 HydrophobicContact CG-CB 4.33Å; L67-L70 PolarHBondContact O-N 3.44Å
71M48.6Very low48.6Very low88 Ų88104.5 Ų104.543%0.43348%0.48SS..  trans-106.169.2-178-70.8-160.1179.400112.3L67 W73 L74L67-M71 HydrophobicContact CD2-CE 4Å; L67-M71 HydrophobicContact CD2-CG 4.32Å; L67-M71 HydrophobicContact CD2-SD 4.11Å; L67-M71 HydrophobicContact CG-CG 4.26Å; L67-M71 PolarHBondContact O-N 2.82Å; M71-W73 PolarHBondContact O-N 2.82Å; M71-W73 VanDerWaalsContact O-N 3.15Å; M71-L74 HydrophobicContact CB-CB 3.77Å; M71-L74 PolarHBondContact O-N 3.24Å; M71-L74 HydrophobicContact SD-CB 4.18Å; M71-L74 HydrophobicContact SD-CD1 4.18Å; M71-L74 HydrophobicContact SD-CD2 3.8Å; M71-L74 HydrophobicContact SD-CG 4.28Å
72K47Very low49Very low190 Ų190104.4 Ų104.483%0.82648%0.479SS*.THydrogen-bonded Turntrans-64-12.8171.4-70.9172.7-176.8160.40113.7
73W42.7Very low49.5Very low249 Ų249104.4 Ų104.494%0.94348%0.479SS*.THydrogen-bonded Turntrans-95.9-5.5-179-13471.4000113.3M71M71-W73 PolarHBondContact O-N 2.82Å; M71-W73 VanDerWaalsContact O-N 3.15Å
74L46.2Very low50.2Low79 Ų7998.9 Ų98.941%0.41446%0.461SS..SBendtrans-96.7126.2-174.8-162.681.4000110.5M71 W76 L79M71-L74 HydrophobicContact CB-CB 3.77Å; M71-L74 PolarHBondContact O-N 3.24Å; M71-L74 HydrophobicContact SD-CB 4.18Å; M71-L74 HydrophobicContact SD-CD1 4.18Å; M71-L74 HydrophobicContact SD-CD2 3.8Å; M71-L74 HydrophobicContact SD-CG 4.28Å; L74-W76 PolarHBondContact O-N 2.77Å; L74-L79 HydrophobicContact CD2-CD1 4.24Å
75F53.3Low51Low144 Ų14498.1 Ų98.163%0.63246%0.456SS*.  trans-69.6100.1177.5-97.2-99.9000110.8P77 L78 L79F75-P77 VanDerWaalsContact C-N 3.33Å; F75-L78 HydrophobicContact CB-CB 3.71Å; F75-L78 WeakPolarHBondContact O-CA 3.22Å; F75-L78 VanDerWaalsContact O-CB 3.24Å; F75-L78 WeakPolarHBondContact O-CB 3.33Å; F75-L78 PolarHBondContact O-N 3.5Å; F75-L79 PolarHBondContact O-N 2.89Å; F75-L79 VanDerWaalsContact O-N 3.13Å
76W49.6Very low51.6Low109 Ų10995.2 Ų95.241%0.41344%0.443SS..Hα-helixtrans-48.5-41.1171.7-85.272.4000115.3D68 L74 L78 L79 D80D68-W76 VanDerWaalsContact CA-CZ2 3.45Å; D68-W76 HydrophobicContact CB-CH2 3.87Å; D68-W76 HydrophobicContact CB-CZ2 3.37Å; D68-W76 VanDerWaalsContact OD2-CE2 3.27Å; D68-W76 VanDerWaalsContact OD2-CH2 3.31Å; D68-W76 WeakPolarHBondContact OD2-CH2 3.2Å; D68-W76 WeakPolarHBondContact OD2-CZ2 3.23Å; L74-W76 PolarHBondContact O-N 2.77Å; W76-L78 VanDerWaalsContact C-N 3.29Å; W76-L78 PolarHBondContact O-N 2.81Å; W76-L79 PolarHBondContact O-N 3.46Å; W76-D80 PolarHBondContact O-N 3.34Å
77P49.8Very low52.1Low43 Ų4390.6 Ų90.628%0.27943%0.431SS..Hα-helixtrans-65.9-31.4175.1-18.931.6000113.3F75 D80 I81 L132F75-P77 VanDerWaalsContact C-N 3.33Å; P77-D80 WeakPolarHBondContact O-CB 3.35Å; P77-D80 PolarHBondContact O-N 3.32Å; P77-I81 WeakPolarHBondContact O-CD1 3.11Å; P77-I81 VanDerWaalsContact O-CG1 3.32Å; P77-I81 WeakPolarHBondContact O-CG1 3.45Å; P77-I81 PolarHBondContact O-N 2.84Å; P77-I81 VanDerWaalsContact O-N 3.16Å; P77-L132 HydrophobicContact CB-CD1 4.04Å; P77-L132 HydrophobicContact CB-CD2 3.52Å; P77-L132 HydrophobicContact CB-CG 4.45Å; P77-L132 HydrophobicContact CG-CD1 4.27Å; P77-L132 HydrophobicContact CG-CD2 3.92Å
78L49.8Very low52.8Low93 Ų9389.3 Ų89.349%0.48743%0.425SS..Hα-helixtrans-72.5-40.5-179.8-147.982.5000110.6F75 W76 D80 I81 I82F75-L78 HydrophobicContact CB-CB 3.71Å; F75-L78 WeakPolarHBondContact O-CA 3.22Å; F75-L78 VanDerWaalsContact O-CB 3.24Å; F75-L78 WeakPolarHBondContact O-CB 3.33Å; F75-L78 PolarHBondContact O-N 3.5Å; W76-L78 VanDerWaalsContact C-N 3.29Å; W76-L78 PolarHBondContact O-N 2.81Å; L78-D80 PolarHBondContact O-N 3.18Å; L78-I81 PolarHBondContact O-N 2.94Å; L78-I82 VanDerWaalsContact O-CG1 3.29Å; L78-I82 WeakPolarHBondContact O-CG1 3.47Å; L78-I82 PolarHBondContact O-N 3.3Å
79L53.2Low53.7Low50 Ų5089 Ų8926%0.26243%0.426SS..Hα-helixtrans-60.3-37.5173.1-165.483.7000111.5F59 L74 F75 W76 I82 N83F59-L79 HydrophobicContact CE1-CD1 4.39Å; F59-L79 HydrophobicContact CE1-CD2 4.29Å; F59-L79 HydrophobicContact CE1-CG 4.01Å; L74-L79 HydrophobicContact CD2-CD1 4.24Å; F75-L79 PolarHBondContact O-N 2.89Å; F75-L79 VanDerWaalsContact O-N 3.13Å; W76-L79 PolarHBondContact O-N 3.46Å; L79-I82 PolarHBondContact O-N 2.96Å; L79-N83 WeakPolarHBondContact O-CB 3.49Å; L79-N83 PolarHBondContact O-N 3.36Å
80D55.8Low54.3Low53 Ų5382.5 Ų82.528%0.28340%0.402SS..Hα-helixtrans-67.9-37.7178.3-140.98.1000112.4R25 W76 P77 L78 S84R25-D80 IonicContact CZ-OD1 3.14Å; R25-D80 IonicContact CZ-OD2 3.26Å; R25-D80 VanDerWaalsContact CZ-OD2 3.26Å; R25-D80 IonicContact NH1-OD1 2.65Å; R25-D80 PolarHBondContact NH1-OD1 3Å; R25-D80 IonicContact NH1-OD2 2.89Å; R25-D80 PolarHBondContact NH1-OD2 3.37Å; R25-D80 IonicContact NH2-OD1 3.24Å; R25-D80 PolarHBondContact NH2-OD1 2.94Å; R25-D80 IonicContact NH2-OD2 2.75Å; R25-D80 PolarHBondContact NH2-OD2 3.24Å; W76-D80 PolarHBondContact O-N 3.34Å; P77-D80 WeakPolarHBondContact O-CB 3.35Å; P77-D80 PolarHBondContact O-N 3.32Å; L78-D80 PolarHBondContact O-N 3.18Å; D80-S84 PolarHBondContact O-N 3.47Å
81I56.8Low55.3Low29 Ų2977.8 Ų77.815%0.14938%0.377CS..Hα-helixtrans-68.4-43.4174.2-68.1159.7000110.7P77 L78 N83 S84 M85 Y129P77-I81 WeakPolarHBondContact O-CD1 3.11Å; P77-I81 VanDerWaalsContact O-CG1 3.32Å; P77-I81 WeakPolarHBondContact O-CG1 3.45Å; P77-I81 PolarHBondContact O-N 2.84Å; P77-I81 VanDerWaalsContact O-N 3.16Å; L78-I81 PolarHBondContact O-N 2.94Å; I81-N83 VanDerWaalsContact C-N 3.31Å; I81-N83 PolarHBondContact O-N 2.95Å; I81-S84 PolarHBondContact O-N 3.41Å; I81-M85 HydrophobicContact CG2-CG 4.37Å; I81-M85 HydrophobicContact CG2-SD 4.33Å; I81-M85 WeakPolarHBondContact O-CB 3.26Å; I81-M85 WeakPolarHBondContact O-CG 3.28Å; I81-M85 PolarHBondContact O-N 2.93Å; I81-Y129 HydrophobicContact CD1-CD2 3.54Å; I81-Y129 HydrophobicContact CD1-CG 4.17Å
82I58.5Low56.1Low84 Ų8477.8 Ų77.843%0.43138%0.378SS..Hα-helixtrans-60.4-43.4176.6-68.2165.5000110.1L78 L79 S84 M85 V86L78-I82 VanDerWaalsContact O-CG1 3.29Å; L78-I82 WeakPolarHBondContact O-CG1 3.47Å; L78-I82 PolarHBondContact O-N 3.3Å; L79-I82 PolarHBondContact O-N 2.96Å; I82-S84 PolarHBondContact O-N 2.92Å; I82-M85 PolarHBondContact O-N 2.95Å; I82-V86 HydrophobicContact CG2-CG2 4.34Å; I82-V86 WeakPolarHBondContact O-CB 3.4Å; I82-V86 WeakPolarHBondContact O-CG2 3.5Å; I82-V86 PolarHBondContact O-N 2.91Å
83N63.1Low56.9Low47 Ų4771.9 Ų71.925%0.25136%0.355SS..Hα-helixtrans-62-44176-172.957.4000112.2F59 L79 I81 M85 V86 T87F59-N83 HydrophobicContact CD1-CB 4.44Å; F59-N83 HydrophobicContact CE1-CB 3.71Å; F59-N83 HydrophobicContact CE2-CB 4.34Å; F59-N83 HydrophobicContact CZ-CB 3.65Å; L79-N83 WeakPolarHBondContact O-CB 3.49Å; L79-N83 PolarHBondContact O-N 3.36Å; I81-N83 VanDerWaalsContact C-N 3.31Å; I81-N83 PolarHBondContact O-N 2.95Å; N83-M85 PolarHBondContact O-N 3.47Å; N83-V86 PolarHBondContact O-N 3.37Å; N83-T87 PolarHBondContact O-N 3.4Å; N83-T87 PolarHBondContact O-OG1 3.07Å; N83-T87 VanDerWaalsContact O-OG1 3.11Å
84S59.8Low57.8Low27 Ų2762.2 Ų62.219%0.18932%0.324CS..Hα-helixtrans-62.3-42175.1-171.30000112.2D80 I81 I82 V86 T87 T88 C121D80-S84 PolarHBondContact O-N 3.47Å; I81-S84 PolarHBondContact O-N 3.41Å; I82-S84 PolarHBondContact O-N 2.92Å; S84-V86 VanDerWaalsContact C-N 3.34Å; S84-T87 PolarHBondContact O-N 3.33Å; S84-T88 PolarHBondContact O-N 3.46Å; S84-T88 PolarHBondContact O-OG1 3.43Å; S84-T88 VanDerWaalsContact O-OG1 3.07Å; S84-C121 PolarHBondContact OG-O 3.41Å
85M58.6Low58.8Low107 Ų10758.8 Ų58.853%0.52731%0.306SS..Hα-helixtrans-63.1-42.2177.3-76.3-171.565.400111.7I81 I82 N83 T88 V89I81-M85 HydrophobicContact CG2-CG 4.37Å; I81-M85 HydrophobicContact CG2-SD 4.33Å; I81-M85 WeakPolarHBondContact O-CB 3.26Å; I81-M85 WeakPolarHBondContact O-CG 3.28Å; I81-M85 PolarHBondContact O-N 2.93Å; I82-M85 PolarHBondContact O-N 2.95Å; N83-M85 PolarHBondContact O-N 3.47Å; M85-T88 PolarHBondContact O-N 3.43Å; M85-V89 WeakPolarHBondContact O-CG2 3.45Å; M85-V89 PolarHBondContact O-N 2.92Å
86V60.4Low59.4Low41 Ų4155.6 Ų55.625%0.24830%0.298CS..Hα-helixtrans-61.2-48.2177.2167.90000110.3V55 I82 N83 S84 T88 V89 F90V55-V86 HydrophobicContact CG1-CG1 3.67Å; I82-V86 HydrophobicContact CG2-CG2 4.34Å; I82-V86 WeakPolarHBondContact O-CB 3.4Å; I82-V86 WeakPolarHBondContact O-CG2 3.5Å; I82-V86 PolarHBondContact O-N 2.91Å; N83-V86 PolarHBondContact O-N 3.37Å; S84-V86 VanDerWaalsContact C-N 3.34Å; V86-T88 VanDerWaalsContact C-N 3.35Å; V86-T88 PolarHBondContact O-N 2.93Å; V86-V89 PolarHBondContact O-N 3.36Å; V86-F90 HydrophobicContact CG1-CD2 3.68Å; V86-F90 HydrophobicContact CG1-CE2 3.5Å; V86-F90 WeakPolarHBondContact O-CD2 3.45Å; V86-F90 PolarHBondContact O-N 3.47Å
87T60.3Low59.9Low51 Ų5152.9 Ų52.931%0.31329%0.291SS..Hα-helixtrans-60.1-41.2175-55.30000112.7N83 S84 F90 M91N83-T87 PolarHBondContact O-N 3.4Å; N83-T87 PolarHBondContact O-OG1 3.07Å; N83-T87 VanDerWaalsContact O-OG1 3.11Å; S84-T87 PolarHBondContact O-N 3.33Å; T87-F90 PolarHBondContact O-N 3.04Å; T87-M91 WeakPolarHBondContact O-CB 3.49Å; T87-M91 PolarHBondContact O-N 3Å
88T62.8Low60.5Low14 Ų1451.2 Ų51.29%0.08628%0.281CS..Hα-helixtrans-62.2-43.7176.4-63.80000111.8S84 M85 V86 F90 M91 L92 A118 L122S84-T88 PolarHBondContact O-N 3.46Å; S84-T88 PolarHBondContact O-OG1 3.43Å; S84-T88 VanDerWaalsContact O-OG1 3.07Å; M85-T88 PolarHBondContact O-N 3.43Å; V86-T88 VanDerWaalsContact C-N 3.35Å; V86-T88 PolarHBondContact O-N 2.93Å; T88-F90 VanDerWaalsContact C-N 3.34Å; T88-M91 PolarHBondContact O-N 3.15Å; T88-L92 VanDerWaalsContact O-CB 3.27Å; T88-L92 WeakPolarHBondContact O-CB 3.27Å; T88-L92 PolarHBondContact O-N 3.2Å; T88-A118 HydrophobicContact CG2-CB 4.12Å; T88-A118 PolarHBondContact OG1-O 2.82Å; T88-L122 HydrophobicContact CG2-CB 4.17Å; T88-L122 HydrophobicContact CG2-CD1 4.06Å
89V61.8Low61.1Low82 Ų8251.8 Ų51.850%0.49728%0.284SS..Hα-helixtrans-63.5-41.4177.8170.90000110.7M85 V86 L92 I93M85-V89 WeakPolarHBondContact O-CG2 3.45Å; M85-V89 PolarHBondContact O-N 2.92Å; V86-V89 PolarHBondContact O-N 3.36Å; V89-L92 PolarHBondContact O-N 2.78Å; V89-I93 HydrophobicContact CG1-CD1 3.82Å; V89-I93 WeakPolarHBondContact O-CD1 3.32Å; V89-I93 VanDerWaalsContact O-CG1 3.22Å; V89-I93 WeakPolarHBondContact O-CG1 3.15Å; V89-I93 PolarHBondContact O-N 3.29Å
90F58.8Low61.7Low18 Ų1855.1 Ų55.18%0.07930%0.301CS..Hα-helixtrans-64.6-47.5176.2-81.5-65.8000113.2F51 E52 V55 V86 T87 T88 L92 I93 V94F51-F90 AromaticContact CD1-CE1 3.55Å; F51-F90 HydrophobicContact CD1-CE1 3.55Å; F51-F90 AromaticContact CD1-CZ 3.4Å; F51-F90 HydrophobicContact CD1-CZ 3.4Å; F51-F90 HydrophobicContact CE1-CE1 4.01Å; F51-F90 AromaticContact CE1-CZ 3.51Å; F51-F90 HydrophobicContact CE1-CZ 3.51Å; F51-F90 HydrophobicContact CG-CZ 4.44Å; E52-F90 HydrophobicContact CB-CD1 4.31Å; E52-F90 HydrophobicContact CB-CE1 4.21Å; E52-F90 HydrophobicContact CG-CG 4.49Å; V55-F90 HydrophobicContact CB-CE2 4.39Å; V55-F90 HydrophobicContact CG1-CE2 4.37Å; V55-F90 HydrophobicContact CG2-CE2 4.26Å; V55-F90 HydrophobicContact CG2-CZ 4.19Å; V86-F90 HydrophobicContact CG1-CD2 3.68Å; V86-F90 HydrophobicContact CG1-CE2 3.5Å; V86-F90 WeakPolarHBondContact O-CD2 3.45Å; V86-F90 PolarHBondContact O-N 3.47Å; T87-F90 PolarHBondContact O-N 3.04Å; T88-F90 VanDerWaalsContact C-N 3.34Å; F90-L92 PolarHBondContact O-N 3.47Å; F90-I93 WeakPolarHBondContact O-CB 3.43Å; F90-I93 PolarHBondContact O-N 2.85Å; F90-I93 VanDerWaalsContact O-N 3.14Å; F90-V94 WeakPolarHBondContact O-CG2 3.32Å; F90-V94 PolarHBondContact O-N 2.95Å
91M63.8Low61.8Low36 Ų3654.6 Ų54.618%0.17730%0.3CS..Hα-helixtrans-62.1-33.6175.9-78-78.9172.600112.5T87 T88 S95 A114 A118T87-M91 WeakPolarHBondContact O-CB 3.49Å; T87-M91 PolarHBondContact O-N 3Å; T88-M91 PolarHBondContact O-N 3.15Å; M91-S95 VanDerWaalsContact O-CB 3.28Å; M91-S95 WeakPolarHBondContact O-CB 3.49Å; M91-S95 PolarHBondContact O-N 3.35Å; M91-A114 HydrophobicContact SD-CB 3.81Å; M91-A118 HydrophobicContact CB-CB 3.74Å
92L66.5Low61.8Low88 Ų8863.2 Ų63.246%0.46134%0.34SS..Hα-helixtrans-68.5-42.2174.2-170.5148.3000111.3T88 V89 F90 S95 V96T88-L92 VanDerWaalsContact O-CB 3.27Å; T88-L92 WeakPolarHBondContact O-CB 3.27Å; T88-L92 PolarHBondContact O-N 3.2Å; V89-L92 PolarHBondContact O-N 2.78Å; F90-L92 PolarHBondContact O-N 3.47Å; L92-S95 WeakPolarHBondContact O-CB 3.4Å; L92-S95 PolarHBondContact O-N 3.22Å; L92-V96 HydrophobicContact CD2-CG2 4.25Å; L92-V96 WeakPolarHBondContact O-CG2 3.45Å; L92-V96 PolarHBondContact O-N 3.3Å
93I62.8Low61.7Low66 Ų6662.3 Ų62.334%0.33834%0.339SS..Hα-helixtrans-61.9-47.1174.1-69.1162.6000110.3V89 F90 S95 V96 L97V89-I93 HydrophobicContact CG1-CD1 3.82Å; V89-I93 WeakPolarHBondContact O-CD1 3.32Å; V89-I93 VanDerWaalsContact O-CG1 3.22Å; V89-I93 WeakPolarHBondContact O-CG1 3.15Å; V89-I93 PolarHBondContact O-N 3.29Å; F90-I93 WeakPolarHBondContact O-CB 3.43Å; F90-I93 PolarHBondContact O-N 2.85Å; F90-I93 VanDerWaalsContact O-N 3.14Å; I93-S95 VanDerWaalsContact C-N 3.31Å; I93-S95 PolarHBondContact O-N 3.29Å; I93-V96 PolarHBondContact O-N 3.32Å; I93-L97 HydrophobicContact CG2-CD1 3.55Å; I93-L97 HydrophobicContact CG2-CG 4.25Å; I93-L97 WeakPolarHBondContact O-CB 3.48Å; I93-L97 WeakPolarHBondContact O-CD1 3.2Å; I93-L97 WeakPolarHBondContact O-CG 3.48Å; I93-L97 PolarHBondContact O-N 2.99Å
94V62.2Low61.7Low46 Ų4664.4 Ų64.428%0.27935%0.353SS..Hα-helixtrans-60.8-40.2176.1172.30000111.5F90 L97 A98 A114F90-V94 WeakPolarHBondContact O-CG2 3.32Å; F90-V94 PolarHBondContact O-N 2.95Å; V94-L97 PolarHBondContact O-N 3.41Å; V94-A98 VanDerWaalsContact O-CB 3.23Å; V94-A98 WeakPolarHBondContact O-CB 3.5Å; V94-A98 PolarHBondContact O-N 2.87Å; V94-A114 HydrophobicContact CG1-CB 4.49Å
95S67.4Low62Low7 Ų768.7 Ų68.75%0.04938%0.381CS..Hα-helixtrans-62-48.9175.8-174.60000112.5M91 L92 I93 L97 A98 L99 G111 L115M91-S95 VanDerWaalsContact O-CB 3.28Å; M91-S95 WeakPolarHBondContact O-CB 3.49Å; M91-S95 PolarHBondContact O-N 3.35Å; L92-S95 WeakPolarHBondContact O-CB 3.4Å; L92-S95 PolarHBondContact O-N 3.22Å; I93-S95 VanDerWaalsContact C-N 3.31Å; I93-S95 PolarHBondContact O-N 3.29Å; S95-L97 VanDerWaalsContact C-N 3.34Å; S95-L97 PolarHBondContact O-N 3.32Å; S95-A98 PolarHBondContact O-N 3Å; S95-L99 VanDerWaalsContact O-CD1 3.26Å; S95-L99 WeakPolarHBondContact O-CD1 3.39Å; S95-L99 PolarHBondContact O-N 3.37Å; S95-G111 VanDerWaalsContact CB-O 3.28Å; S95-G111 WeakPolarHBondContact CB-O 3.28Å; S95-G111 PolarHBondContact OG-O 3.35Å; S95-L115 WeakPolarHBondContact OG-CB 3.4Å; S95-L115 VanDerWaalsContact OG-CD1 3.25Å; S95-L115 WeakPolarHBondContact OG-CD1 3.48Å
96V64.9Low62Low76 Ų7670.9 Ų70.946%0.46139%0.393SS..Hα-helixtrans-63.3-42.5178.3171.70000110.6L92 I93 A98 L99 I100L92-V96 HydrophobicContact CD2-CG2 4.25Å; L92-V96 WeakPolarHBondContact O-CG2 3.45Å; L92-V96 PolarHBondContact O-N 3.3Å; I93-V96 PolarHBondContact O-N 3.32Å; V96-A98 VanDerWaalsContact C-N 3.34Å; V96-A98 PolarHBondContact O-N 3.47Å; V96-L99 PolarHBondContact O-N 3.04Å; V96-L99 VanDerWaalsContact O-N 3.16Å; V96-I100 HydrophobicContact CG1-CD1 3.77Å; V96-I100 HydrophobicContact CG1-CG1 4.48Å; V96-I100 WeakPolarHBondContact O-CD1 3.29Å; V96-I100 VanDerWaalsContact O-CG1 3.27Å; V96-I100 WeakPolarHBondContact O-CG1 3.47Å; V96-I100 PolarHBondContact O-N 2.89Å
97L61.3Low62.2Low52 Ų5271 Ų7127%0.27240%0.395SS..Hα-helixtrans-69.7-28.6178.6-68.4171000113.6I48 I93 V94 S95 L99 I100 P101I48-L97 HydrophobicContact CD1-CD1 3.27Å; I48-L97 HydrophobicContact CG1-CD1 4.39Å; I93-L97 HydrophobicContact CG2-CD1 3.55Å; I93-L97 HydrophobicContact CG2-CG 4.25Å; I93-L97 WeakPolarHBondContact O-CB 3.48Å; I93-L97 WeakPolarHBondContact O-CD1 3.2Å; I93-L97 WeakPolarHBondContact O-CG 3.48Å; I93-L97 PolarHBondContact O-N 2.99Å; V94-L97 PolarHBondContact O-N 3.41Å; S95-L97 VanDerWaalsContact C-N 3.34Å; S95-L97 PolarHBondContact O-N 3.32Å; L97-L99 VanDerWaalsContact C-N 3.27Å; L97-I100 HydrophobicContact CD2-CD1 4.09Å; L97-P101 WeakPolarHBondContact O-CD 3.14Å
98A60.9Low62.5Low8 Ų871.5 Ų71.57%0.06640%0.397CS..Hα-helixtrans-72.4-20.8172.400000113.1V94 S95 V96 T107V94-A98 VanDerWaalsContact O-CB 3.23Å; V94-A98 WeakPolarHBondContact O-CB 3.5Å; V94-A98 PolarHBondContact O-N 2.87Å; S95-A98 PolarHBondContact O-N 3Å; V96-A98 VanDerWaalsContact C-N 3.34Å; V96-A98 PolarHBondContact O-N 3.47Å; A98-T107 HydrophobicContact CB-CG2 4Å
99L63.9Low62.8Low106 Ų10672.9 Ų72.956%0.55541%0.414SS*.Hα-helixtrans-91-17.6176.8-95.577.5000113.9S95 V96 L97S95-L99 VanDerWaalsContact O-CD1 3.26Å; S95-L99 WeakPolarHBondContact O-CD1 3.39Å; S95-L99 PolarHBondContact O-N 3.37Å; V96-L99 PolarHBondContact O-N 3.04Å; V96-L99 VanDerWaalsContact O-N 3.16Å; L97-L99 VanDerWaalsContact C-N 3.27Å
100I64.7Low63.1Low120 Ų12070.9 Ų70.962%0.61541%0.41SS*.SBendtrans-75.4-44.6-175-75.5162000114.3V96 L97V96-I100 HydrophobicContact CG1-CD1 3.77Å; V96-I100 HydrophobicContact CG1-CG1 4.48Å; V96-I100 WeakPolarHBondContact O-CD1 3.29Å; V96-I100 VanDerWaalsContact O-CG1 3.27Å; V96-I100 WeakPolarHBondContact O-CG1 3.47Å; V96-I100 PolarHBondContact O-N 2.89Å; L97-I100 HydrophobicContact CD2-CD1 4.09Å
101P57.7Low63.5Low41 Ų4170 Ų7027%0.26641%0.406SS..SBendtrans-81.3141.1-179.229.8-31.3000110.8L97 T103L97-P101 WeakPolarHBondContact O-CD 3.14Å; P101-T103 HydrophobicContact CB-CG2 3.78Å; P101-T103 HydrophobicContact CG-CG2 4.23Å; P101-T103 WeakPolarHBondContact CG-OG1 3.44Å; P101-T103 PolarHBondContact O-N 3.14Å; P101-T103 PolarHBondContact O-OG1 3.33Å
102E57Low64Low211 Ų21172.1 Ų72.199%0.98642%0.421SS*.  trans-66.766.5166.3-66.6-144-17500110.7
103T57.1Low64Low65 Ų6575.1 Ų75.140%0.39943%0.431SS..  trans-121163.2-17655.80000111.5P101P101-T103 HydrophobicContact CB-CG2 3.78Å; P101-T103 HydrophobicContact CG-CG2 4.23Å; P101-T103 WeakPolarHBondContact CG-OG1 3.44Å; P101-T103 PolarHBondContact O-N 3.14Å; P101-T103 PolarHBondContact O-OG1 3.33Å
104T63.1Low64.1Low91 Ų9172.4 Ų72.456%0.55842%0.418SS*.  trans-37.6145-173.437.80000114.2L106 T107T104-L106 PolarHBondContact O-N 2.96Å; T104-T107 PolarHBondContact O-N 2.89Å
105P65.8Low64.5Low117 Ų11774 Ų7476%0.7642%0.424SS*.Hα-helixtrans-56.1-18.8-178.923.4-35000113.8G109P105-G109 PolarHBondContact O-N 2.92Å
106L59.5Low64.8Low152 Ų15277.5 Ų77.580%0.79645%0.445SS*.Hα-helixtrans-64.4-41.2174.4-15582.7000112.7T104 G109 G110T104-L106 PolarHBondContact O-N 2.96Å; L106-G109 PolarHBondContact O-N 3.44Å; L106-G110 PolarHBondContact O-N 2.88Å
107T63.1Low65Low45 Ų4576.1 Ų76.128%0.27644%0.437SS..Hα-helixtrans-69.3-44.3179-54.80000110.6A98 T104 G109 G110 G111A98-T107 HydrophobicContact CB-CG2 4Å; T104-T107 PolarHBondContact O-N 2.89Å; T107-G109 VanDerWaalsContact C-N 3.29Å; T107-G109 PolarHBondContact O-N 3.48Å; T107-G110 PolarHBondContact O-N 3.03Å; T107-G110 VanDerWaalsContact O-N 3.11Å; T107-G111 PolarHBondContact O-N 3.44Å
108V67.7Low65.1Low61 Ų6173.9 Ų73.937%0.3743%0.426SS..Hα-helixtrans-59.6-42.2174.7-1800000110.6G110 G111 V112V108-G110 PolarHBondContact O-N 3.42Å; V108-G111 PolarHBondContact O-N 3.45Å; V108-V112 WeakPolarHBondContact O-CG2 3.25Å; V108-V112 PolarHBondContact O-N 3.48Å
109G69.2Low65.8Low42 Ų4277.9 Ų77.943%0.43345%0.449SS..Hα-helixtrans-59.1-43.4173.900000112.9P105 L106 T107 V112 F113P105-G109 PolarHBondContact O-N 2.92Å; L106-G109 PolarHBondContact O-N 3.44Å; T107-G109 VanDerWaalsContact C-N 3.29Å; T107-G109 PolarHBondContact O-N 3.48Å; G109-V112 PolarHBondContact O-N 3.4Å; G109-F113 WeakPolarHBondContact O-CB 3.46Å; G109-F113 PolarHBondContact O-N 3.31Å
110G67.2Low65.9Low40 Ų4076 Ų7641%0.41244%0.444SS..Hα-helixtrans-61.2-42174.200000112.9L106 T107 V108 F113 A114L106-G110 PolarHBondContact O-N 2.88Å; T107-G110 PolarHBondContact O-N 3.03Å; T107-G110 VanDerWaalsContact O-N 3.11Å; V108-G110 PolarHBondContact O-N 3.42Å; G110-F113 PolarHBondContact O-N 2.57Å; G110-A114 WeakPolarHBondContact O-CB 3.43Å; G110-A114 PolarHBondContact O-N 3.5Å
111G67.7Low65.8Low0 Ų072.3 Ų72.30%043%0.429CS..Hα-helixtrans-64.2-42.1177.200000113.8S95 T107 V108 A114 L115S95-G111 VanDerWaalsContact CB-O 3.28Å; S95-G111 WeakPolarHBondContact CB-O 3.28Å; S95-G111 PolarHBondContact OG-O 3.35Å; T107-G111 PolarHBondContact O-N 3.44Å; V108-G111 PolarHBondContact O-N 3.45Å; G111-A114 PolarHBondContact O-N 3.1Å; G111-L115 PolarHBondContact O-N 3.28Å
112V74.8Confident66.4Low81 Ų8174.8 Ų74.849%0.49144%0.44SS..Hα-helixtrans-66.4-42.4176.9174.50000110.8V108 G109 A114 L115 V116V108-V112 WeakPolarHBondContact O-CG2 3.25Å; V108-V112 PolarHBondContact O-N 3.48Å; G109-V112 PolarHBondContact O-N 3.4Å; V112-A114 VanDerWaalsContact C-N 3.34Å; V112-A114 PolarHBondContact O-N 2.95Å; V112-L115 WeakPolarHBondContact O-CB 3.27Å; V112-L115 PolarHBondContact O-N 3.06Å; V112-V116 WeakPolarHBondContact O-CG2 3.46Å; V112-V116 PolarHBondContact O-N 3.08Å
113F65.6Low67Low151 Ų15167 Ų6766%0.66241%0.412SS*.Hα-helixtrans-66.2-37.3177.9-165.6-98.3000112.3G109 G110 V116 T117G109-F113 WeakPolarHBondContact O-CB 3.46Å; G109-F113 PolarHBondContact O-N 3.31Å; G110-F113 PolarHBondContact O-N 2.57Å; F113-V116 PolarHBondContact O-N 3.04Å; F113-T117 WeakPolarHBondContact O-CB 3.46Å; F113-T117 PolarHBondContact O-N 2.91Å; F113-T117 PolarHBondContact O-OG1 3.4Å
114A65.5Low67.1Low8 Ų868.6 Ų68.67%0.06642%0.417CS..Hα-helixtrans-63.3-40.1172.500000111.9M91 V94 G110 G111 V112 T117 A118M91-A114 HydrophobicContact SD-CB 3.81Å; V94-A114 HydrophobicContact CG1-CB 4.49Å; G110-A114 WeakPolarHBondContact O-CB 3.43Å; G110-A114 PolarHBondContact O-N 3.5Å; G111-A114 PolarHBondContact O-N 3.1Å; V112-A114 VanDerWaalsContact C-N 3.34Å; V112-A114 PolarHBondContact O-N 2.95Å; A114-T117 PolarHBondContact O-N 3.41Å; A114-A118 WeakPolarHBondContact O-CB 3.26Å; A114-A118 PolarHBondContact O-N 2.89Å
115L70.7Confident67Low79 Ų7964.8 Ų64.841%0.41440%0.397SS..Hα-helixtrans-62.7-47.1176.7-158.690.3000112.1S95 G111 V112 T117 A118 V119S95-L115 WeakPolarHBondContact OG-CB 3.4Å; S95-L115 VanDerWaalsContact OG-CD1 3.25Å; S95-L115 WeakPolarHBondContact OG-CD1 3.48Å; G111-L115 PolarHBondContact O-N 3.28Å; V112-L115 WeakPolarHBondContact O-CB 3.27Å; V112-L115 PolarHBondContact O-N 3.06Å; L115-T117 VanDerWaalsContact C-N 3.3Å; L115-T117 PolarHBondContact O-N 2.97Å; L115-A118 WeakPolarHBondContact O-CB 3.25Å; L115-A118 PolarHBondContact O-N 3.12Å; L115-V119 WeakPolarHBondContact O-CG2 3.42Å; L115-V119 PolarHBondContact O-N 3.22Å
116V74.4Confident67Low81 Ų8161.5 Ų61.549%0.49138%0.379SS..Hα-helixtrans-61.2-43.8177.9173.90000110.1V112 F113 A118 V119 C120V112-V116 WeakPolarHBondContact O-CG2 3.46Å; V112-V116 PolarHBondContact O-N 3.08Å; F113-V116 PolarHBondContact O-N 3.04Å; V116-A118 VanDerWaalsContact C-N 3.33Å; V116-A118 PolarHBondContact O-N 2.89Å; V116-V119 PolarHBondContact O-N 3.16Å; V116-C120 PolarHBondContact O-N 2.71Å; V116-C120 PolarHBondContact O-SG 3.42Å; V116-C120 VanDerWaalsContact O-SG 3.33Å
117T67.9Low67.3Low48 Ų4859.6 Ų59.629%0.29437%0.369SS..Hα-helixtrans-60.3-42.8176-560000111.6F113 A114 L115 V119 C120 C121F113-T117 WeakPolarHBondContact O-CB 3.46Å; F113-T117 PolarHBondContact O-N 2.91Å; F113-T117 PolarHBondContact O-OG1 3.4Å; A114-T117 PolarHBondContact O-N 3.41Å; L115-T117 VanDerWaalsContact C-N 3.3Å; L115-T117 PolarHBondContact O-N 2.97Å; T117-V119 PolarHBondContact O-N 3.47Å; T117-C120 PolarHBondContact O-N 3.25Å; T117-C121 WeakPolarHBondContact O-CB 2.93Å; T117-C121 PolarHBondContact O-N 3.29Å
118A64.6Low67.3Low5 Ų561.7 Ų61.74%0.04138%0.378CS..Hα-helixtrans-60.8-44.5177.800000112.4T88 M91 A114 L115 V116 C121 L122T88-A118 HydrophobicContact CG2-CB 4.12Å; T88-A118 PolarHBondContact OG1-O 2.82Å; M91-A118 HydrophobicContact CB-CB 3.74Å; A114-A118 WeakPolarHBondContact O-CB 3.26Å; A114-A118 PolarHBondContact O-N 2.89Å; L115-A118 WeakPolarHBondContact O-CB 3.25Å; L115-A118 PolarHBondContact O-N 3.12Å; V116-A118 VanDerWaalsContact C-N 3.33Å; V116-A118 PolarHBondContact O-N 2.89Å; A118-C121 PolarHBondContact O-N 3.47Å; A118-L122 WeakPolarHBondContact O-CB 3.28Å; A118-L122 PolarHBondContact O-N 3.45Å
119V74.9Confident66.9Low91 Ų9164 Ų6455%0.55238%0.38SS*.Hα-helixtrans-65.6-43.8178.4173.50000111.1L115 V116 T117 L122 A123L115-V119 WeakPolarHBondContact O-CG2 3.42Å; L115-V119 PolarHBondContact O-N 3.22Å; V116-V119 PolarHBondContact O-N 3.16Å; T117-V119 PolarHBondContact O-N 3.47Å; V119-L122 PolarHBondContact O-N 3.31Å; V119-A123 WeakPolarHBondContact O-CB 3.4Å; V119-A123 PolarHBondContact O-N 3.48Å
120C65.6Low66.7Low66 Ų6669.7 Ų69.745%0.44639%0.389SS..Hα-helixtrans-61.9-47.1175.9-70.50000111.7V116 T117 L122 A123 D124V116-C120 PolarHBondContact O-N 2.71Å; V116-C120 PolarHBondContact O-SG 3.42Å; V116-C120 VanDerWaalsContact O-SG 3.33Å; T117-C120 PolarHBondContact O-N 3.25Å; C120-L122 VanDerWaalsContact C-N 3.33Å; C120-L122 PolarHBondContact O-N 3.21Å; C120-A123 PolarHBondContact O-N 2.87Å; C120-D124 PolarHBondContact O-N 3Å
121C62Low66.4Low44 Ų4475.8 Ų75.830%0.29740%0.404SS..Hα-helixtrans-61.5-39.7176.3-77.60000112.7S84 T117 A118 A123 D124 G125S84-C121 PolarHBondContact OG-O 3.41Å; T117-C121 WeakPolarHBondContact O-CB 2.93Å; T117-C121 PolarHBondContact O-N 3.29Å; A118-C121 PolarHBondContact O-N 3.47Å; C121-A123 VanDerWaalsContact C-N 3.34Å; C121-D124 PolarHBondContact O-N 3.23Å; C121-G125 PolarHBondContact O-N 3.36Å
122L70.8Confident66Low93 Ų9379.5 Ų79.549%0.48742%0.424SS..Hα-helixtrans-64.1-41.6175.6-168.781.6000111.1T88 A118 V119 C120 G125 A126T88-L122 HydrophobicContact CG2-CB 4.17Å; T88-L122 HydrophobicContact CG2-CD1 4.06Å; A118-L122 WeakPolarHBondContact O-CB 3.28Å; A118-L122 PolarHBondContact O-N 3.45Å; V119-L122 PolarHBondContact O-N 3.31Å; C120-L122 VanDerWaalsContact C-N 3.33Å; C120-L122 PolarHBondContact O-N 3.21Å; L122-G125 PolarHBondContact O-N 3.07Å; L122-A126 WeakPolarHBondContact O-CB 3.42Å; L122-A126 PolarHBondContact O-N 3.49Å
123A70.8Confident65.3Low48 Ų4880.6 Ų80.640%0.39743%0.426SS..Hα-helixtrans-64.7-44.3177.400000111.8V119 C120 C121 A126 L127V119-A123 WeakPolarHBondContact O-CB 3.4Å; V119-A123 PolarHBondContact O-N 3.48Å; C120-A123 PolarHBondContact O-N 2.87Å; C121-A123 VanDerWaalsContact C-N 3.34Å; A123-A126 PolarHBondContact O-N 2.91Å; A123-L127 WeakPolarHBondContact O-CB 3.23Å; A123-L127 VanDerWaalsContact O-CG 3.23Å; A123-L127 WeakPolarHBondContact O-CG 3.33Å; A123-L127 PolarHBondContact O-N 3.46Å
124D59.3Low64.9Low97 Ų9780.8 Ų80.852%0.51943%0.427SS..Hα-helixtrans-63.1-43.8175.5-80.8-49000112C120 C121 A126 L127 I128C120-D124 PolarHBondContact O-N 3Å; C121-D124 PolarHBondContact O-N 3.23Å; D124-A126 PolarHBondContact O-N 2.78Å; D124-L127 PolarHBondContact O-N 3.03Å; D124-I128 WeakPolarHBondContact O-CB 3.27Å; D124-I128 VanDerWaalsContact O-CG1 3.27Å; D124-I128 WeakPolarHBondContact O-CG1 3.32Å; D124-I128 PolarHBondContact O-N 3.33Å
125G61Low64.1Low12 Ų1284.6 Ų84.612%0.12445%0.446CS..Hα-helixtrans-61.1-43.617400000112.4C121 L122 I128 Y129C121-G125 PolarHBondContact O-N 3.36Å; L122-G125 PolarHBondContact O-N 3.07Å; G125-I128 PolarHBondContact O-N 3.44Å; G125-Y129 VanDerWaalsContact O-CB 3.32Å; G125-Y129 WeakPolarHBondContact O-CB 3.5Å; G125-Y129 PolarHBondContact O-N 3.45Å
126A64.1Low63.1Low48 Ų4886.3 Ų86.340%0.39746%0.462SS..Hα-helixtrans-68.1-36.5177.700000112.5L122 A123 D124 Y129 R130L122-A126 WeakPolarHBondContact O-CB 3.42Å; L122-A126 PolarHBondContact O-N 3.49Å; A123-A126 PolarHBondContact O-N 2.91Å; D124-A126 PolarHBondContact O-N 2.78Å; A126-Y129 PolarHBondContact O-N 3.27Å; A126-R130 WeakPolarHBondContact O-CB 3.34Å; A126-R130 WeakPolarHBondContact O-CG 3.46Å; A126-R130 PolarHBondContact O-N 3.44Å
127L67.1Low61.7Low111 Ų11186.6 Ų86.658%0.58147%0.467SS*.Hα-helixtrans-67.7-43175.4-76.3173.9000111.1A123 D124 R130 K131A123-L127 WeakPolarHBondContact O-CB 3.23Å; A123-L127 VanDerWaalsContact O-CG 3.23Å; A123-L127 WeakPolarHBondContact O-CG 3.33Å; A123-L127 PolarHBondContact O-N 3.46Å; D124-L127 PolarHBondContact O-N 3.03Å; L127-R130 PolarHBondContact O-N 3.39Å; L127-K131 VanDerWaalsContact O-CB 3.32Å; L127-K131 WeakPolarHBondContact O-CB 3.37Å; L127-K131 PolarHBondContact O-N 3.46Å
128I63.5Low60.8Low89 Ų8986 Ų8646%0.45647%0.471SS..Hα-helixtrans-63.9-43.6174.5-68.2166.2000110.2D124 G125 K131 L132D124-I128 WeakPolarHBondContact O-CB 3.27Å; D124-I128 VanDerWaalsContact O-CG1 3.27Å; D124-I128 WeakPolarHBondContact O-CG1 3.32Å; D124-I128 PolarHBondContact O-N 3.33Å; G125-I128 PolarHBondContact O-N 3.44Å; I128-K131 PolarHBondContact O-N 3.32Å; I128-L132 WeakPolarHBondContact O-CB 3.44Å; I128-L132 PolarHBondContact O-N 3.45Å
129Y59.2Low59.8Low109 Ų10991.6 Ų91.643%0.42751%0.507SS..Hα-helixtrans-60.1-47.5175.5178.3-109.9000111.7I81 G125 A126 K131 L132 L133I81-Y129 HydrophobicContact CD1-CD2 3.54Å; I81-Y129 HydrophobicContact CD1-CG 4.17Å; G125-Y129 VanDerWaalsContact O-CB 3.32Å; G125-Y129 WeakPolarHBondContact O-CB 3.5Å; G125-Y129 PolarHBondContact O-N 3.45Å; A126-Y129 PolarHBondContact O-N 3.27Å; Y129-K131 PolarHBondContact O-N 3.46Å; Y129-L132 WeakPolarHBondContact O-CB 3.4Å; Y129-L132 PolarHBondContact O-N 2.72Å; Y129-L132 VanDerWaalsContact O-N 3.15Å; Y129-L133 HydrophobicContact CE1-CD2 4.18Å; Y129-L133 WeakPolarHBondContact O-CB 3.4Å; Y129-L133 PolarHBondContact O-N 2.94Å
130R64.6Low58.3Low163 Ų16397.7 Ų97.762%0.61552%0.522SS*.Hα-helixtrans-62.7-41.9175.4-79.7-159.6178.9-159.83.6111.7A126 L127 L132 L133 F134A126-R130 WeakPolarHBondContact O-CB 3.34Å; A126-R130 WeakPolarHBondContact O-CG 3.46Å; A126-R130 PolarHBondContact O-N 3.44Å; L127-R130 PolarHBondContact O-N 3.39Å; R130-L132 PolarHBondContact O-N 3.23Å; R130-L133 PolarHBondContact O-N 3.46Å; R130-F134 HydrophobicContact CB-CD2 4.12Å; R130-F134 HydrophobicContact CB-CE2 4.41Å; R130-F134 HydrophobicContact CG-CD2 4.43Å; R130-F134 HydrophobicContact CG-CE2 4.22Å; R130-F134 WeakPolarHBondContact O-CB 3.43Å; R130-F134 VanDerWaalsContact O-CD2 3.25Å; R130-F134 WeakPolarHBondContact O-CD2 3.45Å; R130-F134 PolarHBondContact O-N 3.11Å
131K61Low56.9Low167 Ų167102.5 Ų102.573%0.72654%0.538SS*.Hα-helixtrans-62.9-31.9176.2-141.5174.9-1651780111.4L127 I128 Y129 N135L127-K131 VanDerWaalsContact O-CB 3.32Å; L127-K131 WeakPolarHBondContact O-CB 3.37Å; L127-K131 PolarHBondContact O-N 3.46Å; I128-K131 PolarHBondContact O-N 3.32Å; Y129-K131 PolarHBondContact O-N 3.46Å; K131-N135 VanDerWaalsContact O-CB 3.26Å; K131-N135 WeakPolarHBondContact O-CB 3.43Å; K131-N135 PolarHBondContact O-N 3.03Å; K131-N135 VanDerWaalsContact O-N 3.14Å
132L58.8Low55.8Low79 Ų79109.6 Ų109.641%0.41456%0.563SS.*Hα-helixtrans-74.6-41.8174.7-138.291.1000112.5P77 I128 Y129 R130P77-L132 HydrophobicContact CB-CD1 4.04Å; P77-L132 HydrophobicContact CB-CD2 3.52Å; P77-L132 HydrophobicContact CB-CG 4.45Å; P77-L132 HydrophobicContact CG-CD1 4.27Å; P77-L132 HydrophobicContact CG-CD2 3.92Å; I128-L132 WeakPolarHBondContact O-CB 3.44Å; I128-L132 PolarHBondContact O-N 3.45Å; Y129-L132 WeakPolarHBondContact O-CB 3.4Å; Y129-L132 PolarHBondContact O-N 2.72Å; Y129-L132 VanDerWaalsContact O-N 3.15Å; R130-L132 PolarHBondContact O-N 3.23Å
133L59.7Low54.1Low103 Ų103113.9 Ų113.954%0.53958%0.578SS.*Hα-helixtrans-71.9-38.1-177-162.874.5000111.9Y129 R130Y129-L133 HydrophobicContact CE1-CD2 4.18Å; Y129-L133 WeakPolarHBondContact O-CB 3.4Å; Y129-L133 PolarHBondContact O-N 2.94Å; R130-L133 PolarHBondContact O-N 3.46Å
134F56.9Low52.6Low155 Ų155117 Ų11768%0.6860%0.595SS**Hα-helixtrans-94-14.5-178.2-71-72.4000114.1R130 P136R130-F134 HydrophobicContact CB-CD2 4.12Å; R130-F134 HydrophobicContact CB-CE2 4.41Å; R130-F134 HydrophobicContact CG-CD2 4.43Å; R130-F134 HydrophobicContact CG-CE2 4.22Å; R130-F134 WeakPolarHBondContact O-CB 3.43Å; R130-F134 VanDerWaalsContact O-CD2 3.25Å; R130-F134 WeakPolarHBondContact O-CD2 3.45Å; R130-F134 PolarHBondContact O-N 3.11Å; F134-P136 VanDerWaalsContact C-CD 3.49Å
135N49.4Very low52.2Low89 Ų89118.8 Ų118.848%0.47661%0.608SS.*  trans-124.678172-174.890.2000110K131 S137K131-N135 VanDerWaalsContact O-CB 3.26Å; K131-N135 WeakPolarHBondContact O-CB 3.43Å; K131-N135 PolarHBondContact O-N 3.03Å; K131-N135 VanDerWaalsContact O-N 3.14Å; N135-S137 PolarHBondContact ND2-O 3.42Å; N135-S137 PolarHBondContact O-N 3.02Å
136P49.8Very low51.4Low115 Ų115126.2 Ų126.275%0.74764%0.64SS**  trans-65.6-0.8171.527.5-33.5000113.1F134 G138F134-P136 VanDerWaalsContact C-CD 3.49Å; P136-G138 PolarHBondContact O-N 3.39Å
137S44.5Very low50.5Low86 Ų86130.8 Ų130.860%0.60165%0.653SS**  trans-72.455.2172.8-46.50000111.9N135N135-S137 PolarHBondContact ND2-O 3.42Å; N135-S137 PolarHBondContact O-N 3.02Å
138G49.3Very low49.4Very low36 Ų36136.2 Ų136.237%0.37167%0.665SS.*SBendtrans-64.5162.5152.400000109.7P136 Y140P136-G138 PolarHBondContact O-N 3.39Å; G138-Y140 PolarHBondContact O-N 3.06Å
139P43.2Very low48.6Very low122 Ų122140.7 Ų140.779%0.79268%0.682SS**THydrogen-bonded Turntrans-64.615.7-178.2-15.729.5000115.3Q141P139-Q141 VanDerWaalsContact C-N 3.3Å
140Y43.6Very low48.2Very low220 Ų220141 Ų14186%0.86369%0.694SS**THydrogen-bonded Turntrans-89.917.8177-95-81000113.2G138 K142G138-Y140 PolarHBondContact O-N 3.06Å; Y140-K142 VanDerWaalsContact C-N 3.25Å; Y140-K142 PolarHBondContact O-N 3.45Å
141Q36.6Very low47.6Very low167 Ų167139.5 Ų139.578%0.7870%0.703SS**  trans-68.494.4153.7-95-149.7-100108.3P139 K143P139-Q141 VanDerWaalsContact C-N 3.3Å; Q141-K143 VanDerWaalsContact C-N 3.32Å; Q141-K143 PolarHBondContact O-N 3.37Å
142K38.6Very low46.9Very low193 Ų193142.8 Ų142.884%0.83973%0.727SS**  trans-52.6105.9150.9-78.1-174.8178.3-179.20106.1Y140 P144Y140-K142 VanDerWaalsContact C-N 3.25Å; Y140-K142 PolarHBondContact O-N 3.45Å; K142-P144 WeakPolarHBondContact O-CD 3.44Å
143K34.9Very low46.3Very low182 Ų182146 Ų14679%0.79174%0.743SS**  trans-57.9117.5158.6-77.4-172.3176.1-171.60105.8Q141 V145Q141-K143 VanDerWaalsContact C-N 3.32Å; Q141-K143 PolarHBondContact O-N 3.37Å; K143-V145 PolarHBondContact O-N 2.92Å; K143-V145 VanDerWaalsContact O-N 3.09Å
144P40.4Very low45.6Very low115 Ų115148.2 Ų148.275%0.74775%0.754SS**  trans-63.2117.6168.625.4-29.4000106.8K142 H146K142-P144 WeakPolarHBondContact O-CD 3.44Å; P144-H146 PolarHBondContact O-N 2.87Å
145V50.9Low44.9Very low133 Ų133147.8 Ų147.881%0.80676%0.758SS**  trans-67.192.8159.3176.40000105.2K143K143-V145 PolarHBondContact O-N 2.92Å; K143-V145 VanDerWaalsContact O-N 3.09Å
146H43.7Very low44.7Very low169 Ų169151.3 Ų151.378%0.78277%0.774SS**  trans-101.191.3153.8-98.9-1.2000105.9P144P144-H146 PolarHBondContact O-N 2.87Å
147E45.3Very low44.3Very low143 Ų143153.6 Ų153.667%0.66878%0.776SS**  57.786.2102.8-89.1-132111.200110.4K149E147-K149 PolarHBondContact O-N 2.99Å
148R43.1Very low44.3Very low226 Ų226158.1 Ų158.185%0.85379%0.788SS**  trans-61.791.5156.5-177.5-169.4-64.4-138.61.6106.7V150R148-V150 VanDerWaalsContact C-N 3.3Å; R148-V150 HydrophobicContact CG-CG2 3.84Å; R148-V150 PolarHBondContact O-N 3.4Å
149K46.8Very low44Very low183 Ų183166.8 Ų166.880%0.79682%0.817SS**  trans-64.497.2159.6-82-168.1178.1-174.30107.7E147E147-K149 PolarHBondContact O-N 2.99Å
150V51.1Low44Very low115 Ų115170.2 Ų170.270%0.69782%0.819SS**  trans-126.986.8155.5176.60000106.1R148R148-V150 VanDerWaalsContact C-N 3.3Å; R148-V150 HydrophobicContact CG-CG2 3.84Å; R148-V150 PolarHBondContact O-N 3.4Å
151V51.8Low44.1Very low131 Ų131166.1 Ų166.179%0.79482%0.816SS**  trans-158.9115.8156.6-159.60000102.5
152L45.8Very low44.8Very low236 Ų236166 Ų166100%1.23682%0.819SS**  cis-151.5027.4-154133.5000108.4

Retrieved 152 of 152 residues in 72.5 ms (Link to these results)